100011-37-8	CC(C)C1=CC=CC=C1.[CH-]1C=CC=C1.F[Sb-](F)(F)(F)(F)F.[Fe+2]	Either an rdkit mol or a smiles string is required
10026-07-0	Cl[Te](Cl)(Cl)Cl	Either an rdkit mol or a smiles string is required
10031-27-3	Br[Te](Br)(Br)Br	Either an rdkit mol or a smiles string is required
10049-23-7	O[Te](=O)O	Either an rdkit mol or a smiles string is required
10102-20-2	[O-][Te](=O)[O-].[Na+].[Na+]	Either an rdkit mol or a smiles string is required
101200-57-1	C1=CC=C(C=C1)SC2=CC=C(C=C2)[S+]3C4=CC=CC=C4SC5=CC=CC=C53.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
101200-58-2	C1=CC=C(C=C1)[S+]2C3=CC=CC=C3SC4=CC=CC=C42.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
101200-60-6	C1=CC=C(C=C1)SC2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=C(C=C4)SC5=CC=CC=C5.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
101200-61-7	C1=CC=C(C=C1)SC2=CC=C(C=C2)SC3=CC=C(C=C3)[S+](C4=CC=CC=C4)C5=CC=CC=C5.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
101294-99-9	C1=CC=C(C=C1)[S+]2C3=C(C(=CC=C3)Cl)SC4=CC=CC=C42.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
12005-82-2	F[As-](F)(F)(F)(F)F.[Ag+]	Either an rdkit mol or a smiles string is required
12005-86-6	F[As-](F)(F)(F)(F)F.[Na+]	Either an rdkit mol or a smiles string is required
12021-68-0	F[Si-2](F)(F)(F)(F)F.[Co+2]	Either an rdkit mol or a smiles string is required
12110-39-3	C1=CC=C(C=C1)[C+](C2=CC=CC=C2)Cl.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl	Either an rdkit mol or a smiles string is required
12232-99-4	[O-][Bi](=O)=O.[Na+]	Either an rdkit mol or a smiles string is required
1313606-05-1	[OH-].[In+4]	Either an rdkit mol or a smiles string is required
13451-18-8	O=[Te](=O)=O	Either an rdkit mol or a smiles string is required
13453-06-0	[NH4+].[NH4+].[O-][Te](=O)(=O)[O-]	Either an rdkit mol or a smiles string is required
13466-24-5	[O-][Te](=O)(=O)[O-].[Ba+2]	Either an rdkit mol or a smiles string is required
13637-63-3	FCl(F)(F)(F)F	Either an rdkit mol or a smiles string is required
13637-83-7	O=Cl(=O)F	Either an rdkit mol or a smiles string is required
13693-09-9	F[Xe](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
13709-61-0	F[Xe](F)(F)F	Either an rdkit mol or a smiles string is required
13845-35-7	[O-][Te](=O)(=O)[O-].[Pb+2]	Either an rdkit mol or a smiles string is required
139301-16-9	CCCCCCCCCCCCC(COC1=CC=C(C=C1)[I+]C2=CC=CC=C2)O.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
13932-10-0	O=Cl(=O)=O	Either an rdkit mol or a smiles string is required
139353-88-1	CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)[Sn-](C2=CC=CC=C2)(C3=CC=CC=C3)(F)F	Either an rdkit mol or a smiles string is required
143481-66-7	C[Te](C)(C)C.[Cd]	Either an rdkit mol or a smiles string is required
14522-80-6	Br[Br-]Br	Either an rdkit mol or a smiles string is required
15170-52-2	[Na+].[Cl-][PbH](Cl)Cl	Either an rdkit mol or a smiles string is required
15203-83-5	[Cl-][PbH](Cl)Cl.[Cs+]	Either an rdkit mol or a smiles string is required
15218-57-2	[Cl-][PbH](Cl)Cl.[K+]	Either an rdkit mol or a smiles string is required
15218-58-3	[Cl-][PbH](Cl)Cl.[Rb+]	Either an rdkit mol or a smiles string is required
154718-31-7	CC1=CC(=CC=C1)C.C1CCCC1.F[Sb-](F)(F)(F)(F)F.[Fe]	Either an rdkit mol or a smiles string is required
15845-23-5	O=[Te](=O)([O-])[O-]	Either an rdkit mol or a smiles string is required
15851-40-8	[O-][Te](=O)[O-].[Sr+2]	Either an rdkit mol or a smiles string is required
15851-44-2	[O-][Te](=O)[O-].[Cd+2]	Either an rdkit mol or a smiles string is required
15851-47-5	[O-][Te](=O)[O-].[Pb+2]	Either an rdkit mol or a smiles string is required
15851-49-7	[O-][Te](=O)[O-].[Mn+2]	Either an rdkit mol or a smiles string is required
15851-52-2	[O-][Te](=O)[O-].[Ni+2]	Either an rdkit mol or a smiles string is required
15852-05-8	[O-][Te](=O)(=O)[O-].[Cu+2]	Either an rdkit mol or a smiles string is required
15852-08-1	[O-][Te](=O)(=O)[O-].[Mg+2]	Either an rdkit mol or a smiles string is required
15852-09-2	[O-][Te](=O)(=O)[O-].[Ca+2]	Either an rdkit mol or a smiles string is required
15852-10-5	[O-][Te](=O)(=O)[O-].[Sr+2]	Either an rdkit mol or a smiles string is required
15852-14-9	[O-][Te](=O)(=O)[O-].[Cd+2]	Either an rdkit mol or a smiles string is required
15852-21-8	[O-][Te](=O)(=O)[O-].[Ni+2]	Either an rdkit mol or a smiles string is required
15852-22-9	O=[Te]([O-])[O-]	Either an rdkit mol or a smiles string is required
15885-40-2	[O-][Te](=O)[O-].[Rb+].[Rb+]	Either an rdkit mol or a smiles string is required
15885-43-5	[O-][Te](=O)(=O)[O-].[Rb+].[Rb+]	Either an rdkit mol or a smiles string is required
15899-92-0	[O-][Te](=O)[O-].[Cs+].[Cs+]	Either an rdkit mol or a smiles string is required
16871-71-9	F[Si-2](F)(F)(F)(F)F.[Zn+2]	Either an rdkit mol or a smiles string is required
16893-85-9	F[Si-2](F)(F)(F)(F)F.[Na+].[Na+]	Either an rdkit mol or a smiles string is required
16893-92-8	F[Sb-](F)(F)(F)(F)F.[K+]	Either an rdkit mol or a smiles string is required
16919-19-0	[NH4+].[NH4+].F[Si-2](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
16921-96-3	FI(F)(F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
16925-25-0	F[Sb-](F)(F)(F)(F)F.[Na+]	Either an rdkit mol or a smiles string is required
16949-65-8	F[Si-2](F)(F)(F)(F)F.[Mg+2]	Either an rdkit mol or a smiles string is required
16961-83-4	[H+].[H+].F[Si-2](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
17029-22-0	F[As-](F)(F)(F)(F)F.[K+]	Either an rdkit mol or a smiles string is required
17068-85-8	[H+].F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
17084-08-1	F[Si-2](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
17111-95-4	F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
17856-92-7	[N+](=O)=O.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
18424-17-4	[Li+].F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
22585-64-4	O=Br(=O)F	Either an rdkit mol or a smiles string is required
25230-72-2	C1C=CC=CC=C1.OCl(=O)(O)O	Either an rdkit mol or a smiles string is required
26006-71-3	O.O.[O-][Te](=O)(=O)[O-].[Na+].[Na+]	Either an rdkit mol or a smiles string is required
26042-64-8	F[Sb-](F)(F)(F)(F)F.[Ag+]	Either an rdkit mol or a smiles string is required
26571-79-9	C1=CC=C(C=C1)[Si](Cl)(Cl)[Cl-]Cl	Either an rdkit mol or a smiles string is required
27137-85-5	C1=CC=C(C=C1)[Si](Cl)(Cl)Cl(Cl)Cl	Either an rdkit mol or a smiles string is required
27569-09-1	CC1=C(C=CC(=C1)[N+]#N)N2CCCC2.F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
289651-09-8	[OH-].[Mg+3]	Either an rdkit mol or a smiles string is required
29853-65-4	[O-][Te](=O)[O-].[O-][Te](=O)[O-].[O-][Te](=O)[O-].[Al+3].[Al+3]	Either an rdkit mol or a smiles string is required
29935-35-1	[Li+].F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
34729-54-9	[O-][Te](=O)(=O)[O-].[Cs+].[Cs+]	Either an rdkit mol or a smiles string is required
36470-39-0	F[Ge-2](F)(F)(F)(F)F.[Na+]	Either an rdkit mol or a smiles string is required
38932-80-8	CCCC[N+](CCCC)(CCCC)CCCC.Br[Br-]Br	Either an rdkit mol or a smiles string is required
4126-81-2	C1=CC=C(C=C1)[C+](Cl)Cl.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl	Either an rdkit mol or a smiles string is required
4207-56-1	C[N+](C)(C)C1=CC=CC=C1.Br[Br-]Br	Either an rdkit mol or a smiles string is required
437-15-0	C1=CC=C(C=C1)[C+](C2=CC=CC=C2)C3=CC=CC=C3.F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
53850-35-4	[Db]	Either an rdkit mol or a smiles string is required
54037-14-8	[Bh]	Either an rdkit mol or a smiles string is required
54037-57-9	[Hs]	Either an rdkit mol or a smiles string is required
54038-01-6	[Mt]	Either an rdkit mol or a smiles string is required
54038-81-2	[Sg]	Either an rdkit mol or a smiles string is required
54075-76-2	C[O+](C)C.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl	Either an rdkit mol or a smiles string is required
54083-77-1	[Ds]	Either an rdkit mol or a smiles string is required
54084-26-3	[Cn]	Either an rdkit mol or a smiles string is required
54084-70-7	[Nh]	Either an rdkit mol or a smiles string is required
54085-16-4	[Fl]	Either an rdkit mol or a smiles string is required
54085-64-2	[Mc]	Either an rdkit mol or a smiles string is required
54100-71-9	[Lv]	Either an rdkit mol or a smiles string is required
54101-14-3	[Ts]	Either an rdkit mol or a smiles string is required
54144-19-3	[Og]	Either an rdkit mol or a smiles string is required
54386-24-2	[Rg]	Either an rdkit mol or a smiles string is required
57900-42-2	C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
62613-15-4	C1=CC=C(C=C1)[I+]C2=CC=CC=C2.F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
63217-32-3	CCNC1=CC(=C(C=C1)[N+]#N)C.F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
63217-33-4	CCN(CC)C1=CC(=C(C=C1)[N+]#N)OCC.F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
7128-68-9	CCCC[NH2+]CCCC.F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
71786-70-4	CCCCCCCCCCCCC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)CCCCCCCCCCCC.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
73747-22-5	C[NH+](C)CC1=CC=CC=C1.F[As-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
7446-07-3	O=[Te]=O	Either an rdkit mol or a smiles string is required
7446-35-7	S=[Te]=S	Either an rdkit mol or a smiles string is required
7616-94-6	O=Cl(=O)(=O)F	Either an rdkit mol or a smiles string is required
7783-73-5	F[Ge-2](F)(F)(F)(F)F.[K+].[K+]	Either an rdkit mol or a smiles string is required
7783-80-4	F[Te](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
7787-62-4	F[Bi](F)(F)(F)F	Either an rdkit mol or a smiles string is required
7787-71-5	FBr(F)F	Either an rdkit mol or a smiles string is required
7789-30-2	FBr(F)(F)(F)F	Either an rdkit mol or a smiles string is required
7790-48-9	[Te](I)(I)(I)I	Either an rdkit mol or a smiles string is required
7790-58-1	[O-][Te](=O)[O-].[K+].[K+]	Either an rdkit mol or a smiles string is required
7790-91-2	FCl(F)F	Either an rdkit mol or a smiles string is required
7796-16-9	C(C(=O)O)OOCl(Cl)Cl	Either an rdkit mol or a smiles string is required
7803-68-1	O[Te](O)(O)(O)(O)O	Either an rdkit mol or a smiles string is required
89452-37-9	C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)SC4=CC=C(C=C4)[S+](C5=CC=CC=C5)C6=CC=CC=C6.F[Sb-](F)(F)(F)(F)F.F[Sb-](F)(F)(F)(F)F	Either an rdkit mol or a smiles string is required
Did not match all atoms present	100-00-5	C1=CC(=CC=C1[N+](=O)[O-])Cl	{17: 1, 38: 1, 14: 4}
Did not match all atoms present	100-01-6	C1=CC(=CC=C1N)[N+](=O)[O-]	{38: 1, 30: 1, 14: 4}
Did not match all atoms present	100-02-7	C1=CC(=CC=C1[N+](=O)[O-])O	{38: 1, 21: 1, 14: 4}
Did not match all atoms present	100-03-8	C1=CC(=CC=C1S(=O)O)Cl	{17: 1, 20: 1, 29: 1, 14: 4}
Did not match all atoms present	100-04-9	CN(C)C1=CC=C(C=C1)[N+]#N.[Cl-]	{1: 2, 34: 1, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	100-05-0	C1=CC(=CC=C1[N+]#N)[N+](=O)[O-].[Cl-]	{17: 1, 34: 1, 38: 1, 14: 4}
Did not match all atoms present	100-06-1	CC(=O)C1=CC=C(C=C1)OC	{24: 1, 1: 2, 22: 1, 14: 4}
Did not match all atoms present	100-07-2	COC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	100-09-4	COC1=CC=C(C=C1)C(=O)O	{1: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	100-10-7	CN(C)C1=CC=C(C=C1)C=O	{1: 2, 26: 1, 14: 4, 33: 1}
Did not match all atoms present	100-11-8	C1=CC(=CC=C1CBr)[N+](=O)[O-]	{2: 1, 38: 1, 18: 1, 14: 4}
Did not match all atoms present	100-12-9	CCC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	100-13-0	C=CC1=CC=C(C=C1)[N+](=O)[O-]	{14: 4, 38: 1, 5: 1, 6: 1}
Did not match all atoms present	100-14-1	C1=CC(=CC=C1CCl)[N+](=O)[O-]	{17: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	100-15-2	CNC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	100-16-3	C1=CC(=CC=C1NN)[N+](=O)[O-]	{38: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	100-17-4	COC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	100-18-5	CC(C)C1=CC=C(C=C1)C(C)C	{1: 4, 3: 2, 14: 4}
Did not match all atoms present	100-19-6	CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4}
Did not match all atoms present	100-20-9	C1=CC(=CC=C1C(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 14: 4}
Did not match all atoms present	100-21-0	C1=CC(=CC=C1C(=O)O)C(=O)O	{27: 2, 14: 4}
Did not match all atoms present	100-22-1	CN(C)C1=CC=C(C=C1)N(C)C	{1: 4, 14: 4, 33: 2}
Did not match all atoms present	100-23-2	CN(C)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	100-25-4	C1=CC(=CC=C1[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 4}
Did not match all atoms present	100-26-5	C1=CC(=NC=C1C(=O)O)C(=O)O	{35: 1, 27: 2, 14: 3}
Did not match all atoms present	100-27-6	C1=CC(=CC=C1CCO)[N+](=O)[O-]	{2: 2, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	100-28-7	C1=CC(=CC=C1N=C=O)[N+](=O)[O-]	{8: 1, 34: 1, 38: 1, 29: 1, 14: 4}
Did not match all atoms present	100-29-8	CCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	100-32-3	C1=CC(=CC=C1[N+](=O)[O-])SSC2=CC=C(C=C2)[N+](=O)[O-]	{40: 2, 38: 2, 14: 8}
Did not match all atoms present	100-33-4	C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N	{2: 5, 36: 2, 7: 2, 14: 8, 22: 2, 30: 2}
Did not match all atoms present	100-34-5	C1=CC=C(C=C1)[N+]#N.[Cl-]	{17: 1, 34: 1, 14: 5}
Did not match all atoms present	100-39-0	C1=CC=C(C=C1)CBr	{2: 1, 18: 1, 14: 5}
Did not match all atoms present	100-41-4	CCC1=CC=CC=C1	{1: 1, 2: 1, 14: 5}
Did not match all atoms present	100-42-5	C=CC1=CC=CC=C1	{14: 5, 5: 1, 6: 1}
Did not match all atoms present	100-43-6	C=CC1=CC=NC=C1	{14: 4, 35: 1, 5: 1, 6: 1}
Did not match all atoms present	100-44-7	C1=CC=C(C=C1)CCl	{17: 1, 2: 1, 14: 5}
Did not match all atoms present	100-46-9	C1=CC=C(C=C1)CN	{2: 1, 30: 1, 14: 5}
Did not match all atoms present	100-47-0	C1=CC=C(C=C1)C#N	{37: 1, 14: 5}
Did not match all atoms present	100-48-1	C1=CN=CC=C1C#N	{35: 1, 37: 1, 14: 4}
Did not match all atoms present	100-51-6	C1=CC=C(C=C1)CO	{2: 1, 20: 1, 14: 5}
Did not match all atoms present	100-52-7	C1=CC=C(C=C1)C=O	{26: 1, 14: 5}
Did not match all atoms present	100-53-8	C1=CC=C(C=C1)CS	{2: 1, 14: 5, 39: 1}
Did not match all atoms present	100-54-9	C1=CC(=CN=C1)C#N	{35: 1, 37: 1, 14: 4}
Did not match all atoms present	100-55-0	C1=CC(=CN=C1)CO	{2: 1, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	100-56-1	C1=CC=C(C=C1)[Hg]Cl	{17: 1, 14: 5}
Did not match all atoms present	100-57-2	C1=CC=C(C=C1)[Hg].O	{14: 5}
Did not match all atoms present	100-58-3	C1=CC=[C-]C=C1.[Mg+2].[Br-]	{18: 1, 14: 5}
Did not match all atoms present	100-61-8	CNC1=CC=CC=C1	{1: 1, 14: 5, 31: 1}
Did not match all atoms present	100-62-9	C=NC1=CC=CC=C1	{34: 1, 5: 1, 14: 5}
Did not match all atoms present	100-63-0	C1=CC=C(C=C1)NN	{30: 1, 14: 5, 31: 1}
Did not match all atoms present	100-65-2	C1=CC=C(C=C1)NO	{20: 1, 14: 5, 31: 1}
Did not match all atoms present	100-66-3	COC1=CC=CC=C1	{1: 1, 22: 1, 14: 5}
Did not match all atoms present	100-68-5	CSC1=CC=CC=C1	{40: 1, 1: 1, 14: 5}
Did not match all atoms present	100-69-6	C=CC1=CC=CC=N1	{14: 4, 35: 1, 5: 1, 6: 1}
Did not match all atoms present	100-70-9	C1=CC=NC(=C1)C#N	{35: 1, 37: 1, 14: 4}
Did not match all atoms present	100-71-0	CCC1=CC=CC=N1	{1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	100-80-1	CC1=CC=CC(=C1)C=C	{1: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	100-81-2	CC1=CC(=CC=C1)CN	{1: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	100-82-3	C1=CC(=CC(=C1)F)CN	{16: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	100-83-4	C1=CC(=CC(=C1)O)C=O	{26: 1, 21: 1, 14: 4}
Did not match all atoms present	100-84-5	CC1=CC(=CC=C1)OC	{1: 2, 22: 1, 14: 4}
Did not match all atoms present	100-85-6	C[N+](C)(C)CC1=CC=CC=C1.[OH-]	{1: 3, 2: 1, 14: 5}
Did not match all atoms present	100-86-7	CC(C)(CC1=CC=CC=C1)O	{1: 2, 2: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	100-87-8	C1=CC=C(C=C1)CS(=O)(=O)O	{2: 1, 20: 1, 29: 2, 14: 5}
Did not match all atoms present	100-88-9	C1CCC(CC1)NS(=O)(=O)O	{20: 1, 11: 5, 12: 1, 29: 2, 31: 1}
Did not match all atoms present	100-89-0	B1(OC(CC(O1)(C)C)C)OC(C)CC(C)(C)OB2OC(CC(O2)(C)C)C	{1: 9, 2: 1, 3: 1, 4: 1, 11: 2, 12: 2, 13: 2, 22: 2, 23: 4}
Did not match all atoms present	100-91-4	CC1CC(CC(N1C)(C)C)OC(=O)C(C2=CC=CC=C2)O	{1: 4, 3: 1, 33: 1, 11: 2, 12: 2, 13: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	100-92-5	CC(C)(CC1=CC=CC=C1)NC	{1: 3, 2: 1, 4: 1, 14: 5, 31: 1}
Did not match all atoms present	100-93-6	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3	{1: 1, 29: 2, 14: 13, 31: 2}
Did not match all atoms present	100-94-7	C[N+](C)(CC1=CC=CC=C1)CC2=CC=CC=C2.[Cl-]	{1: 2, 2: 2, 14: 10, 17: 1}
Did not match all atoms present	100-99-2	CC(C)C[Al](CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 3}
Did not match all atoms present	1000-40-4	CCCCS[Sn](C)(C)SCCCC	{40: 2, 1: 4, 2: 6}
Did not match all atoms present	1000-50-6	CCCC[Si](C)(C)Cl	{1: 3, 2: 3, 17: 1}
Did not match all atoms present	1000-56-2	CCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 2, 29: 3, 22: 1}
Did not match all atoms present	1000-67-5	CCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 3, 29: 3, 22: 1}
Did not match all atoms present	1000-70-0	C[Si](C)(C)N=C=N[Si](C)(C)C	{8: 1, 1: 6, 34: 2}
Did not match all atoms present	1000-83-5	C(NC(=S)N)O	{2: 1, 31: 1, 20: 1, 30: 1, 7: 1}
Did not match all atoms present	1000-90-4	CC(C)OC(=S)[S-].CC(C)OC(=S)[S-].[Zn+2]	{1: 4, 3: 2, 22: 2, 7: 2}
Did not match all atoms present	10004-44-1	CC1=CC(=O)NO1	{32: 1, 1: 1, 25: 1, 14: 1, 23: 1}
Did not match all atoms present	100046-00-2	CC1=CC(=C(C(=C1)C)N([N+](=O)C2=C(C=C(C=C2C)C)C)[O-])C	{1: 6, 29: 2, 14: 4, 33: 2}
Did not match all atoms present	10005-29-5	CC1=CC=CC2=C1NC3=CC4=C(C=C3C2=O)NC5=C(C4=O)C=CC=C5C	{32: 2, 1: 2, 14: 8, 25: 2}
Did not match all atoms present	10006-28-7	[O-][Si](=O)[O-].[K+].[K+]	{29: 3}
Did not match all atoms present	10008-90-9	C=C[Sn](C=C)(C=C)Cl	{17: 1, 5: 3, 6: 3}
Did not match all atoms present	100080-82-8	C1=CC=C2C(C=CC2=C1)CCC3C=CC4=CC=CC=C34.Cl[Zr]Cl	{17: 2, 2: 2, 12: 2, 14: 12}
Did not match all atoms present	1001-62-3	CS(=O)(=O)OOS(=O)(=O)C	{1: 2, 29: 4, 22: 2}
Did not match all atoms present	10010-36-3	C1=CC(=CC=C1C=CC2=CC=C(C=C2)F)N	{16: 1, 30: 1, 14: 8, 6: 2}
Did not match all atoms present	10010-67-0	C1CN(CCN1CCS(=O)(=O)O)CCS(=O)(=O)[O-].[Na+]	{33: 2, 2: 4, 11: 4, 20: 1, 29: 5}
Did not match all atoms present	10010-74-9	CC1=NN(C(=O)C1N/N=C/2\C=CC=CC2=O)C3=CC=CC=C3	{1: 1, 34: 1, 35: 1, 33: 1, 12: 1, 14: 9, 15: 2, 25: 2, 31: 1}
Did not match all atoms present	10010-93-2	CC1=CC(=NN1)C(F)(F)F	{32: 1, 1: 1, 35: 1, 4: 1, 14: 1, 16: 3}
Did not match all atoms present	100141-30-8	CC(=O)NC1=C(C=C(C=C1)C(C)(C)C)Cl	{1: 4, 4: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	100144-93-2	COC(C1CC1)(C2CC2)C(=O)[O-]	{1: 1, 4: 1, 11: 4, 12: 2, 22: 1, 24: 1}
Did not match all atoms present	10016-52-1	C1=CC2=C(C=C1Br)C3=C(O2)C=CC(=C3)Br	{18: 2, 14: 6, 23: 1}
Did not match all atoms present	10017-59-1	C1=CC2=C(C=C1S(=O)(=O)O)C(=O)C3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-].[Na+]	{25: 2, 20: 1, 29: 5, 14: 6}
Did not match all atoms present	10019-95-1	CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2=O	{1: 1, 33: 1, 11: 3, 14: 4, 25: 1, 29: 2}
Did not match all atoms present	1002-16-0	CCCCCO[N+](=O)[O-]	{1: 1, 2: 4, 22: 1}
Did not match all atoms present	1002-53-5	CCCC[Sn]CCCC	{1: 2, 2: 6}
Did not match all atoms present	1002-62-6	CCCCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 8}
Did not match all atoms present	1002-88-6	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Co+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	1002-89-7	CCCCCCCCCCCCCCCCCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 16}
Did not match all atoms present	10020-96-9	C1=CC=C(C=C1)[C@H](C#N)O	{3: 1, 20: 1, 37: 1, 14: 5}
Did not match all atoms present	100207-68-9	C[N-]C.C[N-]C.C[N-]C.C[N-]C.[Mo+4]	{1: 8, 34: 4}
Did not match all atoms present	10021-35-9	C1=CC=C2C(=C1)C(=O)NC(=S)O2	{32: 1, 25: 1, 14: 4, 23: 1}
Did not match all atoms present	10021-55-3	C1=CC(=C(C=C1O)S(=O)(=O)[O-])O.[Na+]	{21: 2, 14: 3, 29: 3}
Did not match all atoms present	10022-31-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ba+2]	{}
Did not match all atoms present	10022-47-6	[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.OS(=O)(=O)[O-].OS(=O)(=O)[O-].[Cr+3]	{20: 2, 29: 6}
Did not match all atoms present	10022-48-7	[Li+].[Li+].[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]	{29: 6, 22: 1}
Did not match all atoms present	10022-70-5	O.O.O.O.O.[O-]Cl.[Na+]	{17: 1, 29: 1}
Did not match all atoms present	10023-25-3	C1C2=C(C3=CC=CC=C3S1)NC4=C2C5=CC=CC=C5C=C4	{32: 1, 41: 1, 11: 1, 14: 10}
Did not match all atoms present	10023-74-2	CCCCC(=O)[O-]	{24: 1, 1: 1, 2: 3}
Did not match all atoms present	10024-66-5	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Mn+2].[Mn+2].[Mn+2]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	10024-74-5	CC(C1=CC=CC=C1)NC(C)C2=CC=CC=C2	{1: 2, 3: 2, 14: 10, 31: 1}
Did not match all atoms present	10024-90-5	CC1=C(C=CC(=C1)C(=O)C)OC	{24: 1, 1: 3, 22: 1, 14: 3}
Did not match all atoms present	10024-93-8	Cl[Nd](Cl)Cl	{17: 3}
Did not match all atoms present	10024-97-2	N#[N+][O-]	{34: 1, 29: 1}
Did not match all atoms present	100242-24-8	C1=CC=C(C=C1)C2=C(C(=O)OC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O	{28: 1, 21: 2, 14: 12}
Did not match all atoms present	10025-64-6	O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Zn+2]	{17: 2, 29: 8}
Did not match all atoms present	10025-65-7	Cl[Pt]Cl	{17: 2}
Did not match all atoms present	10025-68-0	Cl[Se][Se]Cl	{17: 2}
Did not match all atoms present	10025-70-4	O.O.O.O.O.O.[Cl-].[Cl-].[Sr+2]	{17: 2}
Did not match all atoms present	10025-71-5	Cl[Te]Cl	{17: 2}
Did not match all atoms present	10025-73-7	[Cl-].[Cl-].[Cl-].[Cr+3]	{17: 3}
Did not match all atoms present	10025-74-8	[Cl-].[Cl-].[Cl-].[Dy+3]	{17: 3}
Did not match all atoms present	10025-75-9	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Er+3]	{17: 3}
Did not match all atoms present	10025-76-0	Cl[Eu](Cl)Cl	{17: 3}
Did not match all atoms present	10025-77-1	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Fe+3]	{17: 3}
Did not match all atoms present	10025-78-2	[Si](Cl)(Cl)Cl	{17: 3}
Did not match all atoms present	10025-82-8	Cl[In](Cl)Cl	{17: 3}
Did not match all atoms present	10025-83-9	Cl[Ir](Cl)Cl	{17: 3}
Did not match all atoms present	10025-84-0	O.O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[La+3]	{17: 3}
Did not match all atoms present	10025-87-3	O=P(Cl)(Cl)Cl	{17: 3, 29: 1}
Did not match all atoms present	10025-90-8	O.O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Pr+3]	{17: 3}
Did not match all atoms present	10025-91-9	Cl[Sb](Cl)Cl	{17: 3}
Did not match all atoms present	10025-93-1	Cl[U](Cl)Cl	{17: 3}
Did not match all atoms present	10025-94-2	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Y+3]	{17: 3}
Did not match all atoms present	10025-97-5	Cl[Ir](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10025-98-6	Cl[Pd-2](Cl)(Cl)Cl.[K+].[K+]	{17: 4}
Did not match all atoms present	10025-99-7	Cl[Pt-2](Cl)(Cl)Cl.[K+].[K+]	{17: 4}
Did not match all atoms present	10026-01-4	Cl[Os](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10026-03-6	Cl[Se](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10026-04-7	[Si](Cl)(Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10026-06-9	O.O.O.O.O.Cl[Sn](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10026-08-1	Cl[Th](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10026-10-5	Cl[U](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10026-11-6	[Cl-].[Cl-].[Cl-].[Cl-].[Zr+4]	{17: 4}
Did not match all atoms present	10026-12-7	Cl[Nb](Cl)(Cl)(Cl)Cl	{17: 5}
Did not match all atoms present	10026-13-8	P(Cl)(Cl)(Cl)(Cl)Cl	{17: 5}
Did not match all atoms present	10026-18-3	[F-].[F-].[F-].[Co+3]	{16: 3}
Did not match all atoms present	10026-22-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Co+2]	{}
Did not match all atoms present	10026-23-0	[O-][Se](=O)[O-].[Co+2]	{29: 3}
Did not match all atoms present	10026-24-1	O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Co+2]	{29: 4}
Did not match all atoms present	10028-14-5	[No]	{}
Did not match all atoms present	10028-16-7	[Te]=[Te]	{}
Did not match all atoms present	10028-17-8	[3H][3H]	{}
Did not match all atoms present	10028-18-9	[F-].[F-].[Ni+2]	{16: 2}
Did not match all atoms present	10028-22-5	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Fe+3].[Fe+3]	{29: 12}
Did not match all atoms present	10028-70-3	C1=CC(=CC=C1C(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 14: 4}
Did not match all atoms present	10029-31-9	CC(C)NC1=CC=C(C=C1)CC2=CC=C(C=C2)N	{1: 2, 2: 1, 3: 1, 14: 8, 30: 1, 31: 1}
Did not match all atoms present	1003-09-4	C1=CSC(=C1)Br	{41: 1, 18: 1, 14: 3}
Did not match all atoms present	1003-26-5	C1=CC(C=C1)[Hg]Cl	{17: 1, 12: 1, 14: 4}
Did not match all atoms present	1003-29-8	C1=CNC(=C1)C=O	{32: 1, 26: 1, 14: 3}
Did not match all atoms present	1003-31-2	C1=CSC(=C1)C#N	{41: 1, 37: 1, 14: 3}
Did not match all atoms present	1003-40-3	C1=CN=CC=C1N.Cl	{17: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	1003-56-1	CC1=CC=CNC1=O	{32: 1, 1: 1, 14: 3, 25: 1}
Did not match all atoms present	1003-67-4	CC1=CC=[N+](C=C1)[O-]	{1: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	1003-68-5	CC1=CNC(=O)C=C1	{32: 1, 1: 1, 14: 3, 25: 1}
Did not match all atoms present	1003-73-2	CC1=C[N+](=CC=C1)[O-]	{1: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	1003-78-7	CC1CC(S(=O)(=O)C1)C	{1: 2, 11: 2, 12: 2, 29: 2}
Did not match all atoms present	1003-90-3	CC1=C(NC(=C1C)C)C	{32: 1, 1: 4}
Did not match all atoms present	1003-98-1	C1=CC(=C(C=C1F)Br)N	{16: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	10031-16-0	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Ba+2]	{29: 6, 22: 1}
Did not match all atoms present	10031-20-6	O.O.O.O.[Mn+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	10031-21-7	O.[O-]Br(=O)=O.[O-]Br(=O)=O.[Pb+2]	{18: 2, 29: 6}
Did not match all atoms present	10031-22-8	Br[Pb]Br	{18: 2}
Did not match all atoms present	10031-24-0	Br[Sn]Br	{18: 2}
Did not match all atoms present	10031-25-1	[Br-].[Br-].[Br-].[Cr+3]	{18: 3}
Did not match all atoms present	10031-26-2	[Fe+3].[Br-].[Br-].[Br-]	{18: 3}
Did not match all atoms present	10031-33-1	O.O.O.O.O.O.[O-]I(=O)=O.[O-]I(=O)=O.[Ca+2]	{19: 2, 29: 6}
Did not match all atoms present	10031-45-5	O.O.O.O.O.[O-][Se](=O)(=O)[O-].[Cu+2]	{29: 4}
Did not match all atoms present	10031-48-8	O.O.O.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Cu+2].[Cu+2].[Cu+2]	{29: 8}
Did not match all atoms present	10031-49-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Dy+3]	{}
Did not match all atoms present	10031-50-2	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Dy+3].[Dy+3]	{29: 12}
Did not match all atoms present	10031-51-3	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Er+3]	{}
Did not match all atoms present	10031-52-4	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Er+3].[Er+3]	{29: 12}
Did not match all atoms present	10031-53-5	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Eu+3]	{}
Did not match all atoms present	10031-58-0	CCC1=C[N+](=C(C=C1)C)C(C)CCC(C)(C)CC(C)(C)C.[Cl-]	{1: 8, 2: 4, 3: 1, 4: 2, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	10031-62-6	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Sn+4]	{29: 8}
Did not match all atoms present	10031-82-0	CCOC1=CC=C(C=C1)C=O	{1: 1, 2: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	10031-96-6	COC1=C(C=CC(=C1)CC=C)OC=O	{1: 1, 2: 1, 5: 1, 6: 1, 14: 3, 22: 1, 26: 1}
Did not match all atoms present	100320-09-0	P12P3P1P23	{}
Did not match all atoms present	100325-51-7	CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)C3=CC=NC=C3)F)C(=O)O	{1: 1, 2: 1, 35: 1, 33: 1, 14: 6, 16: 2, 25: 1, 27: 1}
Did not match all atoms present	10034-76-1	O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ca+2].[Ca+2]	{29: 8}
Did not match all atoms present	10034-81-8	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Mg+2]	{17: 2, 29: 8}
Did not match all atoms present	10034-82-9	O.O.O.O.[O-][Cr](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	10034-88-5	O.OS(=O)(=O)[O-].[Na+]	{20: 1, 29: 3}
Did not match all atoms present	10034-93-2	NN.OS(=O)(=O)O	{20: 2, 29: 2, 30: 2}
Did not match all atoms present	10034-94-3	[O-][Si]([O-])([O-])[O-].[Mg+2].[Mg+2]	{29: 4}
Did not match all atoms present	10034-96-5	O.O=S(=O)(O)O.[Mn]	{20: 2, 29: 2}
Did not match all atoms present	10034-99-8	O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Mg+2]	{29: 4}
Did not match all atoms present	10035-04-8	O.O.[Cl-].[Cl-].[Ca+2]	{17: 2}
Did not match all atoms present	10035-05-9	O.O.[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Ca+2]	{17: 2, 29: 6}
Did not match all atoms present	10035-06-0	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Bi+3]	{}
Did not match all atoms present	100370-71-6	CC1CNC(C(O1)C2=CC(=C(C=C2)O)O)C	{32: 1, 1: 2, 11: 1, 12: 3, 14: 3, 21: 2, 23: 1}
Did not match all atoms present	100379-00-8	B(C1=C(C=CC=C1C)C)(O)O	{1: 2, 20: 2, 14: 3}
Did not match all atoms present	10038-98-9	Cl[Ge](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10039-31-3	[Be+2].O.O.O.O.[O-][Se](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	10039-32-4	O.O.O.O.O.O.O.O.O.O.O.O.OP(=O)([O-])[O-].[Na+].[Na+]	{20: 1, 29: 3}
Did not match all atoms present	10039-33-5	CCCCCCCC[Sn](OC(=O)/C=C/C(=O)OCC(CCCC)CC)(OC(=O)/C=C/C(=O)OCC(CCCC)CC)CCCCCCCC	{1: 6, 2: 24, 3: 2, 28: 4, 6: 4}
Did not match all atoms present	10039-56-2	O.[O-]P=O.[Na+]	{29: 2}
Did not match all atoms present	1004-36-0	CC1=CC(=O)C=C(O1)C	{1: 2, 25: 1, 14: 2, 23: 1}
Did not match all atoms present	1004-38-2	C1=C(N=C(N=C1N)N)N	{35: 2, 30: 3, 14: 1}
Did not match all atoms present	1004-39-3	C1=C(NC(=S)N=C1N)N	{32: 1, 35: 1, 30: 2, 14: 1}
Did not match all atoms present	1004-40-6	C1=C(NC(=S)NC1=O)N	{32: 2, 25: 1, 30: 1, 14: 1}
Did not match all atoms present	1004-66-6	CC1=C(C(=CC=C1)C)OC	{1: 3, 22: 1, 14: 3}
Did not match all atoms present	1004-75-7	C1(=C(NC(=NC1=O)N)N)N	{32: 1, 25: 1, 35: 1, 30: 3}
Did not match all atoms present	10040-45-6	C1=CC=NC(=C1)C(C2=CC=C(C=C2)OS(=O)(=O)[O-])C3=CC=C(C=C3)OS(=O)(=O)[O-].[Na+].[Na+]	{35: 1, 3: 1, 22: 2, 14: 12, 29: 6}
Did not match all atoms present	10040-95-6	COC1=CC=C(C=C1)N2C=CN=C2	{1: 1, 35: 1, 22: 1, 14: 7, 33: 1}
Did not match all atoms present	100402-75-3	CCO[Si](CCCN)(OCC)OCC.O[Si](=O)O.[Ca]	{1: 3, 2: 6, 20: 2, 22: 3, 29: 1, 30: 1}
Did not match all atoms present	100402-78-6	CC(=C)C(=O)OCCC[Si](OC)(OC)OC.O=[Si]=O	{1: 4, 2: 3, 5: 1, 7: 1, 22: 3, 28: 1, 29: 2}
Did not match all atoms present	10041-02-8	C1=CC(=CC=C1N2C=CN=C2)O	{33: 1, 35: 1, 21: 1, 14: 7}
Did not match all atoms present	10041-06-2	CC(=O)C1=CC=C(C=C1)N2C=CN=C2	{24: 1, 1: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	10041-19-7	CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O	{1: 4, 2: 11, 3: 3, 20: 1, 28: 2, 29: 2}
Did not match all atoms present	10042-76-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Sr+2]	{}
Did not match all atoms present	10042-84-9	C(C(=O)O)N(CC(=O)O)CC(=O)[O-].[Na+]	{24: 1, 33: 1, 2: 3, 27: 2}
Did not match all atoms present	10042-88-3	Cl[Tb](Cl)Cl	{17: 3}
Did not match all atoms present	10043-01-3	O=S(=O)([O-])[O-].O=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[Al+3].[Al+3]	{29: 12}
Did not match all atoms present	10043-11-5	B#N	{}
Did not match all atoms present	10043-35-3	B(O)(O)O	{20: 3}
Did not match all atoms present	10043-52-4	[Ca+2].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	10043-67-1	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[K+]	{29: 8}
Did not match all atoms present	10043-84-2	[O-]P=O.[O-]P=O.[Mn+2]	{29: 4}
Did not match all atoms present	10043-91-1	NP(=O)(N)O	{20: 1, 29: 1, 30: 2}
Did not match all atoms present	10043-92-2	[Rn]	{}
Did not match all atoms present	100444-41-5	CCCCCCCCCCC1=CC=C(C=C1)C(=O)C(F)(F)F	{1: 1, 2: 9, 4: 1, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	100447-46-9	CCCC12CCNC1CC(C3=C2C=C(C=C3)O)C.Cl	{32: 1, 1: 2, 2: 2, 11: 3, 12: 2, 13: 1, 14: 3, 17: 1, 21: 1}
Did not match all atoms present	10045-34-8	C=CCN1C=CN=C1[N+](=O)[O-]	{33: 1, 2: 1, 35: 1, 5: 1, 6: 1, 14: 2, 38: 1}
Did not match all atoms present	10045-65-5	C1=CC=C(C=C1)CN2C=CN=C2C=O	{33: 1, 2: 1, 35: 1, 26: 1, 14: 7}
Did not match all atoms present	10045-86-0	[O-]P(=O)([O-])[O-].[Fe+3]	{29: 4}
Did not match all atoms present	10045-94-0	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Hg+2]	{}
Did not match all atoms present	10045-95-1	O=[N+]([O-])O.O=[N+]([O-])O.O=[N+]([O-])O.[Nd+3]	{20: 3}
Did not match all atoms present	100466-04-4	C1CC2=CC=CC3=CC4=C(C=CC5=CC=CC=C54)C(=C23)C1	{11: 3, 14: 10}
Did not match all atoms present	100468-44-8	CCC[CH2-].CCC[CH2-].CCC[CH2-].CCC[CH2-].CCC[CH2-].CCC[CH2-].CCC[CH2-].CCC[CH2-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].O=[Si]=O.O=[Si]=O.O=[Si]=O.O=[Si]=O.O=[Cr](=O)=O.O=[Cr](=O)=O.O=[Cr](=O)=O.O=[Cr](=O)=O.[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Ti+4]	{1: 16, 2: 16, 3: 4, 5: 8, 29: 24}
Did not match all atoms present	10048-13-2	COC1=C2C(=C3[C@@H]4C=CO[C@@H]4OC3=C1)OC5=C(C2=O)C(=CC=C5)O	{1: 1, 12: 2, 14: 6, 21: 1, 22: 1, 23: 3, 25: 1}
Did not match all atoms present	10048-95-0	O.O.O.O.O.O.O.O[As](=O)([O-])[O-].[Na+].[Na+]	{20: 1, 29: 3}
Did not match all atoms present	10048-98-3	OP(=O)([O-])[O-].[Ba+2]	{20: 1, 29: 3}
Did not match all atoms present	10048-99-4	I[Hg-2](I)(I)I.[Ba+2]	{19: 4}
Did not match all atoms present	100482-23-3	C1CCN(CC1)C2(CCN(CC2)CCCN3C4=CC=CC=C4CCC5=CC=CC=C53)C(=O)N.C(=C\C(=O)O)\C(=O)O	{33: 3, 2: 3, 6: 2, 11: 11, 13: 1, 14: 8, 24: 1, 27: 2, 30: 1}
Did not match all atoms present	100482-34-6	C1=CC=C(C=C1)[As](C2=CC=CC=C2C(=O)O)O	{27: 1, 20: 1, 14: 9}
Did not match all atoms present	100486-97-3	COC1=C(C=C(C=C1)C2=C(N=C(N2N3C(=C(N=C3C4=CC=CC=C4Cl)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7Cl)C8=CC=CC=C8Cl)OC	{1: 2, 35: 2, 33: 2, 14: 25, 17: 3, 22: 2}
Did not match all atoms present	10049-01-1	[O-]P(=O)([O-])[O-].[Bi+3]	{29: 4}
Did not match all atoms present	10049-05-5	Cl[Cr]Cl	{17: 2}
Did not match all atoms present	10049-06-6	Cl[Ti]Cl	{17: 2}
Did not match all atoms present	10049-07-7	Cl[Rh](Cl)Cl	{17: 3}
Did not match all atoms present	10049-10-2	[F-].[F-].[Cr+2]	{16: 2}
Did not match all atoms present	10049-11-3	[F-].[F-].[F-].[F-].[Cr+4]	{16: 4}
Did not match all atoms present	10049-12-4	[F-].[F-].[F-].[V]	{16: 3}
Did not match all atoms present	10049-14-6	[F-].[F-].[F-].[F-].[U+4]	{16: 4}
Did not match all atoms present	10049-16-8	[F-].[F-].[F-].[F-].[V+4]	{16: 4}
Did not match all atoms present	10049-17-9	F[Re](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	10049-21-5	O.OP(=O)(O)[O-].[Na+]	{20: 2, 29: 2}
Did not match all atoms present	10049-24-8	Br[Ir](Br)Br	{18: 3}
Did not match all atoms present	10049-25-9	[Cr+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	10049-36-2	B(O)(O)O.C(CO)N(CCO)CCO	{33: 1, 2: 6, 20: 6}
Did not match all atoms present	10049-60-2	CCC(C)[NH3+].[Cl-]	{1: 2, 2: 1, 3: 1, 17: 1}
Did not match all atoms present	100491-29-0	CCOC(=O)C1=CN(C2=NC(=C(C=C2C1=O)F)Cl)C3=C(C=C(C=C3)F)F	{1: 1, 2: 1, 35: 1, 33: 1, 14: 5, 16: 3, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	1005-22-7	C1CCC(CC1)P(=O)(Cl)Cl	{17: 2, 11: 5, 12: 1, 29: 1}
Did not match all atoms present	1005-30-7	C1=CC(=CC=C1C(=O)[O-])I.[Na+]	{24: 1, 19: 1, 14: 4}
Did not match all atoms present	1005-31-8	CN(C)C1=CC=[N+](C=C1)[O-]	{1: 2, 29: 1, 14: 4, 33: 2}
Did not match all atoms present	1005-32-9	CC1=CC=C(C=C1)P(Cl)Cl	{1: 1, 14: 4, 17: 2}
Did not match all atoms present	1005-35-2	C[S+](C)C1=CC=C(C=C1)O.[Cl-]	{1: 2, 21: 1, 14: 4, 17: 1}
Did not match all atoms present	1005-38-5	CSC1=NC(=CC(=N1)Cl)N	{1: 1, 35: 2, 40: 1, 14: 1, 17: 1, 30: 1}
Did not match all atoms present	1005-39-6	CSC1=NC(=CC(=N1)N)N	{40: 1, 1: 1, 35: 2, 30: 2, 14: 1}
Did not match all atoms present	1005-56-7	C1=CC=C(C=C1)OC(=S)Cl	{17: 1, 22: 1, 14: 5, 7: 1}
Did not match all atoms present	1005-69-2	CC1(COP(OC1)OC)C	{1: 3, 11: 2, 13: 1, 22: 1, 23: 2}
Did not match all atoms present	1005-93-2	CCC12COP(=O)(OC1)OC2	{1: 1, 2: 1, 11: 3, 13: 1, 23: 3, 29: 1}
Did not match all atoms present	100508-56-3	COC1=NC(=NC(=N1)OCC([N+](=O)[O-])([N+](=O)[O-])F)OC	{1: 2, 2: 1, 35: 3, 4: 1, 38: 2, 16: 1, 22: 3}
Did not match all atoms present	100508-57-4	COC1=NC(=NC(=N1)OCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F	{1: 1, 2: 2, 35: 3, 4: 2, 38: 4, 16: 2, 22: 3}
Did not match all atoms present	10052-09-2	CCCN(CCC)C(=O)C1=CN=CC=C1	{1: 2, 2: 4, 35: 1, 33: 1, 14: 4, 24: 1}
Did not match all atoms present	10052-47-8	CC[N+](C)(CC)CC.[Cl-]	{1: 4, 2: 3, 17: 1}
Did not match all atoms present	100527-20-6	C1=CC2=C(C=C(C=C2)[N+](=O)[O-])C3=C1C=CC(=C3)[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	10054-29-2	CCCCCCCCCCCCCCOP(=O)(O)O	{1: 1, 2: 13, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	100545-62-8	CCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC	{1: 3, 2: 15, 3: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	100545-63-9	CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC	{1: 3, 2: 9, 3: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	100545-64-0	CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC	{1: 3, 2: 11, 3: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	100545-65-1	CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC	{1: 3, 2: 13, 3: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	100573-96-4	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CC(C)CC	{1: 3, 2: 6, 3: 1, 28: 1, 14: 12}
Did not match all atoms present	10058-07-8	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCNCC3=CN=CC=C3.C1=CC(=CN=C1)C(=O)O	{1: 2, 2: 3, 35: 3, 33: 3, 14: 9, 25: 2, 27: 1, 31: 1}
Did not match all atoms present	10058-38-5	C1=CC=C(C=C1)C2=NC=C(S2)C(=O)O	{35: 1, 27: 1, 14: 6, 41: 1}
Did not match all atoms present	10058-44-3	[O-]P(=O)([O-])OP(=O)([O-])[O-].[O-]P(=O)([O-])OP(=O)([O-])[O-].[O-]P(=O)([O-])OP(=O)([O-])[O-].[Fe+3].[Fe+3].[Fe+3].[Fe+3]	{29: 18, 22: 3}
Did not match all atoms present	10059-74-2	COC1=CC2=C(C=C1)C(=C(CC2)C3=CC=CC=C3)C4=CC=C(C=C4)CCCCN5CCCC5.Cl	{1: 1, 2: 4, 33: 1, 11: 6, 14: 12, 15: 2, 17: 1, 22: 1}
Did not match all atoms present	100593-23-5	C1=CC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC4=C(C=CC1=C43)N=O	{34: 1, 38: 1, 29: 1, 14: 8}
Did not match all atoms present	100595-07-1	CN1C2=CC(=C(C=C2N=C(C1=O)CBr)OC)OC	{1: 3, 2: 1, 35: 1, 33: 1, 14: 2, 18: 1, 22: 2, 25: 1}
Did not match all atoms present	1006-20-8	CN1C=NC2=C1NC=NC2=S	{32: 1, 1: 1, 35: 2, 14: 2, 33: 1}
Did not match all atoms present	1006-23-1	C1(=C(N=C(N=C1N)N)N)N=O	{34: 1, 35: 2, 29: 1, 30: 3}
Did not match all atoms present	1006-31-1	CC1=C(C(=CC(=C1Cl)Cl)Cl)Cl	{1: 1, 14: 1, 17: 4}
Did not match all atoms present	1006-41-3	C1=CC(=C(C=C1F)Br)C(=O)O	{16: 1, 18: 1, 27: 1, 14: 3}
Did not match all atoms present	1006-59-3	CCC1=C(C(=CC=C1)CC)O	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	1006-65-1	C1=CC=C(C=C1)C2=NOC=C2	{35: 1, 14: 7, 23: 1}
Did not match all atoms present	1006-67-3	C1=CC=C(C=C1)C2=CC=NO2	{35: 1, 14: 7, 23: 1}
Did not match all atoms present	1006-68-4	C1=CC=C(C=C1)C2=CN=CO2	{35: 1, 14: 7, 23: 1}
Did not match all atoms present	1006-94-6	COC1=CC2=C(C=C1)NC=C2	{32: 1, 1: 1, 22: 1, 14: 5}
Did not match all atoms present	1006-99-1	CC1=NC2=C(S1)C=CC(=C2)Cl	{1: 1, 35: 1, 41: 1, 14: 3, 17: 1}
Did not match all atoms present	10060-08-9	O.O.[O-][Cr](=O)(=O)[O-].[Ca+2]	{29: 4}
Did not match all atoms present	10060-10-3	F[Ce](F)(F)F	{16: 4}
Did not match all atoms present	10060-11-4	Cl[Ge]Cl	{17: 2}
Did not match all atoms present	10060-12-5	O.O.O.O.O.O.Cl[Cr](Cl)Cl	{17: 3}
Did not match all atoms present	10060-13-6	[NH4+].[NH4+].O.O.Cl[Cu-2](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	10060-32-9	COC(=O)C1=C(C2=CC=CC=C2C=C1)C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	10060-33-0	COC(=O)C1=CC=CC2=C1C(=CC=C2)C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	100603-32-5	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Os+2]	{1: 10, 13: 2, 15: 6}
Did not match all atoms present	10061-32-2	C1CC[C@@]23CCN([C@@H]([C@@H]2C1)CC4=C3C=C(C=C4)O)CC(=O)C5=CC=CC=C5	{33: 1, 2: 1, 11: 7, 12: 2, 13: 1, 14: 8, 21: 1, 24: 1}
Did not match all atoms present	100620-36-8	CC1=C(C(=CC=C1)Cl)NC(=O)CSCC[NH+](C)C.[Cl-]	{1: 3, 2: 3, 40: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	100622-41-1	C1=CC=C2C(=C1)NC(=N2)CC3=CC=C(C=C3)Br	{32: 1, 2: 1, 35: 1, 18: 1, 14: 8}
Did not match all atoms present	10065-57-3	CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=C(C=C2)N(CCCl)CCCl)NC(=O)C	{1: 2, 2: 7, 3: 2, 33: 1, 14: 9, 17: 2, 24: 2, 28: 1, 31: 2}
Did not match all atoms present	100651-98-7	CCOP(=O)(C1=CC=C(S1)P(=O)(OCC)OCC)OCC	{1: 4, 2: 4, 41: 1, 14: 2, 22: 4, 29: 2}
Did not match all atoms present	100656-59-5	C(CO)N(CCO)CCO.C(C(COP(=O)(O)O)O)O	{33: 1, 2: 8, 3: 1, 20: 7, 22: 1, 29: 1}
Did not match all atoms present	10068-07-2	COC(=O)C1=CC(=O)NO1	{32: 1, 1: 1, 14: 1, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	1007-03-0	C1CC1C(C2=CC=CC=C2)O	{11: 2, 20: 1, 3: 1, 12: 1, 14: 5}
Did not match all atoms present	1007-15-4	CC(=O)C1=CC(=C(C=C1)F)Br	{16: 1, 1: 1, 18: 1, 14: 3, 24: 1}
Did not match all atoms present	1007-26-7	CC(C)(C)CC1=CC=CC=C1	{1: 3, 2: 1, 4: 1, 14: 5}
Did not match all atoms present	1007-27-8	C[Sn](C)(C)SC1=CC=CC=C1	{40: 1, 1: 3, 14: 5}
Did not match all atoms present	1007-32-5	CCC(=O)CC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 14: 5}
Did not match all atoms present	1007-36-9	CNC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 31: 2}
Did not match all atoms present	1007-54-1	C1=CC=C(C=C1)CSCCN	{40: 1, 2: 3, 30: 1, 14: 5}
Did not match all atoms present	1007-57-4	CCOP1OCC(CO1)(C)C	{1: 3, 2: 1, 11: 2, 13: 1, 22: 1, 23: 2}
Did not match all atoms present	10070-95-8	CC1=C(C(=O)N(N1C2=CC=CC=C2)C)CN(CCCl)CCCl.Cl	{1: 2, 2: 5, 33: 3, 14: 5, 17: 3, 25: 1}
Did not match all atoms present	100700-23-0	CCC(COCCCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I)C(=O)[O-].[Na+]	{1: 2, 2: 6, 3: 1, 14: 1, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	100700-24-1	CCC(C(=O)[O-])OCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I.[Na+]	{1: 2, 2: 3, 3: 1, 14: 1, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	100700-25-2	CCC(COCCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I)C(=O)[O-].[Na+]	{1: 2, 2: 5, 3: 1, 14: 1, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	100700-34-3	CCC(C(=O)[O-])OCCOC1=C(C=C(C(=C1I)N(C)C(=O)C)I)I.[Na+]	{1: 3, 2: 3, 3: 1, 33: 1, 14: 1, 19: 3, 22: 2, 24: 2}
Did not match all atoms present	10072-24-9	COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)[NH2+]CC[NH2+]CCCl.[Cl-].[Cl-]	{1: 1, 2: 4, 35: 1, 14: 6, 17: 4, 22: 1}
Did not match all atoms present	10072-25-0	COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)[NH2+]CC[NH+](CCCl)CCCl.[Cl-].[Cl-]	{1: 1, 2: 6, 35: 1, 14: 6, 17: 5, 22: 1}
Did not match all atoms present	100733-36-6	CC1=CC=CC=C1C(C2=CC=CC=C2)OC3CC4CCC(C3)[N+]4(C)C.[I-]	{1: 3, 3: 1, 11: 4, 12: 3, 14: 9, 19: 1, 22: 1}
Did not match all atoms present	10075-36-2	CC(C)C(CC(C)N(C)C)(C#N)C1=CC=CC=C1.C1CCC(CC1)NS(=O)(=O)O	{1: 5, 2: 1, 3: 2, 4: 1, 37: 1, 33: 1, 11: 5, 12: 1, 14: 5, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	10075-50-0	C1=CC2=C(C=CN2)C=C1Br	{32: 1, 18: 1, 14: 5}
Did not match all atoms present	10075-69-1	CN(C)C1=CC=CC2=C1C=CC=C2N(C)C	{1: 4, 14: 6, 33: 2}
Did not match all atoms present	10075-72-6	CSC1=CC=CC2=CC=CC=C21	{40: 1, 1: 1, 14: 7}
Did not match all atoms present	10075-73-7	CSC1=CC=C(C2=CC=CC=C21)SC	{40: 2, 1: 2, 14: 6}
Did not match all atoms present	10075-74-8	CSC1=CC=CC2=C1C=CC=C2SC	{40: 2, 1: 2, 14: 6}
Did not match all atoms present	10075-77-1	CSC1=CC2=C(C=C1)C=C(C=C2)SC	{40: 2, 1: 2, 14: 6}
Did not match all atoms present	10075-83-9	CSC1=C2C=CC=CC2=C(C3=CC=CC=C31)SC	{40: 2, 1: 2, 14: 8}
Did not match all atoms present	10075-85-1	C1=CC=C(C=C1)C#CC2=C3C=CC=CC3=C(C4=CC=CC=C42)C#CC5=CC=CC=C5	{10: 4, 14: 18}
Did not match all atoms present	100766-72-1	CCCCCCCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 10, 14: 7}
Did not match all atoms present	100784-20-1	CN1C(=C(C(=N1)Cl)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC	{1: 4, 35: 3, 33: 1, 14: 1, 17: 1, 22: 2, 24: 1, 28: 1, 29: 2, 31: 2}
Did not match all atoms present	1008-74-8	CC1=CC(=NO1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 6, 23: 1}
Did not match all atoms present	1008-75-9	CC1=NOC(=C1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 6, 23: 1}
Did not match all atoms present	1008-76-0	C1CC(=O)OC1C2=CC=CC=C2	{28: 1, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	1008-79-3	C1C(=O)N=CN1C2=CC=CC=C2	{25: 1, 11: 1, 35: 1, 14: 6, 33: 1}
Did not match all atoms present	1008-88-4	C1=CC=C(C=C1)C2=CN=CC=C2	{35: 1, 14: 9}
Did not match all atoms present	1008-89-5	C1=CC=C(C=C1)C2=CC=CC=N2	{35: 1, 14: 9}
Did not match all atoms present	1008-95-3	C1=CC(=CC=C1C2=CN=CO2)N	{35: 1, 30: 1, 14: 6, 23: 1}
Did not match all atoms present	10080-39-4	C1CCC(=CC1)[Hg]Cl	{17: 1, 11: 4, 14: 1, 15: 1}
Did not match all atoms present	10083-24-6	C1=CC(=C(C=C1/C=C/C2=CC(=CC(=C2)O)O)O)O	{14: 6, 6: 2, 21: 4}
Did not match all atoms present	10083-53-1	CNCC/C=C\1/C2=C(CCC3=CC=CC=C31)SC=C2	{1: 1, 2: 2, 6: 1, 41: 1, 11: 2, 14: 6, 15: 1, 31: 1}
Did not match all atoms present	100836-53-1	CC[NH+](CC)CCOC(=O)N(C)C(C)COC1=C(C=C(C=C1C)C)C.[Cl-]	{1: 7, 2: 5, 3: 1, 33: 1, 14: 2, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	100836-60-0	CC1(C(C2=C(O1)C(=CC=C2)OC(=O)N(C)N=O)O)C	{1: 3, 34: 1, 33: 1, 12: 1, 13: 1, 14: 3, 20: 1, 23: 1, 28: 1, 29: 1}
Did not match all atoms present	100836-61-1	CN(C(=O)OC1=CC=CC=C1C2OCCO2)N=O	{1: 1, 34: 1, 33: 1, 11: 2, 12: 1, 14: 4, 23: 2, 28: 1, 29: 1}
Did not match all atoms present	100836-62-2	CCSCC1=CC=CC=C1OC(=O)N(C)N=O	{1: 2, 2: 2, 33: 1, 40: 1, 34: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	100836-65-5	CC[NH+](CC)CCOC(=O)N(C)C(C)COC1=CC(=CC(=C1)C)C.[Cl-]	{1: 6, 2: 5, 3: 1, 33: 1, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	100836-66-6	CC1CCCC[NH+]1CCOC(=O)N(C)C(C)COC2=CC(=CC(=C2)C)C.[Cl-]	{1: 5, 2: 3, 3: 1, 33: 1, 11: 4, 12: 1, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	100836-67-7	CC1=CC(=CC(=C1)OCC(C)N(C)C(=O)OCC[NH+]2CCCC2)C.[Cl-]	{1: 4, 2: 3, 3: 1, 33: 1, 11: 4, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	100836-70-2	CC(COC1=CC=CC=C1)[NH+](C)CCOC(=O)NC2=CC=CC=C2.[Cl-]	{1: 2, 2: 3, 3: 1, 14: 10, 17: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	100836-84-8	COC(=O)N(C1=CC(=C(C=C1)Cl)Cl)N=O	{1: 1, 34: 1, 33: 1, 14: 3, 17: 2, 28: 1, 29: 1}
Did not match all atoms present	100842-25-9	CCCCCCCCCC1=CC=C(C=C1)[O-].CCCCCCCCCC1=CC=C(C=C1)[O-].[Ca+2]	{1: 2, 2: 16, 14: 8}
Did not match all atoms present	100842-26-0	CCCCCCCCCC1=CC=C(C=C1)[O-].CCCCCCCCCC1=CC=C(C=C1)[O-].[Sr+2]	{1: 2, 2: 16, 14: 8}
Did not match all atoms present	100842-27-1	CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].[Sr+2]	{24: 2, 1: 6, 4: 2, 14: 8}
Did not match all atoms present	100842-28-2	CCCCCCC(C)(C)C(=O)[O-].CCCCCCC(C)(C)C(=O)[O-].[Sr+2]	{24: 2, 1: 6, 2: 10, 4: 2}
Did not match all atoms present	10085-76-4	O.O.[Cl-].[Cl-].[Cl-].[Cl-].[K+].[K+].[Cu+2]	{17: 4}
Did not match all atoms present	10085-81-1	CNCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24.Cl	{1: 1, 2: 1, 11: 2, 12: 1, 13: 1, 14: 8, 17: 1, 31: 1}
Did not match all atoms present	100852-80-0	CCOC(=O)C1=CC(=NN1C)C(=O)OCC	{1: 3, 2: 2, 35: 1, 33: 1, 14: 1, 28: 2}
Did not match all atoms present	10087-89-5	C#CC(C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)NC3CCCCC3	{4: 1, 9: 1, 10: 1, 11: 5, 12: 1, 14: 10, 28: 1, 31: 1}
Did not match all atoms present	10088-95-6	C/C=C/C1=CC2=C(C(=O)[C@H]([C@@H](O2)C)O)C(=O)O1	{1: 2, 6: 2, 12: 2, 14: 1, 20: 1, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	10089-93-7	C1=CC=C2C=C(C(=CC2=C1)C(=O)N(CCO)CCO)O	{33: 1, 2: 4, 14: 6, 20: 2, 21: 1, 24: 1}
Did not match all atoms present	1009-11-6	CCCC(=O)C1=CC=C(C=C1)O	{24: 1, 1: 1, 2: 2, 21: 1, 14: 4}
Did not match all atoms present	1009-14-9	CCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 3, 14: 5}
Did not match all atoms present	1009-36-5	COC1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 1, 38: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	1009-61-6	CC(=O)C1=CC=C(C=C1)C(=O)C	{24: 2, 1: 2, 14: 4}
Did not match all atoms present	1009-67-2	CC(CC1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	1009-74-1	CCC1=NC(=NC(=N1)CC)CC	{1: 3, 2: 3, 35: 3}
Did not match all atoms present	1009-84-3	CCCCNC1=NN=C(C=C1)Cl	{1: 1, 2: 3, 35: 2, 14: 2, 17: 1, 31: 1}
Did not match all atoms present	1009-93-4	C[Si]1(N[Si](N[Si](N1)(C)C)(C)C)C	{32: 3, 1: 6}
Did not match all atoms present	10090-05-8	C[Si](C)(C)OS(=O)(=O)C	{1: 4, 29: 2, 22: 1}
Did not match all atoms present	10090-53-6	O.O.O.O.O.O.[Al+3].[I-].[I-].[I-]	{19: 3}
Did not match all atoms present	10094-34-5	CCCC(=O)OC(C)(C)CC1=CC=CC=C1	{1: 3, 2: 3, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	10095-83-7	C1=CC2=CSC=C2C=CC1=O	{25: 1, 14: 6, 41: 1}
Did not match all atoms present	100960-20-1	CN(C)C1=NC(=NC2=C1NC=N2)Cl	{32: 1, 1: 2, 35: 3, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	100965-46-6	C1=CC=C(C=C1)C2(C(=O)N(C(=O)N2Cl)Cl)C3=CC=CC=C3	{17: 2, 33: 2, 13: 1, 14: 10, 25: 2}
Did not match all atoms present	10097-28-6	[O+]#[Si-]	{29: 1}
Did not match all atoms present	10097-84-4	COC1=C(C2=C(C[C@H]3C4=CC(=C(C=C4CCN3C2)OC)OC)C=C1)OC	{1: 4, 33: 1, 11: 4, 12: 1, 14: 4, 22: 4}
Did not match all atoms present	10098-62-1	CC[Al](CC)CC.CC[Al-](CC)(CC)F.[K+]	{16: 1, 1: 6, 2: 6}
Did not match all atoms present	10099-57-7	CC(C)C1=CC=C(C=C1)CCO	{1: 2, 2: 2, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	10099-58-8	[Cl-].[Cl-].[Cl-].[La+3]	{17: 3}
Did not match all atoms present	10099-59-9	O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[La+3]	{}
Did not match all atoms present	10099-60-2	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[La+3].[La+3]	{29: 12}
Did not match all atoms present	10099-74-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Pb+2]	{}
Did not match all atoms present	10099-76-0	[O-][Si](=O)[O-].[Pb+2]	{29: 3}
Did not match all atoms present	10099-79-3	[O-][V](=O)=O.[O-][V](=O)=O.[Pb+2]	{29: 6}
Did not match all atoms present	101-00-8	B12OC(CN(CC(O1)C)CC(O2)C)C	{1: 3, 11: 3, 12: 3, 33: 1, 23: 3}
Did not match all atoms present	101-01-9	C1=CC=C(C=C1)NC(=NC2=CC=CC=C2)NC3=CC=CC=C3	{34: 1, 31: 2, 14: 15, 7: 1}
Did not match all atoms present	101-02-0	C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3	{22: 3, 14: 15}
Did not match all atoms present	101-05-3	C1=CC=C(C(=C1)NC2=NC(=NC(=N2)Cl)Cl)Cl	{17: 3, 35: 3, 14: 4, 31: 1}
Did not match all atoms present	101-06-4	C1=CC=C(C=C1)CN(CCO)CC2=CC=CC=C2	{33: 1, 2: 4, 20: 1, 14: 10}
Did not match all atoms present	101-08-6	C1CCN(CC1)CC(COC(=O)NC2=CC=CC=C2)OC(=O)NC3=CC=CC=C3	{33: 1, 2: 2, 3: 1, 11: 5, 14: 10, 28: 2, 31: 2}
Did not match all atoms present	101-09-7	C1=CC(=CC(=C1)NC(=O)C(=O)O)N	{24: 1, 27: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	101-10-0	CC(C(=O)O)OC1=CC(=CC=C1)Cl	{1: 1, 3: 1, 14: 4, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	101-11-1	CCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC=CC=C2	{1: 1, 2: 2, 33: 1, 14: 9, 20: 1, 29: 2}
Did not match all atoms present	101-12-2	C1=CC(=CC(=C1)N)C(=O)NC2=CC=CC(=C2)N	{24: 1, 30: 2, 14: 8, 31: 1}
Did not match all atoms present	101-14-4	C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)Cl)Cl)N	{17: 2, 2: 1, 30: 2, 14: 6}
Did not match all atoms present	101-15-5	CC1=C(C=CC(=C1)N=C2C=CC(=O)C=C2)N	{1: 1, 34: 1, 14: 7, 15: 1, 25: 1, 30: 1}
Did not match all atoms present	101-16-6	COC1=CC=CC(=C1)NC2=CC=CC=C2	{1: 1, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	101-17-7	C1=CC=C(C=C1)NC2=CC(=CC=C2)Cl	{17: 1, 14: 9, 31: 1}
Did not match all atoms present	101-18-8	C1=CC=C(C=C1)NC2=CC(=CC=C2)O	{21: 1, 14: 9, 31: 1}
Did not match all atoms present	101-20-2	C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)Cl)Cl	{24: 1, 17: 3, 14: 7, 31: 2}
Did not match all atoms present	101-21-3	CC(C)OC(=O)NC1=CC(=CC=C1)Cl	{1: 2, 3: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	101-24-6	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]	{24: 1, 38: 2, 14: 8, 31: 1}
Did not match all atoms present	101-26-8	C[N+]1=CC=CC(=C1)OC(=O)N(C)C.[Br-]	{1: 3, 18: 1, 28: 1, 14: 4, 33: 2}
Did not match all atoms present	101-27-9	C1=CC(=CC(=C1)Cl)NC(=O)OCC#CCCl	{2: 2, 10: 2, 14: 4, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	101-37-1	C=CCOC1=NC(=NC(=N1)OCC=C)OCC=C	{35: 3, 2: 3, 22: 3, 5: 3, 6: 3}
Did not match all atoms present	101-39-3	CC(=CC1=CC=CC=C1)C=O	{1: 1, 26: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	101-41-7	COC(=O)CC1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	101-42-8	CN(C)C(=O)NC1=CC=CC=C1	{24: 1, 1: 2, 33: 1, 14: 5, 31: 1}
Did not match all atoms present	101-48-4	COC(CC1=CC=CC=C1)OC	{1: 2, 2: 1, 3: 1, 22: 2, 14: 5}
Did not match all atoms present	101-49-5	C1COC(O1)CC2=CC=CC=C2	{2: 1, 11: 2, 12: 1, 14: 5, 23: 2}
Did not match all atoms present	101-50-8	C1=CC(=CC=C1N=NC2=CC(=C(C=C2)N)S(=O)(=O)O)S(=O)(=O)O	{30: 1, 34: 2, 20: 2, 29: 4, 14: 7}
Did not match all atoms present	101-51-9	C1=CC(=CC=C1N)N/N=C/2\C=CC(=O)C(=C2)C(=O)O	{34: 1, 14: 7, 15: 2, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	101-53-1	C1=CC=C(C=C1)CC2=CC=C(C=C2)O	{2: 1, 21: 1, 14: 9}
Did not match all atoms present	101-54-2	C1=CC=C(C=C1)NC2=CC=C(C=C2)N	{30: 1, 14: 9, 31: 1}
Did not match all atoms present	101-55-3	C1=CC=C(C=C1)OC2=CC=C(C=C2)Br	{18: 1, 22: 1, 14: 9}
Did not match all atoms present	101-56-4	C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N.[Cl-]	{17: 1, 34: 1, 14: 9, 31: 1}
Did not match all atoms present	101-57-5	C1=CC=C(C=C1)NC2=CC=C(C=C2)S(=O)(=O)O	{20: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	101-58-6	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)C(C)(C)CC(C)(C)C	{1: 10, 2: 2, 4: 4, 22: 1, 14: 8}
Did not match all atoms present	101-59-7	C1=CC(=CC=C1N)SC2=CC=C(C=C2)[N+](=O)[O-]	{40: 1, 38: 1, 30: 1, 14: 8}
Did not match all atoms present	101-60-0	C1=CC2=CC3=CC=C(N3)C=C4C=CC(=N4)C=C5C=CC(=N5)C=C1N2	{32: 2, 35: 2, 14: 12}
Did not match all atoms present	101-61-1	CN(C)C1=CC=C(C=C1)CC2=CC=C(C=C2)N(C)C	{1: 4, 2: 1, 14: 8, 33: 2}
Did not match all atoms present	101-63-3	C1=CC(=CC=C1[N+](=O)[O-])OC2=CC=C(C=C2)[N+](=O)[O-]	{38: 2, 22: 1, 14: 8}
Did not match all atoms present	101-64-4	COC1=CC=C(C=C1)NC2=CC=C(C=C2)N	{1: 1, 30: 1, 22: 1, 14: 8, 31: 1}
Did not match all atoms present	101-67-7	CCCCCCCCC1=CC=C(C=C1)NC2=CC=C(C=C2)CCCCCCCC	{1: 2, 2: 14, 14: 8, 31: 1}
Did not match all atoms present	101-68-8	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O	{8: 2, 2: 1, 34: 2, 29: 2, 14: 8}
Did not match all atoms present	101-70-2	COC1=CC=C(C=C1)NC2=CC=C(C=C2)OC	{1: 2, 22: 2, 14: 8, 31: 1}
Did not match all atoms present	101-71-3	C1=CC=C(C=C1)CC2=CC=C(C=C2)OC(=O)N	{2: 1, 28: 1, 30: 1, 14: 9}
Did not match all atoms present	101-72-4	CC(C)NC1=CC=C(C=C1)NC2=CC=CC=C2	{1: 2, 3: 1, 14: 9, 31: 2}
Did not match all atoms present	101-73-5	CC(C)OC1=CC=C(C=C1)NC2=CC=CC=C2	{1: 2, 3: 1, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	101-74-6	C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=CC=C(C=C3)O	{21: 1, 14: 13, 31: 2}
Did not match all atoms present	101-75-7	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC=CC=C3	{34: 2, 14: 14, 31: 1}
Did not match all atoms present	101-76-8	C1=CC(=CC=C1CC2=CC=C(C=C2)Cl)Cl	{17: 2, 2: 1, 14: 8}
Did not match all atoms present	101-77-9	C1=CC(=CC=C1CC2=CC=C(C=C2)N)N	{2: 1, 30: 2, 14: 8}
Did not match all atoms present	101-79-1	C1=CC(=CC=C1N)OC2=CC=C(C=C2)Cl	{17: 1, 30: 1, 22: 1, 14: 8}
Did not match all atoms present	101-80-4	C1=CC(=CC=C1N)OC2=CC=C(C=C2)N	{30: 2, 22: 1, 14: 8}
Did not match all atoms present	101-81-5	C1=CC=C(C=C1)CC2=CC=CC=C2	{2: 1, 14: 10}
Did not match all atoms present	101-82-6	C1=CC=C(C=C1)CC2=CC=CC=N2	{2: 1, 35: 1, 14: 9}
Did not match all atoms present	101-84-8	C1=CC=C(C=C1)OC2=CC=CC=C2	{22: 1, 14: 10}
Did not match all atoms present	101-85-9	CCCCCC(=CC1=CC=CC=C1)CO	{1: 1, 2: 5, 6: 1, 7: 1, 14: 5, 20: 1}
Did not match all atoms present	101-86-0	CCCCCCC(=CC1=CC=CC=C1)C=O	{1: 1, 2: 5, 6: 1, 7: 1, 14: 5, 26: 1}
Did not match all atoms present	101-87-1	C1CCC(CC1)NC2=CC=C(C=C2)NC3=CC=CC=C3	{11: 5, 12: 1, 14: 9, 31: 2}
Did not match all atoms present	101-89-3	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)[N+]#N)C.OS(=O)(=O)[O-]	{1: 2, 34: 3, 20: 1, 29: 3, 14: 7}
Did not match all atoms present	101-90-6	C1C(O1)COC2=CC(=CC=C2)OCC3CO3	{2: 2, 11: 2, 12: 2, 14: 4, 22: 2, 23: 2}
Did not match all atoms present	101-91-7	CCCC(=O)NC1=CC=C(C=C1)O	{1: 1, 2: 2, 14: 4, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	101-92-8	CC(=O)CC(=O)NC1=CC=C(C=C1)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	101-93-9	CCOC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)OCC)C	{1: 3, 2: 2, 7: 1, 34: 1, 14: 8, 22: 2, 31: 1}
Did not match all atoms present	101-94-0	CC1=CC=C(C=C1)OC(=O)CC2=CC=CC=C2	{1: 1, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	101-96-2	CCC(C)NC1=CC=C(C=C1)NC(C)CC	{1: 4, 2: 2, 3: 2, 14: 4, 31: 2}
Did not match all atoms present	101-97-3	CCOC(=O)CC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	101-98-4	CN(CCO)CC1=CC=CC=C1	{1: 1, 2: 3, 20: 1, 14: 5, 33: 1}
Did not match all atoms present	101-99-5	CCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	1010-19-1	CC[N+](CC)(CC)C1=CC=CC=C1.[I-]	{1: 3, 2: 3, 19: 1, 14: 5}
Did not match all atoms present	1010-48-6	CC(C)(CC(=O)O)C1=CC=CC=C1	{1: 2, 2: 1, 27: 1, 4: 1, 14: 5}
Did not match all atoms present	1010-60-2	C1=CC=C2C(=C1)C(=O)C=C(C2=O)Cl	{17: 1, 25: 2, 14: 5, 15: 1}
Did not match all atoms present	1010-61-3	C1=CC=C2C(=C1)/C(=N/O)/C=CN2O.Cl	{33: 1, 34: 1, 14: 6, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	1010-99-7	CC1=CC(=C(C(=C1)O)O)C(C)(C)C	{1: 4, 4: 1, 21: 2, 14: 2}
Did not match all atoms present	101007-06-1	CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=CC(=O)OC(C(F)(F)F)C(F)(F)F)C	{1: 2, 3: 2, 4: 2, 37: 1, 6: 2, 12: 2, 13: 1, 14: 9, 16: 6, 22: 1, 28: 2}
Did not match all atoms present	10101-39-0	[O-][Si](=O)[O-].[Ca+2]	{29: 3}
Did not match all atoms present	10101-41-4	O.O.[O-]S(=O)(=O)[O-].[Ca+2]	{29: 4}
Did not match all atoms present	10101-50-5	[O-][Mn](=O)(=O)=O.[Na+]	{29: 4}
Did not match all atoms present	10101-52-7	[O-][Si]([O-])([O-])[O-].[Zr+4]	{29: 4}
Did not match all atoms present	10101-53-8	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cr+3].[Cr+3]	{29: 12}
Did not match all atoms present	10101-58-3	[O-2].[O-2].[O-2].[O-2].[Co+2].[W]	{}
Did not match all atoms present	10101-60-7	[NH4+].[O-]P(=O)([O-])[O-].[Fe+2]	{29: 4}
Did not match all atoms present	10101-63-0	I[Pb]I	{19: 2}
Did not match all atoms present	10101-68-5	O.O.O.O.[O-]S(=O)(=O)[O-].[Mn+2]	{29: 4}
Did not match all atoms present	10101-88-9	[O-]P(=S)([O-])[O-].[Na+].[Na+].[Na+]	{29: 3}
Did not match all atoms present	10101-89-0	O.O.O.O.O.O.O.O.O.O.O.O.[O-]P(=O)([O-])[O-].[Na+].[Na+].[Na+]	{29: 4}
Did not match all atoms present	10101-95-8	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Nd+3].[Nd+3]	{29: 12}
Did not match all atoms present	10101-96-9	[O-][Se](=O)[O-].[Ni+2]	{29: 3}
Did not match all atoms present	10101-97-0	O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Ni+2]	{29: 4}
Did not match all atoms present	10101-98-1	O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Ni+2]	{29: 4}
Did not match all atoms present	101018-97-7	C1COC2=C(O1)C=CC(=C2)C(=O)C3=CC=C(C=C3)F	{16: 1, 24: 1, 11: 2, 14: 7, 23: 2}
Did not match all atoms present	10102-02-0	N(=O)[O-].N(=O)[O-].[Zn+2]	{34: 2, 29: 4}
Did not match all atoms present	10102-03-1	[N+](=O)([O-])O[N+](=O)[O-]	{22: 1}
Did not match all atoms present	10102-05-3	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Pd+2]	{}
Did not match all atoms present	10102-06-4	[N+](=O)(O)[O-].[N+](=O)(O)[O-].O=[U]=O	{20: 2, 29: 2}
Did not match all atoms present	10102-15-5	O.O.O.O.O.O.O.[O-]S(=O)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	10102-17-7	O.O.O.O.O.[O-]S(=O)(=S)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	10102-18-8	[O-][Se](=O)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	10102-23-5	O.O.O.O.O.O.O.O.O.O.[O-][Se](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	10102-24-6	O=[Si]([O-])[O-].[Li+].[Li+]	{29: 3}
Did not match all atoms present	10102-25-7	[Li+].[Li+].O.[O-]S(=O)(=O)[O-]	{29: 4}
Did not match all atoms present	10102-34-8	O.O.[O-]P(=O)([O-])OP(=O)([O-])[O-].[Mg+2].[Mg+2]	{29: 6, 22: 1}
Did not match all atoms present	10102-40-6	O.O.[O-][Mo](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	10102-43-9	[N]=O	{29: 1}
Did not match all atoms present	10102-45-1	[N+](=O)([O-])[O-].[Tl+]	{}
Did not match all atoms present	10102-49-5	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Fe+2].[Fe+2].[Fe+2]	{29: 8}
Did not match all atoms present	10102-68-8	[Ca+2].[I-].[I-]	{19: 2}
Did not match all atoms present	10102-71-3	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[Al+3]	{29: 8}
Did not match all atoms present	10102-75-7	[O-]Br(=O)=O.[O-]Br(=O)=O.[Ca+2]	{18: 2, 29: 6}
Did not match all atoms present	10103-50-1	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Mg+2].[Mg+2].[Mg+2]	{29: 8}
Did not match all atoms present	10103-60-3	O[As](=O)(O)[O-].[Na+]	{20: 2, 29: 2}
Did not match all atoms present	10103-89-6	CC(=O)OCC1=C([N+](=O)C2=CC=CC=C2N1[O-])COC(=O)C	{1: 2, 2: 2, 33: 2, 14: 4, 28: 2, 29: 2}
Did not match all atoms present	101043-37-2	C[C@H]1[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(=C)N(C(=O)CC[C@@H](NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)CCCN=C(N)N)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)OC)/C	{32: 6, 1: 9, 2: 5, 3: 3, 5: 1, 6: 3, 7: 2, 11: 2, 12: 8, 34: 1, 14: 5, 15: 1, 22: 1, 25: 7, 33: 1, 27: 2, 30: 2}
Did not match all atoms present	101043-65-6	C1=CC2=C(C=CC3=C2C4=C1C=CC(=C4C=C3)[N+](=O)[O-])N=O	{34: 1, 38: 1, 29: 1, 14: 8}
Did not match all atoms present	10105-42-7	C1(=NC(=NC(=N1)NN)NN)NN	{35: 3, 30: 3, 31: 3}
Did not match all atoms present	101052-67-9	CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.C1N(CSC(=S)N1CC2=CC=CC=C2)CC3=CC=CC=C3.C1=C(C(=CC(=C1Cl)N)Cl)N=C=S	{1: 2, 2: 4, 3: 1, 33: 3, 8: 1, 41: 1, 11: 2, 34: 1, 14: 22, 15: 1, 17: 2, 22: 1, 30: 1}
Did not match all atoms present	10108-61-9	CCC(C)N1C(=O)C2=CC=CC=C2C1=O	{1: 2, 2: 1, 3: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	10108-64-2	[Cd+2].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	10108-73-3	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ce+3]	{}
Did not match all atoms present	10109-95-2	C1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3)C(=O)O	{27: 2, 14: 12, 31: 2}
Did not match all atoms present	1011-15-0	C1CN(CCN1)C2=CC=CC=C2F	{16: 1, 32: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	1011-50-3	C1=CC=C2C(=C1)C=CC(=N2)CCO	{2: 2, 35: 1, 20: 1, 14: 6}
Did not match all atoms present	1011-54-7	COC1=CC=CC=C1C=CC(=O)O	{1: 1, 22: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	1011-73-0	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[O-].[Na+]	{38: 2, 14: 3}
Did not match all atoms present	10110-15-3	CCCCOC(=O)CCN1C(=O)C2=C(C3=C(C(=C2C1=O)N)C(=O)C4=CC=CC=C4C3=O)N	{1: 1, 2: 5, 33: 1, 14: 4, 25: 4, 28: 1, 30: 2}
Did not match all atoms present	10110-24-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCOCCC#N)N	{2: 4, 37: 1, 14: 5, 21: 1, 22: 2, 25: 2, 30: 1}
Did not match all atoms present	10111-08-7	C1=CN=C(N1)C=O	{32: 1, 26: 1, 35: 1, 14: 2}
Did not match all atoms present	10112-15-9	CCNC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	10112-45-5	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Fe+3].[Fe+3]	{24: 6}
Did not match all atoms present	10112-91-1	Cl[Hg].Cl[Hg]	{17: 2}
Did not match all atoms present	10112-94-4	O[Se](=O)(=O)O.[Na]	{20: 2, 29: 2}
Did not match all atoms present	10114-24-6	COC1=CC=CC=C1N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 14: 18, 15: 4, 22: 1, 24: 1, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	10114-63-3	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])OC)NC(=O)NC3=C(C=C(C(=C3)C)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 4, 34: 4, 14: 12, 22: 2, 24: 1, 29: 6, 31: 2}
Did not match all atoms present	10115-25-0	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC=C(C4=CC=CC=C43)S(=O)(=O)[O-])N=NC5=C(C=C(C=C5)N)N.[Na+]	{30: 2, 34: 4, 29: 3, 14: 15}
Did not match all atoms present	10116-15-1	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=C(C=CC(=C3)S(=O)(=O)CCOS(=O)(=O)O)OC)/C2=O)S(=O)(=O)O	{1: 2, 2: 2, 34: 1, 14: 6, 15: 2, 20: 3, 22: 2, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	10117-38-1	[O-]S(=O)[O-].[K+].[K+]	{29: 3}
Did not match all atoms present	10118-76-0	[O-][Mn](=O)(=O)=O.[O-][Mn](=O)(=O)=O.[Ca+2]	{29: 8}
Did not match all atoms present	10118-90-8	CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=CC(=C4C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O)N(C)C	{1: 4, 33: 2, 11: 2, 12: 3, 13: 1, 14: 2, 15: 4, 20: 3, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	10119-53-6	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Ce+3]	{24: 3, 1: 3, 2: 48}
Did not match all atoms present	1012-72-2	CC(C)(C)C1=CC=C(C=C1)C(C)(C)C	{1: 6, 4: 2, 14: 4}
Did not match all atoms present	1012-73-3	C[Sn](C)(C)C1=CC=C(C=C1)[Sn](C)(C)C	{1: 6, 14: 4}
Did not match all atoms present	1012-76-6	CC(C)(C)C1=CC=CC=C1C(C)(C)C	{1: 6, 4: 2, 14: 4}
Did not match all atoms present	1012-82-4	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)O	{1: 2, 35: 1, 33: 3, 14: 1, 21: 1, 25: 2}
Did not match all atoms present	1012-84-6	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C(=O)O	{17: 5, 27: 1}
Did not match all atoms present	101200-48-0	CC1=NC(=NC(=N1)OC)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC	{1: 4, 35: 3, 33: 1, 14: 4, 22: 1, 24: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	101200-55-9	C1=CC=C(C=C1)SC2=CC=C(C=C2)SC3=CC=C(C=C3)[S+](C4=CC=CC=C4)C5=CC=CC=C5.F[P-](F)(F)(F)(F)F	{16: 6, 40: 2, 14: 23}
Did not match all atoms present	101200-62-8	C1=CC=C(C=C1)SC2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=C(C=C4)SC5=CC=CC=C5.F[P-](F)(F)(F)(F)F	{16: 6, 40: 2, 14: 23}
Did not match all atoms present	101200-63-9	C1=CC=C(C=C1)SC2=CC=C(C=C2)[S+]3C4=CC=CC=C4SC5=CC=CC=C53.F[P-](F)(F)(F)(F)F	{16: 6, 40: 1, 14: 17, 41: 1}
Did not match all atoms present	10121-94-5	CNC1=C(C=C(C=C1)N=NC2=CC=CC=C2)OC	{1: 2, 34: 2, 22: 1, 14: 8, 31: 1}
Did not match all atoms present	10122-95-9	C1CC2=CC(=C(CCC3=CC=C1C=C3)C=C2)N	{11: 4, 30: 1, 14: 7}
Did not match all atoms present	101221-62-9	O.O.O.O.O.O.[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Cl-].[Cl-].[Ca+2].[Ca+2]	{17: 4, 29: 6}
Did not match all atoms present	101227-25-2	C[N+](C)(CC(C[N+](C)(C)CC(CCl)O)O)CC(CCl)O.C1C(O1)CCl.C(CNCCN)N.[Cl-].[Cl-]	{1: 4, 2: 11, 3: 3, 11: 1, 12: 1, 17: 5, 20: 3, 23: 1, 30: 2, 31: 1}
Did not match all atoms present	101227-29-6	CC(CN)N.CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4.C(CCCN)CCN	{1: 3, 2: 9, 3: 1, 4: 1, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2, 30: 4}
Did not match all atoms present	10123-62-3	CCOP(=O)(CCC#N)OCC	{1: 2, 2: 4, 29: 1, 22: 2, 37: 1}
Did not match all atoms present	10124-27-3	O.[Al](Cl)(Cl)Cl	{17: 3}
Did not match all atoms present	10124-29-5	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]	{29: 12}
Did not match all atoms present	10124-36-4	[O-]S(=O)(=O)[O-].[Cd+2]	{29: 4}
Did not match all atoms present	10124-37-5	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ca+2]	{}
Did not match all atoms present	10124-41-1	[O-]S(=O)(=S)[O-].[Ca+2]	{29: 3}
Did not match all atoms present	10124-43-3	[O-]S(=O)(=O)[O-].[Co+2]	{29: 4}
Did not match all atoms present	10124-48-8	N[Hg]Cl	{17: 1, 30: 1}
Did not match all atoms present	10124-56-8	[O-]P1(=O)OP(=O)(OP(=O)(OP(=O)(OP(=O)(OP(=O)(O1)[O-])[O-])[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{29: 12, 23: 6}
Did not match all atoms present	10124-65-9	CCCCCCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 10}
Did not match all atoms present	101246-68-8	CCCCCCCNC(=O)OC1=CC2=C(C=C1)N([C@@H]3[C@]2(CCN3C)C)C	{1: 4, 2: 6, 33: 2, 11: 2, 12: 1, 13: 1, 14: 3, 28: 1, 31: 1}
Did not match all atoms present	10125-13-0	O.O.Cl[Cu]Cl	{17: 2}
Did not match all atoms present	10125-18-5	C1=CC=C(C=C1)OCCCCCCOC2=CC=CC=C2	{2: 6, 22: 2, 14: 10}
Did not match all atoms present	10125-76-5	C1=CC=C(C=C1)C2=CC=C(C=C2)N=O	{34: 1, 29: 1, 14: 9}
Did not match all atoms present	10125-85-6	C[N+]1(CCC(CC1)C2=CC=CC=C2)C.[I-]	{19: 1, 1: 2, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	10126-87-1	CCOC1=CC2=C(C=C1)C(=C(S2)C3=C(C4=C(S3)C=C(C=C4)OCC)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 2, 41: 2, 14: 6, 22: 4, 29: 6}
Did not match all atoms present	10127-03-4	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=O)C(=CC4=CC=CC=C34)C(=O)NC5=CC=CC=C5)OC)N/N=C/6\C(=O)C(=CC7=CC=CC=C67)C(=O)NC8=CC=CC=C8	{1: 2, 34: 2, 14: 26, 15: 4, 22: 2, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	10127-36-3	CC[N+](=C1C=C2C(=NC3=C(C=C(C=C3O2)N)N)C=C1C)CC.[Cl-]	{1: 3, 2: 2, 35: 1, 33: 1, 14: 4, 17: 1, 23: 1, 30: 2}
Did not match all atoms present	101294-98-8	C1=CC=C(C=C1)[S+]2C3=C(C(=CC=C3)Cl)SC4=CC=CC=C42.F[P-](F)(F)(F)(F)F	{16: 6, 17: 1, 14: 12, 41: 1}
Did not match all atoms present	1013-08-7	C1CCC2=C(C1)C=CC3=CC=CC=C23	{11: 4, 14: 6}
Did not match all atoms present	1013-22-5	CC1=C(C(=CC=C1)N2CCNCC2)C	{32: 1, 1: 2, 11: 4, 14: 3, 33: 1}
Did not match all atoms present	1013-23-6	C1=CC=C2C(=C1)C3=CC=CC=C3S2=O	{29: 1, 14: 8}
Did not match all atoms present	1013-25-8	CC1=CC(=C(C=C1)C)N2CCNCC2	{32: 1, 1: 2, 11: 4, 14: 3, 33: 1}
Did not match all atoms present	1013-59-8	CC[C@H](C)[C@H]1C(=C(C(=O)N1)C(=O)C)[O-].[Na+]	{32: 1, 1: 3, 2: 1, 3: 1, 12: 1, 15: 2, 24: 1, 25: 1}
Did not match all atoms present	1013-75-8	CCN(C1=CC=CC=C1)C(=O)OCC	{1: 2, 2: 2, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	1013-76-9	CC1=CC(=C(C=C1)N2CCNCC2)C	{32: 1, 1: 2, 11: 4, 14: 3, 33: 1}
Did not match all atoms present	1013-83-8	C1=CC2=C(C=CC(=C2)C(=O)O)C(=C1)Br	{18: 1, 27: 1, 14: 6}
Did not match all atoms present	1013-88-3	C1=CC=C(C=C1)C(=N)C2=CC=CC=C2	{36: 1, 14: 10, 7: 1}
Did not match all atoms present	10130-87-7	COC1=CC=CC=C1S(=O)(=O)Cl	{1: 1, 29: 2, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	10130-89-9	C1=CC(=CC=C1C(=O)O)S(=O)(=O)Cl	{17: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	101316-88-5	CCC(CO)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 1, 2: 4, 4: 1, 14: 8, 20: 3, 27: 2, 28: 2}
Did not match all atoms present	10132-07-7	C1=C(N=C(N=C1Cl)Cl)N	{17: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	101325-00-2	COC(=O)OC.C(CCCO)CCO	{1: 2, 2: 6, 20: 2}
Did not match all atoms present	10133-30-9	C1=CC2=C(C=CS2)C=C1C=O	{41: 1, 26: 1, 14: 5}
Did not match all atoms present	10133-34-3	C1=CC(=C2C=CSC2=C1)[N+](=O)[O-]	{41: 1, 38: 1, 14: 5}
Did not match all atoms present	10133-41-2	C1=CC=C2C(=C1)C=C(S2(=O)=O)Cl	{17: 1, 29: 2, 14: 5, 15: 1}
Did not match all atoms present	10134-35-7	C1=CC2=C(C(=C1)Cl)C3=C(C=C2)C(=C(S3)C4=C(C5=C(N4)C=CC(=C5)Br)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+]	{32: 1, 41: 1, 14: 8, 17: 1, 18: 1, 22: 2, 29: 6}
Did not match all atoms present	10137-69-6	C1CC(CC=C1)[Si](Cl)(Cl)Cl	{17: 3, 11: 3, 12: 1, 14: 2}
Did not match all atoms present	10137-74-3	[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Ca+2]	{17: 2, 29: 6}
Did not match all atoms present	10137-80-1	CCCCC(CC)CNC1=CC=CC=C1	{1: 2, 2: 5, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	10137-87-8	CCNC(C)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	101371-20-4	CCCC(C)C1=CC=C(C=C1)C(CC)CC	{1: 4, 2: 4, 3: 2, 14: 4}
Did not match all atoms present	10138-01-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Eu+3]	{}
Did not match all atoms present	10138-21-3	CC[Si](C=C)(Cl)Cl	{1: 1, 2: 1, 5: 1, 6: 1, 17: 2}
Did not match all atoms present	10138-41-7	Cl[Er](Cl)Cl	{17: 3}
Did not match all atoms present	10138-52-0	Cl[Gd](Cl)Cl	{17: 3}
Did not match all atoms present	10138-62-2	Cl[Ho](Cl)Cl	{17: 3}
Did not match all atoms present	10138-79-1	C(CCl)O[Si](OCCCl)OCCCl	{17: 3, 2: 6, 22: 3}
Did not match all atoms present	101385-90-4	C1CN(C[C@H]1O)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 3, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	10139-01-2	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OC2=CC=CC=C2[N+](=O)[O-])CO)O)O	{1: 1, 2: 1, 38: 1, 12: 5, 14: 4, 20: 3, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	10139-02-3	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OC2=CC=C(C=C2)[N+](=O)[O-])CO)O)O	{1: 1, 2: 1, 38: 1, 12: 5, 14: 4, 20: 3, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	10139-18-1	C(C1C(C(C(C(O1)OP(=O)(O)O)O)O)O)OP(=O)(O)O	{2: 1, 12: 5, 20: 7, 22: 2, 23: 1, 29: 2}
Did not match all atoms present	10139-47-6	[I-].[I-].[Zn+2]	{19: 2}
Did not match all atoms present	10139-58-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Rh+3]	{}
Did not match all atoms present	10139-84-1	CC1=C(C=CC(=C1O)C(=O)C)O	{24: 1, 1: 2, 21: 2, 14: 2}
Did not match all atoms present	1014-05-7	CC1=C(C=C(C=C1)N2CCNCC2)C	{32: 1, 1: 2, 11: 4, 14: 3, 33: 1}
Did not match all atoms present	1014-41-1	CCC(C)C1=CC=C(C=C1)C(C)CC	{1: 4, 2: 2, 3: 2, 14: 4}
Did not match all atoms present	1014-60-4	CC(C)(C)C1=CC(=CC=C1)C(C)(C)C	{1: 6, 4: 2, 14: 4}
Did not match all atoms present	1014-66-0	C[Si](C)(C)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	1014-69-3	CC(C)NC1=NC(=NC(=N1)NC)SC	{40: 1, 1: 4, 3: 1, 35: 3, 31: 2}
Did not match all atoms present	1014-70-6	CCNC1=NC(=NC(=N1)SC)NCC	{40: 1, 1: 3, 2: 2, 35: 3, 31: 2}
Did not match all atoms present	1014-81-9	C1=CC(=CC(=C1)OC(F)(F)F)C(=O)O	{16: 3, 27: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	1014-98-8	C1=CC(=CC=C1CN=C=O)CN=C=O	{8: 2, 2: 2, 34: 2, 29: 2, 14: 4}
Did not match all atoms present	10140-08-6	CCC1=C(C(=CC=C1)CC)C(C2=C(C=CC=C2CC)CC)OCCOCCN3CCN(CC3)C	{1: 5, 2: 8, 3: 1, 33: 2, 11: 4, 14: 6, 22: 2}
Did not match all atoms present	10140-84-8	CCOCCOC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 3, 22: 2, 14: 3, 17: 2}
Did not match all atoms present	10140-91-7	CC12CCCCC1(OP(=S)(OC2)Cl)C	{23: 2, 1: 2, 11: 5, 13: 2, 17: 1}
Did not match all atoms present	10140-94-0	CCCC1C(COP(=S)(O1)Cl)CC	{1: 2, 2: 3, 11: 1, 12: 2, 17: 1, 23: 2}
Did not match all atoms present	10140-97-3	C=C(C1=CC=C(C=C1)[N+](=O)[O-])Cl	{17: 1, 38: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	10141-00-1	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[K+].[Cr+3]	{29: 8}
Did not match all atoms present	10141-05-6	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Co+2]	{}
Did not match all atoms present	101418-02-4	CC(C)OC(=O)N(C1=CC=CC=C1)N=O	{1: 2, 34: 1, 3: 1, 33: 1, 14: 5, 28: 1, 29: 1}
Did not match all atoms present	10142-78-6	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=CC=C(C5=CC=CC=C54)N=NC6=CC=CC7=C6C=CC=C7S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 4, 29: 6, 14: 21, 31: 1}
Did not match all atoms present	10143-03-0	CC1=C(C(=CC(=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC(=C(C(=C3)C(=O)O)O)C)C(=O)O)O	{1: 4, 3: 1, 33: 1, 14: 8, 21: 2, 27: 2}
Did not match all atoms present	101453-68-3	COC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2[O-])OC.[K+]	{24: 1, 1: 2, 22: 2, 14: 9, 31: 1}
Did not match all atoms present	101453-69-4	COC1=CC2=CC(=C(C=C2C=C1)[O-])C(=O)NC3=CC=CC=C3.[K+]	{24: 1, 1: 1, 22: 1, 14: 10, 31: 1}
Did not match all atoms present	101453-70-7	CC1=CC=CC=C1NC(=O)C2=C(C=C3C=CC(=CC3=C2)OC)[O-].[K+]	{24: 1, 1: 2, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	101462-63-9	CCC(=O)C1=CC=CC2=CC=CC=C21	{24: 1, 1: 1, 2: 1, 14: 7}
Did not match all atoms present	101463-69-8	C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=C(C=C(C=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)F)F	{4: 1, 14: 9, 16: 6, 17: 1, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	10147-11-2	C#CCC1=CC=CC=C1	{9: 1, 2: 1, 10: 1, 14: 5}
Did not match all atoms present	10147-36-1	CCCS(=O)(=O)Cl	{1: 1, 2: 2, 29: 2, 17: 1}
Did not match all atoms present	10147-37-2	CC(C)S(=O)(=O)Cl	{1: 2, 3: 1, 29: 2, 17: 1}
Did not match all atoms present	10147-40-7	CCCCCCCCCCCCS(=O)(=O)Cl	{1: 1, 2: 11, 29: 2, 17: 1}
Did not match all atoms present	10147-41-8	CCCCCCCCCCCCCCCCCCS(=O)(=O)Cl	{1: 1, 2: 17, 29: 2, 17: 1}
Did not match all atoms present	10148-71-7	CC(C)[C@H]([C@@H](C(=O)[O-])[NH3+])O	{24: 1, 1: 2, 3: 3, 20: 1}
Did not match all atoms present	101489-25-2	COC1=C2C(=C(C=C1)O)C(=O)C3=C(C=C4C(=C3O2)C5CCOC5O4)OC	{1: 2, 11: 2, 12: 2, 14: 3, 21: 1, 22: 2, 23: 3, 25: 1}
Did not match all atoms present	101491-82-1	CC[NH+](CC)CCOC(=O)N(CC)C(C)COC1=CC=CC=C1.[Cl-]	{1: 4, 2: 6, 3: 1, 33: 1, 14: 5, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	101491-83-2	CCN(C(C)COC1=CC=CC=C1)C(=O)OCC[NH+]2CCCCC2C.[Cl-]	{1: 3, 2: 4, 3: 1, 33: 1, 11: 4, 12: 1, 14: 5, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	101491-84-3	CCN(C(C)COC1=CC=CC=C1C)C(=O)OCC[NH+]2CCCCC2C.[Cl-]	{1: 4, 2: 4, 3: 1, 33: 1, 11: 4, 12: 1, 14: 4, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	101491-85-4	CC[NH+](CC)CCOC(=O)N(CC)C(C)COC1=CC(=CC(=C1)C)C.[Cl-]	{1: 6, 2: 6, 3: 1, 33: 1, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	101491-86-5	CCN(C(C)COC1=CC(=CC(=C1)C)C)C(=O)OCC[NH+]2CCCCC2C.[Cl-]	{1: 5, 2: 4, 3: 1, 33: 1, 11: 4, 12: 1, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	1015-38-9	C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)S	{14: 10, 39: 1}
Did not match all atoms present	1015-89-0	C1=CC=C2C(=C1)C3=CC=CC=C3NC2=O	{32: 1, 25: 1, 14: 8}
Did not match all atoms present	10150-26-2	COC1=C(C=C(C=C1)S(=O)(=O)CCOS(=O)(=O)O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{1: 1, 2: 2, 14: 8, 20: 2, 22: 2, 25: 2, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	101509-27-7	O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Nd+3].[Nd+3]	{29: 12}
Did not match all atoms present	10151-95-8	C1=CC=C(C=C1)NC(=O)C[N+](=O)[O-]	{24: 1, 2: 1, 38: 1, 14: 5, 31: 1}
Did not match all atoms present	101536-80-5	CCC1=CC(=C(C(=C1O)C(=O)NC[C@@H]2CCCN2C)OC)Cl.Cl	{1: 3, 2: 2, 33: 1, 11: 3, 12: 1, 14: 1, 17: 2, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	101544-98-3	CCCCCCCCCCCCCOC(=O)C1=C(C(=C(C=C1)C(=O)OC2CC(N(C(C2)(C)C)C)(C)C)C(=O)OCCCCCCCCCCCCC)C(=O)OC3CC(N(C(C3)(C)C)C)(C)C	{1: 12, 2: 24, 33: 2, 11: 4, 12: 2, 13: 4, 14: 2, 28: 4}
Did not match all atoms present	101544-99-4	CCCCCCCCCCCCCOC(=O)C1=C(C(=C(C=C1)C(=O)OC2CC(NC(C2)(C)C)(C)C)C(=O)OCCCCCCCCCCCCC)C(=O)OC3CC(NC(C3)(C)C)(C)C	{32: 2, 1: 10, 2: 24, 11: 4, 12: 2, 13: 4, 14: 2, 28: 4}
Did not match all atoms present	101552-39-0	CC1=CC(=CC(=C1[N+](=O)[O-])C)C#N	{1: 2, 38: 1, 37: 1, 14: 2}
Did not match all atoms present	101561-50-6	CC(=C)CSCC1=CC=CC=C1	{1: 1, 2: 2, 5: 1, 7: 1, 40: 1, 14: 5}
Did not match all atoms present	101564-54-9	CCC(C1=CC=C(C=C1)O)C(C2=CC=C(C=C2)O)C(=O)C	{1: 2, 2: 1, 3: 2, 14: 8, 21: 2, 24: 1}
Did not match all atoms present	101564-67-4	CC1CCCCN1CCCN2C(=O)C(NC2=S)(C3=CC=CC=C3)C4=CC=CC=C4.Cl	{32: 1, 1: 1, 2: 3, 33: 2, 11: 4, 12: 1, 13: 1, 14: 10, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	101564-69-6	C1CCN(CC1)CCCN2C(=O)C(NC2=S)(C3=CC=CC=C3)C4=CC=CC=C4.Cl	{32: 1, 33: 2, 2: 3, 11: 5, 13: 1, 14: 10, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	101565-05-3	CCCCCC1=CC(=CC2=C1[C@@H]3CC(=CC[C@H]3C(O2)(C)C)C)O	{1: 4, 2: 4, 11: 2, 12: 2, 13: 1, 14: 3, 15: 1, 21: 1, 23: 1}
Did not match all atoms present	10157-76-3	CCCCCCCCCCCCOS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 11, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	10159-46-3	CNP(=O)(N(C)C)N(C)C	{1: 5, 33: 2, 29: 1, 31: 1}
Did not match all atoms present	1016-05-3	C1=CC=C2C(=C1)C3=CC=CC=C3S2(=O)=O	{29: 2, 14: 8}
Did not match all atoms present	1016-09-7	COC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 3: 1, 22: 1, 14: 10}
Did not match all atoms present	1016-19-9	COC1=CC(=CC(=C1OC)OC)N=C=O	{1: 3, 34: 1, 8: 1, 14: 2, 22: 3, 29: 1}
Did not match all atoms present	1016-58-6	COC1=C(C=C(C(=C1)CO)[N+](=O)[O-])OC	{1: 2, 2: 1, 38: 1, 14: 2, 20: 1, 22: 2}
Did not match all atoms present	1016-75-7	C1=CC2=C(C=C1Cl)C(=O)NC(O2)CCCl	{32: 1, 2: 2, 12: 1, 14: 3, 17: 2, 23: 1, 25: 1}
Did not match all atoms present	1016-77-9	C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)Br	{24: 1, 18: 1, 14: 9}
Did not match all atoms present	1016-78-0	C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)Cl	{24: 1, 17: 1, 14: 9}
Did not match all atoms present	1016-94-0	CC1=CC2=NC3=CC=CC=C3N=C2C=C1	{1: 1, 35: 2, 14: 7}
Did not match all atoms present	1016-98-4	CC1=CC2=S(S1)SC(=C2)C3=CC=CC=C3	{1: 1, 41: 2, 14: 7, 15: 3}
Did not match all atoms present	101607-48-1	CC1=C2C=CC3=C(C2=NC4=C1C5=CC=CC=C5C=C4)CCCC3	{1: 1, 11: 4, 14: 8, 35: 1}
Did not match all atoms present	101607-49-2	CC1=C2C=CC3=CC=CC=C3C2=NC4=C1C=CC5=C4CCCC5	{1: 1, 11: 4, 14: 8, 35: 1}
Did not match all atoms present	10161-84-9	CCN(CC)CC[Se]P(=O)(CC)OCC	{1: 4, 2: 6, 29: 1, 22: 1, 33: 1}
Did not match all atoms present	10161-85-0	CCN(CC)CC[Se]P(=O)(OCC)OCC	{1: 4, 2: 6, 29: 1, 22: 2, 33: 1}
Did not match all atoms present	101615-77-4	CO[N+]1=CC=CC(=C1)[O-]	{1: 1, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	10163-15-2	[O-]P(=O)([O-])F.[Na+].[Na+]	{16: 1, 29: 3}
Did not match all atoms present	101646-02-0	C1=C(C=C(C(=C1[N+](=O)[O-])F)Cl)C(F)(F)F	{16: 4, 17: 1, 4: 1, 38: 1, 14: 2}
Did not match all atoms present	101646-62-2	CCC(C)C1=CC=C(C=C1)C(C)C2=CC=CC=C2	{1: 3, 2: 1, 3: 2, 14: 9}
Did not match all atoms present	101646-63-3	CCC(C)C1=CC=C(C=C1)CC2=CC=CC=C2	{1: 2, 2: 2, 3: 1, 14: 9}
Did not match all atoms present	10165-31-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3N)Br)N	{25: 2, 18: 1, 30: 2, 14: 5}
Did not match all atoms present	10165-33-0	COC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)N	{1: 1, 30: 1, 22: 1, 14: 6, 25: 2}
Did not match all atoms present	101651-36-9	CC1CCCC[NH+]1CC(=O)N(C)C(C)COC2=C(C=C(C=C2C)C)C.[Cl-]	{1: 6, 2: 2, 3: 1, 33: 1, 11: 4, 12: 1, 14: 2, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	101651-44-9	CC(=O)NC1=NC=C2C3=CC=CC=C3NC2=C1	{32: 1, 1: 1, 35: 1, 14: 6, 24: 1, 31: 1}
Did not match all atoms present	101651-55-2	CC[NH+](CC)CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2.[Cl-].[Cl-]	{1: 2, 2: 6, 14: 10, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	101651-60-9	CC[NH+](CC)CC[NH+](CC)CC(=O)NC1=CC=CC=C1Cl.[Cl-].[Cl-]	{1: 3, 2: 6, 14: 4, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	101651-61-0	CC[NH+](CC)CCSCC(=O)NC1=CC=CC=C1Cl.[Cl-]	{1: 2, 2: 5, 40: 1, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	101651-62-1	CC[NH+](CC[NH+](C)C)CC(=O)NC1=CC=CC=C1Cl.[Cl-].[Cl-]	{1: 3, 2: 4, 14: 4, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	101651-64-3	CC[NH+](CCN1CCCCC1)CC(=O)NC2=CC=CC=C2Cl.CC[NH+](CCN1CCCCC1)CC(=O)NC2=CC=CC=C2Cl.[Cl-].[Cl-]	{1: 2, 2: 8, 33: 2, 11: 10, 14: 8, 17: 4, 24: 2, 31: 2}
Did not match all atoms present	101651-65-4	C[NH+](C)CC[NH+](C)CC(=O)NC1=CC=CC=C1Cl.[Cl-].[Cl-]	{1: 3, 2: 3, 14: 4, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	101651-66-5	C[NH+](CCN1CCCCC1)CC(=O)NC2=CC=CC=C2Cl.C[NH+](CCN1CCCCC1)CC(=O)NC2=CC=CC=C2Cl.[Cl-].[Cl-]	{1: 2, 2: 6, 33: 2, 11: 10, 14: 8, 17: 4, 24: 2, 31: 2}
Did not match all atoms present	101651-69-8	CC[NH+](CC)CCSCC(=O)NC1=C(C=CC=C1Cl)Cl.[Cl-]	{1: 2, 2: 5, 40: 1, 14: 3, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	101651-73-4	CCN1C(CC(CC1(C)C)N(C2=CC=CC=C2)C(=O)C)(C)C	{1: 6, 2: 1, 33: 2, 11: 2, 12: 1, 13: 2, 14: 5, 24: 1}
Did not match all atoms present	101651-76-7	CC(=O)NC1=C(C(=C(C=C1I)I)OCCOCC(=O)[O-])I.[Na+]	{1: 1, 2: 3, 14: 1, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	101651-77-8	CC1=CC=CC=C1C(C(=O)[O-])OCCOC2=C(C=C(C(=C2I)NC(=O)C)I)I.[Na+]	{1: 2, 2: 2, 3: 1, 14: 5, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	101651-78-9	CC1=CC=C(C=C1)C(C(=O)[O-])OCCOC2=C(C=C(C(=C2I)NC(=O)C)I)I.[Na+]	{1: 2, 2: 2, 3: 1, 14: 5, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	101651-79-0	CCN(C(C)COC1=CC=CC=C1)C(=O)C(C)N2CCCCC2.[Cl-]	{1: 3, 2: 2, 3: 2, 33: 2, 11: 5, 14: 5, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	101651-88-1	C1=CC2=C(C=C1Cl)N=C3C(=O)NC(=O)N=C3N2CCC[NH+](CCO)CCO.OS(=O)(=O)[O-]	{32: 1, 33: 1, 2: 7, 35: 2, 14: 3, 17: 1, 20: 3, 25: 2, 29: 3}
Did not match all atoms present	101651-90-5	CC[NH+](CC)CC(CN1C2=C(C=C(C=C2)Cl)N=C3C1=NC(=O)NC3=O)O.OS(=O)(=O)[O-]	{32: 1, 1: 2, 2: 4, 3: 1, 33: 1, 14: 3, 17: 1, 35: 2, 20: 2, 25: 2, 29: 3}
Did not match all atoms present	101651-94-9	C[NH+](C)CCN1C2=C(C=C(C=C2)Cl)N=C3C1=NC(=O)NC3=O.OS(=O)(=O)[O-]	{32: 1, 1: 2, 2: 2, 35: 2, 33: 1, 14: 3, 17: 1, 20: 1, 25: 2, 29: 3}
Did not match all atoms present	101651-96-1	CC(CCC[NH+](C)C)N1C2=C(C=C(C=C2)Cl)N=C3C1=NC(=O)NC3=O.OS(=O)(=O)[O-]	{32: 1, 1: 3, 2: 3, 3: 1, 33: 1, 14: 3, 17: 1, 35: 2, 20: 1, 25: 2, 29: 3}
Did not match all atoms present	101651-97-2	C[NH+](C)CCCN1C2=C(C=C(C=C2)Cl)N=C3C1=NC(=O)NC3=O.[Cl-]	{32: 1, 1: 2, 2: 3, 35: 2, 33: 1, 14: 3, 17: 2, 25: 2}
Did not match all atoms present	101651-98-3	CC[NH+](CCCN1C2=C(C=C(C=C2)Cl)N=C3C1=NC(=O)NC3=O)CCO.[Cl-]	{32: 1, 1: 1, 2: 6, 35: 2, 33: 1, 14: 3, 17: 2, 20: 1, 25: 2}
Did not match all atoms present	101652-00-0	C1CC[NH+](CC1)CC(CN2C3=C(C=C(C=C3)Cl)N=C4C2=NC(=O)NC4=O)O.OS(=O)(=O)[O-]	{32: 1, 33: 1, 2: 2, 3: 1, 11: 5, 14: 3, 17: 1, 35: 2, 20: 2, 25: 2, 29: 3}
Did not match all atoms present	101652-01-1	CC[NH+](CC)CCCC(C)N1C2=CC(=C(C=C2N=C3C1=NC(=O)NC3=O)Cl)Cl.[Cl-]	{32: 1, 1: 3, 2: 5, 3: 1, 33: 1, 14: 2, 17: 3, 35: 2, 25: 2}
Did not match all atoms present	101652-02-2	C[NH+](C)CCN1C2=CC(=C(C=C2N=C3C1=NC(=O)NC3=O)Cl)Cl.OS(=O)(=O)[O-]	{32: 1, 1: 2, 2: 2, 35: 2, 33: 1, 14: 2, 17: 2, 20: 1, 25: 2, 29: 3}
Did not match all atoms present	101652-05-5	CC[NH+](CCCN1C2=C(C(=C(C=C2)Cl)Cl)N=C3C1=NC(=O)NC3=O)CCO.OS(=O)(=O)[O-]	{32: 1, 1: 1, 2: 6, 35: 2, 33: 1, 14: 2, 17: 2, 20: 2, 25: 2, 29: 3}
Did not match all atoms present	101652-07-7	C[NH+](CCCN1C2=C(C(=C(C=C2)Cl)Cl)N=C3C1=NC(=O)NC3=O)CCO.OS(=O)(=O)[O-]	{32: 1, 1: 1, 2: 5, 35: 2, 33: 1, 14: 2, 17: 2, 20: 2, 25: 2, 29: 3}
Did not match all atoms present	101652-10-2	CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3N2)CC(C(C(CO)O)O)O	{32: 2, 1: 2, 2: 2, 3: 3, 33: 1, 12: 1, 14: 2, 15: 1, 35: 1, 20: 4, 25: 2}
Did not match all atoms present	101652-11-3	C[NH+](C)CCN1C2=CC=CC=C2N=C3C1=NC(=O)NC3=O.OS(=O)(=O)[O-]	{32: 1, 1: 2, 2: 2, 35: 2, 33: 1, 14: 4, 20: 1, 25: 2, 29: 3}
Did not match all atoms present	101657-77-6	CC1=CC(=CC(=C1OC#N)C)CC2=CC(=C(C(=C2)C)OC#N)C	{1: 4, 2: 1, 22: 2, 14: 4, 37: 2}
Did not match all atoms present	101657-79-8	C1=CC(=CC=C1OC#N)SC2=CC=C(C=C2)OC#N	{40: 1, 22: 2, 14: 8, 37: 2}
Did not match all atoms present	10166-08-2	CC1=CC=CC=C1CC=O	{1: 1, 2: 1, 26: 1, 14: 4}
Did not match all atoms present	101670-51-3	CC[NH+](CC)CCSCC(=O)NC1=CC=CC=C1.[Cl-]	{1: 2, 2: 5, 40: 1, 14: 5, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	101670-78-4	C1CNCCC1C(=O)C2=CNC3=C2C=C(C=C3)OCC4=CC=CC=C4	{32: 2, 2: 1, 11: 4, 12: 1, 14: 9, 22: 1, 24: 1}
Did not match all atoms present	10168-80-6	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Er+3]	{}
Did not match all atoms present	10168-81-7	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Gd+3]	{}
Did not match all atoms present	10168-82-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ho+3]	{}
Did not match all atoms present	101688-07-7	CC(=O)C1=CC2=C(C=C1)C3=C(C=C2)OC(=C3)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 6, 23: 1}
Did not match all atoms present	10169-00-3	[NH4+].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[La+3]	{}
Did not match all atoms present	10169-02-5	C1=CC=C2/C(=N/NC3=CC(=C(C=C3)C4=C(C=C(C=C4)N/N=C\5/C6=CC=CC=C6C=CC5=O)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=O)C=CC2=C1.[Na+].[Na+]	{34: 2, 14: 18, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	10169-52-5	C1=CC=C2C(=C1)C(=C(N2)C3=C(C4=C(S3)C5=C(C=CC=C5Cl)C=C4)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+]	{32: 1, 41: 1, 14: 9, 17: 1, 22: 2, 29: 6}
Did not match all atoms present	10169-55-8	CC(=O)C1=CC=C(C=C1)SC2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 40: 1}
Did not match all atoms present	101692-44-8	CCN(CC)C1CC(C2=CC=CC=C12)C3=CC=C(C=C3)OCC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 5, 4: 1, 33: 1, 11: 1, 12: 2, 14: 8, 20: 1, 22: 1, 27: 3}
Did not match all atoms present	1017-22-7	C/C(=C/C1=CC=CC=C1)/C2=CC=CC=C2	{1: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	1017-56-7	C(NC1=NC(=NC(=N1)NCO)NCO)O	{2: 3, 35: 3, 20: 3, 31: 3}
Did not match all atoms present	10170-03-3	COC(=O)CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)CC(=O)OC)CCC(=O)OC)CC(=O)OC)CCC(=O)OC)CC(=O)OC)CCC(=O)OC)CC(=O)OC	{32: 2, 1: 8, 2: 12, 35: 2, 14: 4, 28: 8}
Did not match all atoms present	10170-69-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mn].[Mn]	{29: 10}
Did not match all atoms present	101706-04-1	CN1C2=C(C(=O)N(C1=O)C)[N-]C=N2.[Na+]	{1: 2, 35: 2, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	101708-68-3	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC6=C5C7C(O7)C(C6O)O)C=C3	{20: 2, 12: 4, 14: 10, 23: 1}
Did not match all atoms present	101711-78-8	CCC(=O)N1[C@H](COC1=O)CC2=CC=CC=C2	{1: 1, 2: 2, 33: 1, 11: 1, 12: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	101712-19-0	CCC(=O)C1=C(C(=CC=C1)F)F	{16: 2, 1: 1, 2: 1, 14: 3, 24: 1}
Did not match all atoms present	10172-39-1	COC1=C(C=C2C(=C1)CCN=C2C3=CC=CC=C3)OC	{1: 2, 35: 1, 11: 2, 14: 7, 15: 1, 22: 2}
Did not match all atoms present	10173-43-0	CCCOP(=O)(Cl)Cl	{1: 1, 2: 2, 29: 1, 22: 1, 17: 2}
Did not match all atoms present	10174-83-1	COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)C3=CC=CC=C3)C#N)OC	{1: 2, 37: 1, 33: 1, 11: 2, 12: 1, 14: 7, 22: 2, 24: 1}
Did not match all atoms present	10175-95-8	CCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].CCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].[Zn+2]	{1: 14, 2: 8, 4: 4, 14: 4, 21: 2, 22: 2, 29: 4}
Did not match all atoms present	101758-48-9	CC(=O)OC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OC(=O)C	{1: 2, 28: 2, 14: 12}
Did not match all atoms present	10176-39-3	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)OC=O)O)C)C)OC=O)O[C@H]7C[C@@H]([C@@H]([C@H](O7)C)O[C@H]8C[C@@H]([C@@H]([C@H](O8)C)OC=O)OC(=O)C)OC=O	{1: 6, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 1, 22: 3, 23: 3, 26: 4, 28: 2}
Did not match all atoms present	10177-98-7	CCCCC[SiH3]	{1: 1, 2: 4}
Did not match all atoms present	101772-33-2	CCCCCCOC1=CC=C(C=C1)C(=O)N	{1: 1, 2: 5, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	10179-73-4	[O-][Si](=O)[O-].[Fe+2]	{29: 3}
Did not match all atoms present	10179-91-6	CS(=O)(=O)C1=NC2=NC=NC=C2N1	{32: 1, 1: 1, 35: 3, 29: 2, 14: 2}
Did not match all atoms present	1018-71-9	C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=CNC=C2Cl	{32: 1, 17: 2, 38: 1, 14: 5}
Did not match all atoms present	10181-56-3	CC1(C(=S)C(C1=S)(C)C)C	{1: 4, 13: 2, 15: 2}
Did not match all atoms present	101819-99-2	CCC1=C(C=C(C(=C1Cl)O)N)Cl.Cl	{1: 1, 2: 1, 14: 1, 17: 3, 21: 1, 30: 1}
Did not match all atoms present	10182-82-8	C1=CN(C=C(C1=O)O)CC(C(=O)O)N	{33: 1, 2: 1, 3: 1, 14: 3, 21: 1, 25: 1, 27: 1, 30: 1}
Did not match all atoms present	101831-65-6	CC1CCCCN1C(=O)C2=CC3=CC=CC=C3C=C2	{1: 1, 33: 1, 11: 4, 12: 1, 14: 7, 24: 1}
Did not match all atoms present	101831-88-3	C[NH+](C)CCC1=CNC2=CC=CC=C21.C1=CC(=C(C=C1S(=O)(=O)[O-])C(=O)O)O	{32: 1, 1: 2, 2: 2, 14: 8, 21: 1, 27: 1, 29: 3}
Did not match all atoms present	101833-83-4	CC1(C2CC[C@@]1(C(=O)C2)CS(=O)(=O)[O-])C.C1CC2C3C(C[S+]2C1)N(C(=O)N3CC4=CC=CC=C4)CC5=CC=CC=C5	{1: 2, 2: 3, 33: 2, 11: 7, 12: 4, 13: 2, 14: 10, 25: 2, 29: 3}
Did not match all atoms present	101834-51-9	CC1C(OC(N1)(C(F)(F)F)C(F)(F)F)CC2=CC=CC=C2	{32: 1, 1: 1, 2: 1, 4: 2, 12: 2, 13: 1, 14: 5, 16: 6, 23: 1}
Did not match all atoms present	10187-79-8	CC(=O)NC1=NC(=NN1C)C2=CC=C(O2)[N+](=O)[O-]	{1: 2, 35: 2, 38: 1, 33: 1, 14: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	1019-15-4	C1=CC=C2C(=C1)N=C3C=CC(=CC3=[N+]2[O-])Cl	{17: 1, 35: 1, 29: 1, 14: 7, 33: 1}
Did not match all atoms present	1019-45-0	CN(C)CCC1=CNC2=C1C=C(C=C2)OC	{32: 1, 1: 3, 2: 2, 33: 1, 14: 4, 22: 1}
Did not match all atoms present	1019-52-9	C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C(=O)O	{38: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	1019-57-4	CC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 1, 6: 1, 38: 2, 14: 3, 31: 1}
Did not match all atoms present	1019-80-3	C1=CC=C(C=C1)C2=CC(=NC=C2)C(=NN)N	{34: 1, 35: 1, 30: 2, 14: 8, 7: 1}
Did not match all atoms present	10190-55-3	[O-][Mo](=O)(=O)[O-].[Pb+2]	{29: 4}
Did not match all atoms present	10190-99-5	COC1=CC=CC2=C3C(=C(C=C21)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)[O-].[Na+]	{1: 1, 38: 1, 11: 1, 14: 5, 22: 1, 23: 2, 24: 1}
Did not match all atoms present	101902-48-1	CC(=C)C(=O)OCCOP(=O)(O)O	{1: 1, 2: 2, 5: 1, 7: 1, 20: 2, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	101903-30-4	CCC(C(=O)OCCCC=C)N(CC1=CC=CO1)C(=O)N2C=CN=C2	{1: 1, 2: 5, 3: 1, 5: 1, 6: 1, 33: 2, 14: 6, 35: 1, 23: 1, 24: 1, 28: 1}
Did not match all atoms present	101904-51-2	C1=CC=C(C=C1)NC2=C(C=C3C(=C2)C(=O)C4=CC=CC=C4N3)C(=O)O	{32: 1, 25: 1, 27: 1, 14: 11, 31: 1}
Did not match all atoms present	10191-18-1	C(CO)N(CCO)CCS(=O)(=O)O	{33: 1, 2: 6, 20: 3, 29: 2}
Did not match all atoms present	101913-67-1	CCCCCCCCCCCCCCCC[NH3+].F[Sn-](F)F	{16: 3, 1: 1, 2: 15}
Did not match all atoms present	10192-29-7	N.OCl(=O)=O	{17: 1, 20: 1, 29: 2}
Did not match all atoms present	10192-30-0	[NH4+].OS(=O)[O-]	{20: 1, 29: 2}
Did not match all atoms present	10192-46-8	B(O)(O)O.B(O)(O)O.B(O)(O)O.[Zn].[Zn]	{20: 9}
Did not match all atoms present	10192-55-9	C1CCC(CC1)[Hg]Br	{18: 1, 11: 5, 12: 1}
Did not match all atoms present	10192-62-8	CC(=O)OC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OC(=O)C	{1: 4, 4: 1, 14: 8, 28: 2}
Did not match all atoms present	10192-85-5	C=CC(=O)[O-].[K+]	{24: 1, 5: 1, 6: 1}
Did not match all atoms present	10192-93-5	CCC(C)(C1=CC=CC=C1)C(C)(CC)C2=CC=CC=C2	{1: 4, 2: 2, 4: 2, 14: 10}
Did not match all atoms present	10193-30-3	O.OS(=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	10193-36-9	O[Si](O)(O)O	{20: 4}
Did not match all atoms present	10193-50-7	C1=CC(=CC(=C1)O)CC2=CC(=CC=C2)O	{2: 1, 21: 2, 14: 8}
Did not match all atoms present	101930-07-8	C1CN(C[C@@H]1O)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 3, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	101931-68-4	C1=CC=C(C=C1)CC(=O)CC(C(F)(F)F)(C(F)(F)F)O	{2: 2, 4: 3, 14: 5, 16: 6, 20: 1, 24: 1}
Did not match all atoms present	101935-40-4	C1=CC(=C(C(=C1)O)Br)[N+](=O)[O-]	{18: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	101947-16-4	CCO[Si](CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCC)OCC	{16: 17, 1: 3, 2: 5, 4: 8, 22: 3}
Did not match all atoms present	101947-30-2	FS(=S)F	{16: 2}
Did not match all atoms present	101948-72-5	C/C(=C(/C)\OC)/C1=CC=CC=C1	{1: 3, 22: 1, 14: 5, 7: 2}
Did not match all atoms present	101948-74-7	C/C(=C\C1=CC=CC=C1OC)/OC	{1: 3, 22: 2, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	101952-86-7	CC[C@H](C1=CC=C(C=C1)OP(=O)(O)O)[C@@H](CC)C2=CC=C(C=C2)OP(=O)(O)[O-].[Na+]	{1: 2, 2: 2, 3: 2, 14: 8, 20: 3, 22: 2, 29: 3}
Did not match all atoms present	101952-95-8	C=C1C(CCC1=O)C(=O)O.C1=CC(=CN=C1)C(=O)NN	{35: 1, 5: 1, 11: 2, 12: 1, 14: 4, 15: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	10196-04-0	[NH4+].[NH4+].[O-]S(=O)[O-]	{29: 3}
Did not match all atoms present	10196-13-1	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)OCCO)OC)NN=C3C=CC(=O)C=C3	{1: 2, 2: 2, 34: 3, 14: 10, 15: 1, 20: 1, 22: 2, 25: 1, 31: 1}
Did not match all atoms present	10196-67-5	CCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 24}
Did not match all atoms present	10196-69-7	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Sr+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	101968-77-8	COC1=CC=CC=C1CC(=C)OC	{1: 2, 2: 1, 5: 1, 7: 1, 14: 4, 22: 2}
Did not match all atoms present	10199-50-5	CN1C(=CC(=N1)C2=CC=CC=C2)N	{1: 1, 35: 1, 30: 1, 14: 6, 33: 1}
Did not match all atoms present	10199-68-5	C1=CC=C(C=C1)C2=CNN=C2	{32: 1, 35: 1, 14: 7}
Did not match all atoms present	10199-89-0	C1=C(C2=NON=C2C(=C1)Cl)[N+](=O)[O-]	{17: 1, 35: 2, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	101997-51-7	C1CCN(CC1)CCN(CC2=CC=CC=C2)C3=CC=CC=C3.Cl	{17: 1, 2: 3, 11: 5, 14: 10, 33: 2}
Did not match all atoms present	102-01-2	CC(=O)CC(=O)NC1=CC=CC=C1	{24: 2, 1: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	102-02-3	C1=CC=C(C=C1)N=C(N)N=C(N)N	{34: 2, 30: 3, 14: 5, 7: 2}
Did not match all atoms present	102-04-5	C1=CC=C(C=C1)CC(=O)CC2=CC=CC=C2	{24: 1, 2: 2, 14: 10}
Did not match all atoms present	102-05-6	CN(CC1=CC=CC=C1)CC2=CC=CC=C2	{1: 1, 2: 2, 14: 10, 33: 1}
Did not match all atoms present	102-06-7	C1=CC=C(C=C1)NC(=NC2=CC=CC=C2)N	{34: 1, 31: 1, 30: 1, 14: 10, 7: 1}
Did not match all atoms present	102-07-8	C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2	{24: 1, 14: 10, 31: 2}
Did not match all atoms present	102-08-9	C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2	{31: 2, 14: 10, 7: 1}
Did not match all atoms present	102-09-0	C1=CC=C(C=C1)OC(=O)OC2=CC=CC=C2	{14: 10}
Did not match all atoms present	102-11-4	CNCCN(C)CC1=CC=CC=C1	{1: 2, 2: 3, 33: 1, 14: 5, 31: 1}
Did not match all atoms present	102-13-6	CC(C)COC(=O)CC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	102-14-7	C1=CC=C(C=C1)NC(=O)CCC(=O)O	{24: 1, 2: 2, 27: 1, 14: 5, 31: 1}
Did not match all atoms present	102-16-9	C1=CC=C(C=C1)CC(=O)OCC2=CC=CC=C2	{2: 2, 28: 1, 14: 10}
Did not match all atoms present	102-17-0	COC1=CC=C(C=C1)COC(=O)CC2=CC=CC=C2	{1: 1, 2: 2, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	102-18-1	CN(CCN(C)CC1=CC=CC=C1)CC2=CC=CC=C2	{1: 2, 2: 4, 14: 10, 33: 2}
Did not match all atoms present	102-19-2	CC(C)CCOC(=O)CC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	102-20-5	C1=CC=C(C=C1)CCOC(=O)CC2=CC=CC=C2	{2: 3, 28: 1, 14: 10}
Did not match all atoms present	102-22-7	CC(=CCCC(=CCOC(=O)CC1=CC=CC=C1)C)C	{1: 3, 2: 4, 6: 2, 7: 2, 14: 5, 28: 1}
Did not match all atoms present	102-24-9	B1(OB(OB(O1)OC)OC)OC	{1: 3, 22: 3, 23: 3}
Did not match all atoms present	102-25-0	CCC1=CC(=CC(=C1)CC)CC	{1: 3, 2: 3, 14: 3}
Did not match all atoms present	102-27-2	CCNC1=CC=CC(=C1)C	{1: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	102-28-3	CC(=O)NC1=CC=CC(=C1)N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	102-29-4	CC(=O)OC1=CC=CC(=C1)O	{1: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	102-30-7	CCCCCCCCCCCC[N+](C)(C)CC1=CC(=C(C=C1)Cl)Cl.[Cl-]	{1: 3, 2: 12, 14: 3, 17: 3}
Did not match all atoms present	102-32-9	C1=CC(=C(C=C1CC(=O)O)O)O	{2: 1, 27: 1, 21: 2, 14: 3}
Did not match all atoms present	102-33-0	CC(=O)NC1=CC(=C(C=C1)O)N	{1: 1, 14: 3, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	102-36-3	C1=CC(=C(C=C1N=C=O)Cl)Cl	{8: 1, 17: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	102-41-0	CC1=CC(=CC=C1)NCCO	{1: 1, 2: 2, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	102-42-1	CC1=CC(=CC=C1)NCS(=O)(=O)O	{1: 1, 2: 1, 14: 4, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	102-46-5	CC1=C(C=C(C=C1)CCl)C	{1: 2, 2: 1, 14: 3, 17: 1}
Did not match all atoms present	102-47-6	C1=CC(=C(C=C1CCl)Cl)Cl	{17: 3, 2: 1, 14: 3}
Did not match all atoms present	102-48-7	CC1=C(C=C(C=C1)CN)C	{1: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	102-49-8	C1=CC(=C(C=C1CN)Cl)Cl	{17: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	102-50-1	CC1=C(C=CC(=C1)OC)N	{1: 2, 30: 1, 22: 1, 14: 3}
Did not match all atoms present	102-51-2	COC1=CC(=C(C=C1)N)N	{1: 1, 30: 2, 22: 1, 14: 3}
Did not match all atoms present	102-54-5	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Fe+2]	{14: 10}
Did not match all atoms present	102-56-7	COC1=CC(=C(C=C1)OC)N	{1: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	102-63-6	CC1=CC(=C(C=C1)N=NC2=CC(=C(C=C2)N)C)C	{1: 3, 34: 2, 30: 1, 14: 6}
Did not match all atoms present	102-67-0	CCC[Al](CCC)CCC	{1: 3, 2: 6}
Did not match all atoms present	102-72-7	CCCCCCCCCC(CCCCCCCC(=O)O)OS(=O)(=O)O	{1: 1, 2: 15, 3: 1, 20: 1, 22: 1, 27: 1, 29: 2}
Did not match all atoms present	102-77-2	C1COCCN1SC2=NC3=CC=CC=C3S2	{33: 1, 35: 1, 40: 1, 41: 1, 11: 4, 14: 4, 23: 1}
Did not match all atoms present	102-78-3	CC1CN(CC(O1)C)SC2=NC3=CC=CC=C3S2	{1: 2, 35: 1, 33: 1, 40: 1, 41: 1, 11: 2, 12: 2, 14: 4, 23: 1}
Did not match all atoms present	102-84-1	C=CCOP(OCC=C)OCC=C	{2: 3, 22: 3, 5: 3, 6: 3}
Did not match all atoms present	102-85-2	CCCCOP(OCCCC)OCCCC	{1: 3, 2: 9, 22: 3}
Did not match all atoms present	102-92-1	C1=CC=C(C=C1)/C=C/C(=O)Cl	{24: 1, 17: 1, 14: 5, 6: 2}
Did not match all atoms present	102-96-5	C1=CC=C(C=C1)/C=C/[N+](=O)[O-]	{38: 1, 14: 5, 6: 2}
Did not match all atoms present	102-97-6	CC(C)NCC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	102-98-7	B(O)(O)O[Hg]C1=CC=CC=C1	{20: 2, 22: 1, 14: 5}
Did not match all atoms present	1020-14-0	CCCC(C)C1=CC=C(C=C1)C(C)CCC	{1: 4, 2: 4, 3: 2, 14: 4}
Did not match all atoms present	1020-31-1	CC(C)(C)C1=CC(=C(C(=C1)O)O)C(C)(C)C	{1: 6, 4: 2, 21: 2, 14: 2}
Did not match all atoms present	1020-33-3	CC1=CC(=C(C=C1S(=O)(=O)N)S(=O)(=O)N)N	{1: 1, 30: 3, 29: 4, 14: 2}
Did not match all atoms present	1020-54-8	CCOC1=CC=C(C=C1)NC2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	1020-84-4	C[Si]1(N[Si](N[Si](N[Si](N1)(C)C)(C)C)(C)C)C	{32: 4, 1: 8}
Did not match all atoms present	1020-87-7	CC(C)(C)CC1=CC=C(C=C1)CC(C)(C)C	{1: 6, 2: 2, 4: 2, 14: 4}
Did not match all atoms present	10200-25-6	C1CC(N(C1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)O	{33: 1, 38: 2, 11: 3, 12: 1, 14: 3, 27: 1}
Did not match all atoms present	10200-59-6	C1=CSC(=N1)C=O	{41: 1, 26: 1, 35: 1, 14: 2}
Did not match all atoms present	10201-29-3	C1=C(C=C(C(=C1[N+](=O)[O-])NC2=NC(=NC(=N2)NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])NC4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{35: 3, 38: 9, 14: 6, 31: 3}
Did not match all atoms present	102029-44-7	C1[C@H](NC(=O)O1)CC2=CC=CC=C2	{32: 1, 2: 1, 11: 1, 12: 1, 14: 5, 28: 1}
Did not match all atoms present	10203-08-4	C1=C(C=C(C=C1Cl)Cl)C=O	{17: 2, 26: 1, 14: 3}
Did not match all atoms present	10203-45-9	CC1=C(C(=C(C(=C1Cl)C)Cl)Cl)C	{1: 3, 17: 3}
Did not match all atoms present	102030-00-2	CCCCC(CC)CC(C(C)(C)C(C(C)C)O)O.C1=CC=C2C(=C1)C(=O)OC2=O.C(COCCO)O	{1: 6, 2: 9, 3: 4, 4: 1, 14: 4, 20: 4, 22: 1, 28: 2}
Did not match all atoms present	10205-62-6	CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N(C)C	{1: 3, 35: 1, 41: 1, 14: 7, 33: 1}
Did not match all atoms present	102056-64-4	CCO[Si](CCCC1CCCC1)(OCC)OCC	{1: 3, 2: 6, 11: 4, 12: 1, 22: 3}
Did not match all atoms present	102070-37-1	C1=CC=C(C=C1)SCC=C(SC2=CC=CC=C2)SC3=CC=CC=C3	{40: 3, 2: 1, 14: 15, 6: 1, 7: 1}
Did not match all atoms present	102071-30-7	C1CCNC(C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)Cl)O.Cl	{32: 1, 4: 1, 11: 4, 12: 1, 14: 9, 17: 2, 20: 1}
Did not match all atoms present	102071-76-1	CCCCNC(C)(C)COC(=O)C1=CC=CC=C1.Cl	{1: 3, 2: 4, 4: 1, 14: 5, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	102071-88-5	C1COCCN1C(=O)CCNCC2COC3=CC=CC=C3O2	{33: 1, 2: 3, 11: 5, 12: 1, 14: 4, 23: 3, 24: 1, 31: 1}
Did not match all atoms present	102082-89-3	C1=CC(=C(C(=C1)F)/C=C/C(=O)O)F	{16: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	1021-11-0	C1=CC=C(C=C1)OCCCN=C(N)N.C1=CC=C(C=C1)OCCCN=C(N)N.OS(=O)(=O)O	{2: 6, 7: 2, 34: 2, 14: 10, 20: 2, 22: 2, 29: 2, 30: 4}
Did not match all atoms present	1021-25-6	C1CNCCC12C(=O)NCN2C3=CC=CC=C3	{32: 2, 33: 1, 11: 5, 13: 1, 14: 5, 25: 1}
Did not match all atoms present	10210-64-7	[Be+2].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	102101-03-1	C[Si](C)(C)N1C=NN(C=N1)[Si](C)(C)C	{1: 6, 35: 2, 14: 2, 33: 2}
Did not match all atoms present	102107-61-9	C1=CC(=C(C=C1[As]=O)[N+](=O)[O-])O	{38: 1, 21: 1, 14: 3, 29: 1}
Did not match all atoms present	10211-84-4	C1=CC=C(C=C1)CN2C=NC(=C3C2=NC=N3)N.Cl	{33: 1, 2: 1, 35: 3, 14: 7, 17: 1, 30: 1}
Did not match all atoms present	10212-25-6	C1=CN2[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)OC2=NC1=N.Cl	{33: 1, 2: 1, 35: 1, 36: 1, 12: 4, 14: 2, 17: 1, 20: 2, 23: 2}
Did not match all atoms present	102121-60-8	CC1(CCC(C2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)(C)C)C	{1: 4, 11: 2, 13: 2, 14: 7, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	102128-78-9	CNC(=O)CCNCC1COC2=CC=CC=C2O1	{1: 1, 2: 3, 11: 1, 12: 1, 14: 4, 23: 2, 24: 1, 31: 2}
Did not match all atoms present	102128-91-6	CCN(CC)CCC(=O)N(CC)C(C)COC1=CC=CC=C1.Cl	{1: 4, 2: 6, 3: 1, 33: 2, 14: 5, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	102128-92-7	CCN(CC)CCC(=O)N(C)C(C)COC1=CC=CC=C1.Cl	{1: 4, 2: 5, 3: 1, 33: 2, 14: 5, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	102129-02-2	CCN(CC)CCN(C)C(C)C(=O)NC1=CC=CC=C1Cl.Cl.Cl	{1: 4, 2: 4, 3: 1, 33: 2, 14: 4, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	102129-03-3	CC(C(=O)NC1=CC=CC=C1Cl)N(C)CCN2CCCC2.Cl	{1: 2, 2: 2, 3: 1, 33: 2, 11: 4, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102129-21-5	CCN(CC)CCC1=NN(C(C1)C2=CC=CO2)C3=CC=CC=C3.Cl	{1: 2, 2: 4, 35: 1, 33: 2, 11: 1, 12: 1, 14: 8, 15: 1, 17: 1, 23: 1}
Did not match all atoms present	102129-33-9	CC1=CC=C(O1)C2CC(=NN2C3=CC=CC=C3)CCN4CCCCC4.Cl	{1: 1, 2: 2, 35: 1, 33: 2, 11: 6, 12: 1, 14: 7, 15: 1, 17: 1, 23: 1}
Did not match all atoms present	10213-09-9	O=[V].Cl.Cl	{17: 2, 29: 1}
Did not match all atoms present	10213-10-2	O.O.[O-][W](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	10213-94-2	CCCCN1C2=C(C=C(C=C2)Cl)C(=O)N1	{32: 1, 1: 1, 2: 3, 33: 1, 14: 3, 17: 1, 25: 1}
Did not match all atoms present	10214-07-0	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=CC(=C(C=C3Cl)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 2: 2, 33: 1, 34: 2, 14: 11, 17: 2, 29: 3}
Did not match all atoms present	10214-40-1	O=[Se]([O-])[O-].[Cu+2]	{29: 3}
Did not match all atoms present	10215-25-5	C1C2=C(C=C(C=C2)N)S(=O)(=O)C3=C1C=CC(=C3)N	{30: 2, 11: 1, 29: 2, 14: 6}
Did not match all atoms present	10217-34-2	CCO[Si](CCC1CCC2C(C1)O2)(OCC)OCC	{1: 3, 2: 5, 11: 3, 12: 3, 22: 3, 23: 1}
Did not match all atoms present	102170-56-9	CC1=CC(=CC(=C1N)Br)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	102187-19-9	CCN(CC)C1=CC(=C(C=C1)N=C2C=C(C(=O)C3=CC=CC=C32)C(=O)NC4=CC=CC=C4)C	{1: 3, 2: 2, 33: 1, 34: 1, 14: 13, 15: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	10219-31-5	CC1=CC=C(C=C1)NC(C)(C)C	{1: 4, 4: 1, 14: 4, 31: 1}
Did not match all atoms present	102191-92-4	CC(C)(C)[Si](C)(C)OCC=O	{1: 5, 2: 1, 4: 1, 26: 1, 22: 1}
Did not match all atoms present	1022-07-7	CNC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 2, 31: 1}
Did not match all atoms present	1022-13-5	CNC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 31: 1, 14: 8, 17: 1}
Did not match all atoms present	1022-22-6	C1=CC(=CC=C1C(=CCl)C2=CC=C(C=C2)Cl)Cl	{17: 3, 14: 8, 6: 1, 7: 1}
Did not match all atoms present	1022-46-4	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)O2	{35: 1, 28: 1, 14: 9}
Did not match all atoms present	10220-34-5	CC(C)NSC1=NC2=CC=CC=C2S1	{1: 2, 3: 1, 40: 1, 41: 1, 14: 4, 35: 1, 31: 1}
Did not match all atoms present	102206-89-3	CC1=CC2=C(C=C1)C3=CN=C(C=C3N2)N	{32: 1, 1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	102206-93-9	CCN(CC)C1=NC=C2C3=CC=CC=C3NC2=C1	{32: 1, 1: 2, 2: 2, 35: 1, 33: 1, 14: 6}
Did not match all atoms present	102206-99-5	CCNC1=NC=C2C3=CC=CC=C3NC2=C1	{32: 1, 1: 1, 2: 1, 35: 1, 14: 6, 31: 1}
Did not match all atoms present	102207-73-8	CCCCN(CCCC)CCOC1=NC(=NC=C1)N	{1: 2, 2: 8, 35: 2, 33: 1, 14: 2, 22: 1, 30: 1}
Did not match all atoms present	102207-75-0	CCN(CC)CCOC1=NC(=NC=C1)N	{1: 2, 2: 4, 35: 2, 33: 1, 14: 2, 22: 1, 30: 1}
Did not match all atoms present	102207-76-1	CC(C)CN(CCOC1=NC(=NC=C1)N)CC(C)C	{1: 4, 2: 4, 3: 2, 33: 1, 14: 2, 35: 2, 22: 1, 30: 1}
Did not match all atoms present	102207-77-2	CN(C)CCOC1=NC(=NC=C1)N	{1: 2, 2: 2, 35: 2, 33: 1, 14: 2, 22: 1, 30: 1}
Did not match all atoms present	102207-84-1	CC[NH+](CC)CCOCC(=O)NC1=C(C=CC=C1C)C.[Cl-]	{1: 4, 2: 5, 14: 3, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	102207-85-2	CC[NH+](CC)CCN(CC(=O)NC1=C(C=CC=C1C)C)C(=O)C.[Cl-]	{1: 5, 2: 5, 33: 1, 14: 3, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	102207-86-3	CCOCC[NH2+]CC(=O)NC1=C(C=CC=C1C)C.[Cl-]	{1: 3, 2: 4, 14: 3, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	10222-95-4	CC1=CC(=C(C=C1C)C(C)C)C	{1: 5, 3: 1, 14: 2}
Did not match all atoms present	102232-11-1	CCN(CC1CCCO1)C2=CC3=C(C=C2)C4(C5=CC=CC=C5C(=O)O4)C6=CC(=C(C=C6O3)C)NC7=CC=CC=C7	{1: 2, 2: 2, 33: 1, 11: 3, 12: 1, 13: 1, 14: 14, 23: 2, 28: 1, 31: 1}
Did not match all atoms present	102236-24-8	CCOC1=C(C=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	10224-14-3	C1C(C1(C#N)C2=CC=CC=C2)C3=CC=CC=C3	{11: 1, 12: 1, 13: 1, 14: 10, 37: 1}
Did not match all atoms present	102259-67-6	CCN(CC)CCCC(C)NC1=CC(=C2C(=C1OC)C(=CC(=N2)C)OC)OC.C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O	{1: 7, 2: 5, 3: 1, 33: 1, 14: 8, 35: 1, 20: 2, 22: 3, 29: 4, 31: 1}
Did not match all atoms present	102262-34-0	[NH4+].[O-]S(=O)(=O)[O-].[Ag+]	{29: 4}
Did not match all atoms present	102272-33-3	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)[O-])C)C6=CC=C(C=C6)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 4, 35: 2, 33: 2, 12: 2, 14: 16, 15: 2, 24: 1, 25: 2, 29: 6, 31: 1}
Did not match all atoms present	102280-81-9	CC1=NCCC1(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 35: 1, 11: 2, 13: 1, 14: 10, 15: 1}
Did not match all atoms present	102280-93-3	CC1=CC=C(C=C1)NS(=O)(=O)N([Hg]C)[Hg]C	{1: 3, 33: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	1023-85-4	CN1CN(C2(C1=O)CCNCC2)C3=CC=CC=C3.Cl	{32: 1, 1: 1, 33: 2, 11: 5, 13: 1, 14: 5, 17: 1, 25: 1}
Did not match all atoms present	10230-34-9	C1=CC=C2C(=C1)OC3=C(S2)C=C(C=C3)Cl	{17: 1, 41: 1, 14: 7, 23: 1}
Did not match all atoms present	10230-61-2	CC1=CC(=C(C=C1C)CS)CS	{1: 2, 2: 2, 14: 2, 39: 2}
Did not match all atoms present	10230-69-0	CC(=O)CSCC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 14: 5, 40: 1}
Did not match all atoms present	10232-86-7	CCCCCCCCCCCC[N+](C)(C)CC(C[N+](C)(C)CCCCCCCCCCCC)O.[Br-].[Br-]	{1: 6, 2: 24, 3: 1, 20: 1, 18: 2}
Did not match all atoms present	10234-40-9	C1=CC=C(C(=C1)OCCO)OCCO	{2: 4, 20: 2, 22: 2, 14: 4}
Did not match all atoms present	102340-92-1	C(=O)(N)N.[O-]Cl(=O)=O.[Na+]	{24: 1, 17: 1, 29: 3, 30: 2}
Did not match all atoms present	10235-09-3	C(CCl)OP(=S)(OCCCl)OCCCl	{17: 3, 2: 6, 22: 3}
Did not match all atoms present	10236-14-3	CCOC(=O)/C=C/CP(=O)(OCC)OCC	{1: 3, 2: 4, 6: 2, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	10236-47-2	CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O	{1: 1, 2: 1, 11: 1, 12: 11, 14: 6, 20: 6, 21: 2, 22: 2, 23: 3, 25: 1}
Did not match all atoms present	102366-79-0	C1NC2=C(N1)N=CN=C2NCC3=CC=CC=C3	{32: 2, 2: 1, 35: 2, 11: 1, 14: 6, 31: 1}
Did not match all atoms present	102367-57-7	CC(C)CN(CC(C)C)CC(CC1=NC2=C(N1)C(=O)N(C(=O)N2C)C)OC(=O)C3=CC=CC=C3	{32: 1, 1: 6, 2: 4, 3: 3, 33: 3, 14: 5, 35: 1, 25: 2, 28: 1}
Did not match all atoms present	10238-21-8	COC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3	{1: 1, 2: 2, 11: 5, 12: 1, 14: 7, 17: 1, 22: 1, 24: 2, 29: 2, 31: 3}
Did not match all atoms present	10238-71-8	CC[N+](CC)(CC)CC[N+](CC)(CC)CC	{1: 6, 2: 8}
Did not match all atoms present	102387-48-4	CCN(CC)C1=CC(=C(C=C1)NC2=CC(=NC(=O)C)C(=O)C(=C2C)Cl)C	{1: 5, 2: 2, 33: 1, 34: 1, 14: 4, 15: 4, 17: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	102395-72-2	C1=CC(=C(C=C1Cl)Cl)NC(=O)C2=CC(=C(C(=C2)Cl)O)C(=O)NC3=C(C=C(C=C3)Cl)Cl	{24: 2, 17: 5, 21: 1, 14: 8, 31: 2}
Did not match all atoms present	102395-95-9	CC1=CC=C(C=C1)[As]=O	{1: 1, 29: 1, 14: 4}
Did not match all atoms present	1024-34-6	CCCCOP(=O)(C1=CC=CC=C1)OCCCC	{1: 2, 2: 6, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	1024-47-1	C[Si](C)(C)C1=CC=C(C2=CC=CC=C21)[Si](C)(C)C	{1: 6, 14: 6}
Did not match all atoms present	1024-58-4	C[Si](C)(C)NC(=O)N(C1=CC=CC=C1)[Si](C)(C)C	{24: 1, 1: 6, 33: 1, 14: 5, 31: 1}
Did not match all atoms present	1024-65-3	CC(C)CCN1C(=O)C2=C(N=CN2C)N(C1=O)C	{1: 4, 2: 2, 3: 1, 33: 3, 14: 1, 35: 1, 25: 2}
Did not match all atoms present	10240-08-1	CC1=CC=C(C2=CC=CC=C12)O	{1: 1, 21: 1, 14: 6}
Did not match all atoms present	102408-25-3	CN1C(NC2=C1C3=C(C=C2)N=CC=C3)N	{32: 1, 1: 1, 35: 1, 33: 1, 12: 1, 14: 5, 30: 1}
Did not match all atoms present	102408-31-1	C1=CC=C2C=C3C(=CC2=C1)NC(=N3)N	{32: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	10241-04-0	Cl[Co](Cl)Cl	{17: 3}
Did not match all atoms present	10241-05-1	Cl[Mo](Cl)(Cl)(Cl)Cl	{17: 5}
Did not match all atoms present	102419-73-8	CC1C(OC2=CC=CC3=C2C1=C[N-]3)C(=O)OS.[Na+]	{1: 1, 35: 1, 39: 1, 12: 2, 14: 4, 23: 1, 28: 1}
Did not match all atoms present	10242-13-4	CC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)O	{1: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	102420-56-4	C1=CC=C2C(=C1)C3=CC4=CC=CC5=C4C6=C(C=C5)[C@H]([C@@H](C2=C36)O)O	{20: 2, 12: 2, 14: 10, 15: 1}
Did not match all atoms present	102424-22-6	CCCC(C)CC(C)CC(C)CC1=CC=C(C=C1)S(=O)(=O)O.C1COCCN1.C(COCCO)O.N	{32: 1, 1: 4, 2: 9, 3: 3, 11: 4, 14: 4, 20: 3, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	102424-23-7	C1COCCN1.C(COCCO)O.N.O=S=O	{32: 1, 2: 4, 40: 1, 11: 4, 20: 2, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	102433-74-9	CN(C)C(=O)N(C1=CC(=C(C=C1)OC)Cl)N=O	{1: 3, 34: 1, 33: 2, 14: 3, 17: 1, 22: 1, 24: 1, 29: 1}
Did not match all atoms present	102433-83-0	C1=CC=C(C=C1)OCCN(CCOC2=CC=CC=C2)CCBr.Br	{33: 1, 2: 6, 22: 2, 18: 2, 14: 10}
Did not match all atoms present	10247-90-2	CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[Cl-]	{1: 4, 2: 24, 17: 1}
Did not match all atoms present	10248-55-2	CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)[O-])C	{1: 4, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 24: 1}
Did not match all atoms present	10248-58-5	O1P2OP3OP1OP(O2)O3	{23: 6}
Did not match all atoms present	102488-47-1	C[Si](C)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cl	{16: 13, 1: 2, 2: 2, 4: 6, 17: 1}
Did not match all atoms present	102489-45-2	CC[NH+](CC)CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2Cl)C.[Cl-].[Cl-]	{1: 3, 2: 6, 14: 8, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	102489-46-3	CC[NH+](CC)CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2C.[Cl-].[Cl-]	{1: 3, 2: 6, 14: 9, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-47-4	CCCCN(CC[NH+](CC)CC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 4, 2: 8, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-48-5	CC[NH+](CC)CCOCC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 3, 2: 5, 14: 3, 17: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	102489-49-6	CC[NH+](CC)CCNCC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 3, 2: 5, 14: 3, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	102489-50-9	CC[NH+](CC)CCN(CC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 4, 2: 6, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-51-0	CC[NH+](CC)CCN(CC(=O)NC1=C(C=CC=C1Cl)C)C(C)C.[Cl-]	{1: 5, 2: 5, 3: 1, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-52-1	CC[NH+](CC)CCN(C)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 4, 2: 5, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-53-2	CCCCCCCCN(CC[NH+](CC)CC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 4, 2: 12, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-54-3	CC[NH+](CC)CCN(CCOC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2Cl)C.[Cl-]	{1: 3, 2: 7, 33: 1, 14: 8, 17: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	102489-55-4	CCCN(CC[NH+](CC)CC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 4, 2: 7, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-56-5	CC[NH+](CC)CCSCC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 3, 2: 5, 40: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-58-7	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]CC2=CC=CO2.[Cl-]	{1: 1, 2: 2, 14: 6, 17: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	102489-59-8	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]CC(C)C.[Cl-]	{1: 3, 2: 2, 3: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102489-61-2	CC[NH+](CC)CCSCC(=O)NC1=CC=CC=C1C.[Cl-]	{1: 3, 2: 5, 40: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	102489-70-3	C1CC2CC1C3C2[Se]C(C3(F)F)(F)F	{16: 4, 11: 3, 12: 4, 13: 2}
Did not match all atoms present	102492-24-0	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[NH4+].[Ag+]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	1025-36-1	C1=CC=C(C=C1)N2C(=O)N(C2=O)C3=CC=CC=C3	{25: 2, 14: 10, 33: 2}
Did not match all atoms present	10250-60-9	CC1=CC(=NN1C)C2=CC=CC=C2	{1: 2, 35: 1, 14: 6, 33: 1}
Did not match all atoms present	102504-44-9	CCC1=CC=CC=C1NC(=O)C(C)NCC(CC)OC	{1: 4, 2: 3, 3: 2, 14: 4, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	102504-45-0	CCC1=CC=CC=C1NC(=O)C(C)NCCOC.Cl	{1: 3, 2: 3, 3: 1, 14: 4, 17: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	102504-51-8	CC(COCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I)C(=O)[O-].[Na+]	{1: 2, 2: 3, 3: 1, 14: 1, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	102504-52-9	CC(C(=O)[O-])OCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I.[Na+]	{1: 2, 2: 2, 3: 1, 14: 1, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	102504-64-3	CC1CCCC(N1CCC(=O)NC2=C(C=CC=C2Cl)C)C.Cl	{1: 3, 2: 2, 33: 1, 11: 3, 12: 2, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	102504-65-4	CC1=C(C(=CC=C1)Cl)NC(=O)C(C)NC.Cl	{1: 3, 3: 1, 14: 3, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	102504-71-2	CN(C)C1=CC=C(C=C1)C(=O)CCN2CCC(=CC2)C3=CC=CC=C3	{1: 2, 2: 2, 33: 2, 11: 3, 14: 10, 15: 1, 24: 1}
Did not match all atoms present	10251-17-9	CCCCCCCC(=O)OC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 6, 28: 1, 14: 7}
Did not match all atoms present	102516-61-0	C1=CC=C(C=C1)[As](C2=CC(=C(C=C2)O)N)SCC(C(=O)O)N	{2: 1, 3: 1, 40: 1, 14: 8, 21: 1, 27: 1, 30: 2}
Did not match all atoms present	102516-65-4	CC1=CC=C(C=C1)S(=O)(=O)N(C(CC2=CC=CC=C2)C(=O)O)C(=O)CCl	{1: 1, 2: 2, 3: 1, 33: 1, 14: 9, 17: 1, 24: 1, 27: 1, 29: 2}
Did not match all atoms present	102517-11-3	CC(=CCC/C(=C/CC/C(=C/CN1CCN(CC1)CC2=CC3=C(C=C2)OCO3)/C)/C)C.CS(=O)(=O)O	{1: 5, 2: 6, 33: 2, 6: 3, 7: 3, 11: 5, 14: 3, 20: 1, 23: 2, 29: 2}
Did not match all atoms present	10253-83-5	C1=CC=C(C=C1)NC2=NNC(=S)S2	{32: 1, 41: 1, 35: 1, 14: 5, 31: 1}
Did not match all atoms present	10254-86-1	CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)N.Cl	{1: 3, 4: 1, 14: 8, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	102561-41-1	CCC1=C(C(=CC=C1)C(C)C)N=C=O	{1: 3, 2: 1, 3: 1, 8: 1, 34: 1, 14: 3, 29: 1}
Did not match all atoms present	102561-43-3	CC1=C(C(=CC=C1)C(C)C)N=C=O	{1: 3, 34: 1, 3: 1, 8: 1, 14: 3, 29: 1}
Did not match all atoms present	102561-47-7	CCCCOC(=O)C1=CC=C(C=C1)N=C=O	{1: 1, 2: 3, 8: 1, 34: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	102567-20-4	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C[C@@H]([C@H]4O)O)C=C32	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	10257-55-3	O=S([O-])[O-].[Ca+2]	{29: 3}
Did not match all atoms present	10257-92-8	CC1=C(NC2=CC=CC=C12)C3=CC=CC=C3	{32: 1, 1: 1, 14: 9}
Did not match all atoms present	102571-36-8	CC[N+](C)(C)CC(C)OC12CC3CC(C1)CC(C3)C2.[I-]	{1: 4, 2: 2, 3: 1, 11: 6, 12: 3, 13: 1, 19: 1, 22: 1}
Did not match all atoms present	102577-46-8	CC(C)(C)C1=C(C(=CC(=C1)CCC(=O)OC)N2N=C3C=CC=CC3=N2)O	{1: 4, 2: 2, 35: 2, 4: 1, 33: 1, 14: 6, 21: 1, 28: 1}
Did not match all atoms present	102579-72-6	C1[C@@H](C=C[C@@H]1[NH3+])C(=O)[O-]	{24: 1, 11: 1, 12: 2, 14: 2}
Did not match all atoms present	10258-86-3	CS(=O)C=C	{1: 1, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	102584-01-0	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=C(C=C(C=C4)NC5=CC=[N+](C=C5)CC)N.[Br-].[Br-]	{1: 2, 2: 2, 6: 2, 33: 2, 14: 19, 18: 2, 24: 2, 30: 1, 31: 4}
Did not match all atoms present	102584-14-5	C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=CC(=C4)C(=O)NC5=C[N+](=CC=C5)C.[I-].[I-]	{1: 2, 33: 2, 14: 20, 19: 2, 24: 4, 31: 4}
Did not match all atoms present	102584-42-9	CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCCN3CCCC3	{1: 1, 2: 2, 4: 1, 33: 1, 11: 4, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	102584-57-6	CC(CC(C1=CC=CC=C1)(C2=CC=CC=C2)O)N3CCCC3.Cl	{1: 1, 2: 1, 3: 1, 4: 1, 33: 1, 11: 4, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	102584-86-1	C1CN1NC(=O)NCC2=CC=C(C=C2)CNC(=O)NN3CC3	{33: 2, 2: 2, 11: 4, 14: 4, 24: 2, 31: 4}
Did not match all atoms present	102584-89-4	CCCC(C(=O)[O-])OCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I.[Na+]	{1: 2, 2: 4, 3: 1, 14: 1, 19: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	102584-97-4	CCCC(C(=O)NC1=C(C=CC=C1Cl)C)NCC.Cl	{1: 3, 2: 3, 3: 1, 14: 3, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	102585-37-5	CCC(C)[NH2+]CC(=O)N(C)C(C)COC1=C(C=C(C=C1)C)C.[Cl-]	{1: 6, 2: 3, 3: 2, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	102585-38-6	CCCC[NH2+]CC(=O)NC(C)COC1=CC=CC=C1.[Cl-]	{1: 2, 2: 5, 3: 1, 14: 5, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	102585-42-2	CC[NH+](CC)CC(=O)N(CC)C(C)COC1=CC=CC=C1Cl.[Cl-]	{1: 4, 2: 5, 3: 1, 33: 1, 14: 4, 17: 2, 22: 1, 24: 1}
Did not match all atoms present	102585-43-3	CC[NH+](CC)CC(=O)N(C)C(C)COC1=CC=CC=C1Cl.[Cl-]	{1: 4, 2: 4, 3: 1, 33: 1, 14: 4, 17: 2, 22: 1, 24: 1}
Did not match all atoms present	102585-52-4	CCN(C1=C(C(=C(C=C1I)I)OCCOC(C2=CC=CC=C2)C(=O)[O-])I)C(=O)C.[Na+]	{1: 2, 2: 3, 3: 1, 33: 1, 14: 6, 19: 3, 22: 2, 24: 2}
Did not match all atoms present	102585-53-5	CCN(C1=C(C(=C(C=C1I)I)OCCOCC(=O)[O-])I)C(=O)C.[Na+]	{1: 2, 2: 4, 33: 1, 14: 1, 19: 3, 22: 2, 24: 2}
Did not match all atoms present	102585-59-1	CC(=O)N(C)C1=C(C(=C(C=C1I)I)OCCOC(C2=CC=CC=C2)C(=O)[O-])I.[Na+]	{1: 2, 2: 2, 3: 1, 33: 1, 14: 6, 19: 3, 22: 2, 24: 2}
Did not match all atoms present	102585-60-4	CC(=O)N(C)C1=C(C(=C(C=C1I)I)OCCOCC(=O)[O-])I.[Na+]	{1: 2, 2: 3, 33: 1, 14: 1, 19: 3, 22: 2, 24: 2}
Did not match all atoms present	102585-62-6	C1=CC=C(C(=C1)O[Sb])SCC(=O)[O-].C(CO)[NH2+]CCO.O.O	{2: 5, 40: 1, 14: 4, 20: 2, 22: 1, 24: 1}
Did not match all atoms present	10259-22-0	CCOC(=O)C1=CC(=CC=C1)OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	102593-74-8	C=CCC1=C(C(=CC(=C1O)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)O	{2: 1, 5: 1, 6: 1, 14: 11, 21: 2, 24: 2}
Did not match all atoms present	1026-04-6	C1=CC=C2C(=C1)C(=O)NC(=C3C=CC=CC3=O)N2	{32: 2, 25: 2, 14: 8, 15: 2}
Did not match all atoms present	1026-32-0	CCOC(=O)COC1=CC(=C(C=C1C(=O)C)Cl)C	{1: 3, 2: 2, 14: 2, 17: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	1026-92-2	C=CCOC(=O)C1=CC=C(C=C1)C(=O)OCC=C	{2: 2, 14: 4, 28: 2, 5: 2, 6: 2}
Did not match all atoms present	102612-93-1	C1CCC(CC1)NCCN2C(SCC2=O)C3=CC4=C(C=C3)OCO4.Cl	{33: 1, 2: 2, 41: 1, 11: 7, 12: 2, 14: 3, 17: 1, 23: 2, 25: 1, 31: 1}
Did not match all atoms present	102612-94-2	CC(C)CNCCCN1C(SCC1=O)C2=CC3=C(C=C2)OCO3.Cl	{1: 2, 2: 4, 3: 1, 33: 1, 41: 1, 11: 2, 12: 1, 14: 3, 17: 1, 23: 2, 25: 1, 31: 1}
Did not match all atoms present	102616-55-7	CCOC(=O)CC(C(=O)OCC)S(=O)(=O)[O-].C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CO)O.C(COCCO)O.[Na+]	{1: 2, 2: 9, 3: 1, 14: 4, 20: 4, 22: 1, 27: 2, 28: 2, 29: 3}
Did not match all atoms present	10262-69-8	CNCCCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24	{1: 1, 2: 3, 11: 2, 12: 1, 13: 1, 14: 8, 31: 1}
Did not match all atoms present	10264-18-3	CCCCC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 2: 3, 14: 5, 31: 1}
Did not match all atoms present	102647-16-5	C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O[C@@H]2C[C@@H](O[C@@H](C2O)C)O[C@H]3[C@@H](CC4=C(C3=O)C(=C5C(=C4)C=C(C=C5O)O[C@H]6C[C@H]([C@H]([C@H](O6)C)O[C@@H]7C[C@H]([C@H]([C@H](O7)C)OC)O)OC(=O)C)O)[C@@H](C(=O)[C@H]([C@@H](C)O)O)OC)O[C@H]8CC([C@H]([C@@H](O8)C)OC(=O)C(C)C)(C)O)O	{1: 12, 3: 4, 11: 6, 12: 21, 13: 1, 14: 3, 20: 6, 21: 2, 22: 7, 23: 5, 24: 1, 25: 1, 28: 2}
Did not match all atoms present	10265-69-7	C1=CC=C(C=C1)NCC(=O)[O-].[Na+]	{24: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	10265-92-6	COP(=O)(N)SC	{40: 1, 1: 2, 30: 1, 29: 1, 22: 1}
Did not match all atoms present	10268-69-6	C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2N	{28: 1, 30: 1, 14: 9}
Did not match all atoms present	10268-71-0	COC1=CC=CC=C1C(=O)OC2=CC=CC=C2	{1: 1, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	102691-36-1	CC(C)N(C(C)C)P(N(C(C)C)C(C)C)OCCC#N	{1: 8, 2: 2, 3: 4, 37: 1, 33: 2, 22: 1}
Did not match all atoms present	1027-14-1	CCN(CC)CC(=O)NC1=C(C=C(C=C1C)C)C.Cl	{1: 5, 2: 3, 33: 1, 14: 2, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	1027-62-9	CN(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)N(C)C	{1: 4, 14: 10, 33: 2}
Did not match all atoms present	10270-33-4	C1=CC=C(C(=C1)CCC2=CC=CC=C2C#N)C#N	{2: 2, 37: 2, 14: 8}
Did not match all atoms present	102703-33-3	CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 15, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	10272-07-8	COC1=CC(=CC(=C1)N)OC	{1: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	10273-74-2	C1=CC=C(C=C1)[P+](CC2=CC(=CC=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7	{2: 2, 14: 34}
Did not match all atoms present	10273-90-2	CC1=C(N=CC=C1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 8}
Did not match all atoms present	102744-98-9	C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Fe+2]	{24: 6, 33: 2, 2: 6}
Did not match all atoms present	10276-86-5	CCCCCCCOC(=O)C1=CC=CC=C1Cl	{1: 1, 2: 6, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	10277-43-7	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[La+3]	{}
Did not match all atoms present	10277-44-8	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Pr+3].[Pr+3]	{29: 12}
Did not match all atoms present	10277-74-4	C1CC2=CC=CC=C2[C@@H]1N	{11: 2, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	10278-71-4	CC1=CC=CC=C1N=CN(C)C	{1: 3, 34: 1, 14: 4, 6: 1, 33: 1}
Did not match all atoms present	102783-83-5	CCO[Si](CCCN)(OCC)OCC.CC(CCO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O.C(CO)O	{1: 4, 2: 10, 3: 1, 14: 6, 20: 4, 22: 3, 28: 4, 30: 1}
Did not match all atoms present	1028-33-7	CCCCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C	{1: 3, 2: 5, 35: 1, 33: 3, 14: 1, 25: 2}
Did not match all atoms present	10283-15-5	CC1=C(C(=C(C=C1)O)Cl)C	{1: 2, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	10284-44-3	C1C2=CC=CC=C2OS1(=O)=O	{11: 1, 29: 2, 14: 4, 23: 1}
Did not match all atoms present	10284-49-8	CC(C)(C)C[Hg]CC(C)(C)C	{1: 6, 2: 2, 4: 2}
Did not match all atoms present	102851-06-9	CC(C)[C@H](C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl	{1: 2, 3: 3, 4: 1, 37: 1, 14: 12, 16: 3, 17: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	10287-53-3	CCOC(=O)C1=CC=C(C=C1)N(C)C	{1: 3, 2: 1, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	10287-54-4	CCN(CC)C1=CC=C(C=C1)C(=O)OCC	{1: 3, 2: 3, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	102871-67-0	CC1=NC2=CC(=CC(=C2C=C1)C)C	{1: 3, 35: 1, 14: 4}
Did not match all atoms present	10289-45-9	CCCC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	1029-96-5	C1=CC=C(C=C1)C2=CC(=O)C=C(S2)C3=CC=CC=C3	{25: 1, 14: 12, 41: 1}
Did not match all atoms present	10290-12-7	[O-][As]([O-])[O-].[Cu]	{29: 3}
Did not match all atoms present	102900-05-0	C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.C1=CC(=CC=C1CC2=CC(=C(C=C2)N)CC3=CC=C(C=C3)N)N.C1=CC(=CC=C1CC2=CC=C(C=C2)N3C(=O)C=CC3=O)N4C(=O)C=CC4=O	{25: 4, 2: 4, 30: 5, 14: 31, 33: 2}
Did not match all atoms present	10291-27-7	C1=CC=C(C(=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3Cl)C(=O)O)Cl	{17: 2, 27: 2, 14: 10, 31: 2}
Did not match all atoms present	10291-28-8	CC1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=C(C=C3)C)C(=O)O	{1: 2, 27: 2, 14: 10, 31: 2}
Did not match all atoms present	102916-22-3	O.O.O.O.O.O.O.F[Sn-](F)F.F[Sn-](F)F.[Zn+2]	{16: 6}
Did not match all atoms present	102925-59-7	CN(C)P(=O)(N(C)C)[Si](C)(C)C	{1: 7, 29: 1, 33: 2}
Did not match all atoms present	102925-87-1	COC1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 35: 2, 38: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	102936-05-0	C[C@@H](C(=O)O)OC(=O)NC1=CC=CC=C1	{1: 1, 3: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	10294-26-5	O=S(=O)([O-])[O-].[Ag+].[Ag+]	{29: 4}
Did not match all atoms present	10294-27-6	Br[Au]	{18: 1}
Did not match all atoms present	10294-28-7	Br[Au](Br)Br	{18: 3}
Did not match all atoms present	10294-29-8	Cl[Au]	{17: 1}
Did not match all atoms present	10294-31-2	I[Au]	{19: 1}
Did not match all atoms present	10294-32-3	[O-][Se](=O)(=O)[O-].[O-][Se](=O)(=O)[O-].[O-][Se](=O)(=O)[O-].[Au+3].[Au+3]	{29: 12}
Did not match all atoms present	10294-33-4	B(Br)(Br)Br	{18: 3}
Did not match all atoms present	10294-34-5	B(Cl)(Cl)Cl	{17: 3}
Did not match all atoms present	10294-39-0	O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ba+2]	{17: 2, 29: 8}
Did not match all atoms present	10294-40-3	[O-][Cr](=O)(=O)[O-].[Ba+2]	{29: 4}
Did not match all atoms present	10294-41-4	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Ce+3]	{}
Did not match all atoms present	10294-42-5	O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ce+4]	{29: 8}
Did not match all atoms present	10294-44-7	[O-]Cl(=O)=O.[Hg+]	{17: 1, 29: 3}
Did not match all atoms present	10294-46-9	O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cu+2]	{17: 2, 29: 8}
Did not match all atoms present	10294-47-0	[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Pb+2]	{17: 2, 29: 6}
Did not match all atoms present	10294-50-5	O.O.O.O.O.O.O.O.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Co+2].[Co+2].[Co+2]	{29: 8}
Did not match all atoms present	10294-53-8	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Fe+3].[Fe+3]	{29: 18, 22: 3}
Did not match all atoms present	10294-54-9	[O-]S(=O)(=O)[O-].[Cs+].[Cs+]	{29: 4}
Did not match all atoms present	10294-56-1	OP(O)O	{20: 3}
Did not match all atoms present	10294-58-3	[O-]P=O.[O-]P=O.[Pb+2]	{29: 4}
Did not match all atoms present	10294-62-9	O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[La+3].[La+3]	{29: 12}
Did not match all atoms present	10294-64-1	[O-][Mn](=O)(=O)[O-].[K+].[K+]	{29: 4}
Did not match all atoms present	10294-66-3	[O-]S(=O)(=S)[O-].[K+].[K+]	{29: 3}
Did not match all atoms present	10294-70-9	[Sn](I)I	{19: 2}
Did not match all atoms present	10297-73-1	CC(=O)C1=CC=C(C=C1)S(=O)(=O)C	{24: 1, 1: 2, 29: 2, 14: 4}
Did not match all atoms present	10298-80-3	COC1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	103-01-5	C1=CC=C(C=C1)NCC(=O)O	{2: 1, 27: 1, 14: 5, 31: 1}
Did not match all atoms present	103-02-6	CC(=NNC1=CC=CC=C1)C	{1: 2, 34: 1, 31: 1, 14: 5, 7: 1}
Did not match all atoms present	103-03-7	C1=CC=C(C=C1)NNC(=O)N	{24: 1, 30: 1, 14: 5, 31: 2}
Did not match all atoms present	103-05-9	CC(C)(CCC1=CC=CC=C1)O	{1: 2, 2: 2, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	103-06-0	C1=CC=C(C=C1)NCS(=O)(=O)O	{2: 1, 20: 1, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	103-07-1	CC(=O)OC(C)(C)CCC1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	103-12-8	C1=CC(=CC=C1N=NC2=C(C=C(C=C2)N)N)S(=O)(=O)N	{30: 3, 34: 2, 29: 2, 14: 7}
Did not match all atoms present	103-14-0	C1=CC=C(C=C1)CNC2=CC=C(C=C2)O	{2: 1, 21: 1, 14: 9, 31: 1}
Did not match all atoms present	103-16-2	C1=CC=C(C=C1)COC2=CC=C(C=C2)O	{2: 1, 22: 1, 21: 1, 14: 9}
Did not match all atoms present	103-17-3	C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)Cl	{40: 1, 17: 2, 2: 1, 14: 8}
Did not match all atoms present	103-18-4	C1=CC(=O)C=CC1=NNC2=CC=C(C=C2)N	{34: 1, 14: 8, 15: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	103-19-5	CC1=CC=C(C=C1)SSC2=CC=C(C=C2)C	{40: 2, 1: 2, 14: 8}
Did not match all atoms present	103-25-3	COC(=O)CCC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	103-26-4	COC(=O)/C=C/C1=CC=CC=C1	{1: 1, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	103-28-6	CC(C)C(=O)OCC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	103-29-7	C1=CC=C(C=C1)CCC2=CC=CC=C2	{2: 2, 14: 10}
Did not match all atoms present	103-30-0	C1=CC=C(C=C1)C=CC2=CC=CC=C2	{14: 10, 6: 2}
Did not match all atoms present	103-31-1	C1=CC=C(C=C1)C=CC2=CC=NC=C2	{35: 1, 14: 9, 6: 2}
Did not match all atoms present	103-32-2	C1=CC=C(C=C1)CNC2=CC=CC=C2	{2: 1, 14: 10, 31: 1}
Did not match all atoms present	103-33-3	C1=CC=C(C=C1)N=NC2=CC=CC=C2	{34: 2, 14: 10}
Did not match all atoms present	103-36-6	CCOC(=O)C=CC1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	103-37-7	CCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	103-38-8	CC(C)CC(=O)OCC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	103-41-3	C1=CC=C(C=C1)COC(=O)C=CC2=CC=CC=C2	{2: 1, 28: 1, 14: 10, 6: 2}
Did not match all atoms present	103-43-5	C1=CC=C(C=C1)COC(=O)CCC(=O)OCC2=CC=CC=C2	{2: 4, 28: 2, 14: 10}
Did not match all atoms present	103-45-7	CC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	103-46-8	C1=CC=C(C=C1)CSCC(=O)O	{40: 1, 2: 2, 27: 1, 14: 5}
Did not match all atoms present	103-47-9	C1CCC(CC1)NCCS(=O)(=O)O	{2: 2, 11: 5, 12: 1, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	103-48-0	CC(C)C(=O)OCCC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	103-49-1	C1=CC=C(C=C1)CNCC2=CC=CC=C2	{2: 2, 14: 10, 31: 1}
Did not match all atoms present	103-50-4	C1=CC=C(C=C1)COCC2=CC=CC=C2	{2: 2, 22: 1, 14: 10}
Did not match all atoms present	103-52-6	CCCC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 14: 5}
Did not match all atoms present	103-53-7	C1=CC=C(C=C1)CCOC(=O)C=CC2=CC=CC=C2	{2: 2, 28: 1, 14: 10, 6: 2}
Did not match all atoms present	103-54-8	CC(=O)OC/C=C/C1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	103-55-9	CN(C)CCNCC1=CC=CC=C1	{1: 2, 2: 3, 33: 1, 14: 5, 31: 1}
Did not match all atoms present	103-56-0	CCC(=O)OCC=CC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	103-58-2	CC(C)C(=O)OCCCC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	103-59-3	CC(C)C(=O)OCC=CC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 6: 2, 14: 5, 28: 1}
Did not match all atoms present	103-60-6	CC(C)C(=O)OCCOC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	103-61-7	CCCC(=O)OCC=CC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	103-62-8	CCCCNC1=CC=C(C=C1)O	{1: 1, 2: 3, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	103-63-9	C1=CC=C(C=C1)CCBr	{2: 2, 18: 1, 14: 5}
Did not match all atoms present	103-64-0	C1=CC=C(C=C1)C=CBr	{18: 1, 14: 5, 6: 2}
Did not match all atoms present	103-65-1	CCCC1=CC=CC=C1	{1: 1, 2: 2, 14: 5}
Did not match all atoms present	103-67-3	CNCC1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	103-69-5	CCNC1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	103-70-8	C1=CC=C(C=C1)NC=O	{26: 1, 14: 5, 31: 1}
Did not match all atoms present	103-71-9	C1=CC=C(C=C1)N=C=O	{8: 1, 34: 1, 29: 1, 14: 5}
Did not match all atoms present	103-72-0	C1=CC=C(C=C1)N=C=S	{8: 1, 34: 1, 14: 5}
Did not match all atoms present	103-73-1	CCOC1=CC=CC=C1	{1: 1, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	103-74-2	C1=CC=NC(=C1)CCO	{2: 2, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	103-79-7	CC(=O)CC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	103-80-0	C1=CC=C(C=C1)CC(=O)Cl	{24: 1, 17: 1, 2: 1, 14: 5}
Did not match all atoms present	103-81-1	C1=CC=C(C=C1)CC(=O)N	{24: 1, 2: 1, 30: 1, 14: 5}
Did not match all atoms present	103-82-2	C1=CC=C(C=C1)CC(=O)O	{2: 1, 27: 1, 14: 5}
Did not match all atoms present	103-83-3	CN(C)CC1=CC=CC=C1	{1: 2, 2: 1, 14: 5, 33: 1}
Did not match all atoms present	103-84-4	CC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 31: 1}
Did not match all atoms present	103-85-5	C1=CC=C(C=C1)NC(=S)N	{31: 1, 30: 1, 14: 5, 7: 1}
Did not match all atoms present	103-86-6	CC(CC1=CC=C(C=C1)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 21: 1, 30: 1}
Did not match all atoms present	103-87-7	CN(C)CC1=CC=C(C=C1)O	{1: 2, 2: 1, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	103-88-8	CC(=O)NC1=CC=C(C=C1)Br	{24: 1, 1: 1, 18: 1, 14: 4, 31: 1}
Did not match all atoms present	103-89-9	CC1=CC=C(C=C1)NC(=O)C	{24: 1, 1: 2, 14: 4, 31: 1}
Did not match all atoms present	103-90-2	CC(=O)NC1=CC=C(C=C1)O	{24: 1, 1: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	103-92-4	C1=CC(=CC=C1N)NC(=O)C(=O)O	{24: 1, 27: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	103-93-5	CC1=CC=C(C=C1)OC(=O)C(C)C	{1: 3, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	103-94-6	C1=CC(=CC=C1NC(=O)C(=O)O)[N+](=O)[O-]	{24: 1, 27: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	103-95-7	CC(C)C1=CC=C(C=C1)CC(C)C=O	{1: 3, 2: 1, 3: 2, 26: 1, 14: 4}
Did not match all atoms present	103-96-8	CCCCCCC(C)NC1=CC=C(C=C1)NC(C)CCCCCC	{1: 4, 2: 10, 3: 2, 14: 4, 31: 2}
Did not match all atoms present	103-98-0	CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)O	{1: 1, 2: 10, 14: 4, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	103-99-1	CCCCCCCCCCCCCCCCCC(=O)NC1=CC=C(C=C1)O	{1: 1, 2: 16, 14: 4, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	1030-02-0	C1=CC=C(C=C1)C(SCCC(=O)O)SCCC(=O)O	{27: 2, 40: 2, 2: 4, 3: 1, 14: 5}
Did not match all atoms present	1030-06-4	C1=CC(=CC=C1CCCC(=O)[O-])N(CCCl)CCCl.[Na+]	{24: 1, 17: 2, 2: 7, 14: 4, 33: 1}
Did not match all atoms present	10302-15-5	C1CN1S(=O)(=O)C2=CC=CC=C2	{33: 1, 11: 2, 29: 2, 14: 5}
Did not match all atoms present	10304-39-9	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2N=CC=C3	{1: 1, 35: 1, 29: 2, 14: 10, 31: 1}
Did not match all atoms present	10304-81-1	CC(CC1=CC=CC=C1)Cl	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	103068-82-2	CC[NH+](CC)CC(=O)NC1=C(C(=NN1C)C)C(=O)C2=CC=CC=C2F.[Cl-]	{1: 4, 2: 3, 35: 1, 33: 1, 14: 4, 16: 1, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	10308-82-4	C(=NN)(N)N.[N+](=O)(O)[O-]	{34: 1, 20: 1, 30: 3, 7: 1}
Did not match all atoms present	10309-37-2	CC(=CCCC(C)(C=C)C=CC1=CC=C(C=C1)O)C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 4, 7: 1, 14: 4, 21: 1}
Did not match all atoms present	10309-79-2	CNNCC1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 31: 2}
Did not match all atoms present	10309-97-4	CNC(=O)OC1=CC=CC=C1O	{1: 1, 28: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	103099-52-1	C1CCC(CC1)P(CCCP(C2CCCCC2)C3CCCCC3)C4CCCCC4	{2: 3, 11: 20, 12: 4}
Did not match all atoms present	1031-07-8	C1C2C(COS(=O)(=O)O1)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{11: 2, 12: 2, 13: 3, 15: 2, 17: 6, 23: 2, 29: 2}
Did not match all atoms present	1031-47-6	CN(C)P(=O)(N1C(=NC(=N1)C2=CC=CC=C2)N)N(C)C	{1: 4, 35: 2, 33: 3, 14: 5, 29: 1, 30: 1}
Did not match all atoms present	1031-93-2	CC1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 14: 14}
Did not match all atoms present	10310-21-1	C1=NC2=C(N1)C(=NC(=N2)N)Cl	{32: 1, 17: 1, 35: 3, 30: 1, 14: 1}
Did not match all atoms present	10310-32-4	CCOC1[C@@H]([C@H]([C@H](O1)C(COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)O	{1: 1, 2: 5, 3: 1, 12: 4, 14: 15, 20: 1, 22: 4, 23: 1}
Did not match all atoms present	10310-38-0	C(C[P+](CCC#N)(CCC#N)CC[P+](CCC#N)(CCC#N)CCC#N)C#N.[Br-].[Br-]	{2: 14, 18: 2, 37: 6}
Did not match all atoms present	10311-08-7	CP(=O)(C)C1=CC=CC=C1	{1: 2, 29: 1, 14: 5}
Did not match all atoms present	10311-84-9	CCOP(=S)(OCC)SC(CCl)N1C(=O)C2=CC=CC=C2C1=O	{1: 2, 2: 3, 3: 1, 33: 1, 40: 1, 14: 4, 17: 1, 22: 2, 25: 2}
Did not match all atoms present	10312-55-7	C1=CC(=C(C=C1C(=O)O)N)C(=O)O	{27: 2, 30: 1, 14: 3}
Did not match all atoms present	10313-60-7	COC1=C(C=C(C=C1)CC(=O)Cl)OC	{1: 2, 2: 1, 14: 3, 17: 1, 22: 2, 24: 1}
Did not match all atoms present	103140-12-1	C1=C(C=C(C=C1Cl)Cl)OCC#N	{17: 2, 2: 1, 22: 1, 14: 3, 37: 1}
Did not match all atoms present	103147-46-2	C1=CC2=C(C=CC3=C2C(=C1)C4=C5C3=CC=CC5=C(C=C4)C#N)C#N	{37: 2, 14: 10}
Did not match all atoms present	10316-00-4	C1COCCN1CC2=CC=CC=C2	{33: 1, 2: 1, 11: 4, 14: 5, 23: 1}
Did not match all atoms present	103171-41-1	CCCCCCCCCCCC[N+](C)(C)CC(=O)[O-].[Na+].[Cl-]	{24: 1, 1: 3, 2: 12, 17: 1}
Did not match all atoms present	10318-23-7	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC3=C2C=C[N+](=C3)[O-]	{1: 2, 34: 2, 29: 1, 14: 10, 33: 2}
Did not match all atoms present	10318-38-4	CC1=CC2=C(C=CC3=CC=CC=C32)OC14C=CC5=C(O4)C=CC6=CC=CC=C65	{1: 1, 23: 2, 13: 1, 14: 15, 15: 1}
Did not match all atoms present	10319-70-7	C(C(=N)N)SS(=O)(=O)O	{2: 1, 36: 1, 7: 1, 40: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	10319-80-9	CC(=S)NC1=CC=CC2=CC=CC=C21	{1: 1, 31: 1, 14: 7, 7: 1}
Did not match all atoms present	10321-42-3	C1=CC=C(C=C1)C2C(=O)NC(O2)C3=CC=CC=C3	{32: 1, 25: 1, 12: 2, 14: 10, 23: 1}
Did not match all atoms present	10322-73-3	CC(=O)OC1=CC2=C(C=C1)[C@H]3CC[C@]4([C@H](C3=CC2)CC[C@]4(C5=COC=C5)O)C	{1: 2, 11: 5, 12: 2, 13: 2, 14: 7, 15: 1, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	103225-02-1	CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=NC=C1	{1: 1, 2: 17, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	103225-43-0	C1C(S(=O)(=O)C(CC1=O)C2=CC=CC=C2)C3=CC=CC=C3	{25: 1, 11: 2, 12: 2, 29: 2, 14: 10}
Did not match all atoms present	10323-39-4	CC(C)(C)C1=C(C=CC(=C1)Br)O	{1: 3, 18: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	10324-64-8	CCCC=C(CC)C=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 3, 38: 2, 6: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	10325-39-0	[B](Cl)Cl	{17: 2}
Did not match all atoms present	10325-94-7	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cd+2]	{}
Did not match all atoms present	10326-27-9	O.O.[Cl-].[Cl-].[Ba+2]	{17: 2}
Did not match all atoms present	10326-29-1	[O-][Se](=O)(=O)[O-].[Cs+].[Cs+]	{29: 4}
Did not match all atoms present	103270-64-0	CCCCCCCC[Sn](CCCCCCCC)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 14, 14: 10}
Did not match all atoms present	10328-92-4	CN1C2=CC=CC=C2C(=O)OC1=O	{1: 1, 28: 2, 14: 4, 33: 1}
Did not match all atoms present	10329-95-0	C1CC(=O)N(C(=O)C1N2C(=O)C3=CC=CC=C3C2=O)CN4CCOCC4	{33: 3, 2: 1, 11: 6, 12: 1, 14: 4, 23: 1, 25: 4}
Did not match all atoms present	1033-16-5	C1=CC=C2C(=C1)C(=O)N/C(=C/3\C=C(C=C(C3=O)Cl)Cl)/N2	{32: 2, 17: 2, 25: 2, 14: 6, 15: 4}
Did not match all atoms present	1033-90-5	C1=CC=C(C=C1)C2=CC3=S(S2)SC(=C3)C4=CC=CC=C4	{41: 2, 14: 12, 15: 3}
Did not match all atoms present	10331-57-4	C1=C(C=C(C(=C1[N+](=O)[O-])O)C2=CC(=CC(=C2O)[N+](=O)[O-])Cl)Cl	{17: 2, 38: 2, 21: 2, 14: 4}
Did not match all atoms present	10332-33-9	B(=O)O[O-].O.[Na+]	{29: 2, 22: 1}
Did not match all atoms present	10332-51-1	C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.[K+]	{25: 1, 35: 1, 29: 2, 14: 4}
Did not match all atoms present	10335-79-2	C1=CC=C2C=C(C=CC2=C1)C(=O)NO	{24: 1, 20: 1, 14: 7, 31: 1}
Did not match all atoms present	103361-09-7	C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)C4=C(C3=O)CCCC4)F	{33: 2, 2: 1, 9: 1, 10: 1, 11: 5, 14: 2, 15: 2, 16: 1, 23: 1, 25: 3}
Did not match all atoms present	103365-47-5	CC(C)(C)OC(=O)N[C@@H](CC(=O)O)C1=CC=CC=C1	{1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	103369-17-1	COC1=CC2=CC(=C(C=C2C=C1)[O-])C(=O)NC3=CC(=C(C=C3OC)Cl)OC.[K+]	{1: 3, 14: 7, 17: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	103373-95-1	CCC(CO)(COCC=C)COCC=C.C(CNCCO)N.C(CNCCO)N.C(CNCCO)N.[Zr]	{1: 1, 2: 18, 4: 1, 5: 2, 6: 2, 20: 4, 22: 2, 30: 3, 31: 3}
Did not match all atoms present	10338-69-9	C1CNCC=C1C2=CC=CC=C2	{32: 1, 11: 3, 14: 6, 15: 1}
Did not match all atoms present	1034-01-1	CCCCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O	{1: 1, 2: 7, 28: 1, 21: 3, 14: 2}
Did not match all atoms present	1034-39-5	C1=CC=C(C=C1)P(C2=CC=CC=C2)(C3=CC=CC=C3)(Br)Br	{18: 2, 14: 15}
Did not match all atoms present	1034-49-7	C1=CC=C(C=C1)[P+](CBr)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{2: 1, 18: 2, 14: 15}
Did not match all atoms present	10340-77-9	CC1=CC(=C(C=C1C)CCl)C	{1: 3, 2: 1, 14: 2, 17: 1}
Did not match all atoms present	10340-91-7	[C-]#[N+]CC1=CC=CC=C1	{2: 1, 34: 1, 14: 5}
Did not match all atoms present	103403-38-9	CCCCCCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 21, 28: 1, 14: 5}
Did not match all atoms present	10342-59-3	CCCC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 14: 4}
Did not match all atoms present	10342-83-3	CCC(=O)C1=CC=C(C=C1)Br	{24: 1, 1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	10342-85-5	CC(=O)C1=CC=C(C=C1)N2CCCCC2	{24: 1, 1: 1, 11: 5, 14: 4, 33: 1}
Did not match all atoms present	103426-96-6	C1=C2C(=CC(=C1Cl)Cl)C(=C(C(=C2Cl)Cl)Cl)Cl	{17: 6, 14: 2}
Did not match all atoms present	103426-97-7	C1=C2C(=C(C(=C1Cl)Cl)Cl)C=C(C(=C2Cl)Cl)Cl	{17: 6, 14: 2}
Did not match all atoms present	10343-55-2	CC(=O)/C(=N\NC1=CC(=CC(=C1[O-])S(=O)(=O)[O-])[N+](=O)[O-])/C(=NC2=CC=CC=C2)[O-].[Cr+3]	{1: 1, 34: 2, 38: 1, 7: 2, 14: 7, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	103443-53-4	CCN(CCO)C1=CC=C(C=C1)[N+]#N.C1=C(C=C(C=C1C(=O)O)S(=O)(=O)[O-])C(=O)O	{1: 1, 2: 3, 33: 1, 34: 1, 14: 7, 20: 1, 27: 2, 29: 3}
Did not match all atoms present	103443-55-6	C1=CC(=CC=C1N)OC2=CC=C(C=C2)N.C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N.C1=CC2=C(C=C1C(C3=CC4=C(C=C3)C(=O)OC4=O)(C(F)(F)F)C(F)(F)F)C(=O)OC2=O	{4: 3, 14: 22, 16: 6, 22: 1, 28: 4, 29: 2, 30: 4}
Did not match all atoms present	10345-87-6	C1CC(=CC(=O)C1)C2=CC=CC=C2	{25: 1, 11: 3, 14: 6, 15: 1}
Did not match all atoms present	103457-72-3	C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[Er+3]	{1: 18, 34: 3}
Did not match all atoms present	103458-48-6	[H+].[H+].CCCCC(CC)COCCCN.CCCCC(CC)COCCCN.CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=CC3=[O+]2)N(CC)CC)C4=CC=CC=C4C(=O)O.CC1=NN(C(=O)[C-]1N=NC2=CC(=CC(=C2O)S(=O)(=O)O)[N+](=O)[O-])C3=CC=CC=C3.CC1=NN(C(=O)[C-]1N=NC2=CC(=CC(=C2O)S(=O)(=O)O)[N+](=O)[O-])C3=CC=CC=C3.[Cr]	{1: 10, 2: 20, 3: 2, 38: 2, 33: 4, 34: 4, 14: 24, 35: 2, 20: 2, 21: 2, 22: 2, 23: 1, 25: 2, 27: 1, 29: 4, 30: 2}
Did not match all atoms present	10347-38-3	C1=CC=C(C=C1)C[Sn](CC2=CC=CC=C2)(CC3=CC=CC=C3)S[Sn](CC4=CC=CC=C4)(CC5=CC=CC=C5)CC6=CC=CC=C6	{40: 1, 2: 6, 14: 30}
Did not match all atoms present	10347-81-6	CNCCCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24.Cl	{1: 1, 2: 3, 11: 2, 12: 1, 13: 1, 14: 8, 17: 1, 31: 1}
Did not match all atoms present	103473-99-0	COC(=O)CC1=C(C=CC=C1Cl)F	{1: 1, 2: 1, 14: 3, 16: 1, 17: 1, 28: 1}
Did not match all atoms present	103475-11-2	CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.[Zr]	{1: 4, 2: 24, 4: 4, 5: 8, 6: 8, 20: 4, 22: 8}
Did not match all atoms present	10349-06-1	C1=CC=C(C=C1)C2=NON=C2	{35: 2, 14: 6, 23: 1}
Did not match all atoms present	10349-09-4	CC1=NON=C1C2=CC=CC=C2	{1: 1, 35: 2, 14: 5, 23: 1}
Did not match all atoms present	10349-12-9	C1=CC=C(C=C1)C(=O)C2=NON=C2C(=O)C3=CC=CC=C3	{24: 2, 35: 2, 14: 10, 23: 1}
Did not match all atoms present	10349-14-1	C1=CC=C(C=C1)C2=NON=C2N	{35: 2, 30: 1, 14: 5, 23: 1}
Did not match all atoms present	10349-57-2	C1=CC2=C(C=CC(=C2)C(=O)O)N=C1	{35: 1, 27: 1, 14: 6}
Did not match all atoms present	1035-77-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)OC	{1: 2, 11: 6, 12: 4, 13: 1, 14: 3, 20: 1, 22: 1}
Did not match all atoms present	10350-81-9	C1CCN(C1)CC2=C(C=CC(=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)O.Cl.Cl	{33: 1, 2: 1, 35: 1, 11: 4, 14: 8, 17: 3, 21: 1, 31: 1}
Did not match all atoms present	10351-19-6	C1=CN=CC=C1SCC(=O)O	{40: 1, 35: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	10352-27-9	CC1=NC2=C(C=CC=C2O)C=C1.Cl	{1: 1, 35: 1, 21: 1, 14: 5, 17: 1}
Did not match all atoms present	10352-44-0	CC(=O)NC1=CC=C(C=C1)SC	{24: 1, 1: 2, 40: 1, 14: 4, 31: 1}
Did not match all atoms present	10354-00-4	C1=CC=C2C(C3=CC=CC=C3C=CC2=C1)O	{20: 1, 12: 1, 14: 10}
Did not match all atoms present	10354-27-5	CCC(=O)C=CC1=CC2=C(C=C1)OCO2	{1: 1, 2: 1, 6: 2, 11: 1, 14: 3, 23: 2, 24: 1}
Did not match all atoms present	103547-55-3	B(C(C)(C)C)(C(C)(C)C)N	{1: 6, 4: 2, 30: 1}
Did not match all atoms present	103548-16-9	C1=CC=C(C=C1)[C@@H](CCO)O	{2: 2, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	10355-53-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]	{38: 1, 14: 13}
Did not match all atoms present	10356-76-0	C1[C@@H](O[C@@H](C1O)CO)N2C=C(C(=NC2=O)N)F	{33: 1, 2: 1, 35: 1, 11: 1, 12: 3, 14: 1, 16: 1, 20: 2, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	10357-25-2	C[C@@H](C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)[N+](C)(C)C)C)C)[N+](C)(C)C.[I-].[I-]	{1: 9, 3: 1, 11: 9, 12: 6, 13: 2, 19: 2}
Did not match all atoms present	103580-64-9	CCCCOCC(CNC1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC4=C(C=C5C=C(/C(=N\NC6=CC=CC=C6)/C(=O)C5=C4N)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C)N)O.[Na+].[Na+]	{1: 3, 2: 5, 3: 1, 34: 5, 14: 16, 15: 2, 20: 1, 22: 1, 25: 1, 29: 6, 30: 2, 31: 2}
Did not match all atoms present	10359-69-0	C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]	{38: 1, 14: 8, 6: 2, 29: 3}
Did not match all atoms present	103596-73-2	CC1=C(C(=CC(=C1N)C(C)(C)C)C(C)(C)C)N	{1: 7, 4: 2, 30: 2, 14: 1}
Did not match all atoms present	103598-03-4	CC(C)NCC(COC1=CC=C(C=C1)CCC(=O)OC)O	{1: 3, 2: 4, 3: 2, 14: 4, 20: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	10361-03-2	[O-]P(=O)=O.[Na+]	{29: 3}
Did not match all atoms present	10361-29-2	C(=O)(O)O.N.N	{27: 2}
Did not match all atoms present	10361-37-2	[Ba+2].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	10361-44-1	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Bi+3]	{}
Did not match all atoms present	10361-46-3	[N+](=O)([O-])O[Bi]=O	{29: 1, 22: 1}
Did not match all atoms present	10361-65-6	[NH4+].[NH4+].[NH4+].[O-]P(=O)([O-])[O-]	{29: 4}
Did not match all atoms present	10361-79-2	Cl[Pr](Cl)Cl	{17: 3}
Did not match all atoms present	10361-82-7	Cl[Sm](Cl)Cl	{17: 3}
Did not match all atoms present	10361-83-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Sm+3]	{}
Did not match all atoms present	10361-84-9	Cl[Sc](Cl)Cl	{17: 3}
Did not match all atoms present	10361-91-8	[Cl-].[Cl-].[Cl-].[Yb+3]	{17: 3}
Did not match all atoms present	10361-92-9	Cl[Y](Cl)Cl	{17: 3}
Did not match all atoms present	10361-93-0	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Y+3]	{}
Did not match all atoms present	10361-95-2	[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Zn+2]	{17: 2, 29: 6}
Did not match all atoms present	103628-46-2	CNS(=O)(=O)CC1=CC2=C(C=C1)NC=C2CCN(C)C	{32: 1, 1: 3, 2: 3, 33: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	103637-48-5	CC(=C)C(=O)OC(COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O)COC3=CC(=C(C=C3)C(=O)C4=CC=CC=C4)O	{1: 1, 2: 2, 3: 1, 5: 1, 7: 1, 14: 16, 21: 2, 22: 2, 24: 2, 28: 1}
Did not match all atoms present	10364-68-8	CCC1=NC(=NO1)C2=CC=CC=C2	{1: 1, 2: 1, 35: 2, 14: 5, 23: 1}
Did not match all atoms present	10364-94-0	C1=CC=C(C=C1)C(=O)N2C=CN=C2	{24: 1, 33: 1, 35: 1, 14: 8}
Did not match all atoms present	10365-94-3	C1=C(C=C(C=C1C#N)C#N)C#N	{37: 3, 14: 3}
Did not match all atoms present	10365-98-7	B(C1=CC(=CC=C1)OC)(O)O	{1: 1, 20: 2, 22: 1, 14: 4}
Did not match all atoms present	10366-35-5	C1=CC(=C(N=C1)Cl)C(=O)N	{24: 1, 17: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	103678-18-8	CN(C)P1(=CP(=C1)(N(C)C)N(C)C)N(C)C	{1: 8, 14: 2, 33: 4}
Did not match all atoms present	10369-17-2	CN1P2N(P3N(P1N(P(N2C)N3C)C)C)C	{1: 6, 33: 6}
Did not match all atoms present	1037-50-9	COC1=NC(=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N)OC.[Na+]	{1: 2, 34: 1, 35: 2, 14: 5, 22: 2, 29: 2, 30: 1}
Did not match all atoms present	10371-86-5	CC1=C2C(=C(C3=C1C=CN=C3)C)C4=C(N2)C=CC(=C4)OC	{32: 1, 1: 3, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	10374-80-8	COC(=O)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C(=O)OC	{1: 2, 28: 2, 14: 8, 6: 2}
Did not match all atoms present	10375-96-9	CC1=CC(=C(C=C1C(C)C)C)C(C)C	{1: 6, 3: 2, 14: 2}
Did not match all atoms present	103754-03-6	C1=CC=C(C=C1)NC2=NNN=C2C(=O)N	{32: 1, 35: 2, 14: 5, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	10377-37-4	[Li].[Li].C(=O)(O)O	{27: 2}
Did not match all atoms present	10377-48-7	[Li+].[Li+].[O-]S(=O)(=O)[O-]	{29: 4}
Did not match all atoms present	10377-51-2	[Li+].[I-]	{19: 1}
Did not match all atoms present	10377-52-3	[Li+].[Li+].[Li+].[O-]P(=O)([O-])[O-]	{29: 4}
Did not match all atoms present	10377-58-9	[I-].[I-].[Mg+2]	{19: 2}
Did not match all atoms present	10377-60-3	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Mg+2]	{}
Did not match all atoms present	10377-62-5	[O-][Mn](=O)(=O)=O.[O-][Mn](=O)(=O)=O.[Mg+2]	{29: 8}
Did not match all atoms present	10377-66-9	O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Mn+2]	{}
Did not match all atoms present	10377-81-8	B(O)(O)OCCN	{2: 2, 20: 2, 30: 1, 22: 1}
Did not match all atoms present	10377-95-4	C1=CC=C(C(=C1)C(=O)OCCN(CCO)CCO)O	{33: 1, 2: 6, 14: 4, 20: 2, 21: 1, 28: 1}
Did not match all atoms present	10377-98-7	CC(C(=O)[O-])[O-].CC(C(=O)[O-])[O-].CC(C(=O)[O-])[O-].CC(C(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Zr+4]	{24: 4, 1: 4, 3: 4, 29: 4}
Did not match all atoms present	10378-14-0	CCCCCCCCCCCCCCCCCC[N+](C)(CC)CCCCCCCCCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 5, 2: 36, 29: 3, 22: 1}
Did not match all atoms present	103788-60-9	C1=CC(=CC=C1/C=C/2\C(=O)NC(=O)S2)O	{32: 1, 6: 1, 41: 1, 14: 4, 15: 1, 21: 1, 25: 2}
Did not match all atoms present	10379-11-0	C1CCC(=CC1)C2=NCC(=O)NC3=C2C=C(C=C3)Cl	{32: 1, 35: 1, 11: 5, 14: 4, 15: 2, 17: 1, 25: 1}
Did not match all atoms present	10379-14-3	CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CCCCC3	{1: 1, 35: 1, 33: 1, 11: 5, 14: 4, 15: 2, 17: 1, 25: 1}
Did not match all atoms present	103799-70-8	B(O[C@@H]1C[C@@H](CC[C@H]1C(C)C)C)(O[C@@H]2C[C@@H](CC[C@H]2C(C)C)C)O[C@@H]3C[C@@H](CC[C@H]3C(C)C)C	{11: 9, 1: 9, 3: 3, 12: 9, 22: 3}
Did not match all atoms present	1038-66-0	C1(=C(C(=C(C(=C1F)F)N)F)F)C2=C(C(=C(C(=C2F)F)N)F)F	{16: 8, 30: 2}
Did not match all atoms present	1038-95-5	CC1=CC=C(C=C1)P(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C	{1: 3, 14: 12}
Did not match all atoms present	10380-08-2	OP(=O)(O)OP(=O)(O)OP(=O)(O)O	{20: 5, 29: 3, 22: 2}
Did not match all atoms present	10380-28-6	C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Cu+2]	{35: 2, 14: 12}
Did not match all atoms present	10380-29-7	N.N.N.N.O.[O-]S(=O)(=O)[O-].[Cu+2]	{29: 4}
Did not match all atoms present	10380-31-1	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ba+2].[U].[U]	{}
Did not match all atoms present	10380-77-5	C[N+]1(CCCCC1)CC2CC3=C(O2)C=C(C=C3)C(=O)C4=CC5=C(C=C4)OC(C5)C[N+]6(CCCCC6)C.[I-].[I-]	{1: 2, 2: 2, 11: 12, 12: 2, 14: 6, 19: 2, 23: 2, 24: 1}
Did not match all atoms present	10381-36-9	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ni+2].[Ni+2].[Ni+2]	{29: 8}
Did not match all atoms present	10381-70-1	CC1=CC=C(C=C1)S(=O)CC2=CC=CC=C2	{1: 1, 2: 1, 29: 1, 14: 9}
Did not match all atoms present	10381-75-6	CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Br	{32: 1, 1: 2, 35: 1, 33: 2, 18: 1, 25: 2}
Did not match all atoms present	10385-30-5	C1=CC=C(C=C1)COCCCC(=O)O	{2: 4, 27: 1, 22: 1, 14: 5}
Did not match all atoms present	10387-13-0	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CCl)CCl	{17: 2, 2: 2, 14: 8}
Did not match all atoms present	10388-28-0	[B]Cl	{17: 1}
Did not match all atoms present	10389-51-2	C1COCCN1C2=CC=C(C=C2)[N+](=O)[O-]	{33: 1, 11: 4, 38: 1, 14: 4, 23: 1}
Did not match all atoms present	10389-72-7	CC(C)(CC1=CC=CC=C1Cl)N.Cl	{1: 2, 2: 1, 4: 1, 14: 4, 17: 2, 30: 1}
Did not match all atoms present	10389-73-8	CC(C)(CC1=CC=CC=C1Cl)N	{1: 2, 2: 1, 4: 1, 14: 4, 17: 1, 30: 1}
Did not match all atoms present	10394-64-6	C1=C(C=C(C=C1[N+](=O)[O-])I)N	{38: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	10394-96-4	C1=CC=C(C=C1)C(=C(C#N)C#N)C2=CC=CC=C2	{37: 2, 14: 10, 7: 2}
Did not match all atoms present	10397-30-5	CC1=C(C=C(C=C1)C(=O)Cl)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	10397-58-7	COC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	10397-75-8	CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I	{1: 2, 2: 4, 19: 6, 24: 4, 27: 2, 31: 4}
Did not match all atoms present	10399-73-2	C1=CC=C2C(=C1)C=C3C=CC=CC3=[N+]2[O-]	{33: 1, 29: 1, 14: 9}
Did not match all atoms present	104-01-8	COC1=CC=C(C=C1)CC(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	104-03-0	C1=CC(=CC=C1CC(=O)O)[N+](=O)[O-]	{2: 1, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	104-04-1	CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	104-06-3	CC(=O)NC1=CC=C(C=C1)/C=N/NC(=S)N	{1: 1, 34: 1, 6: 1, 7: 1, 14: 4, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	104-09-6	CC1=CC=C(C=C1)CC=O	{1: 1, 2: 1, 26: 1, 14: 4}
Did not match all atoms present	104-10-9	C1=CC(=CC=C1CCO)N	{2: 2, 20: 1, 30: 1, 14: 4}
Did not match all atoms present	104-11-0	CNCC1=CC=C(C=C1)Cl	{1: 1, 2: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	104-12-1	C1=CC(=CC=C1N=C=O)Cl	{8: 1, 17: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	104-13-2	CCCCC1=CC=C(C=C1)N	{1: 1, 2: 3, 30: 1, 14: 4}
Did not match all atoms present	104-15-4	CC1=CC=C(C=C1)S(=O)(=O)O	{1: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	104-20-1	CC(=O)CCC1=CC=C(C=C1)OC	{24: 1, 1: 2, 2: 2, 22: 1, 14: 4}
Did not match all atoms present	104-21-2	CC(=O)OCC1=CC=C(C=C1)OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	104-23-4	C1=CC(=CC=C1N)N=NC2=CC=C(C=C2)S(=O)(=O)O	{30: 1, 34: 2, 20: 1, 29: 2, 14: 8}
Did not match all atoms present	104-24-5	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)Cl	{24: 1, 17: 1, 34: 2, 14: 9}
Did not match all atoms present	104-28-9	CCOCCOC(=O)/C=C/C1=CC=C(C=C1)OC	{1: 2, 2: 3, 6: 2, 14: 4, 22: 2, 28: 1}
Did not match all atoms present	104-29-0	C1=CC(=CC=C1OCC(CO)O)Cl	{2: 2, 3: 1, 14: 4, 17: 1, 20: 2, 22: 1}
Did not match all atoms present	104-30-3	CC(=O)OCCC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 2, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	104-32-5	C1=CC(=CC=C1C(=N)N)OCCCOC2=CC=C(C=C2)C(=N)N	{2: 3, 36: 2, 7: 2, 14: 8, 22: 2, 30: 2}
Did not match all atoms present	104-36-9	CCCCOC1=CC=C(C=C1)OCCCC	{1: 2, 2: 6, 22: 2, 14: 4}
Did not match all atoms present	104-38-1	C1=CC(=CC=C1OCCO)OCCO	{2: 4, 20: 2, 22: 2, 14: 4}
Did not match all atoms present	104-39-2	CC1=CC=C(C=C1)OCCOCCO	{1: 1, 2: 4, 20: 1, 22: 2, 14: 4}
Did not match all atoms present	104-40-5	CCCCCCCCCC1=CC=C(C=C1)O	{1: 1, 2: 8, 21: 1, 14: 4}
Did not match all atoms present	104-41-6	CCCCCCCCCCCCC1=CC=C(C=C1)C	{1: 2, 2: 11, 14: 4}
Did not match all atoms present	104-42-7	CCCCCCCCCCCCC1=CC=C(C=C1)N	{1: 1, 2: 11, 30: 1, 14: 4}
Did not match all atoms present	104-43-8	CCCCCCCCCCCCC1=CC=C(C=C1)O	{1: 1, 2: 11, 21: 1, 14: 4}
Did not match all atoms present	104-45-0	CCCC1=CC=C(C=C1)OC	{1: 2, 2: 2, 22: 1, 14: 4}
Did not match all atoms present	104-46-1	CC=CC1=CC=C(C=C1)OC	{1: 2, 22: 1, 14: 4, 6: 2}
Did not match all atoms present	104-47-2	COC1=CC=C(C=C1)CC#N	{1: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	104-49-4	C1=CC(=CC=C1N=C=O)N=C=O	{8: 2, 34: 2, 29: 2, 14: 4}
Did not match all atoms present	104-51-8	CCCCC1=CC=CC=C1	{1: 1, 2: 3, 14: 5}
Did not match all atoms present	104-52-9	C1=CC=C(C=C1)CCCCl	{17: 1, 2: 3, 14: 5}
Did not match all atoms present	104-53-0	C1=CC=C(C=C1)CCC=O	{2: 2, 26: 1, 14: 5}
Did not match all atoms present	104-54-1	C1=CC=C(C=C1)/C=C/CO	{2: 1, 20: 1, 14: 5, 6: 2}
Did not match all atoms present	104-55-2	C1=CC=C(C=C1)/C=C/C=O	{26: 1, 14: 5, 6: 2}
Did not match all atoms present	104-57-4	C1=CC=C(C=C1)COC=O	{2: 1, 26: 1, 14: 5}
Did not match all atoms present	104-62-1	C1=CC=C(C=C1)CCOC=O	{2: 2, 26: 1, 14: 5}
Did not match all atoms present	104-63-2	C1=CC=C(C=C1)CNCCO	{2: 3, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	104-64-3	C1=CC=C(C=C1)CCCOC=O	{2: 3, 26: 1, 14: 5}
Did not match all atoms present	104-65-4	C1=CC=C(C=C1)C=CCOC=O	{2: 1, 26: 1, 14: 5, 6: 2}
Did not match all atoms present	104-66-5	C1=CC=C(C=C1)OCCOC2=CC=CC=C2	{2: 2, 22: 2, 14: 10}
Did not match all atoms present	104-68-7	C1=CC=C(C=C1)OCCOCCO	{2: 4, 20: 1, 22: 2, 14: 5}
Did not match all atoms present	104-69-8	C1=CC=C(C=C1)NCCCNC2=CC=CC=C2	{2: 3, 14: 10, 31: 2}
Did not match all atoms present	104-71-2	C1=CC=C(C=C1)C=NCCN=CC2=CC=CC=C2	{2: 2, 34: 2, 14: 10, 6: 2}
Did not match all atoms present	104-72-3	CCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 9, 14: 5}
Did not match all atoms present	104-81-4	CC1=CC=C(C=C1)CBr	{1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	104-82-5	CC1=CC=C(C=C1)CCl	{1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	104-83-6	C1=CC(=CC=C1CCl)Cl	{17: 2, 2: 1, 14: 4}
Did not match all atoms present	104-84-7	CC1=CC=C(C=C1)CN	{1: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	104-85-8	CC1=CC=C(C=C1)C#N	{1: 1, 37: 1, 14: 4}
Did not match all atoms present	104-86-9	C1=CC(=CC=C1CN)Cl	{17: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	104-87-0	CC1=CC=C(C=C1)C=O	{1: 1, 26: 1, 14: 4}
Did not match all atoms present	104-88-1	C1=CC(=CC=C1C=O)Cl	{17: 1, 26: 1, 14: 4}
Did not match all atoms present	104-90-5	CCC1=CN=C(C=C1)C	{1: 2, 2: 1, 35: 1, 14: 3}
Did not match all atoms present	104-91-6	C1=CC(=CC=C1N=O)O	{34: 1, 21: 1, 14: 4, 29: 1}
Did not match all atoms present	104-92-7	COC1=CC=C(C=C1)Br	{1: 1, 18: 1, 22: 1, 14: 4}
Did not match all atoms present	104-93-8	CC1=CC=C(C=C1)OC	{1: 2, 22: 1, 14: 4}
Did not match all atoms present	104-94-9	COC1=CC=C(C=C1)N	{1: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	104-95-0	CSC1=CC=C(C=C1)Br	{40: 1, 1: 1, 18: 1, 14: 4}
Did not match all atoms present	104-96-1	CSC1=CC=C(C=C1)N	{40: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	104-98-3	C1=C(NC=N1)/C=C/C(=O)O	{32: 1, 35: 1, 27: 1, 14: 2, 6: 2}
Did not match all atoms present	10401-11-3	C#CC1=CC(=CC=C1)O	{9: 1, 10: 1, 21: 1, 14: 4}
Did not match all atoms present	10402-15-0	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Cu]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	10402-33-2	COC1=C(C=CC(=C1)CC=C)OC(=O)CC2=CC=CC=C2	{1: 1, 2: 2, 5: 1, 6: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	10402-52-5	CC(COC(=O)C)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	10402-53-6	CCOC(CN1CCN(CC1)CC(C)C(=O)C2=CC=CC=C2)C3=CC=CC=C3.Cl.Cl	{1: 2, 2: 3, 3: 2, 33: 2, 11: 4, 14: 10, 17: 2, 22: 1, 24: 1}
Did not match all atoms present	10402-90-1	CCOC(CN1CCN(CC1)CC(C)C(=O)C2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 2: 3, 3: 2, 33: 2, 11: 4, 14: 10, 22: 1, 24: 1}
Did not match all atoms present	10403-47-1	C1=CC(=C(C=C1[N+](=O)[O-])N)Br	{18: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	104040-78-0	COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC=N2)C(F)(F)F)OC	{1: 2, 35: 3, 4: 1, 14: 4, 16: 3, 22: 2, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	10405-02-4	C1CC[N+]2(C1)C3CCC2CC(C3)OC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O.[Cl-]	{4: 1, 11: 8, 12: 3, 14: 10, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	10405-52-4	CC1=CC=C(C=C1)S(=O)(=O)NC(C)(COS(=O)(=O)C2=CC=C(C=C2)C)COS(=O)(=O)C3=CC=C(C=C3)C	{1: 4, 2: 2, 4: 1, 14: 12, 22: 2, 29: 6, 31: 1}
Did not match all atoms present	104056-62-4	CCNC1=NC(=NC(=N1)SSSSC2=NC(=NC(=N2)N(CC)CC)NCC)N(CC)CC	{1: 6, 2: 6, 35: 6, 33: 2, 40: 4, 31: 2}
Did not match all atoms present	104089-71-6	C1=CC=C(C(=C1)/C=C(\C#N)/C2=CC=C(C=C2)Cl)[N+](=O)[O-]	{37: 1, 38: 1, 7: 1, 14: 8, 17: 1, 6: 1}
Did not match all atoms present	104089-72-7	C1=CC(=CC(=C1)[N+](=O)[O-])/C=C(\C#N)/C2=CC=C(C=C2)Cl	{37: 1, 38: 1, 7: 1, 14: 8, 17: 1, 6: 1}
Did not match all atoms present	104089-73-8	C1=CC(=CC=C1/C=C(\C#N)/C2=CC=C(C=C2)Cl)[N+](=O)[O-]	{37: 1, 38: 1, 7: 1, 14: 8, 17: 1, 6: 1}
Did not match all atoms present	104089-74-9	C1OC2=C(O1)C=C(C=C2)/C=C(\C#N)/C3=CC=C(C=C3)Cl	{37: 1, 6: 1, 7: 1, 11: 1, 14: 7, 17: 1, 23: 2}
Did not match all atoms present	10409-06-0	C1=CC=C(C=C1)S(=O)(=O)S(=O)(=O)C2=CC=CC=C2	{29: 4, 14: 10}
Did not match all atoms present	10409-54-8	CC(C)(C(=O)C1=CC=CC=C1)Br	{24: 1, 1: 2, 18: 1, 4: 1, 14: 5}
Did not match all atoms present	10410-35-2	CC1=CC2=C(C=C1)OC=C2C	{1: 2, 14: 4, 23: 1}
Did not match all atoms present	10411-85-5	COC1=C(C=CC(=C1C(=O)Cl)Cl)Cl	{24: 1, 1: 1, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	104133-09-7	C[Si](C)(C)O[Si](O)(O)O	{1: 3, 20: 3, 22: 1}
Did not match all atoms present	10415-75-5	[N+](=O)([O-])[O-].[Hg+]	{}
Did not match all atoms present	10415-87-9	CCC(C)(CCC1=CC=CC=C1)O	{1: 2, 2: 3, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	10415-88-0	CC(CCC1=CC=CC=C1)OC(=O)C	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	10416-59-8	CC(=N[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 34: 1, 22: 1, 7: 1}
Did not match all atoms present	10416-67-8	C[Si](C)(C)N1C(=O)C2=CC=CC=C2C1=O	{1: 3, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	104164-54-7	C[Si](C)C.C[Si](C)C.C[Si](C)C.[Ge]	{1: 9}
Did not match all atoms present	10418-03-8	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(CC5=C(C4)NN=C5)C	{32: 1, 1: 3, 35: 1, 11: 8, 12: 4, 13: 3, 14: 1, 20: 1}
Did not match all atoms present	10419-75-7	[1H]C([1H])([1H])C([1H])([1H])C#N	{1: 1, 2: 1, 37: 1}
Did not match all atoms present	10419-79-1	CCOP(=O)(CCCl)OCC	{1: 2, 2: 4, 29: 1, 22: 2, 17: 1}
Did not match all atoms present	104196-23-8	C1=CC=C(C=C1)[C@H]2[C@@H](O2)CO	{20: 1, 2: 1, 12: 2, 14: 5, 23: 1}
Did not match all atoms present	10420-89-0	C[C@@H](C1=CC=CC2=CC=CC=C21)N	{1: 1, 3: 1, 30: 1, 14: 7}
Did not match all atoms present	10421-48-4	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Fe+3]	{}
Did not match all atoms present	10421-85-9	C1=CC=C(C(=C1)C(C(=O)O)O)Cl	{27: 1, 17: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	104222-34-6	C1=C(C(=CC(=C1Cl)F)[N+](=O)[O-])N	{16: 1, 17: 1, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	10423-86-6	CCN(CCOC(=O)COC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)C	{1: 2, 2: 4, 38: 1, 33: 1, 34: 2, 14: 12, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	10424-65-4	C[N+](C)(C)C.O.O.O.O.O.[OH-]	{1: 4}
Did not match all atoms present	10425-05-5	CC(C)(C)C1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2	{24: 1, 1: 3, 4: 1, 21: 1, 14: 8}
Did not match all atoms present	10425-11-3	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)O)O	{24: 1, 21: 2, 14: 8}
Did not match all atoms present	104255-97-2	CC(C)(C)[Si](C)(C)OC(=O)CCCCCCCC(=O)O[Si](C)(C)C(C)(C)C	{1: 10, 2: 7, 4: 2, 28: 2}
Did not match all atoms present	104255-98-3	CC(C)(C)[Si](C)(C)OC(=O)CCCCCCCCC(=O)O[Si](C)(C)C(C)(C)C	{1: 10, 2: 8, 4: 2, 28: 2}
Did not match all atoms present	10427-00-6	C1CC(OC1)COP(=O)(OCC2CCCO2)OCC3CCCO3	{2: 3, 11: 9, 12: 3, 22: 3, 23: 3, 29: 1}
Did not match all atoms present	10428-19-0	CCCC[Sn](CCCC)(O[Sn](CCCC)(CCCC)Cl)Cl	{1: 4, 2: 12, 22: 1, 17: 2}
Did not match all atoms present	10428-57-6	C[Si](C)(C)CSC	{40: 1, 1: 4, 2: 1}
Did not match all atoms present	10429-82-0	C1=CC=C(C=C1)CN(CCCl)CCCl.Cl	{17: 3, 2: 5, 14: 5, 33: 1}
Did not match all atoms present	104295-55-8	CNS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)N	{1: 1, 30: 1, 29: 2, 14: 6, 31: 1}
Did not match all atoms present	10431-47-7	[O-][Se](=O)[O-].[K+].[K+]	{29: 3}
Did not match all atoms present	104316-83-8	C1=C[NH+]=CC=C1C(=O)O.C1=C[NH+]=CC=C1C(=O)O.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]	{32: 2, 27: 2, 22: 1, 14: 8, 29: 6}
Did not match all atoms present	10432-22-1	C1C(C1(C#N)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3	{37: 1, 38: 1, 11: 1, 12: 1, 13: 1, 14: 9}
Did not match all atoms present	104322-63-6	CC1(C2CCC13CS(=O)(=O)N4C3(C2)O4)C	{1: 2, 33: 1, 11: 4, 12: 1, 13: 3, 23: 1, 29: 2}
Did not match all atoms present	104326-94-5	C1=CC(=C(C(=C1)Cl)F)C(=O)N	{16: 1, 17: 1, 30: 1, 14: 3, 24: 1}
Did not match all atoms present	10433-06-4	CC[O-].CC[O-].CC[O-].[Sb+3]	{1: 3, 2: 3, 29: 3}
Did not match all atoms present	10433-33-7	C[Si](C)(C)NCCC1=CC=CC=C1	{1: 3, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	10433-41-7	COC(=O)C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)OC.[K+]	{1: 2, 28: 2, 29: 3, 14: 3}
Did not match all atoms present	10433-59-7	C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)[O-].[Na+]	{24: 1, 17: 2, 2: 3, 22: 1, 14: 3}
Did not match all atoms present	10435-35-5	C1=C(C=C(C(=C1[N+](=O)[O-])N)CCO)N	{2: 2, 38: 1, 20: 1, 30: 2, 14: 2}
Did not match all atoms present	10435-67-3	C1=CC=C(C=C1)C2=CC=C3C4=CC=CC=C4C=C3O2	{14: 12, 23: 1}
Did not match all atoms present	10435-68-4	CC1=C(OC2=CC3=CC=CC=C3C2=C1C)C	{1: 3, 14: 5, 23: 1}
Did not match all atoms present	10439-23-3	CC1=CC=C(C=C1)S(=O)Cl	{1: 1, 29: 1, 14: 4, 17: 1}
Did not match all atoms present	10439-94-8	CC(C)[C@](CC1=CC=C(C=C1)OC2=CC=C(C=C2)O)(C(=O)O)N(I)I	{1: 2, 2: 1, 3: 1, 4: 1, 33: 1, 14: 8, 19: 2, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	10441-57-3	CN1CCCC1=S	{1: 1, 11: 3, 33: 1, 15: 1}
Did not match all atoms present	10442-11-2	C(C[O-])N(CC[O-])CC[O-].[OH-].[Ti+4]	{33: 1, 2: 6, 29: 3}
Did not match all atoms present	10442-39-4	CCCC[N+](CCCC)(CCCC)CCCC.[C-]#N	{1: 4, 2: 12}
Did not match all atoms present	10443-70-6	CCOC(=O)CCCOC1=C(C=C(C=C1)Cl)C	{1: 2, 2: 4, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	10444-59-4	C1=CC=C(C=C1)/C=N/NC2=NNN=N2	{32: 1, 34: 1, 35: 3, 6: 1, 14: 5, 31: 1}
Did not match all atoms present	10444-89-0	C1(=NN=C(S1)N)C(F)(F)F	{16: 3, 41: 1, 35: 2, 4: 1, 30: 1}
Did not match all atoms present	104451-70-9	C1=CC(=C(C(=C1F)C=O)F)F	{16: 3, 26: 1, 14: 2}
Did not match all atoms present	10447-38-8	C1CN2CCC1C(C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.Cl	{33: 1, 4: 1, 11: 5, 12: 2, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	10447-93-5	CC1=CN=CN1C	{1: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	104475-16-3	O.[Am]	{}
Did not match all atoms present	10448-09-6	C[Si]1(O[Si](O[Si](O[Si](O1)(C)C)(C)C2=CC=CC=C2)(C)C)C	{1: 7, 14: 5, 23: 4}
Did not match all atoms present	10449-13-5	CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NC5=C(C=C(C=C5)C)S(=O)(=O)O)S(=O)(=O)O	{1: 2, 14: 10, 20: 2, 21: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	10449-71-5	CCCCCCCCCCCCCCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 75}
Did not match all atoms present	104499-08-3	CC(C)[C@H]1COC(=S)N1	{32: 1, 1: 2, 3: 1, 11: 1, 12: 1, 15: 1, 23: 1}
Did not match all atoms present	1045-21-2	CCN(CC)CCOCCOC(=O)C1(CCCC1)C2=CC=CC=C2.Cl	{1: 2, 2: 6, 33: 1, 11: 4, 13: 1, 14: 5, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	10450-55-2	CC(=O)O.CC(=O)O.O.[Fe]	{1: 2, 27: 2}
Did not match all atoms present	10450-69-8	CCCCCCCCC=CCCCCCCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 15, 6: 2, 17: 1}
Did not match all atoms present	104504-33-8	CC(C)(C1=CC(=C(C(=C1)Br)OCCOC(=O)C=C)Br)C2=CC(=C(C(=C2)Br)OCCOC(=O)C=C)Br	{1: 2, 2: 4, 4: 1, 5: 2, 6: 2, 14: 4, 18: 4, 22: 2, 28: 2}
Did not match all atoms present	104514-49-0	C1=CC(=C(C(=C1)Br)Br)Cl	{17: 1, 18: 2, 14: 3}
Did not match all atoms present	10453-86-8	CC(=CC1C(C1(C)C)C(=O)OCC2=COC(=C2)CC3=CC=CC=C3)C	{1: 4, 2: 2, 6: 1, 7: 1, 12: 2, 13: 1, 14: 7, 23: 1, 28: 1}
Did not match all atoms present	104540-42-3	C1=CC(=C(C(=C1)F)Br)C(F)(F)F	{16: 4, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	10457-14-4	C[Si](C)(C)OC1=NC(=NC=C1)O[Si](C)(C)C	{1: 6, 35: 2, 22: 2, 14: 2}
Did not match all atoms present	10457-58-6	CCCCC1=C2C=CC3=CC=CC=C3C2=NC4=C1C5=CC=CC=C5C=C4	{1: 1, 2: 3, 35: 1, 14: 12}
Did not match all atoms present	10457-59-7	CC(C)C1=C2C(=NC3=C1C4=CC=CC=C4C=C3)C=CC5=CC=CC=C52	{1: 2, 3: 1, 14: 12, 35: 1}
Did not match all atoms present	10457-90-6	C1CN(CCC1(C2=CC=C(C=C2)Br)O)CCCC(=O)C3=CC=C(C=C3)F	{33: 1, 2: 3, 11: 4, 13: 1, 14: 8, 16: 1, 18: 1, 20: 1, 24: 1}
Did not match all atoms present	104594-70-9	C1=CC=C(C=C1)CCOC(=O)/C=C/C2=CC(=C(C=C2)O)O	{2: 2, 28: 1, 14: 8, 6: 2, 21: 2}
Did not match all atoms present	1046-56-6	C1=CC=C(C=C1)C2=C(N=NC(=N2)C3=CC=CC=N3)C4=CC=CC=C4	{35: 4, 14: 14}
Did not match all atoms present	10461-98-0	C1CCC(=C(C#N)C2=CC=CC=C2)CC1	{15: 1, 11: 5, 37: 1, 14: 5, 7: 1}
Did not match all atoms present	10463-20-4	C1=CC(=C(C=C1CC(=O)O)[N+](=O)[O-])O	{38: 1, 2: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	104639-49-8	CN=C1CN(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)O.N(=O)[O-].[Na+]	{1: 1, 34: 2, 35: 1, 33: 1, 11: 1, 14: 8, 15: 2, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	104642-21-9	C/1/C=C\C2=CC=CC3=C4C(=C23)C(=CC=C4)/C=C1	{11: 1, 14: 10}
Did not match all atoms present	10465-10-8	CC[C@H](C1=CC(=C(C=C1)O)C)[C@@H](CC)C2=CC(=C(C=C2)O)C	{1: 4, 2: 2, 3: 2, 21: 2, 14: 6}
Did not match all atoms present	10465-27-7	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Sm+3]	{24: 3, 1: 3}
Did not match all atoms present	10466-65-6	[O-][Re](=O)(=O)=O.[K+]	{29: 4}
Did not match all atoms present	10469-09-7	C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)Cl	{17: 4, 27: 1, 35: 1}
Did not match all atoms present	10469-81-5	C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC=CC=C3OC4=CC=CC=C4	{22: 3, 14: 18}
Did not match all atoms present	10469-83-7	C1=CC=C(C=C1)OC2=CC=C(C=C2)OC3=CC=CC(=C3)OC4=CC=CC=C4	{22: 3, 14: 18}
Did not match all atoms present	104713-91-9	C1C2=CC=CC=C(C2=O)CC3=CC=CC=C1C3=O	{25: 2, 11: 2, 14: 8}
Did not match all atoms present	10472-97-6	C1=CC=C(C=C1)CCCCCCCCO	{2: 8, 20: 1, 14: 5}
Did not match all atoms present	104728-29-2	CCCCN1C(=C(N(P1(=O)CC)CCCC)C)C	{1: 5, 2: 7, 33: 2, 29: 1, 15: 2}
Did not match all atoms present	10473-64-0	CCNC(=O)OC(C#C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 4: 1, 9: 1, 10: 1, 14: 10, 28: 1, 31: 1}
Did not match all atoms present	10473-70-8	C#CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OC(=O)N	{4: 1, 9: 1, 10: 1, 14: 9, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	10473-98-0	C#CC(C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)N3CCCC3	{33: 1, 4: 1, 9: 1, 10: 1, 11: 4, 14: 10, 28: 1}
Did not match all atoms present	10476-81-0	[Br-].[Br-].[Sr+2]	{18: 2}
Did not match all atoms present	10476-85-4	[Cl-].[Cl-].[Sr+2]	{17: 2}
Did not match all atoms present	10476-86-5	[Sr+2].[I-].[I-]	{19: 2}
Did not match all atoms present	10477-72-2	C1=CC(=CC=C1CC(=O)O)N(CCCl)CCCl	{17: 2, 2: 5, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	10477-99-3	CC(C)OC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 3: 1, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	104775-36-2	CNC(=O)C1=CC(=CC=C1)NCC(=O)NCCC2=CC(=C(C=C2)OC)OC	{1: 3, 2: 3, 14: 7, 22: 2, 24: 2, 31: 3}
Did not match all atoms present	10478-01-0	CC(C)COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 2, 14: 3, 28: 1}
Did not match all atoms present	10478-02-1	CCCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	10478-03-2	CCCCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 4, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	10478-04-3	CCCCCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 5, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	10478-06-5	CCCCCCCCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 7, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	10478-07-6	C1=CC=C(C=C1)COC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]	{2: 1, 28: 1, 38: 2, 14: 8}
Did not match all atoms present	104782-63-0	COC1=CC=CC(=C1O)CC(CS(=O)(=O)[O-])OC2=C(C=C(C=C2)CCCS(=O)(=O)[O-])OC.[Ca+2]	{1: 2, 2: 5, 3: 1, 14: 6, 21: 1, 22: 3, 29: 6}
Did not match all atoms present	104789-79-9	CC(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=CC(=CC(=C5O)CC6=C(C(=CC(=C6)C(C)C)CC7=C(C(=CC(=C7)C(C)C)C2)O)O)C(C)C)C(C)C)C(C)C)O	{11: 6, 1: 12, 3: 6, 21: 6, 14: 12}
Did not match all atoms present	10479-25-1	CCN(CC1=CC=CC=C1)CC2=CC=CC=C2	{1: 1, 2: 3, 14: 10, 33: 1}
Did not match all atoms present	10479-30-8	CC(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2	{24: 1, 1: 1, 2: 2, 14: 10, 33: 1}
Did not match all atoms present	104795-68-8	CC(C)OC1=C(SC2=C1C=C(C=C2)OC)C(=O)NC3=NN=N[N-]3.[Na+]	{1: 3, 3: 1, 41: 1, 14: 3, 35: 4, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	1048-05-1	C1=CC=C(C=C1)[Ge](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{14: 20}
Did not match all atoms present	1048-08-4	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{14: 20}
Did not match all atoms present	104815-18-1	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)Cl)O)/C2=O.C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)Cl)O)/C2=O.[NH4+].[Fe]	{34: 2, 14: 26, 15: 4, 17: 2, 21: 2, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	10482-79-8	CC(CCC=C(C)C)CCOC(=O)C=CC1=CC=CC=C1	{1: 3, 2: 4, 3: 1, 6: 3, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	104820-96-4	CC[C@@]1([C@H]([C@@H]([C@@]([C@]1(C)O)(COC(=O)C2=C(C=CC=C2O)C)O)NC3=CC=CC(=C3)C(=O)C)N)NC(=O)N(C)C	{1: 6, 2: 2, 33: 1, 12: 2, 13: 3, 14: 7, 20: 2, 21: 1, 24: 2, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	10484-09-0	C=CCOC(=O)C1=CC=CC=C1O	{2: 1, 5: 1, 6: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	10484-13-6	CC(=O)OC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC	{1: 2, 34: 1, 6: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	10484-36-3	CCCCCOC1=C(C=C(C=C1)C=CC)OC	{1: 3, 2: 4, 22: 2, 14: 3, 6: 2}
Did not match all atoms present	10486-12-1	CC(CCCC(=C)C)CCOC(=O)C1=CC=CC=C1	{1: 2, 2: 5, 3: 1, 5: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	10486-25-6	CC1CC(C=C(C2C1CC(=C(C)C)C2)C)OC=O	{1: 4, 7: 1, 11: 3, 12: 4, 14: 1, 15: 2, 26: 1}
Did not match all atoms present	10486-47-2	CC1=CC(=C(C(=C1O)C)C)N.Cl	{1: 3, 30: 1, 21: 1, 14: 1, 17: 1}
Did not match all atoms present	10486-48-3	CC1=CC(=CC(=C1O)C)N.Cl	{1: 2, 30: 1, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	10486-58-5	C1=CC=C2C(=C1)NC(=S)[Se]2	{32: 1, 14: 4}
Did not match all atoms present	10486-61-0	C1=CSC=C1I	{41: 1, 19: 1, 14: 3}
Did not match all atoms present	10487-55-5	CC(=O)C1=CC(=C2C1=CC=CC=C2)C(=O)C	{24: 2, 1: 2, 14: 6}
Did not match all atoms present	10487-96-4	C1CCC(C1)(C2=CC=CC=C2)O	{11: 4, 20: 1, 13: 1, 14: 5}
Did not match all atoms present	10488-36-5	CC1=CC=CC=C1C(C2=CC=CC=C2)OCC[NH2+]C.[Cl-]	{1: 2, 2: 2, 3: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	10488-87-6	CCOC(=O)C(C)C(=O)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	10489-46-0	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Rh+3].[Rh+3]	{29: 12}
Did not match all atoms present	10489-99-3	C[N+](C)(CCO)[O-]	{1: 2, 2: 2, 20: 1, 29: 1}
Did not match all atoms present	1049-38-3	CCN\1C2=CC=CC=C2[Se]/C1=C\C=C\C3=[N+](C4=CC=CC=C4[Se]3)CC.[I-]	{1: 2, 2: 2, 6: 3, 33: 2, 14: 8, 15: 1, 19: 1}
Did not match all atoms present	10493-37-5	COC1=CC=CC=C1CCCO	{1: 1, 2: 3, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	10493-50-2	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCC(C)(C)COC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C	{1: 14, 2: 6, 4: 5, 14: 4, 21: 2, 28: 2}
Did not match all atoms present	104931-87-5	C1C[C@H]([C@H](O[C@@H]1CN)O[C@@H]2[C@H](C[C@H]([C@@H]([C@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)O)NC(=O)[C@H](CCN)O)N)N.OS(=O)(=O)O	{2: 4, 3: 1, 11: 3, 12: 13, 20: 7, 22: 2, 23: 2, 24: 1, 29: 2, 30: 5, 31: 1}
Did not match all atoms present	104934-52-3	CCCCCCCCCCCCC1=CSC=C1	{1: 1, 2: 11, 14: 3, 41: 1}
Did not match all atoms present	10495-45-1	CC(C)CS(=O)(=O)CC(C)C	{1: 4, 2: 2, 3: 2, 29: 2}
Did not match all atoms present	104968-58-3	COC1=CC(=CC(=C1)N=C=S)OC	{8: 1, 1: 2, 34: 1, 22: 2, 14: 3}
Did not match all atoms present	10497-05-9	C[Si](C)(C)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 29: 1, 22: 3}
Did not match all atoms present	104977-53-9	CCCCC(CC)COC(=O)C(=C)C.CC1=CC=C(C=C1)C=C.C=CC=C	{1: 4, 2: 5, 3: 1, 5: 4, 6: 3, 7: 1, 14: 4, 28: 1}
Did not match all atoms present	10498-57-4	CP(C)C1=CC=C(C=C1)P(C)C	{1: 4, 14: 4}
Did not match all atoms present	105-01-1	CC(C)COC(=O)CCC1=CC=CO1	{1: 2, 2: 3, 3: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	105-05-5	CCC1=CC=C(C=C1)CC	{1: 2, 2: 2, 14: 4}
Did not match all atoms present	105-06-6	C=CC1=CC=C(C=C1)C=C	{14: 4, 5: 2, 6: 2}
Did not match all atoms present	105-07-7	C1=CC(=CC=C1C=O)C#N	{26: 1, 37: 1, 14: 4}
Did not match all atoms present	105-09-9	C1=CC(=CC=C1CS)CS	{2: 2, 14: 4, 39: 2}
Did not match all atoms present	105-11-3	C1=CC(=CC=C1NO)N=O	{34: 1, 20: 1, 29: 1, 14: 4, 31: 1}
Did not match all atoms present	105-12-4	C1=CC(=CC=C1N=O)N=O	{34: 2, 29: 2, 14: 4}
Did not match all atoms present	105-13-5	COC1=CC=C(C=C1)CO	{1: 1, 2: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	105-20-4	C1=C(NN=C1)CCN	{32: 1, 2: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	105-55-5	CCNC(=S)NCC	{1: 2, 2: 2, 31: 2, 7: 1}
Did not match all atoms present	105-58-8	CCOC(=O)OCC	{1: 2, 2: 2}
Did not match all atoms present	105-64-6	CC(C)OC(=O)OOC(=O)OC(C)C	{1: 4, 3: 2}
Did not match all atoms present	105-65-7	CC(C)OC(=S)SSC(=S)OC(C)C	{40: 2, 1: 4, 3: 2, 22: 2, 7: 2}
Did not match all atoms present	105-67-9	CC1=CC(=C(C=C1)O)C	{1: 2, 21: 1, 14: 3}
Did not match all atoms present	105-77-1	CCCCOC(=S)SSC(=S)OCCCC	{40: 2, 1: 2, 2: 6, 22: 2, 7: 2}
Did not match all atoms present	105-85-1	CC(CCC=C(C)C)CCOC=O	{1: 3, 2: 4, 3: 1, 6: 1, 7: 1, 26: 1}
Did not match all atoms present	105-86-2	CC(=CCCC(=CCOC=O)C)C	{1: 3, 2: 3, 26: 1, 6: 2, 7: 2}
Did not match all atoms present	1050-79-9	CC1=CC=C(C=C1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)O	{1: 1, 2: 3, 33: 1, 11: 4, 13: 1, 14: 8, 16: 1, 20: 1, 24: 1}
Did not match all atoms present	10500-57-9	C1CCC2=C(C1)C=CC=N2	{35: 1, 11: 4, 14: 3}
Did not match all atoms present	105025-74-9	CC1=NN(C(=O)C1N=NC2=CC=CC=C2C(=O)O)C3=CC=CC=C3	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 9, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	10504-04-8	CC1=CC(=C(O1)C)C	{1: 3, 14: 1, 23: 1}
Did not match all atoms present	10504-99-1	C1=CC=C(C=C1)[Se](=O)(=O)C2=CC=CC=C2	{29: 2, 14: 10}
Did not match all atoms present	10505-40-5	CCN1CCSC1=CC=C2C(=O)N(C(=S)S2)CC	{1: 2, 2: 2, 6: 2, 33: 2, 41: 2, 11: 2, 15: 3, 25: 1}
Did not match all atoms present	10505-41-6	CCN1CCSC1=CC=C2C(=O)N(C(=S)O2)CC	{1: 2, 2: 2, 6: 2, 33: 2, 41: 1, 11: 2, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	10505-45-0	CCN1C(=O)C(=C2N(CCS2)C)SC1=S	{1: 2, 2: 1, 33: 2, 41: 2, 11: 2, 15: 3, 25: 1}
Did not match all atoms present	10507-71-8	CC1=CC=C(N1N2C(=CC=C2C)C)C	{1: 4, 14: 4, 33: 2}
Did not match all atoms present	10510-77-7	CC[N+]1=C2C=CC=CC2=NC3=CC=CC=C31.CCOS(=O)(=O)[O-]	{1: 2, 2: 2, 35: 1, 33: 1, 14: 8, 22: 1, 29: 3}
Did not match all atoms present	10513-96-9	C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C(=O)C4=CC=CC=C4C3=O	{25: 4, 2: 3, 14: 8, 33: 2}
Did not match all atoms present	10514-60-0	CCOC(=O)C1=CN(N=C1C(=O)OCC)C	{1: 3, 2: 2, 35: 1, 33: 1, 14: 1, 28: 2}
Did not match all atoms present	10516-71-9	COC1=CC=CC(=C1)CCC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	10517-21-2	C1=CC2=C(C=C1Cl)C=C(N2)C(=O)O	{32: 1, 17: 1, 27: 1, 14: 4}
Did not match all atoms present	10517-29-0	COC1=CC(=CC(=C1O[Si](C)(C)C)OC)C(=O)O[Si](C)(C)C	{1: 8, 28: 1, 22: 3, 14: 2}
Did not match all atoms present	10517-30-3	C[Si](C)(C)OC1=CC=C(C=C1)C=CC(=O)O[Si](C)(C)C	{1: 6, 22: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	105184-38-1	C1=C(C=C(C=C1F)F)CC(=O)O	{16: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	10519-06-9	CCCCOC1=CC=C(C=C1)C	{1: 2, 2: 3, 22: 1, 14: 4}
Did not match all atoms present	10519-12-7	C1CCC2CC(CCC2C1)OC=O	{26: 1, 11: 7, 12: 3}
Did not match all atoms present	10519-87-6	C[Si](C)(C=C)C=C	{1: 2, 5: 2, 6: 2}
Did not match all atoms present	10519-88-7	C=CC[Si](CC=C)(C1=CC=CC=C1)C2=CC=CC=C2	{2: 2, 14: 10, 5: 2, 6: 2}
Did not match all atoms present	10519-96-7	C[Si](C)(C)[O-].[K+]	{1: 3, 29: 1}
Did not match all atoms present	10519-97-8	C[Si](C)(C)NCC=C	{1: 3, 2: 1, 5: 1, 6: 1, 31: 1}
Did not match all atoms present	1052-92-2	C1=CC(=C(C=C1OC2=C(C=C(C=C2I)CC(=O)O)I)I)O.C(CO)NCCO	{2: 5, 14: 5, 19: 3, 20: 2, 21: 1, 22: 1, 27: 1, 31: 1}
Did not match all atoms present	10521-91-2	C1=CC=C(C=C1)CCCCCO	{2: 5, 20: 1, 14: 5}
Did not match all atoms present	10522-02-8	CC(=O)OC(CO)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	10526-07-5	C1=CC(=CC(=C1)OC2=CC(=CC=C2)OC3=CC=CC(=C3)N)N	{30: 2, 22: 2, 14: 12}
Did not match all atoms present	105267-82-1	CC(C)(C)[C-]1P[C-](P1)C(C)(C)C.[CH-]1C=CC=C1.[Co]	{1: 6, 4: 2, 14: 5, 15: 2}
Did not match all atoms present	10527-11-4	CC1(CC(C2=C1C=CC(=C2)O)(C)C3=CC=C(C=C3)O)C	{1: 3, 11: 1, 13: 2, 14: 7, 21: 2}
Did not match all atoms present	105294-78-8	CCN(CC)C1=CC=C(C=C1)NC2=CC(=NC(=O)C(C)C)C(=O)C=C2	{1: 4, 2: 2, 3: 1, 33: 1, 34: 1, 14: 7, 15: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	105294-79-9	CCN(CC)C1=CC(=C(C=C1)NC2=CC(=NC(=O)C(C)C)C(=O)C=C2)C	{1: 5, 2: 2, 3: 1, 33: 1, 34: 1, 14: 6, 15: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	105296-07-9	CCN(CC)C1=CC(=C(C=C1)NC2=CC(=NC(=O)C)C(=O)C=C2C)C	{1: 5, 2: 2, 33: 1, 34: 1, 14: 5, 15: 3, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	1053-74-3	CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)C	{1: 2, 2: 3, 33: 3, 41: 1, 11: 4, 14: 7, 24: 1}
Did not match all atoms present	10531-13-2	C1=CC=C(C=C1)S(=O)(=O)OCC#N	{2: 1, 37: 1, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	10531-78-9	CC1=CC2=C(C=C1)OC=N2	{1: 1, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	10531-80-3	CC1=CC2=C(C=C1)N=CO2	{1: 1, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	10534-59-5	CCCC[N+](CCCC)(CCCC)CCCC.CC(=O)[O-]	{24: 1, 1: 5, 2: 12}
Did not match all atoms present	10534-77-7	C1=CC=C(C=C1)OCCOC(=O)/C=C\C(=O)OCCOC2=CC=CC=C2	{2: 4, 22: 2, 28: 2, 14: 10, 6: 2}
Did not match all atoms present	10534-85-7	[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[Co]	{}
Did not match all atoms present	10534-86-8	N.N.N.N.N.N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Co+3]	{}
Did not match all atoms present	10534-88-0	[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[Ni]	{}
Did not match all atoms present	10535-87-2	CC[NH+](CC)C(CC(C)C1=CC=CC=C1)C2=CC=C(C=C2)OCC.[Cl-]	{1: 4, 2: 4, 3: 2, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	10536-62-6	C[Si](C)(C1=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F	{16: 10, 1: 2}
Did not match all atoms present	105361-86-2	C1=CC=C(C=C1)C2=CC(=CC=C2)N=O	{34: 1, 29: 1, 14: 9}
Did not match all atoms present	10537-47-0	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C#N)C#N	{1: 6, 4: 2, 37: 2, 6: 1, 7: 1, 14: 2, 21: 1}
Did not match all atoms present	10537-63-0	CC(=O)C1=CC=C(C=C1)C=C	{24: 1, 1: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	10538-49-5	COC1=CC(=C(C=C1)OC)CCC(=O)O	{1: 2, 2: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	10538-51-9	COC1=CC(=C(C=C1)OC)/C=C/C(=O)O	{1: 2, 22: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	105386-85-4	C1=CC=C(C=C1)OCC(CN(CCCCCCN(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O)CC(COC4=CC=CC=C4)O)O	{33: 2, 2: 14, 3: 4, 14: 20, 20: 4, 22: 4}
Did not match all atoms present	10539-19-2	CCC1=CC2=CC(=C(C=C2C(=N1)CC3=CC=CC=C3)OC)OC	{1: 3, 2: 2, 35: 1, 22: 2, 14: 8}
Did not match all atoms present	105391-33-1	CCC1=CC(=CC(=C1N2C(=O)C=CC2=O)C)CC3=CC(=C(C(=C3)CC)N4C(=O)C=CC4=O)C	{1: 4, 2: 3, 33: 2, 14: 8, 25: 4}
Did not match all atoms present	10540-29-1	CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3	{1: 3, 2: 3, 33: 1, 7: 2, 14: 14, 22: 1}
Did not match all atoms present	105400-81-5	C1CNC(C2=CC=CC=C21)CC(=O)O	{32: 1, 2: 1, 11: 2, 12: 1, 14: 4, 27: 1}
Did not match all atoms present	10541-29-4	CC1=CC=CC=C1NC.Cl	{1: 2, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	10541-38-5	CCCCCCCCC1=CC=C(C=C1)CCCCCCCC	{1: 2, 2: 14, 14: 4}
Did not match all atoms present	10541-56-7	CCCCCCCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 7, 14: 4}
Did not match all atoms present	10541-69-2	C1=CC(=C(C=C1Cl)CN)Cl	{17: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	10541-83-0	CNC1=CC=C(C=C1)C(=O)O	{1: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	10542-87-7	CC(=O)/C=C/C1=CC=CC=C1OC	{24: 1, 1: 2, 22: 1, 14: 4, 6: 2}
Did not match all atoms present	105427-00-7	CC1(CO1)C(=O)NCC2=CC=CC=C2	{1: 1, 2: 1, 11: 1, 13: 1, 14: 5, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	105427-01-8	CC1(CO1)C(=O)NC2=CC=CC=C2	{1: 1, 11: 1, 13: 1, 14: 5, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	105427-02-9	C1C(O1)C(=O)NCC2=CC=CC=C2	{2: 1, 11: 1, 12: 1, 14: 5, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	105427-03-0	C1C(O1)C(=O)NC2=CC=CC=C2	{11: 1, 12: 1, 14: 5, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	10543-12-1	CC(=O)OC1=C(C=C(C=C1)C(=O)O)OC	{1: 2, 27: 1, 28: 1, 22: 1, 14: 3}
Did not match all atoms present	10543-95-0	C(=O)(C(F)(F)F)C(F)(F)F.O	{16: 6, 24: 1, 4: 2}
Did not match all atoms present	105442-35-1	CCC1=CC(=CC(=C1N=C=O)CC)CC2=CC(=C(C(=C2)CC)N=C=O)CC	{1: 4, 2: 5, 8: 2, 34: 2, 14: 4, 29: 2}
Did not match all atoms present	105442-62-4	CC(C)[Te]C=C	{1: 2, 3: 1, 5: 1, 6: 1}
Did not match all atoms present	105442-63-5	CCCC[Te]C=C	{1: 1, 2: 3, 5: 1, 6: 1}
Did not match all atoms present	10545-36-5	CCN(CC)C[Si](C)(C)C	{1: 5, 2: 3, 33: 1}
Did not match all atoms present	105453-62-1	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C(C4=C3)[C@@H]([C@H](C=C5)O)O	{20: 2, 12: 2, 14: 12}
Did not match all atoms present	10546-24-4	CC1=CC2=CC=CC=C2C=C1N	{1: 1, 30: 1, 14: 6}
Did not match all atoms present	10546-65-3	CC(C)C1=CC(=C(C(=C1)Br)N)Br	{1: 2, 18: 2, 3: 1, 30: 1, 14: 2}
Did not match all atoms present	105462-24-6	C1=CC(=CN=C1)CC(O)(P(=O)(O)O)P(=O)(O)O	{2: 1, 35: 1, 4: 1, 14: 4, 20: 5, 29: 2}
Did not match all atoms present	105469-89-4	CC(=C)C(=O)OCC[N+](C)(C)CC(C[N+](C)(C)C)O.[Cl-].[Cl-]	{1: 6, 2: 4, 3: 1, 5: 1, 7: 1, 17: 2, 20: 1, 28: 1}
Did not match all atoms present	10547-14-5	CC1=CC=C(C=C1)N=CN(C)C	{1: 3, 34: 1, 14: 4, 6: 1, 33: 1}
Did not match all atoms present	105473-14-1	O.F[Al+]	{16: 1}
Did not match all atoms present	10549-76-5	CCCC[N+](CCCC)(CCCC)CCCC	{1: 4, 2: 12}
Did not match all atoms present	1055-23-8	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C4=C5C=CC=CC5=CC6=CC=CC=C64	{14: 18}
Did not match all atoms present	1055-26-1	C1=CC=C(C=C1)C2=C3C=CC=CC=C3C(=C2C4=CC=CC=C4)C5=CC=CC=C5	{14: 20}
Did not match all atoms present	10551-21-0	CC1=CC=CC=[N+]1CCC2=CC=CC=C2.[Br-]	{1: 1, 2: 2, 18: 1, 14: 9, 33: 1}
Did not match all atoms present	10551-58-3	CC(=O)OCC1=CC=C(O1)C=O	{1: 1, 2: 1, 14: 2, 23: 1, 26: 1, 28: 1}
Did not match all atoms present	10553-31-8	[Br-].[Br-].[Ba+2]	{18: 2}
Did not match all atoms present	10553-44-3	C1=CC=C(C=C1)CN2C=NC3=C2N=CN4C3=NN=N4	{33: 2, 2: 1, 35: 5, 14: 7}
Did not match all atoms present	10555-76-7	B(=O)[O-].O.O.O.O.[Na+]	{29: 2}
Did not match all atoms present	105555-81-5	C/C(=C/C1=NC=C(N1C)[N+](=O)[O-])/C2=CC=CC=C2	{1: 2, 35: 1, 38: 1, 6: 1, 33: 1, 7: 1, 14: 6}
Did not match all atoms present	10556-12-4	CC1=CC=C2C=CC=C2C=C1C	{1: 2, 14: 6}
Did not match all atoms present	105560-93-8	COC1=CC=C(C=C1)C2C(O2)C(=O)OC	{1: 2, 12: 2, 14: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	10557-71-8	C[Si](C)(C)C1=CC=C(C=C1)Cl	{1: 3, 14: 4, 17: 1}
Did not match all atoms present	10557-85-4	CC1=C(C(=NO1)C)I	{1: 2, 19: 1, 35: 1, 23: 1}
Did not match all atoms present	10558-25-5	CC1=C(C(=NO1)C)Br	{1: 2, 18: 1, 35: 1, 23: 1}
Did not match all atoms present	105582-62-5	OOP=O	{20: 1, 29: 1, 22: 1}
Did not match all atoms present	105589-05-7	CCCCCCCCCCCCC(=O)OCCOCCOC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCCOCCOC(=O)CCCCCCCCCCCC	{1: 4, 2: 30, 4: 1, 14: 8, 22: 4, 28: 2}
Did not match all atoms present	1056-77-5	C1=CC=C(C=C1)C2=C(OC(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5	{14: 20, 23: 1}
Did not match all atoms present	105614-86-6	C[N+](C)(C)CCOC(=O)C=C.C[N+](C)(CC=C)CC=C.C=CC(=O)N.[Cl-].[Cl-]	{1: 5, 2: 4, 5: 4, 6: 4, 17: 2, 24: 1, 28: 1, 30: 1}
Did not match all atoms present	10563-70-9	CC1(C2=CC=CC=C2C(=CCCN(C)C)C3=CC=CC=C31)C.Cl	{1: 4, 2: 2, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	105650-23-5	CN1C2=C(N=CC(=C2)C3=CC=CC=C3)N=C1N	{1: 1, 35: 2, 30: 1, 14: 7, 33: 1}
Did not match all atoms present	105661-40-3	C(C(C(=O)O)N)N=[N+]=[N-]	{27: 1, 2: 1, 3: 1, 34: 2, 30: 1}
Did not match all atoms present	10567-69-8	[O-]I(=O)=O.[O-]I(=O)=O.[Ba+2]	{19: 2, 29: 6}
Did not match all atoms present	10568-38-4	CCC1=CC(=CC=C1)OC	{1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	1057-81-4	CN1CCC(CC1)OC2C3=CC=CC=C3CCC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O	{1: 1, 6: 2, 33: 1, 11: 6, 12: 2, 14: 8, 22: 1, 27: 2}
Did not match all atoms present	105708-72-3	C1=CC2=C3C(=C1)C=C4C=CC5=C6C4=C3C(=C(C6=CC=C5)CO)C=C2	{2: 1, 20: 1, 14: 11}
Did not match all atoms present	105715-27-3	[Po+6]	{}
Did not match all atoms present	10572-60-8	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC(C)C)C(=O)C4=CC=CC=C4C3=O	{31: 2, 1: 3, 3: 1, 14: 10, 25: 2}
Did not match all atoms present	105726-60-1	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CO)CO	{2: 3, 27: 4, 20: 2, 14: 8}
Did not match all atoms present	105735-71-5	C1=CC2=C(C=CC3=C2C(=C1)C4=C3C=CC=C4[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	10574-17-1	CCC(C)OC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	10574-66-0	CCN1C(=O)COC1=S	{1: 1, 2: 1, 33: 1, 11: 1, 15: 1, 23: 1, 25: 1}
Did not match all atoms present	105751-18-6	C1=CC=C(C=C1)COC(=O)N[C@@H](CCCCNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O	{2: 6, 3: 1, 12: 1, 14: 13, 27: 1, 28: 2, 31: 2}
Did not match all atoms present	10578-34-4	CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 17, 28: 1, 14: 5}
Did not match all atoms present	10578-66-2	CCCCCCCCCCCCSCCOP(OCCSCCCCCCCCCCCC)OCCSCCCCCCCCCCCC	{40: 3, 1: 3, 2: 39, 22: 3}
Did not match all atoms present	10579-68-7	CC1=CC2=C(C=C1C)NCCN2	{32: 2, 1: 2, 11: 2, 14: 2}
Did not match all atoms present	105791-72-8	C1=CC(=CC=C1N/C(=N/C(=NCCCCCCN=C(/N=C(/NC2=CC=C(C=C2)Cl)\N)N)N)/N)Cl.C(C(=O)O)[C@@H](O)[C@H](O)[C@H](O)CO.C(O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)O.O	{2: 9, 3: 7, 7: 4, 34: 4, 14: 8, 17: 2, 20: 9, 27: 2, 30: 4, 31: 2}
Did not match all atoms present	1058-71-5	C1=CC=C(C=C1)C2=CC(=NC=C2)C3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5	{35: 4, 14: 18}
Did not match all atoms present	10580-03-7	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[NH4+].[NH4+].[Ti+4]	{24: 6}
Did not match all atoms present	10580-52-6	Cl[V]Cl	{17: 2}
Did not match all atoms present	10580-80-0	C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 6, 29: 2, 14: 4}
Did not match all atoms present	10581-12-1	CC(=O)[O-].C[N+](C)(C)C	{24: 1, 1: 5}
Did not match all atoms present	105827-78-9	C1CN(C(=N1)N[N+](=O)[O-])CC2=CN=C(C=C2)Cl	{33: 1, 2: 1, 35: 2, 38: 1, 11: 2, 14: 3, 15: 1, 17: 1, 31: 1}
Did not match all atoms present	105836-99-5	C1=CC2=C(C(=C1)[N+](=O)[O-])N=C3C=CC(=CC3=N2)[N+](=O)[O-]	{35: 2, 38: 2, 14: 6}
Did not match all atoms present	10584-95-9	C[Si](N=C=S)(N=C=S)N=C=S	{8: 3, 1: 1, 34: 3}
Did not match all atoms present	10584-98-2	CCCCC(CC)COC(=O)CS[Sn](CCCC)(CCCC)SCC(=O)OCC(CC)CCCC	{40: 2, 1: 6, 2: 18, 3: 2, 28: 2}
Did not match all atoms present	10586-12-6	C[Si](C)(C)OC1=CC(=CC(=C1)O[Si])O[Si]	{1: 3, 22: 3, 14: 3}
Did not match all atoms present	10586-16-0	C[Si](C)(C)OC1=CC(=C(C=C1)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	105875-75-0	CC(C)(C)[Si](C)(C)OCC=C	{1: 5, 2: 1, 4: 1, 5: 1, 6: 1, 22: 1}
Did not match all atoms present	105878-26-0	O=[Nb]12O[Nb]3(=O)O[Nb](=O)(O1)O[Nb](=O)(O2)O3	{29: 4, 23: 6}
Did not match all atoms present	105879-13-8	[C-]#[N+]C(F)(F)F	{16: 3, 34: 1, 4: 1}
Did not match all atoms present	10588-01-9	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Na+].[Na+]	{29: 6, 22: 1}
Did not match all atoms present	10589-94-3	CC1=CC2=CC3=C(C=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C	{32: 2, 1: 6, 2: 4, 35: 2, 14: 6, 28: 2}
Did not match all atoms present	105918-66-9	C(#N)[Se]I	{19: 1, 37: 1}
Did not match all atoms present	10592-13-9	CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.Cl	{1: 3, 33: 1, 12: 5, 13: 1, 14: 3, 15: 4, 17: 1, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	10593-16-5	C[NH+](C)CCOC(=O)CC1=CC=CC2=CC=CC=C21.[Cl-]	{1: 2, 2: 3, 28: 1, 14: 7, 17: 1}
Did not match all atoms present	105931-73-5	C1=CC(=C(C=C1Br)F)I	{16: 1, 18: 1, 19: 1, 14: 3}
Did not match all atoms present	105942-08-3	C1=CC(=C(C=C1Br)F)C#N	{16: 1, 18: 1, 37: 1, 14: 3}
Did not match all atoms present	10595-06-9	CC(=C)C(=O)OCCOC1=CC=CC=C1	{1: 1, 2: 2, 5: 1, 7: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	10595-80-9	CC(=C)C(=O)OCCS(=O)(=O)O	{1: 1, 2: 2, 5: 1, 7: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	10597-46-3	C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)[NH3+])N.[Cl-].[Cl-]	{1: 1, 33: 1, 30: 1, 14: 7, 17: 2}
Did not match all atoms present	10598-82-0	C1=CC(=CC=C1CN2C=CN=C2[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 2: 1, 35: 1, 38: 2, 14: 6}
Did not match all atoms present	10599-17-4	C1CN(CCN1CCCCl)C2=CC=CC=C2	{17: 1, 2: 3, 11: 4, 14: 5, 33: 2}
Did not match all atoms present	10599-57-2	CC1=COC(=C1C)C	{1: 3, 14: 1, 23: 1}
Did not match all atoms present	10599-58-3	CC1=C(OC(=C1C)C)C	{1: 4, 23: 1}
Did not match all atoms present	10599-69-6	CCC(=O)C1=CC=C(O1)C	{24: 1, 1: 2, 2: 1, 14: 2, 23: 1}
Did not match all atoms present	10599-70-9	CC1=CC(=C(O1)C)C(=O)C	{24: 1, 1: 3, 14: 1, 23: 1}
Did not match all atoms present	106-34-3	C1=CC(=O)C=CC1=O.C1=CC(=CC=C1O)O	{25: 2, 21: 2, 14: 8}
Did not match all atoms present	106-37-6	C1=CC(=CC=C1Br)Br	{18: 2, 14: 4}
Did not match all atoms present	106-38-7	CC1=CC=C(C=C1)Br	{1: 1, 18: 1, 14: 4}
Did not match all atoms present	106-39-8	C1=CC(=CC=C1Cl)Br	{17: 1, 18: 1, 14: 4}
Did not match all atoms present	106-40-1	C1=CC(=CC=C1N)Br	{18: 1, 30: 1, 14: 4}
Did not match all atoms present	106-41-2	C1=CC(=CC=C1O)Br	{18: 1, 21: 1, 14: 4}
Did not match all atoms present	106-42-3	CC1=CC=C(C=C1)C	{1: 2, 14: 4}
Did not match all atoms present	106-43-4	CC1=CC=C(C=C1)Cl	{1: 1, 14: 4, 17: 1}
Did not match all atoms present	106-44-5	CC1=CC=C(C=C1)O	{1: 1, 21: 1, 14: 4}
Did not match all atoms present	106-45-6	CC1=CC=C(C=C1)S	{1: 1, 14: 4, 39: 1}
Did not match all atoms present	106-46-7	C1=CC(=CC=C1Cl)Cl	{17: 2, 14: 4}
Did not match all atoms present	106-47-8	C1=CC(=CC=C1N)Cl	{17: 1, 30: 1, 14: 4}
Did not match all atoms present	106-48-9	C1=CC(=CC=C1O)Cl	{17: 1, 21: 1, 14: 4}
Did not match all atoms present	106-49-0	CC1=CC=C(C=C1)N	{1: 1, 30: 1, 14: 4}
Did not match all atoms present	106-50-3	C1=CC(=CC=C1N)N	{30: 2, 14: 4}
Did not match all atoms present	106-53-6	C1=CC(=CC=C1S)Br	{18: 1, 14: 4, 39: 1}
Did not match all atoms present	106-54-7	C1=CC(=CC=C1S)Cl	{17: 1, 14: 4, 39: 1}
Did not match all atoms present	10601-19-1	COC1=CC2=C(C=C1)NC=C2C=O	{32: 1, 1: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	10604-59-8	CCN1C=CC2=CC=CC=C21	{1: 1, 2: 1, 14: 6, 33: 1}
Did not match all atoms present	10604-69-0	C=CC(=O)[O-].[NH4+]	{24: 1, 5: 1, 6: 1}
Did not match all atoms present	10605-21-7	COC(=O)NC1=NC2=CC=CC=C2N1	{32: 1, 1: 1, 35: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	10605-24-0	CCCC(C)(CO[N+](=O)[O-])CO[N+](=O)[O-]	{1: 2, 2: 4, 4: 1, 22: 2}
Did not match all atoms present	10605-40-0	C[Si](C)(CCCCl)Cl	{1: 2, 2: 3, 17: 2}
Did not match all atoms present	106054-01-7	CCCCN1C(=C(N(P1CC)CCCC)C)C	{1: 5, 2: 7, 33: 2, 15: 2}
Did not match all atoms present	106058-86-0	CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)O	{1: 1, 27: 1, 29: 2, 14: 7, 33: 1}
Did not match all atoms present	10606-46-9	C1=CC=C(C(=C1)C(C2=CC=C(C=C2)Cl)(C(Cl)(Cl)Cl)O)Cl	{17: 5, 4: 2, 14: 8, 20: 1}
Did not match all atoms present	10606-72-1	CCOC(=O)[C@@H](C1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	106070-31-9	C1=CC=C(C(=C1)C2C3=CC(=C(C=C3OC4=CC(=C(C=C24)O)Cl)Cl)O)C(=O)O	{12: 1, 14: 8, 17: 2, 21: 2, 23: 1, 27: 1}
Did not match all atoms present	106070-58-0	CC1=CC(=CN=C1N)N	{1: 1, 35: 1, 30: 2, 14: 2}
Did not match all atoms present	106141-33-7	C1=CC2=C(C(=C1)C(=O)C3=CNC4=C3C=CC=C4C(=O)[O-])C(=CC=C2)C(=O)[O-].[Na+].[Na+]	{24: 3, 32: 1, 14: 10}
Did not match all atoms present	106168-50-7	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.CC(=O)[O-]	{1: 5, 2: 2, 33: 2, 7: 1, 14: 13, 15: 2, 24: 1}
Did not match all atoms present	106200-35-5	CNC(=O)/C(=C\1/N=C(C2=CC=CC=C12)NC3=CC=C(C=C3)NC4=N/C(=C(/C(=O)NC)\C#N)/C5=CC=CC=C45)/C#N	{1: 2, 35: 2, 37: 2, 7: 2, 14: 12, 15: 4, 24: 2, 31: 4}
Did not match all atoms present	106215-23-0	C1=CC=C(C(=C1)C(C2=CC=CC=C2OCC(CCl)O)C3=CC=CC=C3OCC(CCl)O)OCC(CCl)O	{2: 6, 3: 4, 14: 12, 17: 3, 20: 3, 22: 3}
Did not match all atoms present	106220-81-9	C1=C(C=C(C(=C1Cl)OC2=CC(=C(C=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 22: 1, 14: 4}
Did not match all atoms present	106229-05-4	[I-].[I-].[I-].[I-].[I-].[I-].[Ho+3].[Ho+3]	{19: 6}
Did not match all atoms present	106253-69-4	CC1=C(C=CC=C1N2CC(OC2=O)COC3=CC=C(C=C3)C(C4=CC=C(C=C4)OCC5CO5)C6=CC=C(C=C6)OCC7CO7)N8CC(OC8=O)COC9=CC=C(C=C9)C(C1=CC=C(C=C1)OCC1CO1)C1=CC=C(C=C1)OCC1CO1	{1: 1, 2: 6, 3: 2, 33: 2, 11: 6, 12: 6, 14: 27, 22: 6, 23: 4, 28: 2}
Did not match all atoms present	106268-96-6	C[C@@]1(CO1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 11: 1, 13: 1, 14: 4, 23: 1, 28: 1}
Did not match all atoms present	106268-97-7	C[C@H]1[C@@H](O1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 12: 2, 14: 4, 23: 1, 28: 1}
Did not match all atoms present	1063-55-4	CCCC(=O)C1=CC2=C(SC3=CC=CC=C3N2CCCN4CCN(CC4)C)C=C1.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O	{1: 2, 2: 5, 6: 4, 33: 3, 41: 1, 11: 4, 14: 7, 24: 1, 27: 4}
Did not match all atoms present	106342-00-1	CN1C(=O)C2=CC(=C3C4=C(C=C5C6=C4C(=C(C=C6C(=O)N(C5=O)C)Cl)C7=C(C=C(C2=C37)C1=O)Cl)Cl)Cl	{1: 2, 25: 4, 33: 2, 14: 4, 17: 4}
Did not match all atoms present	106359-91-5	C=CS(=O)(=O)CCOCCNC1=NC(=NC(=N1)NC2=CC(=C(C=C2)N=NC3=C(C=C4C=C(C=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)F.[Na+].[Na+].[Na+]	{2: 4, 35: 3, 5: 1, 6: 1, 34: 2, 14: 7, 16: 1, 22: 1, 24: 1, 29: 11, 30: 1, 31: 3}
Did not match all atoms present	1064-10-4	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)C3=CC=CC=C3	{14: 30}
Did not match all atoms present	1064-48-8	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O	{34: 3, 38: 1, 14: 11, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	106449-56-3	C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(NC(=O)N=C32)N)CO)O	{32: 1, 33: 1, 2: 1, 35: 2, 11: 1, 12: 3, 14: 1, 20: 2, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	106454-69-7	CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)CO	{1: 3, 2: 2, 3: 1, 4: 1, 14: 5, 20: 1, 28: 1, 31: 1}
Did not match all atoms present	106463-17-6	CCOC1=CC=CC=C1OCCN[C@H](C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N.Cl	{1: 3, 2: 4, 3: 1, 14: 7, 17: 1, 22: 3, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	106478-00-6	CCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 4, 28: 2, 14: 5}
Did not match all atoms present	1065-05-0	C(C(F)(F)F)OP1(=NP(=NP(=N1)(OCC(F)(F)F)OCC(F)(F)F)(OCC(F)(F)F)OCC(F)(F)F)OCC(F)(F)F	{16: 18, 2: 6, 35: 3, 4: 6, 22: 6}
Did not match all atoms present	1065-80-1	C1=CC=C2C(=C1)C3=C4C5=C2C6=CC=CC=C6C7=C5C8=C(C9=CC=CC=C97)C1=CC=CC=C1C1=C8C4=C(C2=CC=CC=C23)C2=CC=CC=C21	{14: 24}
Did not match all atoms present	1065-95-8	C1=CC=C(C=C1)[Si]2([Si]([Si]([Si]2(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9	{14: 40}
Did not match all atoms present	106513-42-2	CCOC(=O)[C@H](C)O[Si](C)(C)C(C)(C)C	{1: 7, 2: 1, 3: 1, 4: 1, 22: 1, 28: 1}
Did not match all atoms present	106542-73-8	CC[N+](CC)(CC)CC1=CC=CC=C1.C(=O)([O-])Cl	{24: 1, 1: 3, 2: 4, 14: 5, 17: 1}
Did not match all atoms present	1066-26-8	C#[C-].[Na+]	{9: 1}
Did not match all atoms present	1066-27-9	C#C[SiH3]	{9: 1, 10: 1}
Did not match all atoms present	1066-30-4	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Cr+3]	{24: 3, 1: 3}
Did not match all atoms present	1066-33-7	C(=O)(O)[O-].[NH4+]	{27: 1}
Did not match all atoms present	1066-35-9	C[Si](C)Cl	{1: 2, 17: 1}
Did not match all atoms present	1066-37-1	C[Ge](C)(C)Br	{1: 3, 18: 1}
Did not match all atoms present	1066-38-2	C[Ge](C)(C)I	{1: 3, 19: 1}
Did not match all atoms present	1066-40-6	C[Si](C)(C)O	{1: 3, 20: 1}
Did not match all atoms present	1066-42-8	C[Si](C)(O)O	{1: 2, 20: 2}
Did not match all atoms present	1066-43-9	[1H][Si]([1H])([1H])C	{1: 1}
Did not match all atoms present	1066-44-0	C[Sn](C)(C)Br	{1: 3, 18: 1}
Did not match all atoms present	1066-45-1	C[Sn](C)(C)Cl	{1: 3, 17: 1}
Did not match all atoms present	1066-50-8	CCP(=O)(Cl)Cl	{1: 1, 2: 1, 29: 1, 17: 2}
Did not match all atoms present	1066-51-9	C(N)P(=O)(O)O	{2: 1, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	1066-54-2	C[Si](C)(C)C#C	{1: 3, 10: 1, 9: 1}
Did not match all atoms present	1066-57-5	CC[Sn](Cl)(Cl)Cl	{1: 1, 2: 1, 17: 3}
Did not match all atoms present	1066-63-3	C[Ge]C.C[Ge](C)C.C[Ge](C)C	{1: 8}
Did not match all atoms present	1066-64-4	C[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C	{1: 12, 4: 1}
Did not match all atoms present	1066-77-9	CN(C)[Sn](N(C)C)(N(C)C)N(C)C	{1: 8, 33: 4}
Did not match all atoms present	106626-55-5	CN(C)CCNC(=O)C1=CC=CC2=NC3=CC=CC=C3C=C21	{1: 2, 2: 2, 35: 1, 33: 1, 14: 8, 24: 1, 31: 1}
Did not match all atoms present	106678-35-7	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[N+](=O)([O-])[O-].[Cu+]	{14: 30}
Did not match all atoms present	106682-41-1	CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+].[K+].[K+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	106682-42-2	CCOC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])N=NC3C(=NN(C3=O)C4=CC(=CC=C4)N/N=C/5\C(=CC6=C(C5=O)C=CC(=C6)NC(=O)C7=CC=CC=C7)S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 2: 1, 35: 1, 33: 1, 12: 1, 34: 5, 14: 20, 15: 3, 22: 1, 24: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	1067-10-3	CC[Ge](CC)(CC)Br	{1: 3, 2: 3, 18: 1}
Did not match all atoms present	1067-14-7	CC[Pb](CC)(CC)Cl	{1: 3, 2: 3, 17: 1}
Did not match all atoms present	1067-25-0	CCC[Si](OC)(OC)OC	{1: 4, 2: 2, 22: 3}
Did not match all atoms present	1067-29-4	CCC[Sn](CCC)(CCC)O[Sn](CCC)(CCC)CCC	{1: 6, 2: 12, 22: 1}
Did not match all atoms present	1067-42-1	CCCC[Ge](CCCC)(CCCC)CCCC	{1: 4, 2: 12}
Did not match all atoms present	1067-43-2	C=CCO[Si](OCC=C)(OCC=C)OCC=C	{2: 4, 22: 4, 5: 4, 6: 4}
Did not match all atoms present	1067-47-6	CCO[Si](CCCC#N)(OCC)OCC	{1: 3, 2: 6, 37: 1, 22: 3}
Did not match all atoms present	1067-52-3	CCCC[Sn](CCCC)(CCCC)OC	{1: 4, 2: 9, 22: 1}
Did not match all atoms present	1067-53-4	COCCO[Si](C=C)(OCCOC)OCCOC	{1: 3, 2: 6, 22: 6, 5: 1, 6: 1}
Did not match all atoms present	1067-55-6	CCCC[Sn](CCCC)(OC)OC	{1: 4, 2: 6, 22: 2}
Did not match all atoms present	1067-57-8	CCCC[Si](OC)(OC)OC	{1: 4, 2: 3, 22: 3}
Did not match all atoms present	1067-62-5	CC[N+](CC)(CC)CCCC[N+](CC)(CC)CC.[Br-].[Br-]	{1: 6, 2: 10, 18: 2}
Did not match all atoms present	1067-71-6	CCOP(=O)(CC(=O)C)OCC	{24: 1, 1: 3, 2: 3, 29: 1, 22: 2}
Did not match all atoms present	1067-74-9	CCOP(=O)(CC(=O)OC)OCC	{1: 3, 2: 3, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	1067-97-6	CCCC[Sn](CCCC)CCCC.O	{1: 3, 2: 9}
Did not match all atoms present	1067-98-7	C(COP(=O)(OCCCCl)OCCCCl)CCl	{17: 3, 2: 9, 29: 1, 22: 3}
Did not match all atoms present	1067-99-8	CCO[Si](C)(CCCC#N)OCC	{1: 3, 2: 5, 37: 1, 22: 2}
Did not match all atoms present	106705-37-7	CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Sr+2]	{24: 2, 1: 6, 2: 10, 4: 2}
Did not match all atoms present	106740-70-9	C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)NC(=O)C5=CC6=C(C=C5)N=C(C(=N6)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+].[K+].[K+]	{34: 1, 35: 2, 14: 11, 15: 2, 17: 2, 24: 1, 25: 1, 29: 12, 31: 2}
Did not match all atoms present	106742-36-3	CC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C3N2CCCN4CCCCC4	{1: 1, 2: 3, 33: 2, 11: 5, 14: 7, 23: 1, 24: 1}
Did not match all atoms present	106794-63-2	CCCCN(CCC1=CC=CC=C1)C2=CC(=C(C=C2)C=C(C#N)C#N)C	{1: 2, 2: 5, 37: 2, 6: 1, 33: 1, 7: 1, 14: 8}
Did not match all atoms present	106795-66-8	C1CCC(CC1)(C2=CC=CC=C2F)C(=O)O	{16: 1, 27: 1, 11: 5, 13: 1, 14: 4}
Did not match all atoms present	106795-72-6	C1CCC(CC1)(C#N)C2=CC=CC=C2F	{16: 1, 11: 5, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	1068-21-9	CCOP(=O)(N)OCC	{1: 2, 2: 2, 30: 1, 29: 1, 22: 2}
Did not match all atoms present	1068-55-9	C[CH-]C.[Mg+2].[Cl-]	{1: 2, 6: 1, 17: 1}
Did not match all atoms present	1068-61-7	CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].[Pb+2]	{24: 2, 1: 2, 5: 2, 7: 2}
Did not match all atoms present	1068-69-5	C[Si](C)(C)C([Si](C)(C)C)[Si](C)(C)C	{1: 9, 3: 1}
Did not match all atoms present	106809-14-7	C1=C(C(=C(C(=C1F)Cl)[N+](=O)[O-])Cl)C(=O)O	{16: 1, 17: 2, 27: 1, 38: 1, 14: 1}
Did not match all atoms present	106866-56-2	[H+].CCS(=O)(=O)C1=CC(=O)/C(=N\NC2=C(NN(C2=O)C3=CC=CC=C3)C)/C=C1.CCS(=O)(=O)C1=CC(=O)/C(=N\NC2=C(NN(C2=O)C3=CC=CC=C3)C)/C=C1.C(CCN)CCCN.[Cr]	{32: 2, 1: 4, 2: 8, 33: 2, 34: 2, 14: 16, 15: 4, 25: 4, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	106894-52-4	CCCCCCCCCCCC(=O)OCCOCCOC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCCOCCOC(=O)CCCCCCCCCCC	{1: 4, 2: 28, 4: 1, 14: 8, 22: 4, 28: 2}
Did not match all atoms present	106896-49-5	COC(=O)C1=CC(=C(C=C1)N)Br	{1: 1, 18: 1, 28: 1, 30: 1, 14: 3}
Did not match all atoms present	1069-08-5	CCN(CC)P(Cl)Cl	{1: 2, 2: 2, 33: 1, 17: 2}
Did not match all atoms present	1069-66-5	CCCC(CCC)C(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 4, 3: 1}
Did not match all atoms present	106906-27-8	CCC(CO)(CO)CO.CC(C)C(C(C)(C)CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 5, 2: 5, 3: 2, 4: 2, 14: 4, 20: 5, 27: 2}
Did not match all atoms present	106906-28-9	C1=CC=C(C(=C1)C2=NN(N=C2)C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N5N=CC(=N5)C6=CC=CC=C6S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 35: 4, 14: 16, 6: 2, 29: 12}
Did not match all atoms present	106917-60-6	CC1=C(C=C(C=C1)N)NC(C)(C)C	{1: 4, 4: 1, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	106917-61-7	CC1=C(C=C(C=C1)NC(C)(C)C)N	{1: 4, 4: 1, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	106917-62-8	CC1=CC(=C(C=C1NC(C)(C)C)N)C(C)(C)C	{1: 7, 4: 2, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	106917-63-9	CC1=CC(=C(C=C1N)NC(C)(C)C)C(C)(C)C	{1: 7, 4: 2, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	106917-65-1	CC1=C(C=CC=C1NC(C)(C)C)N	{1: 4, 4: 1, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	106917-66-2	CC1=C(C=CC(=C1N)C(C)(C)C)NC(C)(C)C	{1: 7, 4: 2, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	106941-25-7	C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)O	{33: 1, 2: 3, 35: 3, 14: 2, 20: 2, 22: 1, 29: 1, 30: 1}
Did not match all atoms present	106948-05-4	C1=CC(=CC=C1C2C(O2)CO)Br	{2: 1, 12: 2, 14: 4, 18: 1, 20: 1, 23: 1}
Did not match all atoms present	106948-24-7	CC(C)N(C(C)C)[Si](C)(C)CC=C	{1: 6, 2: 1, 3: 2, 5: 1, 6: 1, 33: 1}
Did not match all atoms present	106951-44-4	B(F)(F)F.C1=CC=C(C=C1)O	{16: 3, 21: 1, 14: 5}
Did not match all atoms present	107-26-6	CC[Hg]Br	{1: 1, 2: 1, 18: 1}
Did not match all atoms present	107-27-7	CC[Hg]Cl	{1: 1, 2: 1, 17: 1}
Did not match all atoms present	107-31-3	COC=O	{1: 1, 26: 1}
Did not match all atoms present	107-32-4	C(=O)OO	{26: 1, 20: 1}
Did not match all atoms present	107-34-6	CCC[As](=O)(O)O	{1: 1, 2: 2, 20: 2, 29: 1}
Did not match all atoms present	107-35-7	C(CS(=O)(=O)O)N	{2: 2, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	107-36-8	C(CS(=O)(=O)O)O	{2: 2, 20: 2, 29: 2}
Did not match all atoms present	107-37-9	C=CC[Si](Cl)(Cl)Cl	{17: 3, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	107-43-7	C[N+](C)(C)CC(=O)[O-]	{24: 1, 1: 3, 2: 1}
Did not match all atoms present	107-44-8	CC(C)OP(=O)(C)F	{16: 1, 1: 3, 3: 1, 29: 1, 22: 1}
Did not match all atoms present	107-46-0	C[Si](C)(C)O[Si](C)(C)C	{1: 6, 22: 1}
Did not match all atoms present	107-49-3	CCOP(=O)(OCC)OP(=O)(OCC)OCC	{1: 4, 2: 4, 29: 2, 22: 5}
Did not match all atoms present	107-50-6	C[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 14, 23: 7}
Did not match all atoms present	107-51-7	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 8, 22: 2}
Did not match all atoms present	107-52-8	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 14, 22: 5}
Did not match all atoms present	107-53-9	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 24, 22: 10}
Did not match all atoms present	107-55-1	CCC(C)OP(=S)(OC(C)CC)S	{1: 4, 2: 2, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	107-56-2	CC(C)OP(=S)(OC(C)C)S	{1: 4, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	107-57-3	C(C(CCl)O)S(=O)(=O)O	{17: 1, 2: 2, 3: 1, 20: 2, 29: 2}
Did not match all atoms present	107-61-9	C1CS(=O)(=O)CCO1	{11: 4, 29: 2, 23: 1}
Did not match all atoms present	107-64-2	CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Cl-]	{1: 4, 2: 34, 17: 1}
Did not match all atoms present	107-66-4	CCCCOP(=O)(O)OCCCC	{1: 2, 2: 6, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	107-68-6	CNCCS(=O)(=O)O	{1: 1, 2: 2, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	107-72-2	CCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 4, 17: 3}
Did not match all atoms present	1070-00-4	CCCCCCCC[Al](CCCCCCCC)CCCCCCCC	{1: 3, 2: 21}
Did not match all atoms present	1070-10-6	CCCCC(CC)C[O-].CCCCC(CC)C[O-].CCCCC(CC)C[O-].CCCCC(CC)C[O-].[Ti+4]	{1: 8, 2: 20, 3: 4, 29: 4}
Did not match all atoms present	1070-19-5	CC(C)(C)OC(=O)N=[N+]=[N-]	{1: 3, 34: 2, 4: 1, 28: 1}
Did not match all atoms present	1070-74-2	[2H]C#C[2H]	{9: 2}
Did not match all atoms present	1070-76-4	C(#C[SiH3])[SiH3]	{10: 2}
Did not match all atoms present	1070-89-9	C[Si](C)(C)[N-][Si](C)(C)C.[Na+]	{1: 6, 34: 1}
Did not match all atoms present	1070-91-3	C[Sn](C)(C)S[Sn](C)(C)C	{40: 1, 1: 6}
Did not match all atoms present	107097-74-5	C=CC(=O)N.C=CC(=O)[O-].C=CN1CCCC1=O.[Na+]	{33: 1, 5: 3, 6: 3, 11: 3, 24: 2, 25: 1, 30: 1}
Did not match all atoms present	107097-80-3	CCCCCN(CCCOC)C(=O)C(CCC(=O)O)NC(=O)C1=CC(=C(C=C1)Cl)Cl	{1: 2, 2: 9, 3: 1, 33: 1, 14: 3, 17: 2, 22: 1, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	107099-99-0	B(C1=C(C=CC(=C1)OC)OC)(O)O	{1: 2, 20: 2, 22: 2, 14: 3}
Did not match all atoms present	1071-17-6	C(CC#N)C[Si](CCCC#N)(Cl)Cl	{17: 2, 2: 6, 37: 2}
Did not match all atoms present	1071-21-2	C[Si](CCC#N)(Cl)Cl	{1: 1, 2: 2, 37: 1, 17: 2}
Did not match all atoms present	1071-22-3	C(C[Si](Cl)(Cl)Cl)C#N	{17: 3, 2: 2, 37: 1}
Did not match all atoms present	1071-23-4	C(COP(=O)(O)O)N	{2: 2, 30: 1, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	1071-27-8	C(CC#N)C[Si](Cl)(Cl)Cl	{17: 3, 2: 3, 37: 1}
Did not match all atoms present	1071-39-2	CC(C)[Hg]C(C)C	{1: 4, 3: 2}
Did not match all atoms present	1071-76-7	CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].[Zr+4]	{1: 4, 2: 12, 29: 4}
Did not match all atoms present	1071-83-6	C(C(=O)O)NCP(=O)(O)O	{2: 2, 27: 1, 20: 2, 29: 1, 31: 1}
Did not match all atoms present	107147-13-7	CC1=CC=C(C=C1)C(=O)[C@H]2CCCC[C@H]2C(=O)O	{1: 1, 11: 4, 12: 2, 14: 4, 24: 1, 27: 1}
Did not match all atoms present	107149-56-4	CC[Si](CC)(C(C)C)Cl	{1: 4, 2: 2, 3: 1, 17: 1}
Did not match all atoms present	1072-03-3	CCNCCOS(=O)(=O)O	{1: 1, 2: 3, 20: 1, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	1072-14-6	CCCCCC[Si]	{1: 1, 2: 5}
Did not match all atoms present	1072-15-7	CCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 8, 29: 3, 22: 1}
Did not match all atoms present	1072-32-8	CCCCCCCCCCCCN=C=S	{8: 1, 1: 1, 2: 11, 34: 1}
Did not match all atoms present	1072-35-1	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Pb+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	1072-53-3	C1COS(=O)(=O)O1	{11: 2, 29: 2, 23: 2}
Did not match all atoms present	1072-54-4	C[Si]1(CCCC1)C	{1: 2, 11: 4}
Did not match all atoms present	1072-55-5	C[Sn]1(SCCS1)C	{1: 2, 11: 2, 41: 2}
Did not match all atoms present	1072-62-4	CCC1=NC=CN1	{32: 1, 1: 1, 2: 1, 35: 1, 14: 2}
Did not match all atoms present	1072-67-9	CC1=CC(=NO1)N	{1: 1, 35: 1, 30: 1, 14: 1, 23: 1}
Did not match all atoms present	1072-68-0	CC1=CN(N=C1)C	{1: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	1072-71-5	C1(=S)NNC(=S)S1	{32: 2, 41: 1}
Did not match all atoms present	1072-82-8	CC(=O)C1=CNC=C1	{24: 1, 1: 1, 14: 3, 32: 1}
Did not match all atoms present	1072-83-9	CC(=O)C1=CC=CN1	{24: 1, 1: 1, 14: 3, 32: 1}
Did not match all atoms present	1072-85-1	C1=CC=C(C(=C1)F)Br	{16: 1, 18: 1, 14: 4}
Did not match all atoms present	1072-91-9	CC1=CC(=NN1C)C	{1: 3, 35: 1, 14: 1, 33: 1}
Did not match all atoms present	1072-93-1	C=C[C@@H]1CNC(=S)O1	{32: 1, 5: 1, 6: 1, 11: 1, 12: 1, 15: 1, 23: 1}
Did not match all atoms present	1072-97-5	C1=CC(=NC=C1Br)N	{18: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	1072-98-6	C1=CC(=NC=C1Cl)N	{17: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	107227-88-3	CCCCOC1=CC=C(C2=C3NC(=C12)NC4=C5C(=CC=C(C5=C([N-]4)NC6=C7C(=CC=C(C7=C(N6)NC8=C9C(=CC=C(C9=C(N3)[N-]8)OCCCC)OCCCC)OCCCC)OCCCC)OCCCC)OCCCC)OCCCC.[Cu+2]	{32: 6, 1: 8, 2: 24, 35: 2, 14: 8, 22: 8}
Did not match all atoms present	107240-58-4	CC(=C)C(=O)OCCOC(=O)CC(=O)C.CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.COC(=O)C=C.[Na+]	{1: 5, 2: 4, 4: 1, 5: 3, 6: 2, 7: 1, 24: 2, 28: 3, 29: 3, 31: 1}
Did not match all atoms present	107257-40-9	CC=P	{1: 1, 6: 1}
Did not match all atoms present	107263-95-6	C1=CC=[N+](C=C1)F.C(F)(F)(F)S(=O)(=O)[O-]	{16: 4, 33: 1, 4: 1, 29: 3, 14: 5}
Did not match all atoms present	107264-00-6	CC1=CC(=[N+](C(=C1)C)F)C.C(F)(F)(F)S(=O)(=O)[O-]	{1: 3, 4: 1, 33: 1, 14: 2, 16: 4, 29: 3}
Did not match all atoms present	107264-06-2	C1=C(C=[N+](C=C1Cl)F)Cl.C(F)(F)(F)S(=O)(=O)[O-]	{33: 1, 4: 1, 14: 3, 16: 4, 17: 2, 29: 3}
Did not match all atoms present	107290-05-1	C1CC2=NC3=CC=CC=C3C(=O)N2C4=NC5=CC=CC=C5C(=O)NC41	{32: 1, 33: 1, 35: 2, 11: 2, 12: 1, 14: 8, 15: 1, 25: 2}
Did not match all atoms present	1073-05-8	C1COS(=O)(=O)OC1	{11: 3, 29: 2, 23: 2}
Did not match all atoms present	1073-06-9	C1=CC(=CC(=C1)Br)F	{16: 1, 18: 1, 14: 4}
Did not match all atoms present	1073-23-0	CC1=[N+](C(=CC=C1)C)[O-]	{1: 2, 29: 1, 14: 3, 33: 1}
Did not match all atoms present	1073-26-3	CCC(=O)C1=CC=CN1	{24: 1, 1: 1, 2: 1, 14: 3, 32: 1}
Did not match all atoms present	1073-29-6	CSC1=CC=CC=C1O	{40: 1, 1: 1, 21: 1, 14: 4}
Did not match all atoms present	1073-47-8	C1=CC=C(C=C1)P(Br)Br	{18: 2, 14: 5}
Did not match all atoms present	1073-62-7	C1=CC=C(C=C1)CNN.Cl	{17: 1, 2: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	1073-67-2	C=CC1=CC=C(C=C1)Cl	{17: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	1073-72-9	CSC1=CC=C(C=C1)O	{40: 1, 1: 1, 21: 1, 14: 4}
Did not match all atoms present	1073-75-2	C1COP(O1)OCCO	{2: 2, 11: 2, 20: 1, 22: 1, 23: 2}
Did not match all atoms present	1073-96-7	CC1=C(C(=O)C(=CO1)O)O	{1: 1, 25: 1, 21: 2, 14: 1, 23: 1}
Did not match all atoms present	1073-98-9	CP1P(P(P(P1C)C)C)C	{1: 5}
Did not match all atoms present	107358-77-0	CC1CN2C=C(C(=O)C3=CC(=C(C(=C32)O1)F)F)C(=O)O	{1: 1, 33: 1, 11: 1, 12: 1, 14: 2, 16: 2, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	107359-39-7	C1=CC(=CC=C1COC2=C(C(=O)N(N=C2)C3=CC=C(C=C3)Cl)Cl)Cl	{33: 1, 2: 1, 35: 1, 14: 9, 17: 3, 22: 1, 25: 1}
Did not match all atoms present	107359-42-2	C1=CC(=CC=C1COC2=C(C(=O)N(N=C2)C3=CC=C(C=C3)Cl)Cl)Br	{33: 1, 2: 1, 35: 1, 14: 9, 17: 2, 18: 1, 22: 1, 25: 1}
Did not match all atoms present	107359-69-3	C1=CC(=CC=C1COC2=C(C(=O)N(N=C2)C3=CC=C(C=C3)Br)Cl)Cl	{33: 1, 2: 1, 35: 1, 14: 9, 17: 2, 18: 1, 22: 1, 25: 1}
Did not match all atoms present	107359-74-0	C1=CC(=CC=C1COC2=C(C(=O)N(N=C2)C3=C(C=C(C=C3)Cl)F)Cl)Cl	{33: 1, 2: 1, 35: 1, 14: 8, 16: 1, 17: 3, 22: 1, 25: 1}
Did not match all atoms present	107359-76-2	C1=CC(=CC=C1COC2=C(C(=O)N(N=C2)C3=C(C=C(C=C3)Cl)F)Cl)Br	{33: 1, 2: 1, 35: 1, 14: 8, 16: 1, 17: 2, 18: 1, 22: 1, 25: 1}
Did not match all atoms present	1074-11-9	C1=CC=C(C=C1)C(CCl)Cl	{17: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	1074-12-0	C1=CC=C(C=C1)C(=O)C=O	{24: 1, 26: 1, 14: 5}
Did not match all atoms present	1074-16-4	C1=CC=C(C(=C1)CCO)Br	{2: 2, 20: 1, 18: 1, 14: 4}
Did not match all atoms present	1074-17-5	CCCC1=CC=CC=C1C	{1: 2, 2: 2, 14: 4}
Did not match all atoms present	1074-24-4	CC1=CC(=C(C=C1Br)C)Br	{1: 2, 18: 2, 14: 2}
Did not match all atoms present	1074-29-9	C1=CC=C(C=C1)[Ge](Cl)(Cl)Cl	{17: 3, 14: 5}
Did not match all atoms present	1074-36-8	C1=CC(=CC=C1C(=O)O)S	{27: 1, 14: 4, 39: 1}
Did not match all atoms present	1074-43-7	CCCC1=CC=CC(=C1)C	{1: 2, 2: 2, 14: 4}
Did not match all atoms present	1074-52-8	C1=CC=C(C=C1)NC(=S)[S-].[NH4+]	{31: 1, 14: 5, 7: 1}
Did not match all atoms present	1074-55-1	CCCC1=CC=C(C=C1)C	{1: 2, 2: 2, 14: 4}
Did not match all atoms present	1074-82-4	C1=CC=C2C(=C1)C(=O)[N-]C2=O.[K+]	{25: 2, 35: 1, 14: 4}
Did not match all atoms present	1074-89-1	COC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 35: 3, 22: 1, 14: 2}
Did not match all atoms present	1074-91-5	C1=C(C(=C(C(=C1Br)F)F)F)F	{16: 4, 18: 1, 14: 1}
Did not match all atoms present	1074-92-6	CC1=CC=CC=C1C(C)(C)C	{1: 4, 4: 1, 14: 4}
Did not match all atoms present	1074-98-2	CC1=C(C=C[N+](=C1)[O-])[N+](=O)[O-]	{1: 1, 38: 1, 29: 1, 14: 3, 33: 1}
Did not match all atoms present	1075-06-5	C1=CC=C(C=C1)C(=O)C(O)O	{24: 1, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	1075-16-7	C1CCC2=CC=CC=C2CC1	{11: 5, 14: 4}
Did not match all atoms present	1075-22-5	CC1=C(C=C2CCCC2=C1)C	{1: 2, 11: 3, 14: 2}
Did not match all atoms present	1075-30-5	CC(=O)C1CC2=CC=CC=C12	{24: 1, 1: 1, 11: 1, 12: 1, 14: 4}
Did not match all atoms present	1075-35-0	CC1=CC2=C(N1)C=CC(=C2)Cl	{32: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	1075-38-3	CC1=CC(=CC=C1)C(C)(C)C	{1: 4, 4: 1, 14: 4}
Did not match all atoms present	1075-49-6	C=CC1=CC=C(C=C1)C(=O)O	{14: 4, 27: 1, 5: 1, 6: 1}
Did not match all atoms present	1075-61-2	CC(CC1=CC(=CC=C1)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 21: 1, 30: 1}
Did not match all atoms present	1075-74-7	C=CCCCC1=CC=CC=C1	{2: 3, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	1075-76-9	C1=CC=C(C=C1)NCCC#N	{2: 2, 37: 1, 14: 5, 31: 1}
Did not match all atoms present	107525-86-0	CCC(CO)(COCC=C)COCC=C.C1=CC(=CC(=C1)O)N.C1=CC(=CC(=C1)O)N.C1=CC(=CC(=C1)O)N.[Ti]	{1: 1, 2: 6, 4: 1, 5: 2, 6: 2, 14: 12, 20: 1, 21: 3, 22: 2, 30: 3}
Did not match all atoms present	107534-96-3	CC(C)(C)C(CCC1=CC=C(C=C1)Cl)(CN2C=NC=N2)O	{1: 3, 2: 3, 35: 2, 4: 2, 33: 1, 14: 6, 17: 1, 20: 1}
Did not match all atoms present	107535-73-9	C1=C(C(=C(C(=C1F)F)C(=O)Cl)F)F	{16: 4, 17: 1, 14: 1, 24: 1}
Did not match all atoms present	107539-20-8	O.[Cu].[Y].[Ba]	{}
Did not match all atoms present	107541-22-0	CCC(CO)(COCC=C)COCC=C.C(CNCCO)N.C(CNCCO)N.C(CNCCO)N.[Ti]	{1: 1, 2: 18, 4: 1, 5: 2, 6: 2, 20: 4, 22: 2, 30: 3, 31: 3}
Did not match all atoms present	107550-90-3	CCN1C2=CC=CC=C2N3C1=NN4C5=CC=CC=C5N(C4=N3)CC	{1: 2, 2: 2, 35: 2, 33: 4, 14: 8, 15: 2}
Did not match all atoms present	107555-93-1	C1=C2C(=CC(=C1Br)Br)OC3=CC(=C(C(=C23)Br)Br)Br	{18: 5, 14: 3, 23: 1}
Did not match all atoms present	107559-02-4	CC1=NC2=C(S1)C=C(C=C2)C3=CC=CC=C3	{1: 1, 35: 1, 14: 8, 41: 1}
Did not match all atoms present	107564-21-6	CC1=CC2=C(C=C1N)N=C3C=C(C(=CC3=N2)N)C	{1: 2, 35: 2, 30: 2, 14: 4}
Did not match all atoms present	107568-10-5	CC(=O)OC=C.C=CCS(=O)(=O)[O-].C=CO.[Na+]	{1: 1, 2: 1, 5: 3, 6: 3, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	107572-59-8	COC1=C(C=C(C=C1)C2=NC(=NN2)C3=CC(=C(C=C3)OC)OC)OC	{32: 1, 1: 4, 35: 2, 22: 4, 14: 6}
Did not match all atoms present	107574-57-2	CC(C)C(=O)C1=CC2=CC=CC=C2C=C1	{24: 1, 1: 2, 3: 1, 14: 7}
Did not match all atoms present	107585-40-0	C(C(C(=O)[O-])O)C(=O)[O-].[Na+]	{24: 2, 2: 1, 3: 1, 20: 1}
Did not match all atoms present	1076-17-1	C1CC2=C(C1)C3=C(CCC3)C=C2	{11: 6, 14: 2}
Did not match all atoms present	1076-22-8	CN1C2=C(C(=O)NC1=O)NC=N2	{32: 2, 1: 1, 35: 1, 33: 1, 14: 1, 25: 2}
Did not match all atoms present	1076-26-2	CC1=C(C=CC2=CC=CC=C12)O	{1: 1, 21: 1, 14: 6}
Did not match all atoms present	1076-38-6	C1=CC=C2C(=C1)C(=CC(=O)O2)O	{28: 1, 21: 1, 14: 5}
Did not match all atoms present	1076-43-3	[2H]C1=C(C(=C(C(=C1[2H])[2H])[2H])[2H])[2H]	{14: 6}
Did not match all atoms present	1076-47-7	CC1=C(C(=C(C=C1)C(=O)O)C)C	{1: 3, 27: 1, 14: 2}
Did not match all atoms present	1076-56-8	CC1=CC(=C(C=C1)C(C)C)OC	{1: 4, 3: 1, 22: 1, 14: 3}
Did not match all atoms present	1076-59-1	C1C(=NOC1=O)C2=CC=CC=C2	{35: 1, 11: 1, 28: 1, 14: 5, 15: 1}
Did not match all atoms present	1076-61-5	CC1=C(C=C2CCCCC2=C1)C	{1: 2, 11: 4, 14: 2}
Did not match all atoms present	1076-66-0	C=CCC(C=C)C1=CC=CC=C1	{14: 5, 2: 1, 3: 1, 5: 2, 6: 2}
Did not match all atoms present	1076-69-3	C1CCCC2=CC=CC=C2CC1	{11: 6, 14: 4}
Did not match all atoms present	1076-74-0	CC1=CC2=C(N1)C=CC(=C2)OC	{32: 1, 1: 2, 22: 1, 14: 4}
Did not match all atoms present	1076-88-6	CC1=CC(=CC(=C1C)C)C(=O)O	{1: 3, 27: 1, 14: 2}
Did not match all atoms present	1076-95-5	COC1=CC=C(C=C1)C(=O)C=O	{24: 1, 1: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	1076-98-8	C1=CC(=CC=C1C(=O)S)C(=O)S	{24: 2, 14: 4, 39: 2}
Did not match all atoms present	107638-88-0	C1=CC=C(C=C1)C(C(C#N)[N+](=O)[O-])C(C#N)[N+](=O)[O-].C(C(Cl)Cl)NCC(Cl)Cl	{2: 2, 3: 5, 37: 2, 38: 2, 14: 5, 17: 4, 31: 1}
Did not match all atoms present	107667-60-7	C1=C(NC=N1)C[C@H](C(=O)[O-])N=C(CCN)[O-].[Zn+2]	{32: 1, 2: 3, 3: 1, 7: 1, 34: 1, 14: 2, 35: 1, 24: 1, 30: 1}
Did not match all atoms present	107689-03-2	CCCCN1C(=C(N=C1N=NC2=C(C=C(C=C2)N(CCCC)CCCC)NC(=O)C)C#N)C#N	{1: 4, 2: 9, 35: 1, 37: 2, 33: 2, 34: 2, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	107697-82-5	C1=CC=C(C=C1)OC2=NC=CN=C2	{35: 2, 22: 1, 14: 8}
Did not match all atoms present	1077-16-3	CCCCCCC1=CC=CC=C1	{1: 1, 2: 5, 14: 5}
Did not match all atoms present	1077-18-5	CCCCN=CC1=CC=CC=C1	{1: 1, 2: 3, 34: 1, 14: 5, 6: 1}
Did not match all atoms present	1077-58-3	CC(C)(C)C1=CC=CC=C1C(=O)O	{1: 3, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	107746-52-1	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2CCN(C2=O)OC	{1: 7, 4: 2, 6: 1, 33: 1, 11: 2, 14: 2, 15: 1, 21: 1, 22: 1, 25: 1}
Did not match all atoms present	107770-92-3	CC1=CC=C(C=C1)SC2=CC=CC(=C2)C	{40: 1, 1: 2, 14: 8}
Did not match all atoms present	107778-77-8	CC(C)(C)C1=C(C(=CC=C1)C(C)(C)C)[O-].[K+]	{1: 6, 4: 2, 14: 3}
Did not match all atoms present	107796-30-5	C1COCO[C@@H]1C2=CC=CC=C2	{11: 3, 12: 1, 14: 5, 23: 2}
Did not match all atoms present	1078-04-2	CC1=C2CCC(C2=C(C=C1)C)(C)C	{1: 4, 11: 2, 13: 1, 14: 2}
Did not match all atoms present	1078-19-9	COC1=CC2=C(C=C1)C(=O)CCC2	{1: 1, 11: 3, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	1078-21-3	C1=CC=C(C=C1)C(CC(=O)O)CN	{27: 1, 2: 2, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	1078-28-0	CC1=NC2=C(C=C1)C=C(C=C2)OC	{1: 2, 35: 1, 22: 1, 14: 5}
Did not match all atoms present	1078-30-4	C1=CC2=C(C=C(C=C2)C(=O)O)N=C1	{35: 1, 27: 1, 14: 6}
Did not match all atoms present	1078-31-5	C[Si](C)(C)OC1=CC=CC=C1C=O	{1: 3, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	1078-38-2	CC(=O)NNC(=O)C1=CC=NC=C1	{24: 2, 1: 1, 35: 1, 14: 4, 31: 2}
Did not match all atoms present	1078-58-6	C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zn+2]	{14: 10}
Did not match all atoms present	1078-71-3	CCCCCCCC1=CC=CC=C1	{1: 1, 2: 6, 14: 5}
Did not match all atoms present	1078-96-2	C1=CC=C(C=C1)[Si](CCCC#N)(Cl)Cl	{17: 2, 2: 3, 37: 1, 14: 5}
Did not match all atoms present	1078-97-3	C[Si](C)(C1=CC=C(C=C1)[Si](C)(C)Cl)Cl	{1: 4, 14: 4, 17: 2}
Did not match all atoms present	1079-17-0	C(C1=C(C(=C(C(=C1Cl)Cl)CCl)Cl)Cl)Cl	{17: 6, 2: 2}
Did not match all atoms present	1079-21-6	C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O	{21: 2, 14: 8}
Did not match all atoms present	1079-33-0	CNC(=O)OC1=C2C=CSC2=CC=C1	{1: 1, 28: 1, 41: 1, 14: 5, 31: 1}
Did not match all atoms present	1079-65-8	C1=CC=C(C=C1)P(C2=CC=CC=C2)Br	{18: 1, 14: 10}
Did not match all atoms present	1079-66-9	C1=CC=C(C=C1)P(C2=CC=CC=C2)Cl	{17: 1, 14: 10}
Did not match all atoms present	1079-71-6	C1CCC2=CC3=C(CCCC3)C=C2C1	{11: 8, 14: 2}
Did not match all atoms present	108-32-7	CC1COC(=O)O1	{1: 1, 11: 1, 12: 1}
Did not match all atoms present	108-33-8	CC1=NN=C(S1)N	{1: 1, 35: 2, 30: 1, 41: 1}
Did not match all atoms present	108-34-9	CCOP(=O)(OCC)OC1=NNC(=C1)C	{32: 1, 1: 3, 2: 2, 35: 1, 14: 1, 22: 3, 29: 1}
Did not match all atoms present	108-36-1	C1=CC(=CC(=C1)Br)Br	{18: 2, 14: 4}
Did not match all atoms present	108-37-2	C1=CC(=CC(=C1)Br)Cl	{17: 1, 18: 1, 14: 4}
Did not match all atoms present	108-38-3	CC1=CC(=CC=C1)C	{1: 2, 14: 4}
Did not match all atoms present	108-39-4	CC1=CC(=CC=C1)O	{1: 1, 21: 1, 14: 4}
Did not match all atoms present	108-40-7	CC1=CC(=CC=C1)S	{1: 1, 14: 4, 39: 1}
Did not match all atoms present	108-41-8	CC1=CC(=CC=C1)Cl	{1: 1, 14: 4, 17: 1}
Did not match all atoms present	108-42-9	C1=CC(=CC(=C1)Cl)N	{17: 1, 30: 1, 14: 4}
Did not match all atoms present	108-43-0	C1=CC(=CC(=C1)Cl)O	{17: 1, 21: 1, 14: 4}
Did not match all atoms present	108-44-1	CC1=CC(=CC=C1)N	{1: 1, 30: 1, 14: 4}
Did not match all atoms present	108-45-2	C1=CC(=CC(=C1)N)N	{30: 2, 14: 4}
Did not match all atoms present	108-46-3	C1=CC(=CC(=C1)O)O	{21: 2, 14: 4}
Did not match all atoms present	108-47-4	CC1=CC(=NC=C1)C	{1: 2, 35: 1, 14: 3}
Did not match all atoms present	108-48-5	CC1=NC(=CC=C1)C	{1: 2, 35: 1, 14: 3}
Did not match all atoms present	108-50-9	CC1=CN=CC(=N1)C	{1: 2, 35: 2, 14: 2}
Did not match all atoms present	108-52-1	CC1=NC(=NC=C1)N	{1: 1, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	108-57-6	C=CC1=CC(=CC=C1)C=C	{14: 4, 5: 2, 6: 2}
Did not match all atoms present	108-58-7	CC(=O)OC1=CC(=CC=C1)OC(=O)C	{1: 2, 28: 2, 14: 4}
Did not match all atoms present	108-67-8	CC1=CC(=CC(=C1)C)C	{1: 3, 14: 3}
Did not match all atoms present	108-68-9	CC1=CC(=CC(=C1)O)C	{1: 2, 21: 1, 14: 3}
Did not match all atoms present	108-69-0	CC1=CC(=CC(=C1)N)C	{1: 2, 30: 1, 14: 3}
Did not match all atoms present	108-70-3	C1=C(C=C(C=C1Cl)Cl)Cl	{17: 3, 14: 3}
Did not match all atoms present	108-72-5	C1=C(C=C(C=C1N)N)N	{30: 3, 14: 3}
Did not match all atoms present	108-73-6	C1=C(C=C(C=C1O)O)O	{21: 3, 14: 3}
Did not match all atoms present	108-75-8	CC1=CC(=NC(=C1)C)C	{1: 3, 35: 1, 14: 2}
Did not match all atoms present	108-77-0	C1(=NC(=NC(=N1)Cl)Cl)Cl	{17: 3, 35: 3}
Did not match all atoms present	108-78-1	C1(=NC(=NC(=N1)N)N)N	{35: 3, 30: 3}
Did not match all atoms present	108-79-2	CC1=CC(=NC(=O)N1)C	{32: 1, 1: 2, 35: 1, 14: 1, 25: 1}
Did not match all atoms present	108-86-1	C1=CC=C(C=C1)Br	{18: 1, 14: 5}
Did not match all atoms present	108-88-3	CC1=CC=CC=C1	{1: 1, 14: 5}
Did not match all atoms present	108-89-4	CC1=CC=NC=C1	{1: 1, 35: 1, 14: 4}
Did not match all atoms present	108-90-7	C1=CC=C(C=C1)Cl	{17: 1, 14: 5}
Did not match all atoms present	108-95-2	C1=CC=C(C=C1)O	{21: 1, 14: 5}
Did not match all atoms present	108-98-5	C1=CC=C(C=C1)S	{14: 5, 39: 1}
Did not match all atoms present	108-99-6	CC1=CN=CC=C1	{1: 1, 35: 1, 14: 4}
Did not match all atoms present	1080-06-4	COC(=O)[C@H](CC1=CC=C(C=C1)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 21: 1, 28: 1, 30: 1}
Did not match all atoms present	1080-12-2	CC(=O)C=CC1=CC(=C(C=C1)O)OC	{1: 2, 6: 2, 14: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	1080-32-6	CCOP(=O)(CC1=CC=CC=C1)OCC	{1: 2, 2: 3, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	1080-38-2	CN1[Si](N([Si](N([Si]1(C)C)C)(C)C)C)(C)C	{1: 9, 33: 3}
Did not match all atoms present	1080-43-9	C[Sn](C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 14: 10}
Did not match all atoms present	1080-52-0	CC1=CC(=C(C=C1)N2C(=O)C=CC2=O)C	{1: 2, 33: 1, 14: 5, 25: 2}
Did not match all atoms present	108090-83-1	CC1=C(C(=CC=C1)C)O.C1CCC(=O)NCC1	{32: 1, 1: 2, 11: 5, 14: 3, 21: 1, 25: 1}
Did not match all atoms present	1081-15-8	C=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{34: 1, 38: 2, 5: 1, 14: 3, 31: 1}
Did not match all atoms present	1081-17-0	COC1=CC=C(C=C1)N2C(=O)C=CC2=O	{1: 1, 33: 1, 22: 1, 14: 6, 25: 2}
Did not match all atoms present	1081-34-1	C1=CSC(=C1)C2=CC=C(S2)C3=CC=CS3	{41: 3, 14: 8}
Did not match all atoms present	1081-73-8	C1CCN(C1)CCOC2=CC=C(C=C2)Br	{33: 1, 2: 2, 11: 4, 14: 4, 18: 1, 22: 1}
Did not match all atoms present	1081-75-0	C1=CC=C(C=C1)CCCC2=CC=CC=C2	{2: 3, 14: 10}
Did not match all atoms present	1081-77-2	CCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 8, 14: 5}
Did not match all atoms present	1082-23-1	CC(CC1=C(C(=C(C=C1)OC)OC)OC)N	{1: 4, 2: 1, 3: 1, 14: 2, 22: 3, 30: 1}
Did not match all atoms present	1082-57-1	C1CCC2=C(C1)C=CC=C2NC3=NCCN3	{32: 1, 35: 1, 11: 6, 14: 3, 15: 1, 31: 1}
Did not match all atoms present	1082-85-5	CC(=O)C1=CC=C(C=C1)N2C(=O)C=CC2=O	{24: 1, 1: 1, 33: 1, 14: 6, 25: 2}
Did not match all atoms present	1082-88-8	CC(CC1=CC(=C(C(=C1)OC)OC)OC)N	{1: 4, 2: 1, 3: 1, 14: 2, 22: 3, 30: 1}
Did not match all atoms present	108212-75-5	CCN[C@H]1CO[C@H](C[C@@H]1OC)O[C@@H]2[C@H]([C@@H]([C@H](OC2O[C@H]3C#C/C=C\C#C[C@]\4(CC(=O)C(=C3/C4=C\CSSSC)NC(=O)OC)O)C)NO[C@H]5C[C@@H]([C@@H]([C@H](O5)C)SC(=O)C6=C(C(=C(C(=C6OC)OC)O[C@H]7[C@@H]([C@@H]([C@H]([C@@H](O7)C)O)OC)O)I)C)O)O	{1: 11, 2: 2, 6: 1, 40: 4, 10: 4, 11: 4, 12: 18, 13: 1, 14: 2, 15: 3, 19: 1, 20: 5, 22: 8, 23: 4, 24: 1, 25: 1, 28: 1, 31: 3}
Did not match all atoms present	108251-81-6	C=O.C1=CC=C(C=C1)O.C1=CC2=C(C=CC(=C2[O-])[N+]#N)C(=C1)S(=O)(=O)O	{34: 1, 5: 1, 14: 10, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	108261-34-3	[Br-].[U]	{18: 1}
Did not match all atoms present	108283-47-2	CC(C)(C)OC(=O)[C@H](CN=[N+]=[N-])N	{1: 3, 2: 1, 3: 1, 4: 1, 34: 2, 28: 1, 30: 1}
Did not match all atoms present	108295-75-6	C=[Cu]	{5: 1}
Did not match all atoms present	1083-30-3	C1=CC=C(C=C1)CCC(=O)C2=CC=CC=C2	{24: 1, 2: 2, 14: 10}
Did not match all atoms present	1083-48-3	C1=CC(=CC=C1CC2=CC=NC=C2)[N+](=O)[O-]	{2: 1, 35: 1, 38: 1, 14: 8}
Did not match all atoms present	1083-56-3	C1=CC=C(C=C1)CCCCC2=CC=CC=C2	{2: 4, 14: 10}
Did not match all atoms present	1083-57-4	CCOC1=CC=C(C=C1)NC(=O)CC(C)O	{1: 2, 2: 2, 3: 1, 14: 4, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	108307-56-8	C1=CC(=CC(=C1)OC(F)(F)F)CC#N	{2: 1, 4: 1, 37: 1, 14: 4, 16: 3, 22: 1}
Did not match all atoms present	108319-06-8	CC1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)F)F)F	{32: 1, 1: 1, 33: 2, 11: 3, 12: 1, 14: 6, 16: 3, 25: 1, 27: 1}
Did not match all atoms present	108320-78-1	CC1=C2C3=CC=CC=C3NC2=C(C4=C1C=NC=C4)CO	{32: 1, 1: 1, 2: 1, 35: 1, 14: 7, 20: 1}
Did not match all atoms present	108320-79-2	CC1=C2C3=CC=CC=C3NC2=C(C4=C1C=NC=C4)CO.CNC(=O)O	{32: 1, 1: 2, 2: 1, 35: 1, 14: 7, 20: 1, 27: 1, 31: 1}
Did not match all atoms present	108332-35-0	CCC(C1=C(C=C(C=C1)O)C)C(CC)C2=C(C=C(C=C2)O)C	{1: 4, 2: 2, 3: 2, 21: 2, 14: 6}
Did not match all atoms present	108347-89-3	CCCCCCCCCCC(CCCCCCCC)COC(=O)C1=CC=CC=C1	{1: 2, 2: 17, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	108354-47-8	CN1C2=C(C3=NC=CN=C3C=C2)N=C1N	{1: 1, 35: 3, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	108388-79-0	C[N+](C)(C)CCOC(=O)C=C.C[N+](C)(CCOC(=O)C=C)CC1=CC=CC=C1.C=CC(=O)N.[Cl-].[Cl-]	{1: 5, 2: 5, 5: 3, 6: 3, 14: 5, 17: 2, 24: 1, 28: 2, 30: 1}
Did not match all atoms present	1084-32-8	C1=CC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])O)N=C1	{38: 2, 35: 1, 21: 1, 14: 4}
Did not match all atoms present	1084-65-7	CC1=C(C=C2C(=C1)CCCS2(=O)=O)S(=O)(=O)N	{1: 1, 30: 1, 11: 3, 29: 4, 14: 2}
Did not match all atoms present	108448-77-7	CC1(C2CCC13CS(=O)(=O)NC3C2)C	{32: 1, 1: 2, 11: 4, 12: 2, 13: 2, 29: 2}
Did not match all atoms present	108493-65-8	CCOC(=O)N[C@@H](CO)C1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 14: 5, 20: 1, 28: 1, 31: 1}
Did not match all atoms present	1085-12-7	CCCCCCCOC(=O)C1=CC=C(C=C1)O	{1: 1, 2: 6, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	1085-32-1	CC1=NOC(=C1)C(=O)NNCC2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 14: 6, 23: 1, 24: 1, 31: 2}
Did not match all atoms present	1085-98-9	CN(C)S(=O)(=O)N(C1=CC=CC=C1)SC(F)(Cl)Cl	{1: 2, 4: 1, 33: 2, 40: 1, 14: 5, 16: 1, 17: 2, 29: 2}
Did not match all atoms present	108528-41-2	CCCCCCCCCCCCC1=CC=CC=C1[O-].CCCCCCCCCCCCC1=CC=CC=C1[O-].[Ca+2]	{1: 2, 2: 22, 14: 8}
Did not match all atoms present	108544-97-4	COC1=C(C(=C(C(=C1)C(=O)O)Cl)Cl)O	{1: 1, 14: 1, 17: 2, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	108554-72-9	CC(C)N(C(C)C)P(N(C(C)C)C(C)C)OCC=C	{1: 8, 2: 1, 3: 4, 5: 1, 6: 1, 33: 2, 22: 1}
Did not match all atoms present	108593-47-1	CCOC1=CC=CC(=C1)C(=O)OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	1086-34-6	CN(C)NC1=C2C=CC=CC2=NC3=CC=CC=C31.Cl	{1: 2, 35: 1, 33: 1, 14: 8, 17: 1, 31: 1}
Did not match all atoms present	1086-80-2	CC1=CC2=C(C=C1C)N=C3C(=N2)C(=O)NC(=O)N3	{32: 2, 1: 2, 35: 2, 14: 2, 25: 2}
Did not match all atoms present	108608-62-4	CC(C)(C1=CC(=C(C(=C1)Br)OC)Br)C2=CC(=C(C(=C2)Br)OC)Br	{1: 4, 18: 4, 4: 1, 22: 2, 14: 4}
Did not match all atoms present	108619-67-6	CC12CCC3C(C1CC[C@@H]2SC)CCC4=C3C=CC(=C4)O	{1: 2, 40: 1, 11: 6, 12: 4, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	108648-25-5	C1[C@@H](O1)COC2=CC=C(C=C2)F	{2: 1, 11: 1, 12: 1, 14: 4, 16: 1, 22: 1, 23: 1}
Did not match all atoms present	108682-50-4	COC(=O)C(C(F)(F)F)OP(=O)(OC)OC	{1: 3, 3: 1, 4: 1, 16: 3, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	108682-51-5	CCOP(=O)(OCC)OC(C(=O)OC)C(F)(F)F	{1: 3, 2: 2, 3: 1, 4: 1, 16: 3, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	108682-53-7	CCCCOP(=O)(OCCCC)OC(C(=O)OC)C(F)(F)F	{1: 3, 2: 6, 3: 1, 4: 1, 16: 3, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	108682-54-8	CCCCCOP(=O)(OCCCCC)OC(C(=O)OC)C(F)(F)F	{1: 3, 2: 8, 3: 1, 4: 1, 16: 3, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	108682-55-9	CCCCCCOP(=O)(OCCCCCC)OC(C(=O)OC)C(F)(F)F	{1: 3, 2: 10, 3: 1, 4: 1, 16: 3, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	108682-57-1	CC(C)COP(=O)(OCC(C)C)OC(C(=O)OC)C(F)(F)F	{1: 5, 2: 2, 3: 3, 4: 1, 16: 3, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	108698-12-0	CCCOP(=O)(OCCC)OC(C(=O)OC)C(F)(F)F	{1: 3, 2: 4, 3: 1, 4: 1, 16: 3, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	1087-02-1	C1CCC(CC1)C2=CC=C(C=C2)C3CCCCC3	{11: 10, 12: 2, 14: 4}
Did not match all atoms present	1087-21-4	C=CCOC(=O)C1=CC(=CC=C1)C(=O)OCC=C	{2: 2, 14: 4, 28: 2, 5: 2, 6: 2}
Did not match all atoms present	1087-35-0	C1=CC=C(C=C1)CC(=O)NNCC2=CC=CC=C2	{24: 1, 2: 2, 14: 10, 31: 2}
Did not match all atoms present	1087-49-6	C1=CC=C(C=C1)CCCCCCC2=CC=CC=C2	{2: 6, 14: 10}
Did not match all atoms present	108709-97-3	CC1=C(N=C(N=C1N)C(CC(=N)[O-])NCC(C(=N)[O-])N)C(=NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=N)[O-])O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCC[S+](C)C)O)[O-].[Fe+3]	{32: 1, 1: 6, 2: 9, 3: 9, 36: 3, 7: 4, 41: 2, 12: 10, 34: 1, 14: 4, 35: 5, 20: 8, 22: 3, 23: 2, 24: 4, 30: 2, 31: 5}
Did not match all atoms present	108789-36-2	C1=CC(=C(C2=C1NC=C2O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)Cl)Br	{32: 1, 2: 1, 12: 5, 14: 3, 17: 1, 18: 1, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	108797-81-5	CCN\1C2=CC=CC=C2S/C1=C\C=C\3/C(=O)N(C(=S)N3CC(=O)O)C4=CC=CC=C4.CCN(CC)CC	{1: 4, 2: 5, 6: 2, 33: 4, 41: 1, 14: 9, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	108797-83-7	CC1=NC2=C(C=C1)C=C(C=C2)N.Cl	{1: 1, 35: 1, 30: 1, 14: 5, 17: 1}
Did not match all atoms present	108797-88-2	CC1=C(C(=CC=C1)O)C(=C)C	{1: 2, 21: 1, 5: 1, 14: 3, 7: 1}
Did not match all atoms present	1088-02-4	C1=CC=C(C=C1)[Ga](C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	1088-11-5	C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3	{32: 1, 35: 1, 11: 1, 14: 8, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	1088-56-8	CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C	{32: 1, 1: 3, 35: 2, 33: 1, 14: 2, 25: 2}
Did not match all atoms present	1088-78-4	C1=CC(=CC(=C1)N(CCCl)CCCl)CC(C(=O)O)N	{33: 1, 2: 5, 3: 1, 14: 4, 17: 2, 27: 1, 30: 1}
Did not match all atoms present	108818-89-9	C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C1=CN=CN1.C1=CN=CN1.C1=CN=CN1.C1=CN=CN1.C1=CN=CN1.C1=CN=CN1.[Ni+2]	{24: 2, 32: 6, 35: 6, 14: 22}
Did not match all atoms present	108847-76-3	B(C1=C2C(=CC=C1)SC3=CC=CC=C3S2)(O)O	{41: 2, 20: 2, 14: 7}
Did not match all atoms present	108866-68-8	CC(C)CCCCCC1=CC2=CC(=CC(=C2C=C1)CCCCCC(C)C)S(=O)(=O)[O-].CC(C[NH2+]CC(C)O)O	{1: 6, 2: 12, 3: 4, 14: 5, 20: 2, 29: 3}
Did not match all atoms present	1089-59-4	C[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 14: 15}
Did not match all atoms present	108909-17-7	C[Si](C)(C)O[Si](C)(O)O[Si](C)(O)O[Si](C)(C)C	{1: 8, 20: 2, 22: 3}
Did not match all atoms present	10894-62-9	C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.[Na+]	{24: 1, 2: 1, 3: 5, 20: 6}
Did not match all atoms present	108975-84-4	CN(C)C1CC(C2=CC=CC=C12)C3=CC=CC=C3.Cl	{1: 2, 33: 1, 11: 1, 12: 2, 14: 9, 17: 1}
Did not match all atoms present	109-00-2	C1=CC(=CN=C1)O	{35: 1, 21: 1, 14: 4}
Did not match all atoms present	109-04-6	C1=CC=NC(=C1)Br	{18: 1, 35: 1, 14: 4}
Did not match all atoms present	109-06-8	CC1=CC=CC=N1	{1: 1, 35: 1, 14: 4}
Did not match all atoms present	109-08-0	CC1=NC=CN=C1	{1: 1, 35: 2, 14: 3}
Did not match all atoms present	109-09-1	C1=CC=NC(=C1)Cl	{17: 1, 35: 1, 14: 4}
Did not match all atoms present	109-12-6	C1=CN=C(N=C1)N	{35: 2, 30: 1, 14: 3}
Did not match all atoms present	109-46-6	CCCCNC(=S)NCCCC	{1: 2, 2: 6, 31: 2, 7: 1}
Did not match all atoms present	109-57-9	C=CCNC(=S)N	{2: 1, 5: 1, 6: 1, 7: 1, 30: 1, 31: 1}
Did not match all atoms present	109-63-7	B(F)(F)F.CCOCC	{16: 3, 1: 2, 2: 2, 22: 1}
Did not match all atoms present	109-72-8	[Li+].CCC[CH2-]	{1: 1, 2: 2, 5: 1}
Did not match all atoms present	109-88-6	C[O-].C[O-].[Mg+2]	{1: 2, 29: 2}
Did not match all atoms present	109-94-4	CCOC=O	{1: 1, 2: 1, 26: 1}
Did not match all atoms present	1090-13-7	C1=CC=C2C=C3C(=CC2=C1)C(=O)C4=CC=CC=C4C3=O	{25: 2, 14: 10}
Did not match all atoms present	109028-10-6	CN1CCN(CC1)C2=NC3=C(C=CC(=C3)C(F)(F)F)N4C2=CC=C4	{1: 1, 35: 1, 4: 1, 33: 3, 11: 4, 14: 6, 16: 3}
Did not match all atoms present	109037-77-6	C1=CC=C(C=C1)SC2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)SC4=CC=C(C=C4)[S+](C5=CC=CC=C5)C6=CC=CC=C6.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F	{16: 18, 40: 2, 14: 47}
Did not match all atoms present	109048-92-2	CCC(=O)NC1=C(C=C2C(CC(N(C2=C1)CC)(C)C)C)N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])[N+](=O)[O-]	{1: 5, 2: 2, 34: 2, 38: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 4, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	109066-20-8	C(CN(CCN(C(=S)[S-])C(=S)[S-])C(=S)[S-])N(CCN(C(=S)[S-])C(=S)[S-])C(=S)[S-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 4, 2: 6, 7: 6}
Did not match all atoms present	109075-75-4	CC(C)CCCCCOC(=O)C=C.C=CC1=CC=CC=C1.C=CC(=O)N	{1: 2, 2: 5, 3: 1, 5: 3, 6: 3, 14: 5, 24: 1, 28: 1, 30: 1}
Did not match all atoms present	109086-77-3	COC1=CC=C(C=C1)C2NCCCO2	{32: 1, 1: 1, 11: 3, 12: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	109096-17-5	C(CN(C(=S)[S-])C(=S)[S-])N(CCN(C(=S)[S-])C(=S)[S-])CCN(C(=S)[S-])C(=S)[S-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 4, 2: 6, 7: 6}
Did not match all atoms present	109125-53-3	COC1=CC(=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC4=NC(=NC(=N4)Cl)NC5=CC(=C(C=C5)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+]	{1: 1, 34: 1, 35: 3, 14: 10, 15: 2, 17: 2, 22: 1, 25: 1, 29: 9, 31: 3}
Did not match all atoms present	109125-54-4	COC1=CC(=C(C=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC4=NC(=NC(=N4)[N+]5=CC=CC(=C5)C(=O)O)NC6=CC(=C(C=C6)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[K+]	{1: 1, 34: 1, 35: 3, 33: 1, 14: 14, 15: 2, 17: 1, 22: 1, 25: 1, 27: 1, 29: 9, 31: 3}
Did not match all atoms present	109201-26-5	C1=CN=C[NH2+]1.C1=CN=C[NH2+]1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]	{35: 2, 22: 1, 14: 6, 29: 6}
Did not match all atoms present	109202-92-8	COP(=O)(OC)O/C(=C\Cl)/C1=C(C=C(C=C1)Cl)Cl	{1: 2, 6: 1, 7: 1, 14: 3, 17: 3, 22: 3, 29: 1}
Did not match all atoms present	109227-12-5	C1=CC(=C(C(=C1)F)C(=O)Cl)C(F)(F)F	{16: 4, 17: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	109293-97-2	CC(=NNC(=O)NC1=CC(=CC(=C1)F)F)C2=C(C=CC=N2)C(=O)O	{1: 1, 34: 1, 35: 1, 7: 1, 14: 6, 16: 2, 24: 1, 27: 1, 31: 2}
Did not match all atoms present	109322-04-5	COC1=C(C=C(C=C1)/C=N/NC(=O)CN2C3=CC=CC=C3C4=NC5=C(C=CC(=C5)Cl)N=C42)OC	{1: 2, 2: 1, 35: 2, 6: 1, 33: 1, 34: 1, 14: 10, 17: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	109392-90-7	C1=CC=C(C=C1)OC(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42	{35: 1, 28: 1, 14: 13}
Did not match all atoms present	109423-33-8	CC=CC1=CC=CC=C1OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)OC4=CC=CC=C4C=CC	{24: 1, 1: 2, 22: 2, 14: 16, 6: 4}
Did not match all atoms present	109460-96-0	COC(=O)C(=CC1=CC=CC=C1Br)C#N	{1: 1, 37: 1, 6: 1, 7: 1, 14: 4, 18: 1, 28: 1}
Did not match all atoms present	1095-03-0	B(OC1=CC=CC=C1)(OC2=CC=CC=C2)OC3=CC=CC=C3	{22: 3, 14: 15}
Did not match all atoms present	1095-77-8	CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)(C(F)(F)F)C(F)(F)F	{16: 6, 1: 2, 4: 3, 14: 8}
Did not match all atoms present	1095-78-9	C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C(F)(F)F)C(F)(F)F)N	{16: 6, 4: 3, 30: 2, 14: 8}
Did not match all atoms present	1095-90-5	CCC(=O)C(CC(C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 10, 17: 1, 24: 1}
Did not match all atoms present	109509-25-3	CC1=C(C=CC=C1Cl)NC(=O)CCNCC(C)C.Cl	{1: 3, 2: 3, 3: 1, 14: 3, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	109527-43-7	CC(C)([C@@H]1CCCC[C@H]1O)C2=CC=CC=C2	{1: 2, 4: 1, 11: 4, 12: 2, 14: 5, 20: 1}
Did not match all atoms present	109527-45-9	CC(C)([C@H]1CCCC[C@@H]1O)C2=CC=CC=C2	{1: 2, 4: 1, 11: 4, 12: 2, 14: 5, 20: 1}
Did not match all atoms present	109541-21-1	C1=NC2=CC(=C(C=C2N=C1)Cl)[N+](=O)[O-]	{17: 1, 35: 2, 38: 1, 14: 4}
Did not match all atoms present	109562-39-2	CCCCCCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 6, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	109593-75-1	CCCCCOC1=C(C=C(C=C1COCCN(CC)CC)Br)Br	{1: 3, 2: 9, 33: 1, 14: 2, 18: 2, 22: 2}
Did not match all atoms present	1096-84-0	C1=CC=C2C(=C1)C=CC(=C2CC3=C(C=CC4=CC=CC=C43)O)O	{2: 1, 21: 2, 14: 12}
Did not match all atoms present	109613-00-5	CC(=O)C1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	109643-29-0	CC(C)OP(=O)(CC(=O)OCC1=CC=CC=C1)OC(C)C	{1: 4, 2: 2, 3: 2, 14: 5, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	109651-74-3	CC1=C(C=C(C=C1)NC(=O)C[NH2+]CC(C)C)Cl.[Cl-]	{1: 3, 2: 2, 3: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	109684-94-8	COC1=NN=C(O1)C2=CC=C(C=C2)C#N	{1: 1, 35: 2, 37: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	109704-32-7	C(CN=C=S)CN=C=S	{8: 2, 2: 3, 34: 2}
Did not match all atoms present	109721-30-4	COC(=O)C1=CC=C(C=C1)C(=O)OC.C1CC2C(C1)C3CC2CC3(C4=CC=C(C=C4)OCCO)C5=CC=C(C=C5)OCCO.C(CO)O	{1: 2, 2: 6, 11: 5, 12: 4, 13: 1, 14: 12, 20: 4, 22: 2, 28: 2}
Did not match all atoms present	109766-33-8	CCCCC(CC)COP(=O)(OCC(CC)CCCC)OP(=O)(O)[O-].CCCCC(CC)COP(=O)(OCC(CC)CCCC)OP(=O)(O)[O-].CC(=C)C(=O)NCCCN(C)C.CC(=C)C(=O)NCCCN(C)C.CC(C)(CO)CO.[Zr]	{1: 16, 2: 28, 3: 4, 4: 1, 5: 2, 7: 2, 20: 4, 22: 6, 24: 2, 33: 2, 29: 6, 31: 2}
Did not match all atoms present	109766-34-9	CCC(CO)(COCC=C)COCC=C.CC(C)CCCCCO.CC(C)CCCCCO.CC(C)CCCCCO.[Ti]	{1: 7, 2: 21, 3: 3, 4: 1, 5: 2, 6: 2, 20: 4, 22: 2}
Did not match all atoms present	109766-35-0	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCC(CO)(COCC=C)COCC=C.[Zr]	{1: 4, 2: 39, 4: 1, 5: 2, 6: 2, 14: 12, 20: 4, 22: 2, 29: 6}
Did not match all atoms present	109799-65-7	CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 2: 17, 38: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	1098-60-8	CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F.Cl	{1: 2, 2: 3, 4: 1, 33: 2, 41: 1, 14: 7, 16: 3, 17: 1}
Did not match all atoms present	1098-97-1	CC1=NC=C(C(=C1O)CO)CSSCC2=CN=C(C(=C2CO)O)C	{1: 2, 2: 4, 35: 2, 40: 2, 14: 2, 20: 2, 21: 2}
Did not match all atoms present	109828-61-7	C[Si]1(C2=CC=C(C=C2)[Si]([Si](C3=CC=C([Si]1(C)C)C=C3)(C)C)(C)C)C	{1: 8, 14: 8}
Did not match all atoms present	109835-10-1	C1=CC(=CC=C1CO)[N+]#N.[O-]S(=O)[O-]	{2: 1, 34: 1, 20: 1, 29: 3, 14: 4}
Did not match all atoms present	1099-45-2	CCOC(=O)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 28: 1, 14: 15, 6: 1}
Did not match all atoms present	109919-26-8	C1=C(C=C(C(=C1Cl)N)Br)C(F)(F)F	{4: 1, 14: 2, 16: 3, 17: 1, 18: 1, 30: 1}
Did not match all atoms present	109936-21-2	C1=CC=C(C=C1)C(CC2=CC=C(C=C2)Cl)(C3=CC=CC=C3)O	{17: 1, 2: 1, 4: 1, 14: 14, 20: 1}
Did not match all atoms present	109961-43-5	CCCCCCCCC(=O)OCC(CC)(C[O-])C[O-].CC1(CC(CC(C1)(C)CN)N)C.C1=CC(=CC(=C1)C(=O)O)C(=O)O.[Zn+2]	{1: 5, 2: 12, 4: 1, 11: 3, 12: 1, 13: 2, 14: 4, 27: 2, 28: 1, 29: 2, 30: 2}
Did not match all atoms present	109961-44-6	CO[Si](CCC(F)(F)F)(OC)O[Si](CCC(F)(F)F)(OC)OC	{16: 6, 1: 4, 2: 4, 4: 2, 22: 5}
Did not match all atoms present	109965-82-4	CCCCCOC1=C(C=C(C=C1)Br)COCCN(CC)CC	{1: 3, 2: 9, 33: 1, 14: 3, 18: 1, 22: 2}
Did not match all atoms present	109975-51-1	C[C-]1C(=C(C(=C1C)C)C)C.[N-]=S=N[S-].[Co]	{40: 1, 1: 5, 34: 1}
Did not match all atoms present	109998-76-7	C(CN)N.C(CN)N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].I[Pt+].I[Pt+]	{2: 4, 19: 2, 30: 4}
Did not match all atoms present	110-04-3	C(CS(=O)(=O)O)S(=O)(=O)O	{2: 2, 20: 2, 29: 4}
Did not match all atoms present	110-07-6	CCCCCCCCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 19, 29: 3, 22: 1}
Did not match all atoms present	110-11-2	CCCCCCCCOS(=O)(=O)O	{1: 1, 2: 7, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	110-45-2	CC(C)CCOC=O	{1: 2, 2: 2, 3: 1, 26: 1}
Did not match all atoms present	110-51-0	[B].C1=CC=NC=C1	{35: 1, 14: 5}
Did not match all atoms present	110-74-7	CCCOC=O	{1: 1, 2: 2, 26: 1}
Did not match all atoms present	1100-10-3	C1=CC=C(C=C1)N(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]	{33: 1, 38: 2, 14: 13}
Did not match all atoms present	1100-88-5	C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{17: 1, 2: 1, 14: 20}
Did not match all atoms present	11001-74-4	CC1C(=O)N(C2CSC(C(C(=O)N(C(C(=O)OCC(C(=O)N1)NC(=O)C3=NC4=CC=CC=C4N=C3)C(C)C(C)C)C)N(C(=O)C(NC(=O)C(COC(=O)C(N(C2=O)C)C(C)C(C)C)NC(=O)C5=NC6=CC=CC=C6N=C5)C)C)SC)C	{32: 2, 1: 13, 3: 4, 33: 4, 40: 1, 41: 1, 11: 3, 12: 9, 14: 10, 35: 4, 24: 2, 25: 6, 28: 2, 31: 2}
Did not match all atoms present	110011-81-9	CC(=O)OC(C=C)C1=CC(=C(C(=C1)OC)OC)OC	{1: 4, 3: 1, 5: 1, 6: 1, 14: 2, 22: 3, 28: 1}
Did not match all atoms present	110013-89-3	C=CC1=CC(=CC=C1)CC#N	{2: 1, 14: 4, 5: 1, 6: 1, 37: 1}
Did not match all atoms present	110015-92-4	CCCC(C)C[O-].[Mg+2].[Cl-]	{1: 2, 2: 3, 3: 1, 29: 1, 17: 1}
Did not match all atoms present	11002-20-3	CC1=CC=CC2=C(C=C(C=C12)OC)C(=O)O[C@H](C(=O)N/C(=C/3\[C@H]([C@@H]([C@H]4N3C4)O)OC(=O)C)/C(=O)N/C(=C/O)/C(=O)C)[C@@]5(CO5)C	{1: 5, 3: 1, 33: 1, 6: 1, 7: 2, 11: 2, 12: 3, 13: 1, 14: 5, 15: 1, 20: 2, 22: 1, 23: 1, 24: 3, 28: 2, 31: 2}
Did not match all atoms present	11006-34-1	CCC1=C(C2=NC1=CC3=C(C(=C([O-])[O-])C(=N3)C(=C4C(C(C(=N4)C=C5C(=C(C(=C2)[N-]5)C=C)C)C)CCC(=O)[O-])CC(=O)[O-])C)C.[Na+].[Na+].[Na+].[Cu+2]	{1: 5, 2: 4, 35: 4, 5: 1, 6: 1, 7: 1, 12: 2, 14: 3, 15: 11, 24: 2}
Did not match all atoms present	11006-76-1	CCC1C(=O)N2CCCC2C(=O)N(C(C(=O)N3CCC(=O)CC3C(=O)NC(C(=O)OC(C(C(=O)N1)NC(=O)C4=C(C=CC=N4)O)C)C5=CC=CC=C5)CC6=CC=CC=C6)C.CC1/C=C\C(=O)NC/C=C\C(=C/C(CC(=O)CC2=NC(=CO2)C(=O)N3CCC=C3C(=O)OC1C(C)C)O)\C	{32: 3, 1: 7, 2: 2, 3: 1, 33: 4, 11: 11, 12: 10, 14: 20, 15: 2, 35: 2, 20: 1, 21: 1, 23: 1, 24: 1, 25: 9, 28: 2, 31: 1}
Did not match all atoms present	1101-41-3	C1=CC=C(C=C1)P(C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4	{14: 20}
Did not match all atoms present	11011-32-8	CCCC[C@@H]1[C@@H]([C@@H](OC(=O)C(C(OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)OC(=O)CC(C)C	{1: 5, 2: 4, 3: 1, 12: 5, 14: 3, 21: 1, 24: 1, 26: 1, 28: 3, 31: 2}
Did not match all atoms present	110110-37-7	CCOC(=O)C=CC1=CNC2=CC=CC=C21	{32: 1, 1: 1, 2: 1, 6: 2, 14: 5, 28: 1}
Did not match all atoms present	11013-30-2	CC1C(C(CC(O1)OC2C(OC3(CC2O)OC4C(OC(C(C4(O3)C)O)OC5C(C(OC(C5OC)C)OC6C(OC(C(C6O)OC)OC7C(C8C(CO7)OC9(O8)C1C(C(CO9)(C(C)OC)O)OCO1)OC)COC)O)C)C)OC1CC(C(C(O1)C)OC)(C)[N+](=O)[O-])OC(=O)C1=C(C(=C(C(=C1OC)Cl)O)Cl)C	{1: 16, 2: 1, 3: 1, 38: 1, 11: 6, 12: 30, 13: 5, 17: 2, 20: 5, 21: 1, 22: 12, 23: 14, 28: 1}
Did not match all atoms present	11013-97-1	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@@H]([C@@H](O2)OC3=CC(=C4C(=O)C[C@H](OC4=C3)C5=CC(=C(C=C5)OC)OC)O)O)O)O)O)O)O	{1: 3, 2: 1, 11: 1, 12: 11, 14: 5, 20: 6, 21: 1, 22: 4, 23: 3, 25: 1}
Did not match all atoms present	110143-05-0	C1[C@H](O[C@H]([C@@H]1F)N2C=NC3=C2N=CN=C3N)CO	{33: 1, 2: 1, 35: 3, 11: 1, 12: 3, 14: 2, 16: 1, 20: 1, 23: 1, 30: 1}
Did not match all atoms present	110147-48-3	CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCOCC4	{1: 1, 2: 3, 33: 2, 41: 1, 11: 4, 14: 7, 23: 1, 24: 1}
Did not match all atoms present	11015-37-5	CC1C(C(C(C(O1)OC2C(OC(C(C2O)NC(=O)C)OC3C(C(C(OC3OP(=O)(O)OCC(C(=O)O)OCC=C(C)CCC=CC(C)(C)CCC(=C)CC=C(C)CCC=C(C)C)C(=O)O)(C)O)OC(=O)N)COC4C(C(C(C(O4)CO)O)O)O)NC(=O)C)O)OC5C(C(C(C(O5)C(=O)NC6=C(CCC6=O)O)O)O)O	{1: 10, 2: 11, 3: 1, 4: 1, 5: 1, 6: 5, 7: 4, 11: 2, 12: 24, 13: 1, 15: 2, 20: 12, 22: 7, 23: 5, 24: 3, 25: 1, 27: 2, 28: 1, 29: 1, 30: 1, 31: 3}
Did not match all atoms present	110152-60-8	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N	{1: 1, 2: 11, 34: 2, 14: 12, 20: 1, 29: 2, 30: 2}
Did not match all atoms present	110152-62-0	COC(=O)C=C.C(=C/[NH3+])\C#N	{1: 1, 28: 1, 5: 1, 6: 3, 37: 1}
Did not match all atoms present	110152-63-1	[Li+].C1=CC(=O)C=CC1=NNC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NN=C4C=CC(=O)C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{34: 2, 6: 2, 14: 14, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	11016-71-0	C/C=C\C1C(O1)(C)C2=CC(=O)C3=C(C=C4C(=C3O2)C(=O)C5=C(C4=O)C(=CC(=C5O)[C@H]6C[C@]([C@@H]([C@@H](O6)C)O)(C)N(C)C)[C@H]7C[C@H]([C@@H]([C@H](O7)C)O)N(C)C)C	{1: 10, 6: 2, 33: 2, 11: 2, 12: 8, 13: 2, 14: 3, 20: 2, 21: 1, 23: 4, 25: 3}
Did not match all atoms present	110175-58-1	CC(C)COC(=O)C(=C)C.C[N+]1=CN(C2=CC=CC=C21)C=C.COS(=O)(=O)[O-].C=CC1=CC=CC=C1	{1: 5, 2: 1, 3: 1, 5: 3, 6: 2, 7: 1, 14: 10, 22: 1, 33: 2, 28: 1, 29: 3}
Did not match all atoms present	110175-60-5	CCCCCCCCCCCCCCCCCCNC(=O)N.C=O.C1(=NC(=NC(=N1)N)N)N	{1: 1, 2: 17, 35: 3, 5: 1, 24: 1, 30: 4, 31: 1}
Did not match all atoms present	110208-16-7	C1=CC=C2C(=C1)[N+](=C(S2)SCCCS(=O)(=O)O)CCCS(=O)(=O)[O-]	{33: 1, 2: 6, 40: 1, 41: 1, 14: 4, 20: 1, 29: 5}
Did not match all atoms present	110224-99-2	CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.C=CC(=O)O.[O-]P.[Na+].[Na+]	{1: 2, 2: 1, 4: 1, 5: 2, 6: 2, 24: 1, 27: 1, 29: 4, 31: 1}
Did not match all atoms present	11029-61-1	C[C@@H](C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC5=CNC6=CC=CC=C65)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC7=CNC8=CC=CC=C87)C(=O)NCCO)NC(=O)CNC(=O)[C@H](C(C)C)NC=O	{32: 4, 1: 18, 2: 11, 3: 22, 14: 20, 20: 1, 24: 15, 26: 1, 31: 16}
Did not match all atoms present	110299-87-1	CS(=O)(=O)C1=C(N=CN1)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 14: 1, 29: 2}
Did not match all atoms present	1103-05-5	C1=CC=C(C=C1)S[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)SC4=CC=CC=C4	{40: 2, 14: 20}
Did not match all atoms present	11032-05-6	CC(C)[C@H]1C(=O)N[C@@H](CC2=CNC3=C4C(=CC(=C23)N1C)[C@@](CC[C@]4(C)C=C)(C)C(C)C)CO	{32: 2, 1: 7, 2: 1, 3: 2, 5: 1, 6: 1, 33: 1, 11: 3, 12: 2, 13: 2, 14: 2, 20: 1, 25: 1}
Did not match all atoms present	11032-41-0	CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6C(CC7=CNC8=CC=CC6=C78)N(C5)C.CS(=O)(=O)O	{32: 1, 1: 3, 2: 1, 33: 3, 11: 6, 12: 5, 13: 2, 14: 9, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	110335-28-9	CC[NH2+]CC(=O)NC1=C(C(=CC=C1)Cl)C.[Cl-]	{1: 2, 2: 2, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	110392-54-6	CCCCCCCCCCCCC(=O)[O-].CC(C)(C)C[CH2-].C=CCO.C=CCO.[Zr+2]	{1: 4, 2: 14, 4: 1, 5: 3, 6: 2, 20: 2, 24: 1}
Did not match all atoms present	110392-55-7	CCCCC(CC)CO.CCCCC(CC)CO.CCCCC(CC)CO.CCC(CO)(COCC=C)COCC=C.[Zr]	{1: 7, 2: 21, 3: 3, 4: 1, 5: 2, 6: 2, 20: 4, 22: 2}
Did not match all atoms present	1104-21-8	CN(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C	{1: 6, 14: 12, 33: 3}
Did not match all atoms present	1104-22-9	CC1=CC(=CC=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl.Cl	{1: 1, 2: 1, 3: 1, 33: 2, 11: 4, 14: 13, 17: 3}
Did not match all atoms present	1104-93-4	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(O)O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)O	{20: 2, 22: 1, 14: 20}
Did not match all atoms present	11041-94-4	C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O.Cl	{32: 1, 2: 1, 11: 2, 12: 1, 14: 6, 17: 1, 21: 3}
Did not match all atoms present	11042-64-1	C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2CC[C@@H]5[C@]3(C4)CC[C@@H](C5(C)C)OC(=O)/C=C/C6=CC(=C(C=C6)O)OC)C)C	{1: 8, 2: 2, 3: 1, 6: 3, 7: 1, 11: 9, 12: 4, 13: 5, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	110438-26-1	C1CNCCN1.C1C(O1)CCl.C1=CC=C(C=C1)CCl	{32: 2, 2: 2, 11: 5, 12: 1, 14: 5, 17: 2, 23: 1}
Did not match all atoms present	110475-01-9	CCCCCCOC(=O)C1=C(C=C(C=C1)C(=O)OC2CCCCC2)C(=O)OC3CCCCC3	{1: 1, 2: 5, 11: 10, 12: 2, 14: 3, 28: 3}
Did not match all atoms present	110479-58-8	C1=CC2=CC3=C4NC(=C3C=C2C=C1)NC5=C6C=C7C=CC=CC7=CC6=C8N5[Sn]N9C(=C1C=C2C=CC=CC2=CC1=C9NC1=C2C=C3C=CC=CC3=CC2=C(N1)N8)N4	{32: 6, 33: 2, 14: 24}
Did not match all atoms present	11051-88-0	CC(=CCC1=CC2=C(C=C1)NC=C2C3=C(C(=O)C(=C(C3=O)O)C4=CNC5=C4C=C(C=C5)CC=C(C)C)O)C	{32: 2, 1: 4, 2: 2, 6: 2, 7: 2, 14: 8, 15: 4, 20: 2, 25: 2}
Did not match all atoms present	110512-91-9	CC1=NN(C(=O)C1)C2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 35: 1, 33: 1, 11: 1, 14: 3, 15: 1, 25: 1, 29: 6}
Did not match all atoms present	110512-92-0	CCCCOC(=O)C=C.CC(CCOC(=O)C(=C)C)OC(=O)C(=C)C.C=CC1=CC=CC=C1	{1: 4, 2: 5, 3: 1, 5: 4, 6: 2, 7: 2, 14: 5, 28: 3}
Did not match all atoms present	11052-01-0	CC1=C(C2=C(C=C1)C(=O)C3=C(C4=C(C=C3C2=O)[C@@H]([C@H](C5=C4C(=C6C(=C5)C=C(NC6=O)C)O)O)OC)O)O	{32: 1, 1: 3, 12: 2, 14: 5, 20: 1, 21: 3, 22: 1, 25: 3}
Did not match all atoms present	11052-70-3	CC1(CC(C2=C(C1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=C5C(=C4C3=O)OC6C(C(C(C5(O6)C)O)N(C)C)O)O)O)O	{1: 5, 33: 1, 11: 1, 12: 6, 13: 2, 14: 2, 20: 4, 21: 2, 23: 2, 25: 2, 28: 1}
Did not match all atoms present	11054-70-9	CCC(C1C(CC(O1)(CC)C2CCC(C(O2)C)(CC)O)C)C(=O)C(C)C(C(C)CCC3=C(C(=C(C=C3)C)O)C(=O)O)O	{1: 8, 2: 5, 3: 4, 11: 3, 12: 4, 13: 2, 14: 2, 20: 2, 21: 1, 23: 2, 24: 1, 27: 1}
Did not match all atoms present	11055-06-4	CC[C@@H](C)C[C@H](C)/C=C(\C)/[C@@H]1C(=CCC(O1)C2=C(C(=CN(C2=O)C)C3[C@H]([C@@H]([C@@H]([C@@H]3O)O)O)O)O)C	{1: 6, 2: 2, 3: 2, 33: 1, 6: 1, 7: 1, 11: 1, 12: 7, 14: 2, 15: 1, 20: 4, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	110553-27-0	CCCCCCCCSCC1=CC(=C(C(=C1)CSCCCCCCCC)O)C	{40: 2, 1: 3, 2: 16, 21: 1, 14: 2}
Did not match all atoms present	110553-30-5	CCCCCCCCCCCCCCCCCC[N+](C)(C)CCOC(=O)/C=C/C1=CC=C(C=C1)OC.[Br-]	{1: 4, 2: 19, 6: 2, 14: 4, 18: 1, 22: 1, 28: 1}
Did not match all atoms present	110553-33-8	CCCCOCC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(COCCCC)OCC3CO3)OCC4CO4.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 6, 2: 12, 3: 2, 4: 2, 11: 2, 12: 2, 14: 16, 21: 2, 22: 6, 23: 2}
Did not match all atoms present	11056-06-7	CC1=C(N=C(N=C1N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)C(=O)N[C@@H](C(C2=CN=CN2)O[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)CO)O)O)O[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)OC(=O)N)O)C(=O)N[C@H](C)[C@H]([C@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCC[S+](C)C)O	{32: 1, 1: 6, 2: 9, 3: 9, 41: 2, 12: 10, 14: 4, 35: 5, 20: 8, 22: 2, 23: 2, 24: 7, 28: 1, 30: 5, 31: 6}
Did not match all atoms present	11056-25-0	[Ca].[Ca].[Ca].[Bi].[Bi]	{}
Did not match all atoms present	110601-75-7	B#P	{}
Did not match all atoms present	110615-13-9	COCCOC.[Cl-].[Cl-].[Cl-].[Nb+3]	{1: 2, 2: 2, 22: 2, 17: 3}
Did not match all atoms present	11062-30-9	[Ca].[Ca].[Ca].[Sb].[Sb]	{}
Did not match all atoms present	11062-37-6	[Hg].[Hg].[Hg]	{}
Did not match all atoms present	11065-24-0	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Ir].[Ir].[Ir].[Ir]	{29: 12}
Did not match all atoms present	110655-58-8	C[C@@H]1C2C(=O)N[C@@H](CCCCNC[C@H]3C(=O)N[C@H](C(=O)NCC(=O)N4CCC[C@H]4C(=O)N[C@H](C(=O)N[C@H]5C(SC[C@@H](C(=O)N3)NC(=O)[C@H](CSC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N2)CC(=O)N)[C@H](C(=O)O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC5=O)CC6=CC=CC=C6)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS1)N)CCCNC(=N)N)CCC(=O)N)C)CC7=CC=CC=C7)CC8=CC=CC=C8)C(=O)O	{32: 18, 1: 4, 2: 9, 3: 2, 36: 1, 33: 1, 7: 1, 41: 3, 11: 14, 12: 19, 14: 15, 20: 1, 24: 2, 25: 18, 27: 2, 30: 4, 31: 1}
Did not match all atoms present	11066-21-0	CCCCCCCCCCCC(CC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 11, 3: 1, 29: 3}
Did not match all atoms present	11067-19-9	CCCCCCCCCCCCCC/C=C/S(=O)(=O)[O-].[Na+]	{1: 1, 2: 13, 29: 3, 6: 2}
Did not match all atoms present	110677-79-7	COC1=CC=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3C=C2)O	{1: 1, 14: 10, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	11068-92-1	[B].C.[Si].[Cr].[Mn].[Fe].[Co].[Ni].[Mo]	{}
Did not match all atoms present	110682-18-3	[Be+2].B([O-])[O-]	{29: 2}
Did not match all atoms present	110690-43-2	CCOCN1C=C(C(=O)N(C1=O)C(=O)C2=CC(=CC=C2)C(=O)OC3=C(C=CC(=N3)OC(=O)C4=CC=CC=C4)C#N)F	{1: 1, 2: 2, 35: 1, 37: 1, 33: 2, 14: 12, 16: 1, 22: 1, 24: 1, 25: 2, 28: 2}
Did not match all atoms present	1107-00-2	C1=CC2=C(C=C1C(C3=CC4=C(C=C3)C(=O)OC4=O)(C(F)(F)F)C(F)(F)F)C(=O)OC2=O	{16: 6, 28: 4, 4: 3, 14: 6}
Did not match all atoms present	1107-69-3	C/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 2, 38: 4, 6: 1, 7: 1, 14: 6, 31: 2}
Did not match all atoms present	110720-66-6	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Ca+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	11073-85-1	[Ge].[Te]	{}
Did not match all atoms present	110735-99-4	C(COC(=O)CC(C(=O)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)[O-])C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Na+]	{2: 5, 3: 1, 4: 12, 16: 26, 28: 2, 29: 3}
Did not match all atoms present	110736-41-9	O.O.O.[Fe].[Fe]	{}
Did not match all atoms present	11075-28-8	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCC(CCl)O)NCC(CCl)O	{2: 4, 3: 2, 14: 6, 17: 2, 20: 2, 25: 2, 31: 2}
Did not match all atoms present	11077-12-6	C1C=CC=[C-]1.C1=CN[C-]=C1.[Fe+2]	{32: 1, 11: 1, 14: 6}
Did not match all atoms present	11077-19-3	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.Cl[Co-2](Cl)(Cl)Cl.[Co+3].[Co+3]	{17: 4, 14: 20}
Did not match all atoms present	11077-59-1	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Pr+3]	{14: 15}
Did not match all atoms present	11079-26-8	C\1=C\[C-]=C/C=C\[C-]=C1.C\1=C\[C-]=C/C=C\[C-]=C1.[U+4]	{14: 12}
Did not match all atoms present	11082-38-5	C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Zn+2]	{24: 5, 33: 3, 2: 9}
Did not match all atoms present	110835-84-2	C1=CC=C2C(=C1)C3=C([C@H]([C@@H](C=C3)O)O)C4=CC=CC=C24	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	110839-13-9	CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4.C1=CC(=CC(=C1)CN)CN	{1: 2, 2: 4, 4: 1, 11: 2, 12: 2, 14: 12, 22: 2, 23: 2, 30: 2}
Did not match all atoms present	11084-85-8	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]Cl.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{17: 1, 29: 17}
Did not match all atoms present	11085-35-1	[O-]S(=O)S(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	110877-64-0	C1=C(C(=CC(=C1F)F)Cl)C(=O)O	{16: 2, 17: 1, 27: 1, 14: 2}
Did not match all atoms present	11089-89-7	[Li+].[O-2].[Al+3]	{}
Did not match all atoms present	110895-43-7	CCOC(=O)CSC1=NC(=NN1C(=O)N(C)C)C(C)(C)C	{1: 6, 2: 2, 35: 2, 4: 1, 33: 2, 40: 1, 24: 1, 28: 1}
Did not match all atoms present	1109-15-5	B(C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F	{16: 15}
Did not match all atoms present	1109-85-9	COC1=CC2=C(C[C@@H]3[C@H]4[C@@]2(CCCC4)CCN3CCC5=CC=CC=C5)C=C1.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 1, 2: 2, 3: 2, 33: 1, 11: 7, 12: 2, 13: 1, 14: 8, 20: 2, 22: 1, 27: 2}
Did not match all atoms present	11091-96-6	O.O.O.[Ni]	{}
Did not match all atoms present	11092-86-7	[B-][B][B][B][B]S[B][B][B][B].[Cs+]	{40: 1}
Did not match all atoms present	110920-52-0	CO[Si]1(O[Si](O[Si](O1)(OC)OC)(OC)OC)OC	{1: 6, 22: 6, 23: 3}
Did not match all atoms present	110935-20-1	C1C=CC=C1C2=C(C=CC(=C2)Cl)[S-](=C=O)=C=O.C1C=CC=C1C2=C(C=CC(=C2)Cl)[S-](=C=O)=C=O.[Fe+2]	{8: 4, 11: 2, 14: 12, 15: 2, 17: 2, 29: 4}
Did not match all atoms present	110935-21-2	C1C=CC=C1C2=C(C=CC(=C2)C(F)(F)F)[S-](=C=O)=C=O.C1C=CC=C1C2=C(C=CC(=C2)C(F)(F)F)[S-](=C=O)=C=O.[Fe+2]	{4: 2, 8: 4, 11: 2, 14: 12, 15: 2, 16: 6, 29: 4}
Did not match all atoms present	110935-22-3	C1C=CC=C1C2=C(C=CC(=C2)[N+](=O)[O-])[S-](=C=O)=C=O.C1C=CC=C1C2=C(C=CC(=C2)[N+](=O)[O-])[S-](=C=O)=C=O.[Fe+2]	{38: 2, 8: 4, 11: 2, 14: 12, 15: 2, 29: 4}
Did not match all atoms present	11094-61-4	CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)NCC(=O)N1)CCCCN)C(C)C)[C@@H](C)O)NC(=O)CNC(=O)[C@@H]4CSSC[C@H]5C(=O)N6CCC[C@H]6C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N7CCC[C@H]7C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N5)[C@@H](C)O)CCCCN)[C@@H](C)O)[C@@H](C)O)CCC(=O)N)CCC(=O)N)CO)CO)CC8=CN=CN8)CCC(=O)N)CC(=O)N)CC9=CC=CC=C9)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCCNC(=N)N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N4)CCCNC(=N)N)CCC(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)CCCNC(=N)N)CC1=CC=CC=C1)CC(=O)O)CO)CC1=CNC2=CC=CC=C21)CCC(=O)N)CCCCN)CC(=O)N)CC1=CC=C(C=C1)O)CO)CCC(=O)O)CO)CO)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)O)CO)CCC(=O)O)C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)O)CO)CC(C)C)CCCCN	{32: 52, 1: 19, 2: 65, 3: 16, 36: 3, 33: 4, 7: 3, 41: 8, 11: 24, 12: 53, 14: 21, 35: 1, 20: 13, 21: 1, 24: 15, 25: 54, 27: 6, 30: 16, 31: 10}
Did not match all atoms present	11094-66-9	[Cl-].[Cl-].[Cl-].[Cl-].[In+3].[In+3]	{17: 4}
Did not match all atoms present	110944-98-4	C1=CC(=CC=C1C(=O)CI)[N+](=O)[O-]	{24: 1, 2: 1, 19: 1, 38: 1, 14: 4}
Did not match all atoms present	110945-00-1	CN(C)C1=CC=C(C=C1)C(=O)CCl	{1: 2, 2: 1, 33: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	11095-65-1	[NH4+].[O-]P(=O)([O-])[O-].[F-].[Al+3]	{16: 1, 29: 4}
Did not match all atoms present	11095-66-2	[NH4+].[O-]P(=O)([O-])[O-].[F-].[Fe+3]	{16: 1, 29: 4}
Did not match all atoms present	11096-42-7	CCCCCCCCCC1=CC=C(C=C1)OCCO.II	{1: 1, 2: 10, 14: 4, 19: 2, 20: 1, 22: 1}
Did not match all atoms present	11096-72-3	CC(C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)O.C1=CC(=CC=C1SN=NC2=CC(=C(C=C2Cl)Cl)Cl)Cl	{1: 1, 34: 2, 4: 1, 40: 1, 14: 14, 17: 6, 20: 1}
Did not match all atoms present	11096-91-6	CCCC(C)C1=CC(=CC=C1)OC(=O)NC.CCC(CC)C1=CC(=CC=C1)OC(=O)NC	{1: 6, 2: 4, 3: 2, 14: 8, 28: 2, 31: 2}
Did not match all atoms present	111-22-8	C(COCCO[N+](=O)[O-])OCCO[N+](=O)[O-]	{2: 6, 22: 4}
Did not match all atoms present	111-54-6	C(CNC(=S)S)NC(=S)S	{39: 2, 2: 2, 31: 2, 7: 2}
Did not match all atoms present	11100-01-9	CC1=C(C=CC(=C1)Cl)OCC(=O)[O-].[Na+]	{1: 1, 2: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	111009-83-7	CCCCCCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCCCCCC	{1: 2, 34: 1, 6: 1, 2: 12, 14: 8, 22: 1}
Did not match all atoms present	11103-86-9	[OH-].[O-][Cr](=O)(=O)[O-].[O-][Cr](=O)(=O)[O-].[K+].[Zn+2].[Zn+2]	{29: 8}
Did not match all atoms present	111039-56-6	C1=CC=C(C=C1)N2C(=NN=N2)[S-].[Na+]	{33: 1, 35: 3, 14: 5}
Did not match all atoms present	11104-44-2	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Mo].[Mo].[Bi+3].[Bi+3]	{}
Did not match all atoms present	11104-48-6	[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Ca+2].[Ca+2]	{}
Did not match all atoms present	11104-59-9	[O-][Cr](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	111041-98-6	C1=CC=C2C(=C1)N=CN2N=CC3=CC=C(O3)[N+](=O)[O-]	{33: 1, 34: 1, 35: 1, 38: 1, 6: 1, 14: 7, 23: 1}
Did not match all atoms present	111042-01-4	CN1C(=S)N(C(=N1)SC)N=CC2=CC=C(O2)[N+](=O)[O-]	{1: 2, 34: 1, 35: 1, 38: 1, 6: 1, 33: 2, 40: 1, 14: 2, 23: 1}
Did not match all atoms present	11105-03-6	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].O=[Zr+2].[Na+].[Na+]	{29: 9}
Did not match all atoms present	11105-11-6	O.O=[W](=O)=O	{29: 3}
Did not match all atoms present	11105-19-4	[Mn].[Fe].[Ni].[Cu]	{}
Did not match all atoms present	11105-69-4	[H-].[C-]#[O+].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ta]	{29: 1, 14: 10}
Did not match all atoms present	11106-54-0	CCCCC1=CC=C(C=C1)[N+](=NC2=CC=C(C=C2)OC)[O-]	{1: 2, 2: 3, 33: 1, 34: 1, 14: 8, 22: 1, 29: 1}
Did not match all atoms present	111063-52-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[K+]	{2: 2, 14: 9, 22: 1, 25: 2, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	111070-55-4	C1=CN(N=C1)/N=C/C2=CC=C(O2)[N+](=O)[O-]	{33: 1, 34: 1, 35: 1, 38: 1, 6: 1, 14: 5, 23: 1}
Did not match all atoms present	111070-57-6	C1=CC=C(C=C1)C2=CC(=O)N(C(=C2)C3=CC=CC=C3)/N=C/C4=CC=C(O4)[N+](=O)[O-]	{33: 1, 34: 1, 38: 1, 6: 1, 14: 14, 23: 1, 25: 1}
Did not match all atoms present	111071-53-5	CC\1=NN(C(=N)/C1=N/NC2=CC(=C(C=C2S(=O)(=O)[O-])Cl)Cl)C3=CC(=CC=C3)S(=O)(=O)[O-].[Ca+2]	{1: 1, 34: 1, 35: 1, 36: 1, 33: 1, 14: 6, 15: 3, 17: 2, 29: 6, 31: 1}
Did not match all atoms present	111073-55-3	CC1(OCP(CO1)C)C	{1: 3, 11: 2, 13: 1, 23: 2}
Did not match all atoms present	11108-03-5	[O-2].[O-2].[O-2].[O-2].[V].[Y+3]	{}
Did not match all atoms present	111083-78-4	CCC(CO)(COCC=C)COCC=C.C1=CC(=CC(=C1)O)N.C1=CC(=CC(=C1)O)N.C1=CC(=CC(=C1)O)N.[Zr]	{1: 1, 2: 6, 4: 1, 5: 2, 6: 2, 14: 12, 20: 1, 21: 3, 22: 2, 30: 3}
Did not match all atoms present	1111-44-0	CCN(CC)CCN1C2=C(C=CC(=C2)OC)C3=C1[C@H]4C[C@H]5[C@H](C[C@H]([C@@H]([C@H]5C(=O)OC)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC)CC4CC3.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 8, 2: 4, 3: 2, 33: 2, 11: 5, 12: 7, 14: 5, 20: 2, 22: 5, 27: 2, 28: 2}
Did not match all atoms present	1111-67-7	C(#N)[S-].[Cu+]	{37: 1}
Did not match all atoms present	1111-71-3	[Be+2].C(=O)[O-].C(=O)[O-]	{26: 2}
Did not match all atoms present	1111-74-6	C[Si]C	{1: 2}
Did not match all atoms present	1111-78-0	C(=O)(N)[O-].[NH4+]	{24: 1, 30: 1}
Did not match all atoms present	1111-83-7	C[Si](=S)C	{1: 2}
Did not match all atoms present	1111-88-2	[2H]C([2H])([2H])Br	{1: 1, 18: 1}
Did not match all atoms present	1111-89-3	[2H]C([2H])([2H])Cl	{1: 1, 17: 1}
Did not match all atoms present	1111-92-8	CP(=O)(C)Cl	{1: 2, 29: 1, 17: 1}
Did not match all atoms present	111128-12-2	CC(C1=CC=C(C=C1)CBr)C(=O)O	{1: 1, 2: 1, 3: 1, 14: 4, 18: 1, 27: 1}
Did not match all atoms present	11113-63-6	C.FF	{16: 2}
Did not match all atoms present	11113-81-8	[O-2].[O-2].[O-2].[Pr+3].[Pr+3]	{}
Did not match all atoms present	11114-92-4	[Cr].[Co]	{}
Did not match all atoms present	11115-71-2	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Ti+4].[Bi+3].[Bi+3]	{}
Did not match all atoms present	11115-97-2	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Fe+3].[Fe+3].[Mo].[Mo]	{}
Did not match all atoms present	111154-99-5	CCC1=CC(=CC(=C1)C2=CC=CC=C2)CC	{1: 2, 2: 2, 14: 8}
Did not match all atoms present	11116-31-7	CC1=C(N=C(N=C1N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)C(=O)N[C@@H]([C@H](C2=CN=CN2)O[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)CO)O)O)O[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)OC(=O)N)O)C(=O)N[C@H](C)[C@H]([C@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCC[S+](C)C)O	{32: 1, 1: 6, 2: 9, 3: 9, 41: 2, 12: 10, 14: 4, 35: 5, 20: 8, 22: 2, 23: 2, 24: 7, 28: 1, 30: 5, 31: 6}
Did not match all atoms present	11116-32-8	CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCNCCCCN)O	{32: 1, 1: 4, 2: 13, 3: 9, 41: 2, 12: 10, 14: 4, 35: 5, 20: 8, 22: 2, 23: 2, 24: 7, 28: 1, 30: 6, 31: 7}
Did not match all atoms present	11118-57-3	[O-2].[O-2].[O-2].[Cr+3].[Cr+3]	{}
Did not match all atoms present	111189-83-4	CC1=CC(=C(C(=C1)C)C(=C(O)[SiH3])C2=C(C=C(C=C2C)C)C)C	{1: 6, 20: 1, 14: 4, 7: 2}
Did not match all atoms present	111196-81-7	CCC1=CN=C(N=C1)Cl	{1: 1, 2: 1, 35: 2, 14: 2, 17: 1}
Did not match all atoms present	1112-00-1	C[Sn](C)(C)C#C	{1: 3, 10: 1, 9: 1}
Did not match all atoms present	1112-02-3	[2H]C([2H])([2H])C(=O)O	{1: 1, 27: 1}
Did not match all atoms present	1112-03-4	C(P(F)F)(Cl)(Cl)Cl	{16: 2, 17: 3, 4: 1}
Did not match all atoms present	1112-06-7	C[Si](C)(C)[Si](C)(C)C=C	{1: 5, 5: 1, 6: 1}
Did not match all atoms present	1112-37-4	CCP(=O)(CC)Cl	{1: 2, 2: 2, 29: 1, 17: 1}
Did not match all atoms present	1112-39-6	CO[Si](C)(C)OC	{1: 4, 22: 2}
Did not match all atoms present	1112-48-7	CC[Si](CC)(CC)Br	{1: 3, 2: 3, 18: 1}
Did not match all atoms present	1112-55-6	C=C[Si](C=C)(C=C)C=C	{5: 4, 6: 4}
Did not match all atoms present	1112-56-7	C=C[Sn](C=C)(C=C)C=C	{5: 4, 6: 4}
Did not match all atoms present	1112-63-6	CC[Sn](CC)(CC)O[Sn](CC)(CC)CC	{1: 6, 2: 6, 22: 1}
Did not match all atoms present	1112-66-9	C=CC[Si](CC=C)(CC=C)CC=C	{2: 4, 5: 4, 6: 4}
Did not match all atoms present	1112-67-0	CCCC[N+](CCCC)(CCCC)CCCC.[Cl-]	{1: 4, 2: 12, 17: 1}
Did not match all atoms present	1112-91-0	C[Si](CC=C)(CC=C)CC=C	{1: 1, 2: 3, 5: 3, 6: 3}
Did not match all atoms present	1112-94-3	CCOP(=O)(CCC(=O)OC)OCC	{1: 3, 2: 4, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	11120-25-5	[NH4+].[NH4+].[O-][W](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	11120-29-9	C1=C(C(=CC(=C1Cl)Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)C3=C(C(=C(C=C3Cl)Cl)Cl)Cl)Cl)Cl	{17: 11, 14: 3}
Did not match all atoms present	11121-16-7	B([O-])([O-])[O-].[Al+3]	{29: 3}
Did not match all atoms present	11121-63-4	[C-]1([C-]([C-]([C-]([C-]1Cl)Cl)Cl)Cl)Cl.[C-]1(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl.[Fe]	{17: 10}
Did not match all atoms present	111211-41-7	C1=CC=C(C(=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+].[K+].[K+]	{2: 2, 35: 3, 34: 1, 14: 11, 15: 2, 17: 1, 22: 1, 25: 1, 29: 14, 31: 3}
Did not match all atoms present	111211-42-8	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(/C(=N\NC5=CC=C(C=C5)S(=O)(=O)CCOS(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[K+].[K+].[K+].[K+]	{2: 4, 35: 3, 34: 1, 14: 11, 15: 2, 17: 1, 22: 2, 25: 1, 29: 16, 31: 3}
Did not match all atoms present	111211-43-9	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[K+].[K+].[K+].[K+]	{33: 1, 2: 2, 35: 4, 12: 1, 34: 2, 14: 11, 15: 1, 17: 1, 22: 1, 24: 1, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	111211-44-0	CCN1C(=O)C(=C(/C(=N/NC2=C(C=C(C(=C2)NC3=NC(=NC(=N3)NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])/C1=O)C)C(=O)N.[K+].[K+].[K+]	{1: 2, 2: 3, 35: 3, 33: 1, 34: 1, 14: 6, 15: 3, 17: 1, 22: 1, 24: 1, 25: 2, 29: 11, 30: 1, 31: 3}
Did not match all atoms present	111211-45-1	C1=CC(=CC=C1N=NC2=CC(=C(C=C2N)NC3=NC(=NC(=N3)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[K+].[K+]	{2: 2, 35: 3, 34: 2, 14: 6, 17: 2, 22: 1, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	111239-50-0	C1=CC=C2C(=C1)C(=CC(=NNC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)[O-])O)C2=O)S(=O)(=O)[O-].[K+].[K+].[Cu]	{2: 2, 34: 1, 14: 8, 15: 2, 21: 1, 22: 1, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	11126-29-7	[O-][Si](=O)[O-].[Zn+2]	{29: 3}
Did not match all atoms present	11126-42-4	C1=C(C=C(C(=C1Cl)Cl)Cl)C2=C(C=C(C(=C2Cl)Cl)C3=CC(=CC(=C3Cl)Cl)Cl)Cl	{17: 9, 14: 5}
Did not match all atoms present	11126-80-0	[Ag].[Ag].[Au]	{}
Did not match all atoms present	11126-81-1	[O-]Br(=O)=O.[O-]Br(=O)=O.[O-]Br(=O)=O.[Al+3]	{18: 3, 29: 9}
Did not match all atoms present	11129-14-9	S=[Zn].S=[Cd]	{}
Did not match all atoms present	11129-32-1	[O-2].[O-2].[O-2].[Y+3].[Gd+3]	{}
Did not match all atoms present	11129-37-6	[C-]#[Hf+]	{}
Did not match all atoms present	1113-02-6	CNC(=O)CSP(=O)(OC)OC	{1: 3, 2: 1, 40: 1, 22: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	1113-12-8	C[Si](C)(CC=C)CC=C	{1: 2, 2: 2, 5: 2, 6: 2}
Did not match all atoms present	1113-14-0	CCCS(=O)(=O)C=CS(=O)(=O)CCC	{1: 2, 2: 4, 29: 4, 6: 2}
Did not match all atoms present	1113-22-0	B(C)(C)CC	{1: 3, 2: 1}
Did not match all atoms present	1113-30-0	B(C)(C)N(C)C	{1: 4, 33: 1}
Did not match all atoms present	1113-31-1	B(N(C)C)(Cl)Cl	{1: 2, 33: 1, 17: 2}
Did not match all atoms present	1113-38-8	C(=O)(C(=O)[O-])[O-].[NH4+].[NH4+]	{24: 2}
Did not match all atoms present	1113-78-6	B(C(C)CC)(C(C)CC)C(C)CC	{1: 6, 2: 3, 3: 3}
Did not match all atoms present	11130-24-8	[S-2].[S-2].[S-2].[S-2].[S-2].[V].[V]	{}
Did not match all atoms present	111304-32-6	CCOC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)C	{1: 2, 2: 1, 38: 1, 6: 1, 7: 1, 14: 4, 24: 1, 28: 1}
Did not match all atoms present	11135-81-2	[Na].[K]	{}
Did not match all atoms present	11136-36-0	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Cl-].[Cl-].[Ti+4]	{1: 10, 17: 2, 13: 2, 15: 6}
Did not match all atoms present	11138-49-1	[Al-].[Na+].[O].[O]	{}
Did not match all atoms present	111439-76-0	CC(C)C[Si](C(C)C)(OC)OC	{1: 6, 2: 1, 3: 2, 22: 2}
Did not match all atoms present	11144-43-7	[Cu].[Ag]	{}
Did not match all atoms present	111456-85-0	COC(C1=CC=CC=C1)(N2C=CN=C2)OC	{1: 2, 35: 1, 4: 1, 33: 1, 14: 8, 22: 2}
Did not match all atoms present	111473-17-7	COC1=CC=C(C=C1)C(=O)C(C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3	{24: 3, 1: 1, 3: 1, 22: 1, 14: 14}
Did not match all atoms present	111479-05-1	CC(C(=O)OCCON=C(C)C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl	{1: 3, 2: 2, 3: 1, 7: 1, 34: 1, 14: 8, 17: 1, 35: 2, 22: 3, 28: 1}
Did not match all atoms present	1115-13-5	COC(=S)OC	{1: 2, 22: 2, 7: 1}
Did not match all atoms present	1115-15-7	C=CS(=O)C=C	{5: 2, 6: 2, 29: 1}
Did not match all atoms present	1115-63-5	C([C@@H](C(=O)[O-])N)C(=O)O.[K+]	{24: 1, 27: 1, 2: 1, 3: 1, 30: 1}
Did not match all atoms present	1115-99-7	CC[Ga](CC)CC	{1: 3, 2: 3}
Did not match all atoms present	1116-01-4	C(#N)P(C#N)C#N	{37: 3}
Did not match all atoms present	1116-39-8	B(CC(C)C)(CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 3}
Did not match all atoms present	1116-61-6	B(CCC)(CCC)CCC	{1: 3, 2: 6}
Did not match all atoms present	1116-70-7	CCCC[Al](CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	1116-73-0	CCCCCC[Al](CCCCCC)CCCCCC	{1: 3, 2: 15}
Did not match all atoms present	1116-95-6	C[N+](C)(C)C[C@H](CC#N)O.[Cl-]	{1: 3, 2: 2, 3: 1, 37: 1, 17: 1, 20: 1}
Did not match all atoms present	111686-79-4	CC(CC1=CC=CC=C1)(C2=CC=CC=C2)NC(=O)CN.Cl	{1: 1, 2: 2, 4: 1, 14: 10, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	111771-08-5	C1=CC(=C(C(=C1)I)C(=O)O)F	{16: 1, 27: 1, 19: 1, 14: 3}
Did not match all atoms present	1118-02-1	C[Si](C)(C)N=C=O	{8: 1, 1: 3, 34: 1, 29: 1}
Did not match all atoms present	1118-10-1	CC(C)C[Sn](C)(C)C	{1: 5, 2: 1, 3: 1}
Did not match all atoms present	1118-14-5	CC(=O)O[Sn](C)(C)C	{1: 4, 28: 1}
Did not match all atoms present	1118-15-6	C[Si](C)(O)O[Si](C)(C)O	{1: 4, 20: 2, 22: 1}
Did not match all atoms present	1118-42-9	CCCCC[Sn](CCCCC)(Cl)Cl	{1: 2, 2: 8, 17: 2}
Did not match all atoms present	1118-46-3	CCCC[Sn](Cl)(Cl)Cl	{1: 1, 2: 3, 17: 3}
Did not match all atoms present	111841-85-1	CC(C)OC(=O)C1=NC=C2C(=C1COC)C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4	{32: 1, 1: 3, 2: 2, 3: 1, 14: 9, 35: 1, 22: 2, 28: 1}
Did not match all atoms present	111857-42-2	C1CC[C@@H]([C@@H](C1)C(=O)C2=CC=C(C=C2)F)C(=O)[O-]	{16: 1, 24: 2, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	111858-68-5	CC1=CC=C(C=C1)N(CC2([C@H]([C@@H]([C@@H](CO2)O)O)O)O)N=O	{1: 1, 2: 1, 34: 1, 33: 1, 11: 1, 12: 3, 13: 1, 14: 4, 20: 4, 23: 1, 29: 1}
Did not match all atoms present	111895-49-9	CCC=CS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	1119-22-8	C=[CH-].C=[CH-].[Zn+2]	{5: 2}
Did not match all atoms present	1119-94-4	CCCCCCCCCCCC[N+](C)(C)C.[Br-]	{1: 4, 2: 11, 18: 1}
Did not match all atoms present	1119-97-7	CCCCCCCCCCCCCC[N+](C)(C)C.[Br-]	{1: 4, 2: 13, 18: 1}
Did not match all atoms present	111901-40-7	CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)[C@@H]([C@H]([C@@H]5[C@H]4O5)O)O	{1: 1, 23: 1, 12: 4, 14: 7, 20: 2}
Did not match all atoms present	111935-69-4	C[SiH2]CO	{1: 1, 2: 1, 20: 1}
Did not match all atoms present	111955-14-7	C1[C@H]([C@H]([C@H](C(O1)N(C2=CC=C(C=C2)[N+](=O)[O-])N=O)O)O)O	{33: 1, 34: 1, 38: 1, 11: 1, 12: 4, 14: 4, 20: 3, 23: 1, 29: 1}
Did not match all atoms present	111974-69-7	C1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42	{33: 2, 2: 4, 35: 1, 41: 1, 11: 4, 14: 8, 15: 1, 20: 1, 22: 1}
Did not match all atoms present	111982-81-1	C1=CC=C(C=C1)P(CC2=CC=CC=C2C3=CC=CC=C3CP(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6	{2: 2, 14: 28}
Did not match all atoms present	111988-49-9	C1CSC(=NC#N)N1CC2=CN=C(C=C2)Cl	{33: 1, 2: 1, 35: 1, 37: 1, 41: 1, 11: 2, 34: 1, 14: 3, 15: 1, 17: 1}
Did not match all atoms present	111991-09-4	CN(C)C(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC	{1: 4, 35: 3, 33: 1, 14: 4, 22: 2, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	112-00-5	CCCCCCCCCCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 11, 17: 1}
Did not match all atoms present	112-02-7	CCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 15, 17: 1}
Did not match all atoms present	112-03-8	CCCCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 17, 17: 1}
Did not match all atoms present	112-04-9	CCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 17, 17: 3}
Did not match all atoms present	112-23-2	CCCCCCCOC=O	{1: 1, 2: 6, 26: 1}
Did not match all atoms present	112-32-3	CCCCCCCCOC=O	{1: 1, 2: 7, 26: 1}
Did not match all atoms present	1120-02-1	CCCCCCCCCCCCCCCCCC[N+](C)(C)C.[Br-]	{1: 4, 2: 17, 18: 1}
Did not match all atoms present	1120-04-3	CCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 17, 29: 3, 22: 1}
Did not match all atoms present	1120-44-1	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Cu+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	1120-46-3	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Pb+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	1120-71-4	C1COS(=O)(=O)C1	{11: 3, 29: 2, 23: 1}
Did not match all atoms present	1120-87-2	C1=CN=CC=C1Br	{18: 1, 35: 1, 14: 4}
Did not match all atoms present	1120-88-3	CC1=CN=NC=C1	{1: 1, 35: 2, 14: 3}
Did not match all atoms present	1120-89-4	[2H]C1=CC=CC=C1	{14: 6}
Did not match all atoms present	1120-90-7	C1=CC(=CN=C1)I	{35: 1, 19: 1, 14: 4}
Did not match all atoms present	1120-93-0	C1=COC=CC1=S	{14: 4, 23: 1}
Did not match all atoms present	1120-94-1	C1=CSC=CC1=S	{41: 1, 14: 4}
Did not match all atoms present	1120-99-6	C1=CN=NC(=N1)N	{35: 3, 30: 1, 14: 2}
Did not match all atoms present	112017-99-9	CC(C)CC1=CC=C(C=C1)C(C)C(=O)OCC2=CC=CC=N2	{1: 3, 2: 2, 3: 2, 14: 8, 35: 1, 28: 1}
Did not match all atoms present	112022-83-0	B1(N2CCC[C@@H]2C(O1)(C3=CC=CC=C3)C4=CC=CC=C4)C	{1: 1, 33: 1, 11: 3, 12: 1, 13: 1, 14: 10, 23: 1}
Did not match all atoms present	112068-01-6	C1C[C@H](NC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{32: 1, 4: 1, 11: 3, 12: 1, 14: 10, 20: 1}
Did not match all atoms present	1121-03-5	CC1CCOS1(=O)=O	{1: 1, 11: 2, 12: 1, 29: 2, 23: 1}
Did not match all atoms present	1121-15-9	CC1=C(C(=O)C1=O)C	{1: 2, 25: 2}
Did not match all atoms present	1121-24-0	C1=CC=C(C(=C1)O)S	{21: 1, 14: 4, 39: 1}
Did not match all atoms present	1121-25-1	CC1=C(C=CC=N1)O	{1: 1, 35: 1, 21: 1, 14: 3}
Did not match all atoms present	1121-26-2	CC1=CC=CC=[N+]1C.[Cl-]	{1: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	1121-31-9	C1=CC(=S)N(C=C1)O	{33: 1, 21: 1, 14: 4}
Did not match all atoms present	1121-47-7	C1=COC(=C1)C=NO	{34: 1, 20: 1, 14: 3, 6: 1, 23: 1}
Did not match all atoms present	1121-53-5	[CH2-]C1=CC=CC=C1.[Na+]	{5: 1, 14: 5}
Did not match all atoms present	1121-55-7	C=CC1=CN=CC=C1	{14: 4, 35: 1, 5: 1, 6: 1}
Did not match all atoms present	1121-58-0	CNC1=CC=NC=C1	{1: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	1121-60-4	C1=CC=NC(=C1)C=O	{26: 1, 35: 1, 14: 4}
Did not match all atoms present	1121-70-6	CC1=CC=C(C=C1)[O-].[Na+]	{1: 1, 14: 4}
Did not match all atoms present	1121-76-2	C1=C[N+](=CC=C1Cl)[O-]	{17: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	1121-78-4	CC1=NC=C(C=C1)O	{1: 1, 35: 1, 21: 1, 14: 3}
Did not match all atoms present	1121-79-5	CC1=NN=C(C=C1)Cl	{1: 1, 35: 2, 14: 2, 17: 1}
Did not match all atoms present	1121-86-4	C1=CC(=CC(=C1)I)F	{16: 1, 19: 1, 14: 4}
Did not match all atoms present	112121-78-5	C1CCC(CC1)C2=C(C(=CC=C2)C3CCCCC3)N	{11: 10, 12: 2, 30: 1, 14: 3}
Did not match all atoms present	1122-39-0	CC1=CC(=NC=C1C)C	{1: 3, 35: 1, 14: 2}
Did not match all atoms present	1122-41-4	C1=CC(=C(C=C1Cl)Cl)S	{17: 2, 14: 3, 39: 1}
Did not match all atoms present	1122-42-5	CC1=CC(=C(C=C1)C)I	{1: 2, 19: 1, 14: 3}
Did not match all atoms present	1122-44-7	C1=NC(=O)NC(=C1I)N	{32: 1, 35: 1, 14: 1, 19: 1, 25: 1, 30: 1}
Did not match all atoms present	1122-47-0	CN1C=CC(=NC1=O)N	{1: 1, 35: 1, 33: 1, 14: 2, 25: 1, 30: 1}
Did not match all atoms present	1122-54-9	CC(=O)C1=CC=NC=C1	{24: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	1122-58-3	CN(C)C1=CC=NC=C1	{1: 2, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	1122-61-8	C1=CN=CC=C1[N+](=O)[O-]	{35: 1, 38: 1, 14: 4}
Did not match all atoms present	1122-62-9	CC(=O)C1=CC=CC=N1	{24: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	1122-69-6	CCC1=CC=CC(=N1)C	{1: 2, 2: 1, 35: 1, 14: 3}
Did not match all atoms present	1122-71-0	CC1=NC(=CC=C1)CO	{1: 1, 2: 1, 35: 1, 20: 1, 14: 3}
Did not match all atoms present	1122-72-1	CC1=CC=CC(=N1)C=O	{1: 1, 26: 1, 35: 1, 14: 3}
Did not match all atoms present	1122-81-2	CCCC1=CC=NC=C1	{1: 1, 2: 2, 35: 1, 14: 4}
Did not match all atoms present	1122-82-3	C1CCC(CC1)N=C=S	{8: 1, 34: 1, 11: 5, 12: 1}
Did not match all atoms present	1122-83-4	C1=CC=C(C=C1)N=S=O	{40: 1, 34: 1, 29: 1, 14: 5}
Did not match all atoms present	1122-85-6	C1=CC=C(C=C1)OC#N	{22: 1, 14: 5, 37: 1}
Did not match all atoms present	1122-90-3	C1=CC(=CC=C1N)[As]=O	{30: 1, 29: 1, 14: 4}
Did not match all atoms present	1122-91-4	C1=CC(=CC=C1C=O)Br	{18: 1, 26: 1, 14: 4}
Did not match all atoms present	1122-92-5	CN=C1C=CN(C=C1)O	{1: 1, 34: 1, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	1122-93-6	COC1=CC=C(C=C1)[O-].[K+]	{1: 1, 22: 1, 14: 4}
Did not match all atoms present	1122-96-9	COC1=CC=[N+](C=C1)[O-]	{1: 1, 33: 1, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	1122-97-0	CSC1=CC=C(C=C1)S	{40: 1, 1: 1, 14: 4, 39: 1}
Did not match all atoms present	112243-78-4	[CH-]1C=C(C2=CC=CC=C21)CCC3=C[CH-]C4=CC=CC=C43.Cl[Zr+2]Cl	{17: 2, 2: 2, 14: 12}
Did not match all atoms present	1123-54-2	C1=NC2=NNN=C2C(=N1)N	{32: 1, 35: 4, 30: 1, 14: 1}
Did not match all atoms present	1123-63-3	CC1=CC(=CC(=C1O)C)Cl	{1: 2, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	1123-73-5	CCC1=C(C(=CC=C1)O)C	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	1123-84-8	C=CC1=C(C=CC(=C1)Cl)Cl	{17: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	1123-85-9	CC(CO)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	1123-91-7	CC1=CC2=N[Se]N=C2C=C1	{1: 1, 35: 2, 14: 3}
Did not match all atoms present	1123-94-0	CCC1=C(C=C(C=C1)O)C	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	1123-95-1	C1=NC(=O)NC(=C1CO)N	{32: 1, 2: 1, 35: 1, 14: 1, 20: 1, 25: 1, 30: 1}
Did not match all atoms present	1123-96-2	CCC1=C(C=C(C=N1)C)C	{1: 3, 2: 1, 35: 1, 14: 2}
Did not match all atoms present	1123-98-4	C1=CC=C2C(=C1)N=C(S2)F	{16: 1, 41: 1, 35: 1, 14: 4}
Did not match all atoms present	112313-40-3	CCN(CC)P1(=C(P(=C1C2=CC=CC=C2)(N(CC)CC)N(CC)CC)C3=CC=CC=C3)N(CC)CC	{1: 8, 2: 8, 33: 4, 14: 10, 15: 2}
Did not match all atoms present	112360-63-1	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.C(=[N-])=S.C(=[N-])=S.C(=[N-])=S.C(=[N-])=S.[Zn+2]	{1: 6, 2: 3, 35: 1, 33: 3, 8: 4, 34: 2, 14: 5}
Did not match all atoms present	112379-49-4	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Ba+2]	{1: 10, 13: 2, 15: 6}
Did not match all atoms present	112399-50-5	C1=CC(=C(C=C1F)CBr)Br	{16: 1, 2: 1, 18: 2, 14: 3}
Did not match all atoms present	1124-04-5	CC1=CC(=C(C=C1C)Cl)O	{1: 2, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	1124-05-6	CC1=CC(=C(C=C1Cl)C)Cl	{1: 2, 14: 2, 17: 2}
Did not match all atoms present	1124-06-7	CC1=CC(=C(C=C1Cl)C)O	{1: 2, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	1124-07-8	CC1=CC(=C(C=C1Cl)Cl)O	{1: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	1124-11-4	CC1=C(N=C(C(=N1)C)C)C	{1: 4, 35: 2}
Did not match all atoms present	1124-18-1	[2H]C([2H])([2H])C1=CC=CC=C1	{1: 1, 14: 5}
Did not match all atoms present	1124-19-2	C1=CC=C(C=C1)[Sn](Cl)(Cl)Cl	{17: 3, 14: 5}
Did not match all atoms present	1124-20-5	CC1=CC=CC(=C1)C(=C)C	{1: 2, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1124-33-0	C1=C[N+](=CC=C1[N+](=O)[O-])[O-]	{33: 1, 38: 1, 29: 1, 14: 4}
Did not match all atoms present	1124-35-2	CCC1=CC(=CC(=N1)C)C	{1: 3, 2: 1, 35: 1, 14: 2}
Did not match all atoms present	1124-39-6	CCC1=CC(=C(C=C1)O)O	{1: 1, 2: 1, 21: 2, 14: 3}
Did not match all atoms present	1124-65-8	C1=CSC(=C1)/C=C/C(=O)O	{41: 1, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	112410-23-8	CCC1=CC=C(C=C1)C(=O)NN(C(=O)C2=CC(=CC(=C2)C)C)C(C)(C)C	{1: 6, 2: 1, 4: 1, 33: 1, 14: 7, 24: 2, 31: 1}
Did not match all atoms present	112419-76-8	CCCCCCCCC[C@@H](C1=CC=CC=C1)O	{1: 1, 2: 8, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	112456-87-8	CCN(CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C)C3=CC=C(C=C3)N=NC4=[N+](C=CN4C)C.C(=[N-])=S.C(=[N-])=S.C(=[N-])=S.C(=[N-])=S.[Zn+2]	{1: 6, 2: 4, 35: 1, 33: 6, 8: 4, 34: 4, 14: 11}
Did not match all atoms present	112459-17-3	C1=CC(=CC(=C1)NC(=O)OCCOCCOC(=O)NC2=CC=CC(=C2)CN=C=O)CN=C=O	{2: 6, 8: 2, 34: 2, 14: 8, 22: 1, 28: 2, 29: 2, 31: 2}
Did not match all atoms present	112473-80-0	CC1=CC=C(C=C1)C(C(C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3	{1: 3, 2: 1, 3: 2, 14: 13, 22: 1, 28: 1}
Did not match all atoms present	112494-52-7	CC1=C(C2=CC=CC=C2C=C1)Cl	{1: 1, 14: 6, 17: 1}
Did not match all atoms present	1125-26-4	C[Si](C)(C=C)C1=CC=CC=C1	{1: 2, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	1125-27-5	CC[Si](C1=CC=CC=C1)(Cl)Cl	{1: 1, 2: 1, 14: 5, 17: 2}
Did not match all atoms present	1125-28-6	CC1=C(C(=NN1C)C)C(=O)C	{24: 1, 1: 4, 35: 1, 33: 1}
Did not match all atoms present	1125-30-0	CC1=C(C(=NN1C)C)[N+](=O)[O-]	{1: 3, 35: 1, 38: 1, 33: 1}
Did not match all atoms present	1125-52-6	C1=C(C(=C(C(=C1Br)Cl)Cl)Cl)Cl	{17: 4, 18: 1, 14: 1}
Did not match all atoms present	1125-60-6	C1=CC2=C(C=CN=C2)C(=C1)N	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	1125-74-2	C=CCC1=C(C(=CC=C1)O)O	{2: 1, 14: 3, 5: 1, 6: 1, 21: 2}
Did not match all atoms present	1125-78-6	C1CCC2=C(C1)C=CC(=C2)O	{11: 4, 21: 1, 14: 3}
Did not match all atoms present	1125-80-0	CC1=CC2=CC=CC=C2C=N1	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	1125-88-8	COC(C1=CC=CC=C1)OC	{1: 2, 3: 1, 22: 2, 14: 5}
Did not match all atoms present	1125-90-2	CN=CC1=CC=CC=C1OC	{1: 2, 22: 1, 34: 1, 14: 4, 6: 1}
Did not match all atoms present	112567-52-9	CCC(C)C1=CC2=CC=CC=C2C(=C1C(C)CC)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 2, 3: 2, 29: 3, 14: 5}
Did not match all atoms present	112573-73-6	CC(=O)SC[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)OCC2=CC=CC=C2	{1: 1, 2: 4, 3: 1, 40: 1, 14: 10, 24: 2, 28: 1, 31: 1}
Did not match all atoms present	112576-48-4	CCCCCCCCCCCCCCCCCC(=O)NCCN(CC)CCNC(=O)CCCCCCCCCCCCCCCCC.CCOS(=O)(=O)O	{1: 4, 2: 38, 33: 1, 20: 1, 22: 1, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	1126-00-7	C1=CC=C(C=C1)N2C=CC=N2	{33: 1, 35: 1, 14: 8}
Did not match all atoms present	1126-23-4	CC1=NC2=C(N1)C(=S)N=CN2	{32: 2, 1: 1, 35: 2, 14: 1}
Did not match all atoms present	1126-34-7	C1=CC(=CC(=C1)S(=O)(=O)[O-])N.[Na+]	{30: 1, 29: 3, 14: 4}
Did not match all atoms present	1126-46-1	COC(=O)C1=CC=C(C=C1)Cl	{1: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	1126-48-3	C1=CC(=CC=C1C(=O)O)[Hg].O	{27: 1, 14: 4}
Did not match all atoms present	1126-71-2	CN(C)CCC1=CC=CC=C1	{1: 2, 2: 2, 14: 5, 33: 1}
Did not match all atoms present	1126-74-5	C1=CC(=CN=C1)C=CC(=O)O	{35: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	1126-75-6	CC(C)COC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	1126-78-9	CCCCNC1=CC=CC=C1	{1: 1, 2: 3, 14: 5, 31: 1}
Did not match all atoms present	1126-79-0	CCCCOC1=CC=CC=C1	{1: 1, 2: 3, 22: 1, 14: 5}
Did not match all atoms present	1126-80-3	CCCCSC1=CC=CC=C1	{40: 1, 1: 1, 2: 3, 14: 5}
Did not match all atoms present	1126-81-4	CC(=O)NC1=CC=C(C=C1)S	{24: 1, 1: 1, 39: 1, 14: 4, 31: 1}
Did not match all atoms present	112641-20-0	C1=CC(=C(C(=C1)C(F)(F)F)F)C=O	{16: 4, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	112653-32-4	C[C@@H](C1=CC=CO1)O	{1: 1, 3: 1, 20: 1, 14: 3, 23: 1}
Did not match all atoms present	112674-81-4	CC(C)C(C(=O)O)NC(=O)C(CC1=CC=CC=C1)N	{1: 2, 2: 1, 3: 3, 14: 5, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	1127-45-3	C1=CC2=C(C(=C1)O)[N+](=CC=C2)[O-]	{33: 1, 21: 1, 14: 6, 29: 1}
Did not match all atoms present	1127-76-0	CCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 1, 14: 7}
Did not match all atoms present	112704-79-7	C1=CC(=C(C=C1Br)F)C(=O)O	{16: 1, 18: 1, 27: 1, 14: 3}
Did not match all atoms present	112715-52-3	COC(=O)C1=C(CC(=C(C1)[O-])C(=O)OC)[O-].[Na+].[Na+]	{1: 2, 11: 2, 28: 2, 15: 4}
Did not match all atoms present	112727-79-4	C1=CC(=CC=C1NC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O	{20: 2, 29: 4, 14: 8, 31: 1}
Did not match all atoms present	112740-56-4	CC(=O)/C(=N/O)/S(=O)C	{1: 2, 34: 1, 7: 1, 20: 1, 24: 1, 29: 1}
Did not match all atoms present	112740-58-6	CS(=O)(=O)CC(=O)/C=N/O	{1: 1, 2: 1, 6: 1, 34: 1, 20: 1, 24: 1, 29: 2}
Did not match all atoms present	1128-05-8	CC(=O)C1=CSC2=CC=CC=C21	{24: 1, 1: 1, 14: 5, 41: 1}
Did not match all atoms present	1128-16-1	C1=C(C=NC(=C1Cl)C(Cl)(Cl)Cl)Cl	{17: 5, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	1128-54-7	CC1=NN(C=C1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	1128-61-6	CC1=NC2=C(C=C1)C=C(C=C2)F	{16: 1, 1: 1, 35: 1, 14: 5}
Did not match all atoms present	1128-67-2	CN1C2=CC=CC=C2SC1=NN	{1: 1, 34: 1, 33: 1, 41: 1, 14: 4, 30: 1}
Did not match all atoms present	1128-76-3	CCOC(=O)C1=CC(=CC=C1)Cl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	1128-78-5	CC1=CC=CC=C1OC(=O)NC	{1: 2, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	112811-65-1	COC1=C(C(=CC(=C1F)F)C(=O)O)F	{16: 3, 1: 1, 27: 1, 22: 1, 14: 1}
Did not match all atoms present	112864-15-0	C1=CC2=C(C=CC(=C2C(=C1)C(=O)[O-])C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+]	{24: 2, 29: 3, 14: 5}
Did not match all atoms present	112883-43-9	C1=CC=C2C=C(C=CC2=C1)C[C@@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35	{2: 2, 3: 1, 12: 1, 14: 15, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	112885-41-3	CCOC1=CC(=C(C=C1C(=O)NCC2CN(CCO2)CC3=CC=C(C=C3)F)Cl)N	{1: 1, 2: 3, 33: 1, 11: 3, 12: 1, 14: 6, 16: 1, 17: 1, 22: 1, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	112897-97-9	C1=CC(=C(C=C1/C=C/C(=O)O)F)F	{16: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	112898-33-6	C1=CC(=C(C=C1F)/C=C/C(=O)O)F	{16: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	1129-19-7	C1=C(C=C(N=C1C(Cl)(Cl)Cl)Cl)Cl	{17: 5, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	1129-28-8	COC(=O)C1=CC(=CC=C1)CBr	{1: 1, 2: 1, 28: 1, 18: 1, 14: 4}
Did not match all atoms present	1129-29-9	CC(C)C1=CC=CC(=C1)C(=C)C	{1: 3, 3: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1129-30-2	CC(=O)C1=NC(=CC=C1)C(=O)C	{24: 2, 1: 2, 35: 1, 14: 3}
Did not match all atoms present	1129-35-7	COC(=O)C1=CC=C(C=C1)C#N	{1: 1, 28: 1, 37: 1, 14: 4}
Did not match all atoms present	1129-37-9	C1=CC(=CC=C1C=NO)[N+](=O)[O-]	{34: 1, 38: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	1129-41-5	CC1=CC(=CC=C1)OC(=O)NC	{1: 2, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	1129-50-6	CCCC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	1129-65-3	CCCCC#CC1=CC=CC=C1	{1: 1, 2: 3, 10: 2, 14: 5}
Did not match all atoms present	1129-69-7	CCCCCCC1=CC=CC=N1	{1: 1, 2: 5, 35: 1, 14: 4}
Did not match all atoms present	1129-88-0	C1=CC(=CC(=C1)OC#N)OC#N	{22: 2, 14: 4, 37: 2}
Did not match all atoms present	113-15-5	CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC7=CNC8=CC=CC(=C78)C6=C5)C	{32: 1, 1: 2, 2: 1, 33: 3, 11: 5, 12: 4, 13: 2, 14: 10, 15: 1, 20: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	113-21-3	CC(C(=O)[O-])O	{24: 1, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	113-24-6	CC(=O)C(=O)[O-].[Na+]	{24: 2, 1: 1}
Did not match all atoms present	113-38-2	CCC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)OC(=O)CC)C	{1: 3, 2: 2, 11: 6, 12: 4, 13: 1, 14: 3, 28: 2}
Did not match all atoms present	113-42-8	CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C	{32: 1, 1: 2, 2: 2, 3: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	113-45-1	COC(=O)C(C1CCCCN1)C2=CC=CC=C2	{32: 1, 1: 1, 3: 1, 11: 4, 12: 1, 14: 5, 28: 1}
Did not match all atoms present	113-52-0	CN(C)CCCN1C2=CC=CC=C2CCC3=CC=CC=C31.Cl	{1: 2, 2: 3, 33: 2, 11: 2, 14: 8, 17: 1}
Did not match all atoms present	113-53-1	CN(C)CCC=C1C2=CC=CC=C2CSC3=CC=CC=C31	{1: 2, 2: 2, 6: 1, 33: 1, 41: 1, 11: 1, 14: 8, 15: 1}
Did not match all atoms present	113-59-7	CN(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl	{1: 2, 2: 2, 6: 1, 33: 1, 41: 1, 14: 7, 15: 1, 17: 1}
Did not match all atoms present	113-79-1	C1CC(N(C1)C(=O)C2CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)N)C(=O)NC(CCCN=C(N)N)C(=O)NCC(=O)N	{32: 5, 33: 1, 2: 9, 3: 1, 7: 1, 41: 2, 11: 5, 12: 7, 34: 1, 14: 9, 21: 1, 24: 6, 25: 5, 30: 6, 31: 2}
Did not match all atoms present	113-80-4	CC[C@H](C)C1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)O)N)C(=O)N3CCCC3C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N	{32: 5, 1: 2, 2: 9, 3: 2, 33: 1, 7: 1, 41: 2, 11: 5, 12: 7, 34: 1, 14: 4, 21: 1, 24: 6, 25: 5, 30: 6, 31: 2}
Did not match all atoms present	1130-17-2	C[Si](C)(C)[Si](C)(C)C1=CC=CC=C1	{1: 5, 14: 5}
Did not match all atoms present	1130-51-4	CC[N+](C)(CC)C1=CC(=CC=C1)O.[Cl-]	{1: 3, 2: 2, 21: 1, 14: 4, 17: 1}
Did not match all atoms present	1130-52-5	CC(C(C1=CC(=C(C=C1)O)O)O)N.Cl	{1: 1, 3: 2, 14: 3, 17: 1, 20: 1, 21: 2, 30: 1}
Did not match all atoms present	113016-54-9	F[Mo](F)(F)F	{16: 4}
Did not match all atoms present	113035-27-1	CN(C)C1=C2C(=CC(=C2C(=N1)N(C)C)[Si](C)(C)C)[Si](C)(C)C	{1: 10, 35: 1, 33: 2, 14: 1, 15: 6}
Did not match all atoms present	113060-11-0	CCCCCCCCCCOCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 12, 22: 1, 17: 1}
Did not match all atoms present	113060-12-1	CCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)[O-])N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 2: 13, 34: 1, 14: 6, 15: 2, 22: 1, 24: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	113060-13-2	CC1=NC2=CC(=C(C=C2N1CCCO)Cl)Cl	{1: 1, 2: 3, 35: 1, 33: 1, 14: 2, 17: 2, 20: 1}
Did not match all atoms present	1131-01-7	CC1=C(C(=CC=C1)C)NC(=O)CCl	{1: 2, 2: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	1131-09-5	C1=CC=C2C(=C1)C(=CS2)CC(=O)O	{41: 1, 2: 1, 27: 1, 14: 5}
Did not match all atoms present	1131-15-3	C1C(C(=O)OC1=O)C2=CC=CC=C2	{28: 2, 11: 1, 12: 1, 14: 5}
Did not match all atoms present	1131-16-4	CC1=CC(=NN1C2=CC=CC=C2)C	{1: 2, 35: 1, 14: 6, 33: 1}
Did not match all atoms present	1131-18-6	CC1=NN(C(=C1)N)C2=CC=CC=C2	{1: 1, 35: 1, 30: 1, 14: 6, 33: 1}
Did not match all atoms present	1131-40-4	COC1=CC(=C(C(=C1)OC)Br)OC	{1: 3, 18: 1, 22: 3, 14: 2}
Did not match all atoms present	1131-60-8	C1CCC(CC1)C2=CC=C(C=C2)O	{11: 5, 12: 1, 21: 1, 14: 4}
Did not match all atoms present	1131-61-9	C1=CC=C(C=C1)C2=CC=[N+](C=C2)[O-]	{33: 1, 29: 1, 14: 9}
Did not match all atoms present	1131-62-0	CC(=O)C1=CC(=C(C=C1)OC)OC	{24: 1, 1: 3, 22: 2, 14: 3}
Did not match all atoms present	1131-63-1	C1CCC2=C(C1)C=CC(=C2)C(=O)O	{27: 1, 11: 4, 14: 3}
Did not match all atoms present	1131-64-2	C1CN(CC2=CC=CC=C21)C(=N)N	{33: 1, 36: 1, 7: 1, 11: 3, 14: 4, 30: 1}
Did not match all atoms present	113124-69-9	COC1=CC(=O)C2=C3C(=CN=C2C1=O)C4=C(N3)CCCC4	{32: 1, 1: 1, 35: 1, 11: 4, 14: 2, 15: 1, 22: 1, 25: 2}
Did not match all atoms present	113136-77-9	C1CC1(C(=O)NC2=C(C=C(C=C2)Cl)Cl)C(=O)O	{11: 2, 13: 1, 14: 3, 17: 2, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	113152-92-4	[Bi-3].[O].[O].[O].[O]	{}
Did not match all atoms present	113170-71-1	C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)C(F)(F)F	{4: 1, 38: 1, 14: 2, 16: 3, 18: 1, 30: 1}
Did not match all atoms present	113184-20-6	CC(C(=O)[O-])(O)O.CC(C(=O)[O-])(O)O.CC(C(=O)[O-])(O)O.CC(C(=O)[O-])(O)[O-].[Na+].[Zr+4]	{24: 4, 1: 4, 4: 4, 29: 1, 20: 7}
Did not match all atoms present	113184-23-9	C[N+](C)(C)CC(COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2)O.[Cl-]	{1: 3, 2: 2, 3: 1, 14: 9, 17: 1, 20: 1, 22: 1, 24: 1}
Did not match all atoms present	113184-24-0	C1=CC(=CC=C1N/N=C/2\C(=CC3=C(C=CC(=C3C2=O)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 1, 14: 7, 15: 2, 17: 2, 22: 1, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	113187-28-3	CCOP(=O)(CC(=O)OCC=C)OCC	{1: 2, 2: 4, 5: 1, 6: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	1132-05-4	CC(=O)C1=CC(=C(C=C1)O)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 3, 21: 1, 24: 1}
Did not match all atoms present	1132-14-5	CC(C)(C)C1=CC(=NN1)C(C)(C)C	{32: 1, 1: 6, 35: 1, 4: 2, 14: 1}
Did not match all atoms present	1132-21-4	COC1=CC(=CC(=C1)C(=O)O)OC	{1: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	1132-39-4	C1=CC=C(C=C1)[Se]C2=CC=CC=C2	{14: 10}
Did not match all atoms present	1132-61-2	C1COCCN1CCCS(=O)(=O)O	{33: 1, 2: 3, 11: 4, 20: 1, 23: 1, 29: 2}
Did not match all atoms present	1132-66-7	CCCCCCOC1=CC=CC=C1	{1: 1, 2: 5, 22: 1, 14: 5}
Did not match all atoms present	1132-68-9	C1=CC(=CC=C1C[C@@H](C(=O)O)N)F	{2: 1, 3: 1, 14: 4, 16: 1, 27: 1, 30: 1}
Did not match all atoms present	113211-94-2	C1=CC(=C(C(=C1)F)F)CBr	{16: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	113221-73-1	CC1CC(C2=C(C1(C)C)C=C(C=C2)C=O)(C)C	{1: 5, 11: 1, 12: 1, 13: 2, 14: 3, 26: 1}
Did not match all atoms present	113221-74-2	C(C(=O)[O-])N1C(=S)N=NN1.[Na+]	{24: 1, 32: 1, 2: 1, 35: 2, 33: 1}
Did not match all atoms present	113252-64-5	[H+].[H+].[H+].CCCCC(CC)COP(=O)(OCC(CC)CCCC)OP(=O)(O)[O-].CCCCC(CC)COP(=O)(OCC(CC)CCCC)OP(=O)(O)[O-].CCCCC(CC)COP(=O)(OCC(CC)CCCC)OP(=O)(O)[O-].CCC(CO)(COCC=C)COCC=C.[Zr]	{1: 13, 2: 36, 3: 6, 4: 1, 5: 2, 6: 2, 20: 4, 22: 11, 29: 9}
Did not match all atoms present	113269-09-3	C1=NC2=CC(=C(C=C2N=C1)Br)[N+](=O)[O-]	{18: 1, 35: 2, 38: 1, 14: 4}
Did not match all atoms present	113275-12-0	C1(=C(C(=NC(=C1Cl)Cl)C(=O)[O-])Cl)Cl.[Na+]	{24: 1, 17: 4, 35: 1}
Did not match all atoms present	1133-80-8	C1C2=CC=CC=C2C3=C1C=C(C=C3)Br	{18: 1, 11: 1, 14: 7}
Did not match all atoms present	113366-20-4	CC1=CC(=C(C=C1)C)C(=CC2=CC=CC=C2[N+](=O)[O-])C#N	{1: 2, 37: 1, 38: 1, 7: 1, 14: 7, 6: 1}
Did not match all atoms present	1134-04-9	C1(=C(C(=NC(=C1Cl)Cl)C(Cl)(Cl)Cl)Cl)Cl	{17: 7, 35: 1, 4: 1}
Did not match all atoms present	1134-35-6	CC1=CC(=NC=C1)C2=NC=CC(=C2)C	{1: 2, 35: 2, 14: 6}
Did not match all atoms present	1134-36-7	C1=CC=C(C=C1)C2=CC(=C(C=C2)O)N	{30: 1, 21: 1, 14: 8}
Did not match all atoms present	1134-40-3	CC1=CC2=CC(=C(C=C2C=C1C)C)C	{1: 4, 14: 4}
Did not match all atoms present	1134-47-0	C1=CC(=CC=C1C(CC(=O)O)CN)Cl	{2: 2, 3: 1, 14: 4, 17: 1, 27: 1, 30: 1}
Did not match all atoms present	1134-62-9	CCCCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 3, 14: 7}
Did not match all atoms present	1134-87-8	CC(=O)C(CC1=CC=CC=C1)C(=O)C	{24: 2, 1: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	113436-88-7	CCCCCCOC(=O)CCCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CCCC(=O)OCCCCCC)O	{1: 6, 2: 16, 4: 2, 14: 2, 21: 2, 28: 2}
Did not match all atoms present	113496-36-9	C=O.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O	{20: 1, 5: 1, 14: 7, 29: 2}
Did not match all atoms present	1135-12-2	C1=CC=C(C=C1)CC2=CC=C(C=C2)N	{2: 1, 30: 1, 14: 9}
Did not match all atoms present	1135-14-4	C1=CC=C(C=C1)SC2=CC=C(C=C2)N	{40: 1, 30: 1, 14: 9}
Did not match all atoms present	1135-23-5	COC1=C(C=CC(=C1)CCC(=O)O)O	{1: 1, 2: 2, 14: 3, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	1135-40-6	C1CCC(CC1)NCCCS(=O)(=O)O	{2: 3, 11: 5, 12: 1, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	1135-51-9	B1(OCCO1)OCCOB2OCCO2	{2: 2, 11: 4, 22: 2, 23: 4}
Did not match all atoms present	1135-67-7	C1CCC(CC1)(C2=CC=CC=C2)C(=O)O	{27: 1, 11: 5, 13: 1, 14: 5}
Did not match all atoms present	1135-99-5	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(Cl)Cl	{17: 2, 14: 10}
Did not match all atoms present	113504-93-1	C1OC2=C(O1)C=C(C=C2)N=C=S	{8: 1, 34: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	113548-89-3	CCCCCCOP(=O)(C)F	{16: 1, 1: 2, 2: 5, 29: 1, 22: 1}
Did not match all atoms present	113571-15-6	C1=C(C(=C(C(=C1Br)Cl)Cl)N)Br	{17: 2, 18: 2, 30: 1, 14: 1}
Did not match all atoms present	1136-45-4	CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)O	{1: 1, 27: 1, 35: 1, 14: 5, 23: 1}
Did not match all atoms present	1136-84-1	CNC(=O)OC1=CC=CC2=C1CCCC2	{1: 1, 11: 4, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	1136-86-3	CC(=O)C1=CC(=C(C(=C1)OC)OC)OC	{24: 1, 1: 4, 22: 3, 14: 2}
Did not match all atoms present	1136-89-6	C1=CC=C2C(=C1)C=CC=C2OP(=O)(O)O	{20: 2, 22: 1, 14: 7, 29: 1}
Did not match all atoms present	113659-04-4	CC1(CC(CC(C1)(C)CNC(=O)ON(CC2=CC=CC=C2)CC3=CC=CC=C3)NC(=O)ON(CC4=CC=CC=C4)CC5=CC=CC=C5)C	{1: 3, 2: 5, 33: 2, 11: 3, 12: 1, 13: 2, 14: 20, 28: 2, 31: 2}
Did not match all atoms present	113698-18-3	CC1=NC2=C(C(=O)C=C(C2=O)OC)C3=C1C4=C(N3)CCCC4	{32: 1, 1: 2, 35: 1, 11: 4, 14: 1, 15: 1, 22: 1, 25: 2}
Did not match all atoms present	113698-22-9	CC1=NC2=C(C(=O)C=C(C2=O)OC)C3=C1C4=CC=CC=C4N3	{32: 1, 1: 2, 35: 1, 14: 5, 15: 1, 22: 1, 25: 2}
Did not match all atoms present	113698-48-9	C1=CC2=CN(N=C2C=C1)/N=C/C3=CC=C(O3)[N+](=O)[O-]	{33: 1, 34: 1, 35: 1, 38: 1, 6: 1, 14: 7, 23: 1}
Did not match all atoms present	113698-50-3	CSC1=NN=C(N1/N=C/C2=CC=C(O2)[N+](=O)[O-])SC	{1: 2, 34: 1, 35: 2, 38: 1, 6: 1, 33: 1, 40: 2, 14: 2, 23: 1}
Did not match all atoms present	1137-41-3	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N	{24: 1, 30: 1, 14: 9}
Did not match all atoms present	1137-42-4	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)O	{24: 1, 21: 1, 14: 9}
Did not match all atoms present	1137-68-4	C1=CC=C2C(=C1)NC(=N2)C3=CC=CC=N3	{32: 1, 35: 2, 14: 8}
Did not match all atoms present	1137-73-1	C1=CC=C(C=C1)N(CC(=O)O)CC(=O)O	{33: 1, 2: 2, 27: 2, 14: 5}
Did not match all atoms present	1137-79-7	CN(C)C1=CC=C(C=C1)C2=CC=CC=C2	{1: 2, 14: 9, 33: 1}
Did not match all atoms present	1137-96-8	C1=CC=C(C=C1)/C=[N+](/C2=CC=CC=C2)\[O-]	{33: 1, 14: 10, 6: 1, 29: 1}
Did not match all atoms present	1137-99-1	O=C(O)c1ccc(C(=O)OCCO)cc1	{28: 1, 2: 2, 27: 1, 20: 1, 14: 4}
Did not match all atoms present	113706-14-2	CCC(C)OP(=S)(OCCCCCC(C)C)S	{1: 4, 2: 6, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	113779-16-1	C1=CC=C2C(=C1)C3=C4C5=C(C=CC5=CC6=C4C2=CC=C6)C=C3	{14: 12}
Did not match all atoms present	113798-74-6	C1=CC(=C(C(=C1F)O)F)F	{16: 3, 21: 1, 14: 2}
Did not match all atoms present	1138-15-4	C1=CC=C(C=C1)C=CC(=O)N2C=CN=C2	{24: 1, 33: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	1138-52-9	CC(C)(C)C1=CC(=CC(=C1)O)C(C)(C)C	{1: 6, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	1138-56-3	CCCCOC1=CC=C(C=C1)S(=O)(=O)Cl	{1: 1, 2: 3, 14: 4, 17: 1, 22: 1, 29: 2}
Did not match all atoms present	1138-80-3	C1=CC=C(C=C1)COC(=O)NCC(=O)O	{2: 2, 27: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	113826-06-5	CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2CO2	{1: 1, 2: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	113852-37-2	C1=CN(C(=O)N=C1N)C[C@@H](CO)OCP(=O)(O)O	{33: 1, 2: 3, 3: 1, 14: 2, 35: 1, 20: 3, 22: 1, 25: 1, 29: 1, 30: 1}
Did not match all atoms present	113869-06-0	CCOC(=O)C1=CC2=CC3=C4C(=C2OC1=O)C(CCN4CCC3(C)C)(C)C	{1: 5, 2: 1, 33: 1, 11: 4, 13: 2, 14: 2, 28: 2}
Did not match all atoms present	1139-52-2	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)Br	{1: 6, 18: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	1139-82-8	C1C(=O)CC2=CC=CC=C2C3=CC=CC=C31	{25: 1, 11: 2, 14: 8}
Did not match all atoms present	113913-36-3	CCOC(=O)C1=C(C2=CC=CC=C2S(=O)(=O)N1C)O	{1: 2, 2: 1, 33: 1, 14: 4, 15: 2, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	113915-68-7	CN(C)C1=CC=C(C=C1)C(=CC2(CC(=O)C3=C2C(=C(C(=C3Cl)Cl)Cl)Cl)C=C(C4=CC=C(C=C4)N(C)C)C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC	{1: 6, 33: 2, 6: 2, 7: 2, 11: 1, 13: 1, 14: 16, 17: 4, 22: 2, 25: 1}
Did not match all atoms present	113917-64-9	CN1C2=CC=CC=C2C(=O)C1=C(C(=O)OC)NC3=CC=C(C=C3)OC	{1: 3, 33: 1, 7: 1, 14: 8, 15: 1, 22: 1, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	113960-14-8	CC1(CC(CC(N1C(=O)C=C)(C)C)OC(=O)C(CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)(CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C(=O)OC4CC(N(C(C4)(C)C)C(=O)C=C)(C)C)C	{1: 20, 2: 2, 4: 5, 5: 2, 6: 2, 33: 2, 11: 4, 12: 2, 13: 4, 14: 4, 21: 2, 24: 2, 28: 2}
Did not match all atoms present	114-03-4	C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	114-25-0	CC1=C(C(=CC2=C(C(=C(N2)C=C3C(=C(C(=O)N3)C)C=C)C)CCC(=O)O)NC1=CC4=NC(=O)C(=C4C)C=C)CCC(=O)O	{32: 3, 1: 4, 2: 4, 35: 1, 5: 2, 6: 5, 15: 6, 25: 2, 27: 2}
Did not match all atoms present	114-26-1	CC(C)OC1=CC=CC=C1OC(=O)NC	{1: 3, 3: 1, 14: 4, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	114-33-0	CNC(=O)C1=CN=CC=C1	{24: 1, 1: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	114-38-5	C1=CC=C(C(=C1)NC(=O)N)Cl	{24: 1, 17: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	114-42-1	CCCC(=O)C1=C(C(=C(C(=C1O)CC2=C(C(C(=O)C(=C2O)C(=O)CCC)(C)C)O)O)C)O	{1: 5, 2: 5, 13: 1, 15: 4, 20: 2, 21: 3, 24: 2, 25: 1}
Did not match all atoms present	114-49-8	CN1C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4.Br	{1: 1, 2: 1, 3: 1, 33: 1, 11: 2, 12: 5, 14: 5, 18: 1, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	114-63-6	C1=CC(=CC=C1C(=O)[O-])O.[Na+]	{24: 1, 21: 1, 14: 4}
Did not match all atoms present	114-70-5	C1=CC=C(C=C1)CC(=O)[O-].[Na+]	{24: 1, 2: 1, 14: 5}
Did not match all atoms present	114-80-7	CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.[Br-]	{1: 5, 18: 1, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	114-83-0	CC(=O)NNC1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 31: 2}
Did not match all atoms present	114-86-3	C1=CC=C(C=C1)CCN=C(N)N=C(N)N	{2: 2, 34: 2, 30: 3, 14: 5, 7: 2}
Did not match all atoms present	114-91-0	COCCC1=CC=CC=N1	{1: 1, 2: 2, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	1140-14-3	CC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)C	{24: 1, 1: 2, 14: 8}
Did not match all atoms present	1140-16-5	CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C	{24: 1, 1: 2, 14: 8}
Did not match all atoms present	114088-58-3	C1=NC2=C(N1CCOCP(=O)(O)O)NC(=NC2=O)N	{32: 1, 33: 1, 2: 3, 35: 2, 14: 1, 20: 2, 22: 1, 25: 1, 29: 1, 30: 1}
Did not match all atoms present	1141-06-6	C1=CC=NC(=C1)C(C(=O)C2=CC=CC=N2)O	{24: 1, 35: 2, 3: 1, 20: 1, 14: 8}
Did not match all atoms present	1141-37-3	C1=CC(=CC=C1C(=O)O)N(CCCl)CCCl	{17: 2, 2: 4, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	1141-38-4	C1=CC2=C(C=CC(=C2)C(=O)O)C=C1C(=O)O	{27: 2, 14: 6}
Did not match all atoms present	1141-45-3	C1=CC=C2C=C(C=CC2=C1)SCCC(=O)O	{40: 1, 2: 2, 27: 1, 14: 7}
Did not match all atoms present	1141-59-9	C1=CC=NC(=C1)NN=C2C=CC(=O)C=C2O	{34: 1, 35: 1, 14: 7, 15: 2, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	1141-88-4	C1=CC=C(C(=C1)N)SSC2=CC=CC=C2N	{40: 2, 30: 2, 14: 8}
Did not match all atoms present	114119-92-5	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)N=O	{1: 1, 34: 1, 33: 1, 11: 1, 14: 7, 24: 1, 29: 1}
Did not match all atoms present	114145-42-5	CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)N3CCOCC3	{1: 2, 2: 2, 33: 2, 11: 4, 14: 4, 23: 1, 28: 1}
Did not match all atoms present	114152-19-1	C1=CC(=C(C(=C1F)CO)F)F	{16: 3, 2: 1, 20: 1, 14: 2}
Did not match all atoms present	114162-64-0	C1CCC(CC1)N.C1=CC(=C(C2=C1NC=C2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)Cl)Br	{32: 1, 11: 5, 12: 6, 14: 3, 17: 1, 18: 1, 20: 3, 22: 1, 23: 1, 27: 1, 30: 1}
Did not match all atoms present	114171-77-6	CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)SC#N)C	{1: 3, 2: 2, 37: 1, 33: 1, 40: 1, 14: 3, 28: 1}
Did not match all atoms present	114184-41-7	C[Si]1(C2=CC=C(S2)[Si]([Si](C3=CC=C([Si]1(C)C)S3)(C)C)(C)C)C	{1: 8, 14: 4, 41: 2}
Did not match all atoms present	114184-42-8	C[Si]1(C2=CC=C(O2)[Si]([Si](C3=CC=C(O3)[Si]1(C)C)(C)C)(C)C)C	{1: 8, 14: 4, 23: 2}
Did not match all atoms present	1142-15-0	COC1=CC=C(C=C1)/C=C/C2=CC=CC=C2	{1: 1, 22: 1, 14: 9, 6: 2}
Did not match all atoms present	1142-19-4	C1=CC(=CC=C1SSC2=CC=C(C=C2)Cl)Cl	{40: 2, 17: 2, 14: 8}
Did not match all atoms present	1142-20-7	C[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1142-39-8	CCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 5, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	1142-97-8	C1=CC=C(C=C1)SS(=O)(=O)C2=CC=C(C=C2)Cl	{40: 1, 17: 1, 29: 2, 14: 9}
Did not match all atoms present	114292-91-0	C1=C(C=NC(=C1Br)N)N	{18: 1, 35: 1, 30: 2, 14: 2}
Did not match all atoms present	1143-38-0	C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O	{25: 1, 11: 1, 21: 2, 14: 6}
Did not match all atoms present	114317-22-5	[O-]P(=O)([O-])[O-].[F-].[Ca+2].[Ca+2]	{16: 1, 29: 4}
Did not match all atoms present	114369-43-6	C1=CC=C(C=C1)C(CCC2=CC=C(C=C2)Cl)(CN3C=NC=N3)C#N	{33: 1, 2: 3, 35: 2, 4: 1, 37: 1, 14: 11, 17: 1}
Did not match all atoms present	114389-70-7	CCCCN(CCCC)[C@H](C)[C@H](C1=CC=CC=C1)O	{1: 3, 2: 6, 3: 2, 33: 1, 14: 5, 20: 1}
Did not match all atoms present	114391-97-8	CCC1C/C(=C\C2=CC=C(C=C2)N=[N+]=[N-])/C(=O)/C(=C/C3=CC=C(C=C3)N=[N+]=[N-])/C1	{1: 1, 2: 1, 6: 2, 11: 2, 12: 1, 34: 4, 14: 8, 15: 2, 25: 1}
Did not match all atoms present	1144-74-7	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9}
Did not match all atoms present	114446-55-8	C[C@@H](C1=CC=CC=C1Br)O	{1: 1, 18: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	114460-02-5	CCC1=[C-]CC=C1.CCC1=[C-]CC=C1.[Mg+2]	{1: 2, 2: 2, 11: 2, 14: 4, 15: 2}
Did not match all atoms present	114480-39-6	CCCCC(CCCCCC(=O)[O-])C(=O)[O-].[NH4+].[NH4+]	{24: 2, 1: 1, 2: 8, 3: 1}
Did not match all atoms present	114492-65-8	CC(COP(=O)(OCC(C)Cl)OCC(CBr)Br)Cl	{1: 2, 2: 4, 3: 3, 17: 2, 18: 2, 22: 3, 29: 1}
Did not match all atoms present	114492-66-9	C(CCl)OP(=O)(OCCCl)OCC(CBr)Br	{2: 6, 3: 1, 17: 2, 18: 2, 22: 3, 29: 1}
Did not match all atoms present	1145-01-3	C1=CC=C(C=C1)C2=CC(=NN2)C3=CC=CC=C3	{32: 1, 35: 1, 14: 11}
Did not match all atoms present	1145-32-0	C1=CC=C(C=C1)C(=O)NCC(=O)NCC(=O)O	{24: 2, 2: 2, 27: 1, 14: 5, 31: 2}
Did not match all atoms present	1145-56-8	C1=CC(=CC=C1CC(C(=O)O)NC(=O)CCl)O	{2: 2, 3: 1, 14: 4, 17: 1, 21: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	1145-73-9	CN(C)C1=CC=C(C=C1)C=CC2=CC=CC=C2	{1: 2, 14: 9, 6: 2, 33: 1}
Did not match all atoms present	1145-76-2	C1=CC=C(C=C1)COC2=CC=C(C=C2)[N+](=O)[O-]	{2: 1, 38: 1, 22: 1, 14: 9}
Did not match all atoms present	1145-80-8	C1=CC=C(C=C1)COC(=O)N[C@@H](CO)C(=O)O	{2: 2, 3: 1, 14: 5, 20: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1145-93-3	CCOP(=O)(CC1=CC=C(C=C1)OC)OCC	{1: 3, 2: 3, 22: 3, 14: 4, 29: 1}
Did not match all atoms present	1145-98-8	C[Si](C)(C1=CC=CC=C1)[Si](C)(C)C2=CC=CC=C2	{1: 4, 14: 10}
Did not match all atoms present	114504-74-4	CCCC1=[C-]CC=C1.CCCC1=[C-]CC=C1.[Mg+2]	{1: 2, 2: 4, 11: 2, 14: 4, 15: 2}
Did not match all atoms present	114521-53-8	C[Si](C)(C)OC(=O)C1=CC(=CC=C1)Cl	{1: 3, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	114535-84-1	COC1=C(C=CC(=C1)NC2=CC=CC=C2)[N+]#N.C=O.OS(=O)(=O)[O-].Cl[Zn]Cl	{1: 1, 34: 1, 5: 1, 14: 8, 17: 2, 20: 1, 22: 1, 29: 3, 31: 1}
Did not match all atoms present	114535-85-2	CC1CO1.C1CO1.C1=CC=C2C(=C1)C(=O)OC2=O.C(COCCO)O	{1: 1, 2: 4, 11: 3, 12: 1, 14: 4, 20: 2, 22: 1, 23: 2, 28: 2}
Did not match all atoms present	114535-86-3	C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C(=O)OC3=CC=CC=C3.C(CCCN)CCN.C(CNCCN)N	{2: 10, 28: 2, 30: 4, 14: 14, 31: 1}
Did not match all atoms present	114535-87-4	C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C(=O)OC3=CC=CC=C3.C1=CC(=CC(=C1)CN)CN.C(CCCN)CCN	{2: 8, 28: 2, 30: 4, 14: 18}
Did not match all atoms present	114553-52-5	CC1=C(C(=CC=C1)C)OC(=O)C2=CC3=C(C=C2)C(=O)OC3=O	{1: 2, 28: 3, 14: 6}
Did not match all atoms present	1146-39-0	C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{38: 1, 29: 2, 14: 9}
Did not match all atoms present	1146-65-2	[2H]C1=C(C(=C2C(=C(C(=C(C2=C1[2H])[2H])[2H])[2H])[2H])[2H])[2H]	{14: 8}
Did not match all atoms present	1146-95-8	CCC(=C(C1=CC=CC=C1)C2=CC=CC=C2)CN.Cl	{1: 1, 2: 2, 7: 2, 14: 10, 17: 1, 30: 1}
Did not match all atoms present	1146-98-1	C1=CC=C2C(=C1)C(=O)C(C2=O)C3=CC=C(C=C3)Br	{25: 2, 18: 1, 12: 1, 14: 8}
Did not match all atoms present	1146-99-2	C1=CC=C2C(=C1)C(=O)C(C2=O)C3=CC=C(C=C3)Cl	{17: 1, 12: 1, 14: 8, 25: 2}
Did not match all atoms present	114654-31-8	C1CS(=O)(=O)CC1NC(=S)S	{39: 1, 11: 3, 12: 1, 7: 1, 29: 2, 31: 1}
Did not match all atoms present	114659-08-4	CC(=C)[Se]C	{1: 2, 5: 1, 7: 1}
Did not match all atoms present	114679-30-0	[H+].C1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)[O-])/C=C/C3=CC(=C(C=C3Cl)S(=O)(=O)[O-])Cl)[O-].[Mn+2]	{33: 1, 35: 1, 6: 2, 14: 7, 17: 2, 24: 1, 29: 3}
Did not match all atoms present	114691-30-4	C1C[C@H](N(C1)C(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC3=CC=C(C=C3)O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)O	{33: 2, 2: 5, 3: 3, 11: 6, 12: 2, 14: 4, 21: 1, 24: 6, 27: 1, 30: 3, 31: 2}
Did not match all atoms present	114693-66-2	C[Si](C)(C)C1C(S1)[Si](C)(C)C	{1: 6, 12: 2, 41: 1}
Did not match all atoms present	114693-68-4	C[Si](C)(C)C1CS1	{1: 3, 11: 1, 12: 1, 41: 1}
Did not match all atoms present	114693-78-6	CC(C)(C)C1(CO1)[Si](C)(C)C	{1: 6, 11: 1, 4: 1, 13: 1, 23: 1}
Did not match all atoms present	114693-79-7	C[Si](C)(C)C1C(O1)[Si](C)(C)C	{1: 6, 12: 2, 23: 1}
Did not match all atoms present	1147-55-3	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=CC=C3O	{1: 1, 11: 1, 14: 6, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	114715-38-7	C1CN(C[C@H]1N)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 3, 12: 1, 14: 5, 30: 1}
Did not match all atoms present	114715-39-8	C1CN(C[C@@H]1N)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 3, 12: 1, 14: 5, 30: 1}
Did not match all atoms present	114720-33-1	CC[N+]1=C(SC2=CC=CC=C21)/C=C/C=C/C3=CC=C(C=C3)N(C)C	{1: 3, 2: 1, 6: 4, 33: 2, 41: 1, 14: 8}
Did not match all atoms present	114747-29-4	CCCCCCCCCCCCS(=O)(=O)CC(C)C(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)N2C(=O)CN(C2=O)CC3=CC=CC=C3	{1: 5, 2: 13, 3: 2, 4: 1, 33: 2, 11: 1, 14: 8, 17: 1, 24: 3, 25: 2, 29: 2, 31: 2}
Did not match all atoms present	114747-44-3	CC1(C2=CC=CC=C2N(C13C=NC4=C(O3)C=C(C5=CC=CC=C54)N6CCC7=CC=CC=C76)C)C	{1: 3, 35: 1, 33: 2, 11: 2, 13: 2, 14: 14, 23: 1}
Did not match all atoms present	114747-45-4	CC1(C2=CC=CC=C2N(C13C=NC4=C(O3)C=C(C5=CC=CC=C54)N6CCCCC6)C)C	{1: 3, 35: 1, 33: 2, 11: 5, 13: 2, 14: 10, 23: 1}
Did not match all atoms present	114766-08-4	CCN(CC)C1=C[C@@H]2[C@@H](C=C1)N(C3=C(O2)C=CC(=C3)N(CC)CC)C(=O)C4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C	{1: 10, 2: 4, 4: 2, 33: 3, 12: 2, 14: 8, 15: 1, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	114772-53-1	CC1=CC=C(C=C1)C2=CC=CC=C2C#N	{1: 1, 37: 1, 14: 8}
Did not match all atoms present	114773-97-6	CC(=NOC)C1=CC=CS1	{1: 2, 34: 1, 7: 1, 41: 1, 14: 3, 22: 1}
Did not match all atoms present	1148-11-4	C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)O	{33: 1, 2: 1, 11: 3, 12: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	1148-79-4	C1=CC=NC(=C1)C2=NC(=CC=C2)C3=CC=CC=N3	{35: 3, 14: 11}
Did not match all atoms present	114820-71-2	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])N/N=C\3/C=C(C(=CC3=O)O)N=NC4=C5C(=CC(=C4)S(=O)(=O)[O-])C=C(C=C5O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 3, 38: 1, 14: 13, 15: 3, 20: 1, 21: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	114839-95-1	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])N/N=C\3/C=C(C(=C(C3=O)CO)O)N=NC4=C5C(=CC(=C4)S(=O)(=O)[O-])C=C(C=C5O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 1, 38: 1, 34: 3, 14: 12, 15: 4, 20: 2, 21: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	114873-00-6	CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1F)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	114873-01-7	CC(C)(C)OC(=O)N[C@@H](CC1=CC(=CC=C1)F)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	114873-05-1	CC1=CC=CC=C1C[C@@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 4, 2: 1, 3: 1, 4: 1, 14: 4, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	114873-10-8	CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1F)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	114873-11-9	CC(C)(C)OC(=O)N[C@H](CC1=CC(=CC=C1)F)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	114873-13-1	CC(C)(C)OC(=O)N[C@H](CC1=CC(=C(C=C1)Cl)Cl)C(=O)[O-]	{1: 3, 2: 1, 3: 1, 4: 1, 14: 3, 17: 2, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	114877-91-7	CC(C)C(C(=O)OC)N=C=S	{8: 1, 1: 3, 34: 1, 3: 2, 28: 1}
Did not match all atoms present	114899-77-3	CC1=C(C(=C2[C@@H]3[C@@H]4[C@H]5C6=C([C@@H](N4[C@H]([C@@H](N3C)CC2=C1)O)COC(=O)[C@@]7(CS5)C8=CC(=C(C=C8CCN7)O)OC)C9=C(C(=C6OC(=O)C)C)OCO9)O)OC	{32: 1, 1: 6, 33: 2, 41: 1, 11: 6, 12: 6, 13: 1, 14: 3, 20: 1, 21: 2, 22: 2, 23: 2, 28: 2}
Did not match all atoms present	1149-16-2	C1=CC=C(C(=C1)N/C=C/N=C2C=CC=CC2=O)O	{34: 1, 6: 2, 14: 8, 15: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	1149-24-2	CCOC(=O)C1=CC(=C(N=C1C)C)C(=O)OCC	{1: 4, 2: 2, 35: 1, 28: 2, 14: 1}
Did not match all atoms present	1149-26-4	CC(C)[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1	{1: 2, 2: 1, 3: 2, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1149-42-4	CCOC(=O)C(C)OC(=O)NC1=CC(=CC=C1)Cl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 28: 2, 31: 1}
Did not match all atoms present	114901-61-0	O=[Ca].O=[Cu].O=[Cu].O=[Sr].O=[Sr].O=[Bi]O[Bi]=O.O=[Bi]O[Bi]=O	{29: 9, 22: 2}
Did not match all atoms present	114971-52-7	C[N+](C)(C)CC1=CC=CC=C1.Cl[I-]Cl	{1: 3, 2: 1, 19: 1, 14: 5, 17: 2}
Did not match all atoms present	114977-28-5	CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O	{1: 8, 3: 2, 4: 1, 11: 3, 12: 6, 13: 4, 14: 10, 15: 2, 20: 4, 23: 1, 25: 1, 28: 4, 31: 1}
Did not match all atoms present	114991-53-6	CCCOC(=O)C1C2CCC([NH+]2C)CC1OC(=O)C3=CC=CC=C3.[Cl-]	{1: 2, 2: 2, 11: 3, 12: 4, 14: 5, 17: 1, 28: 2}
Did not match all atoms present	115-02-6	C(C(C(=O)O)N)OC(=C[N+]#N)[O-]	{2: 1, 3: 1, 6: 1, 7: 1, 34: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	115-08-2	C(=S)N	{30: 1, 6: 1}
Did not match all atoms present	115-09-3	C[Hg]Cl	{1: 1, 17: 1}
Did not match all atoms present	115-21-9	CC[Si](Cl)(Cl)Cl	{1: 1, 2: 1, 17: 3}
Did not match all atoms present	115-24-2	CCS(=O)(=O)C(C)(C)S(=O)(=O)CC	{1: 4, 2: 2, 4: 1, 29: 4}
Did not match all atoms present	115-26-4	CN(C)P(=O)(N(C)C)F	{16: 1, 1: 4, 29: 1, 33: 2}
Did not match all atoms present	115-29-7	C1C2C(COS(=O)O1)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{11: 2, 12: 2, 13: 3, 15: 2, 17: 6, 23: 2, 29: 1}
Did not match all atoms present	115-32-2	C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C(Cl)(Cl)Cl)O)Cl	{17: 5, 4: 2, 14: 8, 20: 1}
Did not match all atoms present	115-33-3	CC(=O)OC1=CC=C(C=C1)C2(C3=CC=CC=C3NC2=O)C4=CC=C(C=C4)OC(=O)C	{32: 1, 1: 2, 13: 1, 14: 12, 25: 1, 28: 2}
Did not match all atoms present	115-37-7	CN1CC[C@]23[C@@H]4C(=CC=C2[C@H]1CC5=C3C(=C(C=C5)OC)O4)OC	{1: 3, 33: 1, 11: 3, 12: 2, 13: 1, 14: 4, 15: 2, 22: 2, 23: 1}
Did not match all atoms present	115-38-8	CCC1(C(=O)NC(=O)N(C1=O)C)C2=CC=CC=C2	{32: 1, 1: 2, 2: 1, 33: 1, 13: 1, 14: 5, 25: 3}
Did not match all atoms present	115-39-9	C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC(=C(C(=C3)Br)O)Br)C4=CC(=C(C(=C4)Br)O)Br	{13: 1, 14: 8, 18: 4, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	115-40-2	CC1=C(C(=CC(=C1)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4)Br)O)C)Br)O	{1: 2, 13: 1, 14: 8, 18: 2, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	115-43-5	C=CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2	{32: 2, 2: 1, 5: 1, 6: 1, 13: 1, 14: 5, 25: 3}
Did not match all atoms present	115-46-8	C1CNCCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{32: 1, 4: 1, 11: 4, 12: 1, 14: 10, 20: 1}
Did not match all atoms present	115-53-7	CN1CC[C@@]23CC(=O)C(=C[C@@H]2[C@@H]1CC4=C3C(=C(C=C4)OC)O)OC	{1: 3, 33: 1, 11: 4, 12: 2, 13: 1, 14: 3, 15: 1, 21: 1, 22: 2, 25: 1}
Did not match all atoms present	115-56-0	CCC1(C(=O)NC(=S)NC1=O)CC(=C)C	{32: 2, 1: 2, 2: 2, 5: 1, 7: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	115-63-9	C[N+]1(CCN(CC1)CC(C2CCCCC2)(C3=CC=CC=C3)O)C.COS(=O)(=O)[O-]	{1: 3, 2: 1, 4: 1, 33: 1, 11: 9, 12: 1, 14: 5, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	115-79-7	CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)CC1=CC=CC=C1Cl)CC2=CC=CC=C2Cl.[Cl-].[Cl-]	{1: 4, 2: 10, 14: 8, 17: 4, 24: 2, 31: 2}
Did not match all atoms present	115-82-2	CCCCC(CC)CO[Si](OCC(CC)CCCC)(OCC(CC)CCCC)OCC(CC)CCCC	{1: 8, 2: 20, 3: 4, 22: 4}
Did not match all atoms present	115-85-5	C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3Cl	{17: 1, 22: 3, 14: 14, 29: 1}
Did not match all atoms present	115-86-6	C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{22: 3, 14: 15, 29: 1}
Did not match all atoms present	115-87-7	CC(C)(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=C(C=C3)C(C)(C)C	{1: 6, 4: 2, 22: 3, 14: 13, 29: 1}
Did not match all atoms present	115-88-8	CCCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 7, 22: 3, 14: 10, 29: 1}
Did not match all atoms present	115-89-9	COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 22: 3, 14: 10, 29: 1}
Did not match all atoms present	115-90-2	CCOP(=S)(OCC)OC1=CC=C(C=C1)S(=O)C	{1: 3, 2: 2, 22: 3, 14: 4, 29: 1}
Did not match all atoms present	115-91-3	COP(=S)(OC)OC1=CC=C(C=C1)S(=O)C	{1: 3, 22: 3, 14: 4, 29: 1}
Did not match all atoms present	115-93-5	COP(=S)(OC)OC1=CC=C(C=C1)S(=O)(=O)N	{1: 2, 30: 1, 22: 3, 14: 4, 29: 2}
Did not match all atoms present	115-96-8	C(CCl)OP(=O)(OCCCl)OCCCl	{17: 3, 2: 6, 29: 1, 22: 3}
Did not match all atoms present	115-98-0	C=CP(=O)(OCCCl)OCCCl	{2: 4, 5: 1, 6: 1, 17: 2, 22: 2, 29: 1}
Did not match all atoms present	115-99-1	CC(=CCCC(C)(C=C)OC=O)C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 2, 7: 1, 26: 1}
Did not match all atoms present	1150-62-5	C1=CC=C(C=C1)N2C3=CC=CC=C3C4=CC=CC=C42	{33: 1, 14: 13}
Did not match all atoms present	115008-47-4	CN(C)C(P(=O)(O)O)P(=O)(O)O	{1: 2, 3: 1, 20: 4, 29: 2, 33: 1}
Did not match all atoms present	115029-22-6	C1=CC(=C(C(=C1)C(F)(F)F)F)C(=O)O	{16: 4, 27: 1, 4: 1, 14: 3}
Did not match all atoms present	115029-24-8	C1=CC(=C(C=C1C(F)(F)F)F)C(=O)O	{16: 4, 27: 1, 4: 1, 14: 3}
Did not match all atoms present	115044-87-6	C1COP(O1)OCC(C(F)F)(F)F	{2: 1, 3: 1, 4: 1, 11: 2, 16: 4, 22: 1, 23: 2}
Did not match all atoms present	115066-14-3	C1=C(C(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])C#N	{32: 2, 25: 2, 38: 1, 37: 1, 14: 2}
Did not match all atoms present	1151-15-1	COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O	{24: 1, 1: 1, 27: 1, 22: 1, 14: 8}
Did not match all atoms present	1151-97-9	C1=CC=NC(=C1)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{2: 1, 35: 1, 38: 2, 14: 7}
Did not match all atoms present	115120-48-4	CCCCCCCCCCCOP(=O)(OCCCCCCCCCC)OCCCCCCCCCC	{1: 3, 2: 28, 29: 1, 22: 3}
Did not match all atoms present	115120-49-5	CCCCCCCCCOP(=O)(OCCCCCCCC)OCCCCCCCC	{1: 3, 2: 22, 29: 1, 22: 3}
Did not match all atoms present	115120-50-8	CCCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCCC)OCCCCCCCCCCCCCC	{1: 3, 2: 39, 29: 1, 22: 3}
Did not match all atoms present	115120-51-9	CCCCC(CC)CN.OP(=O)(O)O	{1: 2, 2: 5, 3: 1, 20: 3, 29: 1, 30: 1}
Did not match all atoms present	115144-40-6	COC1=CC(=C(C=C1)F)F	{16: 2, 1: 1, 22: 1, 14: 3}
Did not match all atoms present	115181-05-0	C=CCCCCC1=CC=C(C=C1)C2=CC=CC=C2	{2: 4, 14: 9, 5: 1, 6: 1}
Did not match all atoms present	1152-61-0	C1=CC=C(C=C1)COC(=O)N[C@@H](CC(=O)O)C(=O)O	{2: 2, 3: 1, 14: 5, 27: 2, 28: 1, 31: 1}
Did not match all atoms present	1152-76-7	COC1=CC(=CC(=C1OC)OC)CCN.OS(=O)(=O)O	{1: 3, 2: 2, 14: 2, 20: 2, 22: 3, 29: 2, 30: 1}
Did not match all atoms present	115216-77-8	N(=O)[O-].N(=O)[O-].[Ba+2]	{34: 2, 29: 4}
Did not match all atoms present	115241-77-5	CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)N(CC)CC)C(C)(C)CC	{1: 8, 2: 5, 4: 2, 33: 1, 14: 3, 22: 1, 24: 1}
Did not match all atoms present	115245-06-2	C1=CC=C(C=C1)C2=C(C(=CC=C2)Br)Br	{18: 2, 14: 8}
Did not match all atoms present	115271-32-4	COC1=C(C=CC(=C1)[N+](=O)[O-])N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 38: 1, 14: 6, 15: 2, 21: 1, 22: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	1153-05-5	C1=CC=C(C=C1)[As](=O)(C2=CC=CC=C2)C3=CC=CC=C3	{29: 1, 14: 15}
Did not match all atoms present	115310-98-0	CC1=CC(=NC2=C1C=CC=C2O)C	{1: 2, 35: 1, 21: 1, 14: 4}
Did not match all atoms present	115314-14-2	C1[C@H](O1)COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]	{2: 1, 38: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	115314-17-5	C1[C@@H](O1)COS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]	{2: 1, 38: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	115341-09-8	COC(=O)CC(=C)C(=O)OC.C=CC=C.C=CC#N.C=CC1=CC=CC=C1	{1: 2, 2: 1, 5: 5, 6: 4, 7: 1, 14: 5, 28: 2, 37: 1}
Did not match all atoms present	115362-13-5	C1=CC(=CC=C1[C@@H]2[C@H](O2)CO)Br	{2: 1, 12: 2, 14: 4, 18: 1, 20: 1, 23: 1}
Did not match all atoms present	115383-22-7	C12=C3C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%10=C%10C8=C5C1=C%10C1=C%13C5=C8C1=C2C1=C3C2=C3C%10=C%13C%14=C3C1=C8C1=C3C5=C%12C5=C8C%11=C%11C9=C7C7=C9C6=C4C2=C2C%10=C4C(=C29)C2=C6C(=C8C8=C9C6=C4C%13=C9C(=C%141)C3=C85)C%11=C27	{}
Did not match all atoms present	115392-27-3	CCN(CCC(C)C)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC6=CC=CC=C65	{1: 3, 2: 3, 3: 1, 33: 1, 13: 1, 14: 13, 23: 1, 28: 1}
Did not match all atoms present	1154-59-2	C1=CC(=C(C=C1NC(=O)C2=CC(=CC(=C2O)Cl)Cl)Cl)Cl	{24: 1, 17: 4, 21: 1, 14: 5, 31: 1}
Did not match all atoms present	1154-92-3	CC1CCC(C(C1)OC(=O)CC2=CC=CC=C2)C(C)C	{1: 3, 2: 1, 3: 1, 11: 3, 12: 3, 14: 5, 28: 1}
Did not match all atoms present	115410-77-0	C=[Zn]	{5: 1}
Did not match all atoms present	115491-93-5	C=CCOC(=O)OC(=O)OCC=C	{2: 2, 5: 2, 6: 2}
Did not match all atoms present	1155-00-6	C1=CC=C(C(=C1)[N+](=O)[O-])SSC2=CC=CC=C2[N+](=O)[O-]	{40: 2, 38: 2, 14: 8}
Did not match all atoms present	1155-03-9	CN(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CS2.Cl	{1: 3, 2: 3, 35: 1, 33: 2, 41: 1, 14: 6, 17: 1, 22: 1}
Did not match all atoms present	1155-38-0	CC1=C2C3C(O3)C4=CC=CC=C4C2=CC5=CC=CC=C15	{1: 1, 12: 2, 14: 9, 23: 1}
Did not match all atoms present	1155-49-3	CCCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl	{1: 1, 2: 4, 33: 1, 11: 5, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	1155-62-0	C1=CC=C(C=C1)COC(=O)N[C@@H](CCC(=O)O)C(=O)O	{2: 3, 3: 1, 14: 5, 27: 2, 28: 1, 31: 1}
Did not match all atoms present	1155-64-2	C1=CC=C(C=C1)COC(=O)NCCCC[C@@H](C(=O)O)N	{2: 5, 3: 1, 14: 5, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	115560-11-7	C[C-]1C(=C(C(=C1C)C)C)C.[CH-]1[CH-][C-]2C=CC=C[C-]2[CH-]1.[Ru]	{1: 5, 14: 7}
Did not match all atoms present	115567-50-5	C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=CC=CC=C32	{24: 1, 31: 2, 14: 12, 7: 1}
Did not match all atoms present	1156-05-4	CCN(CC)CCC1(CCC(=O)NC1=O)C2=CC=CC=C2	{32: 1, 1: 2, 2: 4, 33: 1, 11: 2, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	1156-19-0	CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN2CCCCCC2	{1: 1, 33: 1, 11: 6, 14: 4, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	1156-51-0	CC(C)(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N	{1: 2, 4: 1, 22: 2, 14: 8, 37: 2}
Did not match all atoms present	115606-98-9	CC[N+](C)(CC)CCOC(=O)C=C.COS(=O)(=O)[O-]	{1: 4, 2: 4, 5: 1, 6: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	115609-71-7	CC1=CC2=C(C3=NC=C(N=C13)C)N=C(N2C)N	{1: 3, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	115626-83-0	C1=CC=C(C=C1)N([N+](=O)C2=CC=CC=C2)[O-]	{33: 2, 29: 2, 14: 10}
Did not match all atoms present	115651-77-9	CCCCN(CCCC)[C@@H](C)[C@@H](C1=CC=CC=C1)O	{1: 3, 2: 6, 3: 2, 33: 1, 14: 5, 20: 1}
Did not match all atoms present	115662-09-4	CC1(CCN2CCC(C3=C(C(=CC1=C32)C=O)O)(C)C)C	{1: 4, 33: 1, 11: 4, 13: 2, 14: 1, 21: 1, 26: 1}
Did not match all atoms present	115665-92-4	CC(=O)C=CC1=CC=C(C=C1)C(F)(F)F	{1: 1, 4: 1, 6: 2, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	1157-84-2	C1=CC=C(C=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{34: 1, 38: 2, 14: 8, 6: 1, 31: 1}
Did not match all atoms present	115722-23-1	CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)[C@H](CC(C)C)N	{32: 1, 1: 4, 2: 8, 3: 7, 33: 2, 11: 6, 12: 2, 14: 10, 24: 7, 30: 3, 31: 4}
Did not match all atoms present	115722-24-2	CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)N	{32: 1, 1: 4, 2: 11, 3: 8, 33: 2, 7: 1, 11: 6, 12: 2, 34: 1, 14: 10, 24: 8, 30: 5, 31: 5}
Did not match all atoms present	115722-25-3	CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCCN=C(N)N)N	{32: 1, 1: 5, 2: 18, 3: 13, 33: 2, 7: 3, 11: 6, 12: 2, 34: 3, 14: 10, 20: 1, 24: 13, 30: 10, 31: 9}
Did not match all atoms present	115776-74-4	[Ni+3].[OH-]	{}
Did not match all atoms present	1158-17-4	C1=CC=C(C(=C1)[N+](=O)[O-])S[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O	{2: 1, 38: 1, 40: 1, 12: 5, 14: 4, 20: 4, 23: 1}
Did not match all atoms present	115809-83-1	CCCCOC1=CC=CC(=C1)COC(=O)[C@@H]2[C@H](C2(C)C)C=C(C)C	{1: 5, 2: 4, 6: 1, 7: 1, 12: 2, 13: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	115826-95-4	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.Cl[Pd]Cl	{17: 2, 14: 32}
Did not match all atoms present	1159-53-1	CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C	{1: 3, 14: 12, 33: 1}
Did not match all atoms present	1159-54-2	C1=CC(=CC=C1P(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)Cl	{17: 3, 14: 12}
Did not match all atoms present	1159-86-0	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3	{24: 2, 14: 14}
Did not match all atoms present	115950-83-9	C[C@H](C(=O)NC(=O)[C@@H](CC1=CC=CC2=CC=CC=C21)NC(=O)C)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@H](CC5=CC=C(C=C5)O)NC(=O)[C@H](CO)NC(=O)[C@@H](CC6=CC=CC=C6)NC(=O)[C@@H](CC7=CC=C(C=C7)Cl)N	{1: 2, 2: 12, 3: 9, 36: 2, 33: 1, 7: 2, 11: 3, 12: 1, 14: 25, 17: 1, 20: 1, 21: 1, 24: 11, 30: 3, 31: 11}
Did not match all atoms present	115962-35-1	CC(C)(C)OC(=O)N1CC2=CC=CC=C2C[C@@H]1C(=O)O	{1: 3, 4: 1, 33: 1, 11: 2, 12: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	115970-17-7	C1CN(C(=N1)N)CC2=CN=C(C=C2)Cl	{33: 1, 2: 1, 35: 2, 11: 2, 14: 3, 15: 1, 17: 1, 30: 1}
Did not match all atoms present	116-01-8	CCNC(=O)CSP(=S)(OC)OC	{1: 3, 2: 2, 40: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	116-17-6	CC(C)OP(OC(C)C)OC(C)C	{1: 6, 3: 3, 22: 3}
Did not match all atoms present	116-29-0	C1=CC(=CC=C1S(=O)(=O)C2=CC(=C(C=C2Cl)Cl)Cl)Cl	{17: 4, 29: 2, 14: 6}
Did not match all atoms present	116-34-7	CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N	{1: 1, 2: 1, 38: 1, 33: 1, 14: 8, 29: 2, 30: 1}
Did not match all atoms present	116-37-0	CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)O)O	{1: 4, 2: 2, 3: 2, 4: 1, 14: 8, 20: 2, 22: 2}
Did not match all atoms present	116-38-1	CC[N+](C)(C)C1=CC(=CC=C1)O.[Cl-]	{1: 3, 2: 1, 21: 1, 14: 4, 17: 1}
Did not match all atoms present	116-43-8	C1=CC(=CC=C1NC(=O)CCC(=O)O)S(=O)(=O)NC2=NC=CS2	{2: 2, 35: 1, 41: 1, 14: 6, 24: 1, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	116-44-9	C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CN=C2	{30: 1, 35: 2, 29: 2, 14: 7, 31: 1}
Did not match all atoms present	116-45-0	CC1=C(C(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C)Br	{1: 2, 35: 2, 14: 4, 18: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	116-63-2	C1=CC=C2C(=C1)C(=CC(=C2N)O)S(=O)(=O)O	{30: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	116-64-3	C1=CC=C2C(=C1)C=C(C=C2O)S(=O)(=O)N	{30: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	116-66-5	CC1=C(C=C2C(=C1[N+](=O)[O-])C(CC2(C)C)(C)C)[N+](=O)[O-]	{38: 2, 1: 5, 11: 1, 13: 2, 14: 1}
Did not match all atoms present	116-71-2	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C9=CC=CC=C9C8=O)C2=O	{25: 2, 14: 16}
Did not match all atoms present	116-74-5	CCC1=CC(=C(C(=C1)CC)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4CC)CC)CC)C(=O)C5=CC=CC=C5C3=O)CC	{1: 6, 2: 6, 31: 2, 14: 10, 25: 2}
Did not match all atoms present	116-76-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=C5C(=C(C=C4)NC6=CC=CC7=C6C(=O)C8=CC=CC=C8C7=O)C(=O)C9=CC=CC=C9C5=O	{25: 6, 14: 20, 31: 2}
Did not match all atoms present	116-77-8	CC1=CC=C(C=C1)NC2=C3C(=C(C(=C2)C)N)C(=O)C4=CC=CC=C4C3=O	{1: 2, 31: 1, 30: 1, 14: 9, 25: 2}
Did not match all atoms present	116-78-9	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OC2=C3C(=C(C=C2)[N+](=O)[O-])C(=O)C4=C(C=CC(=C4C3=O)[N+](=O)[O-])OC5=C(C=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]	{25: 2, 38: 6, 22: 2, 14: 10}
Did not match all atoms present	116-80-3	COC1=C2C(=C(C=C1)NC(=O)C3=CC=CC=C3)C(=O)C4=C(C2=O)C(=CC=C4)Cl	{1: 1, 14: 10, 17: 1, 22: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	116-81-4	C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)N)S(=O)(=O)O)Br	{14: 5, 18: 1, 20: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	116-82-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)Br)N	{25: 2, 18: 1, 30: 1, 21: 1, 14: 5}
Did not match all atoms present	116-84-7	C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C=CC(=C3C2=O)N)O	{17: 1, 30: 1, 21: 1, 14: 5, 25: 2}
Did not match all atoms present	116-85-8	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)N	{25: 2, 30: 1, 21: 1, 14: 6}
Did not match all atoms present	116-90-5	C1=CC=C2C(=C1)C3=CC=CC4=C(C=CC(=C43)C2=O)C5=C6C=CC=C7C6=C(C=C5)C(=O)C8=CC=CC=C87	{25: 2, 14: 18}
Did not match all atoms present	116-96-1	C1=CC=C2C(=C1)C3=C4C(=C(C=C3)C5=C6C=CC=C7C6=C(C=C5)C8=CC=CC=C8C7=O)C=CC=C4C2=O	{25: 2, 14: 18}
Did not match all atoms present	1160-28-7	C1=CC2=C(C(=C1)SSC3=CC=CC4=C3N=CC=C4)N=CC=C2	{40: 2, 35: 2, 14: 12}
Did not match all atoms present	1160-36-7	CC(=O)C1=C(C=C(C=C1)OC2=C(C=C(C=C2I)C(=O)O)I)I	{1: 1, 14: 5, 19: 3, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	116008-02-7	C1=CC2=C(C=CC(=C2S(=O)(=O)O)[N+]#N)C=C1S(=O)(=O)CCOS(=O)(=O)O.OS(=O)(=O)[O-]	{2: 2, 34: 1, 14: 5, 20: 3, 22: 1, 29: 9}
Did not match all atoms present	1161-13-3	C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)OCC2=CC=CC=C2	{2: 2, 3: 1, 14: 10, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1161-22-4	CN(C)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)N(C)C	{24: 1, 1: 4, 14: 8, 6: 2, 33: 2}
Did not match all atoms present	116199-80-5	CN1C2=C3C(=C(C=C2)NC4=CC=C(C=C4)CCO)C(=O)C5=CC=CC=C5C3=C(C1=O)C#N	{1: 1, 2: 2, 37: 1, 33: 1, 14: 10, 20: 1, 25: 2, 31: 1}
Did not match all atoms present	1162-06-7	CC(=O)O[Pb](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 28: 1, 14: 15}
Did not match all atoms present	1162-65-8	COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C5C=COC5OC4=C1	{1: 1, 11: 2, 12: 2, 14: 3, 22: 1, 23: 2, 25: 1, 28: 1}
Did not match all atoms present	116248-39-6	CN1C(=CN=C1CS(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 14: 6, 29: 2}
Did not match all atoms present	116255-48-2	C1C(COC1(CN2C=NC=N2)C3=C(C=C(C=C3)Cl)Cl)Br	{33: 1, 2: 1, 35: 2, 11: 2, 12: 1, 13: 1, 14: 5, 17: 2, 18: 1, 23: 1}
Did not match all atoms present	116265-76-0	C1=CC2=C(C=C1N/N=C/3\C(=O)C4=C(C=C3S(=O)(=O)O)C=C(C=C4)NC(=O)NC5=CC6=C(C(=O)/C(=N\NC7=CC8=C(C=C(C=C8)S(=O)(=O)O)C=C7)/C(=C6)S(=O)(=O)O)C=C5)C=CC(=C2)S(=O)(=O)O.C(NCCO)CO.C(NCCO)CO.C(NCCO)CO.C(NCCO)CO	{2: 16, 34: 2, 14: 20, 15: 4, 20: 12, 24: 1, 25: 2, 29: 8, 31: 8}
Did not match all atoms present	1163-19-5	C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br	{18: 10, 22: 1}
Did not match all atoms present	1163-36-6	C1CCN(C1)CC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl.Cl	{33: 2, 2: 2, 35: 1, 11: 4, 14: 8, 17: 2}
Did not match all atoms present	116311-64-9	CCCCCCCCCCOC1=CC(=C(C=C1OC)OCCCCCCCCCC)OC	{1: 4, 2: 18, 22: 4, 14: 2}
Did not match all atoms present	116316-70-2	C1N2CN3CN1CN(C2)C3.C1=CC(=C(C=C1S(=O)(=O)O)O)C(=O)O	{33: 4, 11: 6, 14: 3, 20: 1, 21: 1, 27: 1, 29: 2}
Did not match all atoms present	116345-97-2	C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)C(=O)OCC(=O)C3=CC=CC=C3	{24: 2, 2: 2, 28: 2, 14: 14}
Did not match all atoms present	116373-23-0	C1CC1CNCC2=CC=CC=C2	{2: 2, 11: 2, 12: 1, 14: 5, 31: 1}
Did not match all atoms present	116373-55-8	C1CCC(CC1)OC(=O)NC2=CC(=CC=C2)Cl	{11: 5, 12: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	116374-06-2	C1=CC=C(C=C1)C2=CC=CC=C2OCOC3=CC=CC=C3C4=CC=CC=C4	{2: 1, 22: 2, 14: 18}
Did not match all atoms present	116376-29-5	CC1(COC(OC1)CCOCC2=CC=CC=C2)C	{1: 2, 2: 3, 11: 2, 12: 1, 13: 1, 14: 5, 22: 1, 23: 2}
Did not match all atoms present	1164-16-5	C1=CC=C(C=C1)COC(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)O	{2: 2, 3: 1, 14: 9, 21: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1164-38-1	CC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Cl-]	{1: 3, 2: 3, 4: 1, 14: 10, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	11643-50-8	CCCCCC[Si](CCCCCC)(CCCCCC)Br	{1: 3, 2: 15, 18: 1}
Did not match all atoms present	116434-94-7	C1=CC=C(C=C1)C2=NC3=C(C=CC(=C3)Cl)C(=C2)Cl	{17: 2, 35: 1, 14: 9}
Did not match all atoms present	116436-03-4	CCOC1=NC(=NC(=C1)N)N	{1: 1, 2: 1, 35: 2, 14: 1, 22: 1, 30: 2}
Did not match all atoms present	116450-56-7	C1CC2=C3C(=C4C(=C2)C(=C5C=C6CCC[N+]7=C6C(=C5O4)CCC7)C8=CC=CC=C8C(=O)[O-])CCCN3C1	{33: 2, 11: 12, 14: 6, 15: 1, 23: 1, 24: 1}
Did not match all atoms present	116465-48-6	C1=C(C(=CC(=C1F)[N+](=O)[O-])F)C(=O)O	{16: 2, 27: 1, 38: 1, 14: 2}
Did not match all atoms present	116492-57-0	C=[Cr]	{5: 1}
Did not match all atoms present	116496-93-6	C1(=NNC(=NC1=O)N)C(=O)O	{32: 1, 25: 1, 27: 1, 30: 1, 35: 2}
Did not match all atoms present	1165-39-5	COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4C5C=COC5OC4=C1	{1: 1, 11: 2, 12: 2, 14: 3, 22: 1, 23: 2, 28: 2}
Did not match all atoms present	1165-48-6	CC1=C(OC2=C(C1=O)C=CC(=C2CN(C)C)OC)C3=CC=CC=C3	{1: 4, 2: 1, 33: 1, 14: 7, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	1165-91-9	C1=C(C=C(C(=C1Cl)OC(=O)C(=O)OC2=C(C=C(C=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 28: 2, 14: 4}
Did not match all atoms present	116526-84-2	CCCCCCCCCCCCC(C(=O)Cl)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 11, 3: 1, 38: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	116529-31-8	C1CS(=O)(=O)CCC1N.Cl	{17: 1, 11: 4, 12: 1, 29: 2, 30: 1}
Did not match all atoms present	116529-35-2	C1=CC(=C(C=C1Cl)Cl)CI	{17: 2, 2: 1, 19: 1, 14: 3}
Did not match all atoms present	116573-18-3	CCOC(=O)CCOC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl	{1: 1, 2: 3, 35: 1, 14: 7, 17: 1, 22: 2, 23: 1, 28: 1}
Did not match all atoms present	116597-58-1	CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)O)O.C1=CC(=O)OC1=O.C(CO)O	{1: 4, 2: 4, 3: 2, 4: 1, 14: 10, 20: 4, 22: 2, 28: 2}
Did not match all atoms present	1166-18-3	C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC(=C3)C4=CC=CC=C4	{14: 18}
Did not match all atoms present	1166-52-5	CCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O	{1: 1, 2: 11, 28: 1, 21: 3, 14: 2}
Did not match all atoms present	116611-45-1	CC(C)(C)OC(=O)NC(COC1CCCCO1)CS(=O)(=O)C2=CC=CC=C2	{1: 3, 2: 2, 3: 1, 4: 1, 11: 4, 12: 1, 14: 5, 22: 1, 23: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	116632-39-4	CC1=C(C=CC(=C1)Br)I	{1: 1, 18: 1, 19: 1, 14: 3}
Did not match all atoms present	116660-18-5	CCCCC1=C(N=C(C(=N1)CCCC)CCCC)C	{1: 4, 2: 9, 35: 2}
Did not match all atoms present	116668-34-9	CC1=CC(=C2C=COC2=C1)C	{1: 2, 14: 4, 23: 1}
Did not match all atoms present	116668-47-4	C1=CC2=C(C=CC(=C2)N)C=C1C(=O)O	{27: 1, 30: 1, 14: 6}
Did not match all atoms present	116696-85-6	CC(C)(C)OC(=O)[C@@H](CS(=O)(=O)C1=CC=CC=C1)C(N)OC2CCCCO2	{1: 3, 2: 1, 3: 2, 4: 1, 11: 4, 12: 1, 14: 5, 22: 1, 23: 1, 28: 1, 29: 2, 30: 1}
Did not match all atoms present	116783-21-2	CC(CCC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 2, 3: 1, 14: 10}
Did not match all atoms present	1168-42-9	COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)OC	{1: 4, 25: 1, 22: 4, 14: 6, 23: 1}
Did not match all atoms present	116897-98-4	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)N/N=C\6/C=CC(=CC6=O)N)S(=O)(=O)O)S(=O)(=O)O	{34: 4, 14: 18, 15: 4, 20: 2, 24: 1, 25: 2, 29: 4, 30: 2, 31: 3}
Did not match all atoms present	1169-26-2	C1CCCN(CC1)CCC2(CCCCC2=O)C(=O)OCC3=CC=CC=C3.Cl	{33: 1, 2: 3, 11: 10, 13: 1, 14: 5, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	116912-49-3	CCN(CC)CC.CN\1C2=CC=CC=C2S/C1=C/3\C(=O)N(C(=S)S3)CC(=O)O	{1: 4, 2: 4, 33: 3, 41: 2, 14: 4, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	116929-00-1	CC(CC(=O)OC)NC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	116962-64-2	C1=CC(=CC=C1NN=C2C(=CC(=O)C=C2O)O)N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=CC=C(C=C5)NN=C6C(=CC(=O)C=C6O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 5, 14: 14, 15: 8, 20: 6, 25: 3, 29: 4, 30: 1, 31: 3}
Did not match all atoms present	116962-65-3	C1=CC(=CC=C1N/N=C/2\C(=CC(=CC2=O)C3=CC(=CC(=C3)O)O)O)N/N=C/4\C(=CC5=CC(=C(C(=C5C4=O)N)N=NC6=CC=C(C=C6)N/N=C\7/C(=CC(=CC7=O)C8=CC(=CC(=C8)O)O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 5, 14: 20, 15: 8, 20: 4, 21: 4, 25: 3, 29: 4, 30: 1, 31: 3}
Did not match all atoms present	116962-66-4	C1=CC=C2C(=C1)/C(=N/NC3=CC=C(C=C3)N/N=C/4\C=CC5=C(C4=O)C(=O)/C(=N/NC6=CC=C(C=C6)N/N=C\7/C=C(C(=O)C8=CC=CC=C87)C(=O)O)/C=C5S(=O)(=O)O)/C=C(C2=O)C(=O)O	{34: 4, 14: 21, 15: 4, 20: 1, 25: 4, 27: 2, 29: 2, 31: 4}
Did not match all atoms present	116978-88-2	COC1=CC=CC=C1N/N=C/2\C=CC3=C(C=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)N/N=C\6/C=CC(=O)C=C6O)S(=O)(=O)O	{1: 1, 34: 4, 14: 18, 15: 3, 20: 2, 22: 1, 24: 1, 25: 2, 29: 2, 30: 1, 31: 3}
Did not match all atoms present	116988-56-8	CCC1=NC2=C(N1C)N=CN=C2N	{1: 2, 2: 1, 35: 3, 33: 1, 14: 1, 30: 1}
Did not match all atoms present	117-01-1	C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)Br)N)Cl	{17: 1, 18: 1, 30: 1, 14: 5, 25: 2}
Did not match all atoms present	117-03-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=CC=CC5=C4C(=O)C6=C(C5=O)C(=CC=C6)NC7=CC=CC8=C7C(=O)C9=CC=CC=C9C8=O	{25: 6, 14: 20, 31: 2}
Did not match all atoms present	117-05-5	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)Cl	{24: 1, 17: 1, 31: 1, 14: 11, 25: 2}
Did not match all atoms present	117-06-6	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)N	{24: 1, 25: 2, 30: 1, 14: 11, 31: 1}
Did not match all atoms present	117-07-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)Cl)N	{17: 1, 30: 1, 14: 6, 25: 2}
Did not match all atoms present	117-08-8	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)OC2=O	{17: 4, 28: 2}
Did not match all atoms present	117-09-9	C1=CC2=C(C(=C1)N)C(=O)C3=C(C2=O)C=CC=C3Cl	{17: 1, 30: 1, 14: 6, 25: 2}
Did not match all atoms present	117-10-2	C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O	{25: 2, 21: 2, 14: 6}
Did not match all atoms present	117-11-3	C1=CC2=C(C(=C1)N)C(=O)C3=C(C2=O)C(=CC=C3)Cl	{17: 1, 30: 1, 14: 6, 25: 2}
Did not match all atoms present	117-12-4	C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C(=CC=C3)O	{25: 2, 21: 2, 14: 6}
Did not match all atoms present	117-14-6	C1=CC2=C(C(=C1)S(=O)(=O)O)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)O	{25: 2, 20: 2, 29: 4, 14: 6}
Did not match all atoms present	117-18-0	C1=C(C(=C(C(=C1Cl)Cl)[N+](=O)[O-])Cl)Cl	{17: 4, 38: 1, 14: 1}
Did not match all atoms present	117-22-6	C1=CC2=C(C(=C1)O)C(=CC=C2)S(=O)(=O)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	117-23-7	CC1=NN(C(=O)C1)C2=C(C=CC=C2Cl)C	{1: 2, 35: 1, 33: 1, 11: 1, 14: 3, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	117-26-0	CCC(C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl)[N+](=O)[O-]	{1: 1, 2: 1, 3: 2, 38: 1, 14: 8, 17: 2}
Did not match all atoms present	117-27-1	CC(C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl)[N+](=O)[O-]	{1: 1, 3: 2, 38: 1, 14: 8, 17: 2}
Did not match all atoms present	117-32-8	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)O)S(=O)(=O)O)C)NN=C5C=CC(=O)C=C5	{1: 2, 34: 2, 14: 14, 15: 2, 20: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	117-33-9	C1=CC(=O)C=CC1=NNC2=CC=C(C=C2)C3=CC=C(C=C3)N/N=C/4\C(=O)C=CC5=CC(=CC(=C54)S(=O)(=O)O)S(=O)(=O)O	{34: 2, 14: 16, 15: 2, 20: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	117-34-0	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)O	{27: 1, 3: 1, 14: 10}
Did not match all atoms present	117-37-3	COC1=CC=C(C=C1)C2C(=O)C3=CC=CC=C3C2=O	{1: 1, 12: 1, 22: 1, 14: 8, 25: 2}
Did not match all atoms present	117-39-5	C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	{25: 1, 21: 5, 14: 5, 23: 1}
Did not match all atoms present	117-42-0	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)S(=O)(=O)O)S(=O)(=O)O	{30: 1, 20: 3, 29: 6, 14: 4}
Did not match all atoms present	117-43-1	C1=CC2=CC(=CC(=C2C(=C1)S(=O)(=O)O)O)S(=O)(=O)O	{20: 2, 21: 1, 14: 5, 29: 4}
Did not match all atoms present	117-44-2	CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)O)OC)N	{1: 2, 34: 2, 14: 11, 20: 2, 22: 2, 29: 6, 30: 1}
Did not match all atoms present	117-46-4	C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O	{14: 9, 20: 2, 21: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	117-51-1	CCCCCCC1=CC2=C(C3=C(CCC(C3)C)C(O2)(C)C)C(=C1)O	{1: 4, 2: 5, 11: 3, 12: 1, 13: 1, 14: 2, 15: 2, 21: 1, 23: 1}
Did not match all atoms present	117-52-2	CC(=O)CC(C1=CC=CO1)C2=C(C3=CC=CC=C3OC2=O)O	{1: 1, 2: 1, 3: 1, 14: 7, 21: 1, 23: 1, 24: 1, 28: 1}
Did not match all atoms present	117-55-5	C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)N)S(=O)(=O)O	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	117-57-7	CC1=NC2=CC=CC=C2C(=C1O)C(=O)O	{1: 1, 27: 1, 21: 1, 14: 4, 35: 1}
Did not match all atoms present	117-59-9	C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	117-61-3	C1=CC(=C(C=C1N)S(=O)(=O)O)C2=C(C=C(C=C2)N)S(=O)(=O)O	{30: 2, 20: 2, 29: 4, 14: 6}
Did not match all atoms present	117-62-4	C1=CC2=C(C=CC(=C2S(=O)(=O)O)N)C(=C1)S(=O)(=O)O	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	117-70-4	C1=CC=C2C(=C1)C(=CC3=C2ON=N3)S(=O)(=O)O	{35: 2, 20: 1, 29: 2, 14: 5, 23: 1}
Did not match all atoms present	117-71-5	C1=CC=C(C(=C1)C2=C(C=CC(=C2)O)O)Cl	{17: 1, 21: 2, 14: 7}
Did not match all atoms present	117-78-2	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O	{25: 2, 27: 1, 14: 7}
Did not match all atoms present	117-79-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)N	{25: 2, 30: 1, 14: 7}
Did not match all atoms present	117-80-6	C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)Cl	{17: 2, 25: 2, 14: 4, 15: 2}
Did not match all atoms present	117-81-7	CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	117-82-8	COCCOC(=O)C1=CC=CC=C1C(=O)OCCOC	{1: 2, 2: 4, 28: 2, 22: 2, 14: 4}
Did not match all atoms present	117-83-9	CCCCOCCOC(=O)C1=CC=CC=C1C(=O)OCCOCCCC	{1: 2, 2: 10, 28: 2, 22: 2, 14: 4}
Did not match all atoms present	117-84-0	CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC	{1: 2, 2: 14, 28: 2, 14: 4}
Did not match all atoms present	117-85-1	CCOCCOCCOC(=O)C1=CC=CC=C1C(=O)OCCOCCOCC	{1: 2, 2: 10, 28: 2, 22: 4, 14: 4}
Did not match all atoms present	117-86-2	C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)O)[N+](=O)[O-])S(=O)(=O)O	{38: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	117-88-4	CC(=O)NC1=C(C=CC(=C1)N)N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 34: 2, 14: 8, 20: 2, 24: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	117-89-5	CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F	{1: 1, 2: 3, 4: 1, 33: 3, 41: 1, 11: 4, 14: 7, 16: 3}
Did not match all atoms present	117-92-0	CC[N+]1=C(C=CC2=CC=CC=C21)/C=C/C3=CC=C(C=C3)N(C)C	{1: 3, 2: 1, 14: 10, 6: 2, 33: 2}
Did not match all atoms present	117-93-1	CC(=O)NC1=C(C=CC2=CC=CC=C21)O	{24: 1, 1: 1, 21: 1, 14: 6, 31: 1}
Did not match all atoms present	117-96-4	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)NC(=O)C)I	{24: 2, 1: 2, 19: 3, 27: 1, 31: 2}
Did not match all atoms present	117-99-7	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2O	{24: 1, 21: 1, 14: 9}
Did not match all atoms present	1170-02-1	C1=CC=C(C(=C1)C(C(=O)O)NCCNC(C2=CC=CC=C2O)C(=O)O)O	{2: 2, 3: 2, 14: 8, 21: 2, 27: 2, 31: 2}
Did not match all atoms present	1171-47-7	C1=CC(=CC=C1C(=O)O)C(C2=CC=C(C=C2)C(=O)O)(C(F)(F)F)C(F)(F)F	{16: 6, 27: 2, 4: 3, 14: 8}
Did not match all atoms present	117142-26-4	CC(C)(C)OC(=O)N[C@@H](CC1=CN=CC=C1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	117158-43-7	CC1=CC(=CC(=C1OC#N)C)CC2=CC(=C(C(=C2)C)OC#N)C.CC(C)(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N	{1: 6, 2: 1, 4: 1, 37: 4, 14: 12, 22: 4}
Did not match all atoms present	117164-17-7	[2H]C(C([2H])([2H])Br)Br	{2: 2, 18: 2}
Did not match all atoms present	1172-02-7	C1=CC2=C(C=C1[N+](=O)[O-])C(=C(C#N)C#N)C3=CC(=CC(=C23)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 15: 1, 37: 2, 14: 5, 7: 1}
Did not match all atoms present	1172-18-5	CCN(CC)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F.Cl.Cl	{1: 2, 2: 4, 35: 1, 33: 2, 11: 1, 14: 7, 15: 1, 16: 1, 17: 3, 25: 1}
Did not match all atoms present	1172-76-5	C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)[Si](C)(C3=CC=CC=C3)C4=CC=CC=C4	{1: 2, 14: 20}
Did not match all atoms present	117241-25-5	CCCCCCCCCCCCOC1=C(C=C(C=C1)C=O)OCCCCCCCCCCCC	{1: 2, 2: 22, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	117292-47-4	CCCCCCCCCCCCCOCCOCCOCCOCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 19, 22: 4}
Did not match all atoms present	1173-88-2	CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O	{1: 3, 35: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 23: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	117342-25-3	CCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCC.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Mo].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo]	{1: 4, 2: 26}
Did not match all atoms present	117397-31-6	C=COCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCOC=C	{2: 8, 5: 2, 6: 2, 14: 4, 22: 2, 28: 2}
Did not match all atoms present	1174-11-4	CCOC(C(=O)C1=CC=C(C=C1)C2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)O	{1: 1, 2: 1, 3: 1, 14: 13, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	1174-72-7	C1=CC=C(C=C1)O[Si](OC2=CC=CC=C2)(OC3=CC=CC=C3)OC4=CC=CC=C4	{22: 4, 14: 20}
Did not match all atoms present	1174-83-0	COP(=S)(OC)OC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)OP(=S)(OC)OC	{1: 4, 22: 6, 14: 8, 29: 2}
Did not match all atoms present	117412-24-5	[Be-2].[O].[O]	{}
Did not match all atoms present	117464-70-7	CC(=O)OCOC1=C(C=C2C(=C1)OC3=CC(=C(C=C3C24C5=C(C=C(C=C5)C(=O)OCOC(=O)C)C(=O)O4)CCC(=O)OCOC(=O)C)OCOC(=O)C)CCC(=O)OCOC(=O)C	{1: 5, 2: 9, 13: 1, 14: 7, 22: 2, 23: 1, 28: 9}
Did not match all atoms present	117482-84-5	C1=CC(=C(C=C1C#N)Cl)F	{16: 1, 17: 1, 37: 1, 14: 3}
Did not match all atoms present	117522-01-7	[B-](CCCC)(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C[N+](C)(C)C	{1: 5, 2: 3, 14: 15}
Did not match all atoms present	117522-03-9	[B-](CCCC)(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.CCCCCCCN\1C2=CC=CC=C2C(/C1=C/C=C/C3=[N+](C4=CC=CC=C4C3(C)C)CCCCCCC)(C)C	{1: 7, 2: 15, 6: 3, 33: 2, 13: 2, 14: 23, 15: 2}
Did not match all atoms present	117549-13-0	CC(C)C1=CC=CC=[C-]1.CS(=O)(=O)[O-].[CH-]1C=CC=C1.[Fe+3]	{1: 3, 3: 1, 29: 3, 14: 9}
Did not match all atoms present	117559-89-4	COC1=C(C=C(C=C1)CCF)OC	{16: 1, 1: 2, 2: 2, 22: 2, 14: 3}
Did not match all atoms present	117568-24-8	CC(=O)OC1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O	{1: 1, 12: 1, 14: 6, 21: 2, 25: 1, 28: 1}
Did not match all atoms present	117584-82-4	CC12CCC(C1)C([CH-]2)[CH2-].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti+4]	{1: 1, 5: 1, 11: 3, 12: 2, 13: 1, 14: 11}
Did not match all atoms present	117591-20-5	CCCCC(C=O)NC(=O)C(CC(C)C)NC(=O)OCC1=CC=CC=C1	{1: 3, 2: 5, 3: 3, 14: 5, 24: 1, 26: 1, 28: 1, 31: 2}
Did not match all atoms present	1176-08-5	CN(C)CCOC1=CC=CC=C1CC2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 5, 4: 1, 33: 1, 14: 9, 20: 1, 22: 1, 27: 3}
Did not match all atoms present	1176-74-5	CCOC(=O)C1=CC=CC=C1C(=C2C=C(C(=O)C(=C2)Br)Br)C3=CC(=C(C(=C3)Br)O)Br	{1: 1, 2: 1, 7: 1, 14: 8, 15: 3, 18: 4, 21: 1, 25: 1, 28: 1}
Did not match all atoms present	1176-75-6	CCN(CC)CCOC1=CC=C(C=C1)C2=C(CCC3=CC=CC=C32)C4=CC=CC=C4	{1: 2, 2: 4, 33: 1, 11: 2, 14: 13, 15: 2, 22: 1}
Did not match all atoms present	117690-45-6	C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])C=C1S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 2, 34: 1, 14: 9, 15: 2, 22: 1, 25: 1, 29: 14, 31: 1}
Did not match all atoms present	117718-60-2	CC(C)CC1=C(C(=NC(=C1C(=O)OC)C(F)F)C(F)(F)F)C2=NCCS2	{1: 3, 2: 1, 3: 2, 4: 1, 41: 1, 11: 2, 15: 1, 16: 5, 35: 2, 28: 1}
Did not match all atoms present	117750-31-9	CN(C)C=NC1=CC=CC=C1Br	{1: 2, 34: 1, 6: 1, 33: 1, 14: 4, 18: 1}
Did not match all atoms present	117753-51-2	CCCCCCCCCCCCCO[P+](=O)OCCCCCCCCCCCCC.CCCCCCCCCCCCCO[P+](=O)OCCCCCCCCCCCCC.CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.[Zr]	{1: 8, 2: 72, 4: 4, 5: 8, 6: 8, 20: 4, 22: 12, 29: 2}
Did not match all atoms present	1178-29-6	CO[C@H]1C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]([C@H]1OC)C(=O)OC)NC5=C4C=CC(=C5)OC.Cl	{32: 1, 1: 4, 33: 1, 11: 5, 12: 6, 14: 3, 17: 1, 22: 3, 28: 1}
Did not match all atoms present	1178-79-6	CC(C)(C[Sn](CC(C)(C)C1=CC=CC=C1)(CC(C)(C)C2=CC=CC=C2)Cl)C3=CC=CC=C3	{1: 6, 2: 3, 4: 3, 14: 15, 17: 1}
Did not match all atoms present	1178-99-0	CCN(CC)CCOC1=CC=C(C=C1)C2=C(CCC3=C2C=CC(=C3)OC)C4=CC=CC=C4.Cl	{1: 3, 2: 4, 33: 1, 11: 2, 14: 12, 15: 2, 17: 1, 22: 2}
Did not match all atoms present	117806-54-9	[Li+].C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(F)F)(F)F	{16: 15, 4: 7, 29: 3}
Did not match all atoms present	117875-77-1	C(CO)N(CCO)CCO.OS(=O)(=O)O	{33: 1, 2: 6, 20: 5, 29: 2}
Did not match all atoms present	117900-35-3	CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Br)Br)C.CNC(=O)CSP(=S)(OC)OC	{1: 5, 2: 1, 3: 1, 37: 1, 6: 1, 7: 1, 40: 1, 12: 2, 13: 1, 14: 9, 18: 2, 22: 3, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	117924-33-1	CCN(CC)P(OC(C)(C)C)OC(C)(C)C	{1: 8, 2: 2, 4: 2, 22: 2, 33: 1}
Did not match all atoms present	117929-12-1	C1CC2=C3C(=CC(=C2)[N+](=O)[O-])C=CC4=CC(=CC1=C43)[N+](=O)[O-]	{11: 2, 38: 2, 14: 6}
Did not match all atoms present	117929-13-2	C1CC2=CC(=CC3=C2C4=C(CC3)C=C(C=C41)[N+](=O)[O-])[N+](=O)[O-]	{11: 4, 38: 2, 14: 4}
Did not match all atoms present	117929-14-3	C1CC2=C3C(=CC(=C2)[N+](=O)[O-])C=CC4=C3C1=CC=C4	{11: 2, 38: 1, 14: 7}
Did not match all atoms present	117929-15-4	C1=CC2=CC(=CC3=C2C4=C(C=C3)C=C(C=C41)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	117946-91-5	CC(=O)NCCC1=C(NC2=CC=CC=C21)CC3=CC=CC=C3	{32: 1, 1: 1, 2: 3, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	117998-06-8	[Li+].C1=CC(=CC=C1N)S(=O)(=O)[O-]	{30: 1, 29: 3, 14: 4}
Did not match all atoms present	118-00-3	C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)NC(=NC2=O)N	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 1, 20: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	118-02-5	C1=CC(=C(C(=C1N=O)O)N=O)O	{34: 2, 21: 2, 14: 2, 29: 2}
Did not match all atoms present	118-03-6	C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)O)N)S(=O)(=O)O)S(=O)(=O)O	{30: 1, 20: 3, 29: 6, 14: 4}
Did not match all atoms present	118-04-7	C1=CC=C(C(=C1)C(=O)C2=CC(=C(C=C2)Cl)N)C(=O)O	{24: 1, 17: 1, 27: 1, 30: 1, 14: 7}
Did not match all atoms present	118-07-0	CC1=NN(C(=O)C1)C2=C(C=C(C=C2)S(=O)(=O)O)C	{1: 2, 35: 1, 33: 1, 11: 1, 14: 3, 15: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	118-08-1	CN1CCC2=CC3=C(C=C2C1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3	{1: 3, 33: 1, 11: 3, 12: 2, 14: 4, 22: 2, 23: 2, 28: 1}
Did not match all atoms present	118-10-5	C=CC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O	{33: 1, 3: 1, 5: 1, 6: 1, 11: 4, 12: 3, 14: 6, 35: 1, 20: 1}
Did not match all atoms present	118-12-7	CC1(C(=C)N(C2=CC=CC=C21)C)C	{1: 3, 5: 1, 33: 1, 13: 1, 14: 4, 15: 1}
Did not match all atoms present	118-20-7	C1=CC2=C(C=C1[N+](=O)[O-])C3=NC4=NC(=NC5=NC(=NC6=C7C=CC(=CC7=C([N-]6)N=C2[N-]3)[N+](=O)[O-])C8=C5C=CC(=C8)[N+](=O)[O-])C9=C4C=CC(=C9)[N+](=O)[O-].[Cu+2]	{35: 8, 38: 4, 14: 12}
Did not match all atoms present	118-21-8	C1=CC(=CC=C1NC2=C3C=C(C=CC3=C(C=C2)N)S(=O)(=O)O)O	{14: 9, 20: 1, 21: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	118-23-0	CN(C)CCOC(C1=CC=CC=C1)C2=CC=C(C=C2)Br	{1: 2, 2: 2, 3: 1, 33: 1, 14: 9, 18: 1, 22: 1}
Did not match all atoms present	118-28-5	CCOC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)O)N	{1: 1, 2: 1, 14: 5, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	118-29-6	C1=CC=C2C(=C1)C(=O)N(C2=O)CO	{25: 2, 2: 1, 20: 1, 14: 4, 33: 1}
Did not match all atoms present	118-31-0	C1=CC=C2C(=C1)C=CC=C2CN	{2: 1, 30: 1, 14: 7}
Did not match all atoms present	118-32-1	C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)O	{20: 2, 21: 1, 14: 5, 29: 4}
Did not match all atoms present	118-33-2	C1=CC2=C(C=C(C=C2C=C1N)S(=O)(=O)O)S(=O)(=O)O	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	118-34-3	COC1=CC(=CC(=C1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)OC)/C=C/CO	{1: 2, 2: 2, 6: 2, 12: 5, 14: 2, 20: 5, 22: 3, 23: 1}
Did not match all atoms present	118-41-2	COC1=CC(=CC(=C1OC)OC)C(=O)O	{1: 3, 27: 1, 22: 3, 14: 2}
Did not match all atoms present	118-42-3	CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCO	{1: 2, 2: 6, 3: 1, 33: 1, 14: 5, 17: 1, 35: 1, 20: 1, 31: 1}
Did not match all atoms present	118-44-5	CCNC1=CC=CC2=CC=CC=C21	{1: 1, 2: 1, 14: 7, 31: 1}
Did not match all atoms present	118-46-7	C1=CC2=C(C=C(C=C2)O)C(=C1)N	{30: 1, 21: 1, 14: 6}
Did not match all atoms present	118-48-9	C1=CC=C2C(=C1)C(=O)OC(=O)N2	{32: 1, 28: 2, 14: 4}
Did not match all atoms present	118-50-3	C1=CC(=CC(=C1)N)C(=O)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O	{14: 9, 20: 1, 21: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	118-51-4	COC1=CC=C(C=C1)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O	{1: 1, 14: 9, 20: 1, 21: 1, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	118-55-8	C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O	{28: 1, 21: 1, 14: 9}
Did not match all atoms present	118-56-9	CC1CC(CC(C1)(C)C)OC(=O)C2=CC=CC=C2O	{1: 3, 11: 3, 12: 2, 13: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	118-58-1	C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O	{2: 1, 28: 1, 21: 1, 14: 9}
Did not match all atoms present	118-60-5	CCCCC(CC)COC(=O)C1=CC=CC=C1O	{1: 2, 2: 5, 3: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	118-61-6	CCOC(=O)C1=CC=CC=C1O	{1: 1, 2: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	118-68-3	CCC(CC1=CNC2=CC=CC=C21)N.CC(=O)O	{32: 1, 1: 2, 2: 2, 3: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	118-69-4	CC1=C(C=CC=C1Cl)Cl	{1: 1, 14: 3, 17: 2}
Did not match all atoms present	118-71-8	CC1=C(C(=O)C=CO1)O	{1: 1, 25: 1, 21: 1, 14: 2, 23: 1}
Did not match all atoms present	118-72-9	CC1=C(C(=CC=C1)C)S	{1: 2, 14: 3, 39: 1}
Did not match all atoms present	118-74-1	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)Cl	{17: 6}
Did not match all atoms present	118-76-3	C1(=C(C(=O)C(=O)C(=O)C1=O)O)O	{25: 4, 21: 2}
Did not match all atoms present	118-79-6	C1=C(C=C(C(=C1Br)O)Br)Br	{18: 3, 21: 1, 14: 2}
Did not match all atoms present	118-82-1	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C	{1: 12, 2: 1, 4: 4, 21: 2, 14: 4}
Did not match all atoms present	118-83-2	C1=CC(=C(C=C1Cl)C(F)(F)F)[N+](=O)[O-]	{16: 3, 17: 1, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	118-86-5	C1=CC(=C(C=C1N)S(=O)(=O)O)SC2=C(C=C(C=C2)N)S(=O)(=O)O	{40: 1, 30: 2, 20: 2, 29: 4, 14: 6}
Did not match all atoms present	118-88-7	CC1=C(C=C(C=C1)N)S(=O)(=O)O	{1: 1, 30: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	118-89-8	C1=C(C(=CC(=C1Cl)S(=O)(=O)O)Cl)NN	{14: 2, 17: 2, 20: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	118-90-1	CC1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 14: 4}
Did not match all atoms present	118-91-2	C1=CC=C(C(=C1)C(=O)O)Cl	{17: 1, 27: 1, 14: 4}
Did not match all atoms present	118-92-3	C1=CC=C(C(=C1)C(=O)O)N	{27: 1, 30: 1, 14: 4}
Did not match all atoms present	118-93-4	CC(=O)C1=CC=CC=C1O	{24: 1, 1: 1, 21: 1, 14: 4}
Did not match all atoms present	118-96-7	CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 2}
Did not match all atoms present	118-97-8	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(=O)O	{17: 1, 27: 1, 38: 2, 14: 2}
Did not match all atoms present	1180-60-5	COC1=C(C=C2CC3=CC(=C(C=C3CC4=CC(=C(C=C4CC2=C1)OC)OC)OC)OC)OC	{1: 6, 11: 3, 22: 6, 14: 6}
Did not match all atoms present	118060-27-8	C1COC2=C(C=C(C=C2)[N+](=O)[O-])OCCOCCOC3=CC=CC=C3OCCO1	{11: 8, 38: 1, 14: 7, 23: 6}
Did not match all atoms present	118074-08-1	CC1=C(C(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)OC)C4=C(C=C5C(=C4O)C(=O)C6=C(C5=O)C(C(C(C6O)O)(C)O)O)OC)O	{1: 4, 12: 3, 13: 1, 14: 4, 15: 2, 20: 4, 21: 3, 22: 2, 25: 4}
Did not match all atoms present	1181-54-0	C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)NCO)N(C)C)O	{1: 3, 2: 1, 33: 1, 11: 1, 12: 3, 13: 2, 14: 2, 15: 4, 17: 1, 20: 5, 21: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	118100-60-0	CC(CC(C1=CC=CC=C1)O)O	{1: 1, 2: 1, 3: 2, 20: 2, 14: 5}
Did not match all atoms present	118177-67-6	C1=CC=[N+](C=C1)CCC2=CC=C(C=C2)[N+](=O)[O-]	{33: 1, 2: 2, 38: 1, 14: 9}
Did not match all atoms present	118177-93-8	CC1=CC=C(C=C1)CCN2CC=CC=C2	{1: 1, 2: 2, 11: 1, 14: 8, 33: 1}
Did not match all atoms present	118177-96-1	COC1=CC=C(C=C1)CCN2CC=CC=C2	{1: 1, 2: 2, 33: 1, 11: 1, 14: 8, 22: 1}
Did not match all atoms present	1182-06-5	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C5=CC=CC=C5)C)C	{1: 5, 2: 3, 3: 2, 11: 7, 12: 4, 13: 2, 14: 7, 15: 2, 28: 1}
Did not match all atoms present	1182-65-6	CC1=CC=C(C=C1)S(=O)(=O)OC2CCC3(C4CCC5(C(C4CC=C3C2)CCC5C(C)CCCC(C)C)C)C	{1: 6, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 5, 15: 1, 22: 1, 29: 2}
Did not match all atoms present	118200-96-7	C[C@]1(CO1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 11: 1, 13: 1, 14: 4, 23: 1, 28: 1}
Did not match all atoms present	118208-73-4	CN(C)CC1=CC=CC=C1.C=CC1=CC=C(C=C1)O	{1: 2, 2: 1, 5: 1, 6: 1, 33: 1, 14: 9, 21: 1}
Did not match all atoms present	118337-09-0	CC1C2=CC(=CC(=C2OP(OC3=C(C=C(C=C13)C(C)(C)C)C(C)(C)C)F)C(C)(C)C)C(C)(C)C	{1: 13, 4: 4, 12: 1, 14: 4, 16: 1, 23: 2}
Did not match all atoms present	118337-12-5	CC(C)C[Si](OC)(OC)OC(C)C	{1: 6, 2: 1, 3: 2, 22: 3}
Did not match all atoms present	118337-13-6	CC(C)C[Si](OC)(OC(C)C)OC(C)C	{1: 7, 2: 1, 3: 3, 22: 3}
Did not match all atoms present	118337-14-7	CC(C)C[Si](OC(C)C)(OC(C)C)OC(C)C	{1: 8, 2: 1, 3: 4, 22: 3}
Did not match all atoms present	1184-10-7	C1=CC=C(C=C1)OP2(=NP(=NP(=N2)(OC3=CC=CC=C3)OC4=CC=CC=C4)(OC5=CC=CC=C5)OC6=CC=CC=C6)OC7=CC=CC=C7	{35: 3, 22: 6, 14: 30}
Did not match all atoms present	1184-57-2	C[Hg+].[OH-]	{1: 1}
Did not match all atoms present	1184-58-3	C[Al](C)Cl	{1: 2, 17: 1}
Did not match all atoms present	1184-63-0	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Eu+3]	{24: 3, 1: 3}
Did not match all atoms present	1184-64-1	C(=O)([O-])[O-].[Cu+2]	{24: 1}
Did not match all atoms present	1184-65-2	Cl[Ge](Cl)Cl	{17: 3}
Did not match all atoms present	1184-78-7	C[N+](C)(C)[O-]	{1: 3, 29: 1}
Did not match all atoms present	1184-85-6	CNS(=O)(=O)C	{1: 2, 29: 2, 31: 1}
Did not match all atoms present	1184-88-9	CC(C)(C)C(=O)[O-].[Na+]	{24: 1, 1: 3, 4: 1}
Did not match all atoms present	1184-91-4	CC(C)(C)[Ge](C)(C)C	{1: 6, 4: 1}
Did not match all atoms present	118436-77-4	C1=CC=C(C=C1)C2=NS[S]=N2	{41: 2, 35: 2, 14: 5, 15: 1}
Did not match all atoms present	118436-79-6	C1=CC=C(C=C1)C2=NC(=NS[N]2)C3=CC=CC=C3	{41: 1, 35: 3, 14: 10, 15: 2}
Did not match all atoms present	118468-18-1	C1=CC=C(C=C1)OC2=CC=C(C=C2)CCN	{2: 2, 30: 1, 22: 1, 14: 9}
Did not match all atoms present	118468-34-1	CCCCCCCCCCOC1=C(C=C(C=C1)C=O)OCCCCCCCCCC	{1: 2, 2: 18, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	118486-94-5	CCCC[Sn](CCCC)(CCCC)C1=CC=CO1	{1: 3, 2: 9, 14: 3, 23: 1}
Did not match all atoms present	1185-55-3	CO[Si](C)(OC)OC	{1: 4, 22: 3}
Did not match all atoms present	1185-57-5	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.N.[Fe+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	1185-59-7	CC[N+](CC)(CC)CC.CC(=O)[O-]	{24: 1, 1: 5, 2: 4}
Did not match all atoms present	1185-81-5	CCCCCCCCCCCCS[Sn](CCCC)(CCCC)SCCCCCCCCCCCC	{40: 2, 1: 4, 2: 28}
Did not match all atoms present	1186-09-0	CCOP(=O)(OCC)SCC	{40: 1, 1: 3, 2: 3, 29: 1, 22: 2}
Did not match all atoms present	1186-11-4	CCO[Si](C)(CCC#N)OCC	{1: 3, 2: 4, 37: 1, 22: 2}
Did not match all atoms present	1186-49-8	C(=O)(C(=O)[O-])O.[Na+]	{24: 1, 27: 1}
Did not match all atoms present	1186-50-1	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Nd+3].[Nd+3]	{24: 6}
Did not match all atoms present	118628-68-5	CN[C@H](C1=CC=CC=C1)[C@@H](C2=CC=CC=C2)NC	{1: 2, 3: 2, 14: 10, 31: 2}
Did not match all atoms present	1187-00-4	CS(=O)(=O)OCC(C(C(C(COS(=O)(=O)C)O)O)O)O	{1: 2, 2: 2, 3: 4, 20: 4, 22: 2, 29: 4}
Did not match all atoms present	118716-61-3	CC(=O)C(=NNC1=CC2=C(C=C1)C(=O)C(=NNC3=C(C=CC(=C3)S(=O)(=O)N)O)C(=C2)S(=O)(=O)[O-])C(=O)NC4=CC=CC=C4.C1=CC2=C(C=C1NN=C3C=CC(=O)C=C3N)C=C(C(=NNC4=C(C=CC(=C4)S(=O)(=O)N)O)C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cr]	{1: 1, 34: 4, 7: 1, 14: 22, 15: 6, 21: 2, 24: 2, 25: 3, 29: 10, 30: 3, 31: 5}
Did not match all atoms present	118716-62-4	C1=CC2=C(C=C1NN=C3C=CC(=O)C=C3N)C=C(C(=NNC4=C(C=CC(=C4)S(=O)(=O)N)O)C2=O)S(=O)(=O)[O-].C1=CC2=C(C=C1NN=C3C=CC(=O)C=C3N)C=C(C(=NNC4=C(C=CC(=C4)S(=O)(=O)N)O)C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cr]	{34: 4, 14: 20, 15: 8, 21: 2, 25: 4, 29: 10, 30: 4, 31: 4}
Did not match all atoms present	1188-13-2	C=C[Ga](C=C)C=C	{5: 3, 6: 3}
Did not match all atoms present	1188-95-0	CCCCCCCC[NH+](CCCCCCCC)CCCCCCCC.[Cl-]	{1: 3, 2: 21, 17: 1}
Did not match all atoms present	118876-58-7	C1=CC2=C3C(=CC(=C2C(=C1)S(=O)(=O)N)[N+](=O)[O-])NC(=O)C(=O)N3	{32: 2, 38: 1, 14: 4, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	1189-24-8	CC(C)CO[P+](=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	1189-32-8	C(CCl)OP(O)OCCCl	{17: 2, 2: 4, 20: 1, 22: 2}
Did not match all atoms present	1189-71-5	C(=NS(=O)(=O)Cl)=O	{8: 1, 17: 1, 34: 1, 29: 3}
Did not match all atoms present	1189-87-3	CCP(=O)(OC(C)C)F	{1: 3, 2: 1, 3: 1, 16: 1, 22: 1, 29: 1}
Did not match all atoms present	119-06-2	CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCCCC	{1: 2, 2: 24, 28: 2, 14: 4}
Did not match all atoms present	119-07-3	CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC	{1: 2, 2: 16, 28: 2, 14: 4}
Did not match all atoms present	119-10-8	CC1=CC(=C(C=C1)OC)[N+](=O)[O-]	{1: 2, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	119-12-0	CCOP(=S)(OCC)OC1=NN(C(=O)C=C1)C2=CC=CC=C2	{1: 2, 2: 2, 35: 1, 33: 1, 14: 7, 22: 3, 25: 1}
Did not match all atoms present	119-13-1	CC1=C2C(=CC(=C1)O)CC[C@@](O2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C	{1: 6, 2: 9, 3: 3, 11: 2, 13: 1, 14: 2, 21: 1, 23: 1}
Did not match all atoms present	119-15-3	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])O	{38: 2, 21: 1, 14: 7, 31: 1}
Did not match all atoms present	119-17-5	CC1=NN(C(=O)C1)C2=CC(=CC=C2)S(=O)(=O)O	{1: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	119-20-0	C1=CC(=CC=C1C(=O)O)N(CC2=CN=C3C(=N2)C(=O)N=C(N3)N)C=O	{32: 1, 33: 1, 2: 1, 35: 3, 14: 5, 25: 1, 26: 1, 27: 1, 30: 1}
Did not match all atoms present	119-21-1	COC1=CC(=C(C=C1[N+](=O)[O-])Cl)OC	{1: 2, 38: 1, 22: 2, 14: 2, 17: 1}
Did not match all atoms present	119-22-2	CCNC1=C(C=C(C=C1)S(=O)(=O)O)C(=O)O	{1: 1, 2: 1, 14: 3, 20: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	119-23-3	CCOC1=CC(=C(C=C1)OCC)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 22: 2, 14: 3}
Did not match all atoms present	119-26-6	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NN	{38: 2, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	119-27-7	COC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 22: 1, 14: 3}
Did not match all atoms present	119-28-8	C1=CC2=C(C=C(C=C2)S(=O)(=O)O)C(=C1)N	{30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	119-30-2	C1=CC(=C(C=C1I)C(=O)O)O	{27: 1, 19: 1, 21: 1, 14: 3}
Did not match all atoms present	119-32-4	CC1=C(C=C(C=C1)N)[N+](=O)[O-]	{1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	119-33-5	CC1=CC(=C(C=C1)O)[N+](=O)[O-]	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	119-34-6	C1=CC(=C(C=C1N)[N+](=O)[O-])O	{30: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	119-36-8	COC(=O)C1=CC=CC=C1O	{1: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	119-38-0	CC1=NN(C(=C1)OC(=O)N(C)C)C(C)C	{1: 5, 3: 1, 33: 2, 14: 1, 35: 1, 28: 1}
Did not match all atoms present	119-39-1	C1=CC=C2C(=C1)C=NNC2=O	{32: 1, 25: 1, 35: 1, 14: 5}
Did not match all atoms present	119-40-4	C1=CC=C(C=C1)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O	{31: 1, 20: 1, 21: 1, 14: 10, 29: 2}
Did not match all atoms present	119-41-5	CCOC(=O)COC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC=CC=C3	{1: 1, 2: 2, 14: 9, 22: 1, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	119-42-6	C1CCC(CC1)C2=CC=CC=C2O	{11: 5, 12: 1, 21: 1, 14: 4}
Did not match all atoms present	119-43-7	CCC(C1=CC=CC=C1)C(=O)OCC	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	119-44-8	C1=NC2=C(C(=O)N=C(N2)N)NC1=O	{32: 2, 25: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	119-45-9	C=CCNC(=O)C1=CC=CC=C1OCC(=O)O	{2: 2, 5: 1, 6: 1, 14: 4, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	119-47-1	CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)C)O	{1: 8, 2: 1, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	119-51-7	CC(=NO)C(=O)C1=CC=CC=C1	{1: 1, 34: 1, 7: 1, 14: 5, 20: 1, 24: 1}
Did not match all atoms present	119-52-8	COC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)OC)O	{1: 2, 3: 1, 14: 8, 20: 1, 22: 2, 24: 1}
Did not match all atoms present	119-53-9	C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)O	{24: 1, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	119-56-2	C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)O	{17: 1, 3: 1, 20: 1, 14: 9}
Did not match all atoms present	119-58-4	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)O	{1: 4, 3: 1, 20: 1, 14: 8, 33: 2}
Did not match all atoms present	119-59-5	C1=CC(=CC=C1N)S(=O)C2=CC=C(C=C2)N	{30: 2, 29: 1, 14: 8}
Did not match all atoms present	119-61-9	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 14: 10}
Did not match all atoms present	119-62-0	C1=CC(=CC=C1C(C(CO)N)O)[N+](=O)[O-]	{2: 1, 3: 2, 38: 1, 14: 4, 20: 2, 30: 1}
Did not match all atoms present	119-63-1	CC(=O)N(C)C1=CC=C(C=C1)N	{24: 1, 1: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	119-64-2	C1CCC2=CC=CC=C2C1	{11: 4, 14: 4}
Did not match all atoms present	119-65-3	C1=CC=C2C=NC=CC2=C1	{35: 1, 14: 7}
Did not match all atoms present	119-67-5	C1=CC=C(C(=C1)C=O)C(=O)O	{26: 1, 27: 1, 14: 4}
Did not match all atoms present	119-68-6	CNC1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	119-70-0	C1=CC(=CC=C1N)NC2=C(C=C(C=C2)N)S(=O)(=O)O	{30: 2, 20: 1, 29: 2, 14: 7, 31: 1}
Did not match all atoms present	119-72-2	C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O	{6: 2, 38: 1, 14: 6, 20: 2, 29: 4, 30: 1}
Did not match all atoms present	119-74-4	CC1=NN(C(=O)C1)C2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)N)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 35: 1, 6: 2, 33: 1, 11: 1, 14: 6, 15: 1, 20: 2, 25: 1, 29: 4, 30: 1}
Did not match all atoms present	119-75-5	C1=CC=C(C=C1)NC2=CC=CC=C2[N+](=O)[O-]	{38: 1, 14: 9, 31: 1}
Did not match all atoms present	119-76-6	CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C	{24: 2, 1: 2, 38: 1, 14: 3, 31: 2}
Did not match all atoms present	119-77-7	C1=CC(=CC=C1C(=O)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O)N	{14: 9, 20: 1, 21: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	119-79-9	C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C(=C1)N	{30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	119-80-2	C1=CC=C(C(=C1)C(=O)O)SSC2=CC=CC=C2C(=O)O	{40: 2, 27: 2, 14: 8}
Did not match all atoms present	119-81-3	CC(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-]	{1: 2, 38: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	119-84-6	C1CC(=O)OC2=CC=CC=C21	{11: 2, 28: 1, 14: 4}
Did not match all atoms present	119-90-4	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N	{1: 2, 30: 2, 22: 2, 14: 6}
Did not match all atoms present	119-91-5	C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4C=C3	{35: 2, 14: 12}
Did not match all atoms present	119-93-7	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N	{1: 2, 30: 2, 14: 6}
Did not match all atoms present	119-94-8	CCN(CC1=CC=CC=C1)C2=CC=CC(=C2)C	{1: 2, 2: 2, 14: 9, 33: 1}
Did not match all atoms present	119-95-9	CC1=CC(=CC=C1)N(CCC#N)CCO	{1: 1, 2: 4, 37: 1, 33: 1, 14: 4, 20: 1}
Did not match all atoms present	119-97-1	CCN(CCC#N)C1=CC(=C(C=C1)C=O)C	{1: 2, 2: 3, 37: 1, 33: 1, 14: 3, 26: 1}
Did not match all atoms present	1190-16-5	C[Si](CCCC#N)(Cl)Cl	{1: 1, 2: 3, 37: 1, 17: 2}
Did not match all atoms present	119006-57-4	CCN(CC)C1=CC2=C(C=C1)NC3=C(O2)C=C(C=C3)N(CC)CC.Cl.Cl.Cl	{32: 1, 1: 4, 2: 4, 33: 2, 14: 6, 17: 3, 23: 1}
Did not match all atoms present	119022-51-4	CN1C(=CC(=O)N1)C(F)(F)F	{32: 1, 1: 1, 4: 1, 33: 1, 14: 1, 16: 3, 25: 1}
Did not match all atoms present	119029-85-5	[H+].C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=C(C=CC(=C4)Cl)O)C2=O.C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=C(C=CC(=C4)Cl)O)C2=O.[Fe]	{34: 2, 14: 26, 15: 4, 17: 2, 21: 2, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	119033-84-0	C1=C/C(=C/NNC(=S)NC2=CC=C(C=C2)Cl)/N=C1	{35: 1, 6: 1, 7: 1, 14: 7, 15: 1, 17: 1, 31: 3}
Did not match all atoms present	119033-85-1	CN1C=CC=C1/C=N/NC(=S)NC2=CC=C(C=C2)Cl	{1: 1, 34: 1, 33: 1, 6: 1, 7: 1, 14: 7, 17: 1, 31: 2}
Did not match all atoms present	119033-87-3	CN1C=CC=C1/C=N/NC(=S)NC2=CC=C(C=C2)OC	{1: 2, 34: 1, 33: 1, 6: 1, 7: 1, 14: 7, 22: 1, 31: 2}
Did not match all atoms present	119033-91-9	COC1=CC=CC(=C1)NC(=O)NN/C=C/2\C=CC=N2	{1: 1, 35: 1, 6: 1, 14: 7, 15: 1, 22: 1, 24: 1, 31: 3}
Did not match all atoms present	119033-92-0	CN1C=CC=C1C=NNC(=O)NC2=CC(=CC=C2)OC	{1: 2, 34: 1, 6: 1, 33: 1, 14: 7, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	119033-98-6	C1=CC(=CC(=C1)Cl)NC(=O)NNC=C2C=CC=N2	{35: 1, 6: 1, 14: 7, 15: 1, 17: 1, 24: 1, 31: 3}
Did not match all atoms present	119033-99-7	CN1C=CC=C1C=NNC(=O)NC2=CC(=CC=C2)Cl	{1: 1, 34: 1, 6: 1, 33: 1, 14: 7, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	119034-00-3	COC1=CC=C(C=C1)NC(=O)NN/C=C\2/C=CC=N2	{1: 1, 35: 1, 6: 1, 14: 7, 15: 1, 22: 1, 24: 1, 31: 3}
Did not match all atoms present	119034-01-4	CN1C=CC=C1/C=N/NC(=O)NC2=CC=C(C=C2)OC	{1: 2, 34: 1, 6: 1, 33: 1, 14: 7, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	119034-03-6	CCCCOC1=CC=C(C=C1)NC(=O)NN/C=C\2/C=CC=N2	{1: 1, 2: 3, 35: 1, 6: 1, 14: 7, 15: 1, 22: 1, 24: 1, 31: 3}
Did not match all atoms present	119034-04-7	CCCCOC1=CC=C(C=C1)NC(=O)N/N=C/C2=CC=CN2C	{1: 2, 2: 3, 6: 1, 33: 1, 34: 1, 14: 7, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	119034-06-9	CCCCCCCCOC1=CC=C(C=C1)NC(=O)NN/C=C\2/C=CC=N2	{1: 1, 2: 7, 35: 1, 6: 1, 14: 7, 15: 1, 22: 1, 24: 1, 31: 3}
Did not match all atoms present	119034-07-0	CCCCCCCCOC1=CC=C(C=C1)NC(=O)N/N=C/C2=CC=CN2C	{1: 2, 2: 7, 6: 1, 33: 1, 34: 1, 14: 7, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	119034-08-1	C1=C/C(=C\NNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])/N=C1	{35: 1, 38: 1, 6: 1, 14: 7, 15: 1, 24: 1, 31: 3}
Did not match all atoms present	119034-09-2	CN1C=CC=C1/C=N/NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 6: 1, 33: 1, 14: 7, 24: 1, 31: 2}
Did not match all atoms present	119034-14-9	C1=CC=C(C=C1)NC(=O)NN/C=C\2/C=CC=N2	{35: 1, 6: 1, 14: 8, 15: 1, 24: 1, 31: 3}
Did not match all atoms present	119034-15-0	CN1C=CC=C1C=NNC(=O)NC2=CC=CC=C2	{1: 1, 34: 1, 6: 1, 33: 1, 14: 8, 24: 1, 31: 2}
Did not match all atoms present	119034-17-2	C1=C/C(=C/NNC(=O)NC2=CC=C(C=C2)Cl)/N=C1	{35: 1, 6: 1, 14: 7, 15: 1, 17: 1, 24: 1, 31: 3}
Did not match all atoms present	119034-18-3	CN1C=CC=C1/C=N/NC(=O)NC2=CC=C(C=C2)Cl	{1: 1, 34: 1, 6: 1, 33: 1, 14: 7, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	119034-20-7	C1=C/C(=C/NNC(=O)NC2=CC=C(C=C2)Br)/N=C1	{35: 1, 6: 1, 14: 7, 15: 1, 18: 1, 24: 1, 31: 3}
Did not match all atoms present	119034-21-8	CN1C=CC=C1/C=N/NC(=O)NC2=CC=C(C=C2)Br	{1: 1, 34: 1, 6: 1, 33: 1, 14: 7, 18: 1, 24: 1, 31: 2}
Did not match all atoms present	119034-23-0	C1=C/C(=C\NNC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)/N=C1	{35: 1, 6: 1, 14: 7, 15: 1, 24: 1, 29: 2, 30: 1, 31: 3}
Did not match all atoms present	119034-24-1	CN1C=CC=C1/C=N/NC(=O)NC2=CC=C(C=C2)S(=O)(=O)N	{1: 1, 34: 1, 6: 1, 33: 1, 14: 7, 24: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	119046-04-7	[OH-].[OH-].[OH-].[OH-].[Ti+4]	{}
Did not match all atoms present	1191-15-7	CC(C)C[Al]CC(C)C	{1: 4, 2: 2, 3: 2}
Did not match all atoms present	1191-79-3	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O.[Ca].[Ba]	{1: 4, 2: 64, 27: 4}
Did not match all atoms present	1191-80-6	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Hg+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	119121-11-8	CC1=CC(=CC(=C1)N=NC2=CC=C(C=C2)OCC3=CC=CC=C3)C	{1: 2, 2: 1, 34: 2, 22: 1, 14: 12}
Did not match all atoms present	119168-77-3	CCC1=NN(C(=C1Cl)C(=O)NCC2=CC=C(C=C2)C(C)(C)C)C	{1: 5, 2: 2, 35: 1, 4: 1, 33: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	1192-16-1	C1CS(=O)(=O)C=C1	{11: 2, 29: 2, 14: 2}
Did not match all atoms present	1192-21-8	CN1C(=CC=N1)N	{1: 1, 35: 1, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	1192-27-4	C1=CC(=[N+]=[N-])C=C1	{34: 1, 14: 4, 15: 1}
Did not match all atoms present	1192-40-1	C1=CC=C(C=C1)[S-].[Cu+]	{14: 5}
Did not match all atoms present	1192-58-1	CN1C=CC=C1C=O	{1: 1, 26: 1, 14: 3, 33: 1}
Did not match all atoms present	1192-62-7	CC(=O)C1=CC=CO1	{24: 1, 1: 1, 14: 3, 23: 1}
Did not match all atoms present	1192-79-6	CC1=CC=C(N1)C=O	{32: 1, 1: 1, 26: 1, 14: 2}
Did not match all atoms present	1192-89-8	C1=CC=C(C=C1)[Hg]Br	{18: 1, 14: 5}
Did not match all atoms present	119205-39-9	C1=CC=C(C=C1)C2=CC3=C(N2)C=CC(=C3)S(=O)(=O)[O-].[Na+]	{32: 1, 29: 3, 14: 9}
Did not match all atoms present	119235-89-1	C[Si](C)(C)CC(CO)O	{1: 3, 2: 2, 3: 1, 20: 2}
Did not match all atoms present	1193-02-8	C1=CC(=CC=C1N)S	{30: 1, 14: 4, 39: 1}
Did not match all atoms present	1193-10-8	CC1=CCS(=O)(=O)C1	{1: 1, 11: 2, 29: 2, 14: 1, 15: 1}
Did not match all atoms present	1193-21-1	C1=C(N=CN=C1Cl)Cl	{17: 2, 35: 2, 14: 2}
Did not match all atoms present	1193-24-4	C1=C(N=CNC1=O)O	{32: 1, 25: 1, 35: 1, 21: 1, 14: 2}
Did not match all atoms present	1193-56-2	C1=NC(=C(C(=O)N1)Cl)O	{32: 1, 35: 1, 14: 1, 17: 1, 21: 1, 25: 1}
Did not match all atoms present	1193-62-0	COC(=O)C1=CC=CN1	{32: 1, 1: 1, 28: 1, 14: 3}
Did not match all atoms present	1193-72-2	C1=CC(=C(C=C1Cl)Cl)Br	{17: 2, 18: 1, 14: 3}
Did not match all atoms present	1193-74-4	CC1=CN=C(N=C1C)N	{1: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	1193-79-9	CC1=CC=C(O1)C(=O)C	{24: 1, 1: 2, 14: 2, 23: 1}
Did not match all atoms present	1193-82-4	CS(=O)C1=CC=CC=C1	{1: 1, 29: 1, 14: 5}
Did not match all atoms present	1193-92-6	C1=CC(=CN=C1)C=NO	{34: 1, 35: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	119336-68-4	C[Si](C)(N=C=[Se])N=C=[Se]	{8: 2, 1: 2, 34: 2}
Did not match all atoms present	119345-02-7	CCCCCCCCCCCCC1=CC=C(C=C1)OC2=CC=CC=C2	{1: 1, 2: 11, 22: 1, 14: 9}
Did not match all atoms present	119389-05-8	C1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C(=O)OC3=O	{10: 2, 28: 2, 14: 8}
Did not match all atoms present	119391-55-8	C1CN(CCC1C2(CCC(=O)NC2=O)C3=CC=CC=C3)CC4=CC=CC=C4	{32: 1, 33: 1, 2: 1, 11: 6, 12: 1, 13: 1, 14: 10, 25: 2}
Did not match all atoms present	119392-95-9	C[C@H](C1=CC=CC2=CC=CC=C21)N(C)C	{1: 3, 3: 1, 14: 7, 33: 1}
Did not match all atoms present	1194-02-1	C1=CC(=CC=C1C#N)F	{16: 1, 37: 1, 14: 4}
Did not match all atoms present	1194-21-4	C1=C(NC(=NC1=O)N)Cl	{32: 1, 35: 1, 14: 1, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	1194-56-5	C=C1CCC2=CC=CC=C12	{11: 2, 5: 1, 14: 4, 15: 1}
Did not match all atoms present	1194-65-6	C1=CC(=C(C(=C1)Cl)C#N)Cl	{17: 2, 37: 1, 14: 3}
Did not match all atoms present	1194-66-7	C1=CC(=C(C(=C1)Cl)N=O)Cl	{17: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	1194-71-4	CN1C=CC(=O)N(C1=S)C	{1: 2, 33: 2, 14: 2, 25: 1}
Did not match all atoms present	1194-98-5	C1=CC(=C(C=C1O)C=O)O	{26: 1, 21: 2, 14: 3}
Did not match all atoms present	119415-97-3	C[Si](C)(C)O[Si](C)(C)C1=CC=CC1	{1: 5, 11: 1, 22: 1, 14: 3, 15: 1}
Did not match all atoms present	119434-75-2	CC(C)(C)OC(=O)N[C@@H](CC1=CSC=N1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 41: 1, 14: 2, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	119446-68-3	CC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl	{1: 1, 2: 1, 35: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 9, 17: 2, 22: 1, 23: 2}
Did not match all atoms present	119450-11-2	COC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 3, 28: 2, 14: 5}
Did not match all atoms present	119450-12-3	CCCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 5, 28: 2, 14: 5}
Did not match all atoms present	119450-13-4	CCCCCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 7, 28: 2, 14: 5}
Did not match all atoms present	119450-14-5	CCCCCCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 8, 28: 2, 14: 5}
Did not match all atoms present	119450-15-6	CCCCCCCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 9, 28: 2, 14: 5}
Did not match all atoms present	119450-16-7	CCCCCCCCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 10, 28: 2, 14: 5}
Did not match all atoms present	119450-17-8	CCCCCCCCCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 11, 28: 2, 14: 5}
Did not match all atoms present	119450-18-9	CCCCCCCCCCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 12, 28: 2, 14: 5}
Did not match all atoms present	119462-56-5	CC1=CC(=O)N(C1=O)CC2=CC(=CC=C2)CN3C(=O)C=C(C3=O)C	{1: 2, 2: 2, 33: 2, 14: 6, 15: 2, 25: 4}
Did not match all atoms present	119463-09-1	C1=CC=C(C(=C1)N=O)O	{34: 1, 21: 1, 14: 4, 29: 1}
Did not match all atoms present	119467-18-4	CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 4, 35: 2, 37: 1, 14: 6}
Did not match all atoms present	119467-19-5	CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 6, 35: 2, 37: 1, 14: 6}
Did not match all atoms present	1195-08-0	C1=C(C(=O)NC(=O)N1)C=O	{32: 2, 25: 2, 26: 1, 14: 1}
Did not match all atoms present	1195-09-1	CC1=CC(=C(C=C1)OC)O	{1: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	1195-14-8	CC1=CC2=CC=CC=C2S1	{1: 1, 14: 5, 41: 1}
Did not match all atoms present	1195-32-0	CC1=CC=C(C=C1)C(=C)C	{1: 2, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1195-34-2	CCC1=NC(=CC(=N1)Cl)Cl	{1: 1, 2: 1, 35: 2, 14: 1, 17: 2}
Did not match all atoms present	1195-45-5	C1=CC(=CC=C1N=C=O)F	{8: 1, 16: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	1195-59-1	C1=CC(=NC(=C1)CO)CO	{2: 2, 35: 1, 20: 2, 14: 3}
Did not match all atoms present	1195-67-1	CN(C)P(=O)(N1CC1)N(C)C	{1: 4, 11: 2, 29: 1, 33: 3}
Did not match all atoms present	1195-69-3	CN(C)P(=O)(N1CC1)N2CC2	{1: 2, 11: 4, 29: 1, 33: 3}
Did not match all atoms present	119505-09-8	CC(=C)C=C.C1C=CC=C1.C1C=CC2C1C3CC2C=C3.C1=CC=C(C=C1)O	{1: 1, 5: 2, 6: 1, 7: 1, 11: 3, 12: 4, 14: 13, 21: 1}
Did not match all atoms present	119535-63-6	CC(=O)C(=NNC1=CC2=C(C=C1)C(=O)C(=NNC3=C(C=CC(=C3)S(=O)(=O)N)O)C(=C2)S(=O)(=O)[O-])C(=O)NC4=CC=CC=C4.CC(=O)C(=NNC1=CC2=C(C=C1)C(=O)C(=NNC3=C(C=CC(=C3)S(=O)(=O)N)O)C(=C2)S(=O)(=O)[O-])C(=O)NC4=CC=CC=C4.[Na+].[Na+].[Na+].[Cr]	{1: 2, 34: 4, 7: 2, 14: 24, 15: 4, 21: 2, 24: 4, 25: 2, 29: 10, 30: 2, 31: 6}
Did not match all atoms present	1196-12-9	CC1=CC(=C(C(=C1)C)N=O)C	{1: 3, 34: 1, 29: 1, 14: 2}
Did not match all atoms present	1196-13-0	C1=C(C=C(C(=C1Cl)N=O)Cl)Cl	{17: 3, 34: 1, 29: 1, 14: 2}
Did not match all atoms present	1196-39-0	CC1=CN=CC2=CC=CC=C12	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	1196-43-6	C1=NC2=C([N-]1)C(=O)NC(=O)N2.[Na+]	{32: 2, 25: 2, 35: 2, 14: 1}
Did not match all atoms present	1196-57-2	C1=CC=C2C(=C1)NC(=O)C=N2	{32: 1, 25: 1, 35: 1, 14: 5}
Did not match all atoms present	1196-58-3	CCC(CC)C1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	1196-67-4	CC(=CC=O)C1=CC=CC=C1	{1: 1, 26: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	1196-72-1	C1=CC=C(C(=C1)NC(=O)N)O	{24: 1, 30: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	1196-79-8	CC1=CC2=C(C=C1)NC(=C2)C	{32: 1, 1: 2, 14: 4}
Did not match all atoms present	1196-81-2	CCc1cc2ccccc2s1	{1: 1, 2: 1, 14: 5, 41: 1}
Did not match all atoms present	119612-61-2	CC(C)(C)COC1=CC=NC(=S)N1	{32: 1, 1: 3, 2: 1, 35: 1, 4: 1, 14: 2, 22: 1}
Did not match all atoms present	1197-01-9	CC1=CC=C(C=C1)C(C)(C)O	{1: 3, 4: 1, 14: 4, 20: 1}
Did not match all atoms present	1197-03-1	C1=CC(=NC=C1Cl)C(Cl)(Cl)Cl	{17: 4, 35: 1, 4: 1, 14: 3}
Did not match all atoms present	1197-09-7	CC(=O)C1=CC(=C(C=C1)O)O	{24: 1, 1: 1, 21: 2, 14: 3}
Did not match all atoms present	1197-16-6	C1=CC(=CC=C1C(=O)O)[As]=O	{27: 1, 29: 1, 14: 4}
Did not match all atoms present	1197-19-9	CN(C)C1=CC=C(C=C1)C#N	{1: 2, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	1197-22-4	CS(=O)(=O)NC1=CC=CC=C1	{1: 1, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	1197-34-8	CCC1=CC(=CC(=C1)O)CC	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	1197-37-1	CCOC1=CC(=C(C=C1)N)N	{1: 1, 2: 1, 30: 2, 22: 1, 14: 3}
Did not match all atoms present	1197-40-6	C1=COC(=C1)CC2=CC=CO2	{2: 1, 14: 6, 23: 2}
Did not match all atoms present	1197-55-3	C1=CC(=CC=C1CC(=O)O)N	{2: 1, 27: 1, 30: 1, 14: 4}
Did not match all atoms present	119701-01-8	[Mn+4].[O-]	{}
Did not match all atoms present	119718-89-7	CC(=O)O[C@@H](C#N)C1=CC=CC=C1	{1: 1, 3: 1, 28: 1, 37: 1, 14: 5}
Did not match all atoms present	1198-14-7	C1=CC2=C(C=CC(=C2N=C1)O)Br	{18: 1, 35: 1, 21: 1, 14: 5}
Did not match all atoms present	1198-20-5	C1CC2C(C1C3=CC=CC=C23)O	{20: 1, 11: 2, 12: 3, 14: 4}
Did not match all atoms present	1198-27-2	C1=CC=C2C(=C1)C=CC(=C2N)O.Cl	{17: 1, 30: 1, 21: 1, 14: 6}
Did not match all atoms present	1198-37-4	CC1=CC(=NC2=CC=CC=C12)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	1198-47-6	CSC1=NC(=NC2=C1NC=N2)N	{32: 1, 1: 1, 35: 3, 40: 1, 14: 1, 30: 1}
Did not match all atoms present	1198-55-6	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)O)O	{17: 4, 21: 2}
Did not match all atoms present	1198-59-0	C1(=C(C(=C(C(=C1F)Cl)Cl)F)F)F	{16: 4, 17: 2}
Did not match all atoms present	1198-61-4	C1(=C(C(=C(C(=C1F)Cl)F)Cl)F)F	{16: 4, 17: 2}
Did not match all atoms present	1198-62-5	C1(=C(C(=C(C(=C1Cl)F)F)Cl)F)F	{16: 4, 17: 2}
Did not match all atoms present	1198-63-6	C1(=C(C(=C(C(=C1F)F)F)N)F)N	{16: 4, 30: 2}
Did not match all atoms present	1198-64-7	C1(=C(C(=C(C(=C1F)F)N)F)F)N	{16: 4, 30: 2}
Did not match all atoms present	1198-77-2	C12=C(NC(=O)N1)NC(=O)NC2=O.[Na]	{32: 4, 25: 3}
Did not match all atoms present	1198-83-0	CSC1=NC2=C(C(=N1)N)NC=N2	{32: 1, 1: 1, 35: 3, 40: 1, 14: 1, 30: 1}
Did not match all atoms present	1198-84-1	C1=CC(=CC=C1C(C(=O)O)O)O	{27: 1, 3: 1, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	1198-96-5	CC1(CCC2=CC=CC=C2O1)C	{1: 2, 11: 2, 13: 1, 14: 4, 23: 1}
Did not match all atoms present	1198-97-6	C1C(CNC1=O)C2=CC=CC=C2	{32: 1, 25: 1, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	1198-98-7	CC1=NC(=NO1)C2=CC=CC=C2	{1: 1, 35: 2, 14: 5, 23: 1}
Did not match all atoms present	119801-51-3	[N+](=O)([O-])[O-].[OH-].[Pb+2]	{}
Did not match all atoms present	119807-84-0	COC(=O)[C@H](CC1=CC=CC=C1)CC(=O)O	{1: 1, 2: 2, 3: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	119830-32-9	C1=CC=C(C=C1)CNC[C@@H](C(=O)O)N	{2: 2, 3: 1, 14: 5, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	1199-00-4	CC1=NOC(=N1)C2=CC=CC=C2	{1: 1, 35: 2, 14: 5, 23: 1}
Did not match all atoms present	1199-01-5	C1C(=O)OC(=N1)C2=CC=CC=C2	{35: 1, 11: 1, 28: 1, 14: 5, 15: 1}
Did not match all atoms present	1199-03-7	C1=CC=C2C(=C1)NC(=S)C(=S)N2	{32: 2, 14: 4}
Did not match all atoms present	1199-07-1	CC1=C(OC2=CC=CC=C12)C=O	{1: 1, 26: 1, 14: 4, 23: 1}
Did not match all atoms present	1199-18-4	C1=C(C(=CC(=C1O)O)O)CCN	{2: 2, 30: 1, 21: 3, 14: 2}
Did not match all atoms present	1199-20-8	CC(=CC(=O)O)C1=CC=CC=C1	{1: 1, 27: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	1199-36-6	CSC1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{40: 1, 1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	1199-46-8	CC(C)(C)C1=CC(=C(C=C1)O)N	{1: 3, 30: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	1199-59-3	CC1=C(C=CC(=C1)N(C)C)C=O	{1: 3, 26: 1, 14: 3, 33: 1}
Did not match all atoms present	1199-63-9	CN1C(=NC(=N1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 35: 2, 38: 2, 33: 1}
Did not match all atoms present	1199-65-1	CC[N+]1=CC=C(C=C1)C(=O)OC.[I-]	{1: 2, 2: 1, 33: 1, 14: 4, 19: 1, 28: 1}
Did not match all atoms present	1199-66-2	CN(C)C1=CC=C(C=C1)P(C)C	{1: 4, 14: 4, 33: 1}
Did not match all atoms present	1199-77-5	CC(=CC1=CC=CC=C1)C(=O)O	{1: 1, 27: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	1199-85-5	CC(CC1=CC=C(C=C1)Cl)NC	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 31: 1}
Did not match all atoms present	1199-95-7	C[Sn](C)(C)C#CC1=CC=CC=C1	{1: 3, 10: 2, 14: 5}
Did not match all atoms present	119931-90-7	C[NH3+].Br[Bi](Br)Br	{1: 1, 18: 3}
Did not match all atoms present	119980-36-8	CC1(C2=CC=CC=C2N(C13C=NC4=C(O3)C5=CC=CC=C5C6=CC=CC=C64)C)C	{1: 3, 35: 1, 33: 1, 13: 2, 14: 13, 23: 1}
Did not match all atoms present	120-00-3	CCOC1=CC(=C(C=C1N)OCC)NC(=O)C2=CC=CC=C2	{1: 2, 2: 2, 14: 7, 22: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	120-02-5	C1=CC(=CC=C1NC(=O)N)[As](SCC(=O)O)SCC(=O)O	{2: 2, 40: 2, 14: 4, 24: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	120-06-9	C1=CC=C(C=C1)[N+]2=NOC(=C2)[O-]	{33: 1, 35: 1, 14: 6, 23: 1}
Did not match all atoms present	120-07-0	C1=CC=C(C=C1)N(CCO)CCO	{33: 1, 2: 4, 20: 2, 14: 5}
Did not match all atoms present	120-08-1	COC1=C(C=C2C(=C1)C=CC(=O)O2)OC	{1: 2, 28: 1, 22: 2, 14: 4}
Did not match all atoms present	120-11-6	CC=CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC	{1: 2, 2: 1, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	120-12-7	C1=CC=C2C=C3C=CC=CC3=CC2=C1	{14: 10}
Did not match all atoms present	120-14-9	COC1=C(C=C(C=C1)C=O)OC	{1: 2, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	120-15-0	COC1=CC2=C(C=C1)NCCC2	{32: 1, 1: 1, 11: 3, 22: 1, 14: 3}
Did not match all atoms present	120-18-3	C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O	{20: 1, 29: 2, 14: 7}
Did not match all atoms present	120-20-7	COC1=C(C=C(C=C1)CCN)OC	{1: 2, 2: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	120-21-8	CCN(CC)C1=CC=C(C=C1)C=O	{1: 2, 2: 2, 26: 1, 14: 4, 33: 1}
Did not match all atoms present	120-22-9	CCN(CC)C1=CC=C(C=C1)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	120-23-0	C1=CC=C2C=C(C=CC2=C1)OCC(=O)O	{2: 1, 27: 1, 22: 1, 14: 7}
Did not match all atoms present	120-25-2	CCOC1=C(C=C(C=C1)C=O)OC	{1: 2, 2: 1, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	120-26-3	CC(CC1=CC(=C(C=C1)OC)OC)N	{1: 3, 2: 1, 3: 1, 14: 3, 22: 2, 30: 1}
Did not match all atoms present	120-32-1	C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)O	{17: 1, 2: 1, 21: 1, 14: 8}
Did not match all atoms present	120-33-2	CCOC(=O)C1=CC(=CC=C1)C	{1: 2, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	120-35-4	COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)N	{1: 1, 14: 8, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	120-36-5	CC(C(=O)O)OC1=C(C=C(C=C1)Cl)Cl	{1: 1, 3: 1, 14: 3, 17: 2, 22: 1, 27: 1}
Did not match all atoms present	120-37-6	CCNC1=C(C=CC(=C1)O)C	{1: 2, 2: 1, 21: 1, 14: 3, 31: 1}
Did not match all atoms present	120-44-5	COC1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)OC	{24: 1, 1: 2, 2: 1, 22: 2, 14: 8}
Did not match all atoms present	120-45-6	CCC(=O)OC(C)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	120-46-7	C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2	{24: 2, 2: 1, 14: 10}
Did not match all atoms present	120-47-8	CCOC(=O)C1=CC=C(C=C1)O	{1: 1, 2: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	120-48-9	CCCCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 3, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	120-50-3	CC(C)COC(=O)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	120-51-4	C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2	{2: 1, 28: 1, 14: 10}
Did not match all atoms present	120-53-6	CCOC1=CC2=C(C=C1)NC(=S)S2	{32: 1, 1: 1, 2: 1, 41: 1, 14: 3, 22: 1}
Did not match all atoms present	120-54-7	C1CCN(CC1)C(=S)SSSSC(=S)N2CCCCC2	{40: 4, 33: 2, 11: 10, 7: 2}
Did not match all atoms present	120-55-8	C1=CC=C(C=C1)C(=O)OCCOCCOC(=O)C2=CC=CC=C2	{2: 4, 28: 2, 22: 1, 14: 10}
Did not match all atoms present	120-57-0	C1OC2=C(O1)C=C(C=C2)C=O	{26: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	120-58-1	C/C=C/C1=CC2=C(C=C1)OCO2	{1: 1, 11: 1, 14: 3, 6: 2, 23: 2}
Did not match all atoms present	120-61-6	COC(=O)C1=CC=C(C=C1)C(=O)OC	{1: 2, 28: 2, 14: 4}
Did not match all atoms present	120-62-7	CCCCCCCCS(=O)C(C)CC1=CC2=C(C=C1)OCO2	{1: 2, 2: 8, 3: 1, 11: 1, 14: 3, 23: 2, 29: 1}
Did not match all atoms present	120-65-0	CN(C)CC1=CC=CC=C1O	{1: 2, 2: 1, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	120-66-1	CC1=CC=CC=C1NC(=O)C	{24: 1, 1: 2, 14: 4, 31: 1}
Did not match all atoms present	120-67-2	C1=CC(=C(C=C1Cl)Cl)OCCO	{17: 2, 2: 2, 20: 1, 22: 1, 14: 3}
Did not match all atoms present	120-71-8	CC1=CC(=C(C=C1)OC)N	{1: 2, 30: 1, 22: 1, 14: 3}
Did not match all atoms present	120-72-9	C1=CC=C2C(=C1)C=CN2	{32: 1, 14: 6}
Did not match all atoms present	120-73-0	C1=C2C(=NC=N1)N=CN2	{32: 1, 35: 3, 14: 3}
Did not match all atoms present	120-75-2	CC1=NC2=CC=CC=C2S1	{1: 1, 35: 1, 14: 4, 41: 1}
Did not match all atoms present	120-78-5	C1=CC=C2C(=C1)N=C(S2)SSC3=NC4=CC=CC=C4S3	{40: 2, 41: 2, 35: 2, 14: 8}
Did not match all atoms present	120-79-6	CNC(=S)C(=S)NC	{1: 2, 31: 2, 7: 2}
Did not match all atoms present	120-80-9	C1=CC=C(C(=C1)O)O	{21: 2, 14: 4}
Did not match all atoms present	120-82-1	C1=CC(=C(C=C1Cl)Cl)Cl	{17: 3, 14: 3}
Did not match all atoms present	120-83-2	C1=CC(=C(C=C1Cl)Cl)O	{17: 2, 21: 1, 14: 3}
Did not match all atoms present	120-86-5	C(CO)NC(=S)C(=S)NCCO	{2: 4, 31: 2, 20: 2, 7: 2}
Did not match all atoms present	120-95-6	CCC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)CC	{1: 6, 2: 2, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	120-97-8	C1=C(C=C(C(=C1S(=O)(=O)N)Cl)Cl)S(=O)(=O)N	{17: 2, 30: 2, 29: 4, 14: 2}
Did not match all atoms present	1200-00-6	C1=CN=CC=C1C=NNC(=S)N	{34: 1, 35: 1, 6: 1, 7: 1, 14: 4, 30: 1, 31: 1}
Did not match all atoms present	1200-03-9	C1=CC=C(C=C1)OCCCCBr	{2: 4, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	1200-06-2	CC(=O)OC1=CC=C(C=C1)OC	{1: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	1200-14-2	CCCCC1=CC=C(C=C1)C=O	{1: 1, 2: 3, 26: 1, 14: 4}
Did not match all atoms present	1200-27-7	CC(C)(CC1=CC=C(C=C1)F)N	{1: 2, 2: 1, 4: 1, 14: 4, 16: 1, 30: 1}
Did not match all atoms present	1200-67-5	CC1(C2CCC1([C@H](C2)OC=O)C)C	{1: 3, 26: 1, 11: 3, 12: 2, 13: 2}
Did not match all atoms present	1200-73-3	CC1(CCOCO1)C2=CC=CC=C2	{1: 1, 11: 3, 13: 1, 14: 5, 23: 2}
Did not match all atoms present	12001-29-5	O.O[Si]([O-])([O-])[O-].O[Si]([O-])([O-])[O-].[Mg+2].[Mg+2].[Mg+2]	{20: 2, 29: 6}
Did not match all atoms present	12001-47-7	C1=CC(=C(C=C1[As])NCS(=O)(=O)[O-])O.C1=CC(=C(C=C1[As]=[Bi])NCS(=O)(=O)[O-])O.C1=CC(=C(C=C1[As]=[Bi])NCS(=O)(=O)[O-])O.[Na+].[Na+].[Na+]	{2: 3, 31: 3, 21: 3, 14: 9, 29: 9}
Did not match all atoms present	12001-85-3	C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].[Zn+2]	{24: 2, 14: 14}
Did not match all atoms present	12001-89-7	CC(C)C1=CC=CC=C1.CC(C)C1=CC=CC=C1.[Cr]	{1: 4, 3: 2, 14: 10}
Did not match all atoms present	12002-19-6	C1=C[Hg]C=C1	{14: 4}
Did not match all atoms present	12002-28-7	[H-].[H-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe+2]	{29: 4}
Did not match all atoms present	12002-61-8	[O-2].[O-2].[O-2].[Ac].[Ac]	{}
Did not match all atoms present	12002-62-9	[Ag].[Cd]	{}
Did not match all atoms present	12002-74-3	[Ag].[Ho]	{}
Did not match all atoms present	12002-99-2	[Ag].[Ag].[Te]	{}
Did not match all atoms present	120029-06-3	CCN(CC)CCCNC1=NC(=NC(=N1)NC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])NCCCN(CC)CC.[Na+].[Na+]	{1: 4, 2: 10, 35: 3, 33: 2, 34: 3, 14: 12, 15: 2, 25: 1, 29: 6, 31: 4}
Did not match all atoms present	12003-00-8	[S-2].[Ag+].[Ag+].[Ag+].[I-]	{19: 1}
Did not match all atoms present	12003-14-4	[AlH3].[Co]	{}
Did not match all atoms present	12003-63-3	[O-][Al]=O.[K+]	{29: 2}
Did not match all atoms present	12003-67-7	[Li+].[O-][Al]=O	{29: 2}
Did not match all atoms present	12003-78-0	[Al].[Ni]	{}
Did not match all atoms present	12003-81-5	[AlH3].[Ni].[Ni].[Ni]	{}
Did not match all atoms present	12003-96-2	[Al+3].[Ti].[Ti].[Ti]	{}
Did not match all atoms present	12004-03-4	[AlH3].[AlH3].[Au]	{}
Did not match all atoms present	12004-04-5	[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Ba+2].[Ba+2]	{}
Did not match all atoms present	12004-26-1	[Al].[Al].[Gd]	{}
Did not match all atoms present	12004-32-9	[Al].[Al].[La]	{}
Did not match all atoms present	12004-35-2	[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Ni+2]	{}
Did not match all atoms present	12004-36-3	O([AlH2])[AlH2]	{22: 1}
Did not match all atoms present	12004-37-4	[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Sr+2].[Sr+2]	{}
Did not match all atoms present	12004-39-6	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Ti+4].[Ti+4]	{}
Did not match all atoms present	12004-45-4	[AlH2]S[AlH2]	{40: 1}
Did not match all atoms present	12004-48-7	[AlH3].[AlH3].[U]	{}
Did not match all atoms present	12004-76-1	[Al].[Al].[Al].[Ta]	{}
Did not match all atoms present	12004-78-3	[Al].[Al].[Al].[Ti]	{}
Did not match all atoms present	12004-79-4	[AlH3].[AlH3].[AlH3].[U]	{}
Did not match all atoms present	12004-90-9	[AlH3].[AlH3].[AlH3].[AlH3].[Ce]	{}
Did not match all atoms present	120042-13-9	CC(CN=[N+]=[N-])(C(=O)O)N	{1: 1, 2: 1, 4: 1, 34: 2, 27: 1, 30: 1}
Did not match all atoms present	12005-05-9	[AlH3].[AlH3].[AlH3].[AlH3].[U]	{}
Did not match all atoms present	12005-48-0	[O-2].[O-2].[Na+].[Al+3]	{}
Did not match all atoms present	12005-67-3	[O-2].[O-2].[Am]	{}
Did not match all atoms present	12005-75-3	[Cu].[Cu].[Cu].[As]	{}
Did not match all atoms present	12005-88-8	[Fe].[Fe]=[As]	{}
Did not match all atoms present	12005-89-9	[As]#[Gd]	{}
Did not match all atoms present	12005-95-7	[Mn]#[As]	{}
Did not match all atoms present	12006-09-6	[As]#[Tl]	{}
Did not match all atoms present	12006-15-4	[As]=[Cd].[As]=[Cd].[Cd]	{}
Did not match all atoms present	12006-40-5	[Zn].[Zn]=[As].[Zn]=[As]	{}
Did not match all atoms present	12006-51-8	[Cu].[Au]	{}
Did not match all atoms present	12006-52-9	[Cu].[Cu].[Cu].[Au]	{}
Did not match all atoms present	12006-57-4	[Au].[Pb].[Pb]	{}
Did not match all atoms present	12006-60-9	[Sn].[Au]	{}
Did not match all atoms present	12006-78-9	[B].[Co].[Co].[Co]	{}
Did not match all atoms present	12006-79-0	B#[Cr]	{}
Did not match all atoms present	12006-80-3	C.C.Br	{18: 1}
Did not match all atoms present	12006-84-7	B#[Fe]	{}
Did not match all atoms present	12006-85-8	[B].[Fe].[Fe]	{}
Did not match all atoms present	12006-98-3	B#[Mo]	{}
Did not match all atoms present	12006-99-4	B#[Mo]#[Mo]	{}
Did not match all atoms present	12007-00-0	B#[Ni]	{}
Did not match all atoms present	12007-02-2	[B].[Ni].[Ni].[Ni]	{}
Did not match all atoms present	12007-07-7	B#[Ta]	{}
Did not match all atoms present	12007-08-8	B#[Ti]	{}
Did not match all atoms present	12007-09-9	B#[W]	{}
Did not match all atoms present	12007-10-2	[B]=[W].[W]	{}
Did not match all atoms present	12007-16-8	[B].[B].[Cr]	{}
Did not match all atoms present	12007-23-7	[B]=[B].[Hf]	{}
Did not match all atoms present	12007-27-1	B#[Mo]#B	{}
Did not match all atoms present	12007-38-4	[B].[B].[B].[Cr].[Cr].[Cr].[Cr].[Cr]	{}
Did not match all atoms present	12007-56-6	B([O-])([O-])[O-].B([O-])([O-])[O-].[Ca+2].[Ca+2].[Ca+2]	{29: 6}
Did not match all atoms present	12007-57-7	B([O-])([O-])[O-].[NH4+].[NH4+].[NH4+]	{29: 3}
Did not match all atoms present	12007-58-8	B(O)(O)O.B(O)(O)O.B(O)(O)O.B(O)([O-])[O-].[NH4+].[NH4+]	{20: 10, 29: 2}
Did not match all atoms present	12007-66-8	[B].[O-2].[Sr+2]	{}
Did not match all atoms present	12007-97-5	[B].[B].[B].[B].[B].[Mo].[Mo]	{}
Did not match all atoms present	12007-98-6	[B]=[B].B#[W].B#[W]=[B]	{}
Did not match all atoms present	12007-99-7	B12B3[B-]14B5[B-]23B45.[Ca+2]	{}
Did not match all atoms present	12008-06-9	B12B3[B-]14B5[B-]23B45.[Gd+2]	{}
Did not match all atoms present	12008-21-8	B12B3[B-]14B5[B-]23B45.[La]	{}
Did not match all atoms present	12008-29-6	B12B3B4B1[Si]45B2B53	{}
Did not match all atoms present	12008-32-1	[B].[B].[B].[B].[B].[B].[Y]	{}
Did not match all atoms present	12008-33-2	B12B3[B-]14B5[B-]23B45.[Yb+2]	{}
Did not match all atoms present	12008-40-1	[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-]	{29: 24}
Did not match all atoms present	12008-41-2	B(O)(O)O.B(O)(O)O.B(O)(O)O.B(O)(O)O.B(O)(O)O.B(O)(O)O.B(O)(O)O.B(O)([O-])[O-].[Na+].[Na+]	{20: 22, 29: 2}
Did not match all atoms present	12008-75-2	[B-][B][B][B][B][B][B][B][B][B][B][B-].[Cs+].[Cs+]	{}
Did not match all atoms present	12009-18-6	[O-2].[O-2].[O-2].[Sn+4].[Ba+2]	{}
Did not match all atoms present	12009-31-3	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ba+2]	{}
Did not match all atoms present	12009-36-8	[Te]=[Ba]	{}
Did not match all atoms present	120093-92-7	CC1=CC=CC(=C1)C(=C)[Si](C)(C)C	{1: 4, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1201-02-1	CNC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 1, 31: 1}
Did not match all atoms present	1201-10-1	CC1=CC2=C(C=C1)C3CCC2C3O	{1: 1, 11: 2, 12: 3, 14: 3, 20: 1}
Did not match all atoms present	1201-26-9	CC(=O)CC1=CNC2=CC=CC=C21	{24: 1, 1: 1, 2: 1, 14: 5, 32: 1}
Did not match all atoms present	1201-30-5	C1=C(C(=C(C(=N1)C(Cl)(Cl)Cl)Cl)Cl)Cl	{17: 6, 35: 1, 4: 1, 14: 1}
Did not match all atoms present	1201-31-6	C1=C(C(=C(C(=C1F)F)F)F)C(=O)O	{16: 4, 27: 1, 14: 1}
Did not match all atoms present	1201-38-3	CC(=O)C1=C(C=CC(=C1)OC)OC	{24: 1, 1: 3, 22: 2, 14: 3}
Did not match all atoms present	1201-58-7	CSC1=NC(=NC2=C1NC=N2)SC	{32: 1, 1: 2, 35: 3, 14: 1, 40: 2}
Did not match all atoms present	12010-12-7	[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Nb]	{}
Did not match all atoms present	12010-41-2	[Dy].[Bi]	{}
Did not match all atoms present	12010-43-4	[GaH3].[Bi]	{}
Did not match all atoms present	12010-44-5	[Gd].[Bi]	{}
Did not match all atoms present	12010-45-6	[Ho].[Bi]	{}
Did not match all atoms present	12010-49-0	[Lu].[Bi]	{}
Did not match all atoms present	12010-50-3	[Mn].[Bi]	{}
Did not match all atoms present	12010-51-4	[Na].[Na].[Na].[Bi]	{}
Did not match all atoms present	12010-56-9	[Tb].[Bi]	{}
Did not match all atoms present	12010-59-2	[Tm].[Bi]	{}
Did not match all atoms present	12010-60-5	[Bi].[U]	{}
Did not match all atoms present	12010-61-6	[Yb].[Bi]	{}
Did not match all atoms present	12010-67-2	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Sn+4].[Sn+4].[Sn+4].[Bi+3].[Bi+3]	{}
Did not match all atoms present	12010-74-1	[Bi].[Bi].[U]	{}
Did not match all atoms present	120102-96-7	CCCCC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)C	{1: 2, 2: 3, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120102-97-8	CCCCC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)CC	{1: 2, 2: 4, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120102-98-9	CCCCC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)CCCC	{1: 2, 2: 6, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120102-99-0	CCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 7, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-00-6	CCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 8, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-01-7	CCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 9, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-03-9	CCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 11, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-04-0	CCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 12, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-05-1	CCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 13, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-06-2	CCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 14, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-08-4	CCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 16, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-09-5	CCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 17, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-10-8	CCCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 18, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	120103-11-9	CCCCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 19, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	12011-54-0	B#[C]	{}
Did not match all atoms present	12011-77-7	C(=O)([O-])O[Al].O.O.[Na+]	{}
Did not match all atoms present	12011-97-1	C.[Mo]	{}
Did not match all atoms present	12012-16-7	[C]#[Th]	{}
Did not match all atoms present	12012-32-7	[C-]#[C].[Ce]	{}
Did not match all atoms present	12012-35-0	[C-]#[Cr].[C-]#[Cr].[Cr+2]	{}
Did not match all atoms present	12012-50-9	C=C.[Cl-].[Cl-].[Cl-].[K+].[Pt+2]	{17: 3, 5: 2}
Did not match all atoms present	12012-95-2	[CH2-]C=C.[CH2-]C=C.Cl[Pd+].Cl[Pd+]	{17: 2, 5: 4, 6: 2}
Did not match all atoms present	120120-26-5	CC[Si](CC)(CC)C(F)(F)F	{16: 3, 1: 3, 2: 3, 4: 1}
Did not match all atoms present	120122-98-7	CCCCC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)CCC	{1: 2, 2: 5, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	12013-10-4	[S-2].[S-2].[S-2].[Co+3].[Co+3]	{}
Did not match all atoms present	12013-21-7	[O-2].[O-2].[O-2].[O-2].[Mg+2].[Mo]	{}
Did not match all atoms present	12013-31-9	[O-2].[O-2].[O-2].[O-2].[Ca+2].[Cr+3].[Cr+3]	{}
Did not match all atoms present	12013-33-1	O.O.O.O.[Ca].[Fe].[Fe]	{}
Did not match all atoms present	12013-46-6	[O-][Sn](=O)[O-].[Ca+2]	{29: 3}
Did not match all atoms present	12013-47-7	[O-][Zr](=O)[O-].[Ca+2]	{29: 3}
Did not match all atoms present	12013-55-7	[Si]=[Ca]	{}
Did not match all atoms present	12013-57-9	[Ca]=[Te]	{}
Did not match all atoms present	12013-62-6	[O-2].[O-2].[O-2].[O-2].[O-2].[Ca+2].[Ca+2].[Fe+3].[Fe+3]	{}
Did not match all atoms present	12013-82-0	[N-]=[Ca].[N-]=[Ca].[Ca+2]	{}
Did not match all atoms present	120136-28-9	COC1=C(C=C(C=C1)C#C)F	{1: 1, 9: 1, 10: 1, 14: 3, 16: 1, 22: 1}
Did not match all atoms present	120136-29-0	COC1=C(C=C(C=C1)C#C)Cl	{1: 1, 9: 1, 10: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	120136-30-3	CSC1=C(C=C(C=C1)C#C)Cl	{1: 1, 40: 1, 9: 1, 10: 1, 14: 3, 17: 1}
Did not match all atoms present	12014-09-4	[Mg].[Mg].[Mg].[Cd]	{}
Did not match all atoms present	12014-14-1	[O-2].[O-2].[O-2].[Ti+4].[Cd+2]	{}
Did not match all atoms present	12014-29-8	[Cd].[Cd].[Cd].[Sb].[Sb]	{}
Did not match all atoms present	12014-85-6	[Si]=[Ce]=[Si]	{}
Did not match all atoms present	12014-93-6	[S-2].[S-2].[S-2].[Ce+3].[Ce+3]	{}
Did not match all atoms present	12014-94-7	[Se].[Se].[Se].[Ce].[Ce]	{}
Did not match all atoms present	12014-97-0	[Te].[Te].[Te].[Ce].[Ce]	{}
Did not match all atoms present	12016-80-7	O[Co]=O	{20: 1, 29: 1}
Did not match all atoms present	120162-55-2	CN1C(=C(C=N1)C2=NN(N=N2)C)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC	{1: 4, 35: 6, 33: 2, 14: 2, 22: 2, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	12017-12-8	[Co+2].[Si-]#[Si-]	{}
Did not match all atoms present	12017-13-9	[Co]=[Te]	{}
Did not match all atoms present	12017-33-3	[Co].[Co].[Nb]	{}
Did not match all atoms present	12017-38-8	[O-2].[O-2].[O-2].[Ti+4].[Co+2]	{}
Did not match all atoms present	12017-54-8	[Co].[Co].[Co].[Nb]	{}
Did not match all atoms present	12017-73-1	[Co].[Co].[Co].[Co].[Co].[Co].[Co].[W].[W].[W].[W].[W].[W]	{}
Did not match all atoms present	12017-94-6	[O-2].[O-2].[O-2].[Cr+3].[La+3]	{}
Did not match all atoms present	12018-00-7	O=[Cr]	{29: 1}
Did not match all atoms present	12018-01-8	[Cr].[O].[O]	{}
Did not match all atoms present	12018-06-3	[S-2].[Cr+2]	{}
Did not match all atoms present	12018-07-4	[Cr].[Sb].[Sb]	{}
Did not match all atoms present	12018-08-5	[Si]#[Cr]	{}
Did not match all atoms present	12018-09-6	[Cr].[Si].[Si]	{}
Did not match all atoms present	12018-18-7	[O-][Cr](=O)(=O)[O-].[Ni+2]	{29: 4}
Did not match all atoms present	12018-19-8	[O-2].[O-2].[O-2].[O-2].[Cr+3].[Cr+3].[Zn+2]	{}
Did not match all atoms present	12018-27-8	[Ti].[Cr].[Cr]	{}
Did not match all atoms present	12018-36-9	[Si].[Cr].[Cr].[Cr]	{}
Did not match all atoms present	12018-40-5	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Cr+3].[Cr+3].[Cr+3].[Cr+3].[Cr+3]	{}
Did not match all atoms present	12018-68-7	[Sb].[Cs+].[Cs+].[Cs+]	{}
Did not match all atoms present	12018-79-0	[O-][Fe]=O.[O-][Fe]=O.[Cu+2]	{29: 4}
Did not match all atoms present	12018-93-8	[Cu].[Ho]	{}
Did not match all atoms present	12019-23-7	[Cu]=[Te]	{}
Did not match all atoms present	12019-52-2	[Cu].[Cu].[Te]	{}
Did not match all atoms present	12019-57-7	[P-3].[P-3].[Cu+2].[Cu+2].[Cu+2]	{}
Did not match all atoms present	12019-88-4	N#[Dy]	{}
Did not match all atoms present	12019-91-9	P#[Dy]	{}
Did not match all atoms present	1202-08-0	CC1=C(C=C(C=C1)C(C)C)C(=O)C	{24: 1, 1: 4, 3: 1, 14: 3}
Did not match all atoms present	1202-25-1	CN(C)C1=CC=C(C=C1)C(=O)OC	{1: 3, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	1202-34-2	C1=CC=NC(=C1)NC2=CC=CC=N2	{35: 2, 14: 8, 31: 1}
Did not match all atoms present	1202-36-4	C1=CC=C(C=C1)[Te]C2=CC=CC=C2	{14: 10}
Did not match all atoms present	1202-42-2	CN(C)C=NC1=CC(=CC=C1)OC	{1: 3, 34: 1, 6: 1, 33: 1, 14: 4, 22: 1}
Did not match all atoms present	1202-62-6	CN(C)C=NC1=CC=C(C=C1)OC	{1: 3, 34: 1, 6: 1, 33: 1, 14: 4, 22: 1}
Did not match all atoms present	1202-66-0	CC(=O)NCCC1=CC=C(C=C1)O	{1: 1, 2: 2, 14: 4, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	12020-21-2	N#[Er]	{}
Did not match all atoms present	12020-39-2	[Te].[Te].[Te].[Er].[Er]	{}
Did not match all atoms present	12020-58-5	N#[Eu]	{}
Did not match all atoms present	12020-65-4	S=[Eu]	{}
Did not match all atoms present	12020-66-5	COC1=C2C(=O)C[C@H](OC2=CC(=C1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C4=CC=C(C=C4)O	{1: 1, 2: 1, 11: 1, 12: 6, 14: 6, 20: 4, 21: 1, 22: 2, 23: 2, 25: 1}
Did not match all atoms present	12020-69-8	[Te]=[Eu]	{}
Did not match all atoms present	120206-81-7	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=NC5=CC=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+].[K+]	{33: 1, 34: 7, 14: 22, 6: 2, 29: 13}
Did not match all atoms present	120206-82-8	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N=NC5=CC=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+].[K+]	{34: 8, 14: 22, 6: 2, 29: 12}
Did not match all atoms present	120206-83-9	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=[N+](C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=NC5=CC=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+].[K+].[K+]	{33: 2, 34: 6, 14: 22, 6: 2, 29: 14}
Did not match all atoms present	120206-84-0	CCCCC(CC)COCCCN.CCCCC(CC)COCCCN.C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O	{1: 4, 2: 16, 3: 2, 38: 1, 34: 3, 14: 11, 15: 2, 20: 2, 22: 2, 25: 1, 29: 4, 30: 3, 31: 1}
Did not match all atoms present	12022-02-5	[NH4+].[NH4+].F[Ta-2](F)(F)(F)(F)(F)F	{16: 7}
Did not match all atoms present	12022-76-3	[O-2].[O-2].[O-2].[O-2].[V].[Fe+3]	{}
Did not match all atoms present	12022-93-4	[Fe].[Sb].[Sb]	{}
Did not match all atoms present	12022-99-0	[Si]=[Fe]=[Si]	{}
Did not match all atoms present	12023-04-0	[Ti].[Fe]	{}
Did not match all atoms present	12023-22-2	[Fe].[Fe].[Nb]	{}
Did not match all atoms present	12023-25-5	[O-2].[O-2].[O-2].[O-2].[O-2].[Fe+3].[Fe+3].[Sr+2].[Sr+2]	{}
Did not match all atoms present	12023-27-7	[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Fe+3].[Fe+3]	{}
Did not match all atoms present	12023-37-9	[Fe].[Fe].[Ta]	{}
Did not match all atoms present	12023-40-4	[Ti].[Fe].[Fe]	{}
Did not match all atoms present	12023-42-6	[Fe].[Fe].[U]	{}
Did not match all atoms present	12023-50-6	[Fe].[Fe].[Fe].[Mo].[Mo]	{}
Did not match all atoms present	12023-99-3	[OH-].[OH-].[OH-].[Ga+3]	{}
Did not match all atoms present	12024-11-2	[Ga]=[Se]	{}
Did not match all atoms present	12024-14-5	[GaH2].[TeH]	{}
Did not match all atoms present	12024-15-6	[V].[V].[V].[Ga]	{}
Did not match all atoms present	12024-20-3	O([GaH2])[GaH2]	{22: 1}
Did not match all atoms present	12024-21-4	O=[Ga]O[Ga]=O	{29: 2, 22: 1}
Did not match all atoms present	12024-24-7	[Ga+3].[Ga+3].[Se-2].[Se-2].[Se-2]	{}
Did not match all atoms present	12024-36-1	[O-2].[O-2].[O-2].[Ga+3].[Gd+3]	{}
Did not match all atoms present	12024-90-7	[Se-2].[Se-2].[Se-2].[Gd+3].[Gd+3]	{}
Did not match all atoms present	12025-13-7	[O-2].[O-2].[O-2].[O-2].[Mg+2].[Mg+2].[Ge]	{}
Did not match all atoms present	12025-34-2	S=[Ge]=S	{}
Did not match all atoms present	12026-06-1	[OH-].[Tl+]	{}
Did not match all atoms present	12026-66-3	[NH4+].[NH4+].[NH4+].[NH4+].[O-]P(=O)[O-].[O-][Mo](=O)(=O)[O-]	{29: 7}
Did not match all atoms present	12027-06-4	[NH4+].[I-]	{19: 1}
Did not match all atoms present	12027-61-1	[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[K+].[K+].[Sn+4]	{}
Did not match all atoms present	12027-67-7	[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-]	{29: 12}
Did not match all atoms present	12027-88-2	[O-2].[O-2].[O-2].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Y+3].[Y+3].[Y+3].[Y+3]	{29: 9}
Did not match all atoms present	12027-96-2	O.O.O.O.O.O.[Zn+2].[Sn]	{}
Did not match all atoms present	12028-48-7	[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].O.[OH-].[OH-].[OH-].O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)[O-].O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)[O-].O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)O[W](=O)(=O)[O-].[W]	{20: 3, 29: 25, 22: 8}
Did not match all atoms present	12029-86-6	[Sb].[Ho+3]	{}
Did not match all atoms present	120296-99-3	CCC1CO1.CC(C[O-])O.[K+]	{1: 2, 2: 2, 3: 1, 11: 1, 12: 1, 20: 1, 23: 1, 29: 1}
Did not match all atoms present	1203-24-3	C1=CC=C(C(=C1)N2C(=O)C=CC2=O)Cl	{17: 1, 33: 1, 14: 6, 25: 2}
Did not match all atoms present	1203-39-0	C1=CC=C2C(=C1)C(=C(C(=O)C2=O)Br)O	{25: 2, 18: 1, 20: 1, 14: 4, 15: 2}
Did not match all atoms present	1203-40-3	C1=CC=C(C(=C1)C(=O)OO)C(=O)OO	{28: 2, 20: 2, 14: 4}
Did not match all atoms present	1203-86-7	C1=C(C(=CC(=C1Cl)Cl)Cl)C(=O)C(Cl)Cl	{24: 1, 17: 5, 3: 1, 14: 2}
Did not match all atoms present	1203-89-0	CC(C)(C)NC(=O)C1=CC=CC=C1N	{1: 3, 4: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	1203-99-2	CC(CC1=CNC2=C1C=C(C=C2)Cl)[NH3+].[Cl-]	{32: 1, 1: 1, 2: 1, 3: 1, 14: 4, 17: 2}
Did not match all atoms present	12030-14-7	[S-2].[S-2].[S-2].[In+3].[In+3]	{}
Did not match all atoms present	12030-22-7	O([InH2])[InH2]	{22: 1}
Did not match all atoms present	12030-49-8	O=[Ir]=O	{29: 2}
Did not match all atoms present	12030-60-3	[Ir].[Th]	{}
Did not match all atoms present	12030-83-0	[Li].[K]	{}
Did not match all atoms present	12030-85-2	[O-][Nb](=O)=O.[K+]	{29: 3}
Did not match all atoms present	12030-91-0	[O-][Ta](=O)=O.[K+]	{29: 3}
Did not match all atoms present	12031-30-0	[SH-].[La]	{}
Did not match all atoms present	12031-49-1	[S-2].[S-2].[S-2].[La+3].[La+3]	{}
Did not match all atoms present	12031-65-1	[Li+].[O-][Ni]=O	{29: 2}
Did not match all atoms present	12031-70-8	[Li].[Rb]	{}
Did not match all atoms present	12031-80-0	[Li+].[Li+].[O-][O-]	{29: 2}
Did not match all atoms present	12031-83-3	[Li+].[Li+].[O-][Zr](=O)[O-]	{29: 3}
Did not match all atoms present	12032-29-0	[O-][Sn](=O)[O-].[Mg+2]	{29: 3}
Did not match all atoms present	12032-30-3	[O-2].[O-2].[O-2].[Mg+2].[Ti+4]	{}
Did not match all atoms present	12032-31-4	[O-][Zr](=O)[O-].[Mg+2]	{29: 3}
Did not match all atoms present	12032-36-9	[Mg].[S]	{}
Did not match all atoms present	12032-44-9	[Mg]=[Te]	{}
Did not match all atoms present	12032-52-9	[OH-].[OH-].[OH-].[OH-].[Mg+2].[Mg+2].[Ti]	{}
Did not match all atoms present	12032-53-0	[Mg].[Mg].[Pb]	{}
Did not match all atoms present	12032-74-5	[O-2].[O-2].[O-2].[Ti+4].[Mn+2]	{}
Did not match all atoms present	12032-78-9	CC[C@H](C)C1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC([C@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)C)N)(C)C)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCN)C(=O)NCC(=O)N)CC(=O)N)[C@@H](C)O	{32: 5, 1: 6, 2: 7, 3: 3, 33: 1, 41: 2, 11: 4, 12: 7, 13: 1, 14: 4, 20: 1, 24: 5, 25: 5, 30: 4, 31: 2}
Did not match all atoms present	12032-82-5	[Mn+3].[Sb]	{}
Did not match all atoms present	12032-86-9	[Si]=[Mn]=[Si]	{}
Did not match all atoms present	12032-87-0	[Mn].[Sn].[Sn]	{}
Did not match all atoms present	12032-88-1	[Mn]=[Te]	{}
Did not match all atoms present	12032-89-2	[Mn](=[Te])=[Te]	{}
Did not match all atoms present	12032-97-2	[Mn].[Mn].[Sb]	{}
Did not match all atoms present	12033-19-1	N#[Mo]	{}
Did not match all atoms present	12033-29-3	S=[Mo](=S)=S	{}
Did not match all atoms present	12033-40-8	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Mo+4]	{29: 6}
Did not match all atoms present	12033-47-5	N1[SiH2]O[SiH2]1	{32: 1, 23: 1}
Did not match all atoms present	12033-56-6	[N]=S	{}
Did not match all atoms present	12033-60-2	N#[Si]	{}
Did not match all atoms present	12033-62-4	N#[Ta]	{}
Did not match all atoms present	12033-64-6	N#[Tb]	{}
Did not match all atoms present	12033-68-0	N#[Tm]	{}
Did not match all atoms present	12033-76-0	N(=[Si])O	{34: 1, 20: 1}
Did not match all atoms present	12033-89-5	N12[Si]34N5[Si]16N3[Si]25N46	{33: 4}
Did not match all atoms present	12034-09-2	[O-][Nb](=O)=O.[Na+]	{29: 3}
Did not match all atoms present	12034-12-7	O=O.[Na+]	{29: 2}
Did not match all atoms present	12034-34-3	[O-2].[O-2].[O-2].[Na+].[Na+].[Ti+4]	{}
Did not match all atoms present	12034-39-8	[Na+].[Na+].[S-]SS[S-]	{40: 2}
Did not match all atoms present	12034-41-2	[Na][Te][Na]	{}
Did not match all atoms present	12034-55-8	[Ni].[Nb]	{}
Did not match all atoms present	12034-57-0	O=[Nb]	{29: 1}
Did not match all atoms present	12034-59-2	O=[Nb]=O	{29: 2}
Did not match all atoms present	12034-77-4	[Se]=[Nb]=[Se]	{}
Did not match all atoms present	12034-80-9	[Si]=[Nb]=[Si]	{}
Did not match all atoms present	12034-83-2	[Nb](=[Te])=[Te]	{}
Did not match all atoms present	12034-88-7	O=[Nb](=O)O[Pb]O[Nb](=O)=O	{29: 4, 22: 2}
Did not match all atoms present	120341-04-0	C1=CC=C2C(=C1)N=C(N2N)S(=O)(=O)O	{33: 1, 35: 1, 14: 4, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	12035-31-3	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Ti+4].[Nd+3].[Nd+3]	{}
Did not match all atoms present	12035-33-5	[Se-2].[Se-2].[Se-2].[Nd+3].[Nd+3]	{}
Did not match all atoms present	12035-36-8	O=[Ni]O[Ni]=O	{29: 2, 22: 1}
Did not match all atoms present	12035-57-3	[Si]#[Ni]	{}
Did not match all atoms present	12035-71-1	S=[Ni].S=[Ni].[Ni]	{}
Did not match all atoms present	12035-74-4	[Ti].[Ni].[Ni].[Ni]	{}
Did not match all atoms present	12035-75-5	[Ni].[Ni].[Ni].[Ni].[W]	{}
Did not match all atoms present	12035-79-9	[O-2].[O-2].[Np]	{}
Did not match all atoms present	12035-82-4	O=[Pt]	{29: 1}
Did not match all atoms present	12035-90-4	[O-2].[Ta+5]	{}
Did not match all atoms present	12035-94-8	[O-2].[O-2].[O-2].[O-2].[Ti+4].[Ti+4]	{}
Did not match all atoms present	12035-95-9	[O-2].[O-2].[Ti+4]	{}
Did not match all atoms present	12035-98-2	O=[V]	{29: 1}
Did not match all atoms present	12036-01-0	O=[Zr]	{29: 1}
Did not match all atoms present	12036-04-3	O=[Pd]=O	{29: 2}
Did not match all atoms present	12036-05-4	O=[Pr]=O	{29: 2}
Did not match all atoms present	12036-09-8	O=[Re]=O	{29: 2}
Did not match all atoms present	12036-10-1	O=[Ru]=O	{29: 2}
Did not match all atoms present	12036-14-5	O=[Ta]=O	{29: 2}
Did not match all atoms present	12036-21-4	O=[V]=O	{29: 2}
Did not match all atoms present	12036-22-5	O=[W]=O	{29: 2}
Did not match all atoms present	12036-37-2	[O-][Sn](=O)[O-].[Zn+2]	{29: 3}
Did not match all atoms present	12036-39-4	[O-][Zr](=O)[O-].[Sr+2]	{29: 3}
Did not match all atoms present	12036-41-8	O=[Tb]O[Tb]=O	{29: 2, 22: 1}
Did not match all atoms present	12036-44-1	[O-2].[O-2].[O-2].[Tm+3].[Tm+3]	{}
Did not match all atoms present	12036-46-3	[O-]P(=O)([O-])[O-].[Sb+3]	{29: 4}
Did not match all atoms present	12036-69-0	[O-2].[O-2].[O-2].[O-2].[Ti+4].[Zn+2].[Zn+2]	{}
Did not match all atoms present	12036-84-9	[O-2].[O-2].[O-2].[W]	{}
Did not match all atoms present	12037-01-3	O=[Tb]O[Tb](=O)O[Tb](=O)O[Tb]=O	{29: 4, 22: 3}
Did not match all atoms present	12037-06-8	O=P12OP3OP(O1)OP(=O)(O3)O2	{29: 2, 23: 6}
Did not match all atoms present	12037-11-5	O=P12OP3OP(=O)(O1)OP(=O)(O3)O2	{29: 3, 23: 6}
Did not match all atoms present	12037-64-8	P#[Tb]	{}
Did not match all atoms present	12037-65-9	P#[Ti]	{}
Did not match all atoms present	12037-68-2	P#[Tm]	{}
Did not match all atoms present	12037-70-6	P#[W]	{}
Did not match all atoms present	12037-71-7	P#[Yb]	{}
Did not match all atoms present	12037-72-8	P#[Zr]	{}
Did not match all atoms present	12037-79-5	CN(C)S(=O)(=O)C1=CC2=C(C=C1)NC(=O)CN=C2C3=CC=CC=C3	{32: 1, 1: 2, 35: 1, 33: 1, 11: 1, 14: 8, 15: 1, 25: 1, 29: 2}
Did not match all atoms present	12037-82-0	P12SP3SP(S1)SP(=S)(S2)S3	{41: 6}
Did not match all atoms present	120375-41-9	C1=CC=C(C=C1)CCCCCCCC[NH3+].[N+](=O)([O-])[O-]	{2: 8, 14: 5}
Did not match all atoms present	120375-43-1	C1=CC=C(C=C1)CCCCCC[NH3+].[N+](=O)([O-])[O-]	{2: 6, 14: 5}
Did not match all atoms present	120375-45-3	C1=CC=C(C=C1)CCCC[NH3+].[N+](=O)([O-])[O-]	{2: 4, 14: 5}
Did not match all atoms present	120375-47-5	C1=CC=C(C=C1)CC[NH3+].[N+](=O)([O-])[O-]	{2: 2, 14: 5}
Did not match all atoms present	120375-57-7	C1=CC=C(C=C1)CCCCCCN.Cl	{17: 1, 2: 6, 30: 1, 14: 5}
Did not match all atoms present	12038-03-8	[Pd].[Pd].[Pd].[U]	{}
Did not match all atoms present	12038-13-0	[S-2].[S-2].[S-2].[Pr+3].[Pr+3]	{}
Did not match all atoms present	12038-20-9	S=[Pt]	{}
Did not match all atoms present	12038-21-0	S=[Pt]=S	{}
Did not match all atoms present	12038-30-1	[Pt].[Th]	{}
Did not match all atoms present	12038-31-2	[Ti].[Pt]	{}
Did not match all atoms present	12038-62-9	[Rb+].[Rb+].[Rb+].[Sb]	{}
Did not match all atoms present	12038-63-0	S=[Re]=S	{}
Did not match all atoms present	12038-64-1	[Se]=[Re]=[Se]	{}
Did not match all atoms present	12038-66-3	[Si]=[Re]=[Si]	{}
Did not match all atoms present	12038-82-3	[Rh].[Th]	{}
Did not match all atoms present	12039-07-5	[S-2].[S-2].[Ti+4]	{}
Did not match all atoms present	12039-13-3	S=[Ti]=S	{}
Did not match all atoms present	12039-14-4	S=[U]=S	{}
Did not match all atoms present	12039-17-7	[S-2].[Tl+].[Tl+]	{}
Did not match all atoms present	12039-20-2	[S-2].[S-2].[S-2].[Yb+3].[Yb+3]	{}
Did not match all atoms present	12039-31-5	[Sb].[Tb+3]	{}
Did not match all atoms present	12039-33-7	[Sb].[Tm+3]	{}
Did not match all atoms present	12039-34-8	[Sb].[Yb+3]	{}
Did not match all atoms present	12039-35-9	[Zn].[Sb]	{}
Did not match all atoms present	12039-39-3	[Sb].[Sb].[U]	{}
Did not match all atoms present	12039-46-2	[Sc].[Se-2]	{}
Did not match all atoms present	12039-53-1	[Se]=[Tm]	{}
Did not match all atoms present	12039-54-2	[Se]=[Yb]	{}
Did not match all atoms present	12039-55-3	[Se]=[Ta]=[Se]	{}
Did not match all atoms present	12039-70-2	[Si]#[Ti]	{}
Did not match all atoms present	12039-76-8	[Si].[V].[V].[V]	{}
Did not match all atoms present	12039-79-1	[Si]=[Ta]=[Si]	{}
Did not match all atoms present	12039-83-7	[Si]=[Ti]=[Si]	{}
Did not match all atoms present	12039-85-9	[Si]=[U]=[Si]	{}
Did not match all atoms present	12039-87-1	[Si]=[V]=[Si]	{}
Did not match all atoms present	12039-88-2	[Si]#[W]#[Si]	{}
Did not match all atoms present	12039-90-6	[Si]=[Zr]=[Si]	{}
Did not match all atoms present	12039-95-1	[Si].[Si].[Si].[W].[W].[W].[W].[W]	{}
Did not match all atoms present	1204-06-4	C1=CC=C2C(=C1)C(=CN2)C=CC(=O)O	{32: 1, 27: 1, 14: 5, 6: 2}
Did not match all atoms present	1204-21-3	COC1=CC(=C(C=C1)OC)C(=O)CBr	{1: 2, 2: 1, 14: 3, 18: 1, 22: 2, 24: 1}
Did not match all atoms present	1204-28-0	C1=CC2=C(C=C1C(=O)Cl)C(=O)OC2=O	{24: 1, 17: 1, 28: 2, 14: 3}
Did not match all atoms present	1204-29-1	CCC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 2, 14: 3}
Did not match all atoms present	1204-38-2	CC1=CC(=O)OC2=C1C(=O)OC(=C2)C	{1: 2, 28: 2, 14: 2}
Did not match all atoms present	1204-59-7	C1=CC=C(C=C1)C2=CC(=C(C=C2)O)[NH3+].[Cl-]	{17: 1, 21: 1, 14: 8}
Did not match all atoms present	1204-75-7	C1=CC=C2C(=C1)NC(=O)C(=N2)C(=O)O	{32: 1, 25: 1, 27: 1, 14: 4, 35: 1}
Did not match all atoms present	1204-78-0	CC1=CC=C(C=C1)C2=CC=C(C=C2)N	{1: 1, 30: 1, 14: 8}
Did not match all atoms present	1204-79-1	C1=CC(=CC=C1C2=CC=C(C=C2)O)N	{30: 1, 21: 1, 14: 8}
Did not match all atoms present	12040-08-3	[Sr]=[Te]	{}
Did not match all atoms present	12040-13-0	[Te].[Tl].[Tl]	{}
Did not match all atoms present	12041-50-8	B#[Al]	{}
Did not match all atoms present	12041-54-2	[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[Al]	{}
Did not match all atoms present	12041-76-8	C1=CC=C(C=C1)C(O)(Cl)Cl	{17: 2, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	12042-00-1	C(C(CS(=O)(=O)O)O)S.[Na+].[Au+]	{2: 2, 3: 1, 20: 2, 29: 2, 39: 1}
Did not match all atoms present	12042-17-0	[Al].[Fe]	{}
Did not match all atoms present	12042-37-4	[Li-].[Al+3]	{}
Did not match all atoms present	12042-68-1	[O-][Al]=O.[O-][Al]=O.[Ca+2]	{29: 4}
Did not match all atoms present	12042-90-9	[AlH3].[AlH3].[Ce]	{}
Did not match all atoms present	12043-13-9	[Al].[Al].[Nd]	{}
Did not match all atoms present	12043-29-7	[Al]=[Te].[Al]=[Te].[Te]	{}
Did not match all atoms present	12043-39-9	[AlH3].[AlH3].[AlH3].[Ni].[Ni]	{}
Did not match all atoms present	12043-43-5	[Al].[Al].[Al].[Th]	{}
Did not match all atoms present	12043-56-0	[AlH3].[AlH3].[AlH3].[AlH3].[AlH3].[Co].[Co]	{}
Did not match all atoms present	12043-82-2	[AlH3].[AlH3].[AlH3].[AlH3].[AlH3].[AlH3].[AlH3].[AlH3].[AlH3].[Co].[Co]	{}
Did not match all atoms present	12044-16-5	[Fe]#[As]	{}
Did not match all atoms present	12044-21-2	[K][As]([K])[K]	{}
Did not match all atoms present	12044-22-3	[Li][As]([Li])[Li]	{}
Did not match all atoms present	12044-25-6	[Na][As]([Na])[Na]	{}
Did not match all atoms present	12044-49-4	[Mg]=[As][Mg][As]=[Mg]	{}
Did not match all atoms present	12044-54-1	[As](=[Te])[Te][As]=[Te]	{}
Did not match all atoms present	12044-73-4	[Cd].[Au]	{}
Did not match all atoms present	12044-88-1	[Sb].[Sb].[Au]	{}
Did not match all atoms present	12044-91-6	[Sn].[Sn].[Sn].[Sn].[Au]	{}
Did not match all atoms present	120447-97-4	CC1(C(=[N+](C2=CC=CC=C12)C)/C=C/NC3=CC=CC=C3OCCOC4=CC=CC=C4N/C=C/C5=[N+](C6=CC=CC=C6C5(C)C)C)C.C(#N)[S-].C(#N)[S-]	{1: 6, 2: 2, 37: 2, 6: 4, 33: 2, 13: 2, 14: 16, 15: 2, 22: 2, 31: 2}
Did not match all atoms present	12045-15-7	B#[Mn]	{}
Did not match all atoms present	12045-19-1	B#[Nb]	{}
Did not match all atoms present	12045-25-9	B(=S)S	{39: 1}
Did not match all atoms present	12045-27-1	B#[V]	{}
Did not match all atoms present	12045-60-2	BOB	{22: 1}
Did not match all atoms present	12045-63-5	[B].[B].[Ti]	{}
Did not match all atoms present	12045-78-2	B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].O.O.O.O.[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+]	{29: 12}
Did not match all atoms present	12045-87-3	B(O)([O-])[O-].O.O.O.O.[Na+].[Na+]	{20: 1, 29: 2}
Did not match all atoms present	12045-88-4	B(O)([O-])[O-].B(O)([O-])[O-].B(O)([O-])[O-].B(O)([O-])[O-].O.O.O.O.O.[Na+].[Na+]	{20: 4, 29: 8}
Did not match all atoms present	12046-54-7	[B].[B].[B].[B].[B].[B].[Sr]	{}
Did not match all atoms present	12046-91-2	[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[Zr]	{}
Did not match all atoms present	12047-02-8	[Ba].[Bi].[Bi].[Bi]	{}
Did not match all atoms present	12047-79-9	[N-]=[Ba].[N-]=[Ba].[Ba+2]	{}
Did not match all atoms present	120471-84-3	[Na+].[Na+].[Na+].[I-].[I-].[I-]	{19: 3}
Did not match all atoms present	120478-49-1	CC1CO1.C1CO1.C1=CC=C2C=C(C=CC2=C1)OCCCS(=O)(=O)[O-].[K+]	{1: 1, 2: 3, 11: 3, 12: 1, 14: 7, 22: 1, 23: 2, 29: 3}
Did not match all atoms present	12048-16-7	[Be].[Ni]	{}
Did not match all atoms present	12048-26-9	[K].[K].[K].[Bi]	{}
Did not match all atoms present	12048-27-0	[Li].[Bi]	{}
Did not match all atoms present	12048-31-6	[Pr].[Bi]	{}
Did not match all atoms present	12048-34-9	[S-2].[S-2].[S-2].[Bi+3].[Bi+3]	{}
Did not match all atoms present	12048-36-1	[Tl].[Bi]	{}
Did not match all atoms present	12048-50-9	[O-2].[O-2].[O-2].[Bi+3].[Bi+3]	{}
Did not match all atoms present	12049-50-2	[O-][Ti](=O)[O-].[Ca+2]	{29: 3}
Did not match all atoms present	12049-63-7	[Ca].[Ca].[GeH4]	{}
Did not match all atoms present	12049-69-3	[O-][O-].[Ca+2]	{29: 2}
Did not match all atoms present	12049-73-9	[Si](=[Ca])=[Ca]	{}
Did not match all atoms present	12049-74-0	[Ca].[Ca].[Sn]	{}
Did not match all atoms present	1205-02-3	CC(C(=O)O)NC(=O)C1=CC=CC=C1	{1: 1, 3: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	1205-06-7	CCOC(=O)C1=CC=C(C=C1)N=C=S	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 28: 1}
Did not match all atoms present	1205-08-9	COC(=O)CNC(=O)C1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	1205-17-0	CC(CC1=CC2=C(C=C1)OCO2)C=O	{1: 1, 2: 1, 3: 1, 11: 1, 14: 3, 23: 2, 26: 1}
Did not match all atoms present	1205-59-0	CN(C)C=NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 34: 1, 6: 1, 38: 1, 33: 1, 14: 4}
Did not match all atoms present	1205-64-7	CC1=CC(=CC=C1)NC2=CC=CC=C2	{1: 1, 14: 9, 31: 1}
Did not match all atoms present	1205-71-6	C1=CC=C(C=C1)NC2=CC=C(C=C2)Cl	{17: 1, 14: 9, 31: 1}
Did not match all atoms present	1205-91-0	CC(=O)OC1=CC=C(C=C1)OC(=O)C	{1: 2, 28: 2, 14: 4}
Did not match all atoms present	12050-20-3	[Mg].[Cd]	{}
Did not match all atoms present	12050-35-0	[O-][Ta](=O)=O.[O-][Ta](=O)=O.[Cd+2]	{29: 6}
Did not match all atoms present	12050-41-8	[Mg].[Cd].[Cd].[Cd]	{}
Did not match all atoms present	12052-28-7	[O-2].[O-2].[O-2].[O-2].[O-2].[Fe+3].[Fe+3].[Co+2].[Co+2]	{}
Did not match all atoms present	12052-42-5	[Co+3].[Sb]	{}
Did not match all atoms present	12052-43-6	[Co].[Sb].[Sb]	{}
Did not match all atoms present	12052-93-6	[Cr].[GeH4]	{}
Did not match all atoms present	12053-12-2	[Cr]#[Sb]	{}
Did not match all atoms present	12053-13-3	[Cr]=[Se]	{}
Did not match all atoms present	12053-18-8	O=[Cr]O[Cr]=O.O=[Cu].O=[Cu]	{29: 4, 22: 1}
Did not match all atoms present	12053-26-8	[O-][Cr](=O)(=O)[O-].[Mg+2].[Cr+2]	{29: 4}
Did not match all atoms present	12053-39-3	[Cr]=[Te].[Cr]=[Te].[Te]	{}
Did not match all atoms present	12053-95-1	[Mg].[Mg].[Cu]	{}
Did not match all atoms present	12054-17-0	[Mg].[Cu].[Cu]	{}
Did not match all atoms present	12054-21-6	[Cu].[Cu].[Sb]	{}
Did not match all atoms present	12054-72-7	O.O.O.O.[Sn]	{}
Did not match all atoms present	12054-85-2	[NH4+].[NH4+].O.O.O.O.[O-][Mo](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	120547-50-4	CC(C)(C)C1=CC=CC=C1.CC(C1=CC=CC=C1)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O.C(=O)(Cl)Cl	{1: 4, 4: 2, 14: 18, 17: 2, 21: 2, 24: 1}
Did not match all atoms present	12055-23-1	[Hf].[O].[O]	{}
Did not match all atoms present	12055-24-2	[As]#[Tb]	{}
Did not match all atoms present	12056-53-0	[O-2].[O-2].[O-2].[K+].[K+].[Ti+4]	{}
Did not match all atoms present	12057-24-8	[Li+].[Li+].[OH-]	{}
Did not match all atoms present	12057-58-8	[Mg].[Ni].[Ni]	{}
Did not match all atoms present	12057-74-8	[Mg+2].[Mg+2].[Mg+2].[P-3].[P-3]	{}
Did not match all atoms present	12057-75-9	[Mg].[Mg].[Mg].[Sb].[Sb]	{}
Did not match all atoms present	12057-92-0	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Mn].[Mn]	{}
Did not match all atoms present	120575-55-5	CN1C=C[N+](=C1N=NC2=CC(=C(C=C2)NCCN(C)C3=CC=C(C=C3)N=NC4=[N+](C=NN4C)C)Cl)C.C(=[N-])=S.C(=[N-])=S.C(=[N-])=S.C(=[N-])=S.[Zn+2]	{1: 5, 2: 2, 35: 1, 33: 5, 8: 4, 34: 4, 14: 10, 17: 1, 31: 1}
Did not match all atoms present	12058-06-9	[Ni].[Ni].[Ni].[Ni].[Mo]	{}
Did not match all atoms present	12058-07-0	[O-2].[Mo+2]	{}
Did not match all atoms present	12058-18-3	[Se]=[Mo]=[Se]	{}
Did not match all atoms present	12058-20-7	[Mo](=[Te])=[Te]	{}
Did not match all atoms present	12058-38-7	N#[W]	{}
Did not match all atoms present	12058-74-1	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[V].[V].[V].[V]	{}
Did not match all atoms present	12058-85-4	[Na+].[Na+].[Na+].[P-3]	{}
Did not match all atoms present	12059-14-2	[Si](=[Ni])=[Ni]	{}
Did not match all atoms present	12059-23-3	[Ni].[Ni].[Ni].[Sn]	{}
Did not match all atoms present	12059-24-4	[Ni].[Ni].[Ni].[Sn].[Sn]	{}
Did not match all atoms present	12059-89-1	O([PbH3])[PbH3]	{22: 1}
Did not match all atoms present	12059-95-9	[O-2].[O-2].[Pu]	{}
Did not match all atoms present	1206-13-9	CC1=CC=C(C=C1)C2(CCCCC2)C#N	{1: 1, 11: 5, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	1206-15-1	COC1=CC=C(C=C1)C2(CCCC2)C#N	{1: 1, 37: 1, 11: 4, 13: 1, 14: 4, 22: 1}
Did not match all atoms present	1206-46-8	C[Si](C)(C)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 3}
Did not match all atoms present	1206-49-1	CC1=C(C(=CC=C1)C)N2C(=O)C=CC2=O	{1: 2, 33: 1, 14: 5, 25: 2}
Did not match all atoms present	1206-79-7	C1CC2=C3CCCC3=C4CCCC4=C2C1	{11: 9}
Did not match all atoms present	12060-00-3	[O-][Ti](=O)[O-].[Pb+2]	{29: 3}
Did not match all atoms present	12060-01-4	[O-][Zr](=O)[O-].[Pb+2]	{29: 3}
Did not match all atoms present	12060-05-8	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Re].[Re]	{}
Did not match all atoms present	12060-58-1	[O-2].[O-2].[O-2].[Sm+3].[Sm+3]	{}
Did not match all atoms present	12060-59-2	[O-][Ti](=O)[O-].[Sr+2]	{29: 3}
Did not match all atoms present	12061-16-4	O=[Er]O[Er]=O	{29: 2, 22: 1}
Did not match all atoms present	120611-30-5	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OC.C(F)(F)(F)S(=O)(=O)[O-]	{1: 5, 2: 4, 4: 1, 33: 2, 14: 10, 16: 3, 23: 1, 28: 1, 29: 3}
Did not match all atoms present	12062-13-4	[NH4+].[F-].F[Nb](F)(F)(F)F	{16: 6}
Did not match all atoms present	12062-26-9	[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[Si+4].[Si+4].[Si+4].[Fe+3].[Fe+3]	{16: 18}
Did not match all atoms present	12062-85-0	[O-][Fe]=O.[O-][Fe]=O.[Na+].[Na+]	{29: 4}
Did not match all atoms present	12063-10-4	[O-2].[O-2].[O-2].[O-2].[Mn+2].[Fe+3].[Fe+3]	{}
Did not match all atoms present	12063-19-3	O[Fe]=O.O[Fe]=O.[Zn]	{20: 2, 29: 2}
Did not match all atoms present	12063-27-3	[S-2].[S-2].[S-2].[Fe+3].[Fe+3]	{}
Did not match all atoms present	12063-39-7	[S-2].[S-2].[S-2].[S-2].[Fe+2].[Fe+3].[Fe+3]	{}
Did not match all atoms present	12063-56-8	O=[Fe]O[Fe]=O.O=[Fe]O[Fe]=O.O=[Fe]O[Y]=O.O=[Y]O[Y]=O	{29: 8, 22: 4}
Did not match all atoms present	12063-98-8	P#[Ga]	{}
Did not match all atoms present	12064-03-8	[Ga]#[Sb]	{}
Did not match all atoms present	12064-62-9	[O-2].[O-2].[O-2].[Gd+3].[Gd+3]	{}
Did not match all atoms present	12065-11-1	[Ge](=[Se])=[Se]	{}
Did not match all atoms present	12065-36-0	N#[Ge]N([Ge]#N)[Ge]#N	{33: 1}
Did not match all atoms present	12065-68-8	O=[Ta](=O)O[Pb]O[Ta](=O)=O	{29: 4, 22: 2}
Did not match all atoms present	12065-80-4	O=P12OP3OP(O1)OP(O3)O2	{29: 1, 23: 6}
Did not match all atoms present	12066-49-8	P#[Pr]	{}
Did not match all atoms present	12066-50-1	P#[Sm]	{}
Did not match all atoms present	12066-53-4	P#[V]	{}
Did not match all atoms present	12066-62-5	P12(=S)SP3(=S)SP(=S)(S1)SP(=S)(S2)S3	{41: 6}
Did not match all atoms present	12066-81-8	[Sb].[Pr+3]	{}
Did not match all atoms present	12066-83-0	[Si]=[Pr]=[Si]	{}
Did not match all atoms present	12067-00-4	[Te]=[Re]=[Te]	{}
Did not match all atoms present	12067-17-3	S=[SbH]	{}
Did not match all atoms present	12067-22-0	[S-2].[S-2].[S-2].[Sm+3].[Sm+3]	{}
Did not match all atoms present	12067-42-4	[Se]=[Te]	{}
Did not match all atoms present	12067-45-7	[Ti](=[Se])=[Se]	{}
Did not match all atoms present	12067-46-8	[Se]=[W]=[Se]	{}
Did not match all atoms present	12067-53-7	[SiH3][TeH]	{}
Did not match all atoms present	12067-54-8	[Si]=[Th]=[Si]	{}
Did not match all atoms present	12067-56-0	[Si].[Si].[Si].[Ta].[Ta].[Ta].[Ta].[Ta]	{}
Did not match all atoms present	12067-57-1	[Si].[Si].[Si].[Ti].[Ti].[Ti].[Ti].[Ti]	{}
Did not match all atoms present	12067-66-2	[Te]=[Ta]=[Te]	{}
Did not match all atoms present	12067-75-3	[Ti](=[Te])=[Te]	{}
Did not match all atoms present	12067-76-4	[Te]=[W]=[Te]	{}
Did not match all atoms present	12067-99-1	[OH-].[O-]P(=O)([O-])[O-].O=[W]	{29: 5}
Did not match all atoms present	12068-06-3	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C(CN)N	{1: 2, 2: 24, 14: 8, 20: 2, 29: 4, 30: 2}
Did not match all atoms present	12068-40-5	[Li+].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Al+3]	{29: 6}
Did not match all atoms present	12068-50-7	O.O.O[Si](O)(O)O[Si](O)(O)O.[Al].[Al]	{20: 6, 22: 1}
Did not match all atoms present	12068-51-8	[O-2].[O-2].[O-2].[O-2].[Mg+2].[Al+3].[Al+3]	{}
Did not match all atoms present	12068-85-8	S=[Fe]=S	{}
Did not match all atoms present	12068-86-9	[O-][Fe]=O.[O-][Fe]=O.[Mg+2]	{29: 4}
Did not match all atoms present	12068-90-5	[Te]=[Hg]	{}
Did not match all atoms present	12069-00-0	[Se]=[Pb]	{}
Did not match all atoms present	12069-32-8	B12B3C14B2B43	{13: 1}
Did not match all atoms present	12069-85-1	C.[Hf]	{}
Did not match all atoms present	12069-89-5	C.[Mo].[Mo]	{}
Did not match all atoms present	1207-12-1	CC1=CC=CC2=C1SC3=C2C=CC=C3C	{1: 2, 14: 6, 41: 1}
Did not match all atoms present	1207-15-4	CC1=CC2=C(C=C1)SC3=C2C=C(C=C3)C	{1: 2, 14: 6, 41: 1}
Did not match all atoms present	1207-20-1	CCC1=CC2=C(C=C1)C3=CC=CC=C3C2	{1: 1, 2: 1, 11: 1, 14: 7}
Did not match all atoms present	1207-69-8	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)Cl	{17: 1, 35: 1, 14: 8}
Did not match all atoms present	1207-71-2	C1=CC=C2C(=C1)NC3=CC=CC=C3S2=O	{32: 1, 29: 1, 14: 8}
Did not match all atoms present	1207-72-3	CN1C2=CC=CC=C2SC3=CC=CC=C31	{1: 1, 41: 1, 14: 8, 33: 1}
Did not match all atoms present	1207-93-8	C1C2=CC=CC=C2CSC3=CC=CC=C31	{41: 1, 11: 2, 14: 8}
Did not match all atoms present	1207-99-4	C1=CC=C2C(=C1)NC3=C(S2)C=C(C=C3)Cl	{32: 1, 17: 1, 14: 7, 41: 1}
Did not match all atoms present	12070-06-3	C.[Ta]	{}
Did not match all atoms present	12070-07-4	C.[Ta].[Ta]	{}
Did not match all atoms present	12070-09-6	C.[U]	{}
Did not match all atoms present	12070-12-1	[C-]#[W+]	{}
Did not match all atoms present	12070-27-8	C.C.[Ba]	{}
Did not match all atoms present	12070-78-9	[B-](F)(F)(F)F.CCN	{16: 4, 1: 1, 2: 1, 30: 1}
Did not match all atoms present	12071-14-6	C#[C-].[Ho]	{9: 1}
Did not match all atoms present	12071-15-7	[C-]#[C].[La]	{}
Did not match all atoms present	12071-17-9	C.C.[Mn].[Mn].[Mn].[Mn].[Mn]	{}
Did not match all atoms present	12071-20-4	C.[Nb].[Nb]	{}
Did not match all atoms present	12071-29-3	C.C.[Sr].[Sr].[Sr].[Sr].[Sr]	{}
Did not match all atoms present	12071-83-9	CC(CNC(=S)[S-])NC(=S)[S-].[Zn+2]	{31: 2, 1: 1, 2: 1, 3: 1, 7: 2}
Did not match all atoms present	12073-36-8	C=C.C=C.Cl[Pt]Cl.Cl[Pt]Cl	{17: 4, 5: 4}
Did not match all atoms present	12075-40-0	C.C.C.[Cr].[Cr].[Cr].[Cr].[Cr].[Cr].[Cr]	{}
Did not match all atoms present	12075-68-2	Cl.Cl.[Al+2].[Al-].[CH2]C.[CH2]C.[CH2]C.[Cl-]	{1: 3, 5: 3, 17: 3}
Did not match all atoms present	12078-25-0	[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[Co]	{29: 2, 14: 5}
Did not match all atoms present	120788-07-0	C[C@H]([C@@H]1[C@@H]2N(C1=O)C(=C(S2)SC3CCS(=O)C3)C(=O)O)O	{1: 1, 3: 1, 33: 1, 40: 1, 41: 1, 11: 3, 12: 3, 15: 2, 20: 1, 25: 1, 27: 1, 29: 1}
Did not match all atoms present	12079-58-2	C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.BrBr	{18: 2}
Did not match all atoms present	12079-65-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[Mn]	{29: 3, 14: 5}
Did not match all atoms present	12079-73-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[Re]	{29: 3, 14: 5}
Did not match all atoms present	1208-03-3	C1=CC(=CC=C1C=O)N(CCCl)CCCl	{17: 2, 2: 4, 26: 1, 14: 4, 33: 1}
Did not match all atoms present	1208-52-2	C1=CC=C(C(=C1)CC2=CC=C(C=C2)N)N	{2: 1, 30: 2, 14: 8}
Did not match all atoms present	1208-67-9	CC(=C)COC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 5: 1, 7: 1, 14: 4, 22: 1, 29: 3}
Did not match all atoms present	12080-32-9	C1/C=C\CC/C=C\C1.Cl[Pt]Cl	{17: 2, 11: 4, 14: 4}
Did not match all atoms present	12081-16-2	C=C.C=C.C=C.C=C.[Cl-].[Cl-].[Rh].[Rh]	{17: 2, 5: 8}
Did not match all atoms present	12082-08-5	[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=CC=C1.[Cr+6]	{29: 3, 14: 6}
Did not match all atoms present	12082-47-2	C/C(=C/C(=O)C)/O.C=C.C=C.[Rh]	{1: 2, 5: 4, 6: 1, 7: 1, 20: 1, 24: 1}
Did not match all atoms present	12083-24-8	CC1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]	{1: 1, 29: 3, 14: 5}
Did not match all atoms present	12083-67-9	C1=CC(C=C1)[Hg]C2C=CC=C2	{12: 2, 14: 8}
Did not match all atoms present	12084-10-5	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Ni+2]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	12084-29-6	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Ba+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	12087-58-0	C[C-]1[CH-][CH-][CH-][CH-][CH-]1.CC1=CC=CC=C1.[Cr]	{1: 2, 14: 10, 15: 1}
Did not match all atoms present	12089-29-1	C1=CC=CC=C1.C1=CC=CC=C1.[Cr].[I-]	{19: 1, 14: 12}
Did not match all atoms present	1209-84-3	C1=CC2=C(C(=C1)C(=O)[O-])C(=CC=C2)C(=O)[O-].[K+].[K+]	{24: 2, 14: 6}
Did not match all atoms present	1209-98-9	CCNC1C2CCC(C2)C1C3=CC=CC=C3	{1: 1, 2: 1, 11: 3, 12: 4, 14: 5, 31: 1}
Did not match all atoms present	12091-64-4	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Mo].[Mo]	{29: 6, 14: 10}
Did not match all atoms present	12092-21-6	C[C-]1[CH-][CH-][CH-][CH-][C-]1C.CC1=CC=CC=C1C.[Cr]	{1: 4, 14: 8, 15: 2}
Did not match all atoms present	12092-47-6	C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.[Cl-].[Cl-].[Rh].[Rh]	{17: 2, 11: 8, 14: 8}
Did not match all atoms present	120928-09-8	CC(C)(C)C1=CC=C(C=C1)CCOC2=NC=NC3=CC=CC=C32	{1: 3, 2: 2, 35: 2, 4: 1, 14: 9, 22: 1}
Did not match all atoms present	12093-05-9	[C-]#[O+].[C-]#[O+].[C-]#[O+].C\1=C\C=C/C=C\C=C1.[Fe]	{29: 3, 14: 8}
Did not match all atoms present	121-00-6	CC(C)(C)C1=C(C=CC(=C1)OC)O	{1: 4, 22: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	121-01-7	C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)N	{16: 3, 38: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	121-02-8	CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)Cl	{1: 1, 38: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	121-03-9	CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)O	{1: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	121-04-0	CC1=C(C=C(C=C1)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 20: 2, 29: 4, 14: 3}
Did not match all atoms present	121-06-2	CC1=C(C(=CC=C1)C)OP(=O)(OC2=C(C=CC=C2C)C)OC3=C(C=CC=C3C)C	{1: 6, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	121-14-2	CC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 3}
Did not match all atoms present	121-17-5	C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])Cl	{16: 3, 17: 1, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	121-18-6	C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])Cl	{17: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	121-19-7	C1=CC(=C(C=C1[As](=O)(O)O)[N+](=O)[O-])O	{38: 1, 20: 2, 21: 1, 14: 3, 29: 1}
Did not match all atoms present	121-25-5	CCCC1=NC=C(C(=N1)N)C[N+]2=CC=CC=C2C	{1: 2, 2: 3, 35: 2, 33: 1, 14: 5, 30: 1}
Did not match all atoms present	121-27-7	C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)N)Cl	{17: 2, 30: 1, 22: 1, 14: 7}
Did not match all atoms present	121-30-2	C1=C(C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)N)N	{17: 1, 30: 3, 29: 4, 14: 2}
Did not match all atoms present	121-32-4	CCOC1=C(C=CC(=C1)C=O)O	{1: 1, 2: 1, 14: 3, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	121-33-5	COC1=C(C=CC(=C1)C=O)O	{1: 1, 22: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	121-34-6	COC1=C(C=CC(=C1)C(=O)O)O	{1: 1, 22: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	121-39-1	CCOC(=O)C1C(O1)C2=CC=CC=C2	{1: 1, 2: 1, 12: 2, 14: 5, 23: 1, 28: 1}
Did not match all atoms present	121-43-7	B(OC)(OC)OC	{1: 3, 22: 3}
Did not match all atoms present	121-45-9	COP(OC)OC	{1: 3, 22: 3}
Did not match all atoms present	121-47-1	C1=CC(=CC(=C1)S(=O)(=O)O)N	{30: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	121-48-2	C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)C(=O)O	{27: 1, 20: 2, 29: 4, 14: 3}
Did not match all atoms present	121-50-6	C1=CC(=C(C=C1C(F)(F)F)N)Cl	{16: 3, 17: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	121-51-7	C1=CC(=CC(=C1)S(=O)(=O)Cl)[N+](=O)[O-]	{17: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	121-52-8	C1=CC(=CC(=C1)S(=O)(=O)N)[N+](=O)[O-]	{30: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	121-53-9	C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)O	{27: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	121-54-0	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2.[Cl-]	{1: 7, 2: 6, 4: 2, 14: 9, 17: 1, 22: 2}
Did not match all atoms present	121-57-3	C1=CC(=CC=C1N)S(=O)(=O)O	{30: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	121-58-4	CN(C)C1=CC=C(C=C1)S(=O)(=O)O	{1: 2, 20: 1, 29: 2, 14: 4, 33: 1}
Did not match all atoms present	121-59-5	C1=CC(=CC=C1NC(=O)N)[As](=O)(O)O	{14: 4, 20: 2, 24: 1, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	121-60-8	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)Cl	{1: 1, 14: 4, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	121-61-9	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N	{1: 1, 14: 4, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	121-62-0	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)O	{1: 1, 14: 4, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	121-63-1	C1=CC(=CC=C1OC2=CC=C(C=C2)S(=O)(=O)Cl)S(=O)(=O)Cl	{17: 2, 22: 1, 14: 8, 29: 4}
Did not match all atoms present	121-66-4	C1=C(SC(=N1)N)[N+](=O)[O-]	{38: 1, 41: 1, 35: 1, 30: 1, 14: 1}
Did not match all atoms present	121-68-6	C1=CC=C(C=C1)C(=S)S	{39: 1, 14: 5, 7: 1}
Did not match all atoms present	121-69-7	CN(C)C1=CC=CC=C1	{1: 2, 14: 5, 33: 1}
Did not match all atoms present	121-71-1	CC(=O)C1=CC(=CC=C1)O	{24: 1, 1: 1, 21: 1, 14: 4}
Did not match all atoms present	121-72-2	CC1=CC(=CC=C1)N(C)C	{1: 3, 14: 4, 33: 1}
Did not match all atoms present	121-73-3	C1=CC(=CC(=C1)Cl)[N+](=O)[O-]	{17: 1, 38: 1, 14: 4}
Did not match all atoms present	121-74-4	CC(=C)C(=O)[O-].[OH-].[Cl-].[Cl-].[Cl-].[Cl-].[Cr+3].[Cr+3]	{24: 1, 1: 1, 17: 4, 5: 1, 7: 1}
Did not match all atoms present	121-75-5	CCOC(=O)CC(C(=O)OCC)SP(=S)(OC)OC	{1: 4, 2: 3, 3: 1, 40: 1, 22: 2, 28: 2}
Did not match all atoms present	121-79-9	CCCOC(=O)C1=CC(=C(C(=C1)O)O)O	{1: 1, 2: 2, 28: 1, 21: 3, 14: 2}
Did not match all atoms present	121-81-3	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)N	{24: 1, 38: 2, 30: 1, 14: 3}
Did not match all atoms present	121-86-8	CC1=C(C=C(C=C1)[N+](=O)[O-])Cl	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	121-87-9	C1=CC(=C(C=C1[N+](=O)[O-])Cl)N	{17: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	121-88-0	C1=CC(=C(C=C1[N+](=O)[O-])O)N	{30: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	121-89-1	CC(=O)C1=CC(=CC=C1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4}
Did not match all atoms present	121-90-4	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)Cl	{24: 1, 17: 1, 38: 1, 14: 4}
Did not match all atoms present	121-91-5	C1=CC(=CC(=C1)C(=O)O)C(=O)O	{27: 2, 14: 4}
Did not match all atoms present	121-92-6	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O	{27: 1, 38: 1, 14: 4}
Did not match all atoms present	121-94-8	CCOC(=O)CC(=NNC1=CC=C(C=C1)S(=O)(=O)O)C(=O)OCC	{1: 2, 2: 3, 7: 1, 34: 1, 14: 4, 20: 1, 28: 2, 29: 2, 31: 1}
Did not match all atoms present	121-97-1	CCC(=O)C1=CC=C(C=C1)OC	{24: 1, 1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	121-98-2	COC1=CC=C(C=C1)C(=O)OC	{1: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	1210-05-5	C1=CC=C(C(=C1)C=O)C2=CC=CC=C2C=O	{26: 2, 14: 8}
Did not match all atoms present	1210-12-4	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C#N	{37: 1, 14: 9}
Did not match all atoms present	1210-34-0	C1CC2=CC=CC=C2C(C3=CC=CC=C31)O	{20: 1, 11: 2, 12: 1, 14: 8}
Did not match all atoms present	1210-35-1	C1CC2=CC=CC=C2C(=O)C3=CC=CC=C31	{25: 1, 11: 2, 14: 8}
Did not match all atoms present	1210-39-5	C1=CC=C(C=C1)C(=CC=O)C2=CC=CC=C2	{26: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	1210-56-6	CC1C2=C(CCN1)C3=C(N2)C=CC(=C3)OC	{32: 2, 1: 2, 11: 2, 12: 1, 14: 3, 22: 1}
Did not match all atoms present	121010-10-4	CC(C)(C)NCC(COC1=CC=CC=C1C2=CCCC2)O	{1: 3, 2: 2, 3: 1, 4: 1, 11: 3, 14: 5, 15: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	121027-30-3	[Li+].[Na+].[I-].[I-]	{19: 2}
Did not match all atoms present	121045-73-6	C[C@@H](C1=CC=CC2=CC=CC=C21)N(C)C	{1: 3, 3: 1, 14: 7, 33: 1}
Did not match all atoms present	12107-56-1	C1/C=C\CC/C=C\C1.Cl[Pd]Cl	{17: 2, 11: 4, 14: 4}
Did not match all atoms present	12107-76-5	[B-](F)(F)(F)F.CCCC[NH2+]CCCC	{16: 4, 1: 2, 2: 6}
Did not match all atoms present	12108-04-2	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[V]	{29: 4, 14: 5}
Did not match all atoms present	12108-13-3	C[C-]1C=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mn]	{1: 1, 29: 3, 14: 4}
Did not match all atoms present	12109-10-3	CN(C)C1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]	{1: 2, 29: 3, 14: 5, 33: 1}
Did not match all atoms present	1211-08-1	C1=CC=C(C(=C1)N)N2N=C3C=CC=CC3=N2	{33: 1, 35: 2, 30: 1, 14: 8}
Did not match all atoms present	1211-09-2	C1=CC=C2C(=C1)N=C3C=C(C=CC3=[N+]2[O-])Cl	{17: 1, 35: 1, 29: 1, 14: 7, 33: 1}
Did not match all atoms present	1211-28-5	CCCC(CC1=CC=CC=C1)N2CCCC2.Cl	{1: 1, 2: 3, 3: 1, 33: 1, 11: 4, 14: 5, 17: 1}
Did not match all atoms present	1211-40-1	C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])N	{38: 1, 30: 1, 14: 8}
Did not match all atoms present	12110-21-3	CCC[N+](CCC)(CCC)CCC.F[P-](F)(F)(F)(F)F	{16: 6, 1: 4, 2: 8}
Did not match all atoms present	12110-44-0	C1C=CC=C1C2=CC=CC=C2[S-](=C=O)=C=O.C1C=CC=C1C2=CC=CC=C2[S-](=C=O)=C=O.[Fe+2]	{8: 4, 11: 2, 29: 4, 14: 14, 15: 2}
Did not match all atoms present	12111-24-9	C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Ca+2]	{24: 5, 33: 3, 2: 9}
Did not match all atoms present	12112-67-3	C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.[Cl-].[Cl-].[Ir].[Ir]	{17: 2, 11: 8, 14: 8}
Did not match all atoms present	12113-07-4	[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)O.[Na+]	{20: 1, 14: 15}
Did not match all atoms present	121132-38-5	[Li+].[K+].[I-].[I-]	{19: 2}
Did not match all atoms present	121144-97-6	CC1=CSC(=C1O)C	{1: 2, 21: 1, 14: 1, 41: 1}
Did not match all atoms present	12116-05-1	C[O+](C)C.F[P-](F)(F)(F)(F)F	{16: 6, 1: 3}
Did not match all atoms present	12116-44-8	COC1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]	{1: 1, 22: 1, 14: 5, 29: 3}
Did not match all atoms present	12116-66-4	C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Cl-].[Hf+4]	{17: 2, 11: 2, 14: 6}
Did not match all atoms present	12116-82-4	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[S-]SSS[S-].[Ti+4]	{40: 3, 14: 10}
Did not match all atoms present	1212-29-9	C1CCC(CC1)NC(=S)NC2CCCCC2	{31: 2, 11: 10, 12: 2, 7: 1}
Did not match all atoms present	1212-53-9	COC(=O)CNC(=O)OCC1=CC=CC=C1	{1: 1, 2: 2, 28: 2, 14: 5, 31: 1}
Did not match all atoms present	121219-16-7	B(C1=C(C(=CC=C1)F)F)(O)O	{16: 2, 20: 2, 14: 3}
Did not match all atoms present	12122-67-7	C(CNC(=S)[S-])NC(=S)[S-].[Zn+2]	{2: 2, 31: 2, 7: 2}
Did not match all atoms present	12124-97-9	[NH4+].[Br-]	{18: 1}
Did not match all atoms present	12124-99-1	[NH4+].[SH-]	{}
Did not match all atoms present	121246-56-8	CN(C)C1=CC=C(C=C1)CC2C(=O)N(C(=O)N(C2=O)C3CCCCC3)C4CCCCC4	{1: 2, 2: 1, 33: 3, 11: 10, 12: 3, 14: 4, 25: 3}
Did not match all atoms present	12125-01-8	[NH4+].[F-]	{16: 1}
Did not match all atoms present	12125-02-9	Cl.N	{17: 1}
Did not match all atoms present	12125-07-4	[NH4+].O.O.O.O.O.O.Cl[Ni-](Cl)Cl	{17: 3}
Did not match all atoms present	12125-09-6	[PH4+].[I-]	{19: 1}
Did not match all atoms present	12125-22-3	S=[Pd]	{}
Did not match all atoms present	12125-39-2	[NH4+].[NH4+].[Br-].[Br-].[Br-].[Br-].[Br-].[Br-].[Ir]	{18: 6}
Did not match all atoms present	12125-54-1	[Ni+2].[OH-]	{}
Did not match all atoms present	12125-61-0	[Ni]#[Sb]	{}
Did not match all atoms present	12125-63-2	[Fe]=[Te]	{}
Did not match all atoms present	12125-77-8	CC1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mo]	{1: 1, 29: 3, 14: 5}
Did not match all atoms present	12125-87-0	COC(=O)C1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr+6]	{1: 1, 28: 1, 29: 3, 14: 5}
Did not match all atoms present	12126-50-0	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Fe+2]	{1: 10, 13: 2, 15: 6}
Did not match all atoms present	121268-17-5	C(CC(O)(P(=O)(O)O)P(=O)(O)[O-])CN.O.O.O.[Na+]	{20: 4, 2: 3, 4: 1, 29: 3, 30: 1}
Did not match all atoms present	12128-13-1	[C-]#[O+].[C-]#[O+].[CH-]1[C-]=[C-][C-]=[C-]1.N#[O+].[Mo]	{29: 3, 14: 1}
Did not match all atoms present	12128-26-6	[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[W]	{29: 3, 14: 5}
Did not match all atoms present	12129-03-2	[H+].C/C(=C\C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Cl-].[Pt+2]	{24: 2, 1: 4, 17: 1, 6: 2, 7: 2}
Did not match all atoms present	12129-51-0	C1C=CC=[C-]1.C1C=CC=[C-]1.C(=O)=[Ti]=C=O	{8: 2, 11: 2, 29: 2, 14: 6}
Did not match all atoms present	12129-67-8	CC1=CC(=CC(=C1)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]	{1: 3, 29: 3, 14: 3}
Did not match all atoms present	12129-68-9	[CH-]1[CH-][CH-][CH-][CH-][CH-]1.C1=CC=CC=C1.[Mo]	{14: 12}
Did not match all atoms present	12129-69-0	CC1=CC(=CC(=C1)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[W]	{1: 3, 29: 3, 14: 3}
Did not match all atoms present	12129-72-5	C1CCCCC1.[V]	{11: 6}
Did not match all atoms present	12131-50-9	C[C-]1[CH-][C-]([CH-][C-]([CH-]1)C)C.CC1=CC(=CC(=C1)C)C.[Mo]	{1: 6, 14: 6, 15: 3}
Did not match all atoms present	121315-20-6	C1=CC(=CC(=C1)N)C(=O)NCCS(=O)(=O)CCOS(=O)(=O)O	{2: 4, 14: 4, 20: 1, 22: 1, 24: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	12132-04-6	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mo+3].[Mo+3]	{1: 10, 29: 4}
Did not match all atoms present	12132-09-1	[C-]#[O+].[C-]#[O+].[CH-]1[C-]=[C-][C-]=[C-]1.C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)C3=CC=CC=C3.[Fe+5]	{29: 2, 14: 16}
Did not match all atoms present	12132-87-5	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ru+].[Ru+]	{29: 4, 14: 10}
Did not match all atoms present	12133-36-7	[Ca].[Sn]	{}
Did not match all atoms present	12133-37-8	[Ca].[Zn].[Zn]	{}
Did not match all atoms present	12133-58-3	S=[Ce]=S	{}
Did not match all atoms present	12134-75-7	[SiH4].[SiH4].[Gd+3]	{}
Did not match all atoms present	12135-07-8	[OH-].[Sc+3]	{}
Did not match all atoms present	12135-22-7	[OH-].[OH-].[Pd+2]	{}
Did not match all atoms present	12135-76-1	[NH4+].[NH4+].[S-2]	{}
Did not match all atoms present	12135-77-2	[NH4+].[S-2].[S-2].[S-2].[S-2].[S-2]	{}
Did not match all atoms present	12136-45-7	[K+].[K+].[O-2]	{}
Did not match all atoms present	12136-49-1	[S-]SS[S-].[K+].[K+]	{40: 2}
Did not match all atoms present	12136-58-2	[Li+].[Li+].[S-2]	{}
Did not match all atoms present	12136-59-3	[Li][Te][Li]	{}
Did not match all atoms present	12136-60-6	[Li][Se][Li]	{}
Did not match all atoms present	12136-78-6	[Si]=[Mo]=[Si]	{}
Did not match all atoms present	12136-79-7	P#[Mo]	{}
Did not match all atoms present	12136-97-9	S=[Nb]=S	{}
Did not match all atoms present	12137-20-1	O=[Ti]	{29: 1}
Did not match all atoms present	12137-27-8	O=[Rh]=O	{29: 2}
Did not match all atoms present	12137-34-7	[O-2].[O-2].[O-2].[Ti+4].[Rb+].[Rb+]	{}
Did not match all atoms present	12137-38-1	O=POP(=O)=O	{29: 3, 22: 1}
Did not match all atoms present	12137-70-1	P12P3SP(S1)SP(S2)S3	{41: 5}
Did not match all atoms present	12137-76-7	[Se-2].[Pd+2]	{}
Did not match all atoms present	12137-83-6	[SiH3].[Pt]	{}
Did not match all atoms present	12138-07-7	S=[Th]=S	{}
Did not match all atoms present	12138-09-9	S=[W]=S	{}
Did not match all atoms present	12138-11-3	[S-2].[S-2].[S-2].[Tb+3].[Tb+3]	{}
Did not match all atoms present	12138-21-5	[Se]=[U]=[Se]	{}
Did not match all atoms present	12138-26-0	[Si]=[Zr]	{}
Did not match all atoms present	12138-28-2	[Si-].[Si-].[Sr+2]	{}
Did not match all atoms present	12138-37-3	[Te]=[U]=[Te]	{}
Did not match all atoms present	12139-22-9	OO.[Cd]	{20: 2}
Did not match all atoms present	1214-39-7	C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3	{32: 1, 2: 1, 35: 3, 14: 7, 31: 1}
Did not match all atoms present	1214-47-7	C1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2O	{24: 1, 14: 9, 6: 2, 21: 1}
Did not match all atoms present	12140-98-6	[GeH4].[GeH4].[GeH4].[U]	{}
Did not match all atoms present	12140-99-7	[V].[V].[V].[V].[V].[GeH4].[GeH4].[GeH4]	{}
Did not match all atoms present	12141-11-6	COC1=C(C=C(C=C1)C(=O)O[C@H]2[C@@H]3C=CO[C@@H]([C@@H]3[C@@]4([C@H]2O4)CO)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O	{1: 1, 2: 2, 12: 10, 13: 1, 14: 5, 20: 5, 21: 1, 22: 2, 23: 3, 28: 1}
Did not match all atoms present	12141-46-7	[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Si+4]	{}
Did not match all atoms present	12142-33-5	O.O.O.[O-][Sn](=O)[O-].[K+].[K+]	{29: 3}
Did not match all atoms present	12142-40-4	[K][Te][K]	{}
Did not match all atoms present	12142-60-8	[Mg].[La]	{}
Did not match all atoms present	12142-63-1	[Ni].[La]	{}
Did not match all atoms present	12142-77-7	[Li+].[Li+].[O-2]	{}
Did not match all atoms present	12142-88-0	[Ni]=[Te]	{}
Did not match all atoms present	12142-89-1	[Ti].[Ti].[Ni]	{}
Did not match all atoms present	121428-29-3	CC(C)(C)OC(=O)NC(CC1=CN=CN1)C(=O)O	{32: 1, 1: 3, 2: 1, 3: 1, 4: 1, 14: 2, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	12143-34-9	[O-][Sn](=O)[O-].[Sr+2]	{29: 3}
Did not match all atoms present	12143-37-2	[O-][W](=O)[O-].[Sr+2]	{29: 3}
Did not match all atoms present	12143-45-2	OS(=O)(=O)[O-]	{20: 1, 29: 3}
Did not match all atoms present	12143-72-5	S=[Ta]=S	{}
Did not match all atoms present	12144-09-1	C=1=[Si]=C=[Si]1	{8: 2}
Did not match all atoms present	12145-48-1	C1/C=C\CC/C=C\C1.Br[Pt]Br	{18: 2, 11: 4, 14: 4}
Did not match all atoms present	12145-63-0	CCCC.[Ni]	{1: 2, 2: 2}
Did not match all atoms present	12146-37-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1C2C=CC1C=C2.[Mo]	{11: 1, 12: 2, 29: 4, 14: 4}
Did not match all atoms present	12146-92-8	C[C-]1[CH-][CH-][CH-][CH-]1.C[C-]1C=CC=C1.[Cr]	{1: 2, 14: 8}
Did not match all atoms present	12148-49-1	[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.Cl[Zr+2]Cl	{17: 2, 14: 14}
Did not match all atoms present	1215-16-3	CC(=O)NC1=CC=C(C=C1)N(CCCl)CCCl	{1: 1, 2: 4, 33: 1, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	1215-57-2	CC1=CC=CC=C1N=C=NC2=CC=CC=C2C	{8: 1, 1: 2, 34: 2, 14: 8}
Did not match all atoms present	1215-59-4	C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3	{32: 1, 2: 1, 22: 1, 14: 10}
Did not match all atoms present	1215-83-4	CC(CN(C)C)C(C)(CC1=CC=C(C=C1)Cl)O.Cl	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 4, 17: 2, 20: 1}
Did not match all atoms present	121514-72-5	C1=NC(C(N1)[N+]#N)C(=O)N.[OH-]	{32: 1, 34: 1, 35: 1, 12: 2, 14: 1, 24: 1, 30: 1}
Did not match all atoms present	121514-80-5	CCC(COC1=CC=C(C=C1)N=C=O)(COC2=CC=C(C=C2)N=C=O)COC3=CC=C(C=C3)N=C=O	{1: 1, 2: 4, 4: 1, 8: 3, 34: 3, 14: 12, 22: 3, 29: 3}
Did not match all atoms present	12152-92-0	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[Ti](I)I	{19: 2, 14: 10}
Did not match all atoms present	121525-83-5	C1=CC(=[NH+]C[NH+]=C2C=CC(=C(C3=CC=C(C=C3)N)C4=CC=C(C=C4)N)C=C2)C=CC1=C(C5=CC=C(C=C5)N)C6=CC=C(C=C6)N.[Cl-].[Cl-]	{2: 1, 7: 2, 14: 24, 15: 4, 17: 2, 30: 4, 31: 2}
Did not match all atoms present	12154-63-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].C1CCC2=CC=CC=C2C1.[Cr]	{11: 4, 29: 3, 14: 4}
Did not match all atoms present	121543-39-3	CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.CCC(COCC=C)(COCC=C)COP(=O)(O)OP(=O)(O)OCC(CC)(COCC=C)COCC=C.[Zr]	{1: 4, 2: 24, 4: 4, 5: 8, 6: 8, 20: 4, 22: 11, 29: 2}
Did not match all atoms present	121564-27-0	CCCS(=O)C#C	{1: 1, 2: 2, 29: 1, 10: 1, 9: 1}
Did not match all atoms present	12157-68-5	[Ce].[Pt]	{}
Did not match all atoms present	12157-69-6	[Rh].[Ce]	{}
Did not match all atoms present	12157-80-1	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Zr+4].[Zr+4].[Ce+3].[Ce+3]	{}
Did not match all atoms present	12159-43-2	[Te].[Te].[Te].[Dy].[Dy]	{}
Did not match all atoms present	12160-99-5	[Te].[Te].[Te].[Gd].[Gd]	{}
Did not match all atoms present	121602-93-5	C1=C(C=C(C(=C1F)F)F)C(=O)O	{16: 3, 27: 1, 14: 2}
Did not match all atoms present	12162-16-2	[He].[Ne]	{}
Did not match all atoms present	12162-21-9	[Se]=[Hf]=[Se]	{}
Did not match all atoms present	12162-59-3	[S-2].[S-2].[S-2].[Ho+3].[Ho+3]	{}
Did not match all atoms present	12162-60-6	[Se-2].[Se-2].[Se-2].[Ho+3].[Ho+3]	{}
Did not match all atoms present	12163-20-1	[S-2].[S-2].[S-2].[Lu+3].[Lu+3]	{}
Did not match all atoms present	12163-21-2	[Se-2].[Se-2].[Se-2].[Lu+3].[Lu+3]	{}
Did not match all atoms present	12163-67-6	[O-][Mo](=O)[O-].[Sr+2]	{29: 3}
Did not match all atoms present	12163-83-6	O=[Mo]1(=O)O[Mo](=O)(=O)O[Mo](=O)(=O)O1	{29: 6, 23: 3}
Did not match all atoms present	12164-97-5	O=P[O]	{29: 2}
Did not match all atoms present	12165-21-8	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Tc+7].[Tc+7]	{}
Did not match all atoms present	12165-69-4	P(=S)SP=S	{40: 1}
Did not match all atoms present	12165-70-7	P12P3P1SP2S3	{41: 2}
Did not match all atoms present	12165-71-8	P12SP3SP(S1)SP(S2)S3	{41: 6}
Did not match all atoms present	12166-12-0	[Sc].[Rh]	{}
Did not match all atoms present	12166-20-0	S=[Ru]=S	{}
Did not match all atoms present	12166-27-7	S=[V]	{}
Did not match all atoms present	12166-28-8	S=[V]=S	{}
Did not match all atoms present	12166-30-2	[S-2].[S-2].[S-2].[Tm+3].[Tm+3]	{}
Did not match all atoms present	12166-36-8	[Sc+3].[Sb]	{}
Did not match all atoms present	12166-47-1	[Se]=[Zr]=[Se]	{}
Did not match all atoms present	121676-49-1	CCCCC(CC)COC(=O)C=C.CC(=C)C(=O)OCC1CO1.CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4	{1: 5, 2: 8, 3: 1, 4: 1, 5: 2, 6: 1, 7: 1, 11: 3, 12: 3, 14: 8, 22: 2, 23: 3, 28: 2}
Did not match all atoms present	121678-88-4	CC(C)C1=CC=C(C=C1)/C=[N+](/C(C)(C)C)\[O-]	{1: 5, 3: 1, 4: 1, 6: 1, 33: 1, 14: 4, 29: 1}
Did not match all atoms present	12168-52-4	O.O.O.[Ti].[Fe]	{}
Did not match all atoms present	12168-64-8	[OH-].[Pb+2]	{}
Did not match all atoms present	12168-85-3	[O-][Si]([O-])([O-])[O-].O=[Ca].[Ca+2].[Ca+2]	{29: 5}
Did not match all atoms present	1217-44-3	C(#N)C1=C(C(=C(C(=C1C#N)C#N)C#N)C#N)C#N	{37: 6}
Did not match all atoms present	1217-45-4	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2C#N)C#N	{37: 2, 14: 8}
Did not match all atoms present	12170-92-2	[CH-]=O.[CH-]=O.[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[Ni].[Ni]	{29: 2, 14: 10}
Did not match all atoms present	121734-15-4	CCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1	{1: 1, 2: 11, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	121734-16-5	CCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1.C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N	{1: 1, 2: 11, 34: 2, 14: 13, 22: 1, 29: 2, 30: 2}
Did not match all atoms present	12174-11-7	O.O.O.O.O.O.O.O.O.O.O.O.O.O.[OH-].[Mg].[Mg].[Al].[Al].[Si].[Si].[Si].[Si]	{}
Did not match all atoms present	121758-19-8	CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C2=CC=CC=C2)[C@@H](C3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C	{1: 2, 3: 2, 29: 4, 14: 18, 31: 2}
Did not match all atoms present	12177-67-2	[H-].[OH-].[Ca+2]	{}
Did not match all atoms present	121776-33-8	CC1(N(CC(O1)C2=CC=CO2)C(=O)C(Cl)Cl)C	{1: 2, 3: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 3, 17: 2, 23: 2, 24: 1}
Did not match all atoms present	12179-03-2	[OH-].[Th+4]	{}
Did not match all atoms present	12179-04-3	B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].O.O.O.O.O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{29: 12}
Did not match all atoms present	12179-05-4	[OH-].[OH-].[Th+4]	{}
Did not match all atoms present	12179-14-5	[OH-].[OH-].[OH-].[OH-].[Na+].[Na+].[Zn+2]	{}
Did not match all atoms present	12179-29-2	[O-2].[O-2].[O-2].[O-2].[Mg+2].[Ti+4].[Zn+2]	{}
Did not match all atoms present	121799-26-6	C1=CC(=CC(=C1)OCCCCOC2=CC=CC(=C2)C=O)C=O	{2: 4, 26: 2, 22: 2, 14: 8}
Did not match all atoms present	1218-34-4	CC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O	{32: 1, 1: 1, 2: 1, 3: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	1218-35-5	CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C.Cl	{32: 1, 1: 5, 2: 1, 35: 1, 4: 1, 11: 2, 14: 2, 15: 1, 17: 1}
Did not match all atoms present	12183-80-1	O.[O-][Si](=O)O[Si](=O)[O-].[Al].[Al]	{29: 4, 22: 1}
Did not match all atoms present	12184-87-1	[GeH2].[GeH2].[GeH2].[GeH2]	{}
Did not match all atoms present	12184-88-2	[H-]	{}
Did not match all atoms present	121848-13-3	CCCC[P+](CCCC)(CCCC)CC(C)OC.[Cl-]	{1: 5, 2: 10, 3: 1, 22: 1, 17: 1}
Did not match all atoms present	12187-08-5	[As]12[As]3[As]1[As]23	{}
Did not match all atoms present	12187-20-1	[Co].[Sb].[Sb].[Sb]	{}
Did not match all atoms present	12187-84-7	[SbH].[Cs].[Cs]	{}
Did not match all atoms present	12189-76-3	C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Cu+2]	{24: 5, 33: 3, 2: 9}
Did not match all atoms present	1219-20-1	CC[NH+](CC)CCC1=NC(=NO1)C2=CC=CC=C2.[Cl-]	{1: 2, 2: 4, 35: 2, 14: 5, 17: 1, 23: 1}
Did not match all atoms present	1219-99-4	C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)Cl)Cl	{24: 1, 17: 2, 14: 8, 31: 2}
Did not match all atoms present	12190-70-4	[Cu].[Cu]	{}
Did not match all atoms present	12190-75-9	[N]Cl	{17: 1}
Did not match all atoms present	12190-79-3	[Li+].[O-][Co]=O	{29: 2}
Did not match all atoms present	121905-60-0	CC1=C[C-]=CC=C1.[Mg+2].[Cl-]	{1: 1, 14: 4, 17: 1}
Did not match all atoms present	12192-57-3	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)[S-])O)O)O)O.[Au+]	{20: 4, 2: 1, 12: 5, 23: 1}
Did not match all atoms present	121928-38-9	COC(=O)CC(C(=O)OC)N=C=S	{1: 2, 2: 1, 3: 1, 8: 1, 34: 1, 28: 2}
Did not match all atoms present	12193-47-4	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Sr+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	122-00-9	CC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 14: 4}
Did not match all atoms present	122-01-0	C1=CC(=CC=C1C(=O)Cl)Cl	{24: 1, 17: 2, 14: 4}
Did not match all atoms present	122-03-2	CC(C)C1=CC=C(C=C1)C=O	{1: 2, 26: 1, 3: 1, 14: 4}
Did not match all atoms present	122-04-3	C1=CC(=CC=C1C(=O)Cl)[N+](=O)[O-]	{24: 1, 17: 1, 38: 1, 14: 4}
Did not match all atoms present	122-06-5	C1=CC=C(C=C1)C=CC2=CC=CC=C2C(=N)N	{30: 1, 36: 1, 14: 9, 6: 2, 7: 1}
Did not match all atoms present	122-08-7	C[N+](C)(C)CC1=CC=CC=C1.C[O-]	{1: 4, 2: 1, 29: 1, 14: 5}
Did not match all atoms present	122-09-8	CC(C)(CC1=CC=CC=C1)N	{1: 2, 2: 1, 4: 1, 30: 1, 14: 5}
Did not match all atoms present	122-10-1	COC(=O)CC(=CC(=O)OC)OP(=O)(OC)OC	{1: 4, 2: 1, 6: 1, 7: 1, 22: 3, 28: 2, 29: 1}
Did not match all atoms present	122-11-2	COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N)OC	{1: 2, 35: 2, 14: 5, 22: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	122-14-5	CC1=C(C=CC(=C1)OP(=S)(OC)OC)[N+](=O)[O-]	{1: 3, 38: 1, 22: 3, 14: 3}
Did not match all atoms present	122-16-7	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 38: 1, 14: 8, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	122-18-9	CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 16, 14: 5, 17: 1}
Did not match all atoms present	122-19-0	CCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 18, 14: 5, 17: 1}
Did not match all atoms present	122-25-8	C1=CC(=C(C=C1CC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O	{2: 1, 27: 2, 21: 2, 14: 6}
Did not match all atoms present	122-27-0	CC1=CC(=CC=C1)OC(=O)CC2=CC=CC=C2	{1: 1, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	122-28-1	CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	122-34-9	CCNC1=NC(=NC(=N1)Cl)NCC	{1: 2, 2: 2, 31: 2, 35: 3, 17: 1}
Did not match all atoms present	122-35-0	CC(C(=O)Cl)OC1=CC=CC=C1	{1: 1, 3: 1, 14: 5, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	122-36-1	C1CCC(CC1)NC(=S)C(=S)NC2CCCCC2	{31: 2, 11: 10, 12: 2, 7: 2}
Did not match all atoms present	122-37-2	C1=CC=C(C=C1)NC2=CC=C(C=C2)O	{21: 1, 14: 9, 31: 1}
Did not match all atoms present	122-39-4	C1=CC=C(C=C1)NC2=CC=CC=C2	{14: 10, 31: 1}
Did not match all atoms present	122-40-7	CCCCCC(=CC1=CC=CC=C1)C=O	{1: 1, 2: 4, 6: 1, 7: 1, 14: 5, 26: 1}
Did not match all atoms present	122-42-9	CC(C)OC(=O)NC1=CC=CC=C1	{1: 2, 3: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	122-43-0	CCCCOC(=O)CC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 14: 5}
Did not match all atoms present	122-45-2	CCCCCCCCOC(=O)CC1=CC=CC=C1	{1: 1, 2: 8, 28: 1, 14: 5}
Did not match all atoms present	122-46-3	CC1=CC(=CC=C1)OC(=O)C	{1: 2, 28: 1, 14: 4}
Did not match all atoms present	122-47-4	C/C(=C/C1=CC(=C(C=C1)OC)OC)/[N+](=O)[O-]	{1: 3, 6: 1, 38: 1, 7: 1, 14: 3, 22: 2}
Did not match all atoms present	122-48-5	CC(=O)CCC1=CC(=C(C=C1)O)OC	{1: 2, 2: 2, 14: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	122-52-1	CCOP(OCC)OCC	{1: 3, 2: 3, 22: 3}
Did not match all atoms present	122-56-5	B(CCCC)(CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	122-57-6	CC(=O)/C=C/C1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 6: 2}
Did not match all atoms present	122-59-8	C1=CC=C(C=C1)OCC(=O)O	{2: 1, 27: 1, 22: 1, 14: 5}
Did not match all atoms present	122-60-1	C1C(O1)COC2=CC=CC=C2	{2: 1, 11: 1, 12: 1, 14: 5, 22: 1, 23: 1}
Did not match all atoms present	122-63-4	CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	122-65-6	C1=CC=C(C=C1)CNC(=S)C(=S)NCC2=CC=CC=C2	{2: 2, 31: 2, 14: 10, 7: 2}
Did not match all atoms present	122-66-7	C1=CC=C(C=C1)NNC2=CC=CC=C2	{14: 10, 31: 2}
Did not match all atoms present	122-67-8	CC(C)COC(=O)C=CC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 6: 2, 14: 5, 28: 1}
Did not match all atoms present	122-68-9	C1=CC=C(C=C1)CCCOC(=O)C=CC2=CC=CC=C2	{2: 3, 28: 1, 14: 10, 6: 2}
Did not match all atoms present	122-69-0	C1=CC=C(C=C1)C=CCOC(=O)C=CC2=CC=CC=C2	{2: 1, 28: 1, 14: 10, 6: 4}
Did not match all atoms present	122-70-3	CCC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	122-71-4	CC(OCCC1=CC=CC=C1)OCCC2=CC=CC=C2	{1: 1, 2: 4, 3: 1, 22: 2, 14: 10}
Did not match all atoms present	122-72-5	CC(=O)OCCCC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	122-73-6	CC(C)CCOCC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	122-74-7	CCC(=O)OCCCC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 14: 5}
Did not match all atoms present	122-75-8	CC(=O)O.CC(=O)O.C1=CC=C(C=C1)CNCCNCC2=CC=CC=C2	{1: 2, 2: 4, 27: 2, 14: 10, 31: 2}
Did not match all atoms present	122-78-1	C1=CC=C(C=C1)CC=O	{2: 1, 26: 1, 14: 5}
Did not match all atoms present	122-79-2	CC(=O)OC1=CC=CC=C1	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	122-80-5	CC(=O)NC1=CC=C(C=C1)N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	122-82-7	CCOC1=CC=C(C=C1)NC(=O)CC(=O)C	{1: 2, 2: 2, 14: 4, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	122-84-9	CC(=O)CC1=CC=C(C=C1)OC	{24: 1, 1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	122-85-0	CC(=O)NC1=CC=C(C=C1)C=O	{24: 1, 1: 1, 26: 1, 14: 4, 31: 1}
Did not match all atoms present	122-87-2	C1=CC(=CC=C1NCC(=O)O)O	{2: 1, 27: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	122-88-3	C1=CC(=CC=C1OCC(=O)O)Cl	{17: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	122-93-0	CCC1=CN=C(C=C1)CCOC(=O)C=C	{1: 1, 2: 3, 35: 1, 5: 1, 6: 1, 14: 3, 28: 1}
Did not match all atoms present	122-94-1	CCCCOC1=CC=C(C=C1)O	{1: 1, 2: 3, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	122-95-2	CCOC1=CC=C(C=C1)OCC	{1: 2, 2: 2, 22: 2, 14: 4}
Did not match all atoms present	122-97-4	C1=CC=C(C=C1)CCCO	{2: 3, 20: 1, 14: 5}
Did not match all atoms present	122-98-5	C1=CC=C(C=C1)NCCO	{2: 2, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	122-99-6	C1=CC=C(C=C1)OCCO	{2: 2, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	1220-83-3	COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 2, 14: 6, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	1220-94-6	CNC1=C2C(=C(C=C1)N)C(=O)C3=CC=CC=C3C2=O	{1: 1, 31: 1, 30: 1, 14: 6, 25: 2}
Did not match all atoms present	12200-64-5	O.[OH-].[Na+]	{}
Did not match all atoms present	12201-48-8	[O-][Zr](=O)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	12201-85-3	[Ni+2].[Se-2]	{}
Did not match all atoms present	12201-89-7	[Ni+2].[Si-]#[Si-]	{}
Did not match all atoms present	122012-52-6	C(=[N-])=O.C(=[N-])=O.N.N.[Zn+2]	{8: 2, 29: 2}
Did not match all atoms present	12202-01-6	[Ni].[Ni].[Ni].[Sn].[Sn].[Sn].[Sn]	{}
Did not match all atoms present	122023-29-4	CC(=O)C1=C(C=C(C=C1)C(F)(F)F)F	{16: 4, 1: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	122030-04-0	C1=C(C=C(C(=C1F)C(F)(F)F)F)F	{16: 6, 4: 1, 14: 2}
Did not match all atoms present	12207-14-6	[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[K+].[Fe+3].[Fe+3].[Fe+3]	{29: 8}
Did not match all atoms present	12207-63-5	[NH4+].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[V].[V].[V]	{}
Did not match all atoms present	12208-54-7	[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].O.O.O.O.O.O.[O-][W](=O)(=O)[O-].[O-][W](=O)(=O)[O-].[O-][W](=O)(=O)[O-]	{29: 12}
Did not match all atoms present	12209-98-2	O.O.O.O=[Sn]=O.[Na]	{29: 2}
Did not match all atoms present	1221-56-3	CN(C)C=NC1=C(C=C(C(=C1I)CCC(=O)[O-])I)I.[Na+]	{1: 2, 2: 2, 6: 1, 33: 1, 34: 1, 14: 1, 19: 3, 24: 1}
Did not match all atoms present	12211-52-8	[C-]#N.[NH4+]	{}
Did not match all atoms present	122111-03-9	C1=CN(C(=O)N=C1N)[C@H]2C([C@@H]([C@H](O2)CO)O)(F)F.Cl	{33: 1, 2: 1, 35: 1, 12: 3, 13: 1, 14: 2, 16: 2, 17: 1, 20: 2, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	12214-16-3	[S-2].[Cs+].[Cs+]	{}
Did not match all atoms present	12215-68-8	C[Si](C)(C)[C-]1C=CC=C1.[CH-]1[CH-][CH-][CH-][CH-]1.[Fe]	{1: 3, 14: 9}
Did not match all atoms present	12217-45-7	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl.[Cl-]	{1: 4, 2: 3, 38: 1, 33: 1, 34: 2, 14: 6, 17: 3}
Did not match all atoms present	12217-74-2	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])NC(=O)NC3=CC=C(C=C3)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 4, 14: 16, 22: 1, 24: 1, 29: 9, 31: 2}
Did not match all atoms present	12217-79-7	C1=CC(=C2C(=C1N)C(=O)C3=C(C2=O)C(=C(C=C3O)Cl)N)O	{17: 1, 30: 2, 21: 2, 14: 3, 25: 2}
Did not match all atoms present	12218-47-2	P#[Er]	{}
Did not match all atoms present	122185-09-5	CO[Si](CCCCCCCCCC[Si](OC)(OC)OC)(OC)OC	{1: 6, 2: 10, 22: 6}
Did not match all atoms present	12219-37-3	CCCCC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 3, 14: 9, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	1222-05-5	CC1COCC2=CC3=C(C=C12)C(C(C3(C)C)C)(C)C	{1: 6, 11: 2, 12: 2, 13: 2, 14: 2, 23: 1}
Did not match all atoms present	1222-42-0	CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)OC)C	{1: 3, 28: 1, 14: 7, 31: 1}
Did not match all atoms present	1222-57-7	CS(=O)(=O)C1=CC=C(C=C1)C2=CN3C=CC=CC3=N2	{1: 1, 35: 1, 29: 2, 14: 9, 33: 1}
Did not match all atoms present	1222-61-3	CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=CC=CC=C2	{1: 2, 37: 1, 6: 1, 33: 1, 7: 1, 14: 9}
Did not match all atoms present	1222-98-6	C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9, 6: 2}
Did not match all atoms present	12220-28-9	CC1=C(C(=CC=C1)C)NC2=CC3=C(C=C2)C(=C4C=CC(=[NH+]C5=C(C=C(C=C5C)S(=O)(=O)[O-])C)C=C4O3)C6=CC=CC=C6S(=O)(=O)[O-].[Na+]	{1: 4, 31: 2, 29: 6, 14: 15, 23: 1}
Did not match all atoms present	12221-38-4	CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OCC)CCC(=O)N.[Cl-]	{1: 3, 2: 5, 33: 2, 41: 1, 34: 2, 14: 7, 17: 1, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	12222-79-6	C1=CC(=C2C(=C1N)C(=O)C3=C(C2=O)C(=CC(=C3N)Br)O)O	{25: 2, 18: 1, 30: 2, 21: 2, 14: 3}
Did not match all atoms present	12223-46-0	COC(=O)CCN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N	{1: 1, 2: 4, 37: 2, 38: 1, 33: 1, 34: 2, 14: 7, 28: 1}
Did not match all atoms present	12223-84-6	C1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]	{30: 1, 38: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	12223-91-5	C1=CC=C(C=C1)C2=C/C(=N\NC3=CC=C(C=C3)NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])/C=CC2=O	{34: 1, 38: 2, 14: 15, 15: 2, 25: 1, 31: 2}
Did not match all atoms present	12224-02-1	C1=CC(=CC(=C1)S(=O)(=O)[O-])NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC(=CC=C6)S(=O)(=O)[O-])N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 14, 20: 4, 29: 12, 31: 4}
Did not match all atoms present	12225-18-2	CC(=O)C(C(=O)NC1=CC(=C(C=C1OC)Cl)OC)N=NC2=CC(=C(C=C2OC)S(=O)(=O)NC3=CC=CC=C3)OC	{1: 5, 34: 2, 3: 1, 14: 9, 17: 1, 22: 4, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	12226-45-8	CC1=C(C=CC(=C1)NC2=NC(=NC(=N2)Cl)Cl)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 2, 35: 3, 14: 8, 17: 2, 29: 6, 31: 1}
Did not match all atoms present	12228-40-9	[Be+2].[B-].[B-]	{}
Did not match all atoms present	12228-49-8	B(=O)[O-].[K+]	{29: 2}
Did not match all atoms present	12228-87-4	B1(OB(O1)OB2OB(O2)O)O.N.N.O.O.O.O	{20: 2, 22: 1, 23: 4}
Did not match all atoms present	12228-91-0	[B].[O-2].[Mn+2]	{}
Did not match all atoms present	12229-13-9	B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].O.O.O.O.O.O.O.O.[K+].[K+].[K+].[K+].[K+]	{29: 15}
Did not match all atoms present	122293-58-7	C(=C=C=S)=C=S	{8: 4}
Did not match all atoms present	1223-20-7	COC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)OC)N	{1: 2, 2: 1, 30: 2, 22: 2, 14: 6}
Did not match all atoms present	1223-31-0	C1=CC(=CC=C1[N+](=O)[O-])SC2=CC=C(C=C2)[N+](=O)[O-]	{40: 1, 38: 2, 14: 8}
Did not match all atoms present	1223-36-5	CCN(CC)CCNC(=O)COC1=CC=C(C=C1)Cl	{1: 2, 2: 5, 33: 1, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	1223-37-6	CCCCOC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 6, 28: 2, 14: 5}
Did not match all atoms present	12230-30-7	[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[Ga]	{}
Did not match all atoms present	12230-32-9	[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[B].[Mg]	{}
Did not match all atoms present	12230-71-6	O.O.O.O.O.O.O.O.[OH-].[OH-].[Ba+2]	{}
Did not match all atoms present	12231-98-0	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ba+2].[Ba+2].[Ba+2].[Ba+2].[Ba+2].[Ta+5].[Ta+5].[Ta+5].[Ta+5]	{}
Did not match all atoms present	12232-25-6	[Be]=[Se]	{}
Did not match all atoms present	12232-27-8	[Be]=[Te]	{}
Did not match all atoms present	12232-29-0	[Be+2].[Be+2].[Cl-].[Cl-].[Cl-].[Cl-]	{17: 4}
Did not match all atoms present	12232-67-6	[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Ti]	{}
Did not match all atoms present	12232-90-5	[Er].[Bi]	{}
Did not match all atoms present	12232-94-9	[La].[Bi]	{}
Did not match all atoms present	122322-18-3	C1=CC(=C(C=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)I)Cl)Cl)Cl	{33: 1, 2: 1, 35: 2, 14: 7, 17: 3, 19: 1, 22: 1, 25: 1}
Did not match all atoms present	122322-19-4	C1=CC(=CC=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)I)Cl)Cl	{33: 1, 2: 1, 35: 2, 14: 8, 17: 2, 19: 1, 22: 1, 25: 1}
Did not match all atoms present	122322-20-7	C1=CC(=CC=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)Br)Cl)Cl	{33: 1, 2: 1, 35: 2, 14: 8, 17: 2, 18: 1, 22: 1, 25: 1}
Did not match all atoms present	122322-21-8	C1=CC(=C(C=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)Br)Cl)Cl)Cl	{33: 1, 2: 1, 35: 2, 14: 7, 17: 3, 18: 1, 22: 1, 25: 1}
Did not match all atoms present	122322-22-9	C1=CC(=C(C=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)Cl)Cl)Br)Cl	{33: 1, 2: 1, 35: 2, 14: 7, 17: 3, 18: 1, 22: 1, 25: 1}
Did not match all atoms present	122322-23-0	C1=CC(=CC=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)Cl)I)Cl	{33: 1, 2: 1, 35: 2, 14: 8, 17: 2, 19: 1, 22: 1, 25: 1}
Did not match all atoms present	122322-24-1	C1=CC(=C(C=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)Cl)I)Cl)Cl	{33: 1, 2: 1, 35: 2, 14: 7, 17: 3, 19: 1, 22: 1, 25: 1}
Did not match all atoms present	122322-26-3	C1=CC(=C(C=C1N2C(=O)C(=C(C=N2)OCC3=CN=C(C=C3)I)Br)Cl)Cl	{33: 1, 2: 1, 35: 2, 14: 7, 17: 2, 18: 1, 19: 1, 22: 1, 25: 1}
Did not match all atoms present	12233-02-2	[Nd].[Bi]	{}
Did not match all atoms present	12233-13-5	[Sm].[Bi]	{}
Did not match all atoms present	12233-56-6	O.O.O.O.O.O.O.O.O.O.O.O.[Ge].[Ge].[Ge].[Bi].[Bi].[Bi].[Bi]	{}
Did not match all atoms present	12233-73-7	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ge].[Ge].[Bi+3].[Bi+3]	{}
Did not match all atoms present	122349-91-1	CC1=CC(=NC2=CC(=C(C=C12)C)N)C	{1: 3, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	12235-21-1	C1=CC=C(C=C1)C2=C/C(=N/NC3=CC=C(C=C3)OCCOS(=O)(=O)[O-])/C(=O)C=C2.[Na+]	{2: 2, 34: 1, 14: 12, 15: 2, 22: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	12236-86-1	C1=CC(=CC=C1NS(=O)(=O)C2=CC3=C4[N-]C(=C3C=C2)N=C5C6=C(C=CC(=C6)S(=O)(=O)O)C(=N5)N=C7C8=C(C=CC(=C8)S(=O)(=O)O)C(=N7)N=C9C1=C(C=CC(=C1)S(=O)(=O)O)C(=N4)[N-]9)S(=O)(=O)CCO.[Cu+2]	{2: 2, 35: 8, 14: 16, 20: 4, 29: 10, 31: 1}
Did not match all atoms present	12237-01-3	CN(C1=CC2=C(C=C1)C(=O)/C(=N\NC3=C(C=C(C=C3)OC)S(=O)(=O)[O-])/C(=C2)S(=O)(=O)[O-])C4=NC(=NC(=N4)NC5=CC=C(C=C5)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 2, 34: 1, 35: 3, 33: 1, 14: 11, 15: 2, 17: 1, 22: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	122371-93-1	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C(=C(S2)C=O)Cl)C#N)NC(=O)COC	{1: 3, 2: 3, 37: 1, 33: 1, 41: 1, 34: 2, 14: 3, 17: 1, 22: 1, 24: 1, 26: 1, 31: 1}
Did not match all atoms present	122376-76-5	C1=C(C=C(C=C1F)F)CC#N	{16: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	12238-13-0	CC(=O)NC1=C(C=CC(=C1)NC2=NC(=NC(=N2)N)Cl)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 34: 2, 35: 3, 14: 8, 17: 1, 20: 2, 24: 1, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	122383-34-0	C1CC(=O)N2[C@@H]1OC[C@@H]2C3=CC=CC=C3	{33: 1, 11: 3, 12: 2, 14: 5, 23: 1, 25: 1}
Did not match all atoms present	12239-53-1	C1=CC=C(C(=C1)C(=O)[O-])N=NC2=C(C=C3C=C(C=CC3=C2[O-])NC(=O)NC4=CC5=CC(=C(C(=C5C=C4)[O-])N=NC6=C(C=CC(=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{24: 2, 34: 4, 29: 9, 14: 15, 31: 2}
Did not match all atoms present	1224-64-2	CCCCP(=O)(CCCC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 6, 38: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	12240-42-5	[CH-]1C=CC=C1.[Ti](Br)(Br)Br	{18: 3, 14: 5}
Did not match all atoms present	12241-41-7	CNC1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]	{1: 1, 29: 3, 14: 5, 31: 1}
Did not match all atoms present	12243-39-9	C[C-]1[C-]([C-]([C-]([C-]([C-]1C)C)C)C)C.CC1=C(C(=C(C(=C1C)C)C)C)C.[Cr]	{1: 12, 15: 6}
Did not match all atoms present	12243-46-8	CC\1(C2=CC=CC=C2N(/C1=C\C3=C(/C(=C\C4=[N+](C5=CC=CC=C5C4(C)C)C)/C3=O)[O-])C)C	{1: 6, 6: 2, 33: 2, 13: 2, 14: 8, 15: 5, 25: 1}
Did not match all atoms present	122431-37-2	CN1C(=O)C=C(N1)C(F)(F)F	{32: 1, 1: 1, 4: 1, 33: 1, 14: 1, 16: 3, 25: 1}
Did not match all atoms present	12244-16-5	O.O.O.O.O[Si](O)(O)O[Si](O)(O)O.[Al].[Al]	{20: 6, 22: 1}
Did not match all atoms present	12244-51-8	C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.O.O.O.O.O.O.O.[Ni].[Ni].[Ni].[Ni+2].[Ni+2]	{24: 2}
Did not match all atoms present	12244-57-4	C(C(C(=O)[O-])[S-])C(=O)[O-].[Na+].[Na+].[Au+]	{24: 2, 2: 1, 3: 1}
Did not match all atoms present	122453-73-0	CCOCN1C(=C(C(=C1C(F)(F)F)Br)C#N)C2=CC=C(C=C2)Cl	{1: 1, 2: 2, 4: 1, 37: 1, 33: 1, 14: 4, 16: 3, 17: 1, 18: 1, 22: 1}
Did not match all atoms present	12247-12-0	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Ca+2]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	12249-52-4	[H+].[F-].[Ag+]	{16: 1}
Did not match all atoms present	12249-63-7	S=[Ag]	{}
Did not match all atoms present	1225-15-6	C1=CC(=C2C(=C1O)C(=O)C3=CC(=C(C=C3C2=O)Cl)Cl)O	{17: 2, 21: 2, 14: 4, 25: 2}
Did not match all atoms present	1225-20-3	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)[O-])I)C(=O)NC)I.[Na+]	{24: 3, 1: 2, 19: 3, 31: 2}
Did not match all atoms present	1225-56-5	CNCC/C=C/1\C2=CC=CC=C2COC3=CC=CC=C31	{1: 1, 2: 2, 6: 1, 11: 1, 14: 8, 15: 1, 23: 1, 31: 1}
Did not match all atoms present	1225-60-1	CC(CN1C2=CC=CC=C2SC3=C1N=CC=C3)N(C)C.Cl	{1: 3, 2: 1, 3: 1, 33: 2, 41: 1, 14: 7, 17: 1, 35: 1}
Did not match all atoms present	1225-64-5	CNCCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl	{1: 1, 2: 3, 33: 1, 41: 1, 14: 7, 17: 1, 31: 1}
Did not match all atoms present	1225-65-6	CN(C)CCCN1C2=CC=CC=C2SC3=C1N=CC=C3.Cl	{1: 2, 2: 3, 35: 1, 33: 2, 41: 1, 14: 7, 17: 1}
Did not match all atoms present	12250-38-3	[AlH3].[Au]	{}
Did not match all atoms present	12250-39-4	[AlH3].[Au].[Au]	{}
Did not match all atoms present	12250-93-0	[O-2].[O-2].[Al+3].[Cu+]	{}
Did not match all atoms present	12251-27-3	O[Si](O)(O)O.[Na].[Al]	{20: 4}
Did not match all atoms present	12251-90-0	[AlH2+].[SH-]	{}
Did not match all atoms present	12252-33-4	[O-2].[O-2].[O-][Si]([O-])([O-])[O-].[Al+3].[Al+3].[Ca+2]	{29: 4}
Did not match all atoms present	12252-63-0	O1[Al]O[Al]1	{23: 2}
Did not match all atoms present	12252-79-8	[O-2].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3]	{29: 8}
Did not match all atoms present	12252-83-4	[Al].[Al].[Tm]	{}
Did not match all atoms present	122539-74-6	CCOC(=O)C1=C(CCC1)OS(=O)(=O)C(F)(F)F	{1: 1, 2: 1, 4: 1, 11: 3, 15: 2, 16: 3, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	12254-85-2	[Cr]#[As]	{}
Did not match all atoms present	12255-04-8	[As]#[La]	{}
Did not match all atoms present	12255-08-2	[As]#[Nb]	{}
Did not match all atoms present	12255-09-3	[As]#[Nd]	{}
Did not match all atoms present	12256-41-6	[GeH4].[Au]	{}
Did not match all atoms present	12256-54-1	[Sn].[Sn].[Au]	{}
Did not match all atoms present	12258-16-1	[Ag+1].[OH-].[OH-]	{}
Did not match all atoms present	12258-53-6	B(=O)O[B-](=O)O[B-](=O)OB=O	{29: 4, 22: 3}
Did not match all atoms present	12258-89-8	O.O.[Ce].[Ce]	{}
Did not match all atoms present	12258-95-6	[Cl-].[Cl-].[Cs+].[Cs+]	{17: 2}
Did not match all atoms present	12258-97-8	[Cl-].[Cl-].[K+].[K+]	{17: 2}
Did not match all atoms present	12258-98-9	[Na+].[Na+].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	122587-20-6	CC(=O)C1=C(C(=C(O1)[N+](=O)[O-])Cl)Cl	{24: 1, 1: 1, 23: 1, 38: 1, 17: 2}
Did not match all atoms present	122587-23-9	COC(=O)C1=C(C(=C(O1)[N+](=O)[O-])Cl)Cl	{1: 1, 23: 1, 28: 1, 38: 1, 17: 2}
Did not match all atoms present	12259-19-7	F[Gd]F	{16: 2}
Did not match all atoms present	12259-36-8	O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[SiH4].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W]	{}
Did not match all atoms present	12259-92-6	[NH4+].[NH4+].[S-]S[S-]	{40: 1}
Did not match all atoms present	1226-26-2	C1C(OC(=O)N1C2=CC=CC=C2)COC3=CC=CC=C3	{33: 1, 2: 1, 11: 1, 12: 1, 14: 10, 22: 1, 28: 1}
Did not match all atoms present	1226-42-2	COC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)OC	{24: 2, 1: 2, 22: 2, 14: 8}
Did not match all atoms present	1226-43-3	CN(C(=O)C1=CC=CC=C1)N(C)C(=O)C2=CC=CC=C2	{24: 2, 1: 2, 14: 10, 33: 2}
Did not match all atoms present	1226-46-6	CN(C)C1=CC=C(C=C1)C(=S)C2=CC=C(C=C2)N(C)C	{1: 4, 33: 2, 14: 8, 7: 1}
Did not match all atoms present	1226-91-1	CC(CC(=O)C1=CC=CC=C1)CC(=O)C2=CC=CC=C2	{24: 2, 1: 1, 2: 2, 3: 1, 14: 10}
Did not match all atoms present	12260-55-8	[Ge](=[Te])=[Te]	{}
Did not match all atoms present	12261-99-3	C1CCC(=O)C(C1)CC2=CC3=C(C=C2)OCO3	{2: 1, 11: 5, 12: 1, 14: 3, 23: 2, 25: 1}
Did not match all atoms present	12262-90-7	[Ca].[Ca].[Pb]	{}
Did not match all atoms present	12262-91-8	[Mg].[Ce]	{}
Did not match all atoms present	122625-13-2	CCCCCN\1C2=CC=CC=C2C(/C1=C\C=C\C=C\C3=[N+](C4=CC=CC=C4C3(C)C)CCCCC)(C)C.[Br-]	{1: 6, 2: 8, 6: 5, 33: 2, 13: 2, 14: 8, 15: 2, 18: 1}
Did not match all atoms present	122630-55-1	COC(=O)CCN(CCC(=O)OC)C1=CC(=O)/C(=N/NC2=C(C=C(C=C2C#N)Br)C#N)/C=C1	{1: 2, 2: 4, 37: 2, 33: 1, 34: 1, 14: 5, 15: 2, 18: 1, 25: 1, 28: 2, 31: 1}
Did not match all atoms present	122647-32-9	CCCCCCCN(CC)CCCC(C1=CC=C(C=C1)NS(=O)(=O)C)O.CCCCCCCN(CC)CCCC(C1=CC=C(C=C1)NS(=O)(=O)C)O.C(=CC(=O)O)C(=O)O	{1: 6, 2: 20, 3: 2, 6: 2, 33: 2, 14: 8, 20: 2, 27: 2, 29: 4, 31: 2}
Did not match all atoms present	12265-05-3	[Al].[Al].[Yb]	{}
Did not match all atoms present	12265-14-4	PCl	{17: 1}
Did not match all atoms present	12265-61-1	[Cl-].[Cl-].[Rb+].[Rb+]	{17: 2}
Did not match all atoms present	12265-93-9	[Na+].[Ge]	{}
Did not match all atoms present	12266-38-5	[Sb]#[Pb]	{}
Did not match all atoms present	12266-72-7	C1/C=C\CC/C=C\C1.[I-].[I-].[Pt+2]	{19: 2, 11: 4, 14: 4}
Did not match all atoms present	12266-92-1	[CH3-].[CH3-].C1/C=C\CC/C=C\C1.[Pt+2]	{11: 4, 14: 4}
Did not match all atoms present	12267-60-6	[Al].[Al].[Lu]	{}
Did not match all atoms present	12269-78-2	O[Si](=O)[O-].[O-][Si](=O)[O-].[Al+3]	{20: 1, 29: 5}
Did not match all atoms present	122694-42-2	CC(=O)N(C=CC=C(C#N)C#N)C1=CC=CC=C1	{1: 1, 37: 2, 6: 3, 33: 1, 7: 1, 14: 5, 24: 1}
Did not match all atoms present	1227-44-7	COC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)OC	{24: 1, 1: 2, 22: 2, 14: 8, 31: 2}
Did not match all atoms present	1227-61-8	CCN(CC)CCNC(=O)COC1=CC=C(C=C1)OC.Cl	{1: 3, 2: 5, 33: 1, 14: 4, 17: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	12271-71-5	[O-][As](=O)([O-])[O-].[F-].[Zn+2].[Zn+2]	{16: 1, 29: 4}
Did not match all atoms present	12271-72-6	[Ge]#[As]	{}
Did not match all atoms present	12275-13-7	C(CNC(=S)[S-])NC(=S)[S-].[Ni+2]	{2: 2, 31: 2, 7: 2}
Did not match all atoms present	12279-09-3	C1CC/C=C\CCC1.C1CC/C=C\CCC1.C1CC/C=C\CCC1.C1CC/C=C\CCC1.[Cl-].[Cl-].[Rh].[Rh]	{17: 2, 11: 24, 14: 8}
Did not match all atoms present	12279-90-2	S1[As]2S[As]3[As]1S[As]2S3	{41: 4}
Did not match all atoms present	122795-43-1	CNC(=O)CN(CCN(CCN(CC(=O)NC)CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O.[Gd+3]	{24: 5, 1: 2, 2: 9, 33: 3, 31: 2}
Did not match all atoms present	1228-53-1	C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 29: 2, 14: 8}
Did not match all atoms present	1228-73-5	CC12CCC3C(C1CC(=O)C2=O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 5, 12: 3, 13: 1, 14: 3, 21: 1, 25: 2}
Did not match all atoms present	12280-13-6	[Cl-].[Br-].[Cs+].[Cs+]	{17: 1, 18: 1}
Did not match all atoms present	12281-29-7	O=[Tm]	{29: 1}
Did not match all atoms present	12285-55-1	[I-].[I-].[Cs+].[Cs+]	{19: 2}
Did not match all atoms present	12285-90-4	O.O.O.O.O.O.[K+].[K+].[Pt]	{}
Did not match all atoms present	12285-99-3	[K+].[K+].[I-].[I-]	{19: 2}
Did not match all atoms present	12286-07-6	[O-]P(=O)([O-])[O-].[La+3]	{29: 4}
Did not match all atoms present	12286-33-8	[P-3].[P-3].[P-3].[Sn+2].[Sn+2].[Sn+2].[Sn+2]	{}
Did not match all atoms present	12287-95-5	[CH-]1[CH-][CH-][CH-][CH-]1.C1=C[C-](C(=C1)Cl)Cl.[Fe]	{17: 2, 14: 8}
Did not match all atoms present	122891-84-3	CCCCCCCCCCCC[N+](C)(C)CC(C[N+](C)(C)CCCCCCCCCCCC)O.[Cl-].[Cl-]	{1: 6, 2: 24, 3: 1, 20: 1, 17: 2}
Did not match all atoms present	1229-29-4	CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31.Cl	{1: 2, 2: 2, 6: 1, 33: 1, 11: 1, 14: 8, 15: 1, 17: 1, 23: 1}
Did not match all atoms present	1229-35-2	CN1CCC(C1)CN2C3=CC=CC=C3SC4=CC=CC=C42.Cl	{1: 1, 2: 1, 33: 2, 41: 1, 11: 3, 12: 1, 14: 8, 17: 1}
Did not match all atoms present	1229-55-6	COC1=CC=CC=C1NN=C2C(=O)C=CC3=CC=CC=C32	{1: 1, 34: 1, 14: 10, 15: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	12291-11-1	CCCC[Sn](CCCC)CCCC.CCCC[Sn](CCCC)CCCC.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Fe+2]	{1: 6, 2: 18, 14: 10}
Did not match all atoms present	12292-07-8	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Cd+2].[Cd+2].[Ta+5].[Ta+5]	{}
Did not match all atoms present	12292-14-7	[Pd].[Ce]	{}
Did not match all atoms present	122924-58-7	COC1=CC(=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC4=NC(=O)N=C(N4)NC5=CC(=C(C=C5)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[K+]	{32: 1, 1: 1, 34: 1, 35: 2, 14: 10, 15: 2, 17: 1, 22: 1, 25: 2, 29: 9, 31: 3}
Did not match all atoms present	122931-48-0	CCS(=O)(=O)C1=C(N=CC=C1)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC	{1: 3, 2: 1, 35: 3, 14: 4, 22: 2, 24: 1, 29: 4, 31: 2}
Did not match all atoms present	12294-01-8	P#[Y]	{}
Did not match all atoms present	12294-12-1	[Se].[Se].[SbH].[SbH]	{}
Did not match all atoms present	12297-65-3	[Co].[Sn]	{}
Did not match all atoms present	12297-72-2	[I-].[I-].[I-].[Cs+].[Cs+].[Cs+]	{19: 3}
Did not match all atoms present	122970-62-1	B(O)(O)O.CCCCCCCC/C=C/CCCCCCCCO[P+](=O)OCCCCCCCC/C=C/CCCCCCCC.CC(O)CNCC(O)C	{1: 4, 2: 32, 3: 2, 6: 4, 20: 5, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	12298-32-7	[NH4+].I[I-]I	{19: 3}
Did not match all atoms present	12298-43-0	O.O[Si](O)(O)O[Si](O)(O)O.[Al].[Al]	{20: 6, 22: 1}
Did not match all atoms present	12298-68-9	[K+].I[I-]I	{19: 3}
Did not match all atoms present	12298-97-4	[O].[Zr+2]	{}
Did not match all atoms present	12299-51-3	[V](=[Se])=[Se]	{}
Did not match all atoms present	12299-69-3	[Fe+3].[OH-]	{}
Did not match all atoms present	12299-76-2	[H].[O-].[O].[Pb]	{}
Did not match all atoms present	12299-98-8	[Mn](=[Se])=[Se]	{}
Did not match all atoms present	123-01-3	CCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 11, 14: 5}
Did not match all atoms present	123-02-4	CCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 12, 14: 5}
Did not match all atoms present	123-07-9	CCC1=CC=C(C=C1)O	{1: 1, 2: 1, 21: 1, 14: 4}
Did not match all atoms present	123-08-0	C1=CC(=CC=C1C=O)O	{26: 1, 21: 1, 14: 4}
Did not match all atoms present	123-09-1	CSC1=CC=C(C=C1)Cl	{40: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	123-11-5	COC1=CC=C(C=C1)C=O	{1: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	123-22-8	CCOP(O)OCC	{1: 2, 2: 2, 20: 1, 22: 2}
Did not match all atoms present	123-30-8	C1=CC(=CC=C1N)O	{30: 1, 21: 1, 14: 4}
Did not match all atoms present	123-31-9	C1=CC(=CC=C1O)O	{21: 2, 14: 4}
Did not match all atoms present	123-32-0	CC1=CN=C(C=N1)C	{1: 2, 35: 2, 14: 2}
Did not match all atoms present	123-41-1	C[N+](C)(C)CCO.[OH-]	{1: 3, 2: 2, 20: 1}
Did not match all atoms present	123-43-3	C(C(=O)O)S(=O)(=O)O	{2: 1, 27: 1, 20: 1, 29: 2}
Did not match all atoms present	123-45-5	C(C(=O)O)S(=O)(=O)CC(=O)O	{2: 2, 27: 2, 29: 2}
Did not match all atoms present	123-46-6	C[N+](C)(C)CC(=O)NN.[Cl-]	{1: 3, 2: 1, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	123-61-5	C1=CC(=CC(=C1)N=C=O)N=C=O	{8: 2, 34: 2, 29: 2, 14: 4}
Did not match all atoms present	1230-14-4	C1=CC=C(C=C1)C2=NC3=C(C(=N2)N)N=C(C(=N3)N)C(=O)N	{24: 1, 35: 4, 30: 3, 14: 5}
Did not match all atoms present	1230-33-7	COC1=NN=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)N)OC	{1: 2, 35: 2, 14: 5, 22: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	1230-51-9	C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3	{29: 2, 14: 14}
Did not match all atoms present	12301-65-4	[Ne].[Ar]	{}
Did not match all atoms present	123051-21-8	[B-](CCCC)(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.CCCCCCCN\1C2=CC=CC=C2C(/C1=C/C=C/C=C/C3=[N+](C4=CC=CC=C4C3(C)C)CCCCCCC)(C)C	{1: 7, 2: 15, 6: 5, 33: 2, 13: 2, 14: 23, 15: 2}
Did not match all atoms present	12306-28-4	Cl[Sn]Cl	{17: 2}
Did not match all atoms present	12307-40-3	[B-](F)(F)(F)F.CC1=CC=C(CC1)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]	{1: 2, 11: 2, 14: 2, 15: 2, 16: 4, 22: 1, 29: 3}
Did not match all atoms present	123116-01-8	CCSC1=C(C=CC=N1)C(=O)Cl	{1: 1, 2: 1, 35: 1, 40: 1, 14: 3, 17: 1, 24: 1}
Did not match all atoms present	12312-87-7	[NH-]CC[N-]CC[N-]CC[NH-].[NH-]CC[N-]CC[N-]CC[NH-].[NH-]CC[N-]CC[N-]CC[NH-].[Ni+8].[Ni+8]	{2: 18, 36: 6, 34: 6}
Did not match all atoms present	12313-86-9	Br[Hg+]	{18: 1}
Did not match all atoms present	12314-42-0	[O-2].[O-2].[Na+].[Cr+3]	{}
Did not match all atoms present	12317-46-3	C1C2C=CC1C=C2.Cl[Pd]Cl	{17: 2, 11: 1, 12: 2, 14: 4}
Did not match all atoms present	1232-88-8	CC12CCC3C(C1CCC(=O)C2)CCC4=C3C=CC(=C4)OC	{1: 2, 11: 7, 12: 3, 13: 1, 14: 3, 22: 1, 25: 1}
Did not match all atoms present	1232-90-2	CC12CCC3=C(C1CCC(=O)C2)C=CC4=C3C=CC(=C4)OC	{1: 2, 11: 5, 12: 1, 13: 1, 14: 5, 22: 1, 25: 1}
Did not match all atoms present	12323-03-4	[O-2].[O-2].[O-2].[O-2].[Na+].[Nb+5].[Ba+2]	{}
Did not match all atoms present	12323-19-2	[Sb].[Sb].[Bi].[Bi]	{}
Did not match all atoms present	12323-20-5	[Sb].[Sb].[Sb].[Bi]	{}
Did not match all atoms present	12323-26-1	[Sb].[Bi].[Bi].[Bi]	{}
Did not match all atoms present	12323-66-9	[Am+2].[O].[O]	{}
Did not match all atoms present	12323-82-9	O.[Co]	{}
Did not match all atoms present	12324-56-0	F[Sn]F	{16: 2}
Did not match all atoms present	12325-02-9	[Hg+2].[OH-]	{}
Did not match all atoms present	123256-08-6	C1=CC=C(C=C1)OC(=O)OC2=CC=CC=C2.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCCO)CCO	{2: 7, 8: 2, 34: 2, 14: 18, 20: 2, 29: 2}
Did not match all atoms present	12328-03-9	CC[S+](CC)CC.[I-].[I-].[I-].[I-].[I-].[Hg+2].[Hg+2]	{1: 3, 2: 3, 19: 5}
Did not match all atoms present	123298-15-7	CNC(=O)OCC1=C(N(C(=N1)SC)C)COC(=O)NC.Cl	{1: 4, 2: 2, 35: 1, 33: 1, 40: 1, 17: 1, 28: 2, 31: 2}
Did not match all atoms present	123298-28-2	CC1=C(C(=CC=C1)C)N([C@@H](C)C(=O)OC)OC	{1: 5, 3: 1, 33: 1, 14: 3, 22: 1, 28: 1}
Did not match all atoms present	1233-73-4	COC(=O)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OC	{24: 1, 1: 2, 28: 2, 14: 8}
Did not match all atoms present	1233-89-2	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)N(CCCl)CCCl	{17: 2, 2: 4, 28: 1, 14: 9, 33: 1}
Did not match all atoms present	123312-89-0	CC1=NNC(=O)N(C1)/N=C/C2=CN=CC=C2	{32: 1, 1: 1, 34: 1, 35: 2, 6: 1, 33: 1, 11: 1, 14: 4, 15: 1, 25: 1}
Did not match all atoms present	123318-82-1	C1=NC2=C(N1[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)F)N=C(N=C2N)Cl	{33: 1, 2: 1, 35: 3, 12: 4, 14: 1, 16: 1, 17: 1, 20: 2, 23: 1, 30: 1}
Did not match all atoms present	12332-08-0	F[Ge](=[Ge](F)F)F	{16: 4}
Did not match all atoms present	12333-35-6	[In].[Sb].[Sb]	{}
Did not match all atoms present	12333-39-0	[K].[Rb]	{}
Did not match all atoms present	12333-49-2	[Li].[Na]	{}
Did not match all atoms present	12333-57-2	N#[Sb]	{}
Did not match all atoms present	12333-61-8	[Na].[Rb]	{}
Did not match all atoms present	12333-74-3	S=[Nb]	{}
Did not match all atoms present	123333-53-9	C1=CC=C2C(=C1)N=NN2O.O	{33: 1, 35: 2, 21: 1, 14: 4}
Did not match all atoms present	123333-55-1	C1=CN=CC=C1C2=CC=NC=C2.O	{35: 2, 14: 8}
Did not match all atoms present	123333-56-2	COC1=C(C=C(C=C1)N)N.O.OS(=O)(=O)O	{1: 1, 14: 3, 20: 2, 22: 1, 29: 2, 30: 2}
Did not match all atoms present	123333-74-4	CO/N=C(/C1=CSC(=N1)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)\C(=O)[O-]	{1: 1, 34: 1, 35: 1, 4: 1, 7: 1, 41: 1, 14: 16, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	123333-80-2	[13CH3][13C](=O)[O-].[Na+]	{24: 1, 1: 1}
Did not match all atoms present	123334-26-9	C(=C(/O)\C(F)(F)F)\C(=O)C(F)(F)F.C(=C(/O)\C(F)(F)F)\C(=O)C(F)(F)F.O.O.O.[Mn]	{4: 4, 6: 2, 7: 2, 16: 12, 20: 2, 24: 2}
Did not match all atoms present	123334-27-0	B(F)(F)F.CC(C)(C)OC	{16: 3, 1: 4, 4: 1, 22: 1}
Did not match all atoms present	123358-53-2	C1=CC=C2C(=C1)C3=C4C(=C2CCl)C=CC5=CC=CC(=C54)C=C3	{17: 1, 2: 1, 14: 11}
Did not match all atoms present	12336-95-7	[OH-].[O-]S(=O)(=O)[O-].[Cr+3]	{29: 4}
Did not match all atoms present	12338-02-2	[Li].[Li].[Li].[Bi]	{}
Did not match all atoms present	12339-07-0	[O-2].[O-2].[O-2].[S-2].[S-2].[S-2].[Gd+3].[Gd+3].[Gd+3].[Gd+3]	{}
Did not match all atoms present	12339-10-5	[GeH4].[GeH4].[U]	{}
Did not match all atoms present	12339-13-8	[H-].[H-].[Li+].[Li+]	{}
Did not match all atoms present	12339-47-8	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[V].[V].[V].[V].[V].[V].[Fe+3].[Fe+3].[Fe+3].[Fe+3]	{}
Did not match all atoms present	12339-78-5	O.[Lu].[Lu]	{}
Did not match all atoms present	1234-35-1	C1=CC=C(C=C1)COC(=O)N[C@@H](CCCN=C(N)N)C(=O)O	{2: 4, 3: 1, 7: 1, 34: 1, 14: 5, 27: 1, 28: 1, 30: 2, 31: 1}
Did not match all atoms present	12344-68-2	[S-2].[S-2].[S-2].[S-2].[As+3].[As+3]	{}
Did not match all atoms present	12345-15-2	[Sb].[Sb].[Ba].[Ba].[Ba]	{}
Did not match all atoms present	12345-57-2	[Li+].[Li+].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	123454-39-7	[Fe].[O-].[O].[O].[O]	{}
Did not match all atoms present	12349-12-1	CC(C)O[Al](C(C(=O)C)C(=O)C)OC(C)C	{24: 2, 1: 6, 3: 3, 22: 2}
Did not match all atoms present	123497-99-4	CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@@H]([C@@](C31)([C@]5(C[C@@H]([C@H]6C[C@@H]4[C@@H]5C6=O)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7N8C(=O)C[C@@H](C8=O)C	{1: 5, 2: 2, 33: 2, 11: 6, 12: 9, 13: 4, 14: 4, 20: 2, 22: 3, 25: 3, 28: 1}
Did not match all atoms present	1235-18-3	C[Sn](C)C.C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 14: 15}
Did not match all atoms present	1235-21-8	CC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{24: 1, 1: 1, 2: 1, 14: 15, 17: 1}
Did not match all atoms present	1235-74-1	CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)C(=O)OC)C	{1: 5, 3: 1, 11: 5, 12: 1, 13: 2, 14: 3, 28: 1}
Did not match all atoms present	1235-82-1	C1CCN(CC1)CCC(C2CC3CC2C=C3)(C4=CC=CC=C4)O.Cl	{33: 1, 2: 2, 4: 1, 11: 7, 12: 3, 14: 7, 17: 1, 20: 1}
Did not match all atoms present	123505-69-1	[Fe-].[O-].[O].[O].[O]	{}
Did not match all atoms present	12351-33-6	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Na+].[Na+].[Zr+4].[Zr+4]	{29: 15}
Did not match all atoms present	12351-95-0	[CH+]=S	{}
Did not match all atoms present	123533-90-4	CN1C(=CN=C1C=C2C=CC(=O)O2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 6: 1, 33: 1, 14: 3, 15: 1, 28: 1}
Did not match all atoms present	12354-84-6	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3].[Ir+3]	{1: 10, 17: 4}
Did not match all atoms present	12354-85-7	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Rh+3].[Rh+3]	{1: 10, 17: 4}
Did not match all atoms present	123557-86-8	CC1(N=C(C=[N+]1[O-])C2=CC=CC=C2)C	{1: 2, 35: 1, 33: 1, 13: 1, 14: 6, 15: 1, 29: 1}
Did not match all atoms present	12357-13-0	[Ni].[Cu]	{}
Did not match all atoms present	12357-67-4	[OH-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{29: 16}
Did not match all atoms present	123577-48-0	C1CCC2=C(C1)C3=CC4=C(C=C3O2)OC(=O)C=C4CO	{2: 1, 11: 4, 14: 3, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	123577-49-1	C1=CC=C2C(=C1)C3=CC4=C(C=C3O2)OC(=O)C=C4CO	{28: 1, 2: 1, 20: 1, 14: 7, 23: 1}
Did not match all atoms present	123577-99-1	CC(=O)C1=CC(=CC(=C1)F)F	{16: 2, 1: 1, 14: 3, 24: 1}
Did not match all atoms present	123590-00-1	CCCN(CCC)C1=CC(=C(C=C1)N=N[C@@H]2N[C@H]([C@H](N2CC=C)C#N)C#N)NC(=O)C	{32: 1, 1: 3, 2: 5, 5: 1, 6: 1, 33: 2, 12: 3, 34: 2, 14: 3, 24: 1, 37: 2, 31: 1}
Did not match all atoms present	123606-06-4	CSC1=NC2=NN=C(C(=O)N2N1)[N+](=O)[O-]	{32: 1, 1: 1, 35: 3, 38: 1, 33: 1, 40: 1, 25: 1}
Did not match all atoms present	12362-52-6	[Hg].[Tl]	{}
Did not match all atoms present	1237-52-1	CC(=O)N(C1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 33: 2, 11: 4, 12: 1, 14: 10, 24: 1}
Did not match all atoms present	1237-53-2	CC1=CC(=C(C=C1)C2=NC(=NC(=N2)Cl)C3=C(C=C(C=C3)C)C)C	{1: 4, 35: 3, 14: 6, 17: 1}
Did not match all atoms present	1237-69-0	C1=CC=C(C=C1)/C=C/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{34: 1, 38: 2, 14: 8, 6: 3, 31: 1}
Did not match all atoms present	1237-75-8	COC1=CC=CC=C1NC(=O)C2=C(C=C3C=CC(=CC3=C2)Br)O	{1: 1, 14: 9, 18: 1, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	12371-27-6	[O-2].[O-2].[O-2].[Cm].[Cm]	{}
Did not match all atoms present	12372-50-8	[Li].[Pb]	{}
Did not match all atoms present	12372-51-9	[Li].[Sb]	{}
Did not match all atoms present	12375-04-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Os].[Os].[Os].[Os]	{29: 12}
Did not match all atoms present	123794-07-0	CN1C(=CN=C1C=C2CCN(C2=O)CCCN(C)C)[N+](=O)[O-]	{1: 3, 2: 3, 35: 1, 38: 1, 6: 1, 33: 3, 11: 2, 14: 1, 15: 1, 25: 1}
Did not match all atoms present	123794-11-6	CCOCCN1C(=CN=C1/C=C\2/CCN(C2=O)C)[N+](=O)[O-]	{1: 2, 2: 3, 35: 1, 38: 1, 6: 1, 33: 2, 11: 2, 14: 1, 15: 1, 22: 1, 25: 1}
Did not match all atoms present	123794-12-7	CN1CC/C(=C/C2=NC=C(N2CCO)[N+](=O)[O-])/C1=O	{1: 1, 2: 2, 35: 1, 38: 1, 6: 1, 33: 2, 11: 2, 14: 1, 15: 1, 20: 1, 25: 1}
Did not match all atoms present	123794-13-8	CN1CC/C(=C/C2=NC(=CN2C)[N+](=O)[O-])/C1=O	{1: 2, 35: 1, 38: 1, 6: 1, 33: 2, 11: 2, 14: 1, 15: 1, 25: 1}
Did not match all atoms present	12380-47-1	[BH2].[Pt]	{}
Did not match all atoms present	12380-72-2	P.P.[Ba].[Ba].[Ba]	{}
Did not match all atoms present	12380-84-6	[Li+].[Li+].[Br-].[Br-]	{18: 2}
Did not match all atoms present	12385-13-6	[H]	{}
Did not match all atoms present	12389-34-3	CP(C)C.[Ag]I	{1: 3, 19: 1}
Did not match all atoms present	1239-04-9	CC1C2CC3=C(C1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)O.Br	{1: 2, 2: 2, 33: 1, 11: 3, 12: 2, 13: 1, 14: 8, 18: 1, 21: 1}
Did not match all atoms present	1239-29-8	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(CC5=NON=C5C4)C	{1: 3, 35: 2, 11: 8, 12: 4, 13: 3, 20: 1, 23: 1}
Did not match all atoms present	1239-45-8	CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[Br-]	{1: 1, 2: 1, 33: 1, 14: 11, 18: 1, 30: 2}
Did not match all atoms present	123910-26-9	CC(C)(C)OC(=O)N1CC2=C(C[C@@H]1C(=O)O)C3=CC=CC=C3N2	{32: 1, 1: 3, 4: 1, 33: 1, 11: 2, 12: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	12392-64-2	C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)[O-])[O-])[O-].[Na+].[Na+].[Cr+3]	{34: 4, 29: 6, 14: 22}
Did not match all atoms present	12394-14-8	[OH-].[OH-].[OH-].[OH-].[O-]Cl.[O-]Cl.[Ca+2].[Ca+2].[Ca+2]	{17: 2, 29: 2}
Did not match all atoms present	123941-02-6	CC1=C(C(=CC=C1)C)NC(=O)CNCCCC(=O)O	{1: 2, 2: 4, 14: 3, 24: 1, 27: 1, 31: 2}
Did not match all atoms present	123968-25-2	CCC(C)(C)C1=CC(=C(C(=C1)C(C)(C)CC)O)C(C)C2=C(C(=CC(=C2)C(C)(C)CC)C(C)(C)CC)OC(=O)C=C	{1: 13, 2: 4, 3: 1, 4: 4, 5: 1, 6: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	123973-25-1	C1=CC(=C(C(=C1)N)F)C(F)(F)F	{16: 4, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	12398-61-7	[NH4+].[NH4+].[O-2].[O-2].[O-2].[O-2].[W]	{}
Did not match all atoms present	124-03-8	CCCCCCCCCCCCCCCC[N+](C)(C)CC.[Br-]	{1: 4, 2: 16, 18: 1}
Did not match all atoms present	124-23-2	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC[N+](C)(C)C	{24: 1, 1: 5, 2: 31}
Did not match all atoms present	124-41-4	C[O-].[Na+]	{1: 1, 29: 1}
Did not match all atoms present	124-47-0	C(=O)(N)N.[N+](=O)(O)[O-]	{24: 1, 20: 1, 30: 2}
Did not match all atoms present	124-58-3	C[As](=O)(O)O	{1: 1, 20: 2, 29: 1}
Did not match all atoms present	124-63-0	CS(=O)(=O)Cl	{1: 1, 29: 2, 17: 1}
Did not match all atoms present	124-64-1	C(O)[P+](CO)(CO)CO.[Cl-]	{17: 1, 2: 4, 20: 4}
Did not match all atoms present	124-65-2	C[As](=O)(C)[O-].[Na+]	{1: 2, 29: 2}
Did not match all atoms present	124-70-9	C[Si](C=C)(Cl)Cl	{1: 1, 5: 1, 6: 1, 17: 2}
Did not match all atoms present	124-86-7	CC1(C2CCC1(C[N+](C2)(C)CCC[N+](C)(C)C)C)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]	{1: 9, 2: 3, 11: 4, 12: 1, 13: 2, 22: 2, 29: 6}
Did not match all atoms present	12400-16-7	[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[Be].[V]	{}
Did not match all atoms present	12401-03-5	[GaH2].[GaH2].[Te]	{}
Did not match all atoms present	12401-65-9	[Na+].[Na+].[I-].[I-]	{19: 2}
Did not match all atoms present	12403-82-6	C1=C(C(=C(C(=C1[N+](=O)[O-])O[Pb])[N+](=O)[O-])O[Pb])[N+](=O)[O-].O.O	{38: 3, 22: 2, 14: 1}
Did not match all atoms present	12407-86-2	CC1=CC(=CC(=C1C)C)OC(=O)NC	{1: 4, 28: 1, 14: 2, 31: 1}
Did not match all atoms present	12408-02-5	[H+]	{}
Did not match all atoms present	12408-33-2	[O-][Si]=O.[O-][Si]=O.[O-][Si]=O.[Al+3]	{29: 6}
Did not match all atoms present	124088-59-1	CCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.C1=CC(=CC(=C1)S(=O)(=O)O)[N+](=O)[O-]	{1: 3, 2: 18, 38: 1, 14: 9, 20: 1, 29: 2}
Did not match all atoms present	12409-56-2	[Br-].[Br-].[Cs+].[Cs+]	{18: 2}
Did not match all atoms present	12409-58-4	[Br-].[Br-].[Rb+].[Rb+]	{18: 2}
Did not match all atoms present	1241-94-7	CCCCC(CC)COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 2, 2: 5, 3: 1, 14: 10, 22: 3, 29: 1}
Did not match all atoms present	12411-15-3	O=[Fe]=O	{29: 2}
Did not match all atoms present	12412-19-0	O=[Mo]1(=O)O[Mo](=O)(=O)O1	{29: 4, 23: 2}
Did not match all atoms present	12412-52-1	[O-2].[O-2].[O-2].[Sb+3].[Sb+3]	{}
Did not match all atoms present	12417-99-1	[As].[Ag].[Ag].[Ag]	{}
Did not match all atoms present	124185-35-9	CC1=CC(=C(C=C1F)Cl)N	{16: 1, 1: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	12419-43-1	[F-].[F-].[F-].[F-].[F-].[F-].[Zr+4].[Sn+2]	{16: 6}
Did not match all atoms present	12421-82-8	[Y].[Bi]	{}
Did not match all atoms present	12422-12-7	[O-][V](=O)=O.[O-][V](=O)=O.[Cd+2]	{29: 6}
Did not match all atoms present	124268-99-1	C(CN(CC(=O)[O-])CC(=O)[O-])CN(CC(=O)[O-])CC(=O)[O-].[K+].[Fe+3]	{24: 4, 33: 2, 2: 7}
Did not match all atoms present	12427-38-2	C(CNC(=S)[S-])NC(=S)[S-].[Mn+2]	{2: 2, 31: 2, 7: 2}
Did not match all atoms present	12428-46-5	[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[Al].[Al].[Al].[Al]	{29: 12}
Did not match all atoms present	12428-54-5	O[Al]=O.O[Al]=O	{20: 2, 29: 2}
Did not match all atoms present	12429-33-3	[Nd].[Au]	{}
Did not match all atoms present	12429-94-6	[Be].[B].[B].[B].[B].[B].[B]	{}
Did not match all atoms present	12430-73-8	[O-2].[O-2].[O-2].[O-2].[Ti+4].[Sr+2].[Ba+2]	{}
Did not match all atoms present	12431-04-8	[Cs].[Cs].[Cs].[Bi]	{}
Did not match all atoms present	124319-53-5	CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.C(CS)C(=O)O.C(CS)C(=O)O.[Zr]	{1: 2, 2: 16, 4: 2, 5: 4, 6: 4, 39: 2, 20: 2, 22: 4, 27: 2}
Did not match all atoms present	12433-50-0	[O-2].[O-][Cr](=O)(=O)[O-].[K+].[Zn+2]	{29: 4}
Did not match all atoms present	12434-84-3	O=[Fe+]	{29: 1}
Did not match all atoms present	12435-23-3	[Na].[GaH3].[GaH3].[GaH3].[GaH3]	{}
Did not match all atoms present	12435-86-8	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[V].[V].[Sr+2].[Sr+2]	{}
Did not match all atoms present	12436-28-1	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[Na+].[Na+].[V].[V].[V].[V].[V].[V]	{}
Did not match all atoms present	12436-94-1	[NH4+].[NH4+].[NH4+].[N+](=O)([O-])[O-].[O-]S(=O)(=O)[O-]	{29: 4}
Did not match all atoms present	12439-96-2	O.O.O.O.O.[O-]S(=O)(=O)[O-].O=[V+2]	{29: 5}
Did not match all atoms present	1244-76-4	C1CN(CCN1CCOCCO)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl	{33: 2, 2: 4, 3: 1, 11: 4, 14: 9, 17: 2, 20: 1, 22: 1}
Did not match all atoms present	12440-13-0	[H+].[H+].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].O=[Zr+2]	{29: 9}
Did not match all atoms present	12442-27-2	[S-2].[S-2].[Zn+2].[Cd+2]	{}
Did not match all atoms present	124428-11-1	C1=CC=C(C=C1)C2=CC=C(C=C2)CCOC3=NC=NC4=CC=CC=C43	{2: 2, 35: 2, 22: 1, 14: 14}
Did not match all atoms present	124439-07-2	CN([C@H]1CC[C@@]2(CCCO2)C[C@@H]1N3CCCC3)C(=O)CC4=C5C=COC5=CC=C4.Cl	{1: 1, 2: 1, 33: 2, 11: 10, 12: 2, 13: 1, 14: 5, 17: 1, 23: 2, 24: 1}
Did not match all atoms present	124496-00-0	CC1=CC=CC=C1OC2=C3C=CC=C(C3=NC=C2)Cl	{1: 1, 35: 1, 22: 1, 14: 9, 17: 1}
Did not match all atoms present	124533-50-2	C1=CC=C(C=C1)C2=CSC(=N2)CCNC3=C4C=CC=C(C4=NC=C3)F	{2: 2, 35: 2, 41: 1, 14: 11, 16: 1, 31: 1}
Did not match all atoms present	124617-84-1	CCCCON(C(=O)C1=CC=CC=C1)OC(=O)C	{1: 2, 2: 3, 14: 5, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	124617-85-2	CCCCCCCCON(C(=O)C1=CC=CC=C1)OC(=O)C	{1: 2, 2: 7, 14: 5, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	124621-00-7	CC1=C(C=CC(=C1)N(C)CCOC(=O)C)N=NC2=NC3=CC(=C(C=C3S2)Cl)Cl	{1: 3, 2: 2, 35: 1, 33: 1, 41: 1, 34: 2, 14: 5, 17: 2, 28: 1}
Did not match all atoms present	124621-01-8	CC1=C(C=CC(=C1)N(C)CCOC(=O)C)N=NC2=NC3=C(S2)C(=C(C=C3)Cl)Cl	{1: 3, 2: 2, 35: 1, 33: 1, 41: 1, 34: 2, 14: 5, 17: 2, 28: 1}
Did not match all atoms present	124686-47-1	CC1(OC[C@@H]([C@@H](O1)C2=CC=CC=C2)NC)C	{1: 3, 11: 1, 12: 2, 13: 1, 14: 5, 23: 2, 31: 1}
Did not match all atoms present	124687-44-1	[Bi+3]	{}
Did not match all atoms present	1247-08-1	C1=CC=C(C=C1)C#C[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{10: 2, 14: 20}
Did not match all atoms present	124753-65-7	C1C=CC[C@@H]([C@@H]1C(=O)O)NC(=O)OCC2=CC=CC=C2	{2: 1, 11: 2, 12: 2, 14: 7, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	124773-10-0	CCC(C(=O)NC1=CC(=C(C=C1)Cl)NC2=NN(C(=O)C2)C3=C(C=C(C=C3Cl)Cl)Cl)OC4=CC=C(C=C4)C(C)(C)CC(C)(C)C	{1: 6, 2: 2, 3: 1, 4: 2, 33: 1, 11: 1, 14: 9, 15: 1, 17: 4, 35: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	1248-18-6	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])NN=C3C(=O)C=CC4=CC=CC=C43.[Na+]	{34: 1, 14: 12, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	124822-85-1	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(/C(=N\NC3=CC=C(C=C3)S(=O)(=O)CCOS(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 2: 2, 34: 1, 14: 7, 15: 2, 22: 1, 24: 1, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	124822-87-3	COC1=CC(=C(C=C1N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC)S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 2: 4, 34: 3, 14: 8, 15: 2, 22: 4, 25: 1, 29: 16, 30: 1, 31: 1}
Did not match all atoms present	124824-14-2	CN1C2=CC=CC=C2C3=C1C(=O)N(CC3)CCCN4CCN(CC4)C5=CC=CC=C5.Cl.Cl	{1: 1, 2: 3, 33: 4, 11: 6, 14: 9, 17: 2, 25: 1}
Did not match all atoms present	1249-97-4	CN(C)C1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)N(C)C)C(=O)C4=CC=CC=C4	{24: 1, 1: 4, 41: 1, 14: 11, 33: 3}
Did not match all atoms present	124931-12-0	CCOP(=O)(CC(=O)N(C)OC)OCC	{1: 4, 2: 3, 33: 1, 22: 3, 24: 1, 29: 1}
Did not match all atoms present	124993-63-1	CCCC(C)OC1=CC=C(C=C1)NN.Cl	{1: 2, 2: 2, 3: 1, 14: 4, 17: 1, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	125-02-0	CC12CC(C3C(C1CCC2(C(=O)COP(=O)([O-])[O-])O)CCC4=CC(=O)C=CC34C)O.[Na+].[Na+]	{1: 2, 2: 1, 11: 5, 12: 4, 13: 3, 14: 3, 15: 1, 20: 2, 22: 1, 24: 1, 25: 1, 29: 3}
Did not match all atoms present	125-15-5	CN1CC[C@]23[C@@H]4[C@H]5[C@@H](CC2=O)C(=CCO[C@H]5CC(=O)N4C6=C3C=CC=C6O)C1	{1: 1, 33: 2, 11: 6, 12: 4, 13: 1, 14: 4, 15: 1, 21: 1, 23: 1, 25: 2}
Did not match all atoms present	125-20-2	CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O	{1: 6, 3: 2, 13: 1, 14: 8, 21: 2, 28: 1}
Did not match all atoms present	125-24-6	CN1CCC23C4C1CC5=C2C(=C(C(=C5)C6=CC7=C8C(=C6O)OC9C81CCN(C(C7)C1C=CC9O)C)O)OC3C(C=C4)O	{1: 2, 33: 2, 11: 6, 12: 8, 13: 2, 14: 6, 20: 2, 21: 2, 23: 2}
Did not match all atoms present	125-28-0	CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(CC4)O	{1: 2, 33: 1, 11: 5, 12: 4, 13: 1, 14: 2, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	125-29-1	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3C(=O)CC4	{1: 2, 33: 1, 11: 5, 12: 3, 13: 1, 14: 2, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	125-30-4	CCOC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4C)[C@@H](O2)[C@H](C=C5)O)C=C1.Cl	{1: 2, 2: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	125-33-7	CCC1(C(=O)NCNC1=O)C2=CC=CC=C2	{32: 2, 1: 1, 2: 1, 11: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	125-44-0	CC/C=C(\C)/C1(C(=O)NC(=O)NC1=O)CC.[Na+]	{32: 2, 1: 3, 2: 2, 6: 1, 7: 1, 13: 1, 25: 3}
Did not match all atoms present	125-46-2	CC1=C(C(=C2C(=C1O)C3(C(=CC(=O)C(C3=O)C(=O)C)O2)C)C(=O)C)O	{1: 4, 12: 1, 13: 1, 14: 1, 15: 1, 21: 2, 23: 1, 24: 2, 25: 2}
Did not match all atoms present	125-51-9	CC[N+]1(CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.[Br-]	{1: 2, 2: 1, 4: 1, 11: 4, 12: 1, 14: 10, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	125-52-0	CN1CCCN=C1COC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.Cl	{1: 1, 2: 1, 35: 1, 4: 1, 33: 1, 11: 8, 12: 1, 14: 5, 15: 1, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	125-53-1	CN1CCCN=C1COC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O	{1: 1, 2: 1, 35: 1, 4: 1, 33: 1, 11: 8, 12: 1, 14: 5, 15: 1, 20: 1, 28: 1}
Did not match all atoms present	125-58-6	CCC(=O)C(C[C@@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 10, 24: 1}
Did not match all atoms present	125-60-0	C[N+]1(CCCCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[Br-]	{1: 1, 2: 2, 4: 1, 11: 5, 14: 10, 18: 1, 24: 1, 30: 1}
Did not match all atoms present	125-69-9	CN1CC[C@@]23CCCC[C@@H]2[C@@H]1CC4=C3C=C(C=C4)OC.Br	{1: 2, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 18: 1, 22: 1}
Did not match all atoms present	125-70-2	CN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)OC	{1: 2, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 22: 1}
Did not match all atoms present	125-71-3	CN1CC[C@@]23CCCC[C@@H]2[C@@H]1CC4=C3C=C(C=C4)OC	{1: 2, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 22: 1}
Did not match all atoms present	125-73-5	CN1CCC23CCCCC2C1CC4=C3C=C(C=C4)O.C(C(C(=O)O)O)(C(=O)O)O	{1: 1, 3: 2, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 20: 2, 21: 1, 27: 2}
Did not match all atoms present	125-84-8	CCC1(CCC(=O)NC1=O)C2=CC=C(C=C2)N	{32: 1, 1: 1, 2: 1, 11: 2, 13: 1, 14: 4, 25: 2, 30: 1}
Did not match all atoms present	125-85-9	CCN(CC)CCOC(=O)C1(CCCC1)C2=CC=CC=C2.Cl	{1: 2, 2: 4, 33: 1, 11: 4, 13: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	125-86-0	CCN(CC)CCOC(=O)C1(CCCC1)C2=CC=CC=C2.CCN(CC)CCOC(=O)C1(CCCC1)C2=CC=CC=C2.C(CS(=O)(=O)O)S(=O)(=O)O	{1: 4, 2: 10, 33: 2, 11: 8, 13: 2, 14: 10, 20: 2, 28: 2, 29: 4}
Did not match all atoms present	125-88-2	CC(C)C1(C(=O)NC(=O)NC1=O)CC=C.[Na+]	{32: 2, 1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 13: 1, 25: 3}
Did not match all atoms present	1250-96-0	C[C@]12CC[C@@H](C[C@H]1CCC3C2CC[C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)OC=O	{1: 2, 11: 10, 12: 5, 13: 3, 14: 1, 15: 1, 20: 1, 26: 1, 28: 1}
Did not match all atoms present	125025-91-4	COCCOC1=C(C2=C(C(=C1)NC3=CC=CC=C3)C(=O)C4=CC=CC=C4C2=O)N	{1: 1, 2: 2, 14: 10, 22: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	125025-97-0	CC1=CC=CC=C1C(C)(C2=CC(=CC=C2)C(C)(C3=CC=CC=C3C)O)O	{1: 4, 4: 2, 14: 12, 20: 2}
Did not match all atoms present	125025-98-1	CC1=CC=CC=C1C(=C)C2=CC(=CC=C2)C(=C)C3=CC=CC=C3C	{1: 2, 5: 2, 14: 12, 7: 2}
Did not match all atoms present	12505-67-8	O1[As]2O[As]3O[As]1O[As](O2)O3	{23: 6}
Did not match all atoms present	125078-62-8	CC1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)C3=CC=C(C=C3)C	{24: 2, 1: 2, 14: 12}
Did not match all atoms present	125078-63-9	C/C(=C/C(=O)NC1=CC=C(C2=CC=CC=C21)S(=O)(=O)[O-])/O.[Na+]	{1: 1, 6: 1, 7: 1, 14: 6, 20: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	12509-41-0	[P]=[Se]	{}
Did not match all atoms present	1251-85-0	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)CC3=C(N(N(C3=O)C4=CC=CC=C4)C)C	{1: 4, 2: 1, 33: 4, 14: 10, 25: 2}
Did not match all atoms present	12510-42-8	O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[O-2].[O-][Si](=O)O[Si](=O)[O-].[Na+].[Al+3].[K+].[Ca+2]	{29: 4, 22: 1}
Did not match all atoms present	125109-83-3	C[N+](CCC[Si](OC)(OC)OC)(CC=C)CC=C.[Cl-]	{1: 4, 2: 5, 5: 2, 6: 2, 17: 1, 22: 3}
Did not match all atoms present	125109-84-4	CC(CC=O)C1=CC=CC(=C1)C(=C)C	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 14: 4, 26: 1}
Did not match all atoms present	125109-85-5	CC(C)C1=CC(=CC=C1)C(C)CC=O	{1: 3, 2: 1, 3: 2, 26: 1, 14: 4}
Did not match all atoms present	125109-86-6	CC1=CC(=[S+]C(=C1)C(C)(C)C)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]	{1: 7, 4: 3, 41: 1, 14: 2, 16: 3, 29: 3}
Did not match all atoms present	12511-95-4	P12P3P1[As]23	{}
Did not match all atoms present	125116-23-6	CC1(CCC(C1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl)C	{1: 2, 2: 2, 35: 2, 33: 1, 11: 2, 12: 1, 13: 2, 14: 6, 17: 1, 20: 1}
Did not match all atoms present	12512-03-7	P12P3[As]1[As]23	{}
Did not match all atoms present	12512-11-7	P12[As]3[As]1[As]23	{}
Did not match all atoms present	12512-13-9	S1[As]2S[As]3[As]1[As]3S2	{41: 3}
Did not match all atoms present	125139-18-6	CCCCC(C(=O)NC1=CC(=O)/C(=N/C(=O)NC2=CC=C(C=C2)C#N)/C=C1NC3=C(C=C(C=C3)N(CC)CCO)C)OC4=C(C=C(C=C4)C(C)(C)CC)C(C)(C)CC	{1: 9, 2: 8, 3: 1, 4: 2, 37: 1, 33: 1, 34: 1, 14: 12, 15: 3, 20: 1, 22: 1, 24: 2, 25: 1, 31: 3}
Did not match all atoms present	125139-19-7	COC(=O)C=C.C=CC(=O)O.OS(=O)[O-].[Na+]	{1: 1, 5: 2, 6: 2, 20: 1, 27: 1, 28: 1, 29: 2}
Did not match all atoms present	12519-36-7	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Zn+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	12519-76-5	[OH-].[OH-].[OH-].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-]P(=O)([O-])[O-].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo]	{29: 4}
Did not match all atoms present	1252-18-2	C1=CC=C(C=C1)COC2=CC=C(C=C2)/C(=C\C3=CC=CC=C3F)/C4=CC=CC=C4	{2: 1, 6: 1, 7: 1, 14: 18, 16: 1, 22: 1}
Did not match all atoms present	12521-42-5	[Kr].[Xe]	{}
Did not match all atoms present	12523-60-3	B(OB(F)F)(F)F	{16: 4, 22: 1}
Did not match all atoms present	125239-87-4	[N+](=O)([O-])OO	{20: 1, 22: 1}
Did not match all atoms present	12524-56-0	[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[Bi+3].[Bi+3].[Bi+3].[Bi+3]	{29: 12}
Did not match all atoms present	125252-52-0	CCCCCCC[N+]1=C(C(C2=CC=CC=C21)(C)C)C.[Br-]	{1: 4, 2: 6, 33: 1, 13: 1, 14: 4, 15: 1, 18: 1}
Did not match all atoms present	125252-53-1	CCCCCCCCCCCCCCCCS(=O)(=O)C(C(C)C)C(=O)O	{27: 1, 1: 3, 2: 15, 3: 2, 29: 2}
Did not match all atoms present	125252-54-2	COC1=CC(=C(C=C1)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-].[Ca+2]	{1: 1, 34: 1, 14: 8, 15: 2, 22: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	125252-55-3	CO[Si](CCCNCCNC[C@H](COCCC[Si](OC)(OC)OC)O)(OC)OC	{1: 6, 2: 10, 3: 1, 20: 1, 22: 7, 31: 2}
Did not match all atoms present	125252-56-4	[Li+].[Li+].CCC(C)C[C-](C1=CC=C(C=C1)C)C2=CC(=CC=C2)[C-](CC(C)CC)C3=CC=C(C=C3)C	{1: 6, 2: 4, 3: 2, 14: 12, 7: 2}
Did not match all atoms present	125252-57-5	[Li+].C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=C(C=CC(=C3)S(=O)(=O)N)O.C1=CC2=CC(=NNC3=C(C=CC(=C3)S(=O)(=O)N)[O-])C(=O)C=C2C=C1.[Co]	{34: 2, 14: 18, 15: 2, 21: 1, 25: 2, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	125276-72-4	C1=CC=C2C(=C1)C=CC3=CC4=C(C=CC5=C4[C@@H]6[C@@H](O6)[C@H]([C@@H]5O)O)N=C32	{20: 2, 35: 1, 12: 4, 14: 9, 23: 1}
Did not match all atoms present	12528-83-5	[Fe+4].[OH-].[OH-]	{}
Did not match all atoms present	125304-01-0	CCCCC(CC)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Al+3]	{24: 2, 1: 2, 2: 4, 3: 1, 14: 5}
Did not match all atoms present	125304-07-6	C=CC(=O)N.C=O.C1(=NC(=NC(=N1)N)N)N.OO	{35: 3, 5: 2, 6: 1, 20: 2, 24: 1, 30: 4}
Did not match all atoms present	125304-12-3	CC(CN)O.C1CC(CCC1CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 1, 2: 3, 3: 1, 11: 4, 12: 2, 14: 4, 20: 3, 27: 2, 30: 1}
Did not match all atoms present	125304-17-8	CC1=CC(=C(C=C1)NC(=O)CC(=O)C)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 1, 14: 3, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	125304-18-9	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OCC.O[Si](=O)O.O[Mo](=O)(=O)[O-]	{1: 5, 2: 5, 33: 2, 14: 10, 20: 3, 23: 1, 28: 1, 29: 4}
Did not match all atoms present	125304-20-3	COC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OC)C(=O)O.COC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)OC.C1=CC(=CC=C1C(C2=CC=C(C=C2)OC3=CC=C(C=C3)N)(C(F)(F)F)C(F)(F)F)OC4=CC=C(C=C4)N	{1: 4, 4: 3, 14: 20, 16: 6, 22: 2, 27: 4, 28: 4, 30: 2}
Did not match all atoms present	125304-21-4	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=C(C=CC(=C4)Cl)O)C2=O.C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=C(C=CC(=C4)Cl)O)C2=O.[Na+].[Fe]	{34: 2, 14: 26, 15: 4, 17: 2, 21: 2, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	125316-60-1	C1C2CC3CC1CC(C2)(C3)C4=C(C=CC(=C4)C5=CC6=C(C=C5)C=C(C=C6)C(=O)O)O	{11: 6, 12: 3, 13: 1, 14: 9, 21: 1, 27: 1}
Did not match all atoms present	125317-39-7	CCC1=CC2C[C@@](C3=C(CN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{32: 1, 1: 7, 2: 2, 3: 4, 33: 3, 11: 7, 12: 4, 13: 4, 14: 9, 15: 1, 20: 5, 22: 1, 27: 4, 28: 3}
Did not match all atoms present	12532-37-5	[Rb+].[Rb+].[I-].[I-]	{19: 2}
Did not match all atoms present	125331-93-3	CCCCCCCCCCCCCCCCS(=O)(=O)C(C(C)C)C(=O)Cl	{1: 3, 2: 15, 3: 2, 17: 1, 24: 1, 29: 2}
Did not match all atoms present	12534-33-7	O1[SnH2]O[SnH2]O[SnH2]O[SnH2]1	{23: 4}
Did not match all atoms present	125369-26-8	COC(=O)CC(=O)C1=CC=C(C=C1)C(=O)OC	{24: 1, 1: 2, 2: 1, 28: 2, 14: 4}
Did not match all atoms present	12539-57-0	[C+]#N	{}
Did not match all atoms present	125408-88-0	[OH-].[O].[Sn+2]	{}
Did not match all atoms present	12543-75-8	[C]#CC#N	{10: 1, 37: 1}
Did not match all atoms present	12543-88-3	C#[C-].C#[C-].[Dy]	{9: 2}
Did not match all atoms present	125441-94-3	CC(=O)O.C[N+]1=CN(C=C1)CCC(=O)NC2=CC=C(C=C2)N=NC3=C(C=C4C=C(C=CC4=C3[O-])NC(=O)CC[N+]5=CC=CC(=C5)C(=O)N)S(=O)(=O)[O-]	{1: 2, 2: 4, 33: 3, 34: 2, 14: 15, 24: 3, 27: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	125455-66-5	CC(C)(C)C1=[O+]C(=CC=C1)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]	{1: 6, 4: 3, 14: 3, 16: 3, 23: 1, 29: 3}
Did not match all atoms present	1255-69-2	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=C(C=C(C=C3)N(C)C)C(=O)O	{27: 1, 1: 6, 3: 1, 14: 11, 33: 3}
Did not match all atoms present	12552-55-5	C.C.C.C.C.C.C.[Cr].[Cr].[Cr]	{}
Did not match all atoms present	125520-84-5	CCCCCCCCCCCCCCCC(C)C1=NCC[N+]1(CC)CCNC(=O)C(C)CCCCCCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 6, 2: 32, 3: 2, 11: 2, 15: 1, 35: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	125520-85-6	CCCCCCCN\1C2=CC=CC=C2C(/C1=C\C=C/C=C\C3=[N+](C4=CC=CC=C4C3(C)C)CCCCCCC)(C)C.[Br-]	{1: 6, 2: 12, 6: 5, 33: 2, 13: 2, 14: 8, 15: 2, 18: 1}
Did not match all atoms present	125528-33-8	C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[NH4+].[NH4+].[Fe+3]	{24: 5, 33: 3, 2: 9}
Did not match all atoms present	125529-19-3	C1=CC=C(C(=C1)N)Cl.OS(=O)(=O)O	{17: 1, 30: 1, 20: 2, 29: 2, 14: 4}
Did not match all atoms present	125542-03-2	CC1=C(C(=C(C1[Si](C)(C)Cl)C)C)C	{1: 6, 12: 1, 17: 1, 15: 4}
Did not match all atoms present	125542-04-3	CC1=C(C(=C(C1[Si](C)(C)NC(C)(C)C)C)C)C	{1: 9, 31: 1, 4: 1, 12: 1, 15: 4}
Did not match all atoms present	125542-70-3	CC(=O)O.C1=CC=C(C(=C1)C(=O)O)O	{1: 1, 27: 2, 21: 1, 14: 4}
Did not match all atoms present	12558-71-3	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Y+3]	{24: 3, 33: 2, 2: 6, 27: 1}
Did not match all atoms present	12558-92-8	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Hg+2]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	125594-05-0	CCCCCC1=CC=C(C=C1)C#CC2=C(C(=C(C(=C2C#CC3=CC=C(C=C3)CCCCC)C#CC4=CC=C(C=C4)CCCCC)C#CC5=CC=C(C=C5)CCCCC)C#CC6=CC=C(C=C6)CCCCC)C#CC7=CC=C(C=C7)CCCCC	{1: 6, 2: 24, 10: 12, 14: 24}
Did not match all atoms present	125594-06-1	CCCCCCC1=CC=C(C=C1)C#CC2=C(C(=C(C(=C2C#CC3=CC=C(C=C3)CCCCCC)C#CC4=CC=C(C=C4)CCCCCC)C#CC5=CC=C(C=C5)CCCCCC)C#CC6=CC=C(C=C6)CCCCCC)C#CC7=CC=C(C=C7)CCCCCC	{1: 6, 2: 30, 10: 12, 14: 24}
Did not match all atoms present	125594-47-0	CCOC(=O)C=C.CC(C)[O-].C=CC(=O)O.[Na+]	{1: 3, 2: 1, 3: 1, 5: 2, 6: 2, 27: 1, 28: 1, 29: 1}
Did not match all atoms present	125594-49-2	C1=CC=C(C=C1)C[N+](CCO)(CCO)C2=CC=CC=C2.[Cl-]	{17: 1, 2: 5, 20: 2, 14: 10}
Did not match all atoms present	125594-50-5	C1CC2=CC(=CC3=C2N(C1)CCC3)/C=C/4\CC/C(=C/C5=CC6=C7C(=C5)CCCN7CCC6)/C4=O	{33: 2, 6: 2, 11: 14, 14: 4, 15: 2, 25: 1}
Did not match all atoms present	125594-58-3	CCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCCCCCCCCCOC(=O)C(=C)C.C=CC1=CC=NC=C1	{1: 4, 2: 24, 35: 1, 5: 3, 6: 1, 7: 2, 14: 4, 28: 2}
Did not match all atoms present	1256-24-2	C[C@]12CC[C@@H](C[C@H]1CCC3C2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)OC=O)OC=O	{1: 2, 11: 9, 12: 6, 13: 3, 14: 1, 15: 1, 20: 1, 26: 2, 28: 1}
Did not match all atoms present	12562-64-0	C([C@@H]([C@@H]([C@H]([C@H](C(=O)O)O)O)O)O)O.C([C@@H]([C@@H]([C@H]([C@H](C(=O)O)O)O)O)O)O.[Fe]	{27: 2, 2: 2, 3: 8, 20: 10}
Did not match all atoms present	125630-94-6	CCN(CC)C1=CC(=C(C=C1)N=C[C@H]2C=C(C(=O)C(=C2C)Cl)NC(=O)OCC)C	{1: 5, 2: 3, 6: 1, 33: 1, 12: 1, 34: 1, 14: 4, 15: 3, 17: 1, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	125643-59-6	CC(C)COP(=S)(OC(C)C)S	{1: 4, 2: 1, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	1257-78-9	CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.C(CS(=O)(=O)O)S(=O)(=O)O	{1: 1, 2: 5, 33: 3, 41: 1, 11: 4, 14: 7, 17: 1, 20: 2, 29: 4}
Did not match all atoms present	125713-88-4	C1C=CC=CN1CC=CC2=CC=CC=C2	{33: 1, 2: 1, 11: 1, 14: 9, 6: 2}
Did not match all atoms present	125713-89-5	CC1=CC=C(C=C1)C([N+]2=CC=CC=C2)Br	{1: 1, 18: 1, 3: 1, 14: 9, 33: 1}
Did not match all atoms present	125713-96-4	C1C=CC=CN1CN2C3=CC=CC=C3N=N2	{33: 2, 2: 1, 11: 1, 14: 8, 35: 2}
Did not match all atoms present	125749-35-1	C1=C2C(=CC(=C1Br)Br)OC3=CC(=C(C=C3O2)Br)Br	{18: 4, 14: 4, 23: 2}
Did not match all atoms present	125830-49-1	C1=CC=C2C(=C1)C=CC(=C2N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 1, 14: 13, 15: 2, 17: 1, 22: 1, 25: 1, 29: 14, 31: 3}
Did not match all atoms present	125830-50-4	C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[K+].[K+].[K+].[K+].[K+]	{2: 2, 35: 3, 34: 1, 14: 12, 15: 2, 17: 1, 22: 1, 25: 1, 29: 17, 31: 3}
Did not match all atoms present	125844-52-2	[CH3-].[Ag+]	{}
Did not match all atoms present	12588-30-6	[Al+].[O]	{}
Did not match all atoms present	125881-35-8	C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC4=C(C=C3)C(=O)OC4=O)OC5=CC6=C(C=C5)C(=O)OC6=O.C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N	{30: 2, 28: 6, 22: 2, 14: 26, 29: 2}
Did not match all atoms present	12589-02-5	B[SiH3]	{}
Did not match all atoms present	12589-81-0	[Sr].[Bi].[Bi].[Bi]	{}
Did not match all atoms present	1259-35-4	C1(=C(C(=C(C(=C1F)F)P(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F)F)F)F	{16: 15}
Did not match all atoms present	125904-18-9	CCCCOC1=CC(=C(C=C1C(C)(C)C)OCCCC)C(C)(C)C	{1: 8, 2: 6, 4: 2, 22: 2, 14: 2}
Did not match all atoms present	12591-02-5	O=P(=O)Cl	{17: 1, 29: 2}
Did not match all atoms present	12592-31-3	F[La](F)F	{16: 3}
Did not match all atoms present	12595-63-0	[BiH].[BiH].[BiH]	{}
Did not match all atoms present	12595-65-2	[Bi].[Bi].[Bi].[Bi]	{}
Did not match all atoms present	12595-88-9	[Ce]#[Ce]	{}
Did not match all atoms present	12596-26-8	[Hg+].[Hg+]	{}
Did not match all atoms present	12597-03-4	S=S=S	{40: 1}
Did not match all atoms present	12597-04-5	[O-][Ta](=O)=O.[Rb+]	{29: 3}
Did not match all atoms present	12597-05-6	[S-]S[S-]	{40: 1}
Did not match all atoms present	12597-17-0	[Sb].[Sb].[Sb].[Sb]	{}
Did not match all atoms present	12597-28-3	[Se]1[Se][Se][Se][Se]1	{}
Did not match all atoms present	12597-30-7	[Se]1[Se][Se][Se][Se][Se]1	{}
Did not match all atoms present	12597-32-9	[Se]1[Se][Se][Se][Se][Se][Se]1	{}
Did not match all atoms present	12597-33-0	[Se]1[Se][Se][Se][Se][Se][Se][Se]1	{}
Did not match all atoms present	12597-49-8	[Te]1[Te][Te][Te]1	{}
Did not match all atoms present	12598-14-0	[AlH2].[AlH2].[Se]	{}
Did not match all atoms present	12598-16-2	[AlH2].[AlH2].[Te]	{}
Did not match all atoms present	12599-83-6	[Ni].[Ni].[GeH4]	{}
Did not match all atoms present	125997-20-8	CC(C)(COP(=O)(OCCCl)OCCBr)CBr	{1: 2, 2: 6, 4: 1, 17: 1, 18: 2, 22: 3, 29: 1}
Did not match all atoms present	126-00-1	CC(CCC(=O)O)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 1, 2: 2, 4: 1, 14: 8, 21: 2, 27: 1}
Did not match all atoms present	126-02-3	C1CCN(CC1)CCC(C2CCCC2)(C3=CC=CC=C3)O.Cl	{33: 1, 2: 2, 4: 1, 11: 9, 12: 1, 14: 5, 17: 1, 20: 1}
Did not match all atoms present	126-04-5	CC(CN(C)C)C(C1=CC=CC=C1)C(C2=CC=CC=C2)O	{1: 3, 2: 1, 3: 3, 33: 1, 14: 10, 20: 1}
Did not match all atoms present	126-07-8	C[C@@H]1CC(=O)C=C([C@]12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)OC	{1: 4, 11: 1, 12: 1, 13: 1, 14: 2, 15: 1, 17: 1, 22: 3, 23: 1, 25: 2}
Did not match all atoms present	126-22-7	CCCC(=O)OC(C(Cl)(Cl)Cl)P(=O)(OC)OC	{1: 3, 2: 2, 3: 1, 4: 1, 17: 3, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	126-27-2	CC(C)(CC1=CC=CC=C1)N(C)C(=O)CN(CCO)CC(=O)N(C)C(C)(C)CC2=CC=CC=C2	{1: 6, 2: 6, 4: 2, 33: 3, 14: 10, 20: 1, 24: 2}
Did not match all atoms present	126-31-8	C(S(=O)(=O)[O-])I.[Na+]	{2: 1, 19: 1, 29: 3}
Did not match all atoms present	126-33-0	C1CCS(=O)(=O)C1	{11: 4, 29: 2}
Did not match all atoms present	126-45-4	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ag+].[Ag+].[Ag+]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	126-63-6	CCCCC(CC)COP(=O)(CC(CC)CCCC)OCC(CC)CCCC	{1: 6, 2: 15, 3: 3, 29: 1, 22: 2}
Did not match all atoms present	126-64-7	CC(=CCCC(C)(C=C)OC(=O)C1=CC=CC=C1)C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 2, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	126-68-1	CCOP(=S)(OCC)OCC	{1: 3, 2: 3, 22: 3}
Did not match all atoms present	126-71-6	CC(C)COP(=O)(OCC(C)C)OCC(C)C	{1: 6, 2: 3, 3: 3, 29: 1, 22: 3}
Did not match all atoms present	126-72-7	C(C(CBr)Br)OP(=O)(OCC(CBr)Br)OCC(CBr)Br	{2: 6, 3: 3, 18: 6, 22: 3, 29: 1}
Did not match all atoms present	126-73-8	CCCCOP(=O)(OCCCC)OCCCC	{1: 3, 2: 9, 29: 1, 22: 3}
Did not match all atoms present	126-75-0	CCOP(=O)(OCC)SCCSCC	{40: 2, 1: 3, 2: 5, 29: 1, 22: 2}
Did not match all atoms present	126-80-7	C[Si](C)(CCCOCC1CO1)O[Si](C)(C)CCCOCC2CO2	{1: 4, 2: 8, 11: 2, 12: 2, 22: 3, 23: 2}
Did not match all atoms present	126-83-0	C(C(CCl)O)S(=O)(=O)[O-].[Na+]	{17: 1, 2: 2, 3: 1, 20: 1, 29: 3}
Did not match all atoms present	126-85-2	C[N+](CCCl)(CCCl)[O-]	{1: 1, 2: 4, 29: 1, 17: 2}
Did not match all atoms present	126-92-1	CCCCC(CC)COS(=O)(=O)[O-].[Na+]	{1: 2, 2: 5, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	1260-17-9	CC1=C2C(=CC(=C1C(=O)O)O)C(=O)C3=C(C2=O)C(=C(C(=C3O)O)[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O	{1: 1, 2: 1, 12: 5, 14: 1, 20: 4, 21: 4, 23: 1, 25: 2, 27: 1}
Did not match all atoms present	12600-90-7	[Ti].[Rh]	{}
Did not match all atoms present	12601-93-3	C(=P)=P	{8: 1}
Did not match all atoms present	12602-23-2	C(=O)([O-])[O-].C(=O)([O-])[O-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Co+2].[Co+2].[Co+2].[Co+2].[Co+2]	{24: 2}
Did not match all atoms present	12602-39-0	C#CP	{9: 1, 10: 1}
Did not match all atoms present	126050-54-2	CCCCC(CC)COP1OC2=C(C=C(C=C2CC3=CC(=CC(=C3O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 14, 2: 5, 3: 1, 4: 4, 11: 1, 14: 4, 22: 1, 23: 2}
Did not match all atoms present	12607-70-4	C(=O)([O-])[O-].O.O.O.O.[Ni].[Ni].[Ni+2]	{24: 1}
Did not match all atoms present	12607-92-0	CC(=O)NC(CCC(=O)N)C(=O)[O-]	{1: 1, 2: 2, 3: 1, 24: 3, 30: 1, 31: 1}
Did not match all atoms present	12607-93-1	CC1=C2[C@H](C(=O)[C@]3(C/C(=C\[C@@H](C(C2(C)C)C[C@@H]1OC(=O)C)OC(=O)C)/[C@H](C[C@@H]3O)OC(=O)[C@@H]([C@H](C4=CC=CC=C4)N(C)C)O)C)O	{1: 8, 3: 2, 33: 1, 11: 3, 12: 6, 13: 2, 14: 6, 15: 3, 20: 3, 25: 1, 28: 3}
Did not match all atoms present	1261-86-5	CN(C)C1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C	{1: 8, 33: 4, 14: 16, 7: 2}
Did not match all atoms present	1262-21-1	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)O[Sn](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{22: 1, 14: 30}
Did not match all atoms present	1262-78-8	CC(C)(C[Sn](CC(C)(C)C1=CC=CC=C1)(CC(C)(C)C2=CC=CC=C2)CC(C)(C)C3=CC=CC=C3)C4=CC=CC=C4	{1: 8, 2: 4, 4: 4, 14: 20}
Did not match all atoms present	126202-23-1	C1=C(C=C(C(=C1F)F)C=O)F	{16: 3, 26: 1, 14: 2}
Did not match all atoms present	126213-50-1	C1COC2=CSC=C2O1	{41: 1, 11: 2, 14: 2, 23: 2}
Did not match all atoms present	126224-16-6	CCC(=O)NC1=CC(=C(C=C1)OC)NCCOCCC#N	{1: 2, 2: 5, 37: 1, 14: 3, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	12626-81-2	[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Zr+4].[Pb+2]	{}
Did not match all atoms present	126268-14-2	CN1C=CC=C1/C=N/N2C(COC2=O)CN3CCCCC3	{1: 1, 2: 1, 6: 1, 33: 3, 11: 6, 12: 1, 34: 1, 14: 3, 28: 1}
Did not match all atoms present	12627-35-9	CC(=C)C1C(C2C3(O2)C(O1)CCC4(C3(CCC5C4(C6=C7C5OC(C8CC9C8(C1=C7C(=CC(=C1CC9=C)Cl)N6)O)(C)C)C)O)C)O	{32: 1, 1: 5, 5: 2, 7: 1, 11: 6, 12: 8, 13: 6, 14: 1, 15: 1, 17: 1, 20: 3, 23: 3}
Did not match all atoms present	12628-09-0	B=C=[SiH2]	{8: 1}
Did not match all atoms present	1263-63-4	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C)CC)C	{32: 2, 1: 8, 2: 6, 35: 2, 14: 4, 28: 2}
Did not match all atoms present	1263-89-4	C1[C@H]([C@@H]([C@H](C([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)N)OC3[C@@H]([C@@H]([C@H](O3)CO)O[C@@H]4[C@@H]([C@H]([C@@H]([C@@H](O4)CN)O)O)N)O)O)N.OS(=O)(=O)O	{2: 3, 11: 1, 12: 19, 20: 10, 22: 3, 23: 3, 29: 2, 30: 5}
Did not match all atoms present	1263-94-1	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC.OP(=O)(O)O	{32: 1, 1: 6, 33: 1, 11: 5, 12: 6, 14: 5, 20: 3, 22: 5, 28: 2, 29: 1}
Did not match all atoms present	126301-30-2	CC(CS(=O)(=O)O)N	{1: 1, 2: 1, 3: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	126325-46-0	CC1=NC(=C(C=C1)Br)N	{1: 1, 18: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	12634-26-3	[O-2].[O-2].[F-].[F-].[Mg+2].[Ge]	{16: 2}
Did not match all atoms present	12639-43-9	O.O[Si](=O)O.O[Si](=O)O.O[Si](=O)O.[Mg+2].[Mg+2]	{20: 6, 29: 3}
Did not match all atoms present	12640-47-0	O=[W].[Co]	{29: 1}
Did not match all atoms present	126415-01-8	CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)OC(=O)C(=C)C)OC(=O)C(=C)C	{1: 6, 2: 2, 3: 2, 4: 1, 5: 2, 7: 2, 14: 8, 22: 2, 28: 2}
Did not match all atoms present	126424-00-8	CCOP(=O)(C1=CC(CCC1)C)OCC	{1: 3, 2: 2, 11: 3, 12: 1, 14: 1, 15: 1, 22: 2, 29: 1}
Did not match all atoms present	126426-74-2	CC(C)OP(=S)(OC(C)C)[S-].C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Sb+3]	{1: 4, 3: 2, 22: 2, 14: 10}
Did not match all atoms present	126443-11-6	COC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)F	{1: 1, 6: 2, 14: 8, 16: 1, 22: 1, 24: 1}
Did not match all atoms present	12645-31-7	CCCCC(CC)COP(=O)(O)O	{1: 2, 2: 5, 3: 1, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	12645-45-3	[Cl-].[Cl-].[Cl-].[Cl-].[Ir]	{17: 4}
Did not match all atoms present	12645-50-0	O.O.O.O.[Fe].[Fe].[Ni].[Zn]	{}
Did not match all atoms present	126456-43-7	C1[C@H]([C@H](C2=CC=CC=C21)N)O	{20: 1, 11: 1, 12: 2, 30: 1, 14: 4}
Did not match all atoms present	126463-66-9	C1CCN(CC1)CC2=CC(=NC=C2)OC/C=C\CNC3=C(C(=O)C3=O)N.Cl	{33: 1, 2: 3, 35: 1, 6: 2, 11: 5, 14: 3, 17: 1, 22: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	126505-35-9	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)OP2OCCC3(O2)COP(OC3)OC4=C(C=C(C=C4C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 18, 4: 6, 11: 4, 13: 1, 14: 4, 22: 2, 23: 4}
Did not match all atoms present	12653-56-4	[S-2].[Co+2]	{}
Did not match all atoms present	12653-76-8	[O-2].[O-2].[O-2].[Ti+4].[Ni+2]	{}
Did not match all atoms present	12656-43-8	C(#[Al])[Al]=C=[Al]C#[Al]	{8: 1, 10: 2}
Did not match all atoms present	12657-03-3	C1=CC=C(C=C1)[Al](C2=CC=CC=C2)C3=CC=CC=C3.[Al+3].[Cl-].[Cl-].[Cl-]	{17: 3, 14: 15}
Did not match all atoms present	126581-52-0	CCN(C1=CC=C(C=C1)NS(=O)(=O)C)C(=O)C	{1: 3, 2: 1, 33: 1, 14: 4, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	126613-06-7	C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F	{16: 6, 4: 2, 22: 2, 14: 12, 29: 4}
Did not match all atoms present	12663-46-6	CCC1C(=O)NC(C(=O)NC(CC(=O)NC(C(=O)N2CC(C(C2C(=O)N1)Cl)Cl)CO)C3=CC=CC=C3)CO	{32: 4, 1: 1, 2: 3, 33: 1, 11: 2, 12: 7, 14: 5, 17: 2, 20: 2, 25: 5}
Did not match all atoms present	12663-54-6	C1=CC=C2C(=C1)C3=C(C=C4C5=C6C(=CC(=C7C6=C(C=C5)C(=O)C8=CC=CC=C87)Cl)C9=C4C3=C(C2=O)C=C9)Cl	{17: 2, 14: 14, 25: 2}
Did not match all atoms present	126646-15-9	CCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 24, 22: 9}
Did not match all atoms present	126646-16-0	CCCCCCOCCOCCOCCOCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 12, 22: 4}
Did not match all atoms present	126714-85-0	C1=C(SC(=C1Cl)Cl)S(=O)(=O)Cl	{17: 3, 29: 2, 14: 1, 41: 1}
Did not match all atoms present	12673-55-1	C[As](SC#N)SC#N	{40: 2, 1: 1, 37: 2}
Did not match all atoms present	12673-58-4	[O-2].[O-2].[O-2].[O-2].[Ni+2].[Mo]	{}
Did not match all atoms present	126747-14-6	B(C1=CC=C(C=C1)C#N)(O)O	{20: 2, 37: 1, 14: 4}
Did not match all atoms present	12676-27-6	[Li+].[Li+].[Li+].B([O-])([O-])[O-]	{29: 3}
Did not match all atoms present	126833-17-8	CC1(CCCCC1)C(=O)NC2=C(C(=C(C=C2)O)Cl)Cl	{1: 1, 11: 5, 13: 1, 14: 2, 17: 2, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	12684-33-2	C/C=C/C1=CN2[C@@H](C1)[C@H](NC3=C(C(=C(C=C3C2=O)O[C@H]4[C@@H]([C@]([C@H]([C@@H](O4)C)NC)(C)O)O)C)O)O	{32: 1, 1: 5, 6: 2, 33: 1, 11: 1, 12: 6, 13: 1, 14: 2, 15: 1, 20: 3, 21: 1, 22: 1, 23: 1, 25: 1, 31: 1}
Did not match all atoms present	12688-05-0	C(CO)[N+](CCO)(CCO)CCO.O[Si](=O)O	{2: 8, 20: 6, 29: 1}
Did not match all atoms present	12688-15-2	[OH-].[OH-].[OH-].[OH-].[Zr+4]	{}
Did not match all atoms present	12688-64-1	[Ni].[Bi]	{}
Did not match all atoms present	12689-13-3	C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O	{20: 14, 29: 14}
Did not match all atoms present	12689-99-5	[GaH].[Te][Te]	{}
Did not match all atoms present	12690-20-9	[O-2].[O-]P(=O)([O-])[O-].[K+].[Ti+4]	{29: 4}
Did not match all atoms present	126917-10-0	C1=CC(=C(C=C1C(F)(F)F)F)C(=O)Cl	{16: 4, 17: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	126936-19-4	COC1=CC=CC(=C1)NC(=S)NN/C=C/2\C=CC=N2	{1: 1, 35: 1, 6: 1, 7: 1, 14: 7, 15: 1, 22: 1, 31: 3}
Did not match all atoms present	126949-65-3	CCCCO.CCCCO.CC(C)C1=C(C(=CC=C1)C(C)C)N=[Mo]=CC(C)(C)C2=CC=CC=C2	{1: 8, 2: 6, 3: 2, 4: 1, 6: 1, 34: 1, 14: 8, 20: 2}
Did not match all atoms present	126956-10-3	CN1C=CC=C1C=NNC(=S)NC2=CC(=CC=C2)OC	{1: 2, 34: 1, 33: 1, 6: 1, 7: 1, 14: 7, 22: 1, 31: 2}
Did not match all atoms present	126983-60-6	COC1=CC(=O)C2=C3C(=CN=C2C1=O)C4=C(N3)C=CN=C4	{32: 1, 1: 1, 35: 2, 14: 5, 15: 1, 22: 1, 25: 2}
Did not match all atoms present	126983-61-7	CC1=NC2=C(C(=O)C=C(C2=O)OC)C3=C1C4=C(N3)C=CN=C4	{32: 1, 1: 2, 35: 2, 14: 4, 15: 1, 22: 1, 25: 2}
Did not match all atoms present	126990-35-0	CO[Si](C1CCCC1)(C2CCCC2)OC	{1: 2, 11: 8, 12: 2, 22: 2}
Did not match all atoms present	127-08-2	CC(=O)[O-].[K+]	{24: 1, 1: 1}
Did not match all atoms present	127-09-3	CC(=O)[O-].[Na+]	{24: 1, 1: 1}
Did not match all atoms present	127-20-8	CC(C(=O)[O-])(Cl)Cl.[Na+]	{24: 1, 1: 1, 4: 1, 17: 2}
Did not match all atoms present	127-23-1	C1C[C@H]2C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N2C1)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)N)C(=O)N5C[C@@H](C[C@H]5C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N)O)CC(=O)N	{32: 4, 33: 2, 2: 7, 3: 1, 7: 1, 41: 2, 11: 7, 12: 8, 34: 1, 14: 9, 20: 1, 21: 1, 24: 5, 25: 5, 30: 5, 31: 2}
Did not match all atoms present	127-29-7	CCN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@]5(C[C@@H]([C@]6(C[C@@H]4[C@@H]5[C@H]6OC(=O)C7=CC(=C(C=C7)OC)OC)O)OC)OC(=O)C)OC)OC)O)COC	{1: 8, 2: 2, 33: 1, 11: 4, 12: 10, 13: 4, 14: 3, 20: 2, 22: 6, 28: 2}
Did not match all atoms present	127-33-3	CN(C)[C@H]1[C@@H]2C[C@@H]3[C@@H](C4=C(C=CC(=C4C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O)Cl)O	{1: 2, 33: 1, 11: 1, 12: 4, 13: 1, 14: 2, 15: 4, 17: 1, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	127-35-5	CC1C2CC3=C(C1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)O	{1: 2, 2: 2, 33: 1, 11: 3, 12: 2, 13: 1, 14: 8, 21: 1}
Did not match all atoms present	127-52-6	C1=CC=C(C=C1)S(=O)(=O)[N-]Cl.[Na+]	{17: 1, 34: 1, 29: 2, 14: 5}
Did not match all atoms present	127-54-8	CC(C)C1=C(C=CC(=C1)C(C)(C)C2=CC(=C(C=C2)O)C(C)C)O	{1: 6, 3: 2, 4: 1, 21: 2, 14: 6}
Did not match all atoms present	127-56-0	CC(=O)[N-]S(=O)(=O)C1=CC=C(C=C1)N.[Na+]	{1: 1, 34: 1, 14: 4, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	127-57-1	C1=CC=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.[Na+]	{35: 1, 30: 1, 34: 1, 29: 2, 14: 8}
Did not match all atoms present	127-58-2	CC1=NC(=NC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.[Na+]	{1: 1, 34: 1, 35: 2, 14: 6, 29: 2, 30: 1}
Did not match all atoms present	127-59-3	CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)Cl	{1: 2, 2: 6, 33: 1, 14: 4, 17: 1, 29: 2}
Did not match all atoms present	127-63-9	C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2	{29: 2, 14: 10}
Did not match all atoms present	127-65-1	CC1=CC=C(C=C1)S(=O)(=O)[N-]Cl.[Na+]	{1: 1, 34: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	127-66-2	CC(C#C)(C1=CC=CC=C1)O	{1: 1, 4: 1, 9: 1, 10: 1, 14: 5, 20: 1}
Did not match all atoms present	127-68-4	C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]	{38: 1, 29: 3, 14: 4}
Did not match all atoms present	127-69-5	CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 2, 35: 1, 14: 4, 23: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	127-71-9	C1=CC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)N	{24: 1, 30: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	127-77-5	C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{30: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	127-79-7	CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 2, 14: 6, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	127-82-2	C1=CC(=CC=C1O)S(=O)(=O)[O-].C1=CC(=CC=C1O)S(=O)(=O)[O-].[Zn+2]	{21: 2, 14: 8, 29: 6}
Did not match all atoms present	127-85-5	C1=CC(=CC=C1N)[As](=O)(O)[O-].[Na+]	{30: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	127-95-7	C(=O)(C(=O)[O-])O.[K+]	{24: 1, 27: 1}
Did not match all atoms present	127-96-8	C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.[K]	{27: 4}
Did not match all atoms present	12705-20-3	[C-]#[N+]/C(=C\C1=CC(=C(C=C1)O)O)/C(=C/C2=CC(=C(C=C2)O)O)/[N+]#[C-]	{34: 2, 21: 4, 14: 6, 6: 2, 7: 2}
Did not match all atoms present	12706-94-4	C1=CN(C(=O)N=C1N)C2C(C(C(C(O2)C(C(C(C(C(CO)O)O)O)O)OC3C(C(C(C(O3)CO)O)N)O)N)O)O	{33: 1, 2: 2, 3: 5, 12: 10, 14: 2, 35: 1, 20: 10, 22: 1, 23: 2, 25: 1, 30: 3}
Did not match all atoms present	12709-78-3	[Cl-].[Cl-].[In+3].[In+3]	{17: 2}
Did not match all atoms present	12709-98-7	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Cr+3].[Cr+3].[Mo].[Mo].[Pb+2].[Pb+2]	{}
Did not match all atoms present	1271-03-0	[CH2-]C=CC1=CC=CC1.[Pd]	{14: 3, 11: 1, 5: 1, 6: 2, 15: 1}
Did not match all atoms present	1271-07-4	[CH3-].[CH3-].[CH3-].[CH-]1C=CC=C1.[Pt+4]	{14: 5}
Did not match all atoms present	1271-19-8	C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Cl-].[Ti+4]	{17: 2, 11: 2, 14: 6}
Did not match all atoms present	1271-27-8	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Mn+2]	{14: 10}
Did not match all atoms present	1271-28-9	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ni+2]	{14: 10}
Did not match all atoms present	1271-31-4	C1C=CC=[C-]1.C1C=CC=[C-]1.[Yb+2]	{11: 2, 14: 6}
Did not match all atoms present	1271-32-5	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[ReH]	{14: 10}
Did not match all atoms present	1271-33-6	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[W+2]	{14: 10}
Did not match all atoms present	1271-43-8	[CH-]1C=CC=C1.C1=CC=CC=C1.[Mn]	{14: 11}
Did not match all atoms present	1271-44-9	C[C-]1C=CC=C1.[CH-]1[CH-][CH-][CH-][CH-]1.[Fe]	{1: 1, 14: 9}
Did not match all atoms present	1271-54-1	C1=CC=CC=C1.C1=CC=CC=C1.[Cr]	{14: 12}
Did not match all atoms present	1271-66-5	[CH3-].[CH3-].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti+4]	{14: 10}
Did not match all atoms present	12710-19-9	COC1=CC=CC=C1N2CC[NH+](CC2)CCCC(=O)C3=CC=C(C=C3)F.[Cl-]	{1: 1, 2: 3, 33: 1, 11: 4, 14: 8, 16: 1, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	12712-28-6	C(C(CO)(CCl)CCl)O.OS(=O)(=O)O	{17: 2, 2: 4, 4: 1, 29: 2, 20: 4}
Did not match all atoms present	12712-38-8	B([O-])([O-])[O-].[K+].[K+].[K+]	{29: 3}
Did not match all atoms present	12712-63-9	[O-][Si]([O-])([O-])[O-].[Sr+2].[Sr+2]	{29: 4}
Did not match all atoms present	127142-66-9	C1=CC(=C(C=C1N=C=S)[N+](=O)[O-])Cl	{8: 1, 17: 1, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	127142-69-2	C1=CC(=C(C(=C1N=C=S)Cl)Cl)Cl	{8: 1, 17: 3, 34: 1, 14: 2}
Did not match all atoms present	1272-21-5	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Gd+3]	{14: 15}
Did not match all atoms present	1272-22-6	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ho+3]	{14: 15}
Did not match all atoms present	1272-23-7	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[La+3]	{14: 15}
Did not match all atoms present	1272-24-8	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Lu+3]	{14: 15}
Did not match all atoms present	1272-26-0	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Tm+3]	{14: 15}
Did not match all atoms present	1272-35-1	COC(=O)[C-]1[CH-][CH-][CH-][CH-][CH-]1.COC(=O)C1=CC=CC=C1.[Cr]	{1: 2, 28: 2, 14: 10, 15: 1}
Did not match all atoms present	1272-49-7	[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Fe+2]	{14: 14}
Did not match all atoms present	1272-51-1	[CH-]1[CH-][C-]2[CH][CH][CH][CH][C-]2[CH-]1.C1=C[C-]2[CH][CH][CH][CH]C2=C1.[Ru]	{14: 14}
Did not match all atoms present	127277-53-6	CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].CCC(=C1C(=O)CC(CC1=O)C(=O)O)[O-].[Ca+2]	{1: 2, 2: 2, 7: 2, 11: 4, 12: 2, 15: 2, 25: 4, 27: 2}
Did not match all atoms present	1273-74-1	[CH-]1[CH-][CH-][CH-][CH-]1.C1=C[C-](C=C1)Cl.[Fe]	{17: 1, 14: 9}
Did not match all atoms present	1273-75-2	[CH-]1C=CC=C1.[CH-]1C=CC=C1.Cl[Hg].[Fe+2]	{17: 1, 14: 10}
Did not match all atoms present	1273-81-0	C1C=CC=[C-]1.C1C=CC=[C-]1.[Os+2]	{11: 2, 14: 6}
Did not match all atoms present	1273-89-8	CC[C-]1C=CC=C1.[CH-]1C=CC=C1.[Fe+2]	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	1273-95-6	COC(=O)[C-]1[C-]=[C-][C-]=[C-]1.COC(=O)[C-]1[C-]=[C-][C-]=[C-]1.[Fe]	{1: 2, 28: 2}
Did not match all atoms present	1273-98-9	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Nd+3]	{14: 15}
Did not match all atoms present	12737-30-3	[O-2].[O-2].[Co+2].[Ni+2]	{}
Did not match all atoms present	12738-76-0	[O-2].[Tb]	{}
Did not match all atoms present	1274-07-3	C[C-]1[CH-][C-]([CH-][C-]([CH-]1)C)C.CC1=CC(=CC(=C1)C)C.[Cr]	{1: 6, 14: 6, 15: 3}
Did not match all atoms present	1274-08-4	CCCCC1=CC=C[CH-]1.CCCCC1=CC=C[CH-]1.[Fe+2]	{1: 2, 2: 6, 14: 8}
Did not match all atoms present	127502-68-5	CC(C)C1=C(C=CC(=C1)C2=CC=CC=C2)[N+](=O)[O-]	{1: 2, 3: 1, 38: 1, 14: 8}
Did not match all atoms present	12758-12-2	[Al-].[O]	{}
Did not match all atoms present	12758-15-5	[AlH3].[AlH3].[AlH3].[Co]	{}
Did not match all atoms present	12758-40-6	C(C[Ge](=O)O[Ge](=O)CCC(=O)O)C(=O)O	{2: 4, 27: 2, 29: 2, 22: 1}
Did not match all atoms present	127620-11-5	[CH3-].[CH3-].CN(C)[PH+](N(C)C)N(C)C.CN(C)[PH+](N(C)C)N(C)C.[Pt+2]	{1: 12, 33: 6}
Did not match all atoms present	127620-12-6	[CH3-].[CH3-].CCO[PH+](C)OCC.CCO[PH+](C)OCC.[Pt+2]	{1: 6, 2: 4, 22: 4}
Did not match all atoms present	127620-13-7	[CH3-].[CH3-].CCO[PH+](OCC)OCC.CCO[PH+](OCC)OCC.[Pt+2]	{1: 6, 2: 6, 22: 6}
Did not match all atoms present	127622-32-6	[OH-].[Y+3]	{}
Did not match all atoms present	12765-06-9	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Mg+2].[Ca+2]	{29: 6}
Did not match all atoms present	12766-49-3	CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.C(C[Hg]Cl)O.[Br-]	{1: 1, 2: 17, 33: 1, 14: 5, 17: 1, 18: 1, 20: 1}
Did not match all atoms present	127667-44-1	CC(C)(C1=CC=C(C=C1)OC#N)C2=CC(=CC=C2)C(C)(C)C3=CC=C(C=C3)OC#N	{1: 4, 4: 2, 22: 2, 14: 12, 37: 2}
Did not match all atoms present	127667-47-4	CC(C[N+]12CCN(CC1)CC2)OC(=O)[O-]	{11: 6, 1: 1, 2: 1, 3: 1, 33: 1}
Did not match all atoms present	12767-83-8	CCCCC(CC)CO.OP(=O)(O)OP(=O)(O)OP(=O)(O)O.[Na]	{1: 2, 2: 5, 3: 1, 20: 6, 22: 2, 29: 3}
Did not match all atoms present	12769-08-3	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(C(=C2[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)CCOS(=O)(=O)[O-])[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2]	{1: 1, 2: 2, 34: 2, 14: 6, 22: 1, 24: 1, 29: 11, 31: 1}
Did not match all atoms present	127697-56-7	C/C(=C(\C1=CC=C(C=C1)C(=O)O)/F)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C	{1: 5, 7: 2, 11: 2, 13: 2, 14: 7, 16: 1, 27: 1}
Did not match all atoms present	1277-43-6	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Co+2]	{14: 10}
Did not match all atoms present	1277-45-8	C[C-]1C=CC=C1.[Ti](Br)(Br)Br	{1: 1, 18: 3, 14: 4}
Did not match all atoms present	1277-47-0	C1C=CC=[C-]1.C1C=CC=[C-]1.[V+2]	{11: 2, 14: 6}
Did not match all atoms present	12770-26-2	[H-].[H-].[Hf]	{}
Did not match all atoms present	12771-68-5	COC1=CC=C(C=C1)C(C2CC2)(C3=CN=CN=C3)O	{1: 1, 35: 2, 4: 1, 11: 2, 12: 1, 14: 7, 20: 1, 22: 1}
Did not match all atoms present	127733-92-0	CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)C1=CC=CC=C1C(=O)O	{1: 2, 2: 34, 33: 1, 14: 4, 24: 1, 27: 1}
Did not match all atoms present	12774-48-0	[OH-].[O-][As](=O)([O-])[O-].[Cu+2].[Cu+2]	{29: 4}
Did not match all atoms present	127791-53-1	C1=CC(=CC(=C1)N)C=CC(=O)O	{30: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	127793-17-3	C1C#CC[Se]CC#CCS1	{41: 1, 10: 4, 11: 4}
Did not match all atoms present	127793-18-4	C1C#CC[Se]CC#CC[Se]1	{10: 4, 11: 4}
Did not match all atoms present	12786-09-3	C([C@H]([C@H]([C@@H]([C@H](C(C(=O)[O-])O)O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(C(=O)[O-])O)O)O)O)O)O.[Fe+2]	{24: 2, 2: 2, 3: 10, 20: 12}
Did not match all atoms present	127884-84-8	CCCCCCCCCCCC1=NCC[N+]1(CCOCC(=O)[O-])CC(=O)[O-].[OH-].[Na+].[Na+]	{1: 1, 2: 14, 35: 1, 11: 2, 15: 1, 22: 1, 24: 2}
Did not match all atoms present	127909-62-0	CC[PH+](CC)CC.CC[PH+](CC)CC.[C-](F)(F)F.[C-](F)(F)F.[Pt+2]	{16: 6, 1: 6, 2: 6, 7: 2}
Did not match all atoms present	12793-14-5	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.Cl[Nb]Cl	{17: 2, 14: 10}
Did not match all atoms present	127951-99-9	C1C2CC3CC(CC1N3CC2O)OC(=O)C4=CNC5=CC=CC=C54	{32: 1, 33: 1, 11: 5, 12: 5, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	127986-84-9	C1C[C@H](NC1)C(C2=CC3=CC=CC=C3C=C2)(C4=CC5=CC=CC=C5C=C4)O	{32: 1, 4: 1, 11: 3, 12: 1, 14: 14, 20: 1}
Did not match all atoms present	128-00-7	CC(C(=O)[O-])O.[Ag+]	{24: 1, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	128-03-0	CN(C)C(=S)[S-].[K+]	{1: 2, 33: 1, 7: 1}
Did not match all atoms present	128-04-1	CN(C)C(=S)[S-].[Na+]	{1: 2, 33: 1, 7: 1}
Did not match all atoms present	128-37-0	CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 7, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	128-39-2	CC(C)(C)C1=C(C(=CC=C1)C(C)(C)C)O	{1: 6, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	128-42-7	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)C=CC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O	{38: 2, 20: 2, 14: 6, 6: 2, 29: 4}
Did not match all atoms present	128-56-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[Na+]	{25: 2, 29: 3, 14: 7}
Did not match all atoms present	128-58-5	COC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OC	{1: 2, 22: 2, 14: 14, 25: 2}
Did not match all atoms present	128-59-6	C1=CC=C2C(=C1)C3=CC(=C4C5=C(C=CC(=C35)C2=O)C6=C7C4=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)O)O	{25: 2, 21: 2, 14: 14}
Did not match all atoms present	128-62-1	CN1CCC2=CC3=C(C(=C2[C@@H]1[C@@H]4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OC)OCO3	{1: 4, 33: 1, 11: 3, 12: 2, 14: 3, 22: 3, 23: 2, 28: 1}
Did not match all atoms present	128-63-2	C1=CC2=C3C(=C(C=C2Br)Br)C=CC4=C(C=C(C1=C43)Br)Br	{18: 4, 14: 6}
Did not match all atoms present	128-64-3	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=CC=C7C8=C(C=CC5=C68)C9=CC=CC=C9C7=O)C2=O	{25: 2, 14: 16}
Did not match all atoms present	128-66-5	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C(=O)C6=CC=CC=C65)C2=O	{25: 2, 14: 12}
Did not match all atoms present	128-67-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)O)[N+](=O)[O-]	{25: 2, 27: 1, 38: 1, 14: 6}
Did not match all atoms present	128-69-8	C1=CC2=C3C(=CC=C4C3=C1C5=C6C4=CC=C7C6=C(C=C5)C(=O)OC7=O)C(=O)OC2=O	{28: 4, 14: 8}
Did not match all atoms present	128-70-1	C1=CC=C2C(=C1)C3=CC4=C5C6=C(C=CC(=C36)C2=O)C=C7C5=C(C=C4)C(=O)C8=CC=CC=C87	{25: 2, 14: 14}
Did not match all atoms present	128-76-7	COC1=C(C2=C3C(CC4=CC(=C(C=C42)OC)O)NCCC3=C1)OC	{32: 1, 1: 3, 11: 3, 12: 1, 14: 3, 21: 1, 22: 3}
Did not match all atoms present	128-79-0	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC4=C5C(=C(C=C4)NC(=O)C6=CC=CC=C6)C(=O)C7=CC=CC=C7C5=O)C(=O)C8=CC=CC=C8C3=O	{24: 2, 25: 4, 14: 22, 31: 3}
Did not match all atoms present	128-80-3	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=C(C=C4)C)C(=O)C5=CC=CC=C5C3=O	{1: 2, 31: 2, 14: 14, 25: 2}
Did not match all atoms present	128-81-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C4C(=C3N)C(=O)NC4=O)N	{32: 1, 25: 4, 30: 2, 14: 4}
Did not match all atoms present	128-83-6	CC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)Br	{1: 1, 14: 9, 18: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	128-84-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C(=C3N)O)O)N	{25: 2, 30: 2, 21: 2, 14: 4}
Did not match all atoms present	128-87-0	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=C5C(=C(C=C4)N)C(=O)C6=CC=CC=C6C5=O)N	{25: 4, 30: 2, 14: 12, 31: 1}
Did not match all atoms present	128-88-1	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)[N+](=O)[O-])NC4=C5C(=C(C=C4)[N+](=O)[O-])C(=O)C6=CC=CC=C6C5=O	{25: 4, 38: 2, 14: 12, 31: 1}
Did not match all atoms present	128-89-2	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC4=CC=CC5=C4C(=O)C6=C(C5=O)C(=CC=C6)NC(=O)C7=CC=CC=C7)C(=O)C8=CC=CC=C8C3=O	{24: 2, 25: 4, 14: 22, 31: 3}
Did not match all atoms present	128-90-5	C1=C(C2=C(C(=C1S(=O)(=O)O)O)C(=O)C3=C(C2=O)C(=CC(=C3O)S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 2, 20: 2, 21: 2, 25: 2, 29: 4}
Did not match all atoms present	128-91-6	C1=CC(=C2C(=C1[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)[N+](=O)[O-])O)O	{25: 2, 38: 2, 21: 2, 14: 4}
Did not match all atoms present	128-93-8	CNC1=C2C(=C(C=C1)Br)C(=O)C3=CC=CC=C3C2=O	{1: 1, 18: 1, 31: 1, 14: 6, 25: 2}
Did not match all atoms present	128-94-9	C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)O)N)O	{25: 2, 30: 2, 21: 2, 14: 4}
Did not match all atoms present	128-95-0	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)N)N	{25: 2, 30: 2, 14: 6}
Did not match all atoms present	128-97-2	C1=CC(=C2C(=CC=C(C2=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 14: 4}
Did not match all atoms present	128-98-3	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{1: 1, 14: 9, 20: 1, 25: 2, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	128-99-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)S(=O)(=O)O)N)S(=O)(=O)O)N	{14: 8, 20: 2, 25: 2, 29: 4, 30: 2, 31: 1}
Did not match all atoms present	128008-30-0	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[In+3]	{16: 9, 4: 3, 29: 9}
Did not match all atoms present	128093-63-0	CCCC[Sn](CCCC)(CCCC)CC[Si](OCC)(OCC)OCC	{1: 6, 2: 14, 22: 3}
Did not match all atoms present	1281-98-7	[H+].[H+].C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Fe+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	128143-80-6	[N+](=O)(O)[O-].O	{20: 1}
Did not match all atoms present	128143-89-5	C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)Cl	{17: 1, 35: 3, 14: 10}
Did not match all atoms present	128192-25-6	C(C(=O)[O-])(O)P(=O)(O)[O-].[Na+].[Na+]	{24: 1, 3: 1, 20: 2, 29: 2}
Did not match all atoms present	128255-31-2	C1=CC=C(C(=C1)N=C=O)I	{8: 1, 34: 1, 19: 1, 29: 1, 14: 4}
Did not match all atoms present	128345-62-0	CN/C(=C\[N+](=O)[O-])/NCCSCC1=CC=C(O1)CN(C)C.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Bi+3]	{1: 3, 2: 6, 4: 1, 33: 1, 6: 1, 7: 1, 40: 1, 14: 2, 20: 1, 23: 1, 24: 3, 38: 1, 31: 2}
Did not match all atoms present	1284-72-6	C1C=CC=[C-]1.C1C=CC=[C-]1.[Mg+2]	{11: 2, 14: 6}
Did not match all atoms present	128433-68-1	CC1(C2=CC=CC=C2[N+](=C1/C=C/C3=C(/C(=C/C=C/4\C(C5=CC=CC=C5N4C)(C)C)/CC3)Cl)C)C.C(F)(F)(F)S(=O)(=O)[O-]	{1: 6, 4: 1, 6: 4, 33: 2, 11: 2, 13: 2, 14: 8, 15: 5, 16: 3, 17: 1, 29: 3}
Did not match all atoms present	128484-66-2	C1CC(CCC1CC2=CC=CC=C2)CC3=CC=CC=C3	{2: 2, 11: 4, 12: 2, 14: 10}
Did not match all atoms present	128502-56-7	C1[C@H](NCC2=C1C=CC(=C2)O)C(=O)O	{32: 1, 11: 2, 12: 1, 14: 3, 21: 1, 27: 1}
Did not match all atoms present	128544-06-9	CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C3=CC=CC=C3C=C2)C4=C(C=CC5=CC=CC=C54)OS(=O)(=O)C6=CC=C(C=C6)C	{1: 2, 22: 2, 14: 20, 29: 4}
Did not match all atoms present	128601-36-5	CC1=C(C=CC(=C1)O)NC.OS(=O)(=O)O	{1: 2, 14: 3, 20: 2, 21: 1, 29: 2, 31: 1}
Did not match all atoms present	128625-52-5	C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=CC=CC=C5N=N4.F[P-](F)(F)(F)(F)F	{33: 4, 35: 2, 11: 12, 14: 4, 16: 6, 22: 1}
Did not match all atoms present	128639-02-1	CCOC(=O)C(CC1=CC(=C(C=C1Cl)F)N2C(=O)N(C(=N2)C)C(F)F)Cl	{1: 2, 2: 2, 3: 2, 33: 2, 14: 2, 16: 3, 17: 2, 35: 1, 25: 1, 28: 1}
Did not match all atoms present	1287-09-8	[CH-]1C=CC=C1.[CH-]1C=CC=C1.Cl[Fe](Cl)(Cl)Cl.[Fe+2]	{17: 4, 14: 10}
Did not match all atoms present	1287-13-4	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ru+2]	{14: 10}
Did not match all atoms present	128734-38-3	C1=CC(=CC=C1N/N=C\2/C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N=NC5=C(C=C(C=C5)[NH3+])[NH3+])S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC6=C(C=C(C=C6)[NH3+])[NH3+].[O-]S(=O)(=O)[O-]	{34: 7, 14: 16, 15: 2, 25: 1, 29: 10, 30: 1, 31: 1}
Did not match all atoms present	128734-39-4	C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)[O-].[K+]	{28: 1, 13: 1, 14: 12, 21: 1}
Did not match all atoms present	128758-36-1	C1=CC(=CC=C1COC2=C(C(=O)N(N=C2)C3=CC=C(C=C3)Cl)I)Cl	{33: 1, 2: 1, 35: 1, 14: 9, 17: 2, 19: 1, 22: 1, 25: 1}
Did not match all atoms present	128758-37-2	C1=CC(=CC=C1COC2=C(C(=O)N(N=C2)C3=CC(=C(C=C3)Cl)Cl)I)Cl	{33: 1, 2: 1, 35: 1, 14: 8, 17: 3, 19: 1, 22: 1, 25: 1}
Did not match all atoms present	128994-25-2	C1C(O1)COC2=CC=CC=C2Cl	{2: 1, 11: 1, 12: 1, 14: 4, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	129-00-0	C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2	{14: 10}
Did not match all atoms present	129-03-3	CN1CCC(=C2C3=CC=CC=C3C=CC4=CC=CC=C42)CC1	{1: 1, 11: 4, 33: 1, 14: 10, 15: 2}
Did not match all atoms present	129-06-6	CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]	{1: 1, 2: 1, 3: 1, 14: 9, 24: 1, 28: 1}
Did not match all atoms present	129-09-9	C1=CC=C(C=C1)C2=NC3=C(S2)C4=C(C=C3)C(=O)C5=C(C4=O)C=CC6=C5SC(=N6)C7=CC=CC=C7	{25: 2, 35: 2, 14: 14, 41: 2}
Did not match all atoms present	129-15-7	CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]	{1: 1, 38: 1, 14: 6, 25: 2}
Did not match all atoms present	129-16-8	C1=CC=C(C(=C1)C2=C3C=C(C(=O)C=C3OC4=C(C(=C(C=C24)Br)[O-])[Hg])Br)C(=O)[O-].O.[Na+].[Na+]	{24: 1, 25: 1, 18: 2, 14: 7, 23: 1}
Did not match all atoms present	129-17-9	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 4, 2: 4, 33: 2, 7: 1, 14: 11, 15: 2, 29: 6}
Did not match all atoms present	129-18-0	CCCC[C-]1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3.[Na+]	{1: 1, 2: 3, 33: 2, 14: 10, 25: 2}
Did not match all atoms present	129-20-4	CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)O)C3=CC=CC=C3	{1: 1, 2: 3, 33: 2, 12: 1, 14: 9, 21: 1, 25: 2}
Did not match all atoms present	129-28-2	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=CC6=C5C(=O)C7=C(C6=O)C(=CC=C7)NC(=O)C8=CC=CC=C8	{24: 2, 25: 4, 14: 22, 31: 3}
Did not match all atoms present	129-30-6	CC(=O)NC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)C	{24: 2, 1: 2, 31: 2, 14: 6, 25: 2}
Did not match all atoms present	129-35-1	CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)Cl	{1: 1, 25: 2, 14: 6, 17: 1}
Did not match all atoms present	129-39-5	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C2=O)C=CC=C3[N+](=O)[O-]	{25: 2, 38: 2, 14: 6}
Did not match all atoms present	129-40-8	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C2=O)C(=CC=C3)Cl	{17: 1, 38: 1, 14: 6, 25: 2}
Did not match all atoms present	129-41-9	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2C(=CC(=C3O)Cl)Cl	{1: 1, 14: 8, 17: 2, 21: 1, 29: 2, 31: 1}
Did not match all atoms present	129-42-0	C1=CC2=C(C(=C1)N)C(=O)C3=C(C2=O)C=CC=C3N	{25: 2, 30: 2, 14: 6}
Did not match all atoms present	129-43-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O	{25: 2, 21: 1, 14: 7}
Did not match all atoms present	129-44-2	C1=CC2=C(C(=C1)N)C(=O)C3=C(C2=O)C(=CC=C3)N	{25: 2, 30: 2, 14: 6}
Did not match all atoms present	129-45-3	CCCCNC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 3, 31: 1, 14: 7, 25: 2}
Did not match all atoms present	129-49-7	CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CN(C4=CC=CC(=C34)C2=C1)C)C.C(=C\C(=O)O)\C(=O)O	{1: 3, 2: 2, 3: 1, 6: 2, 33: 2, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	129-51-1	C[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C.C(=CC(=O)O)C(=O)O	{32: 1, 1: 2, 2: 1, 3: 1, 6: 2, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	129-54-4	C1=CC=C2C(=C1)C3=NNC4=C(C=CC(=C43)C2=O)C5=C6C7=C(C=C5)C(=O)C8=CC=CC=C8C7=NN6	{32: 2, 25: 2, 35: 2, 14: 12}
Did not match all atoms present	129-56-6	C1=CC=C2C(=C1)C3=NNC4=CC=CC(=C43)C2=O	{32: 1, 25: 1, 35: 1, 14: 7}
Did not match all atoms present	129-63-5	CC(=O)NC1=C(C=C(C(=C1I)C(=O)[O-])I)I.[Na+]	{24: 2, 1: 1, 19: 3, 14: 1, 31: 1}
Did not match all atoms present	129-66-8	C1=C(C=C(C(=C1[N+](=O)[O-])C(=O)O)[N+](=O)[O-])[N+](=O)[O-]	{27: 1, 38: 3, 14: 2}
Did not match all atoms present	129-67-9	C1CC2C(C(C1O2)C(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 11: 2, 12: 4, 23: 1}
Did not match all atoms present	129-68-0	C1=CC=C2C(=C1)C3=C4C5=C6C(=CC=C5)C(=O)C7=CC=CC=C7C6=C4C8=C3C(=CC=C8)C2=O	{25: 2, 14: 14}
Did not match all atoms present	129-71-5	CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl.Cl	{1: 1, 3: 1, 33: 2, 11: 4, 14: 9, 17: 3}
Did not match all atoms present	129-73-7	CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C	{1: 4, 3: 1, 14: 13, 33: 2}
Did not match all atoms present	129-77-1	CCN1CCCC(C1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.Cl	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 12: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	129-79-3	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C23)[N+](=O)[O-])[N+](=O)[O-]	{25: 1, 38: 3, 14: 5}
Did not match all atoms present	129-81-7	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)I	{1: 2, 19: 1, 33: 2, 14: 5, 25: 1}
Did not match all atoms present	129-83-9	CCC(=O)N(C1=CC=CC=C1)C(C)CN2CCCCC2	{1: 2, 2: 2, 3: 1, 33: 2, 11: 5, 14: 5, 24: 1}
Did not match all atoms present	129-90-8	CC1=CC=C(C=C1)NC2=CC=CC3=C2C(=CC=C3)S(=O)(=O)O	{1: 1, 20: 1, 29: 2, 14: 10, 31: 1}
Did not match all atoms present	129-91-9	C1=CC2=CC(=CC(=C2C(=C1)S(=O)(=O)O)N)S(=O)(=O)O	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	129-93-1	C1=CC=C(C=C1)NC2=CC(=C3C(=C2)C=CC=C3S(=O)(=O)O)NC4=CC=CC=C4	{20: 1, 29: 2, 14: 15, 31: 2}
Did not match all atoms present	129-99-7	CN1C2=C(C(=O)N(C1=O)C)NC=N2.COC(CNC(=O)NC(=O)CCC(=O)[O-])C[Hg].O.[Na+]	{32: 1, 1: 3, 2: 4, 3: 1, 33: 2, 14: 1, 35: 1, 22: 1, 24: 3, 25: 2, 31: 2}
Did not match all atoms present	129050-62-0	C(CN(CC(=O)[O-])CC(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]	{24: 3, 33: 1, 2: 4}
Did not match all atoms present	129089-44-7	CCCCOCCOCCOCC[O-].CCCCOCCOCCOCCOC(=O)[O-].[Mg+2]	{1: 2, 2: 18, 29: 1, 22: 6}
Did not match all atoms present	1291-32-3	[C-]1=CC=CC1.[Cl-].[Cl-].[Zr+4].c1cc[cH-]c1	{17: 2, 11: 1, 14: 8}
Did not match all atoms present	1291-40-3	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[MoH2]	{14: 10}
Did not match all atoms present	1291-48-1	C1=C[C-](C=C1)CO.C1=C[C-](C=C1)CO.[Fe+2]	{2: 2, 20: 2, 14: 8}
Did not match all atoms present	129117-54-0	CC1=CC(=C(C2=C1NC3=C2C=C(C=C3)OC)C)N	{32: 1, 1: 3, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	129134-95-8	C[C@@H]1CC2[C@@H](CC3=CN(C4=CC=CC2=C34)S(=O)(=O)C5=CC=C(C=C5)Cl)N(C1)C	{1: 2, 33: 2, 11: 3, 12: 3, 14: 8, 17: 1, 29: 2}
Did not match all atoms present	129134-96-9	C[C@@H]1CC2[C@@H](CC3=CN(C4=CC=CC2=C34)C5CCCC5)N(C1)C	{1: 2, 11: 7, 12: 4, 14: 4, 33: 2}
Did not match all atoms present	129181-55-1	C1C(O1)COC2=CC(=CC=C2)OCC3CO3.C1=CC(=CC(=C1)O)O.C1=CC(=CC=C1O)S(=O)(=O)C2=CC=C(C=C2)O	{2: 2, 11: 2, 12: 2, 14: 16, 21: 4, 22: 2, 23: 2, 29: 2}
Did not match all atoms present	129188-99-4	CC1CC(CC(C1)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)(C)C	{1: 3, 11: 3, 12: 1, 13: 2, 14: 8, 21: 2}
Did not match all atoms present	129209-58-1	CCCCCCCCCCCCCCCCCCN(C1=CC=CC=C1)C2=NC(=NC(=N2)N)C(=C)C	{1: 2, 2: 17, 35: 3, 5: 1, 7: 1, 14: 5, 33: 1, 30: 1}
Did not match all atoms present	129217-90-9	CC1=CC=CC=C1N.C1=CC=C(C=C1)N.C1=CC(=CC=C1C=O)C=O	{1: 1, 26: 2, 30: 2, 14: 13}
Did not match all atoms present	129218-10-6	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OC.CC(=O)[O-]	{1: 6, 2: 4, 33: 2, 14: 10, 23: 1, 24: 1, 28: 1}
Did not match all atoms present	129286-36-8	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC5=C(C=CC3=C54)F	{16: 1, 14: 11}
Did not match all atoms present	129286-37-9	C1=CC2=C3C(=C1)C4=C(C3=CC=C2)C5=C(C=C4)C=C(C=C5)F	{16: 1, 14: 11}
Did not match all atoms present	1293-67-0	[CH-]1[CH-][CH-][C-]([CH-]1)Cl.C1=C[C-](C=C1)Cl.[Fe]	{17: 2, 14: 8}
Did not match all atoms present	1293-73-8	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[Ti](Br)Br	{18: 2, 14: 10}
Did not match all atoms present	1293-94-3	CS[C-]1[CH-][CH-][CH-][CH-]1.CS[C-]1C=CC=C1.[Fe]	{40: 2, 1: 2, 14: 8}
Did not match all atoms present	129322-83-4	CC(=O)C1=CC(=C(C=C1F)F)F	{16: 3, 1: 1, 14: 2, 24: 1}
Did not match all atoms present	1294-07-1	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Y+3]	{14: 15}
Did not match all atoms present	1294-67-3	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.Br[Zr]Br	{18: 2, 14: 10}
Did not match all atoms present	129423-62-7	CC(C)(CO)COC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C#N	{1: 2, 2: 2, 4: 1, 37: 1, 7: 2, 14: 10, 20: 1, 28: 1}
Did not match all atoms present	129466-35-9	O[Te+](O)O	{20: 3}
Did not match all atoms present	129473-78-5	CCCCCN(CCCCC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)C)NC6=CC=CC=C6	{1: 3, 2: 8, 33: 1, 13: 1, 14: 14, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	1295-20-1	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Yb+3]	{14: 15}
Did not match all atoms present	1295-35-8	C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.[Ni]	{11: 8, 14: 8}
Did not match all atoms present	129536-19-2	CCCCCCCC[Si](C(C)C)C(C)C	{1: 5, 2: 7, 3: 2}
Did not match all atoms present	129575-55-9	CO[Si]1(O[Si](O1)(OC)OC)OC	{1: 4, 22: 4, 23: 2}
Did not match all atoms present	129682-74-2	C1=CC=C(C=C1)N(P(OC2=CC=CC=C2)OC3=CC=CC=C3)P(OC4=CC=CC=C4)OC5=CC=CC=C5	{33: 1, 22: 4, 14: 25}
Did not match all atoms present	129707-63-7	CCCCOC1=CC=C(C2=C3NC(=C12)NC4=C5C(=CC=C(C5=C6N4[Al](N7C(=C8C(=CC=C(C8=C7NC9=C1C(=CC=C(C1=C(N9)N6)OCCCC)OCCCC)OCCCC)OCCCC)N3)O[Si](CC)(CC)CC)OCCCC)OCCCC)OCCCC	{32: 6, 1: 11, 2: 27, 33: 2, 14: 8, 22: 9}
Did not match all atoms present	129714-97-2	C1=C(C=C(C=C1F)F)C(=O)Cl	{16: 2, 17: 1, 14: 3, 24: 1}
Did not match all atoms present	129722-12-9	C1CC(=O)NC2=C1C=CC(=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl	{32: 1, 33: 2, 2: 4, 11: 6, 14: 6, 17: 2, 22: 1, 25: 1}
Did not match all atoms present	1298-41-5	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[Zr](I)I	{19: 2, 14: 10}
Did not match all atoms present	1298-53-9	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ce+3]	{14: 15}
Did not match all atoms present	1298-54-0	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Sc+3]	{14: 15}
Did not match all atoms present	1298-55-1	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Sm+3]	{14: 15}
Did not match all atoms present	129813-71-4	CN(CC1CO1)S(=O)(=O)C(C(C(F)(F)F)(F)F)(F)F	{1: 1, 2: 1, 4: 3, 33: 1, 11: 1, 12: 1, 16: 7, 23: 1, 29: 2}
Did not match all atoms present	129813-73-6	CC1=C(C2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)[N+]#N)S(=O)(=O)O)S(=O)(=O)O.OS(=O)(=O)[O-]	{1: 1, 34: 1, 35: 1, 41: 1, 14: 5, 20: 3, 29: 7}
Did not match all atoms present	129836-16-4	CC1=C(C2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)[N+]#N)S(=O)(=O)[O-])S(=O)(=O)O	{1: 1, 34: 1, 35: 1, 41: 1, 14: 5, 20: 1, 29: 5}
Did not match all atoms present	129851-38-3	CNS(=O)(=O)C1=C(C=C(C(=C1)Cl)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=C(C=C4)Cl)Cl	{1: 1, 34: 1, 14: 11, 15: 2, 17: 3, 24: 1, 25: 1, 29: 2, 31: 3}
Did not match all atoms present	129863-13-4	[Na+].[I-].[I-].[I-].[I-].[Er+3]	{19: 4}
Did not match all atoms present	129918-15-6	CC([O-])OC.CC([O-])OC.[Zn+2]	{1: 4, 3: 2, 29: 2, 22: 2}
Did not match all atoms present	129927-33-9	CCN(CC)CC#CC(C)(C)OC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.Cl	{1: 4, 2: 3, 4: 2, 33: 1, 10: 2, 11: 5, 12: 1, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	130-00-7	C1=CC2=C3C(=C1)C(=O)NC3=CC=C2	{32: 1, 25: 1, 14: 6}
Did not match all atoms present	130-13-2	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N	{30: 1, 29: 3, 14: 6}
Did not match all atoms present	130-15-4	C1=CC=C2C(=O)C=CC(=O)C2=C1	{25: 2, 14: 6}
Did not match all atoms present	130-16-5	C1=CC2=C(C=CC(=C2N=C1)O)Cl	{17: 1, 35: 1, 21: 1, 14: 5}
Did not match all atoms present	130-17-6	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N)S(=O)(=O)O	{1: 1, 35: 1, 41: 1, 14: 6, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	130-20-1	C1=CC=C2C(=C1)C(=O)C3=CC(=C4C(=C3C2=O)NC5=C(C=C6C(=C5N4)C(=O)C7=CC=CC=C7C6=O)Cl)Cl	{32: 2, 17: 2, 14: 10, 25: 4}
Did not match all atoms present	130-22-3	C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)S(=O)(=O)[O-].[Na+]	{25: 2, 21: 2, 14: 5, 29: 3}
Did not match all atoms present	130-24-5	CC1=C(C2=CC=CC=C2C(=C1)N)O.Cl	{1: 1, 30: 1, 21: 1, 14: 5, 17: 1}
Did not match all atoms present	130-26-7	C1=CC2=C(C(=C(C=C2Cl)I)O)N=C1	{17: 1, 19: 1, 21: 1, 14: 4, 35: 1}
Did not match all atoms present	130-34-7	C1=CC(=CC=C1N2N=C3C=CC4=C(C=C(C=C4C3=N2)S(=O)(=O)O)S(=O)(=O)O)[N+](=O)[O-]	{33: 1, 35: 2, 38: 1, 14: 8, 20: 2, 29: 4}
Did not match all atoms present	130-37-0	CC1(CC(=O)C2=CC=CC=C2C1=O)S(=O)(=O)[O-].[Na+]	{1: 1, 11: 1, 13: 1, 14: 4, 25: 2, 29: 3}
Did not match all atoms present	130-40-5	CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)O)O)O)O	{32: 1, 1: 2, 2: 2, 3: 3, 33: 1, 14: 2, 35: 2, 20: 5, 22: 1, 25: 2, 29: 1}
Did not match all atoms present	130-59-6	C1=CC2=C(C=C3C(=C2C=C1[N+](=O)[O-])N=NO3)S(=O)(=O)O	{35: 2, 38: 1, 14: 4, 20: 1, 23: 1, 29: 2}
Did not match all atoms present	130-61-0	CN1CCCCC1CCN2C3=CC=CC=C3SC4=C2C=C(C=C4)SC.Cl	{1: 2, 2: 2, 33: 2, 40: 1, 41: 1, 11: 4, 12: 1, 14: 7, 17: 1}
Did not match all atoms present	130-73-4	CCC(C1=CC(=C(C=C1)O)C)C(CC)C2=CC(=C(C=C2)O)C	{1: 4, 2: 2, 3: 2, 21: 2, 14: 6}
Did not match all atoms present	130-80-3	CCC(=C(CC)C1=CC=C(C=C1)OC(=O)CC)C2=CC=C(C=C2)OC(=O)CC	{1: 4, 2: 4, 28: 2, 14: 8, 7: 2}
Did not match all atoms present	130-83-6	C=CCN1CC2=CC=CC=C2C3=CC=CC=C3C1.OP(=O)(O)O	{33: 1, 2: 1, 5: 1, 6: 1, 11: 2, 14: 8, 20: 3, 29: 1}
Did not match all atoms present	130-85-8	C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O	{2: 1, 27: 2, 21: 2, 14: 10}
Did not match all atoms present	130-86-9	CN1CCC2=CC3=C(C=C2C(=O)CC4=C(C1)C5=C(C=C4)OCO5)OCO3	{1: 1, 33: 1, 11: 6, 14: 4, 23: 4, 25: 1}
Did not match all atoms present	130-87-0	CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OCCCCCC(C)C)O	{1: 3, 2: 6, 3: 2, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	130-90-5	COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.C(=O)O	{1: 1, 3: 1, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 1, 22: 1, 26: 1, 27: 1}
Did not match all atoms present	130-95-0	COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O	{1: 1, 3: 1, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	1300-14-7	[H+].[H+].C1=CC=C(C=C1)N.C1=CC=C(C=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{24: 4, 30: 2, 3: 4, 29: 4, 14: 10}
Did not match all atoms present	1300-26-1	C(C(COP(=O)([O-])[O-])O)O.[Zn+2]	{2: 2, 3: 1, 20: 2, 29: 3, 22: 1}
Did not match all atoms present	1300-35-2	C1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)S(=O)(=O)O.[OH-].[OH-].[OH-].[Al+3]	{20: 3, 29: 6, 14: 15}
Did not match all atoms present	1300-47-6	[Li+].C1=CC=C(C(=C1)O)S(=O)(=O)[O-]	{21: 1, 14: 4, 29: 3}
Did not match all atoms present	1300-92-1	C1=CC=C(C=C1)NC2=CC=CC=C2S(=O)(=O)[O-].C1=CC=C(C=C1)NC2=CC=CC=C2S(=O)(=O)[O-].[Ba+2]	{29: 6, 14: 18, 31: 2}
Did not match all atoms present	1300-94-3	CCCCCC1=C(C=C(C=C1)C)O	{1: 2, 2: 4, 21: 1, 14: 3}
Did not match all atoms present	130005-62-8	CC1=CC(=C(C2=C1NC3=C2C=C(C=C3)O)C)N	{32: 1, 1: 2, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	13001-46-2	CC(C)COC(=S)[S-].[K+]	{1: 2, 2: 1, 3: 1, 22: 1, 7: 1}
Did not match all atoms present	13002-65-8	CC/C(=C(/C1=CC=CC=C1)\C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3	{1: 3, 2: 3, 33: 1, 7: 2, 14: 14, 22: 1}
Did not match all atoms present	130047-19-7	C1=CC(=C(C=C1F)C(F)(F)F)O	{16: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	13005-35-1	C(C(C(C(C(C(=O)[O-])O)O)O)O)O.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Cu+2]	{24: 2, 2: 2, 3: 8, 20: 10}
Did not match all atoms present	13005-36-2	C1=CC=C(C=C1)CC(=O)[O-].[K+]	{24: 1, 2: 1, 14: 5}
Did not match all atoms present	13005-39-5	O.O.[Cl-].[Cl-].[Cl-].[Cl-].[K+].[Au+3]	{17: 4}
Did not match all atoms present	13006-05-8	CCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Mg+2]	{1: 2, 2: 34, 29: 6, 22: 2}
Did not match all atoms present	130063-43-3	C1=CC=C2C(=C1)C=C3C(C(C4=CC=CC5=C4C3=C2C6=CC=CC=C56)O)O	{20: 2, 12: 2, 14: 12}
Did not match all atoms present	130066-57-8	C=COCCCCOC(=O)C1=CC(=CC=C1)C(=O)OCCCCOC=C	{2: 8, 5: 2, 6: 2, 14: 4, 22: 2, 28: 2}
Did not match all atoms present	13007-90-4	[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni]	{29: 2, 14: 30}
Did not match all atoms present	13007-92-6	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]	{29: 6}
Did not match all atoms present	13009-91-1	CC1CN1C2=NC(=NC(=N2)N3CC3C)N4CC4C	{1: 3, 11: 3, 12: 3, 35: 3, 33: 3}
Did not match all atoms present	13009-99-9	CC(=O)O.C1=CC(=CC=C1CN)S(=O)(=O)N	{1: 1, 2: 1, 14: 4, 27: 1, 29: 2, 30: 2}
Did not match all atoms present	130097-34-6	CC(=C)C(=O)[O-].C=CC(=O)[O-].[NH4+].[NH4+]	{24: 2, 1: 1, 5: 2, 6: 1, 7: 1}
Did not match all atoms present	130097-36-8	CC(C)(C)CCC(=O)OOC(C)(C)C1=CC=CC=C1	{1: 5, 2: 2, 4: 2, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	1301-14-0	CC(C)(C)C1=CC2=C(C=C1)C=CC(=C2S(=O)(=O)[O-])C(C)(C)C.[Na+]	{1: 6, 4: 2, 29: 3, 14: 5}
Did not match all atoms present	1301-96-8	O=[Ag]	{29: 1}
Did not match all atoms present	13010-31-6	CCC[N+](CCC)(CCC)CCC	{1: 4, 2: 8}
Did not match all atoms present	13011-54-6	[NH4+].OP(=O)([O-])[O-].[Na+]	{20: 1, 29: 3}
Did not match all atoms present	13011-95-5	COC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OC)C(=O)O	{1: 2, 27: 2, 28: 2, 14: 2}
Did not match all atoms present	13012-16-3	CC1=CC(=CC(=C1N(C)C)C)C#N	{1: 4, 37: 1, 14: 2, 33: 1}
Did not match all atoms present	13013-15-5	CC(CN1CCOCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N4CCCC4	{1: 1, 2: 1, 3: 1, 4: 1, 33: 2, 11: 8, 14: 10, 23: 1, 24: 1}
Did not match all atoms present	13014-18-1	C1=CC(=C(C=C1Cl)Cl)C(Cl)(Cl)Cl	{17: 5, 4: 1, 14: 3}
Did not match all atoms present	13014-24-9	C1=CC(=C(C=C1C(Cl)(Cl)Cl)Cl)Cl	{17: 5, 4: 1, 14: 3}
Did not match all atoms present	13014-44-3	CCCCCC=CCC=CCCCCCCCC(=O)[O-].CCCCCC=CCC=CCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 24, 6: 8}
Did not match all atoms present	13014-84-1	CC[Si](C)(CC)CCCN	{1: 3, 2: 5, 30: 1}
Did not match all atoms present	13014-85-2	CCNC[Si](C)(C)C	{1: 4, 2: 2, 31: 1}
Did not match all atoms present	13014-91-0	C1=CC=C(C=C1)N/N=C/2\C=C(C=C(C2=O)N=NC3=CC=CC=C3)N=NC4=CC=CC=C4	{25: 1, 34: 5, 31: 1, 14: 17, 15: 3}
Did not match all atoms present	130169-66-3	CCCCOC1=CC(=C(C=C1N2CCOCC2)OCCCC)N.OS(=O)(=O)O	{1: 2, 2: 6, 33: 1, 11: 4, 14: 2, 20: 2, 22: 2, 23: 1, 29: 2, 30: 1}
Did not match all atoms present	13018-50-3	CN1CCC(CC1)(CNC(=O)CCCCCCCCC(=O)NCC2(CCN(CC2)C)C3=CC=CC=C3)C4=CC=CC=C4	{1: 2, 2: 10, 33: 2, 11: 8, 13: 2, 14: 10, 24: 2, 31: 2}
Did not match all atoms present	1302-09-6	[Se].[Ag].[Ag]	{}
Did not match all atoms present	1302-42-7	[O-][Al]=O.[Na+]	{29: 2}
Did not match all atoms present	1302-52-9	[Be+2].[Be+2].[Be+2].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Al+3].[Al+3]	{29: 18}
Did not match all atoms present	1302-65-4	[Li].O[Si](O)(O)O.[Al]	{20: 4}
Did not match all atoms present	1302-66-5	[Li].O[Si](=O)O[Si](=O)O.O[Si](=O)O[Si](=O)O.[Al]	{20: 4, 29: 4, 22: 2}
Did not match all atoms present	1302-67-6	[O-][Al]=O.[O-][Al]=O.[Mg+2]	{29: 4}
Did not match all atoms present	1302-68-7	[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[Mg+2].[Mg+2].[Mg+2].[Al+3].[Al+3]	{29: 12}
Did not match all atoms present	1302-76-7	O.O[Si](O)(O)O.[Al].[Al]	{20: 4}
Did not match all atoms present	1302-78-9	O.O=[Al]O[Al]=O.O=[Si]=O	{29: 4, 22: 1}
Did not match all atoms present	1302-81-4	[Al+3].[Al+3].[S-2].[S-2].[S-2]	{}
Did not match all atoms present	1302-82-5	[Al+3].[Al+3].[Se-2].[Se-2].[Se-2]	{}
Did not match all atoms present	1302-84-7	F[Al-](F)(F)F.F[Al-2](F)(F)(F)F.F[Al-2](F)(F)(F)F.[Na+].[Na+].[Na+].[Na+].[Na+]	{16: 14}
Did not match all atoms present	13020-57-0	C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)O	{24: 1, 21: 1, 14: 9}
Did not match all atoms present	13020-83-2	C[N+](C)(C)C1=NC=NC2=C1NC=N2.[Cl-]	{32: 1, 1: 3, 35: 3, 14: 2, 17: 1}
Did not match all atoms present	130209-82-4	CC(C)OC(=O)CCCC=CCC1C(CC(C1CCC(CCC2=CC=CC=C2)O)O)O	{1: 2, 2: 8, 3: 2, 6: 2, 11: 1, 12: 4, 14: 5, 20: 3, 28: 1}
Did not match all atoms present	13021-14-2	CC1=CC(=C(C(=C1)C)NC)C	{1: 4, 14: 2, 31: 1}
Did not match all atoms present	13021-15-3	CC1=CC(=C(C(=C1)C)N(C)C)C	{1: 5, 14: 2, 33: 1}
Did not match all atoms present	13021-71-1	CC1=CC(=NC=C1)NCC2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 14: 8, 31: 1}
Did not match all atoms present	130221-27-1	CCN=N[O-].[K+]	{1: 1, 2: 1, 34: 2, 29: 1}
Did not match all atoms present	130221-78-2	CC=COCC1COC(=O)O1	{1: 1, 2: 1, 6: 2, 11: 1, 12: 1, 22: 1}
Did not match all atoms present	130222-35-4	CCCCCCCC/C=C\CCCCCCCCN.CCCCC(CC)COP(=O)(O)O	{1: 3, 2: 20, 3: 1, 6: 2, 20: 2, 22: 1, 29: 1, 30: 1}
Did not match all atoms present	13024-49-2	C1=CC=C(C=C1)CCC2=CC=C(C=C2)N	{2: 2, 30: 1, 14: 9}
Did not match all atoms present	13024-80-1	CCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 25, 14: 5}
Did not match all atoms present	13024-90-3	CC1=NN(C(=O)C1)C2=CC=C(C=C2)Cl	{1: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	13025-29-1	C(COC(=O)OCCN=C=O)N=C=O	{8: 2, 2: 4, 34: 2, 29: 2}
Did not match all atoms present	13025-73-5	[2H]C([2H])([2H])C#C	{1: 1, 10: 1, 9: 1}
Did not match all atoms present	13025-82-6	CCCCCCCCCCCCC(C)[N+](C)(C)[O-]	{1: 4, 2: 11, 3: 1, 29: 1}
Did not match all atoms present	13026-12-5	C1=CC=C2C(=C1)C=CC=C2/C=C/C(=O)O	{27: 1, 14: 7, 6: 2}
Did not match all atoms present	13027-28-6	C1=CC(=CC=C1C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O2)C4=CC=C(C=C4)O)O	{18: 4, 28: 1, 13: 1, 14: 8, 21: 2}
Did not match all atoms present	13029-08-8	C1=CC=C(C(=C1)C2=CC=CC=C2Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	13029-09-9	C1=CC=C(C(=C1)C2=CC=CC=C2Br)Br	{18: 2, 14: 8}
Did not match all atoms present	130296-88-7	C([C@@H](C(=O)O)N)C(=O)[O-].[NH4+]	{24: 1, 27: 1, 2: 1, 3: 1, 30: 1}
Did not match all atoms present	1303-00-0	[Ga]#[As]	{}
Did not match all atoms present	1303-11-3	[As]#[In]	{}
Did not match all atoms present	1303-28-2	O=[As](=O)O[As](=O)=O	{29: 4, 22: 1}
Did not match all atoms present	1303-33-9	S1[As]2S[As]3S[As]1S[As](S2)S3	{41: 6}
Did not match all atoms present	1303-36-2	[As](=[Se])[Se][As]=[Se]	{}
Did not match all atoms present	1303-37-3	[As](=[Se])(=[Se])[Se][As](=[Se])=[Se]	{}
Did not match all atoms present	1303-39-5	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Zn+2].[Zn+2].[Zn+2]	{29: 8}
Did not match all atoms present	1303-57-7	O.[Au].[Au]	{}
Did not match all atoms present	1303-58-8	[O-2].[O-2].[O-2].[Au+3].[Au+3]	{}
Did not match all atoms present	1303-60-2	[SH-].[Au].[Au+]	{}
Did not match all atoms present	1303-61-3	[S-2].[S-2].[S-2].[Au+3].[Au+3]	{}
Did not match all atoms present	1303-96-4	O.O.O.O.O.O.O.O.O.O.O=BOB([O-])OB([O-])OB=O.[Na+].[Na+]	{29: 4, 22: 3}
Did not match all atoms present	13030-26-7	CC1CCC2=CC=CC=C2O1	{1: 1, 11: 2, 12: 1, 14: 4, 23: 1}
Did not match all atoms present	130309-33-0	C1[C@@H](N(CC2=CC=CC=C21)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O	{33: 1, 2: 1, 11: 2, 12: 2, 14: 12, 27: 1, 28: 1}
Did not match all atoms present	13031-13-5	COC(C#N)C1=CC=CC=C1	{1: 1, 3: 1, 22: 1, 14: 5, 37: 1}
Did not match all atoms present	13031-32-8	[2H]C([2H])([2H])[N+](=O)[O-]	{1: 1, 38: 1}
Did not match all atoms present	13031-41-9	CC(=O)OC1=CC=C(C=C1)C#N	{1: 1, 28: 1, 37: 1, 14: 4}
Did not match all atoms present	13031-43-1	CC(=O)C1=CC=C(C=C1)OC(=O)C	{24: 1, 1: 2, 28: 1, 14: 4}
Did not match all atoms present	13031-49-7	COC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	130328-27-7	C1=CC2=C(C=C1C(=O)NC3=CC(=C(C=C3)N)S(=O)(=O)[O-])N=C(C(=N2)Cl)Cl.[Na+]	{35: 2, 14: 6, 17: 2, 24: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	13033-91-5	CCN1C2=CC=CC=C2OC1=CC=C3C(=O)N(C(=S)N3C4=CC=CC=C4)CC	{1: 2, 2: 2, 6: 2, 33: 3, 14: 9, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	13035-04-6	CC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)[O-].[Na+]	{1: 1, 29: 3, 14: 6}
Did not match all atoms present	13036-02-7	COC(=O)C1=CC(=CC(=C1)O)C(=O)OC	{1: 2, 28: 2, 21: 1, 14: 3}
Did not match all atoms present	13036-19-6	COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N	{1: 1, 34: 1, 37: 1, 6: 1, 14: 8, 22: 1}
Did not match all atoms present	13036-75-4	O=S(=O)(OS(=O)(=O)F)F	{16: 2, 29: 4, 22: 1}
Did not match all atoms present	13036-87-8	CCNC(=S)S	{1: 1, 2: 1, 31: 1, 39: 1, 7: 1}
Did not match all atoms present	13037-14-4	CCNC(=S)SC	{40: 1, 1: 2, 2: 1, 31: 1, 7: 1}
Did not match all atoms present	13037-20-2	CCSC(=S)NC1=CC=CC=C1	{1: 1, 2: 1, 7: 1, 40: 1, 14: 5, 31: 1}
Did not match all atoms present	13037-55-3	C1C(=O)N(C(=S)S1)C2=CC=C(C=C2)Cl	{33: 1, 41: 1, 11: 1, 14: 4, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	13037-56-4	C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)C3=CC=CC=C3	{33: 1, 6: 1, 41: 1, 14: 10, 15: 2, 25: 1}
Did not match all atoms present	13037-60-0	C1=CC=C(C(=C1)N=C=S)Br	{8: 1, 18: 1, 34: 1, 14: 4}
Did not match all atoms present	13037-79-1	CC1=C(C(=CC=C1)O)C(C)(C)C	{1: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	13037-86-0	CCCCCCCOC1=CC=C(C=C1)O	{1: 1, 2: 6, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	130381-14-5	CCCCCCCCCCCC[N+](C)(C)CC(COCCOC1C(C(C(OC1O)COCCO)OC2C(C(C(C(O2)COCCOCCO)O)O)O)O)O.[Cl-]	{1: 3, 2: 23, 3: 1, 12: 10, 17: 1, 20: 8, 22: 6, 23: 2}
Did not match all atoms present	130381-20-3	CCC(C(=O)NC1=CC=C(C=C1)N2C(=O)CC(=N2)N3CCCC3)OC4=C(C=C(C=C4)C(C)(C)CC)C(C)(C)CC.Cl	{1: 7, 2: 3, 3: 1, 4: 2, 33: 2, 11: 5, 14: 7, 15: 1, 17: 1, 35: 1, 22: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	13039-35-5	CCCCCCCC1=NCC[N+]1(CCO)CC(=O)[O-].[OH-].[Na+]	{1: 1, 2: 9, 35: 1, 11: 2, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	1304-28-5	O=[Ba]	{29: 1}
Did not match all atoms present	1304-29-6	[O-][O-].[Ba+2]	{29: 2}
Did not match all atoms present	1304-39-8	[Se]=[Ba]	{}
Did not match all atoms present	1304-56-9	[Be]=O	{29: 1}
Did not match all atoms present	1304-82-1	[Te].[Te].[Te].[Te].[Te].[Te].[Bi].[Bi].[Bi].[Bi]	{}
Did not match all atoms present	13040-17-0	CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 16}
Did not match all atoms present	13040-18-1	CCCCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 8}
Did not match all atoms present	130412-47-4	O=P(=S)Br	{18: 1, 29: 1}
Did not match all atoms present	13042-18-7	CC(C1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 2, 3: 2, 14: 15, 31: 1}
Did not match all atoms present	13045-94-8	C1=CC(=CC=C1C[C@H](C(=O)O)N)N(CCCl)CCCl	{33: 1, 2: 5, 3: 1, 14: 4, 17: 2, 27: 1, 30: 1}
Did not match all atoms present	13046-06-5	C(NC1=NC(=NC(=N1)NCS(=O)(=O)[O-])NCS(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 3, 35: 3, 29: 9, 31: 3}
Did not match all atoms present	13047-06-8	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2Br	{24: 1, 18: 1, 14: 9}
Did not match all atoms present	13047-13-7	CC1(CN(NC1=O)C2=CC=CC=C2)CO	{32: 1, 1: 1, 2: 1, 33: 1, 11: 1, 13: 1, 14: 5, 20: 1, 25: 1}
Did not match all atoms present	13049-38-2	CCC1=CC=CC(=C1)C2=CC(=CC=C2)CC	{1: 2, 2: 2, 14: 8}
Did not match all atoms present	13049-40-6	CCC1=CC=C(C=C1)C2=CC=C(C=C2)CC	{1: 2, 2: 2, 14: 8}
Did not match all atoms present	1305-62-0	[OH-].[OH-].[Ca+2]	{}
Did not match all atoms present	1305-78-8	O=[Ca]	{29: 1}
Did not match all atoms present	1305-84-6	[Ca]=[Se]	{}
Did not match all atoms present	1305-99-3	[P-3].[P-3].[Ca+2].[Ca+2].[Ca+2]	{}
Did not match all atoms present	13050-47-0	CC1=CC=CC(=C1)C(=O)NN	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	13051-89-3	COC(=O)C1=CN=C(C=N1)C(=O)OC	{1: 2, 35: 2, 28: 2, 14: 2}
Did not match all atoms present	13052-13-6	C[N+](C)(C)CC(COC(=O)C=C)O.[Cl-]	{1: 3, 2: 2, 3: 1, 5: 1, 6: 1, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	130521-76-5	CC(C)C1=[C-]CC=C1.CC(C)C1=[C-]CC=C1.CC(C)C1=[C-]CC=C1.[Er+3]	{11: 3, 1: 6, 3: 3, 14: 6, 15: 3}
Did not match all atoms present	130525-77-8	CCCCOP(=O)(OCCCC)OCCO	{1: 2, 2: 8, 20: 1, 29: 1, 22: 3}
Did not match all atoms present	13053-54-8	C(C(F)(F)F)[O-].C(C(F)(F)F)[O-].C(C(F)(F)F)[O-].C(C(F)(F)F)[O-].C(C(F)(F)F)[O-].[Ta+5]	{16: 15, 2: 5, 4: 5, 29: 5}
Did not match all atoms present	13053-81-1	CC(=O)NC1=CC=CS1	{24: 1, 1: 1, 41: 1, 14: 3, 31: 1}
Did not match all atoms present	130536-39-9	C1=CC2=C(C3C(O3)C=C2)N=C1	{35: 1, 12: 2, 14: 5, 23: 1}
Did not match all atoms present	13055-82-8	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCNCC(C3=CC(=CC(=C3)O)O)O.Cl	{1: 2, 2: 4, 3: 1, 33: 3, 14: 4, 17: 1, 35: 1, 20: 1, 21: 2, 25: 2, 31: 1}
Did not match all atoms present	130552-91-9	CC1(C2(C(=O)/C(=C(/O)\C(F)(F)C(F)(F)C(F)(F)F)/C1CC2)C)C.CC1(C2(C(=O)/C(=C(/O)\C(F)(F)C(F)(F)C(F)(F)F)/C1CC2)C)C.O=[V]	{1: 6, 4: 6, 7: 2, 11: 4, 12: 2, 13: 4, 15: 2, 16: 14, 20: 2, 25: 2, 29: 1}
Did not match all atoms present	13056-98-9	CCN(CC)N=NC1=CC=CC=C1	{1: 2, 2: 2, 34: 2, 14: 5, 33: 1}
Did not match all atoms present	130560-97-3	C1=CC(=C(C=C1C(=S)N)Cl)F	{16: 1, 17: 1, 30: 1, 14: 3, 7: 1}
Did not match all atoms present	130570-72-8	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ru+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	13059-67-1	C[Sb](C)(C)(Cl)Cl	{1: 3, 17: 2}
Did not match all atoms present	1306-05-4	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[F-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]	{16: 1, 29: 12}
Did not match all atoms present	1306-06-5	[OH-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]	{29: 12}
Did not match all atoms present	1306-19-0	O=[Cd]	{29: 1}
Did not match all atoms present	1306-23-6	S=[Cd]	{}
Did not match all atoms present	1306-24-7	[Se]=[Cd]	{}
Did not match all atoms present	1306-25-8	[Cd]=[Te]	{}
Did not match all atoms present	1306-38-3	O=[Ce]=O	{29: 2}
Did not match all atoms present	13061-28-4	CC(=O)C1=CC(=C(C=C1Cl)Cl)Cl	{24: 1, 1: 1, 14: 2, 17: 3}
Did not match all atoms present	13061-96-6	B(C)(O)O	{1: 1, 20: 2}
Did not match all atoms present	13062-82-3	CC(C(C1=CC=C(C=C1)O)O)N.Cl	{1: 1, 3: 2, 14: 4, 17: 1, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	13065-07-1	CC1CCC2=C(C1)C=C(C=C2)C	{1: 2, 11: 3, 12: 1, 14: 3}
Did not match all atoms present	13065-64-0	CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=O)CN4CCOCC4	{1: 2, 2: 4, 33: 3, 41: 1, 11: 4, 14: 7, 23: 1, 24: 1}
Did not match all atoms present	130650-09-8	CC(C)(C)[Si](C)(C)OC1=CCCCO1	{1: 5, 4: 1, 11: 3, 14: 1, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	13066-19-8	C1=CC=C(C=C1)C=CC2=CC=CC=C2N	{30: 1, 14: 9, 6: 2}
Did not match all atoms present	13067-19-1	CC(=O)NC1=CC2=C(C=C1)OCO2	{1: 1, 11: 1, 14: 3, 23: 2, 24: 1, 31: 1}
Did not match all atoms present	13067-27-1	CCC1=CN=CC(=N1)CC	{1: 2, 2: 2, 35: 2, 14: 2}
Did not match all atoms present	13067-93-1	CCOP(=S)(C1=CC=CC=C1)OC2=CC=C(C=C2)C#N	{1: 1, 2: 1, 22: 2, 14: 9, 37: 1}
Did not match all atoms present	130678-42-1	CC(C)OC(=O)C(C(C(=O)OC(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 10, 3: 4, 28: 2, 22: 2}
Did not match all atoms present	130693-96-8	COC(=O)[C@@H](CC1=CC=CC2=CC=CC=C21)CC(=O)[O-]	{1: 1, 2: 2, 3: 1, 14: 7, 24: 1, 28: 1}
Did not match all atoms present	1307-81-9	[Na+].[Na+].Cl[Os-2](Cl)(Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	1307-96-6	O=[Co]	{29: 1}
Did not match all atoms present	1307-99-9	[Co]=[Se]	{}
Did not match all atoms present	13070-07-0	CN1CCCCC1=S	{1: 1, 11: 4, 33: 1, 15: 1}
Did not match all atoms present	13071-27-7	C1COCCN1CCC(CCN2CCOCC2)C3=CC=CC4=CC=CC=C43	{33: 2, 2: 4, 3: 1, 11: 8, 14: 7, 23: 2}
Did not match all atoms present	13071-79-9	CCOP(=S)(OCC)SCSC(C)(C)C	{40: 2, 1: 5, 2: 3, 4: 1, 22: 2}
Did not match all atoms present	130723-13-6	C1=C(C=C(C=C1F)Br)C(F)(F)F	{16: 4, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	130728-76-6	CCC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N(CC3CO3)CC4CO4)CC)N(CC5CO5)CC6CO6	{1: 2, 2: 7, 33: 2, 11: 4, 12: 4, 14: 6, 23: 4}
Did not match all atoms present	13073-29-5	CC1=C(C(=CC=C1)[N+](=O)[O-])O	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	13074-00-5	C[C@@]1(CC[C@@H]2C1(CC[C@H]3C2CC=C4C3(CC5=C(C4(C)C)ON=C5)C)C)O	{1: 5, 35: 1, 11: 6, 12: 3, 13: 4, 14: 2, 15: 1, 20: 1, 23: 1}
Did not match all atoms present	13074-85-6	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Sm+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	13074-91-4	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Dy+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	13076-29-4	COC1=CC=C(C2=CC3=CC=CC=C3C=C12)OC	{1: 2, 22: 2, 14: 8}
Did not match all atoms present	13076-44-3	CCOC(=O)C1=C[N+](=CC=C1)CC2=CC=CC=C2.[Cl-]	{1: 1, 2: 2, 33: 1, 14: 9, 17: 1, 28: 1}
Did not match all atoms present	13077-53-7	C[Sb](C)(C)(I)I	{1: 3, 19: 2}
Did not match all atoms present	13077-54-8	C[Sb](C)(C)(F)Cl	{16: 1, 1: 3, 17: 1}
Did not match all atoms present	130773-02-3	CCCCCOC1=CC=CC=C1C(=CSC)N2C=CN=C2.Cl	{1: 2, 2: 4, 35: 1, 33: 1, 6: 1, 7: 1, 40: 1, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	13078-04-1	C1CCNC(C1)C2=CN=CC=C2	{32: 1, 35: 1, 11: 4, 12: 1, 14: 4}
Did not match all atoms present	13078-15-4	C1CN(CCN1)C2=CC(=CC=C2)Cl.Cl	{32: 1, 17: 2, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	13078-79-0	C1=CC(=CC(=C1)Cl)CCN	{17: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	13078-80-3	C1=CC=C(C(=C1)CCN)Cl	{17: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	130783-02-7	C1=C(C=C(C=C1C(F)(F)F)S)C(F)(F)F	{16: 6, 4: 2, 14: 3, 39: 1}
Did not match all atoms present	130798-48-0	C1C[C@@H](NC1)C(C2=CC3=CC=CC=C3C=C2)(C4=CC5=CC=CC=C5C=C4)O	{32: 1, 4: 1, 11: 3, 12: 1, 14: 14, 20: 1}
Did not match all atoms present	1308-04-9	O=[Co]O[Co]=O	{29: 2, 22: 1}
Did not match all atoms present	1308-06-1	O=[Co].O=[Co]O[Co]=O	{29: 3, 22: 1}
Did not match all atoms present	1308-14-1	[Cr+3].[OH-].[OH-].[OH-]	{}
Did not match all atoms present	1308-38-9	O=[Cr]O[Cr]=O	{29: 2, 22: 1}
Did not match all atoms present	1308-56-1	S.S.[Fe].[Cu]	{}
Did not match all atoms present	1308-80-1	[NH2-].[Cu].[Cu].[Cu+]	{}
Did not match all atoms present	1308-85-6	[OH-].[OH-].[OH-].[Dy+3]	{}
Did not match all atoms present	1308-87-8	O=[Dy]O[Dy]=O	{29: 2, 22: 1}
Did not match all atoms present	1308-96-9	[O-2].[O-2].[O-2].[Eu+3].[Eu+3]	{}
Did not match all atoms present	13080-43-8	CCC(=O)OC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 1, 28: 1, 14: 7}
Did not match all atoms present	13080-89-2	C1=CC(=CC=C1N)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)N	{30: 2, 22: 2, 14: 16, 29: 2}
Did not match all atoms present	13081-17-9	C1CCC(CC1)C2=C(C=CC(=C2)Cl)O	{17: 1, 11: 5, 12: 1, 21: 1, 14: 3}
Did not match all atoms present	13081-67-9	CCO[Si](CC=C)(CC=C)OCC	{1: 2, 2: 4, 22: 2, 5: 2, 6: 2}
Did not match all atoms present	13082-24-1	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=O)CN4CCOCC4)N(C)C	{1: 3, 2: 2, 3: 1, 33: 3, 41: 1, 11: 4, 14: 7, 23: 1, 24: 1}
Did not match all atoms present	13083-37-9	C1=CC=C2C(=C1)NC(=S)N2CCC3=CC=NC=C3	{32: 1, 33: 1, 2: 2, 35: 1, 14: 8}
Did not match all atoms present	13083-94-8	C(CCC[Si](Cl)(Cl)Cl)CC[Si](Cl)(Cl)Cl	{17: 6, 2: 6}
Did not match all atoms present	13086-84-5	CC(C)(C)OP(O)OC(C)(C)C	{1: 6, 4: 2, 22: 2, 20: 1}
Did not match all atoms present	13087-53-1	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)NC)I.CNCC(C(C(C(CO)O)O)O)O	{1: 3, 2: 2, 3: 4, 19: 3, 20: 5, 24: 2, 27: 1, 31: 3}
Did not match all atoms present	13088-89-6	CCCCCCCCCSP(=O)(C)OCC	{40: 1, 1: 3, 2: 9, 29: 1, 22: 1}
Did not match all atoms present	130882-76-7	COC(=C1C=CC=C1)[O-].COC(=C1C=CC=C1)[O-].C1CN(CCC1C2CCN(CC2)C(=C3C=CC=C3)[O-])C(=C4C=CC=C4)[O-].[Fe+2].[Fe+2]	{1: 2, 33: 2, 7: 4, 11: 8, 12: 2, 14: 16, 15: 4, 22: 2}
Did not match all atoms present	130892-66-9	C1=CC(=C(C(=C1)Cl)OC2=CC(=C(C=C2)Cl)Cl)Cl	{17: 4, 22: 1, 14: 6}
Did not match all atoms present	130892-67-0	C1=CC(=C(C(=C1)Cl)OC2=CC(=C(C=C2Cl)Cl)Cl)Cl	{17: 5, 22: 1, 14: 5}
Did not match all atoms present	1309-33-7	[OH-].[OH-].[OH-].[Fe+3]	{}
Did not match all atoms present	1309-37-1	[Fe+3].[Fe+3].[O-2].[O-2].[O-2]	{}
Did not match all atoms present	1309-42-8	[Mg+2].[OH-].[OH-]	{}
Did not match all atoms present	1309-48-4	O=[Mg]	{29: 1}
Did not match all atoms present	1309-60-0	O=[Pb]=O	{29: 2}
Did not match all atoms present	13090-26-1	C1=CC=C2C(=C1)C=CC3=NN4C(=NN32)C=CC5=CC=CC=C54	{33: 2, 35: 2, 14: 12, 15: 2}
Did not match all atoms present	13090-49-8	C1=C2C3=CSC=C3SC2=CS1	{41: 3, 14: 4}
Did not match all atoms present	13091-80-0	C1=C(C=C(C2=NNN=C21)[N+](=O)[O-])Cl	{32: 1, 17: 1, 35: 2, 38: 1, 14: 2}
Did not match all atoms present	13092-49-4	C1=CC(=CC=C1C(=O)NN)OC2=CC=C(C=C2)C(=O)NN	{24: 2, 30: 2, 22: 1, 14: 8, 31: 2}
Did not match all atoms present	13093-17-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ce+4]	{}
Did not match all atoms present	13093-88-4	CC(CN1CCC(CC1)O)CN2C3=CC=CC=C3SC4=C2C=C(C=C4)OC	{1: 2, 2: 2, 3: 1, 33: 2, 41: 1, 11: 4, 12: 1, 14: 7, 20: 1, 22: 1}
Did not match all atoms present	130933-92-5	C1=CC2=CC3=C(C=CC4=C3C=CC5C4O5)C6=C2C(=C1)C=C6	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	13094-50-3	C1=CC(=CC=C1[N+](=O)[O-])OCCCBr	{38: 1, 2: 3, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	13097-10-4	C1C(=O)N(C(=S)S1)NC2=CC=CC=C2	{33: 1, 41: 1, 11: 1, 14: 5, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	13098-39-0	C(=O)(C(F)(F)F)C(F)(F)F.C(=O)(C(F)(F)F)C(F)(F)F.O.O.O	{16: 12, 24: 2, 4: 4}
Did not match all atoms present	13099-50-8	CC(=CC1=CC=CC=C1)Cl	{1: 1, 17: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	131-01-1	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=CC=CC=C45)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC	{32: 1, 1: 5, 33: 1, 11: 5, 12: 6, 14: 6, 22: 4, 28: 2}
Did not match all atoms present	131-04-4	COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)OC)OC.[OH-]	{1: 4, 11: 2, 22: 4, 14: 6, 33: 1}
Did not match all atoms present	131-08-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)O.[Na+]	{25: 2, 20: 1, 29: 2, 14: 7}
Did not match all atoms present	131-09-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)Cl	{17: 1, 14: 7, 25: 2}
Did not match all atoms present	131-11-3	COC(=O)C1=CC=CC=C1C(=O)OC	{1: 2, 28: 2, 14: 4}
Did not match all atoms present	131-13-5	CC1=C(C2=CC=CC=C2C(=C1)OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 22: 2, 14: 5, 29: 6}
Did not match all atoms present	131-14-6	C1=CC2=C(C=C1N)C(=O)C3=C(C2=O)C=C(C=C3)N	{25: 2, 30: 2, 14: 6}
Did not match all atoms present	131-15-7	CCCCCCC(C)OC(=O)C1=CC=CC=C1C(=O)OC(C)CCCCCC	{1: 4, 2: 10, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	131-16-8	CCCOC(=O)C1=CC=CC=C1C(=O)OCCC	{1: 2, 2: 4, 28: 2, 14: 4}
Did not match all atoms present	131-17-9	C=CCOC(=O)C1=CC=CC=C1C(=O)OCC=C	{2: 2, 14: 4, 28: 2, 5: 2, 6: 2}
Did not match all atoms present	131-18-0	CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC	{1: 2, 2: 8, 28: 2, 14: 4}
Did not match all atoms present	131-22-6	C1=CC=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)N	{34: 2, 30: 1, 14: 11}
Did not match all atoms present	131-27-1	C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)O)N)S(=O)(=O)O	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	131-28-2	CN(C)CCC1=CC2=C(C(=C1CC(=O)C3=C(C(=C(C=C3)OC)OC)C(=O)O)OC)OCO2	{1: 5, 2: 3, 33: 1, 11: 1, 14: 3, 22: 3, 23: 2, 24: 1, 27: 1}
Did not match all atoms present	131-43-1	C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)C=CC5=C(C=C(C=C5)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{33: 1, 35: 2, 38: 1, 6: 2, 14: 11, 20: 3, 29: 6}
Did not match all atoms present	131-49-7	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)NC(=O)C)I.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O	{1: 3, 2: 2, 3: 4, 19: 3, 20: 5, 24: 2, 27: 1, 31: 3}
Did not match all atoms present	131-52-2	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[O-].[Na+]	{17: 5}
Did not match all atoms present	131-53-3	COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2O)O	{24: 1, 1: 1, 22: 1, 21: 2, 14: 7}
Did not match all atoms present	131-54-4	COC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)OC)O)O	{24: 1, 1: 2, 22: 2, 21: 2, 14: 6}
Did not match all atoms present	131-55-5	C1=CC(=C(C=C1O)O)C(=O)C2=C(C=C(C=C2)O)O	{24: 1, 21: 4, 14: 6}
Did not match all atoms present	131-56-6	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)O)O	{24: 1, 21: 2, 14: 8}
Did not match all atoms present	131-57-7	COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{24: 1, 1: 1, 22: 1, 21: 1, 14: 8}
Did not match all atoms present	131-58-8	CC1=CC=CC=C1C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9}
Did not match all atoms present	131-65-7	CCC1=CC=CC=C1N2C(=O)CC(=N2)C	{1: 2, 2: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 25: 1}
Did not match all atoms present	131-69-1	CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)O	{1: 1, 14: 8, 24: 2, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	131-70-4	CCCCOC(=O)C1=CC=CC=C1C(=O)O	{1: 1, 2: 3, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	131-72-6	CCCCCCC(C)C1=CC(=CC(=C1OC(=O)/C=C/C)[N+](=O)[O-])[N+](=O)[O-]	{1: 3, 2: 5, 3: 1, 38: 2, 6: 2, 14: 2, 28: 1}
Did not match all atoms present	131-73-7	C1=C(C=C(C(=C1[N+](=O)[O-])NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 6, 14: 4, 31: 1}
Did not match all atoms present	131-74-8	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-].[NH4+]	{38: 3, 14: 2}
Did not match all atoms present	131-79-3	CC1=CC=CC=C1N=NC2=C(C=CC3=CC=CC=C32)N	{1: 1, 34: 2, 30: 1, 14: 10}
Did not match all atoms present	131-89-5	C1CCC(CC1)C2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 11: 5, 12: 1, 21: 1, 14: 2}
Did not match all atoms present	131-91-9	C1=CC=C2C(=C1)C=CC(=C2N=O)O	{34: 1, 21: 1, 14: 6, 29: 1}
Did not match all atoms present	131-92-0	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C5=C(C=C4)C6=CC(=C7C(=C6N5)C(=O)C8=CC=CC=C8C7=O)NC(=O)C9=CC=CC=C9	{24: 2, 25: 4, 32: 1, 14: 20, 31: 2}
Did not match all atoms present	131-99-7	C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 2, 20: 4, 22: 1, 23: 1, 25: 1, 29: 1}
Did not match all atoms present	1310-03-8	O.O.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2].[Pb+2]	{16: 6, 29: 18}
Did not match all atoms present	1310-32-3	[Fe]=[Se]	{}
Did not match all atoms present	1310-43-6	P(#[Fe])=[Fe]	{}
Did not match all atoms present	1310-52-7	[Mg].[Mg].[GeH4]	{}
Did not match all atoms present	1310-53-8	O=[Ge]=O	{29: 2}
Did not match all atoms present	1310-58-3	[OH-].[K+]	{}
Did not match all atoms present	1310-61-8	[SH-].[K+]	{}
Did not match all atoms present	1310-65-2	[Li+].[OH-]	{}
Did not match all atoms present	1310-66-3	[Li+].O.[OH-]	{}
Did not match all atoms present	1310-73-2	[OH-].[Na+]	{}
Did not match all atoms present	1310-82-3	[OH-].[Rb+]	{}
Did not match all atoms present	1310-97-0	[OH-].[OH-].[Mn+2]	{}
Did not match all atoms present	13100-82-8	C(C(C(=O)O)N)S(=O)(=O)O	{2: 1, 3: 1, 20: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	13103-75-8	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=N2	{1: 2, 34: 2, 35: 1, 14: 8, 33: 1}
Did not match all atoms present	13104-21-7	COP(=O)(OC)OC(=CBr)C1=C(C=C(C=C1)Cl)Cl	{1: 2, 6: 1, 7: 1, 14: 3, 17: 2, 18: 1, 22: 3, 29: 1}
Did not match all atoms present	13106-44-0	C[N+](C)(C)CCOC(=O)C=C.COS(=O)(=O)[O-]	{1: 4, 2: 2, 5: 1, 6: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	13106-47-3	[Be+2].C(=O)([O-])[O-]	{24: 1}
Did not match all atoms present	13106-53-1	CCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)C.[Cl-]	{1: 2, 2: 15, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	13106-76-8	[NH4+].[NH4+].[O-][Mo](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	13107-00-1	CC[N+](CC)(CC=C)CC=C.[Cl-]	{1: 2, 2: 4, 5: 2, 6: 2, 17: 1}
Did not match all atoms present	13108-52-6	CS(=O)(=O)C1=C(C(=NC(=C1Cl)Cl)Cl)Cl	{1: 1, 35: 1, 29: 2, 17: 4}
Did not match all atoms present	131083-49-3	CC(=O)O.C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.O=[Ru]=O.Cl.Cl	{1: 1, 27: 1, 29: 2, 14: 20, 17: 2}
Did not match all atoms present	1311-10-0	O.O.O.O.O.O.O.O.[OH-].[OH-].[Sr+2]	{}
Did not match all atoms present	1311-33-7	[OH-].[OH-].[OH-].[Tm+3]	{}
Did not match all atoms present	1311-90-6	[NH4+].[NH4+].[NH4+].O.O.O.[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-]P(=O)([O-])[O-].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W]	{29: 4}
Did not match all atoms present	13110-37-7	CCCCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 4, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	13113-71-8	C[C@](C1=CC=CC=C1)(C(=O)O)O	{1: 1, 27: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	13114-23-3	CN=CC1=CC=C(C=C1)OC	{1: 2, 22: 1, 34: 1, 14: 4, 6: 1}
Did not match all atoms present	13114-62-0	C1=CC=C2C=C(C=CC2=C1)NC(=O)N	{24: 1, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	13114-72-2	CNC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2	{24: 1, 1: 1, 33: 1, 14: 10, 31: 1}
Did not match all atoms present	13114-87-9	C1=CC(=CC(=C1)NC(=O)N)C(F)(F)F	{4: 1, 14: 4, 16: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	13114-90-4	C1=CC=C(C(=C1)NC(=O)N)Br	{24: 1, 18: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	13114-93-7	C1=CC=C(C(=C1)NC(=O)N)I	{24: 1, 19: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	131145-80-7	C[N+](C)(C)C.I[Pt]I	{1: 4, 19: 2}
Did not match all atoms present	131147-89-2	CC1=C(C(=CC=C1)C)NC(=O)CN2C(CCC2=O)O	{1: 2, 2: 1, 33: 1, 11: 2, 12: 1, 14: 3, 20: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	131147-93-8	CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)CCC(=O)O	{1: 2, 2: 3, 14: 3, 24: 2, 27: 1, 31: 2}
Did not match all atoms present	13115-28-1	C1=CC=C2C=C(C(=CC2=C1)N)[N+](=O)[O-]	{38: 1, 30: 1, 14: 6}
Did not match all atoms present	13115-40-7	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)S(=O)(=O)N(C)C)N(C)C.CS(=O)(=O)O	{1: 6, 2: 1, 3: 1, 33: 3, 41: 1, 14: 7, 20: 1, 29: 4}
Did not match all atoms present	13116-27-3	C1=CC(=CC=C1NN)I	{19: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	13117-94-7	CC1=C(C(=CC=C1)C(C)(C)C)N	{1: 4, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	13118-04-2	C1=CC=C(C(=C1)N2C(=O)C=CC2=O)N3C(=O)C=CC3=O	{25: 4, 14: 8, 33: 2}
Did not match all atoms present	13118-10-0	CN1CCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O.Cl	{1: 1, 4: 1, 33: 1, 11: 7, 12: 2, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	1312-03-4	[O-2].[O-2].[O-]S(=O)(=O)[O-].[Hg+2].[Hg+2].[Hg+2]	{29: 4}
Did not match all atoms present	1312-15-8	S.I	{19: 1}
Did not match all atoms present	1312-41-0	[In]#[Sb]	{}
Did not match all atoms present	1312-43-2	[O-2].[O-2].[O-2].[In+3].[In+3]	{}
Did not match all atoms present	1312-45-4	[In]=[Te].[In]=[Te].[Te]	{}
Did not match all atoms present	1312-46-5	[O-2].[O-2].[O-2].[Ir+3].[Ir+3]	{}
Did not match all atoms present	1312-73-8	[K].[K].[S]	{}
Did not match all atoms present	1312-74-9	[K+].[K+].[Se-2]	{}
Did not match all atoms present	1312-95-4	[O-][O-].[Mg+2]	{29: 2}
Did not match all atoms present	13120-03-1	CN(C)C(=[Se])C1=CC=CC=C1	{1: 2, 33: 1, 14: 5, 7: 1}
Did not match all atoms present	13120-77-9	CC1=C(C=C(C=C1)[N+](=O)[O-])OC	{1: 2, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	13121-70-5	C1CCC(CC1)[Sn](C2CCCCC2)C3CCCCC3.O	{11: 15, 12: 3}
Did not match all atoms present	13121-71-6	CC(=O)O[Sn](C1CCCCC1)(C2CCCCC2)C3CCCCC3	{1: 1, 11: 15, 12: 3, 28: 1}
Did not match all atoms present	13121-76-1	C1CCC(CC1)[Sn](C2CCCCC2)(C3CCCCC3)S[Sn](C4CCCCC4)(C5CCCCC5)C6CCCCC6	{40: 1, 11: 30, 12: 6}
Did not match all atoms present	131220-68-3	C1=CC=C(C=C1)C2=C3C=CC=CC3=CC4=C5NC(=C42)NC6=C7C=C8C=CC=CC8=C(C7=C([N-]6)NC9=C1C=C2C=CC=CC2=C(C1=C(N9)NC1=C2C=C3C=CC=CC3=C(C2=C(N5)[N-]1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1.O=[V+2]	{32: 6, 35: 2, 29: 1, 14: 40}
Did not match all atoms present	131229-60-2	CCCCOC1=C(C=CC(=C1)OC)C(=O)NOC(=O)C	{1: 3, 2: 3, 14: 3, 22: 2, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	131229-61-3	CCCCOC1=C(C=CC(=C1)C)C(=O)NOC(=O)C	{1: 3, 2: 3, 14: 3, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	131229-62-4	CCCCOC1=C(C=CC(=C1)Cl)C(=O)NOC(=O)C	{1: 2, 2: 3, 14: 3, 17: 1, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	131229-64-6	CCCCON(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])OC(=O)C	{1: 2, 2: 3, 38: 1, 14: 4, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	13125-51-4	C[Si](C)(N=C=S)N=C=S	{8: 2, 1: 2, 34: 2}
Did not match all atoms present	13126-12-0	[N+](=O)([O-])[O-].[Rb+]	{}
Did not match all atoms present	131263-08-6	C1=CC=C(C(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)[N+](=O)[O-]	{32: 1, 35: 1, 37: 1, 6: 1, 7: 1, 14: 8, 38: 1}
Did not match all atoms present	131263-09-7	C1=CC=C2C(=C1)NC(=N2)/C(=C/C3=CC(=CC=C3)O)/C#N	{32: 1, 35: 1, 37: 1, 6: 1, 7: 1, 14: 8, 21: 1}
Did not match all atoms present	131263-10-0	C1=CC=C2C(=C1)NC(=C(C=C3C=CC(=O)C=C3)C#N)N2	{32: 2, 37: 1, 6: 1, 7: 1, 14: 8, 15: 2, 25: 1}
Did not match all atoms present	13127-50-9	CN1C2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3	{1: 1, 14: 10, 33: 1}
Did not match all atoms present	13127-88-3	[2H]C1=C(C(=C(C(=C1[2H])[2H])O[2H])[2H])[2H]	{21: 1, 14: 5}
Did not match all atoms present	13129-23-2	COC(=O)C1=COC=C1	{1: 1, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	13129-35-6	C1=COC(=C1)S	{39: 1, 14: 3, 23: 1}
Did not match all atoms present	13129-38-9	CSC1=CC=CO1	{40: 1, 1: 1, 14: 3, 23: 1}
Did not match all atoms present	1313-13-9	O=[Mn]=O	{29: 2}
Did not match all atoms present	1313-22-0	[Mn]=[Se]	{}
Did not match all atoms present	1313-27-5	O=[Mo](=O)=O	{29: 3}
Did not match all atoms present	1313-29-7	O.O.O.[Mo].[Mo]	{}
Did not match all atoms present	1313-59-3	[O-2].[Na+].[Na+]	{}
Did not match all atoms present	1313-60-6	[O-][O-].[Na+].[Na+]	{29: 2}
Did not match all atoms present	1313-82-2	[Na+].[Na+].[S-2]	{}
Did not match all atoms present	1313-83-3	O.O.O.O.O.[Na+].[Na+].[S-2]	{}
Did not match all atoms present	1313-85-5	[Na+].[Na+].[Se-2]	{}
Did not match all atoms present	1313-96-8	O=[Nb](=O)O[Nb](=O)=O	{29: 4, 22: 1}
Did not match all atoms present	1313-99-1	O=[Ni]	{29: 1}
Did not match all atoms present	13130-19-3	C1CCC2=C(C1)C3=CC=CC=C3O2	{11: 4, 14: 4, 23: 1}
Did not match all atoms present	13132-15-5	C1=CC=C(C=C1)CC2=CC=CS2	{41: 1, 2: 1, 14: 8}
Did not match all atoms present	13132-25-7	C[Si](C)(C)C1=CC=C(C=C1)O	{1: 3, 21: 1, 14: 4}
Did not match all atoms present	13132-73-5	C1=CC=NC(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Br)O	{32: 1, 35: 2, 12: 1, 14: 7, 15: 1, 18: 1, 20: 1, 25: 1}
Did not match all atoms present	131323-86-9	C(P)(Cl)(Cl)Cl	{17: 3, 4: 1}
Did not match all atoms present	13138-33-5	C(CN)CP(=O)(O)O	{2: 3, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	13138-36-8	CCCC(N)P(=O)(O)O	{1: 1, 2: 2, 3: 1, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	13138-45-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ni+2]	{}
Did not match all atoms present	13138-53-9	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)N)C(=O)N	{24: 2, 38: 1, 30: 2, 14: 3}
Did not match all atoms present	13139-12-3	CC(C)(C)OC(=O)ON1C(=O)CCC1=O	{1: 3, 11: 2, 4: 1, 33: 1, 25: 2}
Did not match all atoms present	13139-14-5	CC(C)(C)OC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O	{32: 1, 1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	13139-17-8	C1CC(=O)N(C1=O)OC(=O)OCC2=CC=CC=C2	{25: 2, 2: 1, 11: 2, 14: 5, 33: 1}
Did not match all atoms present	1314-05-2	[Ni]=[Se]	{}
Did not match all atoms present	1314-08-5	O=[Pd]	{29: 1}
Did not match all atoms present	1314-11-0	[O-2].[Sr+2]	{}
Did not match all atoms present	1314-13-2	O=[Zn]	{29: 1}
Did not match all atoms present	1314-15-4	[O].[O].[Pt]	{}
Did not match all atoms present	1314-18-7	[O-][O-].[Sr+2]	{29: 2}
Did not match all atoms present	1314-20-1	O=[Th]=O	{29: 2}
Did not match all atoms present	1314-23-4	O=[Zr]=O	{29: 2}
Did not match all atoms present	1314-24-5	O=POP=O	{29: 2, 22: 1}
Did not match all atoms present	1314-28-9	O=[Re](=O)=O	{29: 3}
Did not match all atoms present	1314-32-5	O=[Tl]O[Tl]=O	{29: 2, 22: 1}
Did not match all atoms present	1314-34-7	O=[V]O[V]=O	{29: 2, 22: 1}
Did not match all atoms present	1314-35-8	O=[W](=O)=O	{29: 3}
Did not match all atoms present	1314-41-6	O1[Pb]O[Pb]2O[Pb]1O2	{23: 4}
Did not match all atoms present	1314-56-3	O=P(=O)OP(=O)=O	{29: 4, 22: 1}
Did not match all atoms present	1314-60-9	O=[Sb](=O)O[Sb](=O)=O	{29: 4, 22: 1}
Did not match all atoms present	1314-61-0	O=[Ta](=O)O[Ta](=O)=O	{29: 4, 22: 1}
Did not match all atoms present	1314-62-1	O=[V](=O)O[V](=O)=O	{29: 4, 22: 1}
Did not match all atoms present	1314-64-3	[O-]S(=O)(=O)[O-].O=[U+2]=O	{29: 6}
Did not match all atoms present	1314-68-7	O=[Re](=O)(=O)O[Re](=O)(=O)=O	{29: 6, 22: 1}
Did not match all atoms present	1314-80-3	S=P(=S)SP(=S)=S	{40: 1}
Did not match all atoms present	1314-85-8	P12P3P1SP(S2)S3	{41: 3}
Did not match all atoms present	1314-86-9	P12P3P1[Se]P([Se]2)[Se]3	{}
Did not match all atoms present	1314-87-0	S=[Pb]	{}
Did not match all atoms present	1314-90-5	[Se-2].[Pb+2]	{}
Did not match all atoms present	1314-91-6	[Te]=[Pb]	{}
Did not match all atoms present	1314-95-0	S=[Sn]	{}
Did not match all atoms present	1314-96-1	S=[Sr]	{}
Did not match all atoms present	1314-98-3	S=[Zn]	{}
Did not match all atoms present	13140-49-3	CC1=CC=CC=C1NC(=O)NC2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 2}
Did not match all atoms present	13140-83-5	C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)NC4=CC=CC=C4	{24: 2, 2: 1, 14: 18, 31: 4}
Did not match all atoms present	13141-45-2	C1=CC=C(C=C1)C=CC#CC2=CC=CC=C2	{10: 2, 14: 10, 6: 2}
Did not match all atoms present	13142-86-4	CCOC1=CC=CC(=C1)NC(=O)N	{1: 1, 2: 1, 14: 4, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	131447-40-0	CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)Cl	{1: 2, 2: 2, 33: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	13145-41-0	C(#N)N=C([S-])[S-].[K+].[K+]	{34: 1, 37: 1, 7: 1}
Did not match all atoms present	131457-46-0	CC(C)(C1=N[C@H](CO1)C2=CC=CC=C2)C3=N[C@H](CO3)C4=CC=CC=C4	{1: 2, 35: 2, 4: 1, 11: 2, 12: 2, 14: 10, 15: 2, 23: 2}
Did not match all atoms present	13146-23-1	[C-]#CC1=CC=CC=C1.[Cu+]	{10: 1, 14: 5}
Did not match all atoms present	13146-59-3	C1=CC=C2C=C(C=CC2=C1)OS(=O)(=O)O	{20: 1, 22: 1, 14: 7, 29: 2}
Did not match all atoms present	13147-57-4	C(C(=O)O)OP(=O)(O)O	{2: 1, 27: 1, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	13148-05-5	CCOC(=O)CC(=O)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 2, 6: 1, 14: 15, 24: 1, 28: 1}
Did not match all atoms present	1315-05-5	[Se].[Se].[Se].[Sb].[Sb]	{}
Did not match all atoms present	1315-06-6	[Se]=[SnH2]	{}
Did not match all atoms present	1315-11-3	[Zn]=[Te]	{}
Did not match all atoms present	13150-00-0	CCCCCCCCCCCCOCCOCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 17, 29: 3, 22: 4}
Did not match all atoms present	131513-18-3	CC1=C(C2=C3N1C(COC3=CC=C2)CN4CCOCC4)C(=O)C5=CC=CC6=CC=CC=C65	{1: 1, 2: 1, 33: 2, 11: 5, 12: 1, 14: 10, 23: 2, 24: 1}
Did not match all atoms present	13152-94-8	CC1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C	{24: 1, 1: 2, 14: 8}
Did not match all atoms present	131525-50-3	CCCCCCCCOC1=C(C=C(C=C1)C=O)OCCCCCCCC	{1: 2, 2: 14, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	13153-11-2	C1CS(=O)C1	{11: 3, 29: 1}
Did not match all atoms present	13154-24-0	CC(C)[Si](C(C)C)(C(C)C)Cl	{1: 6, 3: 3, 17: 1}
Did not match all atoms present	13156-75-7	CN(C)C(=O)C1=CC=CO1	{24: 1, 1: 2, 33: 1, 14: 3, 23: 1}
Did not match all atoms present	1316-91-2	[CH-]1C=CC=C1.C1=C[C-](C=C1)CC#N.[Fe+2]	{2: 1, 37: 1, 14: 9}
Did not match all atoms present	13161-28-9	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.[O-]Cl(=O)(=O)=O	{1: 5, 2: 3, 14: 8, 17: 1, 23: 1, 28: 1, 29: 4, 31: 2}
Did not match all atoms present	13162-43-1	CC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])Cl	{1: 1, 35: 2, 38: 1, 17: 2}
Did not match all atoms present	131634-71-4	C1=CC(=C(C=C1Br)C(=O)NN)Cl	{14: 3, 17: 1, 18: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	13164-03-9	CC(C)(C=C)C1=CC2=C(C=C3C(=C2)C=CO3)OC1=O	{1: 2, 4: 1, 5: 1, 6: 1, 14: 5, 23: 1, 28: 1}
Did not match all atoms present	13165-68-9	C1=CC(=CC=C1N=S=O)Cl	{40: 1, 17: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	131689-26-4	CCCCC(C(CO)(CO)CS(=O)(=O)[O-])O.CC1CO1.C1CO1.[Na+]	{1: 2, 2: 6, 3: 1, 4: 1, 11: 3, 12: 1, 20: 3, 23: 2, 29: 3}
Did not match all atoms present	1317-25-5	C1(C(=O)NC(=O)N1)NC(=O)N[Al]Cl.O.O.O.O.[Al]	{32: 2, 12: 1, 17: 1, 24: 1, 25: 2, 31: 2}
Did not match all atoms present	1317-33-5	S=[Mo]=S	{}
Did not match all atoms present	1317-34-6	O=[Mn]O[Mn]=O	{29: 2, 22: 1}
Did not match all atoms present	1317-36-8	O=[Pb]	{29: 1}
Did not match all atoms present	1317-37-9	S=[Fe]	{}
Did not match all atoms present	1317-38-0	O=[Cu]	{29: 1}
Did not match all atoms present	1317-39-1	[Cu].[Cu].[O]	{}
Did not match all atoms present	1317-40-4	S=[Cu]	{}
Did not match all atoms present	1317-41-5	[Cu+2].[Se-2]	{}
Did not match all atoms present	1317-42-6	S=[Co]	{}
Did not match all atoms present	1317-43-7	[Mg+2].[OH-].[OH-]	{}
Did not match all atoms present	1317-66-4	[S-][S-].[Fe+2]	{}
Did not match all atoms present	13170-05-3	CC(C)(C)C1=CC=C(C=C1)C(=O)O[Al]OC(=O)C2=CC=C(C=C2)C(C)(C)C.O	{1: 6, 4: 2, 14: 8, 28: 2}
Did not match all atoms present	13170-18-8	CCO[Si](OCC)(OC(=O)C)OC(=O)C	{1: 4, 2: 2, 28: 2, 22: 2}
Did not match all atoms present	13170-22-4	CC(=O)O[Si](OC(=O)C)(OC(=O)C)OC(C)(C)C	{1: 6, 4: 1, 22: 1, 28: 3}
Did not match all atoms present	13170-23-5	CC(=O)O[Si](OC(=O)C)(OC(C)(C)C)OC(C)(C)C	{1: 8, 4: 2, 22: 2, 28: 2}
Did not match all atoms present	13170-76-8	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Hg+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	13171-00-1	CC(=O)C1=CC(=CC2=C1CCC2(C)C)C(C)(C)C	{1: 6, 4: 1, 11: 2, 13: 1, 14: 2, 24: 1}
Did not match all atoms present	13171-21-6	CCN(CC)C(=O)/C(=C(\C)/OP(=O)(OC)OC)/Cl	{1: 5, 2: 2, 33: 1, 7: 2, 17: 1, 22: 3, 24: 1, 29: 1}
Did not match all atoms present	13171-22-7	C/C(=C\C(=O)NCCOP(=O)(OC)OC)/Cl	{1: 3, 2: 2, 6: 1, 7: 1, 17: 1, 22: 3, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	13171-25-0	COC1=C(C(=C(C=C1)CN2CCNCC2)OC)OC.Cl.Cl	{32: 1, 1: 3, 2: 1, 33: 1, 11: 4, 14: 2, 17: 2, 22: 3}
Did not match all atoms present	13171-59-0	CC1=C(C(=C(C(=C1C)C)[N+](=O)[O-])C)C	{1: 5, 38: 1}
Did not match all atoms present	131718-99-5	CC(C)(CO)CO.C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC(=CC=C1OCCO)OCCO	{1: 2, 2: 6, 4: 1, 14: 8, 20: 4, 22: 2, 27: 2}
Did not match all atoms present	131724-45-3	CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)C#N)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 37: 1, 14: 4, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	13173-04-1	CCCC[Sn](OC(=O)/C=C\C(=O)OCC)(OC(=O)/C=C\C(=O)OCC)CCCC	{1: 4, 2: 8, 28: 4, 6: 4}
Did not match all atoms present	131748-56-6	C1=CC(=NC=C1CN(C(=N)N)[N+](=O)[O-])Cl	{33: 1, 2: 1, 35: 1, 36: 1, 38: 1, 7: 1, 14: 3, 17: 1, 30: 1}
Did not match all atoms present	131766-73-9	CCCC1CC(CCO1)(C)O.CC(=O)[O-]	{1: 3, 2: 2, 11: 3, 12: 1, 13: 1, 20: 1, 23: 1, 24: 1}
Did not match all atoms present	13177-25-8	C1=CC=C2C(=C1)C3=CC=CC4=C3C2=C(C=C4)N	{30: 1, 14: 9}
Did not match all atoms present	13177-28-1	C1=CC=C2C(=C1)C3=CC=CC4=C3C2=C(C=C4)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	13177-29-2	C1=CC=C2C(=C1)C3=CC=CC4=CC(=CC2=C43)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	13177-31-6	C1=CC2=C3C(=C1)C4=C(C3=CC=C2)C(=CC=C4)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	13177-32-7	C1=CC2=C3C(=C1)C4=C(C3=CC=C2)C=C(C=C4)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	13177-49-6	CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O.[Na]	{1: 1, 2: 19, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	13177-50-9	CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 21, 29: 3, 22: 1}
Did not match all atoms present	13177-52-1	CCCCCCCCCCOS(=O)(=O)O.N	{1: 1, 2: 9, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	1318-02-1	O=[Al]O[Al]=O.O=[Si]=O	{29: 4, 22: 1}
Did not match all atoms present	13180-38-6	C12=C(C(=C(C(=C1F)F)F)F)N=C(C(=C2F)F)F	{16: 7, 35: 1}
Did not match all atoms present	13180-39-7	C1=CC=C2C=NC=CC2=C1.C12=C(C(=C(C(=C1F)F)F)F)C(=NC(=C2F)F)F	{16: 7, 35: 2, 14: 7}
Did not match all atoms present	13181-17-4	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])ONC=C2C=C(C(=O)C(=C2)Br)Br	{38: 2, 6: 1, 14: 5, 15: 3, 18: 2, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	131812-48-1	CC1CC(C2=CC(=C(C=C2C1(C)C)C)C3(OCC(O3)C)C)(C)C	{1: 8, 11: 2, 12: 2, 13: 3, 14: 2, 23: 2}
Did not match all atoms present	131812-49-2	CCOC(C1=CC2=C(C=C1)C(CC(C2(C)C)C)(C)C)OCC	{1: 7, 2: 2, 3: 1, 11: 1, 12: 1, 13: 2, 14: 3, 22: 2}
Did not match all atoms present	13183-18-1	CC(C)COC(=O)OC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	13183-68-1	[1H]C(C)(C)C	{1: 3, 3: 1}
Did not match all atoms present	13183-70-5	C[Si](C)(C)C1=CC=C(C=C1)[Si](C)(C)C	{1: 6, 14: 4}
Did not match all atoms present	13183-79-4	CN1C(=S)N=NN1	{32: 1, 1: 1, 35: 2, 33: 1}
Did not match all atoms present	13184-86-6	CCOCC1=CC(=C(C=C1)O)OC	{1: 2, 2: 2, 22: 2, 21: 1, 14: 3}
Did not match all atoms present	13185-22-3	C1=C(OC(=C1)[N+](=O)[O-])/C=N/N2C=NN=C2	{33: 1, 34: 1, 35: 2, 38: 1, 6: 1, 14: 4, 23: 1}
Did not match all atoms present	131860-33-8	CO/C=C(\C1=CC=CC=C1OC2=NC=NC(=C2)OC3=CC=CC=C3C#N)/C(=O)OC	{1: 2, 35: 2, 37: 1, 6: 1, 7: 1, 14: 10, 22: 3, 28: 1}
Did not match all atoms present	13187-06-9	CN1CCC(=C2C3=CC=CC=C3SC4=CC=CC=C42)CC1	{1: 1, 33: 1, 41: 1, 11: 4, 14: 8, 15: 2}
Did not match all atoms present	1319-46-6	C(=O)([O-])[O-].C(=O)([O-])[O-].[OH-].[OH-].[Pb+2].[Pb+2].[Pb+2]	{24: 2}
Did not match all atoms present	1319-69-3	C(C(COP(=O)([O-])[O-])O)O.[K+].[K+]	{2: 2, 3: 1, 20: 2, 29: 3, 22: 1}
Did not match all atoms present	13190-34-6	C=CC1CNC(=S)O1	{32: 1, 5: 1, 6: 1, 11: 1, 12: 1, 15: 1, 23: 1}
Did not match all atoms present	13191-36-1	CC1=C(SC(=C1)Br)Br	{1: 1, 18: 2, 14: 1, 41: 1}
Did not match all atoms present	13194-48-4	CCCSP(=O)(OCC)SCCC	{40: 2, 1: 3, 2: 5, 29: 1, 22: 1}
Did not match all atoms present	13194-67-7	CC1=C(C=C(C=C1)F)I	{16: 1, 1: 1, 19: 1, 14: 3}
Did not match all atoms present	13194-68-8	CC1=C(C=CC(=C1)I)N	{1: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	13194-73-5	CC1=C(C=C(C=C1Br)N)Br	{1: 1, 18: 2, 30: 1, 14: 2}
Did not match all atoms present	13195-76-1	B(OCC(C)C)(OCC(C)C)OCC(C)C	{1: 6, 2: 3, 3: 3, 22: 3}
Did not match all atoms present	13195-79-4	C1=CC(=CC=C1C(=O)C(Br)Br)Br	{24: 1, 18: 3, 3: 1, 14: 4}
Did not match all atoms present	131980-30-8	CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC(=C1)C#N)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 37: 1, 14: 4, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	131983-72-7	CC1(CCC(=CC2=CC=C(C=C2)Cl)C1(CN3C=NC=N3)O)C	{1: 2, 2: 1, 35: 2, 6: 1, 33: 1, 11: 2, 13: 2, 14: 6, 15: 1, 17: 1, 20: 1}
Did not match all atoms present	132-16-1	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Fe+2]	{35: 8, 14: 16}
Did not match all atoms present	132-17-2	CN1[C@@H]2CC[C@@H]1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4.CS(=O)(=O)O	{1: 2, 3: 1, 33: 1, 11: 4, 12: 3, 14: 10, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	132-18-3	CN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3.Cl	{1: 1, 3: 1, 33: 1, 11: 4, 12: 1, 14: 10, 17: 1, 22: 1}
Did not match all atoms present	132-22-9	CN(C)CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2	{1: 2, 2: 2, 3: 1, 33: 1, 14: 8, 17: 1, 35: 1}
Did not match all atoms present	132-27-4	C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]	{14: 9}
Did not match all atoms present	132-29-6	C1=CC=C(C=C1)C2=CC=CC=C2OP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4	{22: 3, 14: 19, 29: 1}
Did not match all atoms present	132-31-0	CN(C)C1=CC=C(C=C1)N=C2C=CC(=O)C3=CC=CC=C23	{1: 2, 34: 1, 33: 1, 14: 10, 15: 1, 25: 1}
Did not match all atoms present	132-32-1	CCN1C2=C(C=C(C=C2)N)C3=CC=CC=C31	{1: 1, 2: 1, 30: 1, 14: 7, 33: 1}
Did not match all atoms present	132-35-4	CCC(C1=CC=CC=C1)C2=NOC(=N2)CCN(CC)CC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 7, 3: 1, 4: 1, 33: 1, 14: 5, 35: 2, 20: 1, 23: 1, 27: 3}
Did not match all atoms present	132-53-6	C1=CC=C2C(=C1)C=CC(=C2O)N=O	{34: 1, 21: 1, 14: 6, 29: 1}
Did not match all atoms present	132-54-7	C1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3C=C2)O	{28: 1, 21: 1, 14: 11}
Did not match all atoms present	132-57-0	C1=CC2=C(C=C(C=C2)O)C(=C1)S(=O)(=O)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	132-60-5	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O	{35: 1, 27: 1, 14: 10}
Did not match all atoms present	132-62-7	COC1=CC(=C(C=C1)OC)NC(=O)C2=C(C=C3C4=CC=CC=C4OC3=C2)O	{1: 2, 14: 9, 21: 1, 22: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	132-63-8	COC(=O)NC1=CC=CC2=C1C=C(C=C2)O	{1: 1, 28: 1, 21: 1, 14: 6, 31: 1}
Did not match all atoms present	132-64-9	C1=CC=C2C(=C1)C3=CC=CC=C3O2	{14: 8, 23: 1}
Did not match all atoms present	132-65-0	C1=CC=C2C(=C1)C3=CC=CC=C3S2	{41: 1, 14: 8}
Did not match all atoms present	132-66-1	C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC=CC=C3C(=O)O	{24: 1, 27: 1, 14: 11, 31: 1}
Did not match all atoms present	132-67-2	C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC=CC=C3C(=O)[O-].[Na+]	{24: 2, 14: 11, 31: 1}
Did not match all atoms present	132-68-3	C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC4=CC=CC=C4C=C3O	{24: 1, 21: 1, 14: 13, 31: 1}
Did not match all atoms present	132-69-4	CN(C)CCCOC1=NN(C2=CC=CC=C21)CC3=CC=CC=C3.Cl	{1: 2, 2: 4, 35: 1, 33: 2, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	132-75-2	C1=CC=C2C(=C1)C=CC=C2CC#N	{2: 1, 37: 1, 14: 7}
Did not match all atoms present	132-86-5	C1=CC=C2C(=C1)C=C(C=C2O)O	{21: 2, 14: 6}
Did not match all atoms present	132-87-6	C1=CC=C(C=C1)C(=O)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O	{14: 10, 20: 1, 21: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	132-88-7	C1=CC(=CC=C1C(=O)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O)[N+](=O)[O-]	{38: 1, 14: 9, 20: 1, 21: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	132-89-8	C1=CC=C2C(=C1)C(=O)NC(O2)CCCl	{32: 1, 2: 2, 12: 1, 14: 4, 17: 1, 23: 1, 25: 1}
Did not match all atoms present	132-98-9	CC1(C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)[O-])C.[K+]	{1: 2, 2: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 22: 1, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	1320-80-5	C1=CC=C(C(=C1)O)[Hg]Cl	{17: 1, 21: 1, 14: 4}
Did not match all atoms present	13200-88-9	CC(C)OC1=C(C=CC(=C1)O)OC(=O)NC	{1: 3, 3: 1, 14: 3, 21: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	13201-16-6	CC(C)(C(=O)O)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 4: 1, 14: 2, 17: 3, 22: 1, 27: 1}
Did not match all atoms present	13203-39-9	CC1=CC=C(C=C1)CCN=C=S	{8: 1, 1: 1, 2: 2, 34: 1, 14: 4}
Did not match all atoms present	13205-46-4	CC(C)OC1=CC=C(C=C1)C(=O)O	{27: 1, 1: 2, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	132054-36-5	C1=CC(=CC=C1OCCNN)OCCNN.Cl.Cl	{2: 4, 14: 4, 17: 2, 22: 2, 30: 2, 31: 2}
Did not match all atoms present	13206-67-2	C1=CC=C(C=C1)NC(=O)N(CCCl)N=O	{33: 1, 2: 2, 34: 1, 14: 5, 17: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	13207-27-7	CCCCCCCCCC1=C(C=CC(=C1)C)O	{1: 2, 2: 8, 21: 1, 14: 3}
Did not match all atoms present	13207-63-1	C1=CC2=C(C=CC(=C2N=C1)O)I	{35: 1, 19: 1, 21: 1, 14: 5}
Did not match all atoms present	13208-31-6	C1=CC(=CC(=C1)Cl)NC(=O)NC2=CC(=CC=C2)Cl	{24: 1, 17: 2, 14: 8, 31: 2}
Did not match all atoms present	13209-15-9	C1=CC=C(C(=C1)C(Br)Br)C(Br)Br	{18: 4, 3: 2, 14: 4}
Did not match all atoms present	13209-38-6	C1=CC=C(C=C1)C(C2=CC=CC=C2N)O	{3: 1, 20: 1, 30: 1, 14: 9}
Did not match all atoms present	132098-59-0	C1[C@@H](N=C(O1)CC2=N[C@H](CO2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 1, 35: 2, 11: 2, 12: 2, 14: 10, 15: 2, 23: 2}
Did not match all atoms present	1321-74-0	C=CC1=CC=CC=C1C=C	{14: 4, 5: 2, 6: 2}
Did not match all atoms present	1321-81-9	CC1=C(C(=CC=C1)O)C(C)C	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	132109-47-8	C1CN(/C(=C\2/C=CC=CC2=O)/N1)CCNC(=O)C3=CC=CC=C3O	{32: 1, 33: 1, 2: 2, 11: 2, 14: 8, 15: 2, 21: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	132123-54-7	C1=C(C=C(C(=C1F)F)F)C=O	{16: 3, 26: 1, 14: 2}
Did not match all atoms present	132128-73-5	CCCCCOP(=O)(O)O.C1(=NC(=NC(=N1)N)N)N	{1: 1, 2: 4, 35: 3, 20: 2, 22: 1, 29: 1, 30: 3}
Did not match all atoms present	13214-66-9	C1=CC=C(C=C1)CCCCN	{2: 4, 30: 1, 14: 5}
Did not match all atoms present	13214-70-5	C1=CC=C2C=C(C(=CC2=C1)Br)Br	{18: 2, 14: 6}
Did not match all atoms present	13217-74-8	C1=CC(=CC(=C1)NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=C(C=C(C=C4)C5=CC(=C(C=C5)N=NC6=C(C=C7C=C(C=CC7=C6[O-])NC8=CC=CC(=C8)C(=O)[O-])S(=O)(=O)[O-])C(=O)[O-])C(=O)[O-])S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{24: 4, 34: 4, 29: 6, 14: 22, 31: 2}
Did not match all atoms present	132184-56-6	CC1=CC=C(C=C1)C=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 14: 8, 6: 1}
Did not match all atoms present	13219-97-1	CC1=C(C=C(N1)C2=CC=CC=C2)C(=O)C	{24: 1, 1: 2, 14: 6, 32: 1}
Did not match all atoms present	1322-06-1	CCCCCC1=CC=CC=C1O	{1: 1, 2: 4, 21: 1, 14: 4}
Did not match all atoms present	1322-12-9	CCCCCCC#COC(=O)OCC	{1: 2, 2: 6, 10: 2}
Did not match all atoms present	1322-14-1	C=CCCCCCCCCC(=O)[O-].C=CCCCCCCCCC(=O)[O-].[Ca+2]	{24: 2, 2: 16, 5: 2, 6: 2}
Did not match all atoms present	1322-26-5	CC(=CC(=O)C)C1=CC=C(C=C1)OC	{1: 3, 6: 1, 7: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	1322-29-8	CCCCOCCOC(=O)C1=CN=CC=C1	{1: 1, 2: 5, 35: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	1322-48-1	C1=CC=C(C=C1)CC2=C(C(=CC=C2)O)Cl	{17: 1, 2: 1, 21: 1, 14: 8}
Did not match all atoms present	1322-69-6	CC(C)(C)CC(C)(C)C1=CC=CC=C1O	{1: 5, 2: 1, 4: 2, 21: 1, 14: 4}
Did not match all atoms present	1322-90-3	CC(=O)C1=CC=CC(=C1)/C=C\C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 6: 2}
Did not match all atoms present	132208-21-0	CCCCCCCCC1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)CCCCCCCC)CC=C	{1: 2, 2: 15, 5: 1, 6: 1, 33: 1, 41: 1, 14: 6}
Did not match all atoms present	13222-85-0	CC1=CC=C(C=C1)C(=O)OC(=O)C2=CC=C(C=C2)C	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	13223-03-5	CC[N+](C)(C)CCOC(=O)C(=C)C.CCOS(=O)(=O)[O-]	{1: 5, 2: 4, 5: 1, 7: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	13224-31-2	[2H]C(C)(C)[N+](=O)[O-]	{1: 2, 3: 1, 38: 1}
Did not match all atoms present	13225-10-0	CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{1: 1, 2: 1, 12: 5, 22: 5, 23: 1}
Did not match all atoms present	132259-10-0	CC(C)[C@]1(C(=O)N(C2=CC=CC=C2S1)C)C3=CC=CC=C3OCCCCN4CCN(CC4)CCC5=CC(=C(C(=C5)OC)OC)OC.Cl.Cl	{1: 6, 2: 6, 3: 1, 33: 3, 41: 1, 11: 4, 13: 1, 14: 10, 17: 2, 22: 4, 25: 1}
Did not match all atoms present	13228-22-3	CCC1=C(NC(=C1C)C(=O)C2=C(C(=C(N2)C)CC)C)C	{24: 1, 1: 6, 2: 2, 32: 2}
Did not match all atoms present	13228-41-6	CCCC1=CC2=CC=CC=C2N1	{32: 1, 1: 1, 2: 2, 14: 5}
Did not match all atoms present	1323-65-5	CCCCCCCCCC1=C(C(=CC=C1)O)CCCCCCCCC	{1: 2, 2: 16, 21: 1, 14: 3}
Did not match all atoms present	13230-04-1	CC1=NC(=CN1C)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 14: 1, 33: 1}
Did not match all atoms present	13238-84-1	CCC1=CN=C(C=N1)CC	{1: 2, 2: 2, 35: 2, 14: 2}
Did not match all atoms present	1324-21-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)S(=O)(=O)[O-])NC5=CC=C(C=C5)S(=O)(=O)[O-])O.[Na+].[Na+]	{25: 2, 31: 2, 21: 1, 14: 13, 29: 6}
Did not match all atoms present	1324-29-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)NC5=C(N4)C=CC6=C5C(=O)C7=C(C6=O)C(=CC=C7)S(=O)(=O)[O-].[Na+]	{32: 2, 25: 4, 29: 3, 14: 11}
Did not match all atoms present	1324-34-1	C1=CC=C2C(=C1)C3=CC4=C5C6=C(C=CC(=C36)C2=O)C=C7C5=C(C=C4)C(=O)C8=C(C(=C(C=C78)Cl)Cl)Cl	{17: 3, 14: 11, 25: 2}
Did not match all atoms present	1324-50-1	CCOC1=CC(=C(C=C1C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C)S(=O)(=O)[O-])NC4=C(C=C(C=C4)C)S(=O)(=O)[O-].[Na+]	{1: 6, 2: 1, 33: 2, 7: 1, 14: 13, 15: 2, 22: 1, 29: 6, 31: 1}
Did not match all atoms present	1324-56-7	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=C(C(=C7C8=CC=CC=C8C(=O)C9=C7C6=C5C=C9)Cl)Cl)C2=O	{17: 2, 14: 14, 25: 2}
Did not match all atoms present	1324-86-3	CC1=C(C=CC(=C1)C(=C2C=CC(=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-])C=C2)C5=CC=C(C=C5)NC6=C(C7=CC=CC=C7C=C6)S(=O)(=O)O)N.[Na+]	{1: 1, 34: 1, 7: 1, 14: 23, 15: 2, 20: 1, 29: 5, 30: 1, 31: 1}
Did not match all atoms present	13240-06-7	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Eu+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	132403-09-9	C1C2=C3C=C4C=CC=CC4=C(C3=C(N2)CC5=C6C=C7C=CC=CC7=C(C6=C8N5[Al]N9C1=C1C(=C9CC2=C3C(=C(C8)N2)C=C2C=CC=CC2=C3C2=CC=CC=C2)C=C2C=CC=CC2=C1C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1.O	{32: 2, 33: 2, 11: 4, 14: 40}
Did not match all atoms present	13244-33-2	COC1=CC(=C(C=C1)N)S(=O)(=O)O	{1: 1, 14: 3, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	13244-35-4	CS(=O)(=O)C1=CC(=C(C=C1)N)Cl	{1: 1, 30: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	13248-55-0	CC1=C(C=C(C=C1)N)S(=O)(=O)NCCO	{1: 1, 2: 2, 14: 3, 20: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	13249-58-6	C1=CC=C(C=C1)C(=CBr)C2=CC=CC=C2	{18: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	13249-96-2	C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC3=CC=CC=C32	{29: 2, 14: 12}
Did not match all atoms present	13249-99-5	CC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC3=CC=CC=C32	{1: 1, 29: 2, 14: 11}
Did not match all atoms present	1325-44-6	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C4C=CC(=CC4=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 4, 2: 4, 33: 2, 7: 1, 14: 13, 15: 2, 29: 6}
Did not match all atoms present	1325-92-4	CCNC1=CC=C(C2=CC=CC=C21)C(C3=CC=C(C=C3)N(C)C)(C4=CC=C(C=C4)N(C)C)O	{1: 5, 2: 1, 4: 1, 33: 2, 14: 14, 20: 1, 31: 1}
Did not match all atoms present	13250-03-8	C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)C3=CC=CC4=CC=CC=C43	{29: 2, 14: 14}
Did not match all atoms present	13250-46-9	CC(=O)N=C=S	{8: 1, 1: 1, 34: 1, 24: 1}
Did not match all atoms present	13250-88-9	CC1=CC=C(C=C1)CSCC2=CC=C(C=C2)C	{40: 1, 1: 2, 2: 2, 14: 8}
Did not match all atoms present	132539-06-1	CC1=CC2=C(NC3=CC=CC=C3N=C2S1)N4CCN(CC4)C	{32: 1, 1: 2, 35: 1, 33: 2, 41: 1, 11: 4, 14: 5, 15: 1}
Did not match all atoms present	13255-26-0	[O-][Si](=O)[O-].[Ba+2]	{29: 3}
Did not match all atoms present	13255-27-1	C1=C(C(=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[O-])[N+](=O)[O-].[Mg+2]	{38: 3, 14: 1}
Did not match all atoms present	13256-21-8	CN(C1CCS(=O)(=O)C1)N=O	{1: 1, 34: 1, 33: 1, 11: 3, 12: 1, 29: 3}
Did not match all atoms present	13256-45-6	CCC1(CCC(=O)NC1=O)C2=CC=C(C=C2)N.OP(=O)(O)O	{32: 1, 1: 1, 2: 1, 11: 2, 13: 1, 14: 4, 20: 3, 25: 2, 29: 1, 30: 1}
Did not match all atoms present	13257-51-7	C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Hg+2]	{16: 6, 24: 2, 4: 2}
Did not match all atoms present	13257-81-3	CC(=CC(=O)C)O[Si](C)(C)C	{24: 1, 1: 5, 22: 1, 6: 1, 7: 1}
Did not match all atoms present	13257-88-0	C[Si](C)(C)N1C=CN=N1	{1: 3, 35: 2, 14: 2, 33: 1}
Did not match all atoms present	13258-63-4	C1=CN=CC=C1CCN	{2: 2, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	13259-29-5	CC(C)C[O-].[Na+]	{1: 2, 2: 1, 3: 1, 29: 1}
Did not match all atoms present	1326-03-0	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)O	{1: 4, 2: 4, 33: 2, 14: 10, 23: 1, 27: 1}
Did not match all atoms present	1326-82-5	C1=CC2=C(C=C1[N+](=O)[O-])NC3=C(S2)C=C4C(=C3)N=C5C=C(C(=O)C=C5S4)[N+](=O)[O-]	{32: 1, 35: 1, 38: 2, 41: 2, 14: 7, 25: 1}
Did not match all atoms present	13261-62-6	CN(C)C1=CC2=C(C=C1)C3=CC=CC=C3C2	{1: 2, 11: 1, 14: 7, 33: 1}
Did not match all atoms present	13265-01-5	CC1=C(C=CC(=C1)C[C@@](C)(C(=O)OC)N)O.Cl	{1: 3, 2: 1, 4: 1, 14: 3, 17: 1, 21: 1, 28: 1, 30: 1}
Did not match all atoms present	13265-60-6	CC(=O)NCCSP(=S)(OC)OC	{1: 3, 2: 2, 40: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	13266-07-4	CCC[Pb](CCC)(CCC)OC(=O)C	{1: 4, 2: 6, 28: 1}
Did not match all atoms present	13266-82-5	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].O.O.O.O.O.O.O.O.O.[Y+3].[Y+3]	{24: 6}
Did not match all atoms present	13269-66-4	C(CO)[N+](CCO)(CCO)CCO.[Cl-]	{17: 1, 2: 8, 20: 4}
Did not match all atoms present	13269-74-4	C[Sn](=S)C	{1: 2}
Did not match all atoms present	1327-39-5	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Al+3].[Al+3].[Ca+2].[Ca+2]	{29: 15}
Did not match all atoms present	1327-44-2	[O-][Si](=O)[O-].[Al+3].[K+]	{29: 3}
Did not match all atoms present	1327-50-0	[Sb]=[Te].[Sb]=[Te].[Te]	{}
Did not match all atoms present	1327-53-3	[As+3].[As+3].[O-2].[O-2].[O-2]	{}
Did not match all atoms present	13270-61-6	C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O	{21: 6, 14: 5, 23: 1}
Did not match all atoms present	13271-67-5	CC[SiH](CC)C1=CC=CO1	{1: 2, 2: 2, 14: 3, 23: 1}
Did not match all atoms present	13271-68-6	C[SiH](C)C1=CC=CO1	{1: 2, 14: 3, 23: 1}
Did not match all atoms present	13271-69-7	CC[SiH](C)C1=CC=CO1	{1: 2, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	13271-93-7	CNN(C)[Si](C)(C)C	{1: 5, 33: 1, 31: 1}
Did not match all atoms present	13274-84-5	C=COP(=O)(CCl)CCl	{2: 2, 5: 1, 6: 1, 17: 2, 22: 1, 29: 1}
Did not match all atoms present	132740-43-3	C1=CC(=CC=C1CN=C=O)F	{2: 1, 8: 1, 34: 1, 14: 4, 16: 1, 29: 1}
Did not match all atoms present	13275-42-8	C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)Br	{32: 1, 18: 1, 35: 1, 14: 8}
Did not match all atoms present	13275-68-8	CCNC1=NN=CS1	{1: 1, 2: 1, 35: 2, 41: 1, 14: 1, 31: 1}
Did not match all atoms present	132752-15-9	CCO[Si](C=C)(OCC)OCC.CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]	{1: 11, 2: 3, 3: 4, 5: 1, 6: 1, 22: 3, 29: 4}
Did not match all atoms present	13277-59-3	CCCCCCCCCCCCO[N+](=O)[O-]	{1: 1, 2: 11, 22: 1}
Did not match all atoms present	13279-22-6	C1CN1C(=O)NC2=CC=CC=C2	{24: 1, 33: 1, 11: 2, 14: 5, 31: 1}
Did not match all atoms present	13279-58-8	CC(=O)NC1=CC(=C(C=C1OC)S(=O)(=O)Cl)OC	{1: 3, 14: 2, 17: 1, 22: 2, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	132790-71-7	CCCCOC1=CC=CC=C1O	{1: 1, 2: 3, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	132794-07-1	C1=C(C(=CC(=C1F)Cl)F)C(=O)O	{16: 2, 17: 1, 27: 1, 14: 2}
Did not match all atoms present	13280-60-9	C1=CC(=C(C=C1N)C(=O)O)[N+](=O)[O-]	{38: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	13280-61-0	CC1=CC=CC=C1C=CC2=CC=C(C=C2)C=CC3=CC=CC=C3C	{1: 2, 14: 12, 6: 4}
Did not match all atoms present	13282-37-6	CCCC(=O)[O-].CCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 4}
Did not match all atoms present	13283-01-7	Cl[W](Cl)(Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	132836-66-9	CC(=O)N1[C@H](COC1=O)CC2=CC=CC=C2	{1: 1, 2: 1, 33: 1, 11: 1, 12: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	13284-86-1	CC(CCC(=O)[O-])C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C.[Na+]	{1: 3, 2: 2, 3: 1, 11: 9, 12: 6, 13: 2, 20: 1, 24: 1}
Did not match all atoms present	132843-44-8	[Li+].C(C(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(C(F)(F)F)(F)F)(F)(F)F	{16: 10, 34: 1, 4: 4, 29: 4}
Did not match all atoms present	13286-32-3	CCOP(=O)(OCC)SCC1=CC=CC=C1	{1: 2, 2: 3, 40: 1, 14: 5, 22: 2, 29: 1}
Did not match all atoms present	13287-49-5	C1=CC(=CC=C1CSC#N)[N+](=O)[O-]	{40: 1, 2: 1, 38: 1, 37: 1, 14: 4}
Did not match all atoms present	13287-76-8	C1=CC(=CC=C1[N+](=O)[O-])SCCO	{40: 1, 2: 2, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	13288-70-5	CC1=CC(=CC(=C1O)C)S(=O)(=O)C2=CC(=C(C(=C2)C)O)C	{1: 4, 21: 2, 14: 4, 29: 2}
Did not match all atoms present	13289-18-4	CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=COC(=O)C=C6)C)C=O)O)O)OC7C(C(C(C(O7)CO)O)O)O	{1: 2, 2: 1, 11: 9, 12: 14, 13: 4, 14: 3, 20: 8, 22: 2, 23: 2, 26: 1, 28: 1}
Did not match all atoms present	13289-97-9	[B].CCN(CC)C1=CC=CC=C1	{1: 2, 2: 2, 14: 5, 33: 1}
Did not match all atoms present	132898-04-5	CC1=CC2=C(N=C1)N=C(N2C)N	{1: 2, 35: 2, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	132898-06-7	CC1=CC(=NC2=C1N=C(N2C)N)C	{1: 3, 35: 2, 30: 1, 14: 1, 33: 1}
Did not match all atoms present	132898-07-8	CC1=CC2=C(C3=C1N(C(=N3)N)C)N=C(C(=N2)C)C	{1: 4, 35: 3, 30: 1, 14: 1, 33: 1}
Did not match all atoms present	13290-00-1	COC(=O)CNC(=O)C1=CC=CO1	{1: 1, 2: 1, 14: 3, 23: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	13290-16-9	CC1=CC=C(C=C1)SCCO	{40: 1, 1: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	13290-74-9	CC1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	13290-96-5	COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC	{1: 2, 28: 2, 38: 1, 14: 3}
Did not match all atoms present	13291-96-8	C/C(=C\C(=O)OC)/N[C@H](C1=CC=CC=C1)C(=O)[O-].[Na+]	{1: 2, 3: 1, 6: 1, 7: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	13292-46-1	C[C@H]1/C=C/C=C(\C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C/NN5CCN(CC5)C)C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)/C	{32: 1, 1: 10, 6: 1, 33: 2, 11: 4, 12: 8, 13: 1, 14: 5, 15: 4, 20: 3, 21: 1, 22: 1, 23: 2, 25: 3, 28: 1, 31: 1}
Did not match all atoms present	13292-87-0	[B].CSC	{40: 1, 1: 2}
Did not match all atoms present	13294-23-0	C[Si](C)(C)C[Hg]C[Si](C)(C)C	{1: 6, 2: 2}
Did not match all atoms present	13294-24-1	C[Si](C)(C)C([Si](C)(C)C)[Hg]C([Si](C)(C)C)[Si](C)(C)C	{1: 12, 3: 2}
Did not match all atoms present	13294-31-0	CCO/C=C\C1=CC=CC=C1	{1: 1, 2: 1, 22: 1, 14: 5, 6: 2}
Did not match all atoms present	13295-76-6	C1=C(OC(=C1)[N+](=O)[O-])/C(=N\N)/N	{34: 1, 38: 1, 7: 1, 14: 2, 23: 1, 30: 2}
Did not match all atoms present	132959-39-8	C1C[C@]2(N(C1=O)[C@@H](CO2)C3=CC=CC=C3)C4=CC=CC=C4	{33: 1, 11: 3, 12: 1, 13: 1, 14: 10, 23: 1, 25: 1}
Did not match all atoms present	13296-94-1	C1=CC(=C(C=C1[N+](=O)[O-])Br)N	{18: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	13297-17-1	CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)C	{24: 1, 1: 2, 29: 2, 14: 4, 33: 2}
Did not match all atoms present	133-07-3	C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl	{33: 1, 4: 1, 40: 1, 14: 4, 17: 3, 25: 2}
Did not match all atoms present	133-09-5	C1=CC(=C(C=C1N)O)C(=O)[O-].[K+]	{24: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	133-10-8	C1=CC(=C(C=C1N)O)C(=O)[O-].[Na+]	{24: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	133-11-9	C1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)N)O	{30: 1, 28: 1, 21: 1, 14: 8}
Did not match all atoms present	133-14-2	C1=CC(=C(C=C1Cl)Cl)C(=O)OOC(=O)C2=C(C=C(C=C2)Cl)Cl	{17: 4, 28: 2, 14: 6}
Did not match all atoms present	133-16-4	CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)Cl	{1: 2, 2: 4, 33: 1, 14: 3, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	133-17-5	C1=CC=C(C(=C1)C(=O)NCC(=O)[O-])I.[Na+]	{24: 2, 2: 1, 19: 1, 14: 4, 31: 1}
Did not match all atoms present	133-18-6	C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2N	{2: 2, 28: 1, 30: 1, 14: 9}
Did not match all atoms present	133-26-6	CC(C)C1=C(C2=C(O1)C=C3C(=C2)C=CC(=O)O3)OC	{1: 3, 3: 1, 14: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	133-32-4	C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O	{32: 1, 2: 3, 27: 1, 14: 5}
Did not match all atoms present	133-49-3	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)S	{17: 5, 39: 1}
Did not match all atoms present	133-53-9	CC1=CC(=C(C(=C1Cl)C)Cl)O	{1: 2, 21: 1, 14: 1, 17: 2}
Did not match all atoms present	133-55-1	CN(C(=O)C1=CC=C(C=C1)C(=O)N(C)N=O)N=O	{1: 2, 34: 2, 33: 2, 14: 4, 24: 2, 29: 2}
Did not match all atoms present	133-58-4	CC1=C2C(=C(C=C1)[N+](=O)[O-])[Hg]O2	{1: 1, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	133-59-5	CC1=CC=CC=C1S(=O)(=O)Cl	{1: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	133-66-4	C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)NC7=CC=CC=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])NC8=CC=CC=C8.[Na+].[Na+]	{35: 6, 31: 6, 14: 26, 6: 2, 29: 6}
Did not match all atoms present	133-67-5	C1=C2C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)NC(N2)C(Cl)Cl	{32: 2, 3: 1, 12: 1, 14: 2, 17: 3, 29: 4, 30: 1}
Did not match all atoms present	133-78-8	CC1=C(C=CC(=C1)N)S(=O)(=O)O	{1: 1, 30: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	133-90-4	C1=C(C=C(C(=C1N)Cl)C(=O)O)Cl	{17: 2, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	133-91-5	C1=C(C=C(C(=C1I)O)C(=O)O)I	{27: 1, 19: 2, 21: 1, 14: 2}
Did not match all atoms present	1330-96-7	CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C	{1: 3, 2: 14, 3: 1, 28: 2, 14: 4}
Did not match all atoms present	133007-27-9	C1CC(=O)N2[C@H]1OC[C@H]2C3=CC=CC=C3	{33: 1, 11: 3, 12: 2, 14: 5, 23: 1, 25: 1}
Did not match all atoms present	13301-33-2	C1=CC(=C(C=C1[N+](=O)[O-])NN=C2C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)O)S(=O)(=O)O)O	{34: 1, 38: 1, 14: 6, 15: 2, 20: 2, 21: 1, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	13302-06-2	CCCC[Sn](CCCC)(CCCC)OS(=O)(=O)C	{1: 4, 2: 9, 29: 2, 22: 1}
Did not match all atoms present	13302-08-4	CS(=O)(=O)O[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 22: 1, 14: 15, 29: 2}
Did not match all atoms present	13302-76-6	C1=CC=C(C=C1)C(=CC(=O)C2=CC=CC=C2)S	{24: 1, 39: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	13303-10-1	CC(C)(C)OC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	13304-62-6	C=CC(=O)NCC1=CC=CC=C1	{2: 1, 5: 1, 6: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	13305-94-7	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)N)Cl)S(=O)(=O)[O-])C4=CC(=C5C=CC=C(C5=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 4, 33: 1, 12: 1, 14: 8, 15: 1, 17: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	133066-42-9	C1CC(CCC1C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CCCO)CCO	{2: 6, 11: 4, 12: 2, 14: 4, 20: 2, 27: 4}
Did not match all atoms present	13307-04-5	CN(C)[Si](Cl)(Cl)Cl	{1: 2, 33: 1, 17: 3}
Did not match all atoms present	13307-05-6	CN(C)[Si](N(C)C)(N(C)C)Cl	{1: 6, 33: 3, 17: 1}
Did not match all atoms present	13307-61-4	CC(C)CSC1=CC=CC=C1	{40: 1, 1: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	13307-67-0	CCOC(=O)N1C=CC2=CC=CC=C21	{1: 1, 2: 1, 28: 1, 14: 6, 33: 1}
Did not match all atoms present	13308-51-5	B12OP(=O)(O1)O2	{29: 1, 23: 3}
Did not match all atoms present	133082-13-0	C1=CC=C(C(=C1)[C@@H](CO)O)Cl	{17: 1, 2: 1, 3: 1, 20: 2, 14: 4}
Did not match all atoms present	1331-28-8	C1=CC=C(C=C1)C=CCl	{17: 1, 14: 5, 6: 2}
Did not match all atoms present	1331-29-9	C1=CC=C(C=C1)CC(Cl)Cl	{17: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	13311-84-7	CC(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F	{1: 2, 3: 1, 4: 1, 38: 1, 14: 3, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	133116-83-3	C1=CC(=C(C(=C1)F)C#N)C(F)(F)F	{16: 4, 4: 1, 37: 1, 14: 3}
Did not match all atoms present	13312-42-0	C1=CC=C2C(=C1)C3=C4C(=C2C=O)C=CC5=CC=CC(=C54)C=C3	{26: 1, 14: 11}
Did not match all atoms present	13313-45-6	CSC1=CC=CC(=C1)NC2=CC=CC=C2	{40: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	13314-52-8	CC[Ge](CC)(Cl)Cl	{1: 2, 2: 2, 17: 2}
Did not match all atoms present	13314-98-2	CC1=CC=CC=C1NCN2C(=O)CCC2=O	{1: 1, 2: 1, 33: 1, 11: 2, 14: 4, 25: 2, 31: 1}
Did not match all atoms present	13316-70-6	CCCCCCCCCCCCCCCC[N+](CC)(CC)CC.[Br-]	{1: 4, 2: 18, 18: 1}
Did not match all atoms present	133167-77-8	CC1=CC(=C(C=C1S(=O)(=O)[O-])OC)NC(=O)CC(=O)C.[Na+]	{1: 3, 2: 1, 14: 2, 22: 1, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	133184-80-2	C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)N	{33: 1, 4: 1, 11: 4, 14: 3, 16: 3, 30: 1}
Did not match all atoms present	13319-69-2	CC1=CC=CC(=C1C)C(=O)C2=CC=CC=C2	{24: 1, 1: 2, 14: 8}
Did not match all atoms present	13319-75-0	B(F)(F)F.O.O	{16: 3}
Did not match all atoms present	1332-07-6	B([O-])([O-])[O-].B([O-])([O-])[O-].[Zn+2].[Zn+2].[Zn+2]	{29: 6}
Did not match all atoms present	1332-37-2	[O-2].[O-2].[O-2].[Fe+3].[Fe+3]	{}
Did not match all atoms present	1332-40-7	[OH-].[OH-].[OH-].[Cl-].[Cl-].[Cu+2].[Cu+2]	{17: 2}
Did not match all atoms present	1332-51-0	C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3].[Ba+2]	{24: 4, 3: 4, 29: 4}
Did not match all atoms present	1332-58-7	O.O.O=[Al]O[Si](=O)O[Si](=O)O[Al]=O	{29: 4, 22: 3}
Did not match all atoms present	1332-73-6	[OH-].[O-]S(=O)(=O)[O-].[Al+3]	{29: 4}
Did not match all atoms present	1332-77-0	B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+].[K+]	{29: 12}
Did not match all atoms present	1332-81-6	O=[Sb]O[Sb](=O)=O	{29: 3, 22: 1}
Did not match all atoms present	1332-86-1	C1=CC=C2C(=C1)C3=C(C(=C4C5=C(C=CC(=C53)C2=O)C6=C(N4)C7=C(C8=CC=CC=C8C(=C7C=C6)OS(=O)(=O)[O-])OS(=O)(=O)[O-])Cl)Cl.[Na+].[Na+]	{32: 1, 14: 12, 17: 2, 22: 2, 25: 1, 29: 6}
Did not match all atoms present	1332-94-1	C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)C(=O)O)O)O)O	{3: 1, 37: 1, 12: 5, 14: 5, 20: 3, 22: 1, 23: 1, 27: 1}
Did not match all atoms present	13320-71-3	Cl[Mo](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	133220-86-7	C1=CC(=C(C=C1F)Cl)C=CC(=O)O	{16: 1, 17: 1, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	13323-62-1	CCCCCCCCC=CCCCCCCCC(=O)O[Sn](CCCC)(CCCC)OC(=O)CCCCCCCC=CCCCCCCCC	{1: 4, 2: 34, 28: 2, 6: 4}
Did not match all atoms present	13324-11-3	COC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl	{1: 1, 28: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	13324-20-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)S(=O)(=O)O)NC5=NC(=NC(=N5)Cl)Cl)S(=O)(=O)O)N	{35: 3, 14: 8, 17: 2, 20: 2, 25: 2, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	13324-23-7	CN(C)C1=C2C(=C(C=C1)O)C(=O)C3=C(C=CC(=C3C2=O)O)N(C)C	{1: 4, 33: 2, 21: 2, 14: 4, 25: 2}
Did not match all atoms present	13324-66-8	C1CC1NCC2=CC=CC=C2	{2: 1, 11: 2, 12: 1, 14: 5, 31: 1}
Did not match all atoms present	13327-31-6	C1=CC2=C(C=CC(=C2)I)N=C1	{35: 1, 19: 1, 14: 6}
Did not match all atoms present	13328-30-8	CN(C)[Si](N(C)C)(Cl)Cl	{1: 4, 33: 2, 17: 2}
Did not match all atoms present	13329-40-3	CC(=O)C1=CC=C(C=C1)I	{24: 1, 1: 1, 19: 1, 14: 4}
Did not match all atoms present	13329-66-3	CCCCCCC(CCCCCCCCCCC(=O)[O-])O.CCCCCCC(CCCCCCCCCCC(=O)[O-])O.CCCCCCC(CCCCCCCCCCC(=O)[O-])O.[Al+3]	{24: 3, 1: 3, 2: 45, 3: 3, 20: 3}
Did not match all atoms present	133296-90-9	CCCCCCCCCCCCOC(=O)C(C)OC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)NC2=C(C=CC(=C2)C(=O)OC(C)C(=O)OCCCCCCCCCCCC)Cl)N3C4=C(C=C(C=C4)C(=O)OC5=CC=CC=C5)N=N3	{1: 4, 2: 22, 3: 3, 33: 1, 14: 14, 17: 2, 35: 2, 24: 2, 28: 5, 31: 2}
Did not match all atoms present	1333-22-8	[OH-].[OH-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cu+2].[Cu+2].[Cu+2]	{29: 8}
Did not match all atoms present	1333-39-7	C1=CC=C(C(=C1)O)S(=O)(=O)O	{20: 1, 21: 1, 14: 4, 29: 2}
Did not match all atoms present	1333-74-0	[HH]	{}
Did not match all atoms present	1333-78-4	[O-2].[O-2].[K+].[Sb+3]	{}
Did not match all atoms present	1333-82-0	O=[Cr](=O)=O	{29: 3}
Did not match all atoms present	1333-88-6	[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Co+2].[Co+2]	{}
Did not match all atoms present	13331-27-6	B(C1=CC(=CC=C1)[N+](=O)[O-])(O)O	{20: 2, 38: 1, 14: 4}
Did not match all atoms present	13331-93-6	CC1=CC(=CC(=C1O)C)N=O	{1: 2, 34: 1, 21: 1, 14: 2, 29: 1}
Did not match all atoms present	13334-49-1	CC1=CC(=C(C=C1)OCC(=O)O)C	{1: 2, 2: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	13334-71-9	CC1=C(C=CC(=C1)OC)Cl	{1: 2, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	13336-31-7	COC1=CC=CC2=C1CCC2=O	{1: 1, 11: 2, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	13337-33-2	CC(=C=CP(=O)(Cl)Cl)C	{1: 2, 6: 1, 7: 1, 8: 1, 17: 2, 29: 1}
Did not match all atoms present	13338-63-1	COC1=CC(=CC(=C1OC)OC)CC#N	{1: 3, 2: 1, 22: 3, 14: 2, 37: 1}
Did not match all atoms present	1334-41-4	[H+].C(C(=O)[O-])N.[O-]S(=O)(=O)[O-].[Fe+2]	{24: 1, 2: 1, 29: 4, 30: 1}
Did not match all atoms present	1334-82-3	CCCCCOC(=O)C1=CC=CO1	{1: 1, 2: 4, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	133408-50-1	CNC(=O)C(=NOC)C1=CC=CC=C1OC2=CC=CC=C2	{1: 2, 34: 1, 7: 1, 14: 9, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	13343-26-5	C1=CC=C(C=C1)SC2=CC=C(C=C2)Cl	{40: 1, 17: 1, 14: 9}
Did not match all atoms present	13345-09-0	C1=CC=C(C=C1)C2=CC(=O)NC(=O)N2	{32: 2, 25: 2, 14: 6}
Did not match all atoms present	13345-21-6	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C(C=CC(=C54)C=C3)O	{21: 1, 14: 11}
Did not match all atoms present	13345-23-8	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=C(C=C5)O)C=C3	{21: 1, 14: 11}
Did not match all atoms present	13345-25-0	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC(C5O)O)C=C2	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	13345-58-9	CC1=C2C(=C(C3=CC=CC=C13)CCO)C=CC4=CC=CC=C42	{1: 1, 2: 2, 20: 1, 14: 10}
Did not match all atoms present	13345-60-3	CC1=C2C(=C(C3=CC=CC=C13)COC)C=CC4=CC=CC=C42	{1: 2, 2: 1, 22: 1, 14: 10}
Did not match all atoms present	13345-61-4	CC1=C2C(=C(C3=CC=CC=C13)C=O)C=CC4=CC=CC=C42	{1: 1, 26: 1, 14: 10}
Did not match all atoms present	13345-62-5	CC1=C2C(=C(C3=CC=CC=C13)CCl)C=CC4=CC=CC=C42	{1: 1, 2: 1, 14: 10, 17: 1}
Did not match all atoms present	13345-64-7	CC1=CC=CC2=C1C(=C3C=CC4=CC=CC=C4C3=C2C)C	{1: 3, 14: 9}
Did not match all atoms present	13347-42-7	C1CCC(C1)C2=C(C=CC(=C2)Cl)O	{17: 1, 11: 4, 12: 1, 21: 1, 14: 3}
Did not match all atoms present	1335-32-6	CC(=O)O[Pb]OC(=O)C.O.O.O.O.[Pb].[Pb]	{1: 2, 28: 2}
Did not match all atoms present	1335-47-3	CC1=CC=CC=C1CC2=CC=CC=C2C	{1: 2, 2: 1, 14: 8}
Did not match all atoms present	13351-61-6	CC(C)(CC1=CC=CC=C1)CO	{1: 2, 2: 2, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	13351-73-0	CN1C2=CC=CC=C2N=N1	{1: 1, 35: 2, 14: 4, 33: 1}
Did not match all atoms present	133514-97-3	CN(C)CCS(=O)(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl.C(=O)O	{1: 2, 2: 2, 35: 1, 33: 2, 11: 2, 14: 8, 15: 1, 17: 1, 26: 1, 27: 1, 29: 2}
Did not match all atoms present	13352-41-5	C1C2=CC=CC=C1C3=CC=CC=C3C=C2	{11: 1, 14: 10, 15: 2}
Did not match all atoms present	13354-35-3	C1=CC=C(C=C1)SC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O	{40: 1, 25: 2, 14: 12}
Did not match all atoms present	13355-00-5	C1=CC(=CC=C1NC2=NC(=NC(=N2)N)N)[As]3SC(C(S3)C(=O)[O-])C(=O)[O-].[K+].[K+]	{35: 3, 41: 2, 12: 2, 14: 4, 24: 2, 30: 2, 31: 1}
Did not match all atoms present	13355-96-9	CCCC[Sn]Cl.O.O	{1: 1, 2: 3, 17: 1}
Did not match all atoms present	13356-08-6	CC(C)(C[Sn](CC(C)(C)C1=CC=CC=C1)(CC(C)(C)C2=CC=CC=C2)O[Sn](CC(C)(C)C3=CC=CC=C3)(CC(C)(C)C4=CC=CC=C4)CC(C)(C)C5=CC=CC=C5)C6=CC=CC=C6	{1: 12, 2: 6, 4: 6, 22: 1, 14: 30}
Did not match all atoms present	13356-21-3	CC(C)(C)C[Sn](CC(C)(C)C)(CC(C)(C)C)CC(C)(C)C	{1: 12, 2: 4, 4: 4}
Did not match all atoms present	133560-78-8	C1COCCOC2=CC=CC=C2OCCOC3=CC=CC=C3OCCOCCO1	{11: 10, 14: 8, 23: 7}
Did not match all atoms present	133590-12-2	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)Cl	{1: 2, 2: 2, 33: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	133591-33-0	CC1=CC(=C(C2=C1NC3=CC=CC=C32)C)[N+](=O)[O-]	{32: 1, 1: 2, 38: 1, 14: 5}
Did not match all atoms present	133591-35-2	CC1=CC(=C(C2=C1NC3=C2C=C(C=C3)[N+](=O)[O-])C)[N+](=O)[O-]	{32: 1, 1: 2, 38: 2, 14: 4}
Did not match all atoms present	133591-38-5	CC1=C2C3=C(C=CC(=C3)[N+](=O)[O-])NC2=C(C=C1)C	{32: 1, 1: 2, 38: 1, 14: 5}
Did not match all atoms present	1336-21-6	[NH4+].[OH-]	{}
Did not match all atoms present	1336-61-4	CCN(CC(=O)O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 8, 33: 1, 16: 17, 27: 1, 29: 2}
Did not match all atoms present	1336-62-5	CCC(CC)CO[Si](O)(O)O	{1: 2, 2: 3, 3: 1, 20: 3, 22: 1}
Did not match all atoms present	1336-93-2	C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].[Mn+2]	{24: 2, 14: 14}
Did not match all atoms present	13360-45-7	CN(C(=O)NC1=CC(=C(C=C1)Br)Cl)OC	{1: 2, 33: 1, 14: 3, 17: 1, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	13360-57-1	CN(C)S(=O)(=O)Cl	{1: 2, 33: 1, 29: 2, 17: 1}
Did not match all atoms present	13360-64-0	CCC1=NC=C(N=C1)C	{1: 2, 2: 1, 35: 2, 14: 2}
Did not match all atoms present	13360-65-1	CCC1=NC(=CN=C1C)C	{1: 3, 2: 1, 35: 2, 14: 1}
Did not match all atoms present	13360-77-5	CC(C)CS[P-]SCC(C)C.[NH4+]	{40: 2, 1: 4, 2: 2, 3: 2}
Did not match all atoms present	13360-92-4	C1=CC=C(C=C1)OP(C2=CC=CC=C2)C3=CC=CC=C3	{22: 1, 14: 15}
Did not match all atoms present	13361-64-3	C[Si](C)(C)CC#C	{1: 3, 2: 1, 10: 1, 9: 1}
Did not match all atoms present	13361-67-6	CN(C)[Ge](C)(C)C	{1: 5, 33: 1}
Did not match all atoms present	13362-33-9	CC1=C(C=CC(=C1)N=O)O	{1: 1, 34: 1, 21: 1, 14: 3, 29: 1}
Did not match all atoms present	13362-75-9	C1=CC=NC(=C1)C=CC2=CN=CC=C2	{35: 2, 14: 8, 6: 2}
Did not match all atoms present	13362-78-2	C1=CN=CC=C1C=CC2=CC=NC=C2	{35: 2, 14: 8, 6: 2}
Did not match all atoms present	13362-80-6	CC1=C2C=CC=C(C2=NC=C1)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	13363-41-2	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{24: 4}
Did not match all atoms present	13364-95-9	CNC1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O	{1: 1, 2: 1, 35: 3, 33: 1, 12: 4, 14: 1, 20: 3, 23: 1, 30: 1, 31: 1}
Did not match all atoms present	13365-38-3	CN(C)C1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42	{1: 2, 35: 1, 33: 1, 14: 12, 31: 1}
Did not match all atoms present	13366-18-2	CCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCOS(=O)(=O)[O-].[Al+3]	{1: 3, 2: 33, 29: 9, 22: 3}
Did not match all atoms present	13367-92-5	C/[As](=S)=[As](=S)/C	{1: 2}
Did not match all atoms present	133672-84-1	CC#CP	{1: 1, 10: 2}
Did not match all atoms present	133672-87-4	C=C=CP	{8: 1, 5: 1, 6: 1}
Did not match all atoms present	133672-88-5	CC(=C=C)P	{8: 1, 1: 1, 5: 1, 7: 1}
Did not match all atoms present	13368-42-8	C[Si](C)(C)N1CCOCC1	{1: 3, 11: 4, 33: 1, 23: 1}
Did not match all atoms present	1337-26-4	B([O-])([O-])[O-].C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O.[Na+].[Na+].[Na+]	{2: 2, 3: 4, 20: 6, 29: 3}
Did not match all atoms present	13371-17-0	CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{1: 1, 2: 3, 14: 15, 17: 1}
Did not match all atoms present	13372-81-1	C1=CC=C(C=C1)/C=C/C=N/O	{34: 1, 20: 1, 14: 5, 6: 3}
Did not match all atoms present	133743-71-2	CC1=C(C(C(=C(N1)C)C(=O)OCCC2=CC=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC(=CC=C6)[N+](=O)[O-])C(=O)OC.Cl.Cl	{32: 1, 1: 3, 2: 2, 3: 1, 38: 1, 33: 2, 11: 4, 12: 1, 14: 18, 15: 4, 17: 2, 28: 2}
Did not match all atoms present	133745-75-2	C1=CC=C(C=C1)S(=O)(=O)N(F)S(=O)(=O)C2=CC=CC=C2	{16: 1, 33: 1, 29: 4, 14: 10}
Did not match all atoms present	133749-71-0	C1=NC(=O)C2=C(N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)([O-])[O-])O)O.[Na+].[Na+]	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 2, 20: 2, 22: 1, 23: 1, 25: 1, 29: 3}
Did not match all atoms present	13377-98-5	CC1=C(C=CC(=C1)N(CCC#N)CCO)N/N=C/2\C=CC(=CC2=O)[N+](=O)[O-]	{1: 1, 2: 4, 37: 1, 38: 1, 33: 1, 34: 1, 14: 6, 15: 2, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	1338-02-9	C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].[Cu+2]	{24: 2, 14: 14}
Did not match all atoms present	1338-16-5	C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Fe+3]	{24: 3, 20: 7, 2: 4, 3: 4, 4: 1}
Did not match all atoms present	13380-67-1	C1=CC(=CC=C1N2C(=O)C=CC2=O)Br	{25: 2, 18: 1, 14: 6, 33: 1}
Did not match all atoms present	13382-43-9	CC1=NC2=C(S1)C=CC(=C2)N	{1: 1, 35: 1, 30: 1, 14: 3, 41: 1}
Did not match all atoms present	133826-40-1	CP(=O)(OC1=CC=CC=C1)F	{16: 1, 1: 1, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	133831-28-4	COC(=O)C1=CC2=C(C=C1)C(=CN2)C=O	{32: 1, 1: 1, 26: 1, 28: 1, 14: 4}
Did not match all atoms present	13388-75-5	COC1=CC(=CC(=C1)CC#N)OC	{1: 2, 2: 1, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	133888-47-8	CCC1=C(C=C(C(=C1Cl)O)N)Cl.CCC1=C(C=C(C(=C1Cl)O)N)Cl.OS(=O)(=O)O	{1: 2, 2: 2, 14: 2, 17: 4, 20: 2, 21: 2, 29: 2, 30: 2}
Did not match all atoms present	13389-98-5	COC(=O)C1(CCC(=O)O1)C2=CC=CC=C2	{1: 1, 11: 2, 28: 2, 13: 1, 14: 5}
Did not match all atoms present	1339-86-2	CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O.C1=CC=C2C(=C1)N=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N	{1: 1, 2: 1, 3: 1, 14: 18, 35: 2, 21: 1, 24: 1, 28: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	13390-46-0	CC(=O)NC1=CC=C(C=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 12, 15: 2, 24: 1, 25: 1, 29: 8, 31: 3}
Did not match all atoms present	13390-47-1	CCOC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)SC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)OCC)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 2, 40: 1, 34: 4, 14: 14, 22: 2, 29: 6}
Did not match all atoms present	133920-06-6	C1=CC=C(C=C1)CCCCCCN=C=S	{8: 1, 2: 6, 34: 1, 14: 5}
Did not match all atoms present	13393-56-1	CN(C)C(=S)SC(C(=O)OC)SC(=S)N(C)C	{1: 5, 3: 1, 33: 2, 40: 2, 7: 2, 28: 1}
Did not match all atoms present	13393-75-4	CC1=CC2=C(S1)C=CS2	{1: 1, 14: 3, 41: 2}
Did not match all atoms present	133930-64-0	CC(C)(C(C)(C)N=NC1=CC=CC=C1)N=NC2=CC=CC=C2	{1: 4, 34: 4, 4: 2, 14: 10}
Did not match all atoms present	13394-86-0	CC1=CC=CC=C1C2=CC(=C(C=C2)N)C	{1: 2, 30: 1, 14: 7}
Did not match all atoms present	13395-16-9	C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.[Cu]	{24: 2, 1: 4, 20: 2, 6: 2, 7: 2}
Did not match all atoms present	13395-64-7	C1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2)Cl)Cl	{24: 1, 17: 2, 14: 8}
Did not match all atoms present	13395-85-2	CC(C)(C)C1=C(C=CC(=C1)Cl)O	{1: 3, 4: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	13396-41-3	[O-]P1(=O)OP(=O)(OP(=O)(OP(=O)(O1)[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{29: 8, 23: 4}
Did not match all atoms present	13396-89-9	P1=PSP=P1	{41: 1}
Did not match all atoms present	13397-98-3	CCCCC1=CC=CC=C1Br	{1: 1, 2: 3, 18: 1, 14: 4}
Did not match all atoms present	13398-94-2	C1=CC(=CC(=C1)O)CCO	{2: 2, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	133986-51-3	C(CS(=O)(=O)[O-])N(CCS(=O)(=O)[O-])O.[Na+].[Na+]	{33: 1, 2: 4, 20: 1, 29: 6}
Did not match all atoms present	13399-93-4	C[Si](C)(C)CCCS	{1: 3, 2: 3, 39: 1}
Did not match all atoms present	134-03-2	C(C(C1C(=C(C(=O)O1)O)[O-])O)O.[Na+]	{2: 1, 3: 1, 12: 1, 15: 2, 20: 3, 28: 1}
Did not match all atoms present	134-04-3	C1=CC(=CC=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O)O.[Cl-]	{17: 1, 21: 4, 14: 7, 23: 1}
Did not match all atoms present	134-08-7	C1=CC2=C(C=C1S(=O)(=O)O)C(=O)OC2=O	{28: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	134-09-8	CC1CCC(C(C1)OC(=O)C2=CC=CC=C2N)C(C)C	{1: 3, 3: 1, 11: 3, 12: 3, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	134-11-2	CCOC1=CC=CC=C1C(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	134-19-0	CC1=CC(=C(C=C1[N+](=O)[O-])OC)N	{1: 2, 30: 1, 38: 1, 22: 1, 14: 2}
Did not match all atoms present	134-20-3	COC(=O)C1=CC=CC=C1N	{1: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	134-25-8	C1=CC(=C(C=C1Cl)Cl)C(Cl)Cl	{17: 4, 3: 1, 14: 3}
Did not match all atoms present	134-29-2	COC1=CC=CC=C1N.Cl	{1: 1, 30: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	134-32-7	C1=CC=C2C(=C1)C=CC=C2N	{30: 1, 14: 7}
Did not match all atoms present	134-34-9	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C=C2O)S(=O)(=O)O	{1: 1, 14: 4, 20: 2, 21: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	134-37-2	C1=CC(=O)N(C=C1)C2=CC(=CC=C2)N	{25: 1, 30: 1, 14: 8, 33: 1}
Did not match all atoms present	134-38-3	CC1COCOC1C2=CC3=C(C=C2)OCO3	{1: 1, 11: 3, 12: 2, 14: 3, 23: 4}
Did not match all atoms present	134-47-4	C1=CC2=C(C=C(C=C2C=C1NC(=O)NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)O)S(=O)(=O)O)O	{14: 10, 20: 2, 21: 2, 24: 1, 29: 4, 31: 2}
Did not match all atoms present	134-49-6	CC1C(OCCN1)C2=CC=CC=C2	{32: 1, 1: 1, 11: 2, 12: 2, 14: 5, 23: 1}
Did not match all atoms present	134-50-9	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N.Cl	{17: 1, 35: 1, 30: 1, 14: 8}
Did not match all atoms present	134-52-1	C1=CC=C(C=C1)C2=C(C=C(C=C2)O)O	{21: 2, 14: 8}
Did not match all atoms present	134-53-2	CCN(CC)CC(C)(C)COC(=O)C(CO)C1=CC=CC=C1.OP(=O)(O)O	{1: 4, 2: 5, 3: 1, 4: 1, 33: 1, 14: 5, 20: 4, 28: 1, 29: 1}
Did not match all atoms present	134-58-7	C12=NNNC1=NC(=NC2=O)N	{32: 2, 25: 1, 35: 3, 30: 1}
Did not match all atoms present	134-62-3	CCN(CC)C(=O)C1=CC(=CC=C1)C	{24: 1, 1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	134-63-4	CN1C(CCCC1CC(=O)C2=CC=CC=C2)CC(C3=CC=CC=C3)O.Cl	{1: 1, 2: 2, 3: 1, 33: 1, 11: 3, 12: 2, 14: 10, 17: 1, 20: 1, 24: 1}
Did not match all atoms present	134-64-5	CN1[C@@H](CCC[C@@H]1CC(=O)C2=CC=CC=C2)C[C@@H](C3=CC=CC=C3)O.CN1[C@@H](CCC[C@@H]1CC(=O)C2=CC=CC=C2)C[C@@H](C3=CC=CC=C3)O.OS(=O)(=O)O	{1: 2, 2: 4, 3: 2, 33: 2, 11: 6, 12: 4, 14: 20, 20: 4, 24: 2, 29: 2}
Did not match all atoms present	134-69-0	C12=C(NC(=O)N1)N=C(N=C2[O-])[O-].[Na+].[Na+]	{32: 2, 25: 1, 35: 2}
Did not match all atoms present	134-71-4	CC(C(C1=CC=CC=C1)O)NC.Cl	{1: 2, 3: 2, 14: 5, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	134-80-5	CCN(CC)C(C)C(=O)C1=CC=CC=C1.Cl	{1: 3, 2: 2, 3: 1, 33: 1, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	134-81-6	C1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2	{24: 2, 14: 10}
Did not match all atoms present	134-83-8	C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)Cl	{17: 2, 3: 1, 14: 9}
Did not match all atoms present	134-84-9	CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9}
Did not match all atoms present	134-85-0	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl	{24: 1, 17: 1, 14: 9}
Did not match all atoms present	134-90-7	C1=CC(=CC=C1[C@@H]([C@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]	{2: 1, 3: 3, 38: 1, 14: 4, 17: 2, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	134-94-1	CCN(CCO)C1=CC=C(C=C1)[N+]#N.[Cl-]	{1: 1, 2: 3, 33: 1, 34: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	134-96-3	COC1=CC(=CC(=C1O)OC)C=O	{1: 2, 22: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	13400-13-0	[F-].[Cs+]	{16: 1}
Did not match all atoms present	13402-08-9	CCC(C1=CC=CC=C1)C(=O)NC(=O)NC(=O)C	{1: 2, 2: 1, 3: 1, 14: 5, 24: 3, 31: 2}
Did not match all atoms present	13402-32-9	C1=CC(=C(C(=C1)Br)[N+](=O)[O-])Br	{18: 2, 38: 1, 14: 3}
Did not match all atoms present	13402-51-2	C1=CC=C(C=C1)CSC(=O)C2=CC=CC=C2	{24: 1, 40: 1, 2: 1, 14: 10}
Did not match all atoms present	13402-96-5	CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)O)C(C)(C)CC	{1: 6, 2: 3, 4: 2, 14: 3, 22: 1, 27: 1}
Did not match all atoms present	13403-01-5	CCC(C(=O)O)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 3, 3: 1, 4: 2, 14: 3, 22: 1, 27: 1}
Did not match all atoms present	13405-77-1	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)SC)CN(C)C	{1: 4, 2: 2, 3: 1, 33: 2, 40: 1, 41: 1, 14: 7}
Did not match all atoms present	13406-29-6	C1=CC(=CC=C1C(F)(F)F)P(C2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C(F)(F)F	{16: 9, 4: 3, 14: 12}
Did not match all atoms present	13406-60-5	CCN(CC)CCN1C2=C(C=C(C=C2)C(=O)C)N=C1CC3=CC=C(C=C3)OCC	{1: 4, 2: 6, 35: 1, 33: 2, 14: 7, 22: 1, 24: 1}
Did not match all atoms present	13408-58-7	C1CC[N-]CC1.C1CC[N-]CC1.Cl[Cu]Cl	{17: 2, 11: 10, 35: 2}
Did not match all atoms present	13408-62-3	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+3]	{}
Did not match all atoms present	13408-63-4	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2]	{}
Did not match all atoms present	13410-01-0	[O-][Se](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	13410-61-2	C1=CC=C(C=C1)OP(C2=CC=CC=C2)OC3=CC=CC=C3	{22: 2, 14: 15}
Did not match all atoms present	13411-16-0	C1=CC(=NC(=C1)CO)/C=C/C2=CC=C(O2)[N+](=O)[O-]	{2: 1, 35: 1, 38: 1, 6: 2, 14: 5, 20: 1, 23: 1}
Did not match all atoms present	13411-42-2	C[Si](C)(C)C1SCCCS1	{1: 3, 11: 3, 12: 1, 41: 2}
Did not match all atoms present	13411-48-8	CC(=O)[Si](C)(C)C	{24: 1, 1: 4}
Did not match all atoms present	13411-91-1	COC1=CC=C(C=C1)N/N=C/2\C(=O)C=CC3=CC=CC=C32	{1: 1, 34: 1, 14: 10, 15: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	13412-64-1	CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O.O.[Na]	{1: 3, 35: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 3, 17: 2, 23: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	134123-93-6	CCC1=CC=C(C=C1)CC(C)(C)C#N	{1: 3, 2: 2, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	13413-18-8	CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)S[Sn](CCCCCCCC)(CCCCCCCC)CCCCCCCC	{40: 1, 1: 6, 2: 42}
Did not match all atoms present	13414-54-5	CC(=C)COC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 1, 5: 1, 38: 1, 7: 1, 14: 4, 22: 1}
Did not match all atoms present	13414-55-6	CC1(CC2=C(O1)C(=CC=C2)[N+](=O)[O-])C	{1: 2, 38: 1, 11: 1, 13: 1, 14: 3, 23: 1}
Did not match all atoms present	13414-58-9	CC(=C)CC1=C(C(=CC=C1)[N+](=O)[O-])O	{1: 1, 2: 1, 5: 1, 38: 1, 7: 1, 14: 3, 21: 1}
Did not match all atoms present	13414-95-4	C1CC2=C(C=CS2)C(=O)C1	{25: 1, 11: 3, 14: 2, 41: 1}
Did not match all atoms present	13416-17-6	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCOC)C=C4N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCOC.[I-]	{1: 3, 2: 5, 33: 2, 6: 2, 7: 1, 14: 16, 15: 1, 19: 1, 22: 2, 23: 2}
Did not match all atoms present	13416-33-6	CC1=C(SC(=S)N1)[N+](=O)[O-]	{32: 1, 1: 1, 38: 1, 41: 1}
Did not match all atoms present	13416-35-8	CCN1C2=C(C=CC3=CC=CC=C32)SC1=S	{1: 1, 2: 1, 41: 1, 14: 6, 33: 1}
Did not match all atoms present	13417-01-1	CN(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 8, 33: 1, 16: 17, 29: 2, 31: 1}
Did not match all atoms present	13418-50-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C4C(=C3N)C(=NC4=O)N)N	{25: 3, 35: 1, 30: 3, 14: 4}
Did not match all atoms present	134180-76-0	CC1CO1.C[Si](C)(C)O[Si](C)(CCCO)O[Si](C)(C)C.C1CO1	{1: 8, 2: 3, 11: 3, 12: 1, 20: 1, 22: 2, 23: 2}
Did not match all atoms present	13419-37-9	CCCCCCCCCCCCCCOS(=O)(=O)[O-].[K+]	{1: 1, 2: 13, 29: 3, 22: 1}
Did not match all atoms present	13419-51-7	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Sc+3].[Sc+3]	{24: 6}
Did not match all atoms present	13419-61-9	CCCCCCCCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 9, 29: 3}
Did not match all atoms present	13421-00-6	C1=CC(=C(C=C1Cl)C(=O)O)I	{27: 1, 17: 1, 19: 1, 14: 3}
Did not match all atoms present	13421-13-1	C1=CC(=C(C=C1Cl)I)C(=O)O	{27: 1, 17: 1, 19: 1, 14: 3}
Did not match all atoms present	13422-51-0	CC1=CC2=C(C=C1C)N(C=N2)[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)OP(=O)([O-])O[C@H](C)CNC(=O)CC[C@@]\4([C@H]([C@@H]5[C@]6([C@@]([C@@H](C(=N6)/C(=C\7/[C@@]([C@@H](C(=N7)/C=C\8/C([C@@H](C(=N8)/C(=C4\[N-]5)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)/C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.O.[Co+2]	{1: 11, 2: 13, 3: 1, 33: 1, 12: 9, 13: 5, 14: 4, 15: 8, 35: 5, 20: 2, 22: 2, 23: 1, 24: 7, 29: 2, 30: 6, 31: 1}
Did not match all atoms present	13422-55-4	[CH3-].CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)([O-])OC(C)CNC(=O)CCC\4(C(C5C6(C(C(C(=N6)/C(=C\7/C(C(C(=N7)/C=C\8/C(C(C(=N8)/C(=C4\[N-]5)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)/C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.[Co+3]	{1: 11, 2: 13, 3: 1, 33: 1, 12: 9, 13: 5, 14: 4, 15: 8, 35: 5, 20: 2, 22: 2, 23: 1, 24: 7, 29: 2, 30: 6, 31: 1}
Did not match all atoms present	134227-45-5	C1=C(C=C(C(=C1F)F)F)C#N	{16: 3, 37: 1, 14: 2}
Did not match all atoms present	13423-47-7	C1N2CN3CN1CN(C2)C3.C1=CC(=CC(=C1)O)O	{33: 4, 11: 6, 21: 2, 14: 4}
Did not match all atoms present	13423-48-8	CCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 2: 6, 18: 1, 14: 15}
Did not match all atoms present	13423-61-5	[O-][Cr](=O)(=O)[O-].[Mg+2]	{29: 4}
Did not match all atoms present	13423-78-4	C1CCC(CC1)C2=CC=CC=C2OP(OC3=CC=CC=C3C4CCCCC4)OC5=CC=CC=C5C6CCCCC6	{11: 15, 12: 3, 22: 3, 14: 12}
Did not match all atoms present	13425-22-4	C1C(OC(=N1)N)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O	{35: 1, 6: 2, 11: 1, 12: 1, 14: 5, 15: 1, 23: 1, 27: 2, 30: 1}
Did not match all atoms present	13425-94-0	CCOC(=O)[C@@H](C(C)C)NC(=O)C(CC1=CC=C(C=C1)N(CCCl)CCCl)NC(=O)C	{1: 4, 2: 6, 3: 3, 33: 1, 14: 4, 17: 2, 24: 2, 28: 1, 31: 2}
Did not match all atoms present	13426-91-0	C(C[NH-])[NH-].C(C[NH-])[NH-].[Cu+2]	{2: 4, 36: 4}
Did not match all atoms present	13428-80-3	CC[O-].CC[O-].CC[O-].CC[O-].[Hf+4]	{1: 4, 2: 4, 29: 4}
Did not match all atoms present	13429-10-2	CC1=CC(=C(C=C1)NC(=O)C)O	{24: 1, 1: 2, 21: 1, 14: 3, 31: 1}
Did not match all atoms present	13429-12-4	C1=C(C=C(C(=C1O)Br)O)C(=O)N	{24: 1, 18: 1, 30: 1, 21: 2, 14: 2}
Did not match all atoms present	13429-27-1	CCCCCCCCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 12}
Did not match all atoms present	1343-90-4	O.[O-][Si]1(O[Si]2(O1)O[Si](O2)([O-])[O-])[O-].[Mg+2].[Mg+2]	{29: 4, 23: 4}
Did not match all atoms present	13431-10-2	CN1CCNC1=S	{32: 1, 1: 1, 11: 2, 33: 1, 15: 1}
Did not match all atoms present	13431-34-0	CCNC(=S)NN	{1: 1, 2: 1, 31: 2, 30: 1, 7: 1}
Did not match all atoms present	13432-32-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3Cl)Cl)N	{17: 2, 30: 1, 14: 5, 25: 2}
Did not match all atoms present	13433-09-5	C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)[C@H](CC(=O)O)N	{2: 2, 3: 2, 14: 5, 24: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	13433-42-6	COP(=O)(C[Si](C)(C)C)OC	{1: 5, 2: 1, 29: 1, 22: 2}
Did not match all atoms present	13433-92-6	C(C(CBr)Br)O[Sb](OCC(CBr)Br)OCC(CBr)Br	{2: 6, 3: 3, 18: 6, 22: 3}
Did not match all atoms present	134332-29-9	CC1=CC(=C(C=C1Br)F)Br	{16: 1, 1: 1, 18: 2, 14: 2}
Did not match all atoms present	134338-99-1	CCCCCN(CCCCC)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O	{1: 2, 2: 8, 33: 1, 14: 7, 21: 1, 24: 1, 27: 1}
Did not match all atoms present	13434-24-7	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Mn+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	13435-09-1	C[Si](C)(NC1=CC=CC=C1)NC2=CC=CC=C2	{1: 2, 14: 10, 31: 2}
Did not match all atoms present	13435-12-6	CC(=O)N[Si](C)(C)C	{24: 1, 1: 4, 31: 1}
Did not match all atoms present	13436-03-8	C[Si](C)(C)N=N[Si](C)(C)C	{1: 6, 34: 2}
Did not match all atoms present	13436-48-1	CN1C2=CC=CC=C2C=N1	{1: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	1344-00-9	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Na+].[Al+3]	{29: 6}
Did not match all atoms present	1344-28-1	O=[Al]O[Al]=O	{29: 2, 22: 1}
Did not match all atoms present	1344-40-7	O.OP([O-])[O-].OP([O-])[O-].O=[Pb].O=[Pb].O=[Pb].O=[Pb].[Pb+2].[Pb+2]	{20: 2, 29: 8}
Did not match all atoms present	1344-43-0	O=[Mn]	{29: 1}
Did not match all atoms present	1344-48-5	S=[Hg]	{}
Did not match all atoms present	1344-54-3	[O].[O].[O].[Ti].[Ti]	{}
Did not match all atoms present	1344-55-4	OO.O=[Ti]	{20: 2, 29: 1}
Did not match all atoms present	1344-57-6	O=[U]=O	{29: 2}
Did not match all atoms present	1344-58-7	O=[U](=O)=O	{29: 3}
Did not match all atoms present	1344-95-2	[O-][Si]([O-])([O-])[O-].[Ca+2].[Ca+2]	{29: 4}
Did not match all atoms present	13441-36-6	C1CCN(CC1)C2CCC(CC2)C(=O)C3=CC=CC=C3	{24: 1, 33: 1, 11: 9, 12: 2, 14: 5}
Did not match all atoms present	13442-07-4	CC1=C2C(=NO)C=CN(C2=CC=C1)O	{1: 1, 34: 1, 33: 1, 14: 5, 20: 1, 21: 1}
Did not match all atoms present	13442-08-5	CC1=CC2=C(C=C1)N(C=CC2=NO)O	{1: 1, 34: 1, 33: 1, 14: 5, 20: 1, 21: 1}
Did not match all atoms present	13442-10-9	CC1=CC=CC2=C1N(C=CC2=NO)O	{1: 1, 34: 1, 33: 1, 14: 5, 20: 1, 21: 1}
Did not match all atoms present	13442-12-1	C1=CC2=C(C=C1Cl)N(C=CC2=NO)O	{33: 1, 34: 1, 14: 5, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	13442-13-2	C1=CN(C2=CC(=C(C=C2C1=NO)Cl)Cl)O	{33: 1, 34: 1, 14: 4, 17: 2, 20: 1, 21: 1}
Did not match all atoms present	13442-14-3	C1=CC2=C(C=C1C(=O)O)C(=NO)C=CN2O	{33: 1, 34: 1, 14: 5, 20: 1, 21: 1, 27: 1}
Did not match all atoms present	13442-15-4	C1=CC2=C(C=C1[N+](=O)[O-])C(=NO)C=CN2O	{33: 1, 34: 1, 38: 1, 14: 5, 20: 1, 21: 1}
Did not match all atoms present	13442-17-6	C1=CC2=C(C=C[N+](=C2C=C1[N+](=O)[O-])[O-])[N+](=O)[O-]	{33: 1, 38: 2, 29: 1, 14: 5}
Did not match all atoms present	134430-93-6	C[C@H](C1=CC=CC=C1)NCC2=CC(=C(C=C2)OC)OC	{1: 3, 2: 1, 3: 1, 14: 8, 22: 2, 31: 1}
Did not match all atoms present	13444-75-2	[O-][Cr](=O)(=O)[O-].[Hg+2]	{29: 4}
Did not match all atoms present	13444-76-3	Br[Hg]I	{18: 1, 19: 1}
Did not match all atoms present	13444-83-2	[N+](=O)(O)[O-].O.O.O	{20: 1}
Did not match all atoms present	13444-90-1	[NH+](=O)[O-].[Cl-]	{17: 1, 31: 1}
Did not match all atoms present	13444-93-4	Cl[Os](Cl)Cl	{17: 3}
Did not match all atoms present	13444-94-5	Br[Pd]Br	{18: 2}
Did not match all atoms present	134440-55-4	CC(C)(C)C1=CC(=CC(=NNC2=CC=CC=C2[N+](=O)[O-])C1=O)CCC(=O)OC	{1: 4, 2: 2, 4: 1, 38: 1, 34: 1, 14: 6, 15: 3, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	13445-49-3	OS(=O)(=O)OOS(=O)(=O)O	{20: 2, 29: 4, 22: 2}
Did not match all atoms present	13445-50-6	PP	{}
Did not match all atoms present	13446-03-2	[Br-].[Br-].[Mn+2]	{18: 2}
Did not match all atoms present	13446-08-7	[NH4+].[O-]S(=O)(=O)F	{16: 1, 29: 3}
Did not match all atoms present	13446-09-8	[NH4+].[O-]I(=O)=O	{19: 1, 29: 3}
Did not match all atoms present	13446-10-1	[NH4+].[O-][Mn](=O)(=O)=O	{29: 4}
Did not match all atoms present	13446-11-2	[NH4+].[O-]I(=O)(=O)=O	{19: 1, 29: 4}
Did not match all atoms present	13446-18-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Mg+2]	{}
Did not match all atoms present	13446-19-0	O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Mg+2]	{17: 2, 29: 8}
Did not match all atoms present	13446-23-6	O.O.O.O.O.O.O.O.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Mg+2].[Mg+2].[Mg+2]	{29: 8}
Did not match all atoms present	13446-24-7	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Mg+2].[Mg+2]	{29: 6, 22: 1}
Did not match all atoms present	13446-28-1	O.O.O.O.O.O.[O-][Se](=O)(=O)[O-].[Mg+2]	{29: 4}
Did not match all atoms present	13446-29-2	O.O.O.O.O.O.[O-]S(=O)[O-].[Mg+2]	{29: 3}
Did not match all atoms present	13446-30-5	O.O.O.O.O.O.[O-]S(=O)(=S)[O-].[Mg+2]	{29: 3}
Did not match all atoms present	13446-37-2	O.O.O.O.[Mn+2].[I-].[I-]	{19: 2}
Did not match all atoms present	13446-48-5	[NH4+].N(=O)[O-]	{34: 1, 29: 2}
Did not match all atoms present	13446-49-6	[O-][Mo](=O)(=O)[O-].[K+].[K+]	{29: 4}
Did not match all atoms present	13446-53-2	O.O.O.O.O.O.[Mg+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	13446-57-6	Br[Mo](Br)Br	{18: 3}
Did not match all atoms present	13446-71-4	[O-]Cl(=O)=O.[Rb+]	{17: 1, 29: 3}
Did not match all atoms present	13446-72-5	[O-][Cr](=O)(=O)[O-].[Rb+].[Rb+]	{29: 4}
Did not match all atoms present	13446-73-6	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Rb+].[Rb+]	{29: 6, 22: 1}
Did not match all atoms present	13446-74-7	[F-].[Rb+]	{16: 1}
Did not match all atoms present	13446-75-8	[H-].[Rb+]	{}
Did not match all atoms present	13446-76-9	[O-]I(=O)=O.[Rb+]	{19: 1, 29: 3}
Did not match all atoms present	13448-22-1	CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=C(C=C4)Cl	{1: 1, 33: 2, 41: 1, 11: 5, 12: 1, 14: 7, 17: 1}
Did not match all atoms present	1345-04-6	S=[Sb+]	{}
Did not match all atoms present	1345-25-1	O=[Fe]	{29: 1}
Did not match all atoms present	13450-37-8	C1=CC=C(C(=C1)C(=O)C2=CC(=CC=C2)Cl)C(=O)O	{24: 1, 17: 1, 27: 1, 14: 8}
Did not match all atoms present	13450-67-4	C1CCN(CC1)CCC2=CC=NC=C2	{33: 1, 2: 2, 11: 5, 14: 4, 35: 1}
Did not match all atoms present	13450-77-6	C1=CC(=CC=C1C(=O)NCC(=O)O)Cl	{2: 1, 14: 4, 17: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	13450-84-5	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Gd+3]	{17: 3}
Did not match all atoms present	13450-87-8	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Gd+3].[Gd+3]	{29: 12}
Did not match all atoms present	13450-88-9	[Ga](Br)(Br)Br	{18: 3}
Did not match all atoms present	13450-90-3	Cl[Ga](Cl)Cl	{17: 3}
Did not match all atoms present	13450-91-4	[Ga](I)(I)I	{19: 3}
Did not match all atoms present	13450-92-5	[Ge](Br)(Br)(Br)Br	{18: 4}
Did not match all atoms present	13450-95-8	[Ge](I)(I)(I)I	{19: 4}
Did not match all atoms present	13450-97-0	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Sr+2]	{17: 2, 29: 8}
Did not match all atoms present	13450-99-2	OP(=O)([O-])[O-].[Sr+2]	{20: 1, 29: 3}
Did not match all atoms present	13451-00-8	[O-][Si](=O)[O-].[Sr+2]	{29: 3}
Did not match all atoms present	13451-02-0	[O-]S(=O)[O-].[Sr+2]	{29: 3}
Did not match all atoms present	13451-08-6	S(Cl)(Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	13451-10-0	O.O.OS(=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	13451-11-1	Br[Ta](Br)(Br)(Br)Br	{18: 5}
Did not match all atoms present	13451-17-7	O=[Te]	{29: 1}
Did not match all atoms present	13451-19-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Tb+3]	{}
Did not match all atoms present	134514-27-5	C1=C(C(=CC(=C1[N+](=O)[O-])N)F)N	{16: 1, 38: 1, 30: 2, 14: 2}
Did not match all atoms present	13452-85-2	CN(C)C1=NC(=NC(=N1)N2CCCC2)N(C)C	{1: 4, 11: 4, 35: 3, 33: 3}
Did not match all atoms present	13452-92-1	C[Si]1([Si]([Si]([Si]([Si]1(C)C)(C)C)(C)C)(C)C)C	{1: 10}
Did not match all atoms present	13452-94-3	C[Si]1([Si]([Si]([Si]([Si]([Si]([Si]1(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 14}
Did not match all atoms present	1345201-68-4	[O-].[O].[Zn+2]	{}
Did not match all atoms present	1345201-74-2	[O-].[O].[Zn+3]	{}
Did not match all atoms present	134523-03-8	CC(C)C1=C(C(=C(N1CC[C@H](C[C@H](CC(=O)[O-])O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4.CC(C)C1=C(C(=C(N1CC[C@H](C[C@H](CC(=O)[O-])O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4.[Ca+2]	{1: 4, 2: 8, 3: 6, 33: 2, 14: 28, 16: 2, 20: 4, 24: 4, 31: 2}
Did not match all atoms present	13453-07-1	Cl[Au](Cl)Cl	{17: 3}
Did not match all atoms present	13453-15-1	O[As](=O)(O)O.O[As](=O)(O)O	{20: 6, 29: 2}
Did not match all atoms present	13453-24-2	[I-].[I-].[I-].[Au+3]	{19: 3}
Did not match all atoms present	13453-30-0	[O-]Cl(=O)=O.[Tl+]	{17: 1, 29: 3}
Did not match all atoms present	13453-34-4	[C-]#N.[Tl+]	{}
Did not match all atoms present	13453-40-2	[O-]Cl(=O)(=O)=O.[Tl+]	{17: 1, 29: 4}
Did not match all atoms present	13453-62-8	O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Pb+2]	{17: 2, 29: 8}
Did not match all atoms present	13453-69-5	[Li+].B(=O)[O-]	{29: 2}
Did not match all atoms present	13453-70-8	[Li+].O.[Br-]	{18: 1}
Did not match all atoms present	13453-71-9	[Li+].[O-]Cl(=O)=O	{17: 1, 29: 3}
Did not match all atoms present	13453-76-4	[Li+].[N+](=O)([O-])[O-].O.O.O	{}
Did not match all atoms present	13453-78-6	[Li+].O.O.O.[O-]Cl(=O)(=O)=O	{17: 1, 29: 4}
Did not match all atoms present	13453-80-0	[Li+].OP(=O)(O)[O-]	{20: 2, 29: 2}
Did not match all atoms present	13454-52-9	CCOC(=O)C(C(C(=O)OCC)O)O.[N+](=O)(O)[O-].[N+](=O)(O)[O-]	{1: 2, 2: 2, 3: 2, 20: 4, 28: 2}
Did not match all atoms present	13454-59-6	CCCCCOP(=O)(C)F	{16: 1, 1: 2, 2: 4, 29: 1, 22: 1}
Did not match all atoms present	13454-75-6	[O-]Br(=O)=O.[Cs+]	{18: 1, 29: 3}
Did not match all atoms present	13454-78-9	[O-][Cr](=O)(=O)[O-].[Cs+].[Cs+]	{29: 4}
Did not match all atoms present	13454-81-4	[O-]I(=O)=O.[Cs+]	{19: 1, 29: 3}
Did not match all atoms present	13454-83-6	N(=O)[O-].[Cs+]	{34: 1, 29: 2}
Did not match all atoms present	13454-84-7	[O-]Cl(=O)(=O)=O.[Cs+]	{17: 1, 29: 4}
Did not match all atoms present	13454-88-1	O.O.[F-].[F-].[Cu+2]	{16: 2}
Did not match all atoms present	13454-89-2	[O-]I(=O)=O.[O-]I(=O)=O.[Cu+2]	{19: 2, 29: 6}
Did not match all atoms present	13454-94-9	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ce+3].[Ce+3]	{29: 12}
Did not match all atoms present	13454-96-1	Cl[Pt](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	13455-00-0	P(P(I)I)(I)I	{19: 4}
Did not match all atoms present	13455-01-1	P(I)(I)I	{19: 3}
Did not match all atoms present	13455-12-4	Br[Pt]Br	{18: 2}
Did not match all atoms present	13455-15-7	F[Pt](F)(F)F	{16: 4}
Did not match all atoms present	13455-20-4	[O-]S(=O)(=O)S(=O)(=O)[O-].[K+].[K+]	{29: 6}
Did not match all atoms present	13455-21-5	O.O.[F-].[K+]	{16: 1}
Did not match all atoms present	13455-24-8	OI(=O)=O.[O-]I(=O)=O.[K+]	{19: 2, 20: 1, 29: 5}
Did not match all atoms present	13455-31-7	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Co+2]	{17: 2, 29: 8}
Did not match all atoms present	13455-36-2	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Co+2].[Co+2].[Co+2]	{29: 8}
Did not match all atoms present	13455-50-0	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ho+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	13456-28-5	[O-][Mn](=O)(=O)=O.[Cs+]	{29: 4}
Did not match all atoms present	13457-18-6	CCOC(=O)C1=CN2C(=CC(=N2)OP(=S)(OCC)OCC)N=C1C	{1: 4, 2: 3, 35: 2, 33: 1, 14: 2, 22: 3, 28: 1}
Did not match all atoms present	13458-81-6	CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3	{1: 1, 34: 2, 35: 1, 38: 1, 33: 1, 12: 1, 14: 8, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	134595-59-8	[Li+].CC\1=C(C(=O)N(C(=O)/C1=N\NC2=C(C=CC(=C2)NC3=C(C(=NC=N3)F)Cl)S(=O)(=O)[O-])C)CS(=O)(=O)[O-].[Na+]	{1: 2, 2: 1, 35: 2, 33: 1, 34: 1, 14: 4, 15: 3, 16: 1, 17: 1, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	13460-50-9	B(=O)O	{20: 1, 29: 1}
Did not match all atoms present	13460-51-0	B1(OB(OB(O1)O)O)O	{20: 3, 23: 3}
Did not match all atoms present	13461-01-3	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=O)C)N(C)C	{1: 4, 2: 1, 3: 1, 33: 2, 41: 1, 14: 7, 24: 1}
Did not match all atoms present	13461-16-0	CN1CCN(C1=S)C	{1: 2, 11: 2, 33: 2, 15: 1}
Did not match all atoms present	13461-74-0	C#CC1(C2=CC=CC=C2C3=CC=CC=C31)O	{9: 1, 10: 1, 20: 1, 13: 1, 14: 8}
Did not match all atoms present	13462-88-9	[Ni](Br)Br	{18: 2}
Did not match all atoms present	13462-90-3	[Ni](I)I	{19: 2}
Did not match all atoms present	13462-93-6	[NH4+].O[As](=O)(O)[O-]	{20: 2, 29: 2}
Did not match all atoms present	134627-17-1	[OH-].[Sc+2]	{}
Did not match all atoms present	13463-30-4	Cl[Pb](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	13463-39-3	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Ni]	{29: 4}
Did not match all atoms present	13463-40-6	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]	{29: 5}
Did not match all atoms present	13463-41-7	C1=CC(=S)N(C=C1)[O-].C1=CC(=S)N(C=C1)[O-].[Zn+2]	{33: 2, 29: 2, 14: 8}
Did not match all atoms present	13463-43-9	O.[O-]S(=O)(=O)[O-].[Fe+2]	{29: 4}
Did not match all atoms present	13463-67-7	O=[Ti]=O	{29: 2}
Did not match all atoms present	13463-98-4	CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)[O-])C.CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)[O-])C.[Ca+2]	{1: 8, 3: 2, 11: 12, 12: 4, 13: 4, 14: 4, 15: 4, 24: 2}
Did not match all atoms present	13464-19-2	C1=CC=C(C=C1)SC(=O)Cl	{24: 1, 17: 1, 14: 5, 40: 1}
Did not match all atoms present	13464-24-9	CC(C)(CC(=C)C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 2, 2: 1, 4: 1, 5: 1, 7: 1, 14: 8, 21: 2}
Did not match all atoms present	13464-33-0	O=[As](O)(O)O.[Zn]	{20: 3, 29: 1}
Did not match all atoms present	13464-35-2	[O-][As]=O.[K+]	{29: 2}
Did not match all atoms present	13464-36-3	[O-][As](=O)([O-])[O-].[K+].[K+].[K+]	{29: 4}
Did not match all atoms present	13464-37-4	[O-][As]([O-])[O-].[Na+].[Na+].[Na+]	{29: 3}
Did not match all atoms present	13464-38-5	[O-][As](=O)([O-])[O-].[Na+].[Na+].[Na+]	{29: 4}
Did not match all atoms present	13464-42-1	[O-][As](=O)([O-])O[As](=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{29: 6, 22: 1}
Did not match all atoms present	13464-44-3	O=[As]([O-])([O-])[O-].O=[As]([O-])([O-])[O-].[Zn+2].[Zn+2].[Zn+2]	{29: 8}
Did not match all atoms present	13464-46-5	[Cl-].[Cl-].[Cl-].[Am]	{17: 3}
Did not match all atoms present	13464-57-8	O[As](=O)(O)[O-].[Rb+]	{20: 2, 29: 2}
Did not match all atoms present	13464-58-9	O[As](O)O	{20: 3}
Did not match all atoms present	13464-68-1	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Sr+2].[Sr+2].[Sr+2]	{29: 8}
Did not match all atoms present	13464-73-8	[Br-].[Br-].[Br-].[Br-].[Rb+].[Au+3]	{18: 4}
Did not match all atoms present	13464-80-7	NN.NN.OS(=O)(=O)O	{20: 2, 29: 2, 30: 4}
Did not match all atoms present	13464-82-9	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[In+3].[In+3]	{29: 12}
Did not match all atoms present	13464-92-1	O.O.O.O.[Br-].[Br-].[Cd+2]	{18: 2}
Did not match all atoms present	13464-97-6	NN.[N+](=O)(O)[O-]	{20: 1, 30: 2}
Did not match all atoms present	13464-98-7	NN.[N+](=O)(O)[O-].[N+](=O)(O)[O-]	{20: 2, 30: 2}
Did not match all atoms present	13465-08-2	[NH3+]O.[N+](=O)([O-])[O-]	{20: 1}
Did not match all atoms present	13465-09-3	Br[In](Br)Br	{18: 3}
Did not match all atoms present	13465-10-6	[Cl-].[Cl-].[Cl-].[In+3]	{17: 3}
Did not match all atoms present	13465-15-1	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[In+3]	{17: 3, 29: 12}
Did not match all atoms present	13465-33-3	[O-]Br(=O)=O.[Hg+]	{18: 1, 29: 3}
Did not match all atoms present	13465-34-4	[O-][Cr](=O)(=O)[O-].[Hg+].[Hg+]	{29: 4}
Did not match all atoms present	13465-43-5	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.[Rh+3]	{}
Did not match all atoms present	13465-49-1	[O-][Mn](=O)(=O)=O.[Rb+]	{29: 4}
Did not match all atoms present	13465-55-9	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Sm+3]	{17: 3}
Did not match all atoms present	13465-58-2	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Sm+3].[Sm+3]	{29: 12}
Did not match all atoms present	13465-59-3	[Sc](Br)(Br)Br	{18: 3}
Did not match all atoms present	13465-60-6	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Sc+3]	{}
Did not match all atoms present	13465-61-7	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Sc+3].[Sc+3]	{29: 12}
Did not match all atoms present	13465-66-2	F[Se](F)(F)F	{16: 4}
Did not match all atoms present	13465-72-0	[SiH](I)(I)I	{19: 3}
Did not match all atoms present	13465-73-1	[Si]Br	{18: 1}
Did not match all atoms present	13465-74-2	[Si](Cl)(Cl)(Cl)Br	{17: 3, 18: 1}
Did not match all atoms present	13465-75-3	[Si](Cl)(Cl)(Br)Br	{17: 2, 18: 2}
Did not match all atoms present	13465-76-4	[Si](Cl)(Br)(Br)Br	{17: 1, 18: 3}
Did not match all atoms present	13465-77-5	[Si]([Si](Cl)(Cl)Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	13465-78-6	[Si]Cl	{17: 1}
Did not match all atoms present	13465-83-3	[SiH2](I)I	{19: 2}
Did not match all atoms present	13465-84-4	[Si](I)(I)(I)I	{19: 4}
Did not match all atoms present	13465-95-7	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ba+2]	{17: 2, 29: 8}
Did not match all atoms present	13465-98-0	[O-]S(=O)[O-].[Ag+].[Ag+]	{29: 3}
Did not match all atoms present	13466-21-2	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Ba+2].[Ba+2]	{29: 6, 22: 1}
Did not match all atoms present	13466-40-5	C1=CC=C(C=C1)/C=C/C=C/C=O	{26: 1, 14: 5, 6: 4}
Did not match all atoms present	13466-41-6	CC1=CC(=O)NC=C1	{32: 1, 1: 1, 14: 3, 25: 1}
Did not match all atoms present	13467-96-4	CCCCCCCCC(=O)OCCS[Sn](CCCC)(CCCC)SCCOC(=O)CCCCCCCC	{40: 2, 1: 4, 2: 24, 28: 2}
Did not match all atoms present	13468-00-3	CCCC[Sn]1(SCC(=O)OCCOC(=O)CS1)CCCC	{1: 2, 2: 6, 11: 4, 28: 2, 41: 2}
Did not match all atoms present	13468-27-4	CCN1C2=C(C=CC(=C2)N(C)C)C=C(C1=O)C3=CC=CC=C3	{1: 3, 2: 1, 33: 2, 14: 9, 25: 1}
Did not match all atoms present	13469-52-8	C1=CC(=CC=C1CC(C(=O)O)[NH3+])N(CCCl)CCCl.[Cl-]	{33: 1, 2: 5, 3: 1, 14: 4, 17: 3, 27: 1}
Did not match all atoms present	13469-97-1	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Yb+3].[Yb+3]	{29: 12}
Did not match all atoms present	13469-98-2	Br[Y](Br)Br	{18: 3}
Did not match all atoms present	134695-74-2	CC1=C(C(=C(C1[Si](C)(C)C)C)C)C	{1: 7, 12: 1, 15: 4}
Did not match all atoms present	13470-01-4	[O-]I(=O)=O.[O-]I(=O)=O.[Sr+2]	{19: 2, 29: 6}
Did not match all atoms present	13470-06-9	N(=O)[O-].N(=O)[O-].[Sr+2]	{34: 2, 29: 4}
Did not match all atoms present	13470-11-6	Br[W](Br)(Br)(Br)Br	{18: 5}
Did not match all atoms present	13470-13-8	Cl[W](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	13470-14-9	Cl[W](Cl)(Cl)(Cl)Cl	{17: 5}
Did not match all atoms present	13470-19-4	Br[U](Br)Br	{18: 3}
Did not match all atoms present	13470-22-9	I[U](I)(I)I	{19: 4}
Did not match all atoms present	13470-26-3	[V](Br)(Br)Br	{18: 3}
Did not match all atoms present	13471-35-7	B(C1=CC=CC=C1)(OC)OC	{1: 2, 22: 2, 14: 5}
Did not match all atoms present	13471-69-7	CC1=C(C=C(C=C1)N=C=O)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 8: 1, 14: 3, 29: 1}
Did not match all atoms present	13472-00-9	C1=CC(=CC=C1CCN)N	{2: 2, 30: 2, 14: 4}
Did not match all atoms present	13472-30-5	[O-][Si]([O-])([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{29: 4}
Did not match all atoms present	13472-31-6	O.O.O.[O-]I(=O)(=O)=O.[Na+]	{19: 1, 29: 4}
Did not match all atoms present	13472-33-8	[O-][Re](=O)(=O)=O.[Na+]	{29: 4}
Did not match all atoms present	13472-35-0	O.O.OP(=O)(O)[O-].[Na+]	{20: 2, 29: 2}
Did not match all atoms present	13472-36-1	O.O.O.O.O.O.O.O.O.O.[O-]P(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{29: 6, 22: 1}
Did not match all atoms present	13472-45-2	[O-][W](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	13473-26-2	C1=C2C(=C(C(=C1Br)O)Br)OC3=C(C(=C(C=C3C24C5=C(C(=C(C(=C5Cl)Cl)Cl)Cl)C(=O)O4)Br)O)Br	{13: 1, 14: 2, 17: 4, 18: 4, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	13473-57-9	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ho+3].[Ho+3]	{29: 12}
Did not match all atoms present	13473-77-3	O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Lu+3].[Lu+3]	{29: 12}
Did not match all atoms present	13474-03-8	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)[O-])O)O.[Na+]	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 3, 22: 1, 23: 1, 29: 2, 30: 1}
Did not match all atoms present	13476-05-6	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Er+3]	{}
Did not match all atoms present	13476-55-6	CCCCCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 5, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	13476-99-8	CC(=O)CC(=O)C.CC(=O)CC(=O)C.CC(=O)CC(=O)C.[V]	{24: 6, 1: 6, 2: 3}
Did not match all atoms present	134761-64-1	CCCCCCCCOCCOCCOCCOCCOS(=O)(=O)C	{1: 2, 2: 15, 29: 2, 22: 5}
Did not match all atoms present	134761-87-8	C(=O)(C(=O)[O-])[O-].[Co+2]	{24: 2}
Did not match all atoms present	13477-00-4	[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Ba+2]	{17: 2, 29: 6}
Did not match all atoms present	13477-04-8	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Ba+2].[Ba+2].[Ba+2]	{29: 8}
Did not match all atoms present	13477-10-6	[O-]Cl.[O-]Cl.[Ba+2]	{17: 2, 29: 2}
Did not match all atoms present	13477-17-3	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Cd+2].[Cd+2].[Cd+2]	{29: 8}
Did not match all atoms present	13477-19-5	[O-][Si](=O)[O-].[Cd+2]	{29: 3}
Did not match all atoms present	13477-23-1	[O-]S(=O)[O-].[Cd+2]	{29: 3}
Did not match all atoms present	13477-29-7	O.[Cl-].[Cl-].[Ca+2]	{17: 2}
Did not match all atoms present	13477-34-4	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.[Ca+2]	{}
Did not match all atoms present	13477-36-6	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ca+2]	{17: 2, 29: 8}
Did not match all atoms present	13477-70-8	O[As](=O)(O)O.[Ni]	{20: 3, 29: 1}
Did not match all atoms present	13477-89-9	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Nd+3]	{17: 3}
Did not match all atoms present	13477-91-3	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Nd+3].[Nd+3]	{29: 12}
Did not match all atoms present	13477-95-7	[C-]#N.[C-]#N.O.O.O.O.[Ni+2]	{}
Did not match all atoms present	13478-00-7	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Ni+2]	{}
Did not match all atoms present	13478-06-3	O.O.O.O.O.O.[Cr+3].[Br-].[Br-].[Br-]	{18: 3}
Did not match all atoms present	13478-14-3	[Li+].[Li+].[Li+].[O-][As](=O)([O-])[O-]	{29: 4}
Did not match all atoms present	13478-16-5	[NH4+].O.O.O.O.O.O.[O-]P(=O)([O-])[O-].[Mg+2]	{29: 4}
Did not match all atoms present	13478-17-6	Cl[Mo]Cl	{17: 2}
Did not match all atoms present	13478-18-7	Cl[Mo](Cl)Cl	{17: 3}
Did not match all atoms present	13478-20-1	O=P(F)(F)F	{16: 3, 29: 1}
Did not match all atoms present	13478-28-9	[Cr+2].[I-].[I-]	{19: 2}
Did not match all atoms present	13478-38-1	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Cu+2]	{}
Did not match all atoms present	13478-41-6	F[Cu]	{16: 1}
Did not match all atoms present	13478-45-0	[Br-].[Br-].[Br-].[Br-].[Br-].[Nb+5]	{18: 5}
Did not match all atoms present	13478-49-4	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Er+3].[Er+3]	{29: 12}
Did not match all atoms present	13478-50-7	[O-]S(=O)(=S)[O-].[Pb+2]	{29: 3}
Did not match all atoms present	13479-19-1	CCNCCNC1=C2C(=C(C=C1)CO)SC3=CC=CC=C3C2=O	{1: 1, 2: 4, 41: 1, 14: 6, 20: 1, 25: 1, 31: 2}
Did not match all atoms present	13479-29-3	C1=NC2=C(N1)C(=O)NC(=O)N2O	{32: 2, 33: 1, 35: 1, 14: 1, 21: 1, 25: 2}
Did not match all atoms present	13479-54-4	C(C(=O)[O-])N.C(C(=O)[O-])N.[Cu+2]	{24: 2, 2: 2, 30: 2}
Did not match all atoms present	13481-70-4	CC1=C(C(=C(C=C1)Cl)O)Cl	{1: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	13482-49-0	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Tb+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	13482-64-9	C(P(=O)(CCl)Cl)Cl	{17: 3, 2: 2, 29: 1}
Did not match all atoms present	13484-13-4	C1C(O1)C2=CC3=C(O3)C=C2	{11: 1, 12: 1, 14: 3, 23: 2}
Did not match all atoms present	134855-87-1	CC(C1=CC=C(C=C1)O)N	{1: 1, 30: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	13486-13-0	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)NN=C3N=CN=N3	{1: 1, 2: 2, 35: 3, 33: 1, 34: 1, 14: 10, 15: 1, 31: 1}
Did not match all atoms present	13486-43-6	CCN(CCO)C1=CC=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)OC	{1: 2, 2: 3, 35: 1, 33: 1, 41: 1, 34: 2, 14: 7, 20: 1, 22: 1}
Did not match all atoms present	13492-01-8	C1C(C1N)C2=CC=CC=C2.C1C(C1N)C2=CC=CC=C2.OS(=O)(=O)O	{11: 2, 12: 4, 14: 10, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	13492-24-5	O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Mn+2]	{29: 4}
Did not match all atoms present	134931-98-9	CC1=C(C(=C2CCC(OC2=C1C)(C)CCC=C(C)CCC=C(C)CCC=C(C)C)C)O	{1: 8, 2: 6, 6: 3, 7: 3, 11: 2, 13: 1, 21: 1, 23: 1}
Did not match all atoms present	13494-38-7	C1=CC=C(C=C1)C2=C(N(C3=CC=CC=C3[N+]2=O)[O-])C(=O)C4=CC=CC=C4	{24: 1, 33: 2, 29: 2, 14: 14}
Did not match all atoms present	13494-80-9	[Te]	{}
Did not match all atoms present	13494-88-7	[Bi+2].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	13494-90-1	O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ga+3]	{}
Did not match all atoms present	13494-98-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Y+3]	{}
Did not match all atoms present	13495-09-5	CCOC(=O)C1(CCN(CC1)CCCNC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 4, 33: 1, 11: 4, 13: 1, 14: 10, 28: 1, 31: 1}
Did not match all atoms present	13497-05-7	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)[O-])/C)/C.[Na+]	{1: 5, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 24: 1}
Did not match all atoms present	13497-18-2	CCO[Si](CCCNCCC[Si](OCC)(OCC)OCC)(OCC)OCC	{1: 6, 2: 12, 22: 6, 31: 1}
Did not match all atoms present	13497-25-1	CCCCOC(=O)CC(C(=O)OCCCC)S[Sn](CCCC)(CCCC)SC(CC(=O)OCCCC)C(=O)OCCCC	{40: 2, 1: 6, 2: 20, 3: 2, 28: 4}
Did not match all atoms present	13497-36-4	C1=CC=C(C=C1)C2=CC(=PC(=C2)C3=CC=CC=C3)C4=CC=CC=C4	{14: 17}
Did not match all atoms present	13497-91-1	P(P(Cl)Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	13497-96-6	F[Al](Cl)Cl	{16: 1, 17: 2}
Did not match all atoms present	13498-07-2	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Pr+3]	{17: 3, 29: 12}
Did not match all atoms present	13498-08-3	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Yb+3]	{17: 3, 29: 12}
Did not match all atoms present	13499-05-3	Cl[Hf](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	135-00-2	C1=CC=C(C=C1)C(=O)C2=CC=CS2	{24: 1, 41: 1, 14: 8}
Did not match all atoms present	135-01-3	CCC1=CC=CC=C1CC	{1: 2, 2: 2, 14: 4}
Did not match all atoms present	135-02-4	COC1=CC=CC=C1C=O	{1: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	135-07-9	CN1C(NC2=CC(=C(C=C2S1(=O)=O)S(=O)(=O)N)Cl)CCl	{32: 1, 1: 1, 2: 1, 33: 1, 12: 1, 14: 2, 17: 2, 29: 4, 30: 1}
Did not match all atoms present	135-09-1	C1NC2=C(C=C(C(=C2)C(F)(F)F)S(=O)(=O)N)S(=O)(=O)N1	{32: 2, 4: 1, 11: 1, 14: 2, 16: 3, 29: 4, 30: 1}
Did not match all atoms present	135-10-4	C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)N)C(=O)O	{30: 1, 27: 2, 29: 2, 14: 7, 31: 1}
Did not match all atoms present	135-11-5	C1=CC(=CC=C1N)NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-]	{38: 1, 14: 7, 20: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	135-12-6	C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])Cl	{17: 2, 38: 1, 22: 1, 14: 7}
Did not match all atoms present	135-14-8	C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)NC3=CC4=C(C=C3)[N+](=CC=C4)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]	{1: 4, 33: 2, 14: 12, 22: 2, 24: 1, 29: 6, 31: 2}
Did not match all atoms present	135-15-9	CCCCOC1=CC(=C(C=C1)OCCCC)[N+](=O)[O-]	{1: 2, 2: 6, 38: 1, 22: 2, 14: 3}
Did not match all atoms present	135-16-0	C1C(NC2=C(N1)NC(=NC2=O)N)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O	{32: 3, 2: 3, 3: 1, 11: 1, 12: 1, 14: 4, 35: 1, 24: 1, 25: 1, 27: 2, 30: 1, 31: 2}
Did not match all atoms present	135-19-3	C1=CC=C2C=C(C=CC2=C1)O	{21: 1, 14: 7}
Did not match all atoms present	135-20-6	C1=CC=C(C=C1)N(N=O)[O-]	{33: 1, 34: 1, 29: 2, 14: 5}
Did not match all atoms present	135-22-8	C1CCN(CC1)CN2C=C(C3=CC=CC=C32)CC4=CN(C5=CC=CC=C54)CN6CCCCC6	{33: 4, 2: 3, 11: 10, 14: 10}
Did not match all atoms present	135-23-9	CN(C)CCN(CC1=CC=CS1)C2=CC=CC=N2.Cl	{1: 2, 2: 3, 35: 1, 33: 2, 41: 1, 14: 7, 17: 1}
Did not match all atoms present	135-44-4	CCN(CC)C(CC(C)C)COC(=O)C1=CC=C(C=C1)N	{1: 4, 2: 4, 3: 2, 33: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	135-48-8	C1=CC=C2C=C3C=C4C=C5C=CC=CC5=CC4=CC3=CC2=C1	{14: 14}
Did not match all atoms present	135-49-9	CC1=CC2=CC3=CC(=C(C=C3N=C2C=C1N)N)C.Cl	{1: 2, 35: 1, 30: 2, 14: 5, 17: 1}
Did not match all atoms present	135-50-2	C1=CC(=CC2=CC(=C(C=C21)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 29: 6, 14: 5}
Did not match all atoms present	135-51-3	C1=CC(=CC2=CC(=C(C=C21)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{21: 1, 14: 5, 29: 6}
Did not match all atoms present	135-55-7	C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)[O-])O.[Na+]	{21: 1, 14: 6, 29: 3}
Did not match all atoms present	135-57-9	C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SSC3=CC=CC=C3NC(=O)C4=CC=CC=C4	{24: 2, 40: 2, 14: 18, 31: 2}
Did not match all atoms present	135-61-5	CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2O	{24: 1, 1: 1, 21: 1, 14: 10, 31: 1}
Did not match all atoms present	135-62-6	COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2O	{1: 1, 14: 10, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	135-64-8	C1=CC=C2C=C(C=CC2=C1)NC(=O)C3=CC4=CC=CC=C4C=C3O	{24: 1, 21: 1, 14: 13, 31: 1}
Did not match all atoms present	135-67-1	C1=CC=C2C(=C1)NC3=CC=CC=C3O2	{32: 1, 14: 8, 23: 1}
Did not match all atoms present	135-68-2	C1=CC(=CC=C1C2=CC=C(C=C2)Cl)N	{17: 1, 30: 1, 14: 8}
Did not match all atoms present	135-69-3	CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 8}
Did not match all atoms present	135-70-6	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4=CC=CC=C4	{14: 18}
Did not match all atoms present	135-71-7	C1=CC(=CC=C1C2=CC=C(C=C2)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 34: 2, 14: 16}
Did not match all atoms present	135-72-8	CCN(CCO)C1=CC=C(C=C1)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 14: 4, 20: 1, 29: 1}
Did not match all atoms present	135-73-9	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CBr	{24: 1, 2: 1, 18: 1, 14: 9}
Did not match all atoms present	135-76-2	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C=C1O.[Na+]	{21: 1, 14: 6, 29: 3}
Did not match all atoms present	135-77-3	COC1=CC(=C(C=C1)OC)OC	{1: 3, 22: 3, 14: 3}
Did not match all atoms present	135-79-5	CC(C)C1=CC2=C(C=C1)N=CC=C2	{1: 2, 3: 1, 14: 6, 35: 1}
Did not match all atoms present	135-85-3	COC1=C(C=C(C=C1)CNN)OC	{1: 2, 2: 1, 14: 3, 22: 2, 30: 1, 31: 1}
Did not match all atoms present	135-88-6	C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C=C2	{14: 12, 31: 1}
Did not match all atoms present	135-91-1	CCN(CC)C1=CC=C(C=C1)CC2=CC=C(C=C2)N(CC)CC	{1: 4, 2: 5, 14: 8, 33: 2}
Did not match all atoms present	135-98-8	CCC(C)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	135006-63-2	CCC1=CC=CC(=C1NC2=CC(=CC=C2)O)C	{1: 2, 2: 1, 21: 1, 14: 7, 31: 1}
Did not match all atoms present	135014-87-8	CCOC1=CC=C(C=C1)CC(C)N.Cl	{1: 2, 2: 2, 3: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	13502-13-1	CCCCCCCCCCCC/C=C\S(=O)(=O)[O-].[Na+]	{1: 1, 2: 11, 29: 3, 6: 2}
Did not match all atoms present	13502-26-6	CCCCCCCCC/C=C/CS(=O)(=O)[O-].[Na+]	{1: 1, 2: 9, 29: 3, 6: 2}
Did not match all atoms present	13502-28-8	CCCCCCCCCC(CCS(=O)(=O)[O-])O.[Na+]	{1: 1, 2: 10, 3: 1, 20: 1, 29: 3}
Did not match all atoms present	135043-68-4	C(CCC(=O)[O-])CCNC1=NC(=NC(=N1)NCCCCCC(=O)[O-])NCCCCCC(=O)[O-].[Na+].[Na+].[Na+]	{24: 3, 2: 15, 35: 3, 31: 3}
Did not match all atoms present	135043-69-5	C(CCC(=O)[O-])CCNC1=NC(=NC(=N1)NCCCCCC(=O)[O-])NCCCCCC(=O)[O-].[K+].[K+].[K+]	{24: 3, 2: 15, 35: 3, 31: 3}
Did not match all atoms present	135050-44-1	C1=CC(=C(C=C1N)Cl)I	{17: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	13506-76-8	CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)O	{1: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	13508-53-7	CCO[Si](C)(C)CCl	{1: 3, 2: 2, 22: 1, 17: 1}
Did not match all atoms present	13509-27-8	COC(=O)OC1=CC=CC=C1	{1: 1, 14: 5}
Did not match all atoms present	13509-52-9	CC1=CC(=O)N(C(=O)N1C)C	{1: 3, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	13510-35-5	[In](I)(I)I	{19: 3}
Did not match all atoms present	13510-41-3	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Pr+3].[Pr+3]	{29: 12}
Did not match all atoms present	13510-42-4	[O-]Cl(=O)(=O)=O.[Rb+]	{17: 1, 29: 4}
Did not match all atoms present	13510-44-6	[O-][As](=O)([O-])[O-].[Ag+].[Ag+].[Ag+]	{29: 4}
Did not match all atoms present	13510-46-8	O.O.O.O.O.O.O.O.O.O.O.O.[O-][As](=O)([O-])[O-].[Na+].[Na+].[Na+]	{29: 4}
Did not match all atoms present	13510-48-0	[Be+2].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O	{}
Did not match all atoms present	13510-49-1	[Be+2].[O-]S(=O)(=O)[O-]	{29: 4}
Did not match all atoms present	13510-60-6	COC1=C(C=CC(=C1)NC2=CC=CC=C2)[N+]#N.[Cl-]	{1: 1, 34: 1, 14: 8, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	13510-99-1	[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[U]	{}
Did not match all atoms present	135108-89-3	CC(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O	{1: 1, 2: 2, 3: 1, 14: 6, 20: 2, 27: 2, 28: 2}
Did not match all atoms present	13513-82-1	CC(C1=CC=CC=C1OC)O	{1: 2, 3: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	135158-54-2	CSC(=O)C1=C2C(=CC=C1)N=NS2	{1: 1, 35: 2, 40: 1, 41: 1, 14: 3, 24: 1}
Did not match all atoms present	13517-00-5	[CuH]	{}
Did not match all atoms present	13517-06-1	O.O.[Na+].[I-]	{19: 1}
Did not match all atoms present	13517-08-3	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ba+2].[Ba+2].[Ba+2]	{29: 8}
Did not match all atoms present	13517-10-7	B(I)(I)I	{19: 3}
Did not match all atoms present	13517-12-9	O.O.O.O.O.O.[Br-].[Br-].[Br-].[Sm+3]	{18: 3}
Did not match all atoms present	13517-17-4	O.O.O.O.O.O.O.O.O.O.[O-][Cr](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	13517-24-3	O.O.O.O.O.O.O.O.O.[O-][Si](=O)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	13517-26-5	[O-2].[O-2].[O-2].[Na+].[V]	{}
Did not match all atoms present	13517-49-2	CCC(C1=CC=C(C=C1)S(=O)(=O)[O-])C(CC)C2=CC=C(C=C2)S(=O)(=O)[O-].[K+].[K+]	{1: 2, 2: 2, 3: 2, 29: 6, 14: 8}
Did not match all atoms present	135192-53-9	C1(=C(C(=C(C(=C1F)F)F)F)F)OC(=S)Cl	{16: 5, 17: 1, 22: 1, 7: 1}
Did not match all atoms present	135193-39-4	CC1=C(C=CC(=C1NC(C)(C)C)C(C)(C)C)N	{1: 7, 4: 2, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	13520-59-7	Br[Mo](Br)(Br)Br	{18: 4}
Did not match all atoms present	13520-66-6	O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cr+3].[Cr+3]	{29: 12}
Did not match all atoms present	13520-68-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Fe+2]	{}
Did not match all atoms present	13520-69-9	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+2]	{17: 2, 29: 8}
Did not match all atoms present	13520-75-7	O=[W]=O.Br.Br	{18: 2, 29: 2}
Did not match all atoms present	13520-77-9	O=[W].Br.Br.Br.Br	{18: 4, 29: 1}
Did not match all atoms present	13520-78-0	[Cl-].[Cl-].[Cl-].[Cl-].[O].[W+4]	{17: 4}
Did not match all atoms present	13520-79-1	O=[W].F.F.F.F	{16: 4, 29: 1}
Did not match all atoms present	13520-87-1	O=[V].Cl	{17: 1, 29: 1}
Did not match all atoms present	13520-92-8	O.O.O.O.O.O.O.O.O=[Zr].Cl.Cl	{17: 2, 29: 1}
Did not match all atoms present	13520-96-2	CN(C)C1=CC=C(C=C1)N=NC2=CC=[N+](C=C2)[O-]	{1: 2, 34: 2, 29: 1, 14: 8, 33: 2}
Did not match all atoms present	13523-86-9	CC(C)NCC(COC1=CC=CC2=C1C=CN2)O	{32: 1, 1: 2, 2: 2, 3: 2, 14: 5, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	13524-04-4	CC(C1=CC=CC=C1Cl)O	{1: 1, 3: 1, 20: 1, 14: 4, 17: 1}
Did not match all atoms present	13528-88-6	C[Si](C)([Si](C)(Cl)Cl)Cl	{1: 3, 17: 3}
Did not match all atoms present	13528-93-3	C[Si](C)(CC[Si](C)(C)Cl)Cl	{1: 4, 2: 2, 17: 2}
Did not match all atoms present	135286-85-0	CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.C[N+](C)(CC=C)CC=C.[Na+].[Cl-]	{1: 4, 2: 3, 4: 1, 5: 3, 6: 3, 17: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	13529-27-6	CCOC(C1=CC=CO1)OCC	{1: 2, 2: 2, 3: 1, 14: 3, 22: 2, 23: 1}
Did not match all atoms present	13530-57-9	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Rb+]	{29: 8}
Did not match all atoms present	13530-65-9	[O-][Cr](=O)(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	13530-67-1	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Cs+].[Cs+]	{29: 6, 22: 1}
Did not match all atoms present	135302-13-5	CN1C(=O)NN=C1OC	{32: 1, 1: 2, 35: 1, 33: 1, 22: 1, 25: 1}
Did not match all atoms present	135306-45-5	CCC(=O)C1=CC(=CC(=C1)F)F	{16: 2, 1: 1, 2: 1, 14: 3, 24: 1}
Did not match all atoms present	13531-48-1	COC(=O)C1=CC=CC(=C1)C#N	{1: 1, 28: 1, 37: 1, 14: 4}
Did not match all atoms present	13534-89-9	C1=CC(=C(N=C1)Br)Br	{18: 2, 35: 1, 14: 3}
Did not match all atoms present	13534-97-9	C1=CC(=NC=C1N)Br	{18: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	13534-98-0	C1=CN=CC(=C1N)Br	{18: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	13534-99-1	C1=CC(=C(N=C1)N)Br	{18: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	13536-48-6	P(Cl)(Cl)Br	{17: 2, 18: 1}
Did not match all atoms present	13536-53-3	Br[Pr](Br)Br	{18: 3}
Did not match all atoms present	13536-59-9	[2H]Br	{18: 1}
Did not match all atoms present	13536-71-5	Cl[Ge](Br)(Br)Br	{17: 1, 18: 3}
Did not match all atoms present	13536-73-7	[Br-].[Br-].[Br-].[Er+3]	{18: 3}
Did not match all atoms present	13536-79-3	[Br-].[Br-].[Br-].[La+3]	{18: 3}
Did not match all atoms present	13536-80-6	[Br-].[Br-].[Br-].[Nd+3]	{18: 3}
Did not match all atoms present	13536-84-0	O=[U]=O.F.F	{16: 2, 29: 2}
Did not match all atoms present	13536-88-4	[O-][Si]([O-])([O-])O[Si]([O-])([O-])[O-].[Ce+3].[Ce+3]	{29: 6, 22: 1}
Did not match all atoms present	13536-94-2	[2H]S[2H]	{}
Did not match all atoms present	13537-03-6	[2H]P([2H])[2H]	{}
Did not match all atoms present	13537-09-2	[H-].[H-].[H-].[Dy+3]	{}
Did not match all atoms present	13537-18-3	Cl[Tm](Cl)Cl	{17: 3}
Did not match all atoms present	13537-21-8	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cr+3]	{17: 3, 29: 12}
Did not match all atoms present	13537-22-9	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Eu+3]	{17: 3, 29: 12}
Did not match all atoms present	13537-24-1	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+3]	{17: 3, 29: 12}
Did not match all atoms present	13537-30-9	F[GeH3]	{16: 1}
Did not match all atoms present	13537-32-1	OP(=O)(O)F	{16: 1, 20: 2, 29: 1}
Did not match all atoms present	13537-33-2	F[Si]	{16: 1}
Did not match all atoms present	13539-59-8	CCCC1C(=O)N2C3=C(C=CC(=C3)C)N=C(N2C1=O)N(C)C	{1: 4, 2: 2, 35: 1, 33: 3, 12: 1, 14: 3, 15: 1, 25: 2}
Did not match all atoms present	13540-50-6	CC1=CC(=C(C=C1)C)CC2=CC=CC=C2	{1: 2, 2: 1, 14: 8}
Did not match all atoms present	135427-08-6	CC1=C(C=CC(=C1)C=O)F	{16: 1, 1: 1, 26: 1, 14: 3}
Did not match all atoms present	135445-19-1	CCCCCCOP(=O)(CC)F	{16: 1, 1: 2, 2: 6, 29: 1, 22: 1}
Did not match all atoms present	13545-65-8	C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3C=C2)O	{24: 1, 21: 1, 14: 11, 31: 1}
Did not match all atoms present	13545-67-0	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O	{1: 2, 2: 2, 33: 1, 34: 2, 14: 8, 20: 1, 29: 2}
Did not match all atoms present	135470-04-1	C1=CC(=CC(=C1)CN)CN.C(C(CN)O)N	{2: 4, 3: 1, 20: 1, 30: 4, 14: 4}
Did not match all atoms present	13548-38-4	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cr+3]	{}
Did not match all atoms present	13548-42-0	[O-][Cr](=O)(=O)[O-].[Cu+2]	{29: 4}
Did not match all atoms present	13550-32-8	P(Cl)(Br)Br	{17: 1, 18: 2}
Did not match all atoms present	13550-49-7	[2H]N([2H])[2H]	{}
Did not match all atoms present	13550-52-2	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Dy+3].[Dy+3].[W].[W].[W]	{}
Did not match all atoms present	13551-73-0	CC1=NN(C(=C1[N+](=O)[O-])Cl)C	{1: 2, 35: 1, 33: 1, 38: 1, 17: 1}
Did not match all atoms present	13551-87-6	COCC(CN1C=CN=C1[N+](=O)[O-])O	{1: 1, 2: 2, 3: 1, 38: 1, 33: 1, 14: 2, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	13551-92-3	C1=CN(C(=N1)[N+](=O)[O-])CC(CO)O	{33: 1, 2: 2, 3: 1, 38: 1, 14: 2, 35: 1, 20: 2}
Did not match all atoms present	13552-44-8	C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.Cl.Cl	{17: 2, 2: 1, 30: 2, 14: 8}
Did not match all atoms present	13553-79-2	C[C@H]1/C=C/C=C(\C(=O)NC2=CC(=O)C3=C4C(=C(C(=C3C2=O)O)C)O[C@@](C4=O)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)/C	{32: 1, 1: 9, 12: 8, 13: 1, 14: 6, 15: 2, 20: 2, 21: 1, 22: 1, 23: 2, 25: 4, 28: 1}
Did not match all atoms present	13556-50-8	C1=CC(=CC(=C1)N=[N+]=[N-])N=[N+]=[N-]	{34: 4, 14: 4}
Did not match all atoms present	13556-55-3	CC1(CCC2=CC=CC=C2C1)C	{1: 2, 11: 3, 13: 1, 14: 4}
Did not match all atoms present	13556-58-6	CCC1CCCC2=CC=CC=C12	{1: 1, 2: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	13556-84-8	C1=CC=C(C(=C1)N=[N+](C2=CC=CC=C2Cl)[O-])Cl	{17: 2, 34: 1, 29: 1, 14: 8, 33: 1}
Did not match all atoms present	13557-46-5	C1=CC=C2C(=C1)C(=CC(=C2[O-])N=O)S(=O)(=O)[O-].C1=CC=C2C(=C1)C(=CC(=C2[O-])N=O)S(=O)(=O)[O-].C1=CC=C2C(=C1)C(=CC(=C2[O-])N=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Fe+3]	{34: 3, 29: 12, 14: 15}
Did not match all atoms present	13557-98-7	CCCCOC(=O)C(C)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 3, 3: 1, 14: 2, 17: 3, 22: 1, 28: 1}
Did not match all atoms present	13558-31-1	C1=CC=C(C(=C1)C2=C3C=CC(=[NH2+])C=C3OC4=C2C=CC(=C4)N)C(=O)O.[Cl-]	{17: 1, 27: 1, 30: 2, 14: 10, 23: 1}
Did not match all atoms present	135585-40-9	CCCCCCCCCCCCCCCCCCC(C)C1=CC=CC2=CC=CC=C21	{1: 2, 2: 17, 3: 1, 14: 7}
Did not match all atoms present	13561-08-5	C1C(O1)CC2=C(C(=CC=C2)CC3CO3)OCC4CO4	{2: 3, 11: 3, 12: 3, 14: 3, 22: 1, 23: 3}
Did not match all atoms present	135620-04-1	CC(C)(C)C1=CC(=C(C(=C1)C=NC2CCCCC2N=CC3=CC(=CC(=C3[O-])C(C)(C)C)C(C)(C)C)[O-])C(C)(C)C.[Cl-].[Mn+3]	{1: 12, 34: 2, 4: 4, 6: 2, 11: 4, 12: 2, 14: 4, 17: 1}
Did not match all atoms present	13565-36-1	CCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 6, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	13565-97-4	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Zr+4]	{29: 6, 22: 1}
Did not match all atoms present	135659-79-9	[CH2-]O.[Ni]	{20: 1, 5: 1}
Did not match all atoms present	13566-03-5	[O-]S(=O)(=O)[O-].[Pd+2]	{29: 4}
Did not match all atoms present	13566-05-7	[O-2].[O-2].[O-2].[V].[Rb+]	{}
Did not match all atoms present	13566-12-6	[O-][V](=O)([O-])[O-].[Y+3]	{29: 4}
Did not match all atoms present	13566-15-9	[O-]P(=O)=O.[O-]P(=O)=O.[Zn+2]	{29: 6}
Did not match all atoms present	13567-11-8	CC[C@H](C)[C@H]1C(=O)NCC(=O)N[C@H]2CSC3=C(C[C@@H](C(=O)NCC(=O)N1)NC(=O)C(NC(=O)[C@@H]4C[C@H](CN4C(=O)[C@H](NC2=O)CC(=O)N)O)[C@@H](C)[C@@H](C)O)C5=C(N3)C=C(C=C5)O	{32: 8, 1: 4, 2: 2, 3: 3, 33: 1, 41: 1, 11: 6, 12: 7, 14: 3, 20: 2, 21: 1, 24: 1, 25: 8, 30: 1}
Did not match all atoms present	135673-97-1	C1CCC(CC1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 2, 3: 1, 11: 5, 12: 2, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	13568-33-7	[Li+].N(=O)[O-]	{34: 1, 29: 2}
Did not match all atoms present	13568-40-6	[Li+].[Li+].[O-][Mo](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	13568-45-1	[Li+].[Li+].[O-][W](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	135682-18-7	COC[C@H]1COC(=O)O1	{1: 1, 2: 1, 11: 1, 12: 1, 22: 1}
Did not match all atoms present	13569-43-2	[GeH3]Br	{18: 1}
Did not match all atoms present	13569-59-0	Cl[Nb](Cl)Cl	{17: 3}
Did not match all atoms present	13569-62-5	[Cl-].[Cl-].[Cl-].[Pu]	{17: 3}
Did not match all atoms present	13569-63-6	Cl[Re](Cl)Cl	{17: 3}
Did not match all atoms present	13569-67-0	Cl[Ta](Cl)Cl	{17: 3}
Did not match all atoms present	13569-70-5	Cl[Nb](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	13569-72-7	Cl[Ta](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	13569-75-0	[Cr](I)(I)I	{19: 3}
Did not match all atoms present	135711-18-1	CC[C@H](CO)N1CC2=CC=CC=C2C1	{1: 1, 2: 2, 3: 1, 33: 1, 11: 2, 14: 4, 20: 1}
Did not match all atoms present	13572-97-9	[H-].[H-].[H-].[Gd+3]	{}
Did not match all atoms present	13572-98-0	[Gd+3].[I-].[I-].[I-]	{19: 3}
Did not match all atoms present	13572-99-1	[GeH]	{}
Did not match all atoms present	13573-02-9	[GeH3]I	{19: 1}
Did not match all atoms present	13573-06-3	P.[GeH3]	{}
Did not match all atoms present	13573-08-5	[Ge](I)I	{19: 2}
Did not match all atoms present	13573-11-0	[O-][W](=O)(=O)[O-].[Mg+2]	{29: 4}
Did not match all atoms present	13573-13-2	[O-][V](=O)=O.[O-][V](=O)=O.[Mg+2]	{29: 6}
Did not match all atoms present	13573-15-4	[O-][Si]([O-])([O-])O[Si]([O-])([O-])[O-].[Mg+2].[Ca+2].[Ca+2]	{29: 6, 22: 1}
Did not match all atoms present	13573-16-5	C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].[NH4+].N.N.[Cr+3]	{37: 4}
Did not match all atoms present	13573-18-7	OP(=O)([O-])OP(=O)(O)OP(=O)(O)[O-].[Na+].[Na+]	{20: 3, 29: 5, 22: 2}
Did not match all atoms present	13574-13-5	CC(C)(C)OC(=O)N[C@@H](CCC(=O)OCC1=CC=CC=C1)C(=O)O	{1: 3, 2: 3, 3: 1, 4: 1, 14: 5, 27: 1, 28: 2, 31: 1}
Did not match all atoms present	135742-55-1	CCCCCCCCCC(=O)NC(=O)C1=NC=CN=C1	{1: 1, 2: 8, 35: 2, 14: 3, 24: 2, 31: 1}
Did not match all atoms present	13575-60-5	CCN(CC)C(=S)SCNC(=O)NCSC(=S)N(CC)CC	{1: 4, 2: 6, 33: 2, 40: 2, 7: 2, 24: 1, 31: 2}
Did not match all atoms present	13575-74-1	COC1=C(C=C(C=C1)CCCC(=O)O)OC	{1: 2, 2: 3, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	135768-83-1	C[C@]12CC[C@H]3[C@H](C14CC[C@@]2([C@H](C4)O)O)CCC5=C3C=CC(=C5)O	{1: 1, 11: 7, 12: 3, 13: 3, 14: 3, 20: 2, 21: 1}
Did not match all atoms present	13578-25-1	CNC(=O)N(C)C1=CC=C(C=C1)Cl	{1: 2, 33: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	135805-96-8	CC1=C(C=CC(=C1)[N+](=O)[O-])N=C=S	{8: 1, 1: 1, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	13581-52-7	CS(=O)(=O)C1=CC=C(C=C1)C(CN2C3=C(CCCC3)SC2=N)O	{1: 1, 2: 1, 3: 1, 36: 1, 33: 1, 41: 1, 11: 4, 14: 4, 20: 1, 29: 2}
Did not match all atoms present	13586-38-4	[NH4+].O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Co+2]	{29: 4}
Did not match all atoms present	13587-16-1	[2H-].[Li+]	{}
Did not match all atoms present	13587-20-7	[O-][U](=O)(=O)O[U](=O)(=O)[O-].[Cs+].[Cs+]	{29: 6, 22: 1}
Did not match all atoms present	13587-49-0	[2H]N	{}
Did not match all atoms present	13587-50-3	[1H]P	{}
Did not match all atoms present	13587-51-4	[2H][Si]	{}
Did not match all atoms present	13587-52-5	[2H]O[N+](=O)[O-]	{20: 1}
Did not match all atoms present	13587-54-7	[2H][O]	{}
Did not match all atoms present	13588-33-5	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=CC=C(C=C3)C(=O)NC4=CC(=CC=C4)S(=O)(=O)CCOS(=O)(=O)O)/C2=O)S(=O)(=O)O	{1: 1, 2: 2, 34: 1, 14: 11, 15: 2, 20: 3, 22: 1, 24: 2, 25: 1, 29: 8, 31: 3}
Did not match all atoms present	13590-71-1	CO[P+](=O)O	{1: 1, 20: 1, 29: 1, 22: 1}
Did not match all atoms present	13590-82-4	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ce+4]	{29: 8}
Did not match all atoms present	135929-41-8	CCO[Si](OCC)(OCC)OCC.Cl[Sb](Cl)Cl	{1: 4, 2: 4, 22: 4, 17: 3}
Did not match all atoms present	135929-42-9	CCO.Cl[Ta](Cl)(Cl)(Cl)Cl	{1: 1, 2: 1, 20: 1, 17: 5}
Did not match all atoms present	135929-43-0	CCO[Si](OCC)(OCC)OCC.O=P(Cl)(Cl)Cl	{1: 4, 2: 4, 29: 1, 22: 4, 17: 3}
Did not match all atoms present	13593-03-8	CCOP(=S)(OCC)OC1=NC2=CC=CC=C2N=C1	{1: 2, 2: 2, 35: 2, 22: 3, 14: 5}
Did not match all atoms present	135936-92-4	CN(C)C1=CC=C(C=C1)C=C2C(=O)N(C(=O)N(C2=O)C3CCCCC3)C4CCCCC4	{1: 2, 6: 1, 33: 3, 11: 10, 12: 2, 14: 4, 15: 1, 25: 3}
Did not match all atoms present	135944-06-8	CC1=CC=CC=C1C[C@@H](C(=O)[O-])NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{1: 1, 2: 2, 3: 1, 12: 1, 14: 12, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	135944-07-9	C1C2=CC=CC=C2CC1(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35	{2: 1, 11: 2, 12: 1, 13: 1, 14: 12, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	135944-08-0	C1CC(CC2=CC=CC=C21)(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35	{2: 1, 11: 3, 12: 1, 13: 1, 14: 12, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	13595-25-0	CC(C)(C1=CC=C(C=C1)O)C2=CC(=CC=C2)C(C)(C)C3=CC=C(C=C3)O	{1: 4, 4: 2, 21: 2, 14: 12}
Did not match all atoms present	13595-81-8	[Al]Cl	{17: 1}
Did not match all atoms present	13595-82-9	F[Al](F)F	{16: 3}
Did not match all atoms present	13595-87-4	[O-][W](=O)(=O)[O-].[O-][W](=O)(=O)[O-].[O-][W](=O)(=O)[O-].[Bi+3].[Bi+3]	{29: 12}
Did not match all atoms present	13595-90-9	Cl[SnH2]Br	{17: 1, 18: 1}
Did not match all atoms present	13595-97-6	Br[I-]Br.[Rb+]	{18: 2, 19: 1}
Did not match all atoms present	13596-11-7	O=[Al].Cl	{17: 1, 29: 1}
Did not match all atoms present	13596-12-8	O=[Al].F	{16: 1, 29: 1}
Did not match all atoms present	13596-18-4	[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[Mg+2].[Ca+2].[Ca+2].[Ca+2]	{29: 8}
Did not match all atoms present	13596-23-1	[Si]([Si](Cl)(Cl)Cl)([Si](Cl)(Cl)Cl)(Cl)Cl	{17: 8}
Did not match all atoms present	13596-35-5	Cl[Re](Cl)(Cl)(Cl)Cl	{17: 5}
Did not match all atoms present	13596-46-8	[NH4+].[NH4+].O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Co+2]	{29: 8}
Did not match all atoms present	13596-75-3	CCCS(=O)(=O)C1=CC=CC=C1	{1: 1, 2: 2, 29: 2, 14: 5}
Did not match all atoms present	13597-19-8	[O-2].[O-2].[O-2].[O-2].[V].[Ce+3]	{}
Did not match all atoms present	13597-25-6	O=[Nb]=O.F	{16: 1, 29: 2}
Did not match all atoms present	13597-30-3	O(F)F.[Th]	{16: 2, 22: 1}
Did not match all atoms present	13597-44-9	[O-]S(=O)[O-].[Zn+2]	{29: 3}
Did not match all atoms present	13597-46-1	[O-][Se](=O)[O-].[Zn+2]	{29: 3}
Did not match all atoms present	13597-54-1	[O-][Se](=O)(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	13597-56-3	[O-][W](=O)(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	13597-61-0	C1CC2=C(C=CC3=C2C=C4C(=N3)C=CC5=CC=CC=C54)[C@H]([C@@H]1O)O	{20: 2, 11: 2, 12: 2, 14: 9, 35: 1}
Did not match all atoms present	13597-70-1	PPP	{}
Did not match all atoms present	13597-72-3	NP(=O)(N)N	{29: 1, 30: 3}
Did not match all atoms present	13597-95-0	[Be+2].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O	{17: 2, 29: 8}
Did not match all atoms present	13597-99-4	[Be+2].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]	{}
Did not match all atoms present	13598-00-0	[Be+2].[Be+2].[O-][Si]([O-])([O-])[O-]	{29: 4}
Did not match all atoms present	13598-12-4	[Be+2].[F-].[Cl-]	{16: 1, 17: 1}
Did not match all atoms present	13598-15-7	[Be+2].OP(=O)([O-])[O-]	{20: 1, 29: 3}
Did not match all atoms present	13598-36-2	O=[PH](O)O	{20: 2, 29: 1}
Did not match all atoms present	13598-37-3	OP(=O)(O)[O-].OP(=O)(O)[O-].[Zn+2]	{20: 4, 29: 4}
Did not match all atoms present	13598-41-9	[H-].[H-].[H-].[Ho+3]	{}
Did not match all atoms present	13598-44-2	[H-].[H-].[H-].[Lu+3]	{}
Did not match all atoms present	13598-54-4	[H-].[H-].[H-].[Tb+3]	{}
Did not match all atoms present	13598-55-5	[H-].[H-].[H-].[Tm+3]	{}
Did not match all atoms present	13598-57-7	[H-].[H-].[H-].[Y+3]	{}
Did not match all atoms present	13598-65-7	[NH4+].[O-][Re](=O)(=O)=O	{29: 4}
Did not match all atoms present	13598-78-2	N[SiH3]	{30: 1}
Did not match all atoms present	136-21-0	CC1=CC(=C(C=C1)N=NC2=C(C=C(C(=C2)C)N)C)C	{1: 4, 34: 2, 30: 1, 14: 5}
Did not match all atoms present	136-23-2	CCCCN(CCCC)C(=S)[S-].CCCCN(CCCC)C(=S)[S-].[Zn+2]	{1: 4, 2: 12, 33: 2, 7: 2}
Did not match all atoms present	136-25-4	CC(C(=O)OCCOC1=CC(=C(C=C1Cl)Cl)Cl)(Cl)Cl	{1: 1, 2: 2, 4: 1, 14: 2, 17: 5, 22: 1, 28: 1}
Did not match all atoms present	136-30-1	CCCCN(CCCC)C(=S)[S-].[Na+]	{1: 2, 2: 6, 33: 1, 7: 1}
Did not match all atoms present	136-32-3	C1=C(C(=CC(=C1Cl)Cl)Cl)[O-].[Na+]	{17: 3, 14: 2}
Did not match all atoms present	136-35-6	C1=CC=C(C=C1)NN=NC2=CC=CC=C2	{34: 2, 14: 10, 31: 1}
Did not match all atoms present	136-36-7	C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)O	{28: 1, 21: 1, 14: 9}
Did not match all atoms present	136-40-3	C1=CC=C(C=C1)N=NC2=C(N=C(C=C2)N)N.Cl	{17: 1, 34: 2, 35: 1, 30: 2, 14: 7}
Did not match all atoms present	136-44-7	C1=CC(=CC=C1C(=O)OCC(CO)O)N	{2: 2, 3: 1, 14: 4, 20: 2, 28: 1, 30: 1}
Did not match all atoms present	136-45-8	CCCOC(=O)C1=CN=C(C=C1)C(=O)OCCC	{1: 2, 2: 4, 35: 1, 28: 2, 14: 3}
Did not match all atoms present	136-47-0	CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C.Cl	{1: 3, 2: 5, 33: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	136-51-6	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ca+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	136-53-8	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Zn+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	136-60-7	CCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	136-64-1	C1=CC(=CC=C1C(=O)NN)C(=O)NN	{24: 2, 30: 2, 14: 4, 31: 2}
Did not match all atoms present	136-72-1	C1OC2=C(O1)C=C(C=C2)/C=C/C=C/C(=O)O	{27: 1, 11: 1, 14: 3, 6: 4, 23: 2}
Did not match all atoms present	136-77-6	CCCCCCC1=C(C=C(C=C1)O)O	{1: 1, 2: 5, 21: 2, 14: 3}
Did not match all atoms present	136-78-7	C1=CC(=C(C=C1Cl)Cl)OCCOS(=O)(=O)[O-].[Na+]	{17: 2, 2: 2, 22: 2, 14: 3, 29: 3}
Did not match all atoms present	136-80-1	CC1=CC=CC=C1NCCO	{1: 1, 2: 2, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	136-82-3	CC1CCCCN1CCCOC(=O)C2=CC=CC=C2	{1: 1, 2: 3, 33: 1, 11: 4, 12: 1, 14: 5, 28: 1}
Did not match all atoms present	136-85-6	CC1=CC2=NNN=C2C=C1	{32: 1, 1: 1, 35: 2, 14: 3}
Did not match all atoms present	136-90-3	CC1=C(C=CC(=C1)N)OC	{1: 2, 30: 1, 22: 1, 14: 3}
Did not match all atoms present	136-92-5	CCN(CC)C(=S)S[Se]SC(=S)N(CC)CC	{40: 2, 1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	136-95-8	C1=CC=C2C(=C1)N=C(S2)N	{41: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	13600-88-9	[NH2-].[NH2-].[NH2-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[Co+3]	{34: 3, 29: 6}
Did not match all atoms present	13600-89-0	[NH2-].[NH2-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[Co+2]	{34: 4, 29: 8}
Did not match all atoms present	13601-02-0	N.N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.[Pt+2]	{}
Did not match all atoms present	13601-08-6	N.N.N.N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Pd+2]	{}
Did not match all atoms present	13601-13-3	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+3].[Cu+2].[Cu+2]	{}
Did not match all atoms present	13601-14-4	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-](F)(F)F.[Mn]	{16: 3, 29: 5, 7: 1}
Did not match all atoms present	13602-12-5	C1=C[N+](=CC=C1C(=O)O)[O-]	{33: 1, 27: 1, 29: 1, 14: 4}
Did not match all atoms present	13603-25-3	C1CC(CNC1)CC2=CC=CC=C2	{32: 1, 2: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	13603-70-8	CCCCCCCCS(=O)(=O)S(=O)(=O)CCCCCCCC	{1: 2, 2: 14, 29: 4}
Did not match all atoms present	13603-84-4	CC#CCS(=O)(=O)C1=CC=CC=C1	{1: 1, 2: 1, 10: 2, 14: 5, 29: 2}
Did not match all atoms present	136030-00-7	C1[C@@H]([C@@H](C2=CC=CC=C21)N)O	{20: 1, 11: 1, 12: 2, 30: 1, 14: 4}
Did not match all atoms present	136030-33-6	C1[C@H](N(CC2=CC=CC=C21)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O	{33: 1, 2: 1, 11: 2, 12: 2, 14: 12, 27: 1, 28: 1}
Did not match all atoms present	136040-19-2	[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.C1=CC=C(C=C1)[C+](C2=CC=CC=C2)C3=CC=CC=C3	{16: 20, 14: 15, 7: 1}
Did not match all atoms present	13605-05-5	CC1=CC(=C(C(=C1)C)OC(C)C)C	{1: 5, 3: 1, 22: 1, 14: 2}
Did not match all atoms present	13605-19-1	CC1=CC(=CC=C1)OCCO	{1: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	13607-48-2	C1=CC=C(C=C1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3	{29: 2, 14: 14, 31: 1}
Did not match all atoms present	13608-36-1	CC(C)(C)/C=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 3, 34: 1, 4: 1, 38: 2, 6: 1, 14: 3, 31: 1}
Did not match all atoms present	13608-87-2	CC(=O)C1=C(C(=C(C=C1)Cl)Cl)Cl	{24: 1, 1: 1, 14: 2, 17: 3}
Did not match all atoms present	136087-85-9	C1[C@H](OC2=C([C@]13C(=O)NC(=O)N3)C=C(C=C2)F)C(=O)N	{32: 2, 11: 1, 12: 1, 13: 1, 14: 3, 16: 1, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	136112-69-1	C1=CC(=CC=C1NC2=NC=NC3=C2NC=N3)[N+](=O)[O-]	{32: 1, 35: 3, 38: 1, 14: 6, 31: 1}
Did not match all atoms present	13612-34-5	CC1=CC(=C(C=C1)C)CC(=O)O	{1: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	136120-13-3	CC(CNCCNCCC[Si](OC)(OC)OC)C(=O)OCCC[Si](OC)(OC)OC	{1: 7, 2: 9, 3: 1, 22: 6, 28: 1, 31: 2}
Did not match all atoms present	13614-98-7	CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=CC(=C4C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O)N(C)C.Cl	{1: 4, 33: 2, 11: 2, 12: 3, 13: 1, 14: 2, 15: 4, 17: 1, 20: 3, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	13615-35-5	CC1=C(C2=CC=CC=C2C=C1)NC(=O)C	{24: 1, 1: 2, 14: 6, 31: 1}
Did not match all atoms present	13616-82-5	CC1=CC(=C(C=C1)S)C	{1: 2, 14: 3, 39: 1}
Did not match all atoms present	13616-83-6	CC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	13617-28-2	CC(C[Si](C)(Cl)Cl)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 17: 2}
Did not match all atoms present	13618-34-3	CCC1=C(C(=NN1)CC)C	{32: 1, 1: 3, 2: 2, 35: 1}
Did not match all atoms present	13619-98-2	COC1=CC2=C(C=C1)C(=C(CO2)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCC5	{1: 1, 2: 2, 33: 1, 11: 5, 14: 12, 15: 2, 22: 2, 23: 1}
Did not match all atoms present	13621-25-5	CC1=CC(=C2CCCC(=O)C2=C1)C	{1: 2, 11: 3, 14: 2, 25: 1}
Did not match all atoms present	13621-47-1	CNC(=S)C#N	{1: 1, 31: 1, 37: 1, 7: 1}
Did not match all atoms present	13623-10-4	C1CCC2=C(C=CC(=C2C1)O)O	{11: 4, 21: 2, 14: 2}
Did not match all atoms present	13623-11-5	CC1=C(SC(=N1)C)C	{1: 3, 35: 1, 41: 1}
Did not match all atoms present	13623-25-1	COC1=CC2=C(CCC2=O)C=C1	{1: 1, 11: 2, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	13624-14-1	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC=C1C=C	{1: 2, 5: 1, 6: 1, 33: 1, 14: 8, 29: 3}
Did not match all atoms present	13628-54-1	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Gd+3].[Gd+3]	{29: 12}
Did not match all atoms present	13629-22-6	C1=CC=C2C(=C1)C3=CC=CC=C3C2=NN	{34: 1, 30: 1, 14: 8, 15: 1}
Did not match all atoms present	13629-82-8	CC1=CC=CC(=C1)C2=CC(=C(C=C2)N)C	{1: 2, 30: 1, 14: 7}
Did not match all atoms present	13631-64-6	C1=CC=C(C=C1)N=C(C2=CSC=N2)N.Cl	{34: 1, 35: 1, 7: 1, 41: 1, 14: 7, 17: 1, 30: 1}
Did not match all atoms present	13632-93-4	CCC1=CC=CC(=C1CC)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	13632-94-5	CCC1=CC(=C(C=C1)CC)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	13632-95-6	CCC1=C(C(=CC=C1)CC)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	13634-93-0	C1(=C(C(=C(C(=C1S)F)F)Cl)F)F	{16: 4, 17: 1, 39: 1}
Did not match all atoms present	13637-61-1	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Zn+2]	{17: 2, 29: 8}
Did not match all atoms present	13637-65-5	Cl[GeH3]	{17: 1}
Did not match all atoms present	13637-68-8	O=[Mo]=O.Cl.Cl	{17: 2, 29: 2}
Did not match all atoms present	13637-71-3	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ni+2]	{17: 2, 29: 8}
Did not match all atoms present	13637-76-8	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Pb+2]	{17: 2, 29: 8}
Did not match all atoms present	13637-84-8	O=S(=O)(F)Cl	{16: 1, 17: 1, 29: 2}
Did not match all atoms present	13642-52-9	CC(C)NCC(C1=CC(=C(C=C1)O)NS(=O)(=O)C)O	{1: 3, 2: 1, 3: 2, 14: 3, 20: 1, 21: 1, 29: 2, 31: 2}
Did not match all atoms present	136434-77-0	C1=CC(=C(C=C1I)F)Br	{16: 1, 18: 1, 19: 1, 14: 3}
Did not match all atoms present	136440-26-1	CCCCCCCCCC1(N=C(C=[N+]1[O-])C2=CC=CC=C2)C	{1: 2, 2: 8, 35: 1, 33: 1, 13: 1, 14: 6, 15: 1, 29: 1}
Did not match all atoms present	13651-14-4	CC1=C(C(=CC=C1)CO)C	{1: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	136514-17-5	C1=CC(=C(C(=C1F)C#N)F)F	{16: 3, 37: 1, 14: 2}
Did not match all atoms present	13652-14-7	C[As](C)C=C	{1: 2, 5: 1, 6: 1}
Did not match all atoms present	13652-22-7	CCCCP(CCCC)C=C	{1: 2, 2: 6, 5: 1, 6: 1}
Did not match all atoms present	13653-18-4	C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)N	{30: 1, 22: 1, 14: 9, 29: 2}
Did not match all atoms present	13654-09-6	C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)C2=C(C(=C(C(=C2Br)Br)Br)Br)Br	{18: 10}
Did not match all atoms present	13654-74-5	C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].[Al+3].[Al+3]	{24: 6, 18: 12}
Did not match all atoms present	136547-17-6	C1=C(NC(=S)N=C1)C(F)(F)F	{16: 3, 32: 1, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	13655-52-2	CC(C)NCC(COC1=CC=CC=C1CC=C)O	{1: 2, 2: 3, 3: 2, 5: 1, 6: 1, 14: 4, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	13655-95-3	C[C@H]1C[C@]2([C@@H](CC[C@]2(C#C)O)[C@H]3[C@H]1C4=C(CC3)C=C(C=C4)O)C	{1: 2, 9: 1, 10: 1, 11: 5, 12: 4, 13: 2, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	136552-06-2	C1CN([C@@H]1C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{33: 1, 2: 1, 11: 2, 12: 2, 14: 8, 27: 1, 28: 1}
Did not match all atoms present	13657-49-3	C1=CC=C(C=C1)CC=CCC2=CC=CC=C2	{2: 2, 14: 10, 6: 2}
Did not match all atoms present	136572-09-3	CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)[C@@]5(CC)O)OC(=O)N6CCC(CC6)N7CCCCC7.O.O.O.Cl	{1: 2, 2: 2, 35: 1, 33: 3, 11: 11, 12: 1, 13: 1, 14: 4, 17: 1, 20: 1, 25: 1, 28: 2}
Did not match all atoms present	13658-18-9	C1CC(C(=O)C(C1)C2=CC=CC=C2)C#N	{25: 1, 11: 3, 12: 2, 37: 1, 14: 5}
Did not match all atoms present	13659-13-7	C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)Cl	{17: 1, 18: 1, 22: 1, 14: 8, 29: 2}
Did not match all atoms present	13659-16-0	C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)Br	{17: 1, 18: 1, 22: 1, 14: 8, 29: 2}
Did not match all atoms present	13659-18-2	C1=CC=C(C=C1)OS(=O)(=O)C2=CC(=CC=C2)Cl	{17: 1, 22: 1, 14: 9, 29: 2}
Did not match all atoms present	13659-19-3	C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2Cl	{17: 1, 22: 1, 14: 9, 29: 2}
Did not match all atoms present	136602-17-0	CC1=C(C=C(C(=C1)O)C2CCCCC2)[C@@H](C)CC(C3=C(C=C(C(=C3)C4CCCCC4)O)C)C5=C(C=C(C(=C5)C6CCCCC6)O)C	{1: 4, 2: 1, 3: 2, 11: 15, 12: 3, 14: 6, 21: 3}
Did not match all atoms present	13663-04-2	CC(CSC1=CC=C(C=C1)Cl)O	{1: 1, 2: 1, 3: 1, 40: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	13663-23-5	C1CCCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]	{33: 1, 11: 6, 38: 1, 14: 4}
Did not match all atoms present	13665-04-8	C1=CC=C(C=C1)C(=O)C(Br)Br	{24: 1, 18: 2, 3: 1, 14: 5}
Did not match all atoms present	13669-42-6	C1=CC=C2C(=C1)C=C(C=N2)C=O	{26: 1, 35: 1, 14: 6}
Did not match all atoms present	13669-70-0	CN1CCOC(C2=CC=CC=C2C1)C3=CC=CC=C3	{1: 1, 33: 1, 11: 3, 12: 1, 14: 9, 23: 1}
Did not match all atoms present	13669-76-6	B(F)(F)F.OP(=O)(O)O	{16: 3, 20: 3, 29: 1}
Did not match all atoms present	13670-99-0	CC(=O)C1=C(C=CC=C1F)F	{16: 2, 1: 1, 14: 3, 24: 1}
Did not match all atoms present	136705-64-1	CC[C@@H]1CC[C@H](P1C2=CC=CC=C2P3[C@@H](CC[C@H]3CC)CC)CC	{1: 4, 2: 4, 11: 4, 12: 4, 14: 4}
Did not match all atoms present	13671-00-6	COC(=O)C1=C(C=CC=C1F)F	{16: 2, 1: 1, 28: 1, 14: 3}
Did not match all atoms present	13672-07-6	C1CC2=CC=CC=C2C(=O)C1Br	{25: 1, 18: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	13672-18-9	C1=CC=C(C=C1)CNC2=CC3=CC=CC=C3C=C2	{2: 1, 14: 12, 31: 1}
Did not match all atoms present	13673-30-8	CCN(CCO)C1=CC=C(C=C1)[N+]#N.[Cl-].Cl[Zn]Cl	{1: 1, 2: 3, 33: 1, 34: 1, 14: 4, 17: 3, 20: 1}
Did not match all atoms present	13673-63-7	CN1C2=CC=CC=C2OC1=S	{1: 1, 33: 1, 14: 4, 23: 1}
Did not match all atoms present	13673-92-2	C1=C(C=C(C(=C1Cl)O)O)Cl	{17: 2, 21: 2, 14: 2}
Did not match all atoms present	136735-95-0	C[C@H]1CC[C@@H](P1C2=CC=CC=C2P3[C@H](CC[C@@H]3C)C)C	{1: 4, 11: 4, 12: 4, 14: 4}
Did not match all atoms present	13674-16-3	COC(=O)C(CC1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	13674-84-5	CC(CCl)OP(=O)(OC(C)CCl)OC(C)CCl	{1: 3, 2: 3, 3: 3, 17: 3, 22: 3, 29: 1}
Did not match all atoms present	13674-87-8	C(C(CCl)OP(=O)(OC(CCl)CCl)OC(CCl)CCl)Cl	{17: 6, 2: 6, 3: 3, 29: 1, 22: 3}
Did not match all atoms present	136745-87-4	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=CC(=O)[O-].[Na+]	{1: 2, 2: 17, 5: 2, 6: 1, 7: 1, 24: 1, 28: 1}
Did not match all atoms present	13675-18-8	B(B(O)O)(O)O	{20: 4}
Did not match all atoms present	13675-47-3	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Cu+2]	{29: 6, 22: 1}
Did not match all atoms present	13676-54-5	C1=CC(=CC=C1CC2=CC=C(C=C2)N3C(=O)C=CC3=O)N4C(=O)C=CC4=O	{25: 4, 2: 1, 14: 12, 33: 2}
Did not match all atoms present	13677-79-7	C1=C(C=C(C(=C1O)O)O)C=O	{26: 1, 21: 3, 14: 2}
Did not match all atoms present	136779-28-7	CC[C@H]1CC[C@@H](P1C2=CC=CC=C2P3[C@H](CC[C@@H]3CC)CC)CC	{1: 4, 2: 4, 11: 4, 12: 4, 14: 4}
Did not match all atoms present	13678-51-8	CC1=CC=C(O1)CC2=CC=CO2	{1: 1, 2: 1, 14: 5, 23: 2}
Did not match all atoms present	13678-54-1	CCC1=CSC(=C1)C	{1: 2, 2: 1, 14: 2, 41: 1}
Did not match all atoms present	13678-59-6	CC1=CC=C(O1)SC	{40: 1, 1: 2, 14: 2, 23: 1}
Did not match all atoms present	13678-67-6	C1=COC(=C1)CSCC2=CC=CO2	{40: 1, 2: 2, 14: 6, 23: 2}
Did not match all atoms present	13678-68-7	CC(=O)SCC1=CC=CO1	{1: 1, 2: 1, 40: 1, 14: 3, 23: 1, 24: 1}
Did not match all atoms present	13679-41-9	C1=CC=C(C=C1)C2=COC=C2	{14: 8, 23: 1}
Did not match all atoms present	13679-46-4	COCC1=CC=CO1	{1: 1, 2: 1, 22: 1, 14: 3, 23: 1}
Did not match all atoms present	13679-56-6	CC1=CC=C(O1)CCC(=O)C	{24: 1, 1: 2, 2: 2, 14: 2, 23: 1}
Did not match all atoms present	13679-61-3	CSC(=O)C1=CC=CO1	{24: 1, 1: 1, 40: 1, 14: 3, 23: 1}
Did not match all atoms present	13679-70-4	CC1=CC=C(S1)C=O	{1: 1, 26: 1, 14: 2, 41: 1}
Did not match all atoms present	13679-72-6	CC1=C(SC=C1)C(=O)C	{24: 1, 1: 2, 14: 2, 41: 1}
Did not match all atoms present	13679-73-7	CC1=CSC(=C1)C(=O)C	{24: 1, 1: 2, 14: 2, 41: 1}
Did not match all atoms present	13679-74-8	CC1=CC=C(S1)C(=O)C	{24: 1, 1: 2, 14: 2, 41: 1}
Did not match all atoms present	13679-75-9	CCC(=O)C1=CC=CS1	{24: 1, 1: 1, 2: 1, 14: 3, 41: 1}
Did not match all atoms present	136793-29-8	CC(=C)C(=O)O.CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.[Na+]	{1: 3, 2: 1, 4: 1, 5: 2, 6: 1, 7: 1, 24: 1, 27: 1, 29: 3, 31: 1}
Did not match all atoms present	13680-30-3	CC1=C(C(=CC=C1)C(C)(C)C)N=C=O	{1: 4, 34: 1, 4: 1, 8: 1, 14: 3, 29: 1}
Did not match all atoms present	13680-36-9	CC1=C(C(=CC(=C1)CC2=CC(=C(C(=C2)C(C)(C)C)N)C)C(C)(C)C)N	{1: 8, 2: 1, 4: 2, 30: 2, 14: 4}
Did not match all atoms present	13681-87-3	CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Cu+2]	{1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	13682-04-7	C[CH2-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co].[Co]	{1: 1, 5: 1, 29: 9}
Did not match all atoms present	13682-59-2	[Br-].[Br-].[Br-].[Br-].[Cs+].[Au+3]	{18: 4}
Did not match all atoms present	13682-60-5	[Cl-].[Cl-].[Cl-].[Cl-].[Cs+].[Au+3]	{17: 4}
Did not match all atoms present	13682-61-6	Cl[Au-](Cl)(Cl)Cl.[K+]	{17: 4}
Did not match all atoms present	13682-62-7	[Cl-].[Cl-].[Cl-].[Cl-].[Rb+].[Au+3]	{17: 4}
Did not match all atoms present	13682-74-1	[C-]#[O+].[C-]#[O+].[N-]=O.[N-]=O.[Fe+2]	{29: 4}
Did not match all atoms present	13682-92-3	C(C(=O)[O-])N.C(C(=O)[O-])N.C(C(=O)[O-])N.[Al+3]	{24: 3, 2: 3, 30: 3}
Did not match all atoms present	13682-99-0	CCCCC[Si](C)(Cl)Cl	{1: 2, 2: 4, 17: 2}
Did not match all atoms present	13683-41-5	C[Si](C)(C)C(=C)Br	{1: 3, 18: 1, 5: 1, 7: 1}
Did not match all atoms present	13684-28-1	COC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])O	{1: 1, 38: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	13684-56-5	CCOC(=O)NC1=CC(=CC=C1)OC(=O)NC2=CC=CC=C2	{1: 1, 2: 1, 28: 2, 14: 9, 31: 2}
Did not match all atoms present	13684-63-4	CC1=CC(=CC=C1)NC(=O)OC2=CC=CC(=C2)NC(=O)OC	{1: 2, 28: 2, 14: 8, 31: 2}
Did not match all atoms present	136840-56-7	CCC(N)P(=O)(O)O	{1: 1, 2: 1, 3: 1, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	136846-72-5	C=C1C=C2CCC2=CC1=C	{11: 2, 5: 2, 14: 2}
Did not match all atoms present	136849-72-4	[B-](F)(F)(F)F.CCOC(=O)C(=NOC(=[N+](C)C)N(C)C)C#N	{1: 5, 2: 1, 33: 2, 7: 2, 34: 1, 16: 4, 22: 1, 28: 1, 37: 1}
Did not match all atoms present	13686-28-7	OS(=O)(=S)O	{20: 2, 29: 1}
Did not match all atoms present	13686-33-4	CC(C)(C)N=[N+]=[N-]	{1: 3, 34: 2, 4: 1}
Did not match all atoms present	13686-49-2	C1=CC=C2C(=C1)C=CC=C2CCBr	{2: 2, 18: 1, 14: 7}
Did not match all atoms present	13686-66-3	CCN(CC)[Si](C)C	{1: 4, 2: 2, 33: 1}
Did not match all atoms present	13686-87-8	CC1=CC=CC=[N+]1CC2=CC=CC=C2.[Cl-]	{1: 1, 2: 1, 33: 1, 14: 9, 17: 1}
Did not match all atoms present	13688-56-7	CC(=C)C(=O)O[Si](C)(C)C	{1: 4, 28: 1, 5: 1, 7: 1}
Did not match all atoms present	13688-59-0	C[Si](C)(C1=CC=CC1)Cl	{1: 2, 11: 1, 17: 1, 14: 3, 15: 1}
Did not match all atoms present	13688-63-6	C1=CC(C=C1)[Si](Cl)(Cl)Cl	{17: 3, 12: 1, 14: 4}
Did not match all atoms present	13688-68-1	C[Si]1(C2=CC=CC=C2C3=CC=CC=C31)C	{1: 2, 14: 8}
Did not match all atoms present	13688-75-0	CC1=CC(=CC=C1)[Si](Cl)(Cl)Cl	{1: 1, 14: 4, 17: 3}
Did not match all atoms present	13688-90-9	C1=CC(=CC=C1CCl)[Si](Cl)(Cl)Cl	{17: 4, 2: 1, 14: 4}
Did not match all atoms present	13689-20-8	C1CCC(CC1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3	{11: 5, 12: 1, 29: 1, 14: 10}
Did not match all atoms present	13689-92-4	C(#N)[S-].C(#N)[S-].[Ni+2]	{37: 2}
Did not match all atoms present	13691-26-4	C1CC(=O)N(C1)C2=CC=C(C=C2)[N+](=O)[O-]	{25: 1, 11: 3, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	13691-84-4	C1CCC(C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F	{4: 1, 11: 4, 12: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	13692-14-3	C1=CC(=C(C=C1Cl)Cl)C(CCl)O	{17: 3, 2: 1, 3: 1, 20: 1, 14: 3}
Did not match all atoms present	13692-99-4	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Tb+3].[Tb+3]	{29: 12}
Did not match all atoms present	13693-05-5	F[Pt-2](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	13693-06-6	F[Pu](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	13693-07-7	F[Rh](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	13693-08-8	F[Ru](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	13693-10-2	N(F)(F)S(F)(F)(F)(F)F	{16: 7, 33: 1}
Did not match all atoms present	13693-59-9	C1=CC=C(C(=C1)O)SC2=CC=CC=C2O	{40: 1, 21: 2, 14: 8}
Did not match all atoms present	13698-87-8	CCN(CC)C(=O)C1=CC(=CC=C1)C(=O)N(CC)CC	{24: 2, 1: 4, 2: 4, 14: 4, 33: 2}
Did not match all atoms present	137-00-8	CC1=C(SC=N1)CCO	{1: 1, 2: 2, 35: 1, 41: 1, 14: 1, 20: 1}
Did not match all atoms present	137-04-2	C1=CC=C(C(=C1)N)Cl.Cl	{17: 2, 30: 1, 14: 4}
Did not match all atoms present	137-06-4	CC1=CC=CC=C1S	{1: 1, 14: 4, 39: 1}
Did not match all atoms present	137-07-5	C1=CC=C(C(=C1)N)S	{30: 1, 14: 4, 39: 1}
Did not match all atoms present	137-08-6	CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.[Ca+2]	{1: 4, 2: 6, 3: 2, 4: 2, 20: 4, 24: 4, 31: 2}
Did not match all atoms present	137-09-7	C1=CC(=C(C=C1N)N)O.Cl.Cl	{17: 2, 30: 2, 21: 1, 14: 3}
Did not match all atoms present	137-16-6	CCCCCCCCCCCC(=O)N(C)CC(=O)[O-].O.[Na+]	{24: 2, 1: 2, 2: 11, 33: 1}
Did not match all atoms present	137-17-7	CC1=CC(=C(C=C1C)N)C	{1: 3, 30: 1, 14: 2}
Did not match all atoms present	137-19-9	C1=C(C(=CC(=C1O)Cl)Cl)O	{17: 2, 21: 2, 14: 2}
Did not match all atoms present	137-20-2	CCCCCCCC/C=C\CCCCCCCC(=O)N(C)CCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 16, 6: 2, 33: 1, 24: 1, 29: 3}
Did not match all atoms present	137-26-8	CN(C)C(=S)SSC(=S)N(C)C	{40: 2, 1: 4, 33: 2, 7: 2}
Did not match all atoms present	137-29-1	CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Cu+2]	{1: 4, 33: 2, 7: 2}
Did not match all atoms present	137-30-4	CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Zn+2]	{1: 4, 33: 2, 7: 2}
Did not match all atoms present	137-40-6	CCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	137-42-8	CNC(=S)[S-].[Na+]	{1: 1, 31: 1, 7: 1}
Did not match all atoms present	137-47-3	CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 2, 38: 1, 33: 1, 14: 3, 17: 1, 29: 2}
Did not match all atoms present	137-48-4	CNS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 17: 1, 29: 2, 31: 1}
Did not match all atoms present	137-49-5	C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]	{17: 1, 38: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	137-50-8	C1=C(C(=CC(=C1N)S(=O)(=O)O)S(=O)(=O)O)N	{30: 2, 20: 2, 29: 4, 14: 2}
Did not match all atoms present	137-51-9	C1=CC(=C(C=C1S(=O)(=O)O)S(=O)(=O)O)N	{30: 1, 20: 2, 29: 4, 14: 3}
Did not match all atoms present	137-53-1	C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)CC(C(=O)[O-])N.[Na+]	{2: 1, 3: 1, 14: 4, 19: 4, 21: 1, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	137-58-6	CCN(CC)CC(=O)NC1=C(C=CC=C1C)C	{1: 4, 2: 3, 33: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	137-64-4	C1=CC(=C(C=C1S(=O)(=O)Cl)C(=O)O)Cl	{17: 2, 27: 1, 29: 2, 14: 3}
Did not match all atoms present	137-65-5	C1=CC(=C(C=C1S(=O)(=O)N)C(=O)O)N	{30: 2, 27: 1, 29: 2, 14: 3}
Did not match all atoms present	137-86-0	CC1=NC=C(C(=N1)N)CN(C=O)/C(=C(\CCO)/SSCCC(CCCCC(=O)OC)SC(=O)C)/C	{1: 4, 2: 9, 3: 1, 33: 1, 7: 2, 40: 3, 14: 1, 35: 2, 20: 1, 24: 1, 26: 1, 28: 1, 30: 1}
Did not match all atoms present	137-89-3	CCCCC(CC)COC(=O)C1=CC(=CC=C1)C(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	137-97-3	CC1=CC=CC=C1NC(=S)NC2=CC=CC=C2C	{1: 2, 31: 2, 14: 8, 7: 1}
Did not match all atoms present	137-99-5	CCCCCCCCCC1=CC(=C(C=C1)O)CCCCCCCCC	{1: 2, 2: 16, 21: 1, 14: 3}
Did not match all atoms present	13701-64-9	B(=O)[O-].B(=O)[O-].[Ca+2]	{29: 4}
Did not match all atoms present	13701-67-2	B(B(Cl)Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	13701-71-8	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Sc+3].[Sc+3].[W].[W].[W]	{}
Did not match all atoms present	13701-73-0	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Sm+3].[Sm+3].[W].[W].[W]	{}
Did not match all atoms present	13701-74-1	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Tb+4].[Tb+4].[W].[W].[W]	{}
Did not match all atoms present	13701-90-1	Br[Tl](Br)Br	{18: 3}
Did not match all atoms present	13701-91-2	Br[Pb](Br)(Br)Br	{18: 4}
Did not match all atoms present	13702-38-0	O[As](=O)(O)O.[Bi]	{20: 3, 29: 1}
Did not match all atoms present	137027-51-1	CC1=CC2=C(C(=O)OC=C2C3=C1N(C(=N3)N)C)N	{1: 2, 35: 1, 33: 1, 14: 2, 28: 1, 30: 2}
Did not match all atoms present	13703-82-7	B([O-])([O-])[O-].B([O-])([O-])[O-].[Mg+2].[Mg+2].[Mg+2]	{29: 6}
Did not match all atoms present	13703-84-9	B(=O)[O-].B(=O)[O-].[Sr+2]	{29: 4}
Did not match all atoms present	13703-88-3	B1(NB(NB(N1)Br)Br)Br	{32: 3, 18: 3}
Did not match all atoms present	13703-91-8	B1(OB(OB(O1)Cl)Cl)Cl	{17: 3, 23: 3}
Did not match all atoms present	13703-95-2	B1(OB(OB(O1)F)F)F	{16: 3, 23: 3}
Did not match all atoms present	13703-97-4	B1(SB(SB(S1)S)S)S	{41: 3, 39: 3}
Did not match all atoms present	13704-09-1	CCOC(=O)[C@H](C1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	13705-05-0	CSC1=NC(=NC(=N1)Cl)Cl	{40: 1, 1: 1, 35: 3, 17: 2}
Did not match all atoms present	13706-68-8	C1=CC=C(C=C1)C(CC#N)C#N	{2: 1, 3: 1, 37: 2, 14: 5}
Did not match all atoms present	137062-87-4	C1=NC2=C(C(=N1)N)N=CN2N	{33: 1, 35: 3, 30: 2, 14: 2}
Did not match all atoms present	13707-88-5	CC(C)NCC(COC1=CC=CC=C1CC=C)O.Cl	{1: 2, 2: 3, 3: 2, 5: 1, 6: 1, 14: 4, 17: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	13708-12-8	CC1=C2C(=CC=C1)N=CC=N2	{1: 1, 35: 2, 14: 5}
Did not match all atoms present	13708-67-3	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Zr+4].[Ba+2]	{29: 9}
Did not match all atoms present	13708-80-0	[F-].[F-].[F-].[Am]	{16: 3}
Did not match all atoms present	13708-85-5	[O-]P([O-])[O-].[Na+].[Na+].[Na+]	{29: 3}
Did not match all atoms present	13709-30-3	N(F)(F)S(=O)(=O)F	{16: 3, 33: 1, 29: 2}
Did not match all atoms present	13709-36-9	F[Xe]F	{16: 2}
Did not match all atoms present	13709-40-5	N(F)(S(=O)(=O)F)S(=O)(=O)F	{16: 3, 33: 1, 29: 4}
Did not match all atoms present	13709-42-7	[F-].[F-].[F-].[Nd+3]	{16: 3}
Did not match all atoms present	13709-49-4	[F-].[F-].[F-].[Y+3]	{16: 3}
Did not match all atoms present	13709-54-1	O=S(F)(F)(F)F	{16: 4, 29: 1}
Did not match all atoms present	13709-56-3	F[Pu](F)(F)F	{16: 4}
Did not match all atoms present	13709-59-6	F[Th](F)(F)F	{16: 4}
Did not match all atoms present	13709-70-1	B(Cl)(Cl)Br	{17: 2, 18: 1}
Did not match all atoms present	13709-71-2	B(Cl)(Br)Br	{17: 1, 18: 2}
Did not match all atoms present	13709-72-3	B(Br)(Br)I	{18: 2, 19: 1}
Did not match all atoms present	13709-74-5	B(Cl)(I)I	{17: 1, 19: 2}
Did not match all atoms present	13709-76-7	B(Cl)(Cl)I	{17: 2, 19: 1}
Did not match all atoms present	13709-83-6	B(F)F	{16: 2}
Did not match all atoms present	13709-93-8	B([O-])([O-])[O-].[In+3]	{29: 3}
Did not match all atoms present	13710-19-5	CC1=C(C=CC=C1Cl)NC2=CC=CC=C2C(=O)O	{31: 1, 1: 1, 27: 1, 14: 7, 17: 1}
Did not match all atoms present	13713-13-8	C[N+]1(CC2C3CCC(C2C1)C=C3)CCC[N+](C)(C)C.[I-].[I-]	{1: 4, 2: 3, 11: 4, 12: 4, 14: 2, 19: 2}
Did not match all atoms present	13716-10-4	CC(C)(C)P(C(C)(C)C)Cl	{1: 6, 4: 2, 17: 1}
Did not match all atoms present	13716-12-6	CC(C)(C)P(C(C)(C)C)C(C)(C)C	{1: 9, 4: 3}
Did not match all atoms present	13716-45-5	CCOP(OCC)O[Si](C)(C)C	{1: 5, 2: 2, 22: 3}
Did not match all atoms present	13717-04-9	CCC(=O)N(C1=CC=CC=N1)C(C)CN2CCCCC2.C(=CC(=O)O)C(=O)O	{1: 2, 2: 2, 3: 1, 6: 2, 33: 2, 11: 5, 14: 4, 35: 1, 24: 1, 27: 2}
Did not match all atoms present	13718-22-4	O=[Mo].[Rb]	{29: 1}
Did not match all atoms present	13718-26-8	[O-][V](=O)=O.[Na+]	{29: 3}
Did not match all atoms present	13718-36-0	[O-][Si]([O-])([O-])O[Si]([O-])([O-])[O-].[La+3].[La+3]	{29: 6, 22: 1}
Did not match all atoms present	13718-50-8	[Ba+2].[I-].[I-]	{19: 2}
Did not match all atoms present	13718-55-3	[F-].[Cl-].[Ba+2]	{16: 1, 17: 1}
Did not match all atoms present	13718-59-7	[O-][Se](=O)[O-].[Ba+2]	{29: 3}
Did not match all atoms present	13718-70-2	[O-][Mo](=O)(=O)[O-].[Fe+2]	{29: 4}
Did not match all atoms present	13719-97-6	CC(C)(C)C1=C2C=CC=CC2=CC3=CC=CC=C31	{1: 3, 4: 1, 14: 9}
Did not match all atoms present	13720-91-7	CCOC1=CC=NC2=CC=CC=C21	{1: 1, 2: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	13721-35-2	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[W]	{}
Did not match all atoms present	13721-43-2	[O-]P(=O)([O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{29: 6}
Did not match all atoms present	13721-48-7	[O-][Si]([O-])([O-])O[Si]([O-])([O-])[O-].[Nd+3].[Nd+3]	{29: 6, 22: 1}
Did not match all atoms present	13722-15-1	B1(N(B(N(B(N1C)F)C)F)C)F	{16: 3, 1: 3, 33: 3}
Did not match all atoms present	13725-27-4	[2H]C([2H])([2H])OC	{1: 2, 22: 1}
Did not match all atoms present	13725-30-9	COC(=O)NC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	13726-52-8	CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)N	{1: 2, 2: 4, 3: 1, 14: 4, 24: 1, 28: 2, 30: 1, 31: 1}
Did not match all atoms present	13728-34-2	COC(=O)C1=CC2=CC=CC=C2C=C1C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	13730-09-1	CC1=CC(=C(C=C1)C)C#N	{1: 2, 37: 1, 14: 3}
Did not match all atoms present	13730-13-7	C(=N[SiH3])=O	{8: 1, 34: 1, 29: 1}
Did not match all atoms present	13730-55-7	CC1=CC(=C(C=C1)C)C(=O)OC	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	13731-82-3	C1=C(C(=CC(=C1Br)C(=O)O)Br)C(=O)O	{18: 2, 27: 2, 14: 2}
Did not match all atoms present	13732-32-6	CC(=NNC1=CC=CC=C1)C(=O)C	{1: 2, 34: 1, 7: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	13732-80-4	CCC1=C(C=C(C=C1)C)CC	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	13734-34-4	CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	137348-86-8	CC(C)N(C(C)C)P(OC(C)(C)C)OC(C)(C)C	{1: 10, 3: 2, 4: 2, 22: 2, 33: 1}
Did not match all atoms present	137349-65-6	C1CCC(CC1)P(CP(C2CCCCC2)C3CCCCC3)C4CCCCC4	{2: 1, 11: 20, 12: 4}
Did not match all atoms present	13735-12-1	C1CSC2=C(C1=O)C=C(C=C2)Cl	{17: 1, 11: 2, 41: 1, 14: 3, 25: 1}
Did not match all atoms present	13735-81-4	C[Si](C)(C)OC(=C)C1=CC=CC=C1	{1: 3, 22: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	137354-65-5	CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC(C)C)N	{32: 1, 1: 13, 2: 23, 3: 20, 14: 5, 20: 2, 24: 14, 30: 6, 31: 13}
Did not match all atoms present	13737-04-7	C[Si](C)(C)C1=CC=CC=N1	{1: 3, 35: 1, 14: 4}
Did not match all atoms present	13738-63-1	C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=C(C=C2F)Cl)Cl	{16: 1, 17: 2, 38: 1, 22: 1, 14: 6}
Did not match all atoms present	13738-70-0	C1=CC=C(C=C1)SCC2=CC=C(C=C2)N	{40: 1, 2: 1, 30: 1, 14: 9}
Did not match all atoms present	13739-35-0	CC1=CC=C(C=C1)SCCC(=O)O	{40: 1, 1: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	137407-62-6	C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=CC(=CC(=C5O)CC6=C(C(=CC(=C6)S(=O)(=O)O)CC7=C(C(=CC(=C7)S(=O)(=O)O)CC8=C(C(=CC(=C8)S(=O)(=O)O)CC9=C(C1=CC(=C9)S(=O)(=O)O)O)O)O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{11: 8, 20: 8, 21: 8, 14: 16, 29: 16}
Did not match all atoms present	137424-81-8	CC(=CC(C(=O)O)N)CP(=O)(O)O	{1: 1, 2: 1, 3: 1, 6: 1, 7: 1, 20: 2, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	13746-54-8	CC1C2CC(C1(C)C)CC2C3=CC(=C(C=C3)O)OC	{1: 4, 11: 2, 12: 4, 13: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	13746-57-1	C[C@@H]1[C@@H]2C[C@H](C1(C)C)C[C@H]2C3=CC(=C(C=C3)OC)O	{1: 4, 11: 2, 12: 4, 13: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	13746-58-2	C[C@@]12CC[C@@H](C1(C)C)CC2C3=CC(=C(C=C3)OC)O	{1: 4, 11: 3, 12: 2, 13: 2, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	13746-60-6	C[C@@]12CC[C@@H](C1(C)C)C[C@H]2C3=C(C(=CC=C3)OC)O	{1: 4, 11: 3, 12: 2, 13: 2, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	13746-66-2	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[K+].[Fe+3]	{}
Did not match all atoms present	13746-98-0	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Tl+3]	{}
Did not match all atoms present	13750-62-4	CC1=NC=CN1CC2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	13750-81-7	CN1C=CN=C1C=O	{1: 1, 26: 1, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	13752-33-5	CC1=NC=C(N1CCC2=CC=NC=C2)[N+](=O)[O-]	{1: 1, 2: 2, 35: 2, 38: 1, 33: 1, 14: 5}
Did not match all atoms present	13752-51-7	C1COCCN1C(=S)SN2CCOCC2	{23: 2, 33: 2, 11: 8, 40: 1, 7: 1}
Did not match all atoms present	13754-19-3	C1=C(C(=NC=N1)N)N	{35: 2, 30: 2, 14: 2}
Did not match all atoms present	13754-56-8	CC(CN1C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C31)N(C)C	{1: 3, 2: 1, 3: 1, 33: 2, 14: 8, 29: 2}
Did not match all atoms present	13755-29-8	[B-](F)(F)(F)F.[Na+]	{16: 4}
Did not match all atoms present	13755-38-9	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[N-]=O.O.O.[Na+].[Na+].[Fe+4]	{29: 1}
Did not match all atoms present	13755-79-8	CN1C=NC(=C1S(=O)(=O)C)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 33: 1, 14: 1, 29: 2}
Did not match all atoms present	13756-40-6	CC(C)OC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 3: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	13758-99-1	C[N+]1(CCCC1)CC[N+]2(CC3C4CCC(C3C2)C=C4)C.[I-].[I-]	{1: 2, 2: 2, 11: 8, 12: 4, 14: 2, 19: 2}
Did not match all atoms present	13759-10-9	[Si](=S)=S	{}
Did not match all atoms present	13759-17-6	O(Cl)Cl.[Hf]	{17: 2, 22: 1}
Did not match all atoms present	13759-30-3	[O-2].[O-2].[Cl-].[V]	{17: 1}
Did not match all atoms present	13759-83-6	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Sm+3]	{}
Did not match all atoms present	13759-87-0	Br[Sm](Br)Br	{18: 3}
Did not match all atoms present	13759-88-1	[Br-].[Br-].[Br-].[Eu+3]	{18: 3}
Did not match all atoms present	13759-90-5	[I-].[I-].[I-].[Eu+3]	{19: 3}
Did not match all atoms present	13759-92-7	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Eu+3]	{17: 3}
Did not match all atoms present	13760-37-7	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cd+2]	{17: 2, 29: 8}
Did not match all atoms present	13760-80-0	[F-].[F-].[F-].[Yb+3]	{16: 3}
Did not match all atoms present	13760-81-1	F[Lu](F)F	{16: 3}
Did not match all atoms present	13761-79-0	[2H]OP(=O)([O-])O[2H].[K+]	{20: 2, 29: 2}
Did not match all atoms present	13762-14-6	[O-][Mo](=O)(=O)[O-].[Co+2]	{29: 4}
Did not match all atoms present	13762-18-0	[2H]S	{}
Did not match all atoms present	13762-51-1	[B-].[K+]	{}
Did not match all atoms present	13762-65-7	NN.NN.O.OCl(=O)(=O)=O.OCl(=O)(=O)=O	{17: 2, 20: 2, 29: 6, 30: 4}
Did not match all atoms present	13762-75-9	[Li+].[O-]P(=O)=O	{29: 3}
Did not match all atoms present	13762-83-9	[O-]P(=O)=O.[O-]P(=O)=O.[Ba+2]	{29: 6}
Did not match all atoms present	137622-07-2	CC1=CC=CC=C1[P+](=O)O	{1: 1, 20: 1, 29: 1, 14: 4}
Did not match all atoms present	137622-08-3	CC1=CC(=CC=C1)[P+](=O)O	{1: 1, 20: 1, 29: 1, 14: 4}
Did not match all atoms present	13764-18-6	CC1=C2C=C(C(=CC2=C(C=C1)C)C)C	{1: 4, 14: 4}
Did not match all atoms present	13764-35-7	CCN(CC)CCSC(=S)N1C2=CC=CC=C2SC3=CC=CC=C31	{1: 2, 2: 4, 33: 2, 40: 1, 41: 1, 7: 1, 14: 8}
Did not match all atoms present	13764-49-3	CCCC(C)(C1C[C@@]23C=CC1(C4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)C)OC)O.Cl	{1: 4, 2: 2, 4: 1, 33: 1, 11: 4, 12: 3, 13: 3, 14: 4, 17: 1, 20: 1, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	137649-46-8	FP(=S)=S	{16: 1}
Did not match all atoms present	13765-03-2	[Li+].[O-]I(=O)=O	{19: 1, 29: 3}
Did not match all atoms present	13765-19-0	[O-][Cr](=O)(=O)[O-].[Ca+2]	{29: 4}
Did not match all atoms present	13765-26-9	[F-].[F-].[F-].[Gd+3]	{16: 3}
Did not match all atoms present	13765-35-0	[NH4+].[NH4+].[NH4+].[NH4+].[O-]P(=O)([O-])OP(=O)([O-])[O-]	{29: 6, 22: 1}
Did not match all atoms present	13765-43-0	[PH2]	{}
Did not match all atoms present	13765-44-1	[SiH3]	{}
Did not match all atoms present	13765-45-2	[GeH4]	{}
Did not match all atoms present	137658-79-8	CCCCC(CC)COCC(COC1=CC(=O)C(=C2N=C(NC(=N2)C3=C(C=C(C=C3)C)C)C4=C(C=C(C=C4)C)C)C=C1)O	{32: 1, 1: 6, 2: 7, 3: 2, 14: 9, 15: 5, 35: 2, 20: 1, 22: 2, 25: 1}
Did not match all atoms present	13766-28-4	B(=O)B=O	{29: 2}
Did not match all atoms present	13766-47-7	F[W](F)(F)F	{16: 4}
Did not match all atoms present	13767-16-3	[15NH3]	{}
Did not match all atoms present	13767-31-2	[Cl-].[Cl-].[Dy]	{17: 2}
Did not match all atoms present	13767-32-3	[O-][Mo](=O)(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	13767-34-5	[O-][Mo](=O)(=O)[O-].[Cu+2]	{29: 4}
Did not match all atoms present	13767-71-0	[Cu](I)I	{19: 2}
Did not match all atoms present	13767-90-3	[O-]P(=O)(F)F.[K+]	{16: 2, 29: 2}
Did not match all atoms present	13768-07-5	O[As]=O	{20: 1, 29: 1}
Did not match all atoms present	13768-11-1	O[Re](=O)(=O)=O	{20: 1, 29: 3}
Did not match all atoms present	13768-38-2	F[Os](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	13768-49-5	[O-][Re](=O)(=O)=O.[Cs+]	{29: 4}
Did not match all atoms present	13768-60-0	[B]F	{16: 1}
Did not match all atoms present	13768-63-3	[SiH3].[GeH3]	{}
Did not match all atoms present	13768-67-7	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Yb+3]	{}
Did not match all atoms present	13768-86-0	O=[Se](=O)=O	{29: 3}
Did not match all atoms present	13768-94-0	[SiH2](Br)Br	{18: 2}
Did not match all atoms present	13769-20-5	Cl[Eu]Cl	{17: 2}
Did not match all atoms present	13769-36-3	[GeH2](Br)Br	{18: 2}
Did not match all atoms present	13769-43-2	[O-][V](=O)=O.[K+]	{29: 3}
Did not match all atoms present	13769-75-0	O=P(F)(F)Cl	{16: 2, 17: 1, 29: 1}
Did not match all atoms present	13770-16-6	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Mn+2]	{17: 2, 29: 8}
Did not match all atoms present	13770-61-1	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[In+3]	{}
Did not match all atoms present	13770-86-0	NS(=O)(=O)[O-].NS(=O)(=O)[O-].[Ba+2]	{29: 6, 30: 2}
Did not match all atoms present	13770-89-3	NS(=O)(=O)[O-].NS(=O)(=O)[O-].[Ni+2]	{29: 6, 30: 2}
Did not match all atoms present	13770-96-2	[Na+].[AlH4-]	{}
Did not match all atoms present	13771-22-7	B.B.B.[AlH3]	{}
Did not match all atoms present	13772-29-7	OP(=O)([O-])[O-].OP(=O)([O-])[O-].[Zr+4]	{20: 2, 29: 6}
Did not match all atoms present	13772-30-0	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ti+4]	{29: 8}
Did not match all atoms present	13772-47-9	[H-].[Cs+]	{}
Did not match all atoms present	137724-66-4	C1=CC(=C(C=C1N=C=S)Cl)F	{8: 1, 16: 1, 34: 1, 14: 3, 17: 1}
Did not match all atoms present	13773-81-4	F[Kr]F	{16: 2}
Did not match all atoms present	13774-16-8	O[P+](=O)O.[Rb]	{20: 2, 29: 1}
Did not match all atoms present	13774-81-7	[B].N	{}
Did not match all atoms present	13774-92-0	[NH]	{}
Did not match all atoms present	13775-06-9	F[U](F)F	{16: 3}
Did not match all atoms present	13775-13-8	Br[U]Br	{18: 2}
Did not match all atoms present	13775-16-1	Br[U](Br)(Br)(Br)Br	{18: 5}
Did not match all atoms present	13775-50-3	O=S(=O)([O-])O.O=S(=O)([O-])[O-].[Na+].[Na+].[Na+]	{20: 1, 29: 7}
Did not match all atoms present	13775-53-6	[Al+3].[F-].[F-].[F-].[F-].[F-].[F-].[Na+].[Na+].[Na+]	{16: 6}
Did not match all atoms present	13775-54-7	[O-][Si]([O-])([O-])[O-].[Ni+2].[Ni+2]	{29: 4}
Did not match all atoms present	13776-74-4	[O-][Si](=O)[O-].[Mg+2]	{29: 3}
Did not match all atoms present	13776-84-6	[OH-].[OH-].[OH-].[Na+].[Na+].[Na+].S=[Sb]	{}
Did not match all atoms present	13776-99-3	[H-].[Ti]	{}
Did not match all atoms present	13777-22-5	Br[Hf](Br)(Br)Br	{18: 4}
Did not match all atoms present	13777-23-6	[Hf+4].[I-].[I-].[I-].[I-]	{19: 4}
Did not match all atoms present	13777-25-8	Br[Zr](Br)(Br)Br	{18: 4}
Did not match all atoms present	13778-36-4	Cl[Pb]Br	{17: 1, 18: 1}
Did not match all atoms present	13778-39-7	O.O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Tm+3]	{17: 3}
Did not match all atoms present	13778-40-0	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Tm+3].[Tm+3]	{29: 12}
Did not match all atoms present	13779-24-3	B1(NB(NB(N1)F)F)F	{16: 3, 32: 3}
Did not match all atoms present	13779-41-4	OP(=O)(F)F	{16: 2, 20: 1, 29: 1}
Did not match all atoms present	13779-98-1	I[Pb](I)(I)I	{19: 4}
Did not match all atoms present	13780-03-5	OS(=O)[O-].OS(=O)[O-].[Ca+2]	{20: 2, 29: 4}
Did not match all atoms present	13780-06-8	N(=O)[O-].N(=O)[O-].[Ca+2]	{34: 2, 29: 4}
Did not match all atoms present	13780-11-5	[NH4+].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ca+2]	{}
Did not match all atoms present	13780-17-1	[O-]P(=O)([O-])[O-].[Na+].[Ca+2]	{29: 4}
Did not match all atoms present	13780-18-2	[O-][Se](=O)[O-].[Ca+2]	{29: 3}
Did not match all atoms present	13780-23-9	[1H][S]	{}
Did not match all atoms present	13780-28-4	[2H]N[2H]	{}
Did not match all atoms present	13780-29-5	[2H]P[2H]	{}
Did not match all atoms present	13780-39-7	O=[Ti].Cl.Cl	{17: 2, 29: 1}
Did not match all atoms present	13780-42-2	O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ga].[Ga]	{29: 12}
Did not match all atoms present	13780-48-8	[Br-].[Br-].[Eu+2]	{18: 2}
Did not match all atoms present	13780-57-9	FS(F)(F)(F)(F)Cl	{16: 5, 17: 1}
Did not match all atoms present	13780-71-7	[B](O)O	{20: 2}
Did not match all atoms present	13781-53-8	C1=CSC=C1CC#N	{41: 1, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	13781-67-4	C1=CSC=C1CCO	{41: 1, 2: 2, 20: 1, 14: 3}
Did not match all atoms present	13782-18-8	F[Zr-](F)(F)(F)F.[K+]	{16: 5}
Did not match all atoms present	13782-33-7	N.N.[Cl-].[Cl-].[Pd+2]	{17: 2}
Did not match all atoms present	13783-12-5	[Cl-].[Cl-].[Rh+2]	{17: 2}
Did not match all atoms present	137833-36-4	CC(=O)C(C(=O)C)C(=O)C1=CC=C(C=C1)OC	{24: 3, 1: 3, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	137869-70-6	C[C@]12CCC(=O)N1[C@@H](CO2)C3=CC=CC=C3	{1: 1, 33: 1, 11: 3, 12: 1, 13: 1, 14: 5, 23: 1, 25: 1}
Did not match all atoms present	137873-52-0	CCCC(C)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 38: 1, 14: 4, 22: 1}
Did not match all atoms present	13788-41-5	CN=C(N)N(C)C1=CC(=CC=C1)Cl	{1: 2, 34: 1, 33: 1, 7: 1, 14: 4, 17: 1, 30: 1}
Did not match all atoms present	13788-59-5	CC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2	{24: 2, 1: 1, 31: 1, 14: 8, 17: 1}
Did not match all atoms present	13788-84-6	CC1=C(C=NN1)C2=CC=CC=C2	{32: 1, 1: 1, 35: 1, 14: 6}
Did not match all atoms present	137898-96-5	CC1(CC(CC(N1)(C)C)OCCC[Si]C(Cl)Cl)C	{32: 1, 1: 4, 2: 3, 3: 1, 11: 2, 12: 1, 13: 2, 17: 2, 22: 1}
Did not match all atoms present	13791-92-9	CC1=C(C=CC(=C1)Cl)OC(C)C(=O)N(C)C	{1: 4, 3: 1, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	13794-14-4	CCC(C(=O)O)OC1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 22: 1, 27: 1}
Did not match all atoms present	137944-39-9	CN[C@H](C1=CC(=CC=C1)C(F)(F)F)[C@@H](C2=CC(=CC=C2)C(F)(F)F)NC	{1: 2, 3: 2, 4: 2, 14: 8, 16: 6, 31: 2}
Did not match all atoms present	13795-24-9	C1=CC=C(C=C1)COC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]	{2: 1, 38: 1, 14: 9}
Did not match all atoms present	137953-98-1	C1=CC=C2C=C(C(=CC2=C1)C(=O)O[Al](OC(=O)C3=CC4=CC=CC=C4C=C3O)OC(=O)C5=CC6=CC=CC=C6C=C5O)O	{28: 3, 21: 3, 14: 18}
Did not match all atoms present	13796-22-0	CC1=CC2=C(C=C1)NC3=C(C2=O)CC4=C(C3)C(=O)C5=C(N4)C=CC(=C5)C	{32: 2, 1: 2, 11: 2, 14: 6, 25: 2}
Did not match all atoms present	13798-24-8	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Tb+3]	{17: 3}
Did not match all atoms present	13799-03-6	CC(C1=CC2=C(C=C1)SC3=C(N2C)C=CC(=C3)OC)C(=O)O	{1: 3, 3: 1, 33: 1, 41: 1, 14: 6, 22: 1, 27: 1}
Did not match all atoms present	13799-90-1	C1=C(C(=CC(=C1Cl)C(=O)O)Cl)C(=O)O	{17: 2, 27: 2, 14: 2}
Did not match all atoms present	138-00-1	CCCCCC1=CC(=C(C=C1)O)CCCCC	{1: 2, 2: 8, 21: 1, 14: 3}
Did not match all atoms present	138-08-9	C=C(C(=O)O)OP(=O)(O)O	{5: 1, 7: 1, 20: 2, 22: 1, 27: 1, 29: 1}
Did not match all atoms present	138-14-7	CC(=O)N(CCCCCNC(=O)CCC(=O)N(CCCCCNC(=O)CCC(=O)N(CCCCCN)O)O)O.CS(=O)(=O)O	{1: 2, 2: 19, 33: 3, 20: 4, 24: 5, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	138-24-9	C[N+](C)(C)C1=CC=CC=C1.[Cl-]	{1: 3, 14: 5, 17: 1}
Did not match all atoms present	138-25-0	COC(=O)C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)OC	{1: 2, 20: 1, 29: 2, 14: 3, 28: 2}
Did not match all atoms present	138-28-3	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)N	{1: 1, 34: 2, 14: 7, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	138-30-7	C1=CC(=CC(=C1)S(=O)(=O)O)NN	{30: 1, 20: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	138-31-8	CC(=O)NC1=CC=C(C=C1)[Sb](=O)(O)[O-].[Na+]	{1: 1, 14: 4, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	138-32-9	CCCCCCCCCCCCCCCC[N+](C)(C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 15, 29: 3, 14: 4}
Did not match all atoms present	138-39-6	C1=CC(=CC=C1CN)S(=O)(=O)N	{2: 1, 30: 2, 29: 2, 14: 4}
Did not match all atoms present	138-41-0	C1=CC(=CC=C1C(=O)O)S(=O)(=O)N	{30: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	138-42-1	C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)O	{38: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	138-52-3	C1=CC=C(C(=C1)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	{2: 2, 12: 5, 14: 4, 20: 5, 22: 1, 23: 1}
Did not match all atoms present	138-53-4	C1=CC=C(C=C1)C(C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	{2: 1, 3: 1, 37: 1, 12: 5, 14: 5, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	138-56-7	CN(C)CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC	{1: 5, 2: 3, 33: 1, 14: 6, 22: 4, 24: 1, 31: 1}
Did not match all atoms present	138-65-8	C1=CC(=C(C=C1C(CN)O)O)O	{2: 1, 3: 1, 14: 3, 20: 1, 21: 2, 30: 1}
Did not match all atoms present	138-84-1	C1=CC(=CC=C1C(=O)[O-])N.[K+]	{24: 1, 30: 1, 14: 4}
Did not match all atoms present	138-85-2	C1=CC(=CC=C1C(=O)[O-])[Hg].O.[Na+]	{24: 1, 14: 4}
Did not match all atoms present	138-89-6	CN(C)C1=CC=C(C=C1)N=O	{1: 2, 34: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	138009-62-8	C=O.C1=CC=C(C=C1)O.C(CO)N(CCO)CC(COCC(CN(CCO)CCO)O)O	{33: 2, 2: 12, 3: 2, 5: 1, 14: 5, 20: 6, 21: 1, 22: 1}
Did not match all atoms present	13801-49-5	CC[N-]CC.CC[N-]CC.CC[N-]CC.CC[N-]CC.[Zr+4]	{1: 8, 2: 8, 34: 4}
Did not match all atoms present	13801-50-8	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)S)S	{17: 4, 39: 2}
Did not match all atoms present	13808-64-5	CC1=C(C=NN1)Br	{32: 1, 1: 1, 18: 1, 35: 1, 14: 1}
Did not match all atoms present	13812-07-2	O(P(F)F)P(F)F	{16: 4, 22: 1}
Did not match all atoms present	13812-81-2	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Sr+2].[Sr+2]	{29: 6, 22: 1}
Did not match all atoms present	138124-32-0	CC(C)(C)C1=CC(=C(C(=C1)C=N[C@@H]2CCCC[C@H]2N=CC3=CC(=CC(=C3[O-])C(C)(C)C)C(C)(C)C)[O-])C(C)(C)C.[Cl-].[Mn+3]	{1: 12, 34: 2, 4: 4, 6: 2, 11: 4, 12: 2, 14: 4, 17: 1}
Did not match all atoms present	13813-19-9	[2H]OS(=O)(=O)O[2H]	{20: 2, 29: 2}
Did not match all atoms present	13813-22-4	I[La](I)I	{19: 3}
Did not match all atoms present	13813-23-5	I[Pr](I)I	{19: 3}
Did not match all atoms present	13813-24-6	I[Nd](I)I	{19: 3}
Did not match all atoms present	13813-25-7	I[Sm](I)I	{19: 3}
Did not match all atoms present	13813-79-1	[10B](O)(O)O	{20: 3}
Did not match all atoms present	13813-81-5	[NH4+].[NH4+].[NH4+].OP(=O)([O-])OP(=O)([O-])[O-]	{20: 1, 29: 5, 22: 1}
Did not match all atoms present	13814-20-5	F[Ti]F	{16: 2}
Did not match all atoms present	13814-49-8	[Be+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	13814-59-0	O=[Se]([O-])[O-].[Cd+2]	{29: 3}
Did not match all atoms present	13814-62-5	[O-][Se](=O)(=O)[O-].[Cd+2]	{29: 4}
Did not match all atoms present	13814-65-8	F[Al](F)Cl	{16: 2, 17: 1}
Did not match all atoms present	13814-75-0	O=[Mo].Cl.Cl.Cl.Cl	{17: 4, 29: 1}
Did not match all atoms present	13814-76-1	[Cl-].[Cl-].[Cl-].[Cl-].[O].[Re+4]	{17: 4}
Did not match all atoms present	13814-81-8	O.O.[O-]S(=O)[O-].[O-]S(=O)[O-].[Cu+].[Cu+].[Cu+2]	{29: 6}
Did not match all atoms present	13814-83-0	O=[V].F.F	{16: 2, 29: 1}
Did not match all atoms present	13814-96-5	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Pb+2]	{16: 8}
Did not match all atoms present	13814-98-7	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Sr+2]	{16: 8}
Did not match all atoms present	13815-13-9	[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[Cl-].[Cl-].[Fe+2]	{17: 2}
Did not match all atoms present	13815-28-6	[NH4+].[NH4+].[NH4+].F[Fe-3](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	13815-31-1	[NH4+].[NH4+].[NH4+].[F-].[F-].[F-].[F-].[F-].[F-].[V]	{16: 6}
Did not match all atoms present	13815-33-3	F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.[Pd]	{16: 12}
Did not match all atoms present	13815-35-5	F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.[W]	{16: 18}
Did not match all atoms present	13815-39-9	N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[K+].[K+].[Pt]	{34: 4, 29: 8}
Did not match all atoms present	13816-33-6	CC(C)C1=CC=C(C=C1)C#N	{1: 2, 3: 1, 37: 1, 14: 4}
Did not match all atoms present	13816-38-1	S=[Sb]I	{19: 1}
Did not match all atoms present	13817-06-6	O=P	{29: 1}
Did not match all atoms present	13817-37-3	O.O.O.O.[F-].[F-].[Co+2]	{16: 2}
Did not match all atoms present	13818-75-2	Br[Gd](Br)Br	{18: 3}
Did not match all atoms present	13818-89-8	[GeH3].[GeH3]	{}
Did not match all atoms present	13819-11-9	FP(F)I	{16: 2, 19: 1}
Did not match all atoms present	13819-84-6	F[Mo](F)(F)(F)F	{16: 5}
Did not match all atoms present	13820-33-2	[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2].[Cs+].[Cs+]	{17: 4}
Did not match all atoms present	13820-45-6	N.N.N.N.[Cl-].[Cl-].[Cl-].[Cl-].[Pt+2].[Pt+2]	{17: 4}
Did not match all atoms present	13820-56-9	[Cl-].[Cl-].[Cl-].[Cl-].[Rb+].[Rb+].[Pt+2]	{17: 4}
Did not match all atoms present	13820-81-0	[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].O.OCl(=O)(=O)=O.[Co+3]	{17: 1, 20: 1, 29: 3}
Did not match all atoms present	13820-91-2	N.Cl[Pt-](Cl)Cl.[K+]	{17: 3}
Did not match all atoms present	13820-95-6	N.N.N.N.N.[Cl-].[Cl-].[Cl-].[Rh+3]	{17: 3}
Did not match all atoms present	13821-00-6	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].I[Re]	{19: 1, 29: 5}
Did not match all atoms present	13821-08-4	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ca+2].[Ca+2].[Fe+2]	{}
Did not match all atoms present	13821-13-1	[Al-](Cl)(Cl)(Cl)Cl.[K+]	{17: 4}
Did not match all atoms present	13821-15-3	F[Al-](F)(F)F.[Na+]	{16: 4}
Did not match all atoms present	13822-05-4	C1C[NH2+]C(C2=CC=CC=C2C[NH2+]1)C3=CC=C(C=C3)Cl.[Cl-].[Cl-]	{17: 3, 11: 3, 12: 1, 14: 8}
Did not match all atoms present	13822-56-5	CO[Si](CCCN)(OC)OC	{1: 3, 2: 3, 30: 1, 22: 3}
Did not match all atoms present	13823-29-5	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Th+4]	{}
Did not match all atoms present	13824-36-7	F[SiH2]F	{16: 2}
Did not match all atoms present	13824-57-2	O=[Mo]=O.F.F	{16: 2, 29: 2}
Did not match all atoms present	13824-74-3	FP(F)P(F)F	{16: 4}
Did not match all atoms present	13824-85-6	[O-]S(=O)(=O)[O-].[Zr+2]	{29: 4}
Did not match all atoms present	138240-24-1	CCOC1=C2CC3=CC=CC(=C3O)CC4=C(C(=CC=C4)CC5=C(C(=CC=C5)CC1=CC=C2)O)O	{1: 1, 2: 1, 11: 4, 14: 12, 21: 3, 22: 1}
Did not match all atoms present	138249-07-7	CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H](C=C)O	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 14: 4, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	13825-25-7	O=N[O-].[Rb+]	{34: 1, 29: 2}
Did not match all atoms present	13825-74-6	O=S(=O)([O-])[O-].[O].[Ti+2]	{29: 4}
Did not match all atoms present	13825-76-8	[Br-].[Br-].[Br-].[Ho+3]	{18: 3}
Did not match all atoms present	13825-86-0	[O-]S(=O)(=O)[O-].[Cr+2]	{29: 4}
Did not match all atoms present	13826-35-2	C1=CC=C(C=C1)OC2=CC=CC(=C2)CO	{2: 1, 20: 1, 22: 1, 14: 9}
Did not match all atoms present	13826-65-8	N(=O)[O-].N(=O)[O-].[Pb+2]	{34: 2, 29: 4}
Did not match all atoms present	13826-66-9	[N+](=O)(O)[O-].[N+](=O)(O)[O-].O=[Zr]	{20: 2, 29: 1}
Did not match all atoms present	13826-83-0	[B-](F)(F)(F)F.[NH4+]	{16: 4}
Did not match all atoms present	13826-86-3	[B-](F)(F)(F)F.[N+](=O)=O	{16: 4, 34: 1, 29: 2}
Did not match all atoms present	13826-88-5	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Zn+2]	{16: 8}
Did not match all atoms present	13826-93-2	[K+].[K+].Br[Pd-2](Br)(Br)Br	{18: 4}
Did not match all atoms present	13826-94-3	[K+].[K+].[Br-].[Br-].[Br-].[Br-].[Pt+2]	{18: 4}
Did not match all atoms present	13827-30-0	N1=P(N=P(N=P(N=P(N=P(N=P(N=P1(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 14, 35: 7}
Did not match all atoms present	13827-32-2	O=S	{29: 1}
Did not match all atoms present	13829-21-5	CCCCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 9, 17: 3}
Did not match all atoms present	13830-68-7	F[Si](F)(F)[Si](F)(F)F	{16: 6}
Did not match all atoms present	138314-12-2	C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[Na].[Na+].[Na+].[Na+].[Na+].[Na+].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]	{33: 4, 2: 12, 29: 24}
Did not match all atoms present	13835-15-9	CN(C)CCN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=C(C=C3)Cl	{1: 2, 2: 3, 35: 1, 33: 2, 14: 8, 17: 1, 25: 1}
Did not match all atoms present	13835-81-9	CC1=CC=CC=C1[Si](Cl)(Cl)Cl	{1: 1, 14: 4, 17: 3}
Did not match all atoms present	13836-37-8	CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C)N	{1: 4, 2: 3, 3: 1, 4: 1, 7: 1, 34: 1, 14: 4, 27: 1, 28: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	138377-34-1	C1=CC(=C(C(=C1)O)Cl)C(F)(F)F	{16: 3, 17: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	13839-85-5	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Yb+3]	{}
Did not match all atoms present	13840-33-0	[Li+].[O-]Cl	{17: 1, 29: 1}
Did not match all atoms present	13840-88-5	[B]([OH2+])[O-]	{29: 1}
Did not match all atoms present	13842-48-3	[SiH](Br)(Br)Br	{18: 3}
Did not match all atoms present	13842-55-2	[B](F)F	{16: 2}
Did not match all atoms present	13842-56-3	[B]I	{19: 1}
Did not match all atoms present	13842-67-6	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Tb+3].[Tb+3]	{29: 12}
Did not match all atoms present	13842-83-6	[F-].[F-].[F-].[Pu]	{16: 3}
Did not match all atoms present	13842-84-7	F[Th](F)F	{16: 3}
Did not match all atoms present	13842-93-8	F[Tc](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	13842-94-9	F[Zr]F	{16: 2}
Did not match all atoms present	13843-59-9	[NH4+].[O-]Br(=O)=O	{18: 1, 29: 3}
Did not match all atoms present	13844-89-8	N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[K+].[K+].[Pd]	{34: 4, 29: 8}
Did not match all atoms present	13845-17-5	[O-]S(=O)(=O)S(=O)(=O)[O-].[Ba+2]	{29: 6}
Did not match all atoms present	13845-36-8	[O-]P(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+]	{29: 8, 22: 2}
Did not match all atoms present	13847-57-9	F[Pb]Cl	{16: 1, 17: 1}
Did not match all atoms present	13847-60-4	[N-]=[N+]=N[SiH3]	{34: 2}
Did not match all atoms present	13847-65-9	[N+]([O-])(F)(F)F	{16: 3, 29: 1}
Did not match all atoms present	138474-57-4	C1CN=C(N1)NC2=CC=CC=C2	{32: 1, 35: 1, 11: 2, 14: 5, 15: 1, 31: 1}
Did not match all atoms present	13849-08-6	CC(C)([C@@H]1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)O	{1: 2, 4: 1, 11: 1, 12: 1, 14: 4, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	1385-04-2	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3C(=CC4)OC	{1: 3, 33: 1, 11: 4, 12: 3, 13: 1, 14: 3, 15: 1, 22: 2, 23: 1}
Did not match all atoms present	138519-56-9	CC(C)(C1=CC(=CC=C1)C(C)(C)N=C=O)N=C=O.C1CCC(=O)OCC1.C(COCCO)O	{1: 4, 2: 4, 4: 2, 8: 2, 11: 5, 34: 2, 14: 4, 20: 2, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	138526-69-9	C1=C(C=C(C(=C1F)F)F)Br	{16: 3, 18: 1, 14: 2}
Did not match all atoms present	138542-40-2	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=CC(=CC(=C54)C=C3)[N+](=O)[O-]	{38: 1, 14: 11}
Did not match all atoms present	13856-85-4	CCC(C1=CC=C(C=C1)Cl)O	{1: 1, 2: 1, 3: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	138574-86-4	C1=CC2=C(C=C1S(=O)(=O)O)C(=O)/C(=C\3/C(=O)C4=CC(=CC(=C4N3)S(=O)(=O)O)S(=O)(=O)O)/N2	{32: 2, 14: 5, 15: 2, 20: 3, 25: 2, 29: 6}
Did not match all atoms present	138574-87-5	C1C(=O)NC(=O)N1.C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N	{32: 2, 35: 3, 11: 1, 14: 5, 25: 2, 30: 2}
Did not match all atoms present	13859-51-3	N.N.N.N.N.[Cl-].[Cl-].[Cl-].[Co+3]	{17: 3}
Did not match all atoms present	13859-65-9	FP(F)F.FP(F)F.FP(F)F.FP(F)F.[Ni]	{16: 12}
Did not match all atoms present	13859-68-2	N.N.N.N.N.N.[Ni](I)I	{19: 2}
Did not match all atoms present	13861-37-5	CCN1C2=CC=CC=C2SC1=CC(=O)C	{1: 2, 2: 1, 6: 1, 33: 1, 41: 1, 14: 4, 15: 1, 24: 1}
Did not match all atoms present	13862-07-2	C1CCN(C(C1)C(C2=CC=CC=C2)C3=CC=CC=C3)CCO	{33: 1, 2: 2, 3: 1, 11: 4, 12: 1, 14: 10, 20: 1}
Did not match all atoms present	13862-16-3	N([SiH3])([SiH3])[SiH3]	{33: 1}
Did not match all atoms present	13862-62-9	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Ba+2]	{16: 8}
Did not match all atoms present	13862-78-7	N.N.[SH-].[SH-].S=[W]=S	{}
Did not match all atoms present	13863-31-5	CN(CCO)C1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)N(C)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC=CC=C6.[Na+].[Na+]	{1: 2, 2: 4, 35: 6, 6: 2, 33: 2, 14: 16, 20: 2, 29: 6, 31: 4}
Did not match all atoms present	13864-01-2	[H-].[H-].[H-].[La+3]	{}
Did not match all atoms present	13864-02-3	[CeH3]	{}
Did not match all atoms present	13864-03-4	[H-].[H-].[H-].[Pr+3]	{}
Did not match all atoms present	13864-04-5	[H-].[H-].[H-].[Nd+3]	{}
Did not match all atoms present	13865-48-0	CC1=CC(=CC=C1)SC2=CC=CC=C2	{40: 1, 1: 1, 14: 9}
Did not match all atoms present	13865-49-1	C1=CC=C(C=C1)CCSC2=CC=CC=C2	{40: 1, 2: 2, 14: 10}
Did not match all atoms present	13865-50-4	COCSC1=CC=CC=C1	{40: 1, 1: 1, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	13865-57-1	CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 3: 1, 14: 14, 33: 1}
Did not match all atoms present	13867-66-8	B(O)(F)F	{16: 2, 20: 1}
Did not match all atoms present	13869-33-5	C(C(=O)[O-])NCC(=O)[O-].[Ni+2]	{24: 2, 2: 2, 31: 1}
Did not match all atoms present	13869-38-0	CC#N.CC#N.Cl[Pt]Cl	{1: 2, 37: 2, 17: 2}
Did not match all atoms present	13871-27-7	[Be+2].[F-].[F-].[F-].[Na+]	{16: 3}
Did not match all atoms present	13871-68-6	CC(=O)OC1=CC=C(C=C1)N	{1: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	13871-89-1	C[Si](C)(C)OC1CCCCC1	{1: 3, 11: 5, 12: 1, 22: 1}
Did not match all atoms present	13874-75-4	[Cl-].[Cl-].[Sm+2]	{17: 2}
Did not match all atoms present	13874-77-6	[Cl-].[Cl-].[Yb+2]	{17: 2}
Did not match all atoms present	13876-97-6	[B-](O)(F)(F)F.[Na+]	{16: 3, 20: 1}
Did not match all atoms present	13876-98-7	[B-](O)(F)(F)F.[K+]	{16: 3, 20: 1}
Did not match all atoms present	13877-56-0	C1=NNC2=C1N=CN=C2N	{32: 1, 35: 3, 30: 1, 14: 2}
Did not match all atoms present	13877-99-1	CN(C)CCOCCOC(=O)C1(CCCC1)C2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 11: 4, 13: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	138774-94-4	C1=CC=C2C=C(C=CC2=C1)C[C@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35	{2: 2, 3: 1, 12: 1, 14: 15, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	13878-44-9	CCC(=O)CC(=O)C.CCC(=O)CC(=O)C.[Cu]	{24: 4, 1: 4, 2: 4}
Did not match all atoms present	13878-48-3	CC(=NCCN=C(C)CC(=O)C)CC(=O)C.[Ni]	{24: 2, 1: 4, 2: 4, 34: 2, 7: 2}
Did not match all atoms present	13878-54-1	C1CCN(CC1)C(=S)[S-].C1CCN(CC1)C(=S)[S-].[Zn+2]	{33: 2, 11: 10, 7: 2}
Did not match all atoms present	13881-91-9	C(N)S(=O)(=O)O	{2: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	138816-93-0	[Li+].CN(CCO)CCO.C1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C=C3O)S(=O)(=O)[O-])S(=O)(=O)[O-])/C=C/C4=C(C=C(C=C4)N=NC5=C6C(=CC(=C5)S(=O)(=O)[O-])C=C(C=C6O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 1, 2: 4, 6: 2, 33: 1, 34: 4, 14: 14, 20: 2, 21: 2, 29: 18}
Did not match all atoms present	138816-95-2	[Li+].CN(CCO)CCO.C1=CC(=C(C=C1N=NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)[O-])S(=O)(=O)[O-])/C=C/C4=C(C=C(C=C4)N=NC5=CC6=CC(=CC(=C6C=C5)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 1, 2: 4, 6: 2, 33: 1, 34: 4, 14: 16, 20: 2, 21: 2, 29: 12}
Did not match all atoms present	138816-97-4	[Li+].CN(CCO)CCO.C1=CC(=C(C=C1N=NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)[O-])S(=O)(=O)[O-])/C=C/C4=C(C=C(C=C4)N=NC5=C6C(=CC(=C5)S(=O)(=O)[O-])C=C(C=C6O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 1, 2: 4, 6: 2, 33: 1, 34: 4, 14: 15, 20: 2, 21: 2, 29: 15}
Did not match all atoms present	13882-12-7	CSS(=O)C	{40: 1, 1: 2, 29: 1}
Did not match all atoms present	138825-96-4	CC(=O)NC1=C(C=C(C=C1)Br)C(=O)OC	{1: 2, 14: 3, 18: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	13883-39-1	C(C[Si](Cl)(Cl)Cl)CBr	{17: 3, 2: 3, 18: 1}
Did not match all atoms present	138835-33-3	C1=CC=C2C(=C1)C3=C4C(=[N+]2[O-])C=CC5=C4C(=C(C=C5)[N+](=O)[O-])C=C3	{33: 1, 38: 1, 29: 1, 14: 10}
Did not match all atoms present	138835-34-4	C1=CC=C2C(=C1)C3=C4C(=[N+]2[O-])C=CC5=C(C=CC(=C54)C=C3)[N+](=O)[O-]	{33: 1, 38: 1, 29: 1, 14: 10}
Did not match all atoms present	138835-35-5	C1=CC=C2C(=C1)C3=C4C(=N2)C=CC5=C4C(=C(C=C5)[N+](=O)[O-])C=C3	{35: 1, 38: 1, 14: 10}
Did not match all atoms present	138835-36-6	C1=CC=C2C(=C1)C3=C4C(=N2)C=CC5=C(C=CC(=C54)C=C3)[N+](=O)[O-]	{35: 1, 38: 1, 14: 10}
Did not match all atoms present	138859-29-7	CCCC(C)OC1=CC=C(C=C1)N.Cl	{1: 2, 2: 2, 3: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	13886-04-9	CC(=O)NC1=CC(=C(C=C1)O)CN(C)C	{1: 3, 2: 1, 33: 1, 14: 3, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	13886-99-2	CCCCCCCCCCCCCCCCCCCCP1C2CCCCC1CC2	{1: 1, 2: 19, 11: 6, 12: 2}
Did not match all atoms present	13887-00-8	CCCCCCCCCCCCCCCCCCCCP1C2CCCC1CCC2	{1: 1, 2: 19, 11: 6, 12: 2}
Did not match all atoms present	138908-40-4	C[C@H](CC1=CC2=C(C=C1)OC(O2)(C(=O)[O-])C(=O)[O-])NC[C@@H](C3=CC(=CC=C3)Cl)O.[Na+].[Na+]	{1: 1, 2: 2, 3: 2, 13: 1, 14: 7, 17: 1, 20: 1, 23: 2, 24: 2, 31: 1}
Did not match all atoms present	13892-06-3	C[Si](C)(C)N=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 34: 1, 14: 15}
Did not match all atoms present	13893-34-0	CCCCCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 17, 29: 3}
Did not match all atoms present	13895-38-0	COC1=CC(=C(C=C1)N=O)O	{1: 1, 34: 1, 14: 3, 21: 1, 22: 1, 29: 1}
Did not match all atoms present	138977-28-3	C1CC2=CC(=C(C=C2CN(C1)C(=S)NCCC3=CC=C(C=C3)Cl)O)O	{33: 1, 2: 2, 7: 1, 11: 4, 14: 6, 17: 1, 21: 2, 31: 1}
Did not match all atoms present	13898-58-3	C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C(=O)O)O	{24: 1, 27: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	138983-08-1	CC(C)(C)[Si](C)(C)C(Cl)Cl	{1: 5, 3: 1, 4: 1, 17: 2}
Did not match all atoms present	139-02-6	C1=CC=C(C=C1)[O-].[Na+]	{14: 5}
Did not match all atoms present	139-05-9	C1CCC(CC1)NS(=O)(=O)[O-].[Na+]	{11: 5, 12: 1, 29: 3, 31: 1}
Did not match all atoms present	139-06-0	C1CCC(CC1)NS(=O)(=O)[O-].C1CCC(CC1)NS(=O)(=O)[O-].[Ca+2]	{11: 10, 12: 2, 29: 6, 31: 2}
Did not match all atoms present	139-07-1	CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 12, 14: 5, 17: 1}
Did not match all atoms present	139-08-2	CCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 14, 14: 5, 17: 1}
Did not match all atoms present	139-10-6	CC(CC1=CC=CC=C1)N.OP(=O)(O)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 3, 29: 1, 30: 1}
Did not match all atoms present	139-12-8	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Al+3]	{24: 3, 1: 3}
Did not match all atoms present	139-25-3	CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N=C=O)C)N=C=O	{1: 2, 2: 1, 8: 2, 34: 2, 14: 6, 29: 2}
Did not match all atoms present	139-40-2	CC(C)NC1=NC(=NC(=N1)Cl)NC(C)C	{31: 2, 1: 4, 3: 2, 35: 3, 17: 1}
Did not match all atoms present	139-42-4	C(=O)(C(=O)[O-])[O-].[Ce].[Ce]	{24: 2}
Did not match all atoms present	139-59-3	C1=CC=C(C=C1)OC2=CC=C(C=C2)N	{30: 1, 22: 1, 14: 9}
Did not match all atoms present	139-60-6	CCC(C)CC(CC)NC1=CC=C(C=C1)NC(CC)CC(C)CC	{1: 6, 2: 6, 3: 4, 14: 4, 31: 2}
Did not match all atoms present	139-62-8	CC1CCCCN1CCCOC(=O)C2=CC=C(C=C2)OC3CCCCC3	{1: 1, 2: 3, 33: 1, 11: 9, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	139-65-1	C1=CC(=CC=C1N)SC2=CC=C(C=C2)N	{40: 1, 30: 2, 14: 8}
Did not match all atoms present	139-66-2	C1=CC=C(C=C1)SC2=CC=CC=C2	{40: 1, 14: 10}
Did not match all atoms present	139-70-8	CC(CCC=C(C)C)CCOC(=O)CC1=CC=CC=C1	{1: 3, 2: 5, 3: 1, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	139-85-5	C1=CC(=C(C=C1C=O)O)O	{26: 1, 21: 2, 14: 3}
Did not match all atoms present	139-88-8	CCCCC(CC)CCC(CC(C)C)OS(=O)(=O)[O-].[Na+]	{1: 4, 2: 7, 3: 3, 29: 3, 22: 1}
Did not match all atoms present	139-91-3	C1COCCN1CC2CN(C(=O)O2)/N=C/C3=CC=C(O3)[N+](=O)[O-]	{33: 2, 2: 1, 38: 1, 6: 1, 11: 5, 12: 1, 34: 1, 14: 2, 23: 2, 28: 1}
Did not match all atoms present	139-93-5	C1=CC(=C(C=C1[As]=[As]C2=CC(=C(C=C2)O)N)N)O.Cl.Cl	{17: 2, 30: 2, 21: 2, 14: 6}
Did not match all atoms present	139-94-6	CCNC(=O)NC1=NC=C(S1)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 41: 1, 14: 1, 24: 1, 31: 2}
Did not match all atoms present	139-96-8	CCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 17, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	13904-39-7	CCC[Ge](I)(I)I	{1: 1, 2: 2, 19: 3}
Did not match all atoms present	13904-58-0	CC1=CC=C(P1C2=CC=CC=C2)C	{1: 2, 14: 7}
Did not match all atoms present	13904-95-5	CS(=N)(=N)C	{1: 2, 36: 2}
Did not match all atoms present	139043-27-9	COC(=O)C1=CC=C(C=C1)C(=O)OC.C1C(O1)CN2C(=O)N(C(=O)N(C2=O)CC3CO3)CC4CO4.C(CCO)CO	{1: 2, 2: 7, 33: 3, 11: 3, 12: 3, 14: 4, 20: 2, 23: 3, 25: 3, 28: 2}
Did not match all atoms present	139057-86-6	C1=CC(=C(C=C1N=C=O)C(F)(F)F)F	{34: 1, 4: 1, 8: 1, 14: 3, 16: 4, 29: 1}
Did not match all atoms present	13907-45-4	[Cr].[O-].[O-].[O].[O]	{}
Did not match all atoms present	13907-47-6	[Cr].[Cr].[O-].[O-].[O].[O].[O].[O].[O]	{}
Did not match all atoms present	13907-59-0	C1=CC(=CC=C1NC(=O)N(CCCl)N=O)NC(=O)N(CCCl)N=O	{33: 2, 2: 4, 34: 2, 14: 4, 17: 2, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	13907-61-4	C1=C(C=C(C=C1NC(=O)N(CCCl)N=O)NC(=O)N(CCCl)N=O)C(=O)O	{33: 2, 2: 4, 34: 2, 14: 3, 17: 2, 24: 2, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	13907-99-8	C1=CC(=CC=C1NC(=O)NCCF)NC(=O)NCCF	{16: 2, 24: 2, 2: 4, 14: 4, 31: 4}
Did not match all atoms present	139072-43-8	CCCCCCCCCCCCCC[N+]1(CCOCC1)CC.CCOS(=O)(=O)[O-]	{1: 3, 2: 15, 11: 4, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	13908-23-1	C1CCC(CC1)(C2=CC=CC=C2)NC(=O)NCCCl	{2: 2, 11: 5, 13: 1, 14: 5, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	13908-34-4	C1=CC(=CC(=C1)Cl)NC(=O)NCCCl	{24: 1, 17: 2, 2: 2, 14: 4, 31: 2}
Did not match all atoms present	13908-36-6	C1=C(C=C(C(=C1Cl)N)Cl)NC(=O)NCCCl	{2: 2, 14: 2, 17: 3, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	13908-45-7	C1=CC(=CC(=C1)NC(=O)NCCCl)C(=O)O	{2: 2, 14: 4, 17: 1, 24: 1, 27: 1, 31: 2}
Did not match all atoms present	13908-48-0	CC(=O)C1=CC=C(C=C1)NC(=O)NCCCl	{1: 1, 2: 2, 14: 4, 17: 1, 24: 2, 31: 2}
Did not match all atoms present	13908-49-1	CN(C)C(=O)C1=CC=C(C=C1)NC(=O)NCCCl	{1: 2, 2: 2, 33: 1, 14: 4, 17: 1, 24: 2, 31: 2}
Did not match all atoms present	13908-56-0	C1CCC2=C(C1)C=CC(=C2)NC(=O)NCCCl	{2: 2, 11: 4, 14: 3, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	13908-65-1	C1=CC=C(C(=C1)NC(=O)NCCCl)NC(=O)NCCCl	{24: 2, 17: 2, 2: 4, 14: 4, 31: 4}
Did not match all atoms present	13908-71-9	C1=CC(=CC=C1CC2=CC=C(C=C2)NC(=O)NCCCl)NC(=O)NCCCl	{24: 2, 17: 2, 2: 5, 14: 8, 31: 4}
Did not match all atoms present	13909-23-4	C1=CC=C(C(=C1)C(=O)O)NC(=O)N(CCCl)N=O	{33: 1, 2: 2, 34: 1, 14: 4, 17: 1, 24: 1, 27: 1, 29: 1, 31: 1}
Did not match all atoms present	13909-25-6	C1=CC(=CC=C1C(=O)O)NC(=O)N(CCCl)N=O	{33: 1, 2: 2, 34: 1, 14: 4, 17: 1, 24: 1, 27: 1, 29: 1, 31: 1}
Did not match all atoms present	13909-28-9	CN(C)C(=O)C1=CC=C(C=C1)NC(=O)N(CCCl)N=O	{1: 2, 2: 2, 33: 2, 34: 1, 14: 4, 17: 1, 24: 2, 29: 1, 31: 1}
Did not match all atoms present	13909-30-3	C1=CC(=CC=C1NC(=O)N(CCCl)N=O)SCC(=O)O	{33: 1, 2: 3, 40: 1, 34: 1, 14: 4, 17: 1, 24: 1, 27: 1, 29: 1, 31: 1}
Did not match all atoms present	13909-73-4	CC(=O)C1=C(C(=C(C=C1)OC)OC)OC	{24: 1, 1: 4, 22: 3, 14: 2}
Did not match all atoms present	1391-36-2	CC1[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]3CSC[C@@H](C(=O)N[C@@H](CS1)C(=O)NCCC(=O)N[C@H](C(=O)NCC(=O)N4CCC[C@H]4C(=O)N[C@H](C(=O)N2)CC5=CC=CC=C5)CC6=CC=CC=C6)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CSC([C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC3=O)C(C(=O)O)O)CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)O)C)N)CCCCN)CCC(=O)N)C(C)C)CC7=CC=CC=C7	{32: 16, 1: 4, 2: 14, 3: 3, 33: 1, 41: 3, 11: 11, 12: 17, 14: 15, 20: 1, 24: 3, 25: 17, 27: 2, 30: 5, 31: 1}
Did not match all atoms present	13911-65-4	C[As](=O)(C1=CC=CC=C1)O	{1: 1, 20: 1, 29: 1, 14: 5}
Did not match all atoms present	13912-65-7	C1C(C2=CC=CC=C2C3C1C(=O)OC3=O)C4CC(=O)OC4=O	{28: 4, 11: 2, 12: 4, 14: 4}
Did not match all atoms present	13912-77-1	CCN(CC)C(C)CC(=O)NC1=CC=CC=C1	{1: 3, 2: 3, 3: 1, 33: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	139149-55-6	C1[C@H](C2=C(O1)C=C(C=C2)OCC3=CC=CC=C3)N(C(=O)N)O	{33: 1, 2: 1, 11: 1, 12: 1, 14: 8, 20: 1, 22: 1, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	13915-79-2	CCC(=O)NC1=NC(=C(S1)Cl)C	{1: 2, 2: 1, 35: 1, 41: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	139157-69-0	CC1(OCC(=CC2=NC=C(N2C)[N+](=O)[O-])CO1)C	{1: 3, 35: 1, 38: 1, 6: 1, 33: 1, 11: 2, 13: 1, 14: 1, 15: 1, 23: 2}
Did not match all atoms present	139157-71-4	CN1C(=CN=C1C=C2CN(CN(C2)C3CCCCC3)C4CCCCC4)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 6: 1, 33: 3, 11: 13, 12: 2, 14: 1, 15: 1}
Did not match all atoms present	13918-22-4	[O-][W](=O)(=O)[O-].[Mn+2]	{29: 4}
Did not match all atoms present	13918-37-1	O[Si](O)(O)O.[Fe+2].[Fe+2]	{20: 4}
Did not match all atoms present	139215-43-3	C1=C(C=C(C(=C1F)Br)Br)F	{16: 2, 18: 2, 14: 2}
Did not match all atoms present	13922-41-3	B(C1=CC=CC2=CC=CC=C12)(O)O	{20: 2, 14: 7}
Did not match all atoms present	13924-50-0	C1C2=CC=CC=C2C3=C1C=C(C=C3)N=CC4=CC=CC=C4	{34: 1, 11: 1, 14: 12, 6: 1}
Did not match all atoms present	13925-00-3	CCC1=NC=CN=C1	{1: 1, 2: 1, 35: 2, 14: 3}
Did not match all atoms present	13925-03-6	CCC1=NC(=CN=C1)C	{1: 2, 2: 1, 35: 2, 14: 2}
Did not match all atoms present	13925-05-8	CC1=CN=C(C=N1)C(C)C	{1: 3, 3: 1, 14: 2, 35: 2}
Did not match all atoms present	13925-07-0	CCC1=NC=C(N=C1C)C	{1: 3, 2: 1, 35: 2, 14: 1}
Did not match all atoms present	13925-08-1	CC1=NC=C(N=C1)C=C	{1: 1, 14: 2, 35: 2, 5: 1, 6: 1}
Did not match all atoms present	13925-09-2	CC1=NC(=CN=C1)C=C	{1: 1, 14: 2, 35: 2, 5: 1, 6: 1}
Did not match all atoms present	13925-12-7	COC1=CC=CC2=C1N(C3=CC=CC(=O)C3=[N+]2[O-])O	{1: 1, 33: 2, 14: 6, 21: 1, 22: 1, 25: 1, 29: 1}
Did not match all atoms present	139254-91-4	C[Si](N=C=[Se])(N=C=[Se])N=C=[Se]	{8: 3, 1: 1, 34: 3}
Did not match all atoms present	13927-71-4	CCCCN(CCCC)C(=S)[S-].CCCCN(CCCC)C(=S)[S-].[Cu+2]	{1: 4, 2: 12, 33: 2, 7: 2}
Did not match all atoms present	13927-77-0	CCCCN(CCCC)C(=S)[S-].CCCCN(CCCC)C(=S)[S-].[Ni+2]	{1: 4, 2: 12, 33: 2, 7: 2}
Did not match all atoms present	13928-31-9	C1=CC(=CNCCNC=C2C=CC=CC2=O)C(=O)C=C1.[Mn]	{2: 2, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
Did not match all atoms present	13929-01-6	CC[NH+](CCCl)C1C2=CC=CC=C2C3=CC=CC=C13.[Cl-]	{1: 1, 2: 3, 12: 1, 14: 8, 17: 2}
Did not match all atoms present	13929-35-6	C[C@H]1/C=C/C=C(\C(=O)NC2=CC(=C3C(=C2O)C(=C(C4=C3C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C)O)OCC(=O)O)/C	{32: 1, 1: 9, 2: 1, 12: 8, 13: 1, 14: 6, 15: 1, 20: 2, 21: 2, 22: 2, 23: 2, 25: 2, 27: 1, 28: 1}
Did not match all atoms present	1393-38-0	CCC(C)C(C(=O)NC(=C)C(=O)NC(CCCCN)C(=O)O)NC(=O)C(CCCCN)NC(=O)C1CSC(C2C(=O)NC(CSC(C(C(=O)NC(C(=O)N2)CC(C)C)NC(=O)C(CCC(=O)N)NC(=O)C(CC(C)C)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4CSC(C(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)N/C(=C\C)/C(=O)N4)CCC(=O)N)CC(C)C)C)NC(=O)C(C(C)C)NC(=O)C5CSC(C(C(=O)N6CCCC6C(=O)NCC(=O)N5)NC(=O)C7CSCC(C(=O)NC(C(=O)NC(=C)C(=O)NC(C(=O)N7)CC(C)C)CCC(=O)O)NC(=O)C(CCCCN)NC(=O)C(CC8=CNC9=CC=CC=C98)N)C)C)C)C(=O)NC(C(=O)N1)CC(=O)N)C	{32: 18, 1: 18, 2: 26, 3: 15, 5: 2, 6: 1, 7: 1, 41: 5, 11: 11, 12: 22, 14: 10, 15: 2, 24: 16, 25: 18, 33: 1, 27: 2, 30: 7, 31: 13}
Did not match all atoms present	1393-48-2	CCC(C)C1C(=O)NC(C(=O)NC(=C)C(=O)NC(C(=O)NC23CCC(=NC2C4=CSC(=N4)[C@H](C(OC(=O)C5=NC6=C(C=C[C@H]([C@@H]6O)N1)C(=C5)C(C)O)C)NC(=O)C7=CSC(=N7)[C@H](NC(=O)C8CSC(=N8)/C(=C/C)/NC(=O)[C@@H](NC(=O)C9=CSC3=N9)[C@@H](C)O)C(C)(C(C)O)O)C1=NC(=CS1)C(=O)NC(=C)C(=O)NC(=C)C(=O)N)C)C	{32: 9, 1: 10, 2: 1, 3: 4, 4: 1, 5: 3, 6: 1, 7: 2, 41: 5, 11: 3, 12: 11, 13: 1, 14: 7, 15: 4, 35: 7, 20: 5, 24: 3, 25: 8, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	1393-72-2	C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)OC2=CC=CC3=C2C4=C5C6=C(C=CC(=C6C(=O)O4)C)OC(=O)C5=C3O)O[C@@H]7[C@@H]([C@H]([C@H]([C@H](O7)C)O)OC)O)O)O.[Na]	{1: 4, 12: 10, 14: 5, 20: 4, 21: 1, 22: 3, 23: 2, 28: 2}
Did not match all atoms present	13930-31-9	CC(C)(CC1=CC=CC=C1)N(C)C(=O)CN(CCO)CC(=O)N(C)C(C)(C)CC2=CC=CC=C2.Cl	{1: 6, 2: 6, 4: 2, 33: 3, 14: 10, 17: 1, 20: 1, 24: 2}
Did not match all atoms present	13931-79-8	Cl[Sn]	{17: 1}
Did not match all atoms present	13932-13-3	[O-]S(=O)(=O)SSS(=O)(=O)[O-].[K+].[K+]	{40: 2, 29: 6}
Did not match all atoms present	13932-17-7	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[K+].[K+].[Zn+2]	{29: 8}
Did not match all atoms present	13933-31-8	N.N.N.N.O.[Cl-].[Cl-].[Pd+2]	{17: 2}
Did not match all atoms present	13933-33-0	N.N.N.N.O.[Cl-].[Cl-].[Pt+2]	{17: 2}
Did not match all atoms present	13935-44-9	C1=CC=C(C2=CC=CC2=C1)CCO	{2: 2, 20: 1, 14: 7}
Did not match all atoms present	13936-21-5	CCCCCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 4, 14: 7, 25: 2}
Did not match all atoms present	13936-29-3	CCCCCCCCCC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O	{24: 1, 1: 1, 2: 8, 27: 1, 14: 8}
Did not match all atoms present	13938-73-3	C1C2CC1C3=CC=CC=C23	{11: 2, 12: 2, 14: 4}
Did not match all atoms present	13938-94-8	[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Rh]	{17: 1, 29: 1, 14: 30}
Did not match all atoms present	13939-06-5	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mo]	{29: 6}
Did not match all atoms present	13939-41-8	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[La+3].[La+3].[W].[W].[W]	{}
Did not match all atoms present	13940-16-4	Cl[Sn](Cl)(I)I	{17: 2, 19: 2}
Did not match all atoms present	13940-22-2	[SeH]	{}
Did not match all atoms present	13940-36-8	[TeH]	{}
Did not match all atoms present	13940-38-0	OI(=O)(O)([O-])([O-])[O-].[Na+].[Na+].[Na+]	{19: 1, 20: 2, 29: 4}
Did not match all atoms present	13940-94-8	C1=CC(=CC=C1C(Cl)Cl)Cl	{17: 3, 3: 1, 14: 4}
Did not match all atoms present	139417-55-3	CC1=CC=CC2=CC(=C(C(=C12)C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 10, 4: 3, 14: 4}
Did not match all atoms present	13943-41-4	[Cl-].[Yb]	{17: 1}
Did not match all atoms present	13947-76-7	CCC(C)(C)[N+]#[C-]	{1: 3, 2: 1, 4: 1, 34: 1}
Did not match all atoms present	13949-67-2	CC(C(=O)O)OC1=CC=CC2=CC=CC=C21	{27: 1, 1: 1, 3: 1, 22: 1, 14: 7}
Did not match all atoms present	139512-70-2	C1=C(C(=CC(=C1F)Cl)N)N	{16: 1, 17: 1, 30: 2, 14: 2}
Did not match all atoms present	13954-62-6	C1=CC(=C(C=C1[N+]#N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)[N+]#N)S(=O)(=O)O.[Cl-].[Cl-]	{34: 2, 6: 2, 14: 6, 17: 2, 20: 2, 29: 4}
Did not match all atoms present	13955-12-9	CC(C)OP(=S)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]	{38: 1, 1: 3, 3: 1, 22: 3, 14: 4}
Did not match all atoms present	13956-29-1	CCCCCC1=CC(=C(C(=C1)O)C2C=C(CC[C@H]2C(=C)C)C)O	{1: 3, 2: 4, 5: 1, 7: 1, 11: 2, 12: 2, 14: 3, 15: 1, 21: 2}
Did not match all atoms present	139598-41-7	C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)[S-].[Sb+3]	{14: 20}
Did not match all atoms present	13963-35-4	CC1=CC=CC=C1SC2=CC=CC=C2	{40: 1, 1: 1, 14: 9}
Did not match all atoms present	13963-59-2	CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Fe+3]	{1: 6, 2: 6, 33: 3, 7: 3}
Did not match all atoms present	13964-88-0	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co].[Hg]	{29: 8}
Did not match all atoms present	13964-90-4	C[Sn](C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co]	{1: 3, 29: 4}
Did not match all atoms present	13965-03-2	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Cl-].[Pd+2]	{17: 2, 14: 30}
Did not match all atoms present	13965-63-4	C[C@@](CCC1=CC=CC=C1)([C@H]2CC34C=C[C@]2([C@H]5[C@@]36CCN([C@@H]4CC7=C6C(=C(C=C7)OC)O5)C)OC)O	{1: 4, 2: 2, 4: 1, 33: 1, 11: 4, 12: 3, 13: 3, 14: 9, 20: 1, 22: 2, 23: 1}
Did not match all atoms present	13965-73-6	B(B(F)F)(F)F	{16: 4}
Did not match all atoms present	13965-74-7	PS	{39: 1}
Did not match all atoms present	13965-91-8	[Cl-].[Cl-].[Cl-].[Cl-].[Pt+2]	{17: 4}
Did not match all atoms present	13966-61-5	[H-].[Cd]	{}
Did not match all atoms present	13966-62-6	[HgH]	{}
Did not match all atoms present	13966-86-4	[Cd+].[Cl-]	{17: 1}
Did not match all atoms present	13966-94-4	[In]I	{19: 1}
Did not match all atoms present	13967-01-6	[AgH]	{}
Did not match all atoms present	13967-50-5	[C-]#N.[C-]#N.[K+].[Au+]	{}
Did not match all atoms present	13967-90-3	[O-]Br(=O)=O.[O-]Br(=O)=O.[Ba+2]	{18: 2, 29: 6}
Did not match all atoms present	13968-08-6	[OH3+]	{}
Did not match all atoms present	13969-03-4	CC(C)(C)P1P(P(P1C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 4: 4}
Did not match all atoms present	1397-84-8	C=CCNC(CC/C(=C/[N+]#N)/[O-])C(=O)NC(CC/C(=C/[N+]#N)/[O-])C(=O)O	{2: 5, 3: 2, 5: 1, 6: 3, 7: 2, 34: 2, 24: 1, 27: 1, 31: 2}
Did not match all atoms present	1397-94-0	CCCCCC[C@@H]1[C@H]([C@@H](OC(=O)[C@H]([C@H](OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)OC(=O)CC(C)C	{1: 5, 2: 6, 3: 1, 12: 5, 14: 3, 21: 1, 24: 1, 26: 1, 28: 3, 31: 2}
Did not match all atoms present	13973-87-0	[N-]=[N+]=NBr	{18: 1, 34: 2}
Did not match all atoms present	13973-88-1	[N-]=[N+]=NCl	{17: 1, 34: 2}
Did not match all atoms present	13974-19-1	[O-2].[O-2].[O-2].[V].[Ag+]	{}
Did not match all atoms present	139768-71-1	C1=CC=C(C=C1)COC2=CC=C(C=C2)N=C=S	{8: 1, 2: 1, 34: 1, 22: 1, 14: 9}
Did not match all atoms present	13977-28-1	CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Br)OCC[NH+](C)C.[Cl-]	{1: 3, 2: 2, 4: 1, 14: 9, 17: 1, 18: 1, 22: 1}
Did not match all atoms present	13977-33-8	CN(CCC1=CC=CC=C1)CCC2=CC=CC=C2	{1: 1, 2: 4, 14: 10, 33: 1}
Did not match all atoms present	13977-65-6	OP(O)[O-].[K+]	{20: 2, 29: 1}
Did not match all atoms present	13978-85-3	C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Zn+2]	{35: 2, 14: 12}
Did not match all atoms present	13979-81-2	CC1=C(C=C(C=C1Br)O)Br	{1: 1, 18: 2, 21: 1, 14: 2}
Did not match all atoms present	13981-20-9	[O].[O].[O].[V-]	{}
Did not match all atoms present	13981-87-8	[H-].[Zn]	{}
Did not match all atoms present	13981-95-8	[H-].[H-].[H-].[H-].[H-].[Ta+5]	{}
Did not match all atoms present	13983-20-5	[2HH]	{}
Did not match all atoms present	13984-07-1	CN(C=CC=CC=[N+](C)C1=CC=CC=C1)C2=CC=CC=C2.[Cl-]	{1: 2, 33: 2, 14: 10, 6: 5, 17: 1}
Did not match all atoms present	13985-60-9	CCC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 3, 14: 2}
Did not match all atoms present	13986-18-0	O.O.O.O.[F-].[F-].[Zn+2]	{16: 2}
Did not match all atoms present	13986-26-0	[Zr+4].[I-].[I-].[I-].[I-]	{19: 4}
Did not match all atoms present	13988-24-4	CN(CC1COC2=CC=CC=C2O1)C(=O)N(CC=C)CC=C	{1: 1, 2: 3, 5: 2, 6: 2, 33: 2, 11: 1, 12: 1, 14: 4, 23: 2, 24: 1}
Did not match all atoms present	13988-26-6	C1COC(=O)C2=CC=CC=C2C(=O)OCCO1	{11: 4, 28: 2, 14: 4, 23: 1}
Did not match all atoms present	139883-82-2	C(CC(=O)[O-])[C@@H](C(=O)O)N.[NH4+].O	{24: 1, 27: 1, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	13989-64-5	CC(C)(C)N=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 34: 1, 4: 1, 14: 15}
Did not match all atoms present	1399-80-0	CCCCCCCCCCCCC(C)[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 4, 2: 12, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	13990-54-0	[O-]P(=O)([O-])[O-].[Y+3]	{29: 4}
Did not match all atoms present	13991-08-7	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3P(C4=CC=CC=C4)C5=CC=CC=C5	{14: 24}
Did not match all atoms present	13991-87-2	CC=CC=CC(=O)[O-].CC=CC=CC(=O)[O-].[Cu+2]	{24: 2, 1: 2, 6: 8}
Did not match all atoms present	13992-25-1	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)N=[N+]=[N-])OC(=O)C)OC(=O)C)OC(=O)C	{1: 4, 2: 1, 12: 5, 34: 2, 23: 1, 28: 4}
Did not match all atoms present	13993-65-2	CN1C2=CC=CC=C2SC3=C1C=C(C=C3)CC(=O)O	{1: 1, 2: 1, 33: 1, 41: 1, 14: 7, 27: 1}
Did not match all atoms present	139941-00-7	[F-].[Lu+2]	{16: 1}
Did not match all atoms present	139955-19-4	C1C=CC=[SiH]1	{11: 1, 14: 3}
Did not match all atoms present	13997-19-8	CCCCC1=C(C=C2C(=C1)C(=O)C(=CN2)C(=O)OC)OCC3=CC=CC=C3	{32: 1, 1: 2, 2: 4, 14: 8, 22: 1, 25: 1, 28: 1}
Did not match all atoms present	13997-70-1	C=CCOC1=CC=C(C=C1)Cl	{2: 1, 5: 1, 6: 1, 14: 4, 17: 1, 22: 1}
Did not match all atoms present	13997-73-4	C=CCC1=C(C=CC(=C1)Cl)O	{2: 1, 5: 1, 6: 1, 14: 3, 17: 1, 21: 1}
Did not match all atoms present	140-00-1	CCCCCCCCC(CCCCCCCCC(=O)OCCC)OS(=O)(=O)[O-].[Na+]	{1: 2, 2: 17, 3: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	140-01-2	C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{24: 5, 33: 3, 2: 9}
Did not match all atoms present	140-08-9	C(CCl)OP(OCCCl)OCCCl	{17: 3, 2: 6, 22: 3}
Did not match all atoms present	140-10-3	C1=CC=C(C=C1)/C=C/C(=O)O	{27: 1, 14: 5, 6: 2}
Did not match all atoms present	140-11-4	CC(=O)OCC1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	140-18-1	C1=CC=C(C=C1)COC(=O)CCl	{17: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	140-20-5	COC(CNC(=O)NC(=O)CCC(=O)O)C[Hg].O	{1: 1, 2: 4, 3: 1, 22: 1, 24: 2, 27: 1, 31: 2}
Did not match all atoms present	140-22-7	C1=CC=C(C=C1)NNC(=O)NNC2=CC=CC=C2	{24: 1, 14: 10, 31: 4}
Did not match all atoms present	140-24-9	C1=CC=C(C=C1)COC(=O)CCCCCCCCC(=O)OCC2=CC=CC=C2	{2: 10, 28: 2, 14: 10}
Did not match all atoms present	140-25-0	CCCCCCCCCCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 11, 28: 1, 14: 5}
Did not match all atoms present	140-26-1	CC(C)CC(=O)OCCC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	140-27-2	CC(C)CC(=O)OCC=CC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 6: 2, 14: 5, 28: 1}
Did not match all atoms present	140-28-3	C1=CC=C(C=C1)CNCCNCC2=CC=CC=C2	{2: 4, 14: 10, 31: 2}
Did not match all atoms present	140-29-4	C1=CC=C(C=C1)CC#N	{2: 1, 37: 1, 14: 5}
Did not match all atoms present	140-38-5	C1=CC(=CC=C1NC(=O)N)Cl	{24: 1, 17: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	140-39-6	CC1=CC=C(C=C1)OC(=O)C	{1: 2, 28: 1, 14: 4}
Did not match all atoms present	140-40-9	CC(=O)NC1=NC=C(S1)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 41: 1, 14: 1, 24: 1, 31: 1}
Did not match all atoms present	140-41-0	CN(C)C(=O)NC1=CC=C(C=C1)Cl.C(=O)(C(Cl)(Cl)Cl)O	{1: 2, 4: 1, 33: 1, 14: 4, 17: 4, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	140-49-8	CC(=O)NC1=CC=C(C=C1)C(=O)CCl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	140-50-1	CC(=O)NC1=CC=C(C=C1)NC(=O)C	{24: 2, 1: 2, 14: 4, 31: 2}
Did not match all atoms present	140-53-4	C1=CC(=CC=C1CC#N)Cl	{17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	140-56-7	CN(C)C1=CC=C(C=C1)N=NS(=O)(=O)[O-].[Na+]	{1: 2, 34: 2, 29: 3, 14: 4, 33: 1}
Did not match all atoms present	140-57-8	CC(COC1=CC=C(C=C1)C(C)(C)C)OS(=O)OCCCl	{1: 4, 2: 3, 3: 1, 4: 1, 14: 4, 17: 1, 22: 3, 29: 1}
Did not match all atoms present	140-60-3	CCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O	{1: 1, 2: 9, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	140-64-7	C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N.C(CS(=O)(=O)O)O.C(CS(=O)(=O)O)O	{2: 9, 36: 2, 7: 2, 14: 8, 20: 4, 22: 2, 29: 4, 30: 2}
Did not match all atoms present	140-65-8	CCCCOC1=CC=C(C=C1)OCCCN2CCOCC2	{1: 1, 2: 6, 33: 1, 11: 4, 14: 4, 22: 2, 23: 1}
Did not match all atoms present	140-66-9	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O	{1: 5, 2: 1, 4: 2, 21: 1, 14: 4}
Did not match all atoms present	140-67-0	COC1=CC=C(C=C1)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 4, 22: 1}
Did not match all atoms present	140-75-0	C1=CC(=CC=C1CN)F	{16: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	140-76-1	CC1=NC=C(C=C1)C=C	{1: 1, 14: 3, 35: 1, 5: 1, 6: 1}
Did not match all atoms present	140-89-6	CCOC(=S)[S-].[K+]	{1: 1, 2: 1, 22: 1, 7: 1}
Did not match all atoms present	140-90-9	CCOC(=S)[S-].[Na+]	{1: 1, 2: 1, 22: 1, 7: 1}
Did not match all atoms present	140-92-1	CC(C)OC(=S)[S-].[K+]	{1: 2, 3: 1, 22: 1, 7: 1}
Did not match all atoms present	140-93-2	CC(C)OC(=S)[S-].[Na+]	{1: 2, 3: 1, 22: 1, 7: 1}
Did not match all atoms present	140-99-8	C(CC(=O)[O-])C(=O)[O-].[Ca+2]	{24: 2, 2: 2}
Did not match all atoms present	1400-62-0	CC1=CC(=CC(=C1NC2=C(C3=C4C(=C(C(=O)C=C4OC3=CC2=O)NC5=C(C=C(C=C5C)O)O)C)C)O)O	{1: 4, 14: 6, 15: 4, 21: 4, 23: 1, 25: 2, 31: 2}
Did not match all atoms present	14000-31-8	O=P([O-])([O-])OP(=O)([O-])[O-]	{29: 6, 22: 1}
Did not match all atoms present	14001-66-2	COC1=NC=C(C=N1)Br	{1: 1, 18: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	14001-71-9	CCCCNC1=NC=C(C=N1)Br	{1: 1, 2: 3, 35: 2, 14: 2, 18: 1, 31: 1}
Did not match all atoms present	14002-51-8	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)Cl	{24: 1, 17: 1, 14: 9}
Did not match all atoms present	14003-08-8	CC#C[Ge](C)(C)C	{1: 4, 10: 2}
Did not match all atoms present	14003-16-8	CC1=CC=C(O1)CN	{1: 1, 2: 1, 30: 1, 14: 2, 23: 1}
Did not match all atoms present	14003-34-0	CC1=NC2=CC=CC=C2NC1=O	{32: 1, 1: 1, 35: 1, 14: 4, 25: 1}
Did not match all atoms present	14003-66-8	CC1=C(N=CN1)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 14: 1}
Did not match all atoms present	14007-39-7	CCC(C)C[Si](Cl)(Cl)Cl	{1: 2, 2: 2, 3: 1, 17: 3}
Did not match all atoms present	14007-64-8	CCC(C1=CC=CC=C1)C(=O)OCCN(CC)CC	{1: 3, 2: 5, 3: 1, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	14008-44-7	CS(=O)(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCC(CC4)C(=O)N	{1: 1, 2: 3, 33: 2, 41: 1, 11: 4, 12: 1, 14: 7, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	14008-53-8	C1CS(=O)(=O)CC1Br	{18: 1, 11: 3, 12: 1, 29: 2}
Did not match all atoms present	14008-79-8	CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl	{1: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 9, 17: 2, 22: 1}
Did not match all atoms present	1401-55-4	C1=C(C=C(C(=C1O)O)O)C(=O)OC2=CC(=CC(=C2O)O)C(=O)OC[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)OC(=O)C4=CC(=C(C(=C4)OC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6)OC(=O)C7=CC(=C(C(=C7)O)O)O)O)O)OC(=O)C8=CC(=C(C(=C8)OC(=O)C9=CC(=C(C(=C9)O)O)O)O)O)OC(=O)C1=CC(=C(C(=C1)OC(=O)C1=CC(=C(C(=C1)O)O)O)O)O	{2: 1, 12: 5, 14: 20, 21: 25, 23: 1, 28: 10}
Did not match all atoms present	1401-63-4	C1=CC(=O)C=CC1=C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)S	{39: 1, 7: 1, 14: 12, 15: 1, 21: 1, 25: 1}
Did not match all atoms present	1401-89-4	C[N+]1(CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@H](CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC)C	{1: 6, 11: 6, 12: 2, 14: 10, 21: 2, 22: 2, 23: 2}
Did not match all atoms present	14011-00-8	CCCCC1=CC=C(C=C1)C(C)(C)C	{1: 4, 2: 3, 4: 1, 14: 4}
Did not match all atoms present	14013-11-7	C1=CC=C(C=C1)CN2C=NC3=C2NC=NC3=O	{32: 1, 33: 1, 2: 1, 35: 2, 14: 7, 25: 1}
Did not match all atoms present	14013-71-9	[O-]Cl(=O)=O.[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Fe+3]	{17: 3, 29: 9}
Did not match all atoms present	14013-86-6	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Fe+2]	{}
Did not match all atoms present	14014-06-3	[2H][O-].[Na+]	{}
Did not match all atoms present	14014-27-8	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Nd+3].[Nd+3].[W].[W].[W]	{}
Did not match all atoms present	14017-34-6	F[Se]F	{16: 2}
Did not match all atoms present	14017-39-1	NS(=O)(=O)[O-].NS(=O)(=O)[O-].[Fe+2]	{29: 6, 30: 2}
Did not match all atoms present	14017-41-5	NS(=O)(=O)[O-].NS(=O)(=O)[O-].[Co+2]	{29: 6, 30: 2}
Did not match all atoms present	14017-46-0	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[La+3]	{17: 3, 29: 12}
Did not match all atoms present	14017-47-1	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ce+3]	{17: 3, 29: 12}
Did not match all atoms present	14017-54-0	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ho+3]	{17: 3, 29: 12}
Did not match all atoms present	14017-56-2	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Y+3]	{17: 3, 29: 12}
Did not match all atoms present	14018-82-7	[H-].[H-].[Zn+2]	{}
Did not match all atoms present	14018-95-2	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Zn+2]	{29: 6, 22: 1}
Did not match all atoms present	14019-65-9	CC(=O)OCC1=CC=CC=C1COC(=O)C	{1: 2, 2: 2, 28: 2, 14: 4}
Did not match all atoms present	14019-91-1	[O-][Se](=O)(=O)[O-].[Ca+2]	{29: 4}
Did not match all atoms present	1402-38-6	CC1C(C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C(=C(C5=N4)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)[C@@H]7CCCN7C(=O)[C@H](NC6=O)C(C)C)C)C)C(C)C)C)N)C	{32: 2, 1: 16, 3: 4, 33: 6, 11: 8, 12: 10, 14: 2, 35: 1, 23: 1, 24: 2, 25: 9, 28: 2, 30: 1, 31: 2}
Did not match all atoms present	14020-52-1	CC1=CC(=C(C(=C1)C(C)(C)CC(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)CC(C)(C)C)O	{1: 12, 2: 3, 4: 4, 21: 2, 14: 4}
Did not match all atoms present	14023-10-0	CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.Cl[Re-](Cl)(Cl)Cl.Cl[Re-](Cl)(Cl)Cl	{1: 8, 2: 24, 17: 8}
Did not match all atoms present	14023-80-4	C/C(=C/C(=O)C)/O.[C-]#[O+].[C-]#[O+].[Ir]	{1: 2, 6: 1, 7: 1, 20: 1, 24: 1, 29: 2}
Did not match all atoms present	14024-11-4	[Li+].[Al-](Cl)(Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	14024-17-0	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Fe+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	14024-34-1	Cl[Hg-2](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	14024-50-1	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Cr+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	14024-56-7	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Mg+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	14024-58-9	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Mn+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	14024-61-4	CC(=CC(=O)C)O.CC(=CC(=O)C)O.[Pd]	{24: 2, 1: 4, 20: 2, 6: 2, 7: 2}
Did not match all atoms present	14024-64-7	C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.O=[Ti]	{1: 4, 6: 2, 7: 2, 20: 2, 24: 2, 29: 1}
Did not match all atoms present	14024-75-0	C1COCCN1C(=S)[S-].C1COCCN1C(=S)[S-].[Hg+2]	{23: 2, 33: 2, 11: 8, 7: 2}
Did not match all atoms present	14027-53-3	CC#CS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 10: 2, 29: 2, 14: 4}
Did not match all atoms present	14028-44-5	C1CN(CCN1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)Cl	{32: 1, 33: 1, 35: 1, 11: 4, 14: 7, 15: 1, 17: 1, 23: 1}
Did not match all atoms present	14029-02-8	COC1=C(C=C2C(NCCC2=C1)CCO)OC	{32: 1, 1: 2, 2: 2, 11: 2, 12: 1, 14: 2, 20: 1, 22: 2}
Did not match all atoms present	1403-47-0	CC(=O)N[C@@H](CC/C(=C/[N+]#N)/[O-])C(=O)O	{1: 1, 2: 2, 3: 1, 6: 1, 7: 1, 34: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	14038-43-8	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Fe+2].[Fe+2].[Fe+3].[Fe+3].[Fe+3].[Fe+3]	{}
Did not match all atoms present	14038-85-8	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Na+].[Na+].[Ni]	{}
Did not match all atoms present	14039-23-7	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Na+].[Na+].[Na+].[Co+3]	{}
Did not match all atoms present	1404-15-5	CC1C(C(C(C(O1)OC2CC(C(C3=C2C(=C4C(=C3)C(=O)C5=C6C(=CC(=C5C4=O)O)C7(C(C(C(C(O6)O7)O)N(C)C)O)C)O)C(=O)OC)(C)O)OC)(C)OC)OC	{1: 10, 33: 1, 11: 1, 12: 10, 13: 3, 14: 2, 20: 3, 21: 2, 22: 4, 23: 3, 25: 2, 28: 1}
Did not match all atoms present	1404-64-4	CC1=C(C(=O)NC(=O)N1)/C=C/C(=O)N[C@@H](CO)CS(=O)CSC	{32: 2, 1: 2, 2: 3, 3: 1, 6: 2, 40: 1, 20: 1, 24: 1, 25: 2, 29: 1, 31: 1}
Did not match all atoms present	1404-88-2	CC(C)C[C@H]1C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@@H](C(=O)[C@@H](NC(=O)[C@@H](N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCN)C(C)C)CC3=CC=C(C=C3)O)CCC(=O)O)CC(=O)N)CC4=CC=CC=C4)CC5=CC=CC=C5)CC6=CC=CC=C6	{32: 8, 1: 4, 2: 11, 3: 2, 33: 1, 11: 3, 12: 10, 14: 19, 21: 1, 24: 1, 25: 9, 27: 1, 30: 2}
Did not match all atoms present	1404-90-6	C[C@H]1[C@H]([C@@](C[C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)[C@H]([C@H](C(=O)N[C@H](C(=O)N[C@H]5C(=O)N[C@@H]7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9[C@H](NC(=O)[C@H]([C@@H](C1=CC(=C(O4)C=C1)Cl)O)NC7=O)C(=O)O)O)O)CC(=O)N)NC(=O)[C@@H](CC(C)C)NC)O)Cl)CO)O)O)(C)N)O	{32: 5, 1: 5, 2: 3, 3: 2, 11: 1, 12: 16, 13: 1, 14: 13, 17: 2, 20: 6, 21: 3, 22: 2, 23: 4, 24: 2, 25: 5, 27: 1, 30: 2, 31: 2}
Did not match all atoms present	1404-93-9	C[C@@H]1[C@@H]([C@](C[C@H](O1)O[C@H]2[C@@H]([C@H]([C@@H](O[C@@H]2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)[C@H](C(C(=O)N[C@H](C(=O)N[C@H]5C(=O)N[C@@H]7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9[C@@H](NC(=O)[C@H]([C@@H](C1=CC(=C(O4)C=C1)Cl)O)NC7=O)C(=O)O)O)O)CC(=O)N)NC(=O)[C@@H](CC(C)C)NC)O)Cl)CO)O)O)(C)N)O.Cl	{32: 5, 1: 5, 2: 3, 3: 2, 11: 1, 12: 16, 13: 1, 14: 13, 17: 3, 20: 6, 21: 3, 22: 2, 23: 4, 24: 2, 25: 5, 27: 1, 30: 2, 31: 2}
Did not match all atoms present	140401-00-9	CCCCCCCCCCCCSCCC(=O)OC1=C(C=C(C(=C1)C)SC2=CC(=C(C=C2C)OC(=O)CCSCCCCCCCCCCCC)C(C)(C)C)C(C)(C)C	{1: 10, 2: 26, 4: 2, 40: 3, 14: 4, 28: 2}
Did not match all atoms present	14041-22-6	O=[Si](F)F	{16: 2, 29: 1}
Did not match all atoms present	14044-65-6	[B].C1CCOC1	{11: 4, 23: 1}
Did not match all atoms present	14044-97-4	[SiH3]S	{39: 1}
Did not match all atoms present	140448-30-2	CONC(=O)CN1C=CN=C1[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 14: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	140448-34-6	CONC(=O)CCCN1C=CN=C1[N+](=O)[O-]	{1: 1, 2: 3, 35: 1, 38: 1, 33: 1, 14: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	140456-78-6	[NH4+].[N-]([N+](=O)[O-])[N+](=O)[O-]	{34: 1, 38: 2}
Did not match all atoms present	14046-99-2	CCC[N+]12[C@H]3CC([C@@H]([C@H]1O)CC)C4[C@@H]2CC5([C@H]3N(C6=CC=CC=C65)C)[C@@H]4O.[Br-]	{1: 3, 2: 3, 33: 1, 11: 2, 12: 8, 13: 1, 14: 4, 18: 1, 20: 2}
Did not match all atoms present	140460-96-4	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C(C4=N3)[C@H]6[C@H](O6)[C@H]([C@@H]5O)O	{20: 2, 35: 1, 12: 4, 14: 9, 23: 1}
Did not match all atoms present	140460-97-5	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C(C4=N3)[C@H]6[C@H](O6)[C@@H]([C@H]5O)O	{20: 2, 35: 1, 12: 4, 14: 9, 23: 1}
Did not match all atoms present	140460-98-6	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C(C4=N3)[C@@H]6[C@@H](O6)[C@@H]([C@H]5O)O	{20: 2, 35: 1, 12: 4, 14: 9, 23: 1}
Did not match all atoms present	140461-57-0	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C(C4=N3)[C@@H]6[C@@H](O6)[C@H]([C@@H]5O)O	{20: 2, 35: 1, 12: 4, 14: 9, 23: 1}
Did not match all atoms present	14047-09-7	C1=CC(=C(C=C1N=NC2=CC(=C(C=C2)Cl)Cl)Cl)Cl	{17: 4, 34: 2, 14: 6}
Did not match all atoms present	14047-29-1	B(C1=CC=C(C=C1)C(=O)O)(O)O	{27: 1, 20: 2, 14: 4}
Did not match all atoms present	14047-60-0	CCCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 7}
Did not match all atoms present	14049-36-6	F[Si](F)(F)Cl	{16: 3, 17: 1}
Did not match all atoms present	14049-39-9	F[Si](F)(F)Br	{16: 3, 18: 1}
Did not match all atoms present	14049-79-7	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Co+3].[Co+3].[Co+3].[Zn+2].[Zn+2]	{}
Did not match all atoms present	1405-20-5	CCC(C)CCCCC(=O)NC(CCN)C(=O)NC(C(C)O)C(=O)NC(CCN)C(=O)NC1CCNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CCN)CC2=CC=CC=C2)CC(C)C)CCN)CCN)C(C)O	{32: 7, 1: 6, 2: 17, 3: 7, 11: 2, 12: 7, 14: 5, 20: 2, 24: 4, 25: 7, 30: 5, 31: 4}
Did not match all atoms present	1405-36-3	C1CN=C(NC1C2C(=O)NCC(C(=O)NC(C(=O)NC(C(=O)N/C(=C\NC(=O)N)/C(=O)N2)CNC(=O)CC(CCCN)N)CO)N)N.OS(=O)(=O)O.OS(=O)(=O)O	{32: 6, 2: 6, 3: 1, 6: 1, 11: 3, 12: 5, 15: 2, 35: 1, 20: 5, 24: 2, 25: 5, 29: 4, 30: 5, 31: 2}
Did not match all atoms present	1405-46-5	CC1=C(C(=CC=C1)O)C(=O)OCC2(C(C(C(C2(C)O)(C(C)O)NC(=O)N(C)C)N)NC3=CC=CC(=C3)C(=O)C)O	{1: 6, 2: 1, 3: 1, 33: 1, 12: 2, 13: 3, 14: 7, 20: 3, 21: 1, 24: 2, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	1405-97-6	C[C@@H](C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC5=CNC6=CC=CC=C65)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC7=CNC8=CC=CC=C87)C(=O)NCCO)NC(=O)CNC(=O)[C@H](C(C)C)NC=O	{32: 4, 1: 18, 2: 11, 3: 22, 14: 20, 20: 1, 24: 15, 26: 1, 31: 16}
Did not match all atoms present	14051-46-8	C1CNCCC1=C2C3=CC=CC=C3C=CC4=CC=CC=C42	{32: 1, 11: 4, 14: 10, 15: 2}
Did not match all atoms present	14054-89-8	C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.[Gd]	{2: 3, 4: 3, 41: 3, 14: 9, 16: 9, 24: 6}
Did not match all atoms present	14054-92-3	C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.[Sm]	{2: 3, 4: 3, 41: 3, 14: 9, 16: 9, 24: 6}
Did not match all atoms present	14054-93-4	C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F.[Tb]	{2: 3, 4: 3, 41: 3, 14: 9, 16: 9, 24: 6}
Did not match all atoms present	14055-74-4	[Mo](I)I	{19: 2}
Did not match all atoms present	14055-76-6	[Mo](I)(I)(I)I	{19: 4}
Did not match all atoms present	14056-64-5	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)SC)CN(C)C.Cl	{1: 4, 2: 2, 3: 1, 33: 2, 40: 1, 41: 1, 14: 7, 17: 1}
Did not match all atoms present	14056-88-3	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Cl-].[Pt+2]	{17: 2, 14: 30}
Did not match all atoms present	1406-11-7	C[C@H]([C@H]1C(=O)NCC[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCN)CCN)CC(C)C)CC2=CC=CC=C2)CCN)NC(=O)[C@H](CCN)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCN)NC(=O)O)O	{32: 7, 1: 4, 2: 12, 3: 6, 11: 2, 12: 7, 14: 5, 20: 2, 24: 3, 25: 7, 27: 1, 30: 5, 31: 4}
Did not match all atoms present	1406-65-1	CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C4[N-]3)C5=NC(=CC6=NC(=C2)C(=C6C)C=C)C(C5CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C(=O)OC)[O-])C)C.[Mg+2]	{1: 11, 2: 13, 3: 3, 5: 1, 6: 2, 7: 1, 12: 3, 14: 3, 15: 12, 35: 4, 28: 2}
Did not match all atoms present	14062-18-1	CCOC(=O)CC1=CC=C(C=C1)OC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	14062-19-2	CCOC(=O)CC1=CC=C(C=C1)C	{1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	14062-34-1	C1=CC(=CC(=C1)N)C(=O)NN	{24: 1, 30: 2, 14: 4, 31: 1}
Did not match all atoms present	14062-78-3	CC1=CC=C(C=C1)C(=O)N(C)C	{24: 1, 1: 3, 14: 4, 33: 1}
Did not match all atoms present	14062-80-7	CN(C)C(=O)C1=CC=C(C=C1)Cl	{24: 1, 1: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	140637-82-7	C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)COC(=O)CCN)O)F)O)O.Cl	{1: 2, 2: 3, 11: 2, 12: 6, 13: 1, 14: 3, 16: 1, 17: 1, 20: 3, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 28: 1, 30: 1}
Did not match all atoms present	14064-03-0	CCOCC[O-].CCOCC[O-].[Mg+2]	{1: 2, 2: 6, 29: 2, 22: 2}
Did not match all atoms present	14064-15-4	C[Sn](C)(C)C1=CC=C(C=C1)Cl	{1: 3, 14: 4, 17: 1}
Did not match all atoms present	14064-21-2	CN(C)/N=C/C1=CC=CO1	{1: 2, 34: 1, 6: 1, 33: 1, 14: 3, 23: 1}
Did not match all atoms present	14064-55-2	C1=CC(=CC=C1C=CC2=CC=C(C=C2)Cl)[N+](=O)[O-]	{17: 1, 38: 1, 14: 8, 6: 2}
Did not match all atoms present	14064-58-5	COC1=CC=CC(=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 22: 1, 38: 1, 14: 8, 6: 2}
Did not match all atoms present	14064-82-5	C1=CC=C(C=C1)/C=C/C2=CC(=CC=C2)N	{30: 1, 14: 9, 6: 2}
Did not match all atoms present	14064-83-6	C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)O)[N+](=O)[O-]	{38: 1, 14: 8, 6: 2, 21: 1}
Did not match all atoms present	14066-19-4	O=P([O-])([O-])O	{20: 1, 29: 3}
Did not match all atoms present	14066-20-7	O=P([O-])(O)O	{20: 2, 29: 2}
Did not match all atoms present	14066-61-6	C1=CC=C(C(=C1)C(=O)O)[Hg].O	{27: 1, 14: 4}
Did not match all atoms present	14067-04-0	[Ti+]	{}
Did not match all atoms present	14068-53-2	CCC1=NN=C(S1)N	{1: 1, 2: 1, 35: 2, 30: 1, 41: 1}
Did not match all atoms present	140681-55-6	[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1C[N+]2(CC[N+]1(CC2)CCl)F	{16: 9, 17: 1, 2: 1, 11: 6}
Did not match all atoms present	140681-69-2	[B-](F)(F)(F)F.C1C[N+]2(CCN1CC2)CCl	{16: 4, 17: 1, 2: 1, 11: 6, 33: 1}
Did not match all atoms present	14069-89-7	CCC(C)[N+]#[C-]	{1: 2, 2: 1, 3: 1, 34: 1}
Did not match all atoms present	140690-56-8	C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CBr	{16: 6, 2: 1, 4: 2, 18: 1, 14: 3}
Did not match all atoms present	140695-21-2	CNCC1=CC=C(O1)CSCCNC(=NCC(C2=CC=C(C=C2)O)O)NS(=O)(=O)C	{1: 2, 2: 5, 3: 1, 7: 1, 40: 1, 34: 1, 14: 6, 20: 1, 21: 1, 23: 1, 29: 2, 31: 3}
Did not match all atoms present	1407-03-0	C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O)C)(C)C(=O)O.N	{1: 7, 11: 9, 12: 14, 13: 6, 14: 1, 15: 1, 20: 5, 22: 2, 23: 2, 25: 1, 27: 3}
Did not match all atoms present	14070-49-6	CCCCCC(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2	{32: 1, 1: 1, 2: 4, 35: 2, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	14073-00-8	CC1=C(C2=CC=CC=C2[N+](=C1)[O-])[N+](=O)[O-]	{1: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	14074-80-7	C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9)N3.[Zn]	{32: 2, 35: 2, 14: 28}
Did not match all atoms present	14075-02-6	C[N+]1(CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O)C.[Cl-]	{1: 2, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	14075-53-7	[B-](F)(F)(F)F.[K+]	{16: 4}
Did not match all atoms present	14076-05-2	C1=CC2=C(C=C1Cl)C(=NO)C=CN2O	{33: 1, 34: 1, 14: 5, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	14076-19-8	C1=CC2=[N+](C=CC(=C2C(=C1)Cl)[N+](=O)[O-])[O-]	{17: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	14077-39-5	[F-].[F-].[Eu+2]	{16: 2}
Did not match all atoms present	14088-57-4	C/C(=C(\C1=CC=CC=C1)/[O-])/[N+]#N	{1: 1, 34: 1, 14: 5, 7: 2}
Did not match all atoms present	14088-58-5	C/C(=C(\C)/[O-])/[N+]#N	{1: 2, 34: 1, 7: 2}
Did not match all atoms present	14088-71-2	C1CC1C(C2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Cl)O	{4: 1, 11: 2, 12: 1, 14: 8, 17: 2, 20: 1}
Did not match all atoms present	14089-43-1	CO/C(=N/S(=O)(=O)C1=CC=C(C=C1)N)/[O-].[K+]	{1: 1, 34: 1, 7: 1, 14: 4, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	14090-22-3	B(CCCC)(Cl)Cl	{1: 1, 2: 3, 17: 2}
Did not match all atoms present	14090-77-8	C1=CC=C(C=C1)/C(=N\O)/C(=O)C2=CC=CC=C2	{24: 1, 34: 1, 20: 1, 14: 10, 7: 1}
Did not match all atoms present	14090-83-6	COC(=O)CS(=O)C1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 29: 1, 14: 5}
Did not match all atoms present	14091-15-7	C1=CC(=CC=C1CC(C(=O)O)N)Br	{2: 1, 3: 1, 14: 4, 18: 1, 27: 1, 30: 1}
Did not match all atoms present	14091-93-1	C/C(=C\C(=O)C1=CC=CC=C1)/NC	{1: 2, 6: 1, 7: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	14094-08-7	CCCS(=O)C	{1: 2, 2: 2, 29: 1}
Did not match all atoms present	14094-09-8	CC(C)S(=O)C	{1: 3, 3: 1, 29: 1}
Did not match all atoms present	14094-11-2	CC(C)(C)S(=O)C	{1: 4, 4: 1, 29: 1}
Did not match all atoms present	14094-12-3	CC(C)(C)S(=O)(=O)C	{1: 4, 4: 1, 29: 2}
Did not match all atoms present	14094-45-2	CC1=CC=CC2=C(C=C[N+](=C12)[O-])[N+](=O)[O-]	{1: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	14096-51-6	C(C[NH-])[NH-].Cl[Pt+2]Cl	{17: 2, 2: 2, 36: 2}
Did not match all atoms present	14097-03-1	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 4, 2: 3, 38: 1, 33: 1, 34: 2, 14: 7, 17: 1}
Did not match all atoms present	14097-20-2	N1=P(N=P(N=P(N=P(N=P(N=P(N=P(N=P1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 16, 35: 8}
Did not match all atoms present	14098-41-0	C1COCCOC2=CC=CC=C2OCCOCCOC3=CC=CC=C3OCCO1	{11: 10, 14: 8, 23: 7}
Did not match all atoms present	14098-44-3	C1COCCOC2=CC=CC=C2OCCOCCO1	{11: 8, 14: 4, 23: 5}
Did not match all atoms present	14099-01-5	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].Cl[Re]	{17: 1, 29: 5}
Did not match all atoms present	14099-62-8	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-](=O)C(F)(F)F.[Mn]	{16: 3, 4: 1, 29: 6}
Did not match all atoms present	141-00-4	C(CC(=O)[O-])C(=O)[O-].[Cd+2]	{24: 2, 2: 2}
Did not match all atoms present	141-01-5	C(=CC(=O)[O-])C(=O)[O-].[Fe+2]	{24: 2, 6: 2}
Did not match all atoms present	141-30-0	C1=CC(=NN=C1Cl)Cl	{17: 2, 35: 2, 14: 2}
Did not match all atoms present	141-51-5	C(I)[Hg]I	{2: 1, 19: 2}
Did not match all atoms present	141-52-6	CC[O-].[Na+]	{1: 1, 2: 1, 29: 1}
Did not match all atoms present	141-53-7	C(=O)[O-].[Na+]	{26: 1}
Did not match all atoms present	141-57-1	CCC[Si](Cl)(Cl)Cl	{1: 1, 2: 2, 17: 3}
Did not match all atoms present	141-62-8	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 10, 22: 3}
Did not match all atoms present	141-63-9	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 12, 22: 4}
Did not match all atoms present	141-65-1	CCCCC(CC)COP(=O)([O-])OCC(CC)CCCC.[Na+]	{1: 4, 2: 10, 3: 2, 29: 2, 22: 2}
Did not match all atoms present	141-66-2	C/C(=C\C(=O)N(C)C)/OP(=O)(OC)OC	{1: 5, 33: 1, 6: 1, 7: 1, 22: 3, 24: 1, 29: 1}
Did not match all atoms present	141-84-4	C1C(=O)NC(=S)S1	{32: 1, 25: 1, 11: 1, 41: 1, 15: 1}
Did not match all atoms present	141-85-5	C1=CC(=CC(=C1)Cl)N.Cl	{17: 2, 30: 1, 14: 4}
Did not match all atoms present	141-86-6	C1=CC(=NC(=C1)N)N	{35: 1, 30: 2, 14: 3}
Did not match all atoms present	141-90-2	C1=CNC(=S)NC1=O	{32: 2, 25: 1, 14: 2}
Did not match all atoms present	141-93-5	CCC1=CC(=CC=C1)CC	{1: 2, 2: 2, 14: 4}
Did not match all atoms present	141-95-7	C(C(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 2: 1}
Did not match all atoms present	14100-52-8	C1=CC=C2C(=C1)C(=C(C=[N+]2[O-])Cl)[N+](=O)[O-]	{17: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	14100-64-2	[O-][V](=O)([O-])O[V](=O)([O-])[O-].[Ca+2].[Ca+2]	{29: 6, 22: 1}
Did not match all atoms present	14100-65-3	O=B[O-]	{29: 2}
Did not match all atoms present	14101-95-2	CC(C)[Sn](C(C)C)(C(C)C)Cl	{1: 6, 3: 3, 17: 1}
Did not match all atoms present	14102-45-5	O=[AsH]([O-])O	{20: 1, 29: 2}
Did not match all atoms present	14104-20-2	[B-](F)(F)(F)F.[Ag+]	{16: 4}
Did not match all atoms present	14104-45-1	[1H]I	{19: 1}
Did not match all atoms present	14107-97-2	CC1=C(C=C(C=C1OC)OC)OC	{1: 4, 22: 3, 14: 2}
Did not match all atoms present	14108-88-4	CC1=C2CCCCC2=C(C=C1)C	{1: 2, 11: 4, 14: 2}
Did not match all atoms present	141091-72-7	CC(=C)C(=O)[O-].CC(=C)C(=O)OC.CC(=C)C(=O)OCCS(=O)(=O)[O-].[Na+].[K+]	{1: 4, 2: 2, 5: 3, 7: 3, 24: 1, 28: 2, 29: 3}
Did not match all atoms present	14110-97-5	C1=CC(=CC=C1S(=O)(=O)[O-])[Hg]Cl.[Na+]	{17: 1, 29: 3, 14: 4}
Did not match all atoms present	141106-52-7	C1=CC(=C(C=C1F)F)N=C=S	{8: 1, 16: 2, 34: 1, 14: 3}
Did not match all atoms present	14114-05-7	C1CC1[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{18: 1, 11: 2, 12: 1, 14: 15}
Did not match all atoms present	14117-96-5	CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 28: 2, 14: 4}
Did not match all atoms present	141179-72-8	C1=CC(=C(C=C1F)C(F)(F)F)C(=O)O	{16: 4, 27: 1, 4: 1, 14: 3}
Did not match all atoms present	14118-16-2	C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5	{33: 2, 14: 24}
Did not match all atoms present	14118-40-2	C(#N)P(F)F	{16: 2, 37: 1}
Did not match all atoms present	141206-73-7	[C-]#[N+]C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{16: 6, 34: 1, 4: 2, 14: 3}
Did not match all atoms present	14121-36-9	C1=C(C(=C(N=C1Cl)Cl)Cl)Cl	{17: 4, 35: 1, 14: 1}
Did not match all atoms present	14122-00-0	CC1=C(C=C(C=C1O)Br)Br	{1: 1, 18: 2, 21: 1, 14: 2}
Did not match all atoms present	141227-99-8	C1=NC(=C(C(=N1)N2C(=NC(=N2)[N+](=O)[O-])N)[N+](=O)[O-])N3C(=NC(=N3)[N+](=O)[O-])N	{38: 3, 33: 2, 35: 6, 30: 2, 14: 1}
Did not match all atoms present	14123-60-5	CC(=O)CC1=CC(=CC=C1)Cl	{24: 1, 1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	14124-47-1	CCN1C(=CC=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 2, 6: 3, 33: 2, 14: 16, 15: 1, 29: 3}
Did not match all atoms present	14124-67-5	O=[Se]([O-])[O-]	{29: 3}
Did not match all atoms present	14124-68-6	O=[Se](=O)([O-])[O-]	{29: 4}
Did not match all atoms present	14126-37-5	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni+2].[Br-].[Br-]	{18: 2, 14: 30}
Did not match all atoms present	14126-40-0	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Co]Cl	{17: 2, 14: 30}
Did not match all atoms present	14126-89-7	C1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F.C1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F.[Cu]	{16: 6, 24: 4, 2: 2, 4: 2, 14: 10}
Did not match all atoms present	14127-61-8	[Ca+2]	{}
Did not match all atoms present	14127-68-5	O=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-]	{29: 8, 22: 2}
Did not match all atoms present	14127-70-9	[Br-].[Br-].[Br-].[Br-].[Pd+2]	{18: 4}
Did not match all atoms present	141274-57-9	CCCN(CCC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CCC)CCC)C=C2)C3=CC=C(C=C3)N(CCC)CCC.O[Si](=O)[O-].O[Mo](=O)(=O)O[Mo](=O)(=O)[O-]	{1: 6, 2: 12, 33: 3, 7: 1, 14: 12, 15: 2, 20: 2, 22: 1, 29: 7}
Did not match all atoms present	141274-60-4	[Li+].[Li+].C1=CC(=C(C=C1S(=O)(=O)[O-])C(=O)O)[O-]	{27: 1, 29: 3, 14: 3}
Did not match all atoms present	14128-54-2	[2H][Al-]([2H])([2H])[2H].[Li+]	{}
Did not match all atoms present	14128-84-8	CC(=O)/C=C(\[O-])/C1=CC=CC=C1.CC(=O)/C=C(\[O-])/C1=CC=CC=C1.[Cu+2]	{24: 2, 1: 2, 14: 10, 6: 2, 7: 2}
Did not match all atoms present	14128-86-0	CC(=O)CC(=O)C1=CC=CC=C1.CC(=O)CC(=O)C1=CC=CC=C1.[Mn]	{24: 4, 1: 2, 2: 2, 14: 10}
Did not match all atoms present	14128-95-1	CC(=O)/C=C(\[O-])/C1=CC=CC=C1.CC(=O)/C=C(\[O-])/C1=CC=CC=C1.[Co+2]	{24: 2, 1: 2, 14: 10, 6: 2, 7: 2}
Did not match all atoms present	14129-98-7	C1COCCN1P(=S)(N2CCOCC2)N3CCOCC3	{33: 3, 11: 12, 23: 3}
Did not match all atoms present	141300-30-3	C1=CC(=CC=C1N2C=NN3C2=NC4=C(C3=O)C=NN4)Br	{32: 1, 33: 2, 35: 3, 14: 6, 18: 1, 25: 1}
Did not match all atoms present	141318-28-7	CCCCCCCCCCCCC/C=C/C=C/C(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4	{1: 4, 2: 26, 4: 1, 6: 8, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2, 27: 2}
Did not match all atoms present	14133-07-4	CCSC1=NC=NC2=C1N=CN2CO	{1: 1, 2: 2, 35: 3, 33: 1, 40: 1, 14: 2, 20: 1}
Did not match all atoms present	141363-21-5	CN1C(=CN=C1/C=C/2\CCC3=CC=CC=C32)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 6: 1, 33: 1, 11: 2, 14: 5, 15: 1}
Did not match all atoms present	141363-22-6	CN1C(=CN=C1/C=C\2/CCCC3=CC=CC=C32)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 6: 1, 33: 1, 11: 3, 14: 5, 15: 1}
Did not match all atoms present	141363-23-7	C/C(=C\C1=NC=C(N1C)[N+](=O)[O-])/CO	{1: 2, 2: 1, 35: 1, 33: 1, 6: 1, 7: 1, 14: 1, 20: 1, 38: 1}
Did not match all atoms present	141363-24-8	CC(=CC1=NC=C(N1CCN2CCOCC2)[N+](=O)[O-])C	{1: 2, 2: 2, 35: 1, 33: 2, 6: 1, 7: 1, 11: 4, 14: 1, 23: 1, 38: 1}
Did not match all atoms present	141363-26-0	CN1C(=CN=C1/C=C\2/CCCS2(=O)=O)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 6: 1, 33: 1, 11: 3, 14: 1, 15: 1, 29: 2}
Did not match all atoms present	1414-45-5	CCC(C)C1C(=O)NC(=C)C(=O)NC(C(=O)NC(CSCC(C(=O)N1)NC(=O)/C(=C/C)/NC(=O)C(C(C)CC)N)C(=O)NC2C(SCC(NC(=O)CNC(=O)C3CCCN3C2=O)C(=O)NC(CCCCN)C(=O)NC4C(SCC(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC4=O)C)CC(C)C)CCSC)C(=O)NC(CC(=O)N)C(=O)NC(CCSC)C(=O)NC(CCCCN)C(=O)NC5C(SCC6C(=O)NC(C(=O)NC(CSC(C(C(=O)N6)NC(=O)C(NC5=O)C)C)C(=O)NC(CO)C(=O)NC(C(C)CC)C(=O)NC(CC7=CN=CN7)C(=O)NC(C(C)C)C(=O)NC(=C)C(=O)NC(CCCCN)C(=O)O)CC8=CN=CN8)C)C)C)CC(C)C	{32: 19, 1: 21, 2: 25, 3: 16, 5: 2, 6: 1, 7: 2, 40: 2, 41: 5, 11: 12, 12: 22, 14: 4, 15: 1, 35: 2, 20: 1, 24: 16, 25: 18, 33: 1, 27: 1, 30: 5, 31: 15}
Did not match all atoms present	14142-16-6	CC1CCCCN1C2=CC=CC=C2	{1: 1, 11: 4, 12: 1, 14: 5, 33: 1}
Did not match all atoms present	14143-25-0	CC1=C(C=CC(=C1)O)N(C)C	{1: 3, 21: 1, 14: 3, 33: 1}
Did not match all atoms present	14143-55-6	COC(=O)C1=NC(=C(C(=C1Cl)N)Cl)Cl	{1: 1, 35: 1, 28: 1, 30: 1, 17: 3}
Did not match all atoms present	14143-60-3	C(#N)C1=C(C(=C(C(=N1)Cl)Cl)N)Cl	{17: 3, 35: 1, 37: 1, 30: 1}
Did not match all atoms present	14147-38-7	C1=CC=C2C=C3C4=CC=CC5=C4C(=CC3=CC2=C1)C6=CC=CC7=C6C5=CC=C7	{14: 16}
Did not match all atoms present	141478-68-4	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Tm+3]	{16: 9, 4: 3, 29: 9}
Did not match all atoms present	14148-99-3	C[NH+](C)[C@H](CC1=CC=CC=C1)C2=CC=CC=C2.[Cl-]	{1: 2, 2: 1, 3: 1, 14: 10, 17: 1}
Did not match all atoms present	141483-15-0	C1=CC(=C(C=C1C(F)(F)F)O)F	{16: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	14149-58-7	[2H]OB(O[2H])O[2H]	{20: 3}
Did not match all atoms present	14150-95-9	C1=CC(=N)N(C=C1)O	{33: 1, 36: 1, 21: 1, 14: 4}
Did not match all atoms present	141511-29-7	C1CCC2=C(C1)C=CC3=C2CCC4=C3C=CC(=C4)[N+](=O)[O-]	{11: 6, 38: 1, 14: 5}
Did not match all atoms present	14154-09-7	OP(=O)(O)O.OP(=O)(O)O.[Mn+2].[Mn+2].[Mn+2]	{20: 6, 29: 2}
Did not match all atoms present	14155-77-2	C=CC[Hg]Cl	{17: 1, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	141556-45-8	CC1=CC(=C(C(=C1)C)N2C=C[N+](=C2)C3=C(C=C(C=C3C)C)C)C.[Cl-]	{1: 6, 33: 2, 14: 7, 17: 1}
Did not match all atoms present	141557-57-5	[Li+].C1=CC(=CC=C1N=NC2=CC(=C(C=C2)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC5=NC(=NC(=N5)F)NCCS(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[K+]	{2: 2, 35: 3, 34: 3, 14: 11, 15: 2, 16: 1, 25: 1, 29: 12, 31: 3}
Did not match all atoms present	14159-48-9	CC(C)S(=O)(=O)O	{1: 2, 3: 1, 20: 1, 29: 2}
Did not match all atoms present	14159-61-6	CC(C)CC1=CN=CC=C1	{1: 2, 2: 1, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	14160-93-1	C1=NC(=C(C(=N1)Cl)C=O)N	{17: 1, 26: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	141606-44-2	C1C2=CC=CC=C2C3=C(C=CC=C31)C#N	{11: 1, 37: 1, 14: 7}
Did not match all atoms present	141607-49-0	CC1=C(C=CC(=C1)[N+]#N)N2CCCC2.CC1=C(C=CC(=C1)[N+]#N)N2CCCC2.Cl[Zn-2](Cl)(Cl)Cl	{1: 2, 34: 2, 33: 2, 11: 8, 14: 6, 17: 4}
Did not match all atoms present	14161-72-9	CC1(CC1C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 11: 1, 12: 1, 13: 1, 14: 10}
Did not match all atoms present	141657-27-4	CN1C=CN=C1C2=CN(C(=N2)[N+](=O)[O-])C	{1: 2, 35: 2, 38: 1, 14: 3, 33: 2}
Did not match all atoms present	14166-78-0	O.O.O.[F-].[F-].[F-].[In+3]	{16: 3}
Did not match all atoms present	141665-16-9	CC(C)(C)C1=NN(C=C1)C	{1: 4, 35: 1, 4: 1, 14: 2, 33: 1}
Did not match all atoms present	141665-17-0	CC(C)(C)C1=CC=NN1C	{1: 4, 35: 1, 4: 1, 14: 2, 33: 1}
Did not match all atoms present	141665-18-1	CC(C)(C)C1=CC(=NN1C)C(C)(C)C	{1: 7, 35: 1, 4: 2, 14: 1, 33: 1}
Did not match all atoms present	141665-20-5	CC1=C(N(N=C1C(C)(C)C)C)C(C)(C)C	{1: 8, 35: 1, 4: 2, 33: 1}
Did not match all atoms present	141665-22-7	CCC1=CC(=NN1)C2=CC=CC=C2	{32: 1, 1: 1, 2: 1, 35: 1, 14: 6}
Did not match all atoms present	14167-15-8	C1=C/C(=C/NCCN/C=C/2\C(=O)C=CC=C2)/C(=O)C=C1.[Cu]	{2: 2, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
Did not match all atoms present	14167-18-1	C1=CC=C(C(=C1)C=NCCN=CC2=CC=CC=C2[O-])[O-].[Co+2]	{2: 2, 34: 2, 14: 8, 6: 2}
Did not match all atoms present	14167-20-5	C1=C/C(=C/NCCN/C=C/2\C(=O)C=CC=C2)/C(=O)C=C1.[Ni]	{2: 2, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
Did not match all atoms present	14168-73-1	O.[O-]S(=O)(=O)[O-].[Mg+2]	{29: 4}
Did not match all atoms present	14172-90-8	C1=CC=C(C=C1)C2C3C=CC(N3)C(C4=CC=C([N-]4)C(C5C=CC(N5)C(C6=CC=C2[N-]6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9.[Co+2]	{32: 2, 35: 2, 12: 8, 14: 28}
Did not match all atoms present	14172-92-0	C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)[N-]3.[Ni+2]	{35: 4, 14: 28}
Did not match all atoms present	14173-25-2	CSSC1=CC=CC=C1	{40: 2, 1: 1, 14: 5}
Did not match all atoms present	14173-39-8	C1=CC(=CC=C1C[C@@H](C(=O)O)N)Cl	{2: 1, 3: 1, 14: 4, 17: 1, 27: 1, 30: 1}
Did not match all atoms present	14173-58-1	C1=CC=C2C(=C1)C(=C(C=[N+]2[O-])Br)[N+](=O)[O-]	{33: 1, 18: 1, 38: 1, 29: 1, 14: 5}
Did not match all atoms present	14174-08-4	C1COCCOC2=CC=CC=C2OCCO1	{11: 6, 14: 4, 23: 4}
Did not match all atoms present	14174-09-5	C1COCCOC2=CC=CC=C2OCCOCCOCCOC3=CC=CC=C3OCCO1	{11: 12, 14: 8, 23: 8}
Did not match all atoms present	14175-03-2	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Sm+3].[Sm+3]	{24: 6}
Did not match all atoms present	14176-49-9	CCNC1(CCCCC1=O)C2=CC=CS2	{1: 1, 2: 1, 41: 1, 11: 4, 13: 1, 14: 3, 25: 1, 31: 1}
Did not match all atoms present	14176-81-9	[Ag].[Ag].[Ag].[Sb]	{}
Did not match all atoms present	14177-51-6	[O-][W](=O)(=O)[O-].[Ni+2]	{29: 4}
Did not match all atoms present	14177-55-0	[O-][Mo](=O)(=O)[O-].[Ni+2]	{29: 4}
Did not match all atoms present	14177-95-8	CCO[P+](OCC)([S-])[S-].CCO[P+](OCC)([S-])[S-].CCO[P+](OCC)([S-])[S-].[Cr+6]	{1: 6, 2: 6, 22: 6}
Did not match all atoms present	141776-91-2	C1=C(C=C(C=C1F)F)CBr	{16: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	14178-15-5	C1=CC=C(C=C1)OC2=C(C=CC=N2)C#N	{35: 1, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	141782-32-3	CC1C(O1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 12: 2, 14: 4, 23: 1, 28: 1}
Did not match all atoms present	14180-51-9	COC1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=C(C=C3)OC	{1: 2, 22: 2, 14: 13}
Did not match all atoms present	14180-63-3	C=CCS(=O)CC=C	{2: 2, 5: 2, 6: 2, 29: 1}
Did not match all atoms present	141807-57-0	CN1C2CCC1[C@H]([C@H](C2)C3=CC=C(C=C3)Cl)C(=O)OC4=CC=CC=C4.Cl	{1: 1, 33: 1, 11: 3, 12: 4, 14: 9, 17: 2, 28: 1}
Did not match all atoms present	14186-60-8	CC1=C(C=CC(=C1)C(=O)OC)C(=O)OC	{1: 3, 28: 2, 14: 3}
Did not match all atoms present	14187-31-6	CCN1C(=CC=CC=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41.[I-]	{1: 2, 2: 2, 6: 5, 33: 2, 14: 12, 15: 1, 19: 1}
Did not match all atoms present	14187-32-7	C1COC2=CC=CC=C2OCCOCCOC3=CC=CC=C3OCCO1	{11: 8, 14: 8, 23: 6}
Did not match all atoms present	14188-79-5	CCCCCCCCCCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 9, 14: 7}
Did not match all atoms present	14188-94-4	CC(=O)C1=C[N+](=CC=C1)[O-]	{24: 1, 1: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	14191-22-1	C1=CC=C2C(=C1)C3=C(N2)C=C(C=C3)[N+](=O)[O-]	{32: 1, 38: 1, 14: 7}
Did not match all atoms present	14191-95-8	C1=CC(=CC=C1CC#N)O	{2: 1, 21: 1, 14: 4, 37: 1}
Did not match all atoms present	141942-51-0	C1COC(C1(Cl)Cl)OC=O	{11: 2, 12: 1, 13: 1, 17: 2, 23: 1, 26: 1}
Did not match all atoms present	141942-53-2	C1CC(C(OC1)OC=O)(Cl)Cl	{11: 3, 12: 1, 13: 1, 17: 2, 23: 1, 26: 1}
Did not match all atoms present	141968-97-0	CCCCN1C(=C(N(P1OCC)CCCC)C)C	{1: 5, 2: 7, 33: 2, 22: 1, 15: 2}
Did not match all atoms present	141968-98-1	CCCCN1C(=C(N(P1N(CC)CC)CCCC)C)C	{1: 6, 2: 8, 33: 3, 15: 2}
Did not match all atoms present	141968-99-2	CCCCN1C(=C(N(P1Cl)CCCC)C)C	{1: 4, 2: 6, 17: 1, 33: 2, 15: 2}
Did not match all atoms present	14199-15-6	COC(=O)CC1=CC=C(C=C1)O	{1: 1, 2: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	14199-80-5	C[Si](C)(C)OC[C@H]([C@H]([C@@H]([C@H](CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 18, 2: 2, 3: 4, 22: 6}
Did not match all atoms present	141993-16-0	CC(=O)N1[C@@H]2C[C@@H]3CC[C@]2(C3(C)C)CS1(=O)=O	{1: 3, 33: 1, 11: 4, 12: 2, 13: 2, 24: 1, 29: 2}
Did not match all atoms present	142-04-1	C1=CC=C(C=C1)N.Cl	{17: 1, 30: 1, 14: 5}
Did not match all atoms present	142-17-6	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	142-22-3	C=CCOC(=O)OCCOCCOC(=O)OCC=C	{2: 6, 22: 1, 5: 2, 6: 2}
Did not match all atoms present	142-31-4	CCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 7, 29: 3, 22: 1}
Did not match all atoms present	142-46-1	C(=S)(N)NNC(=S)N	{31: 2, 30: 2, 7: 2}
Did not match all atoms present	142-47-2	C(CC(=O)[O-])C(C(=O)[O-])N.[Na+].[Na+]	{24: 2, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	142-63-2	C1CNCCN1.O.O.O.O.O.O	{32: 2, 11: 4}
Did not match all atoms present	142-65-4	C1CC2C(C1C3=CC=CC=C23)N	{11: 2, 12: 3, 30: 1, 14: 4}
Did not match all atoms present	142-71-2	CC(=O)[O-].CC(=O)[O-].[Cu+2]	{24: 2, 1: 2}
Did not match all atoms present	142-72-3	CC(=O)[O-].CC(=O)[O-].[Mg+2]	{24: 2, 1: 2}
Did not match all atoms present	142-86-9	CCCCCCCCCCCC(=O)NCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 12, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	142-87-0	CCCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 9, 29: 3, 22: 1}
Did not match all atoms present	142-98-3	CCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 9, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	1420-03-7	CN1CCCC(C1)OC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.Cl	{1: 1, 4: 1, 33: 1, 11: 9, 12: 2, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	1420-04-8	C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC(=O)C2=C(C=CC(=C2)Cl)O.C(CO)N	{2: 2, 38: 1, 14: 6, 17: 2, 20: 1, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	1420-07-1	CC(C)(C)C1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]	{1: 3, 38: 2, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	1420-40-2	C[N+](C)(C)CCCCCCCCCC[N+](C)(C)C.[I-].[I-]	{1: 6, 2: 10, 19: 2}
Did not match all atoms present	1420-53-7	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.OS(=O)(=O)O	{1: 8, 33: 4, 11: 12, 12: 16, 13: 4, 14: 16, 20: 6, 22: 4, 23: 4, 29: 2}
Did not match all atoms present	1420-55-9	CCSC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)C	{1: 2, 2: 4, 33: 3, 40: 1, 41: 1, 11: 4, 14: 7}
Did not match all atoms present	14200-84-1	C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC=CC(=C3)O	{22: 2, 21: 1, 14: 13}
Did not match all atoms present	14202-49-4	[2H]C([2H])([2H])C1CCC(CC1)OC	{1: 2, 11: 4, 12: 2, 22: 1}
Did not match all atoms present	14204-15-0	CC(C)(C(=O)N)O.OS(=O)(=O)O	{1: 2, 4: 1, 20: 3, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	142044-37-9	C[N+]1=CC=CC2=C1C=C[C@@H]3[C@H]2O3	{1: 1, 12: 2, 33: 1, 14: 5, 23: 1}
Did not match all atoms present	14205-65-3	CCOC(=O)C1=CNC2=CC3=C(C=C2C1=O)OCO3	{32: 1, 1: 1, 2: 1, 11: 1, 14: 3, 23: 2, 25: 1, 28: 1}
Did not match all atoms present	14206-62-3	C1=CC=C2C=C(C(=CC2=C1)C(=O)[O-])O.[Na+]	{24: 1, 21: 1, 14: 6}
Did not match all atoms present	14207-78-4	CC1=CC2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3C	{1: 2, 14: 10}
Did not match all atoms present	14208-78-7	CC(C)C[Sn](CC(C)C)(Cl)Cl	{1: 4, 2: 2, 3: 2, 17: 2}
Did not match all atoms present	1421-14-3	CCCOC(=O)CC1=CC(=C(C=C1)OCC(=O)N(CC)CC)OC	{1: 4, 2: 6, 33: 1, 14: 3, 22: 2, 24: 1, 28: 1}
Did not match all atoms present	1421-23-4	C1=CC=C(C=C1)CN=C(N)N=C(N)N.Cl	{2: 1, 7: 2, 34: 2, 14: 5, 17: 1, 30: 3}
Did not match all atoms present	1421-49-4	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)O	{1: 6, 27: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	1421-63-2	CCCC(=O)C1=CC(=C(C=C1O)O)O	{24: 1, 1: 1, 2: 2, 21: 3, 14: 2}
Did not match all atoms present	1421-68-7	CNCC(C1=CC(=CC=C1)NS(=O)(=O)C)O.CS(=O)(=O)O	{1: 3, 2: 1, 3: 1, 14: 4, 20: 2, 29: 4, 31: 2}
Did not match all atoms present	1421-85-8	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)C5C(O5)C6=CC=CC=C64	{12: 2, 14: 12, 23: 1}
Did not match all atoms present	14210-25-4	C1=CC=C(C=C1)N2C(=NN=N2)Cl	{17: 1, 35: 3, 14: 5, 33: 1}
Did not match all atoms present	14211-01-9	CC(C)OC(=O)C(C1=CC=CC=C1)SP(=S)(OC)OC	{1: 4, 3: 2, 40: 1, 14: 5, 22: 2, 28: 1}
Did not match all atoms present	14211-53-1	C1CC2=CC=CC=C2C(C1O)O	{20: 2, 11: 2, 12: 2, 14: 4}
Did not match all atoms present	14212-54-5	CC1C(O1)C2=CC=CC=C2	{1: 1, 12: 2, 14: 5, 23: 1}
Did not match all atoms present	142129-81-5	C1=CC2=C(C3C(O3)[C@H]4[C@H]2O4)N=C1	{35: 1, 12: 4, 14: 3, 23: 2}
Did not match all atoms present	14213-16-2	CC1=NN=NN1C2=CC=CC=C2	{1: 1, 35: 3, 14: 5, 33: 1}
Did not match all atoms present	14213-84-4	C1=CC=C(C=C1)CCC=CC2=CC=CC=C2	{2: 2, 14: 10, 6: 2}
Did not match all atoms present	14213-97-9	[O-]B([O-])[O-]	{29: 3}
Did not match all atoms present	14214-31-4	C=C(CN=C=S)Cl	{2: 1, 5: 1, 7: 1, 8: 1, 34: 1, 17: 1}
Did not match all atoms present	14214-32-5	CN(C)C(=O)NC1=CC=C(C=C1)OC2=CC=C(C=C2)OC	{1: 3, 33: 1, 14: 8, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	14215-29-3	[N-]=[N+]=[N-].[N-]=[N+]=[N-].[Cd+2]	{34: 2}
Did not match all atoms present	14215-30-6	[N-]=[N+]=[N-].[N-]=[N+]=[N-].[Cu+2]	{34: 2}
Did not match all atoms present	14215-58-8	C(C[N-]CC[NH-])[NH-].[Cl-].[Pt+4]	{17: 1, 2: 4, 36: 2, 34: 1}
Did not match all atoms present	14216-34-3	COC(=O)OC1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 14: 4}
Did not match all atoms present	14217-00-6	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Na+].[Na+].[Na+].[Na+].[Co+2]	{}
Did not match all atoms present	14217-21-1	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Na+].[Na+].[Na+].[Fe+3]	{}
Did not match all atoms present	142186-36-5	CC(C)(C)OC(=O)N[C@@H](C1=CC=C(C=C1)F)C(=O)O	{1: 3, 3: 1, 4: 1, 14: 4, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1422-07-7	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.Cl	{1: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	1422-53-3	CC1=C(C=C(C=C1)F)Br	{16: 1, 1: 1, 18: 1, 14: 3}
Did not match all atoms present	14220-17-8	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[Ni+2]	{}
Did not match all atoms present	14220-21-4	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].Br[Re]	{18: 1, 29: 5}
Did not match all atoms present	14220-64-5	C1=CC=C(C=C1)C#N.C1=CC=C(C=C1)C#N.Cl[Pd]Cl	{17: 2, 37: 2, 14: 10}
Did not match all atoms present	14221-00-2	C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.[Ni]	{22: 12, 14: 60}
Did not match all atoms present	14221-01-3	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pd]	{14: 60}
Did not match all atoms present	14221-02-4	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pt]	{14: 60}
Did not match all atoms present	14221-06-8	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Mo+2].[Mo+2]	{24: 4, 1: 4}
Did not match all atoms present	14221-47-7	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[NH4+].[NH4+].[NH4+].[Fe+3]	{24: 6}
Did not match all atoms present	14221-48-8	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[NH4+].[NH4+].[NH4+].[Fe+3]	{}
Did not match all atoms present	14222-46-9	CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C.CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C.[Ca+2]	{1: 4, 2: 2, 33: 2, 41: 2, 12: 6, 13: 2, 14: 10, 24: 4, 25: 2, 31: 2}
Did not match all atoms present	14222-60-7	CCCC1=NC=CC(=C1)C(=S)N	{1: 1, 2: 2, 35: 1, 7: 1, 14: 3, 30: 1}
Did not match all atoms present	14224-99-8	CC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 35: 1, 14: 10, 23: 1}
Did not match all atoms present	14226-68-7	CN1CCCC1C2=CNC3=C2C=C(C=C3)OCC4=CC=CC=C4	{32: 1, 1: 1, 2: 1, 33: 1, 11: 3, 12: 1, 14: 9, 22: 1}
Did not match all atoms present	14227-18-0	COC1=CC(=C(C(=C1)OC)[N+](=O)[O-])OC	{1: 3, 38: 1, 22: 3, 14: 2}
Did not match all atoms present	1423-13-8	C1(=C(C(=C(C(=C1F)F)F)F)F)N=O	{16: 5, 34: 1, 29: 1}
Did not match all atoms present	1423-15-0	C1(=C(C(=C(C(=C1F)F)F)F)F)N=[N+]=[N-]	{16: 5, 34: 2}
Did not match all atoms present	1423-26-3	B(C1=CC(=CC=C1)C(F)(F)F)(O)O	{16: 3, 20: 2, 4: 1, 14: 4}
Did not match all atoms present	1423-97-8	C[C@]12CCC3=C([C@@H]1CC[C@@H]2O)C=CC4=C3C=CC(=C4)O	{1: 1, 11: 4, 12: 2, 13: 1, 14: 5, 20: 1, 21: 1}
Did not match all atoms present	14230-52-5	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)O	{1: 2, 2: 15, 3: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	142313-30-2	C1=C2C(=CC(=C1F)Cl)NC(=S)N2	{16: 1, 17: 1, 14: 2, 32: 2}
Did not match all atoms present	14235-81-5	C#CC1=CC=C(C=C1)N	{9: 1, 10: 1, 30: 1, 14: 4}
Did not match all atoms present	14236-04-5	CN(CC1CO1)C2=CC=CC=C2	{1: 1, 2: 1, 33: 1, 11: 1, 12: 1, 14: 5, 23: 1}
Did not match all atoms present	142381-76-8	CC(CO)(CO)CO.O.O.O.O	{1: 1, 2: 3, 4: 1, 20: 3}
Did not match all atoms present	14239-68-0	CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Cd+2]	{1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	14239-75-9	C(=S)(N)N.C(=S)(N)N.[Cl-].[Cl-].[Zn+2]	{17: 2, 30: 4, 7: 2}
Did not match all atoms present	1424-14-2	C1=CC=C(C=C1)CNC(=S)NCC2=CC=CC=C2	{2: 2, 31: 2, 14: 10, 7: 1}
Did not match all atoms present	1424-27-7	CC(=O)NC1=NN=C(S1)S(=O)(=O)[NH-].[Na+]	{1: 1, 35: 2, 36: 1, 41: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	1424-48-2	CC1=CC=C(C=C1)S(=O)(=O)C=CC#N	{1: 1, 37: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	1424-66-4	CN(C)C1=CC(=C(C=C1)C=O)Cl	{1: 2, 26: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	1424-79-9	C1=CC(=C(C(=C1Cl)CCl)Cl)Cl	{17: 4, 2: 1, 14: 2}
Did not match all atoms present	14240-75-6	CC[N+](CC)(CC)CC.Cl[Fe-](Cl)(Cl)Cl	{1: 4, 2: 4, 17: 4}
Did not match all atoms present	14242-05-8	O.[O-]Cl(=O)(=O)=O.[Ag+]	{17: 1, 29: 4}
Did not match all atoms present	14243-64-2	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Au]	{17: 1, 14: 15}
Did not match all atoms present	14244-35-0	C/C(=C(/[O-])\C)/C(=O)C.C/C(=C(/[O-])\C)/C(=O)C.C/C(=C(/[O-])\C)/C(=O)C.[Cr+3]	{24: 3, 1: 9, 7: 6}
Did not match all atoms present	14244-61-2	C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].[K+].[K+].[Pt+2]	{37: 4}
Did not match all atoms present	14244-62-3	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[Zn+2]	{}
Did not match all atoms present	142443-61-6	CC=O.CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N	{1: 2, 34: 1, 14: 9, 22: 1, 26: 1, 29: 2}
Did not match all atoms present	14245-62-6	CCS(=O)(=O)OC(C)C	{1: 3, 2: 1, 3: 1, 29: 2, 22: 1}
Did not match all atoms present	14246-15-2	CCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 4, 28: 1}
Did not match all atoms present	14246-16-3	CCCCCCCCO[Si](C)(C)C	{1: 4, 2: 7, 22: 1}
Did not match all atoms present	142474-86-0	CCCCCCCCCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 13, 22: 3, 14: 10, 29: 1}
Did not match all atoms present	14248-01-2	CN1C=C(C=NC1=O)Br	{1: 1, 35: 1, 33: 1, 14: 2, 18: 1, 25: 1}
Did not match all atoms present	14248-22-7	CC(C)(CC1=CC=CC=C1)C(=O)OC	{1: 3, 2: 1, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	14248-50-1	C1=C[N+](=CC=C1Br)[O-]	{33: 1, 18: 1, 29: 1, 14: 4}
Did not match all atoms present	14248-66-9	CC1=C[N+](=CC(=C1[N+](=O)[O-])C)[O-]	{1: 2, 38: 1, 29: 1, 14: 2, 33: 1}
Did not match all atoms present	1425-58-7	B12C=CC=CN1C=CC=C2	{33: 1, 14: 8}
Did not match all atoms present	1425-61-2	C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(CO)O.OS(=O)(=O)O	{1: 2, 2: 2, 34: 2, 7: 2, 12: 14, 13: 1, 20: 10, 22: 2, 23: 2, 29: 2, 30: 4, 31: 1}
Did not match all atoms present	1425-63-4	CC1=NC2=C(N=C1C)N=C(N=C2N)N	{1: 2, 35: 4, 30: 2}
Did not match all atoms present	1425-67-8	C1=CC2=[N+](C=CC(=C2C=C1C(=O)O)[N+](=O)[O-])[O-]	{38: 1, 33: 1, 27: 1, 29: 1, 14: 5}
Did not match all atoms present	14251-72-0	CCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 3, 17: 1}
Did not match all atoms present	14252-32-5	CCCC(=O)C#CC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 10: 2, 14: 5}
Did not match all atoms present	14252-46-1	CC(C)(SC1=CC=CC=C1)SC2=CC=CC=C2	{40: 2, 1: 2, 4: 1, 14: 10}
Did not match all atoms present	14252-80-3	CCCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C.Cl	{1: 3, 2: 3, 33: 1, 11: 4, 12: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	14254-76-3	CC1=C(C=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=C(C=C4)OC	{1: 2, 34: 1, 14: 12, 15: 2, 22: 1, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	142547-16-8	CCOC(=O)[C@@H]1CC=CC[C@H]1[NH3+]	{1: 1, 2: 1, 11: 2, 12: 2, 14: 2, 28: 1}
Did not match all atoms present	14255-87-9	CCCCC1=CC2=C(C=C1)N=C(N2)NC(=O)OC	{32: 1, 1: 2, 2: 3, 35: 1, 14: 3, 28: 1, 31: 1}
Did not match all atoms present	14255-88-0	C1=CC=C(C=C1)OC(=O)N2C3=CC(=C(C=C3N=C2C(F)(F)F)Cl)Cl	{33: 1, 35: 1, 4: 1, 14: 7, 16: 3, 17: 2, 28: 1}
Did not match all atoms present	142559-11-3	CC[C@H](COCC1=CC=CC=C1)N	{1: 1, 2: 3, 3: 1, 14: 5, 22: 1, 30: 1}
Did not match all atoms present	14258-76-5	C1=CC=C2C=C3C4=CC=CC5=C4C6=C(C3=CC2=C1)C=CC7=C6C8=C(C=CC=C58)C=C7	{14: 16}
Did not match all atoms present	14259-85-9	[Mo-2].[O].[O].[O].[O]	{}
Did not match all atoms present	1426-87-5	CC(C)C1=CC(=C(C=C1)F)C(C)C	{16: 1, 1: 4, 3: 2, 14: 3}
Did not match all atoms present	14260-80-1	C(CO)N(CCO)CCO.C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O	{33: 2, 2: 9, 20: 9, 29: 3}
Did not match all atoms present	14260-97-0	CCCCOCCOP(=O)(O)OCCOCCCC	{1: 2, 2: 10, 20: 1, 29: 1, 22: 4}
Did not match all atoms present	14260-98-1	CCCCOCCOP(=O)(O)O	{1: 1, 2: 5, 20: 2, 29: 1, 22: 2}
Did not match all atoms present	142617-53-6	CC(/C(=C\C(=O)C(C)(C)C)/O[Bi](O/C(=C/C(=O)C(C)(C)C)/C(C)(C)C)O/C(=C/C(=O)C(C)(C)C)/C(C)(C)C)(C)C	{1: 18, 4: 6, 6: 3, 7: 3, 22: 3, 24: 3}
Did not match all atoms present	142619-57-6	CCCCCCCCCCCCC(C)C1=CC(=C(C=C1O)C(C)CCCCCCCCCCCC)O	{1: 4, 2: 22, 3: 2, 21: 2, 14: 2}
Did not match all atoms present	14262-60-3	C1COC2=CC=CC=C2OCCOC3=CC=CC=C3OCCO1	{11: 6, 14: 8, 23: 5}
Did not match all atoms present	14262-61-4	C1COCCOC2=CC=CC=C2OCCOC3=CC=CC=C3OCCO1	{11: 8, 14: 8, 23: 6}
Did not match all atoms present	14263-53-7	CC(=NCCN=C(C)CC(=O)C)CC(=O)C.[Cu]	{24: 2, 1: 4, 2: 4, 34: 2, 7: 2}
Did not match all atoms present	14263-59-3	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[Au+3]	{}
Did not match all atoms present	14263-91-3	C1=C(C=C(C=C1C(F)(F)F)[N+]#N)C(F)(F)F.C1=C(C=C(C=C1C(F)(F)F)[N+]#N)C(F)(F)F.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{16: 12, 17: 4, 34: 2, 4: 4, 14: 6}
Did not match all atoms present	14263-92-4	C1=CC=C(C(=C1)[N+]#N)Cl.C1=CC=C(C(=C1)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 6, 34: 2, 14: 8}
Did not match all atoms present	14263-93-5	COC1=CC(=C(C=C1C#N)OC)[N+]#N.COC1=CC(=C(C=C1C#N)OC)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 34: 2, 37: 2, 14: 4, 17: 4, 22: 4}
Did not match all atoms present	14263-94-6	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]#N)OC)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 2, 22: 2, 14: 6, 17: 4}
Did not match all atoms present	14264-16-5	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Cl-].[Ni+2]	{17: 2, 14: 30}
Did not match all atoms present	14264-31-4	[C-]#N.[C-]#N.[C-]#N.[Na+].[Na+].[Cu+]	{}
Did not match all atoms present	14265-44-2	O=P([O-])([O-])[O-]	{29: 4}
Did not match all atoms present	14265-45-3	O=S([O-])[O-]	{29: 3}
Did not match all atoms present	14267-08-4	CN(C)CCN(C)C.[Cl-].[Cl-].[Pd+2]	{1: 4, 2: 2, 33: 2, 17: 2}
Did not match all atoms present	14267-17-5	CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Ni+2]	{1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	14268-23-6	[C-]([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-].[K+]	{38: 3, 7: 1}
Did not match all atoms present	14268-66-7	C1OC2=C(O1)C=C(C=C2)N	{11: 1, 30: 1, 14: 3, 23: 2}
Did not match all atoms present	1427-07-2	CC1=C(C=C(C=C1)[N+](=O)[O-])F	{16: 1, 1: 1, 38: 1, 14: 3}
Did not match all atoms present	142700-78-5	C1=CC2=CC3=C4NC(=C3C=C2C=C1)NC5=C6C=C7C=CC=CC7=CC6=C8N5[Ga](N9C(=C1C=C2C=CC=CC2=CC1=C9NC1=C2C=C3C=CC=CC3=CC2=C(N1)N8)N4)Cl	{32: 6, 17: 1, 14: 24, 33: 2}
Did not match all atoms present	142702-41-8	C=O.C1CC(=NC1)[O-].[Ca+2]	{35: 1, 11: 3, 5: 1, 15: 1}
Did not match all atoms present	14271-73-9	CC1=CC=C(C=C1)C(=O)C#N	{24: 1, 1: 1, 37: 1, 14: 4}
Did not match all atoms present	142720-24-9	CCCCCCN(CCCCCC)C(=O)CC1=C(NC2=CC=CC=C21)C3=CC=C(C=C3)F	{32: 1, 1: 2, 2: 11, 33: 1, 14: 8, 16: 1, 24: 1}
Did not match all atoms present	142730-48-1	CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C=O)C	{1: 3, 2: 2, 33: 1, 14: 3, 26: 1, 28: 1}
Did not match all atoms present	142782-22-7	COC(=O)C1=NC(=NN1)N.Cl	{32: 1, 1: 1, 35: 2, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	14280-30-9	[OH-]	{}
Did not match all atoms present	14280-50-3	[Pb+2]	{}
Did not match all atoms present	14282-76-9	CC1=C(SC=C1)Br	{1: 1, 18: 1, 14: 2, 41: 1}
Did not match all atoms present	142828-65-7	CCC(C)C1=CC=C(C=C1)CCC2=CC=CC=C2	{1: 2, 2: 3, 3: 1, 14: 9}
Did not match all atoms present	14283-07-9	[Li+].[B-](F)(F)(F)F	{16: 4}
Did not match all atoms present	14284-24-3	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Ca+2].[Zr+4]	{29: 9}
Did not match all atoms present	14284-36-7	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Cs+]	{29: 8}
Did not match all atoms present	14284-87-8	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Gd+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	14284-90-3	C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.[Mo]	{24: 3, 1: 6, 20: 3, 6: 3, 7: 3}
Did not match all atoms present	14284-92-5	C/C(=C\C(=O)C)/O.C/C(=C\C(=O)C)/O.C/C(=C\C(=O)C)/O.[Rh]	{24: 3, 1: 6, 20: 3, 6: 3, 7: 3}
Did not match all atoms present	14284-95-8	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Tb+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	14284-96-9	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Ti+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	14284-98-1	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Yb+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	14285-43-9	CC(C)C1=C(C=CC(=C1)OC(=O)NC)SC	{1: 4, 3: 1, 40: 1, 14: 3, 28: 1, 31: 1}
Did not match all atoms present	14286-02-3	N.N.N(=O)[O-].N(=O)[O-].[Pt+2]	{34: 2, 29: 4}
Did not match all atoms present	14286-84-1	CN(C)CCCOC1(CCCCCC1)CC2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 4, 6: 2, 33: 1, 11: 6, 13: 1, 14: 5, 22: 1, 27: 2}
Did not match all atoms present	14287-04-8	CCCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 2}
Did not match all atoms present	1429-30-7	COC1=CC(=CC(=C1O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]	{1: 1, 14: 5, 17: 1, 21: 5, 22: 1, 23: 1}
Did not match all atoms present	14293-15-3	C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)C(C3=CC=CC=C3)NC4=CC=CC=C4	{2: 1, 3: 1, 14: 19, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	14293-24-4	CC(=O)CC1=C(C=CC(=C1)OC)OC	{24: 1, 1: 3, 2: 1, 22: 2, 14: 3}
Did not match all atoms present	14293-44-8	CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=C(C=C2O)Cl)S(=O)(=O)N	{1: 2, 14: 5, 17: 1, 21: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	14293-73-3	[O-]S(=O)S(=O)[O-].[K+].[K+]	{29: 4}
Did not match all atoms present	14297-39-3	C1=CC=C(C=C1)CC2=CC=C(C=C2)CCl	{17: 1, 2: 2, 14: 9}
Did not match all atoms present	14297-59-7	CCOC(=O)C1=CC(=C(C=C1NC2=CC=CC=C2)C(=O)OCC)NC3=CC=CC=C3	{1: 2, 2: 2, 28: 2, 14: 12, 31: 2}
Did not match all atoms present	14297-87-1	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OCC6=CC=CC=C6)O[C@H]3[C@H](C=C4)O	{1: 1, 2: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 9, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	14298-31-8	[O-]P(=O)([O-])[O-].[Pr+3]	{29: 4}
Did not match all atoms present	14298-32-9	[O-]P(=O)([O-])[O-].[Nd+3]	{29: 4}
Did not match all atoms present	142982-23-8	CC(C)C(C(C)(C)COC(=O)CC(=O)C)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O	{1: 5, 2: 6, 3: 2, 4: 1, 14: 4, 20: 1, 24: 1, 27: 4, 28: 1}
Did not match all atoms present	142994-19-2	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=C(C=C4)Cl)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 17: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	142994-45-4	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CN=CC=C4)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	143-02-2	CCCCCCCCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 15, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	143-03-3	CCCCCCCCCCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 17, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	143-18-0	CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 14, 6: 2}
Did not match all atoms present	143-19-1	CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 14, 6: 2}
Did not match all atoms present	143-33-9	[C-]#N.[Na+]	{}
Did not match all atoms present	143-36-2	C[Hg]I	{1: 1, 19: 1}
Did not match all atoms present	143-52-2	C[C@]12C(=O)CC[C@@H]3[C@]14CCN([C@@H]3CC5=C4C(=C(C=C5)O)O2)C	{1: 2, 33: 1, 11: 5, 12: 2, 13: 2, 14: 2, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	143-66-8	[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Na+]	{14: 20}
Did not match all atoms present	143-67-9	CC[C@@]1(C[C@@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O.OS(=O)(=O)O	{32: 1, 1: 7, 2: 2, 33: 3, 11: 9, 12: 4, 13: 5, 14: 8, 20: 4, 22: 1, 28: 3, 29: 2}
Did not match all atoms present	143-71-5	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3C(=O)CC4.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 2, 3: 2, 33: 1, 11: 5, 12: 3, 13: 1, 14: 2, 20: 2, 22: 1, 23: 1, 25: 1, 27: 2}
Did not match all atoms present	143-74-8	C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O	{23: 1, 29: 2, 13: 1, 14: 12, 21: 2}
Did not match all atoms present	143-81-7	CCC(C)C1(C(=O)NC(=NC1=O)[O-])CC.[Na+]	{32: 1, 1: 3, 2: 2, 3: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	143-84-0	C1CN(CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(=O)CBr	{33: 1, 2: 1, 4: 1, 11: 4, 12: 1, 14: 10, 18: 1, 20: 1, 24: 1}
Did not match all atoms present	143-85-1	C1CN(CCC1C(=O)CCl)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{33: 1, 2: 1, 4: 1, 11: 4, 12: 1, 14: 10, 17: 1, 20: 1, 24: 1}
Did not match all atoms present	143-86-2	C1CN(CCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(=O)CI	{33: 1, 2: 1, 4: 1, 11: 4, 12: 1, 14: 10, 19: 1, 20: 1, 24: 1}
Did not match all atoms present	143-98-6	CN1CC[C@@]23CCCC[C@@H]2[C@@H]1CC4=C3C=C(C=C4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 1, 3: 2, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 20: 2, 21: 1, 27: 2}
Did not match all atoms present	1430-97-3	CC1=CC2=C(C=C1)C3=CC=CC=C3C2	{1: 1, 11: 1, 14: 7}
Did not match all atoms present	14302-13-7	C12=C(C(=C(C(=C1Cl)Br)Cl)Br)C3=NC4=NC(=NC5=C6C(=C([N-]5)N=C7C8=C(C(=C(C(=C8Br)Cl)Cl)Cl)C(=N7)N=C2[N-]3)C(=C(C(=C6Br)Cl)Br)Cl)C9=C4C(=C(C(=C9Cl)Br)Cl)Cl.[Cu+2]	{17: 10, 18: 6, 35: 8}
Did not match all atoms present	14302-87-5	[Hg+2]	{}
Did not match all atoms present	14306-51-5	C1C=CCO1.O	{11: 2, 14: 2, 23: 1}
Did not match all atoms present	14307-35-8	[Li+].[Li+].[O-][Cr](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	14307-43-8	[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.N	{27: 2, 3: 2, 20: 2}
Did not match all atoms present	14307-49-4	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Ca+2]	{29: 6, 22: 1}
Did not match all atoms present	143077-71-8	CCC(C)C1=CC2=CC=CC=C2C(=C1)S(=O)(=O)O	{1: 2, 2: 1, 3: 1, 14: 6, 20: 1, 29: 2}
Did not match all atoms present	14309-25-2	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N=[N+]=[N-]	{34: 2, 4: 1, 14: 15}
Did not match all atoms present	14309-40-1	CCCCCCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 6, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	14309-41-2	CCCCCCCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 7, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	14309-42-3	CCCCCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 4, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	1431-39-6	CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N	{1: 2, 30: 1, 29: 2, 14: 6, 33: 1}
Did not match all atoms present	14310-20-4	CC1=CC=C(C=C1)CCC2=CC=CC=C2	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	14310-21-5	COC1=CC=C(C=C1)CCC2=CC=CC=C2	{1: 1, 2: 2, 22: 1, 14: 9}
Did not match all atoms present	14310-24-8	C1=CC=C(C=C1)CCC2=CC=C(C=C2)Br	{2: 2, 18: 1, 14: 9}
Did not match all atoms present	14310-25-9	C1=CC=C(C=C1)CCC2=CC=C(C=C2)I	{2: 2, 19: 1, 14: 9}
Did not match all atoms present	14310-29-3	C1=CC=C(C=C1)CCC2=CC=C(C=C2)[N+](=O)[O-]	{2: 2, 38: 1, 14: 9}
Did not match all atoms present	14311-52-5	[O].[O].[O].[O].[W-2]	{}
Did not match all atoms present	14311-93-4	CC(=O)[O-].CC(=O)[O-].[OH-].[OH-].[Zr+4]	{24: 2, 1: 2}
Did not match all atoms present	14312-00-6	[O-][Cr](=O)(=O)[O-].[Cd+2]	{29: 4}
Did not match all atoms present	14314-27-3	[O-]Cl=O.[K+]	{17: 1, 29: 2}
Did not match all atoms present	14314-42-2	[18OH2]	{}
Did not match all atoms present	14314-87-5	C1CCC2=CC3=C(CCCCC3)C=C2CC1	{11: 10, 14: 2}
Did not match all atoms present	143140-06-1	C[C@@]12C=CC(=O)N1[C@H](CO2)C3=CC=CC=C3	{1: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 7, 23: 1, 25: 1}
Did not match all atoms present	14315-11-8	CC1=C2C=CSC2=CC=C1	{1: 1, 14: 5, 41: 1}
Did not match all atoms present	14315-14-1	CC1=CC2=C(C=C1)SC=C2	{1: 1, 14: 5, 41: 1}
Did not match all atoms present	14317-07-8	C[Si](C)(C)OCC(C(C(C(CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 18, 2: 2, 3: 4, 22: 6}
Did not match all atoms present	14318-88-8	C1=CC=C(C=C1)P(=[Co]Br)(C2=CC=CC=C2)C3=CC=CC=C3.[N-]=O.[N-]=O	{18: 1, 29: 2, 14: 15}
Did not match all atoms present	14318-98-0	C1=CC=C(C=C1)P(=[Co]I)(C2=CC=CC=C2)C3=CC=CC=C3.[N-]=O.[N-]=O	{19: 1, 29: 2, 14: 15}
Did not match all atoms present	14319-01-8	C1=CC=C(C=C1)N(N=O)[O-].C1=CC=C(C=C1)N(N=O)[O-].C1=CC=C(C=C1)N(N=O)[O-].[Fe+3]	{33: 3, 34: 3, 29: 6, 14: 15}
Did not match all atoms present	14319-08-5	CC(/C(=C\C(=O)C(C)(C)C)/O[Al](O/C(=C/C(=O)C(C)(C)C)/C(C)(C)C)O/C(=C/C(=O)C(C)(C)C)/C(C)(C)C)(C)C	{1: 18, 4: 6, 6: 3, 7: 3, 22: 3, 24: 3}
Did not match all atoms present	14319-13-2	CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.[La]	{1: 18, 4: 6, 6: 3, 7: 3, 20: 3, 24: 3}
Did not match all atoms present	1432-14-0	CC1=C(C=CC(=C1)Cl)OC(C)C(=O)O.C(CO)NCCO	{1: 2, 2: 4, 3: 1, 14: 3, 17: 1, 20: 2, 22: 1, 27: 1, 31: 1}
Did not match all atoms present	1432-31-1	C[SiH](C)C1=CC=C(C=C1)Cl	{1: 2, 14: 4, 17: 1}
Did not match all atoms present	1432-39-9	CC1=CC=C(C=C1)[SiH](C)C	{1: 3, 14: 4}
Did not match all atoms present	1432-75-3	C1=CC=C(C(=C1)C(C[N+](=O)[O-])SCC[NH3+])Cl.[Cl-]	{2: 3, 3: 1, 38: 1, 40: 1, 14: 4, 17: 2}
Did not match all atoms present	14320-04-8	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Zn+2]	{35: 8, 14: 16}
Did not match all atoms present	143201-11-0	CC(C)C1=C(C(=C(C(=N1)C(C)C)/C=C/[C@H](C[C@H](CC(=O)[O-])O)O)C2=CC=C(C=C2)F)COC.[Na+]	{1: 5, 2: 3, 3: 4, 6: 2, 14: 4, 16: 1, 35: 1, 20: 2, 22: 1, 24: 1}
Did not match all atoms present	143203-47-8	CO[Si](C)(C)CCCC#N	{1: 3, 2: 3, 37: 1, 22: 1}
Did not match all atoms present	14321-05-2	C1=C(C(=C(C(=N1)C(Cl)(Cl)Cl)Cl)N)Cl	{17: 5, 35: 1, 4: 1, 30: 1, 14: 1}
Did not match all atoms present	14321-27-8	CCNCC1=CC=CC=C1	{1: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	14323-18-3	CC(=O)CC(=O)C1=CC=CC=C1.CC(=O)CC(=O)C1=CC=CC=C1.CC(=O)CC(=O)C1=CC=CC=C1.[Tb]	{24: 6, 1: 3, 2: 3, 14: 15}
Did not match all atoms present	14323-32-1	[K+].[Br-].[Br-].[Br-].[Br-].[Au+3]	{18: 4}
Did not match all atoms present	14323-41-2	[C-]#N.[C-]#N.[C-]#N.[C-]#N.O.[K+].[K+].[Ni+2]	{}
Did not match all atoms present	143239-12-7	C(CN(CC(=O)O)CC(=O)[O-])C(=O)[O-].[K+].[K+]	{24: 2, 33: 1, 2: 4, 27: 1}
Did not match all atoms present	14324-55-1	CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Zn+2]	{1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	14324-83-5	CC(=O)C=C(C(F)(F)F)[O-].CC(=O)C=C(C(F)(F)F)[O-].O.O.[Ni+2]	{1: 2, 4: 2, 6: 2, 7: 2, 16: 6, 24: 2}
Did not match all atoms present	14326-59-1	CS[Pb](C)(C)C	{40: 1, 1: 4}
Did not match all atoms present	143268-49-9	CC(=C1N(C2=CC=CC=C2N1C)C)C	{1: 4, 15: 1, 33: 2, 14: 4, 7: 1}
Did not match all atoms present	143268-59-1	CC(=C1N(C2=CC=CC=C2O1)C)C	{1: 3, 33: 1, 7: 1, 14: 4, 15: 1, 23: 1}
Did not match all atoms present	143268-64-8	CC(=C1N(C2=CC=CC=C2S1)C)C	{1: 3, 33: 1, 41: 1, 7: 1, 14: 4, 15: 1}
Did not match all atoms present	14327-04-9	CC(C)(C)NC(=S)NC1=CC=CC=C1	{1: 3, 31: 2, 4: 1, 14: 5, 7: 1}
Did not match all atoms present	1433-65-4	C1=CC(=CC=C1C2=NC(=O)C=C(S2)O)Cl	{35: 1, 41: 1, 14: 5, 17: 1, 21: 1, 25: 1}
Did not match all atoms present	14331-54-5	CC1=NC(=NC=C1)C	{1: 2, 35: 2, 14: 2}
Did not match all atoms present	14331-83-0	[Ac]	{}
Did not match all atoms present	143314-16-3	[B-](F)(F)(F)F.CCN1C=C[N+](=C1)C	{16: 4, 1: 2, 2: 1, 14: 3, 33: 2}
Did not match all atoms present	14332-59-3	[O-][P+](=O)[O-].[Zn+2]	{29: 3}
Did not match all atoms present	14333-13-2	[Mn].[O-].[O].[O].[O]	{}
Did not match all atoms present	14333-14-3	[Mn].[O-].[O-].[O].[O]	{}
Did not match all atoms present	14333-18-7	[O].[O].[O].[O].[V-3]	{}
Did not match all atoms present	14333-20-1	[O].[O].[O].[O].[Tc-]	{}
Did not match all atoms present	14333-21-2	[O].[O].[O].[O].[Ru-]	{}
Did not match all atoms present	14333-22-3	[O].[O].[O].[O].[Ru-2]	{}
Did not match all atoms present	14333-24-5	[O].[O].[O].[O].[Re-]	{}
Did not match all atoms present	14334-41-9	CC(C)NC1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3.Cl	{1: 2, 3: 1, 11: 4, 12: 1, 13: 1, 14: 10, 17: 1, 31: 1}
Did not match all atoms present	143348-13-4	CC(C)(CO)N.C=CC1=CC=CC=C1.C(=C\C(=O)O)\C(=O)O	{1: 2, 2: 1, 4: 1, 5: 1, 6: 3, 14: 5, 20: 1, 27: 2, 30: 1}
Did not match all atoms present	14335-33-2	[2H]OP(=O)(O[2H])O[2H]	{20: 3, 29: 1}
Did not match all atoms present	14335-40-1	FP(F)Cl	{16: 2, 17: 1}
Did not match all atoms present	14337-12-3	[Au+3].[Cl-].[Cl-].[Cl-].[Cl-]	{17: 4}
Did not match all atoms present	14337-14-5	[Au+3].[Br-].[Br-].[Br-].[Br-]	{18: 4}
Did not match all atoms present	14338-32-0	C[N+]1=CC=CC=C1Cl.[I-]	{1: 1, 19: 1, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	14338-93-3	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ce+4]	{17: 4, 29: 16}
Did not match all atoms present	143390-89-0	CC1=CC=CC=C1OCC2=CC=CC=C2/C(=N\OC)/C(=O)OC	{1: 3, 2: 1, 7: 1, 34: 1, 14: 8, 22: 2, 28: 1}
Did not match all atoms present	14343-69-2	[N]N=[N-]	{34: 1}
Did not match all atoms present	14345-97-2	CC1=C(SC=C1)Cl	{1: 1, 41: 1, 14: 2, 17: 1}
Did not match all atoms present	14346-19-1	C1=CC2=NSC(=C2C=C1[N+](=O)[O-])N	{38: 1, 41: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	14348-40-4	C1=C(C(=C(C(=C1Br)O)Br)C(=O)O)Br	{18: 3, 27: 1, 21: 1, 14: 1}
Did not match all atoms present	14349-67-8	[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2]	{17: 4}
Did not match all atoms present	1435-43-4	C1=C(C=C(C=C1F)Cl)F	{16: 2, 17: 1, 14: 3}
Did not match all atoms present	1435-44-5	C1=CC(=C(C=C1F)F)Cl	{16: 2, 17: 1, 14: 3}
Did not match all atoms present	1435-46-7	C1=C(C=C(C=C1Cl)Cl)F	{16: 1, 17: 2, 14: 3}
Did not match all atoms present	1435-48-9	C1=CC(=C(C=C1Cl)Cl)F	{16: 1, 17: 2, 14: 3}
Did not match all atoms present	1435-49-0	C1=CC(=C(C=C1F)Cl)Cl	{16: 1, 17: 2, 14: 3}
Did not match all atoms present	1435-50-3	C1=CC(=C(C=C1Cl)Br)Cl	{17: 2, 18: 1, 14: 3}
Did not match all atoms present	1435-51-4	C1=C(C=C(C=C1Br)Br)F	{16: 1, 18: 2, 14: 3}
Did not match all atoms present	1435-52-5	C1=CC(=C(C=C1Br)F)Br	{16: 1, 18: 2, 14: 3}
Did not match all atoms present	1435-53-6	C1=CC(=C(C=C1Br)Br)F	{16: 1, 18: 2, 14: 3}
Did not match all atoms present	1435-55-8	CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)O	{1: 2, 2: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	1435-60-5	C1=CC(=O)C=CC1=NNC2=CC=C(C=C2)[N+](=O)[O-]	{34: 1, 38: 1, 14: 8, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	1435-68-3	CC1=C/C(=N/NC2=CC=C(C=C2)[N+](=O)[O-])/C(=O)C=C1	{1: 1, 34: 1, 38: 1, 14: 7, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	1435-71-8	CC1=C/C(=N/NC2=CC=CC=C2[N+](=O)[O-])/C(=O)C=C1	{1: 1, 34: 1, 38: 1, 14: 7, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	14350-75-5	CCCCCCCCCC(CCCCCCCC(=O)OCCCC)OS(=O)(=O)[O-].[Na+]	{1: 2, 2: 18, 3: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	14350-94-8	CCCCCCCCCC1=NCC[N+]1(CCO)CC(=O)[O-].[OH-].[Na+]	{1: 1, 2: 11, 35: 1, 11: 2, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	14351-59-8	CCCCCCCCCCCCCCCCCC(=O)NCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 18, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	14351-66-7	CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)[O-])C.[Na+]	{1: 4, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 24: 1}
Did not match all atoms present	14352-51-3	C1=CC=C2C(=C1)C(=NC2=O)N	{25: 1, 35: 1, 30: 1, 14: 4, 15: 1}
Did not match all atoms present	14354-56-4	C1=CC=C(C=C1)[Hg]OC2=CC=CC3=C2N=CC=C3	{35: 1, 22: 1, 14: 11}
Did not match all atoms present	14354-59-7	CC(=O)C=C(C(F)(F)F)[O-].CC(=O)C=C(C(F)(F)F)[O-].CC(=O)C=C(C(F)(F)F)[O-].[Al+3]	{1: 3, 4: 3, 6: 3, 7: 3, 16: 9, 24: 3}
Did not match all atoms present	143545-90-8	C[C@H]1[C@H](C[C@@H]2C[C@@H](NC3=NC[C@H]1N23)[C@@H](C4=CC(=O)NC(=O)N4)O)OS(=O)(=O)O	{32: 3, 1: 1, 3: 1, 33: 1, 11: 3, 12: 5, 14: 1, 15: 1, 35: 1, 20: 2, 22: 1, 25: 2, 29: 2}
Did not match all atoms present	14355-21-6	B(Br)(I)I	{18: 1, 19: 2}
Did not match all atoms present	14355-67-0	CC[Si](CC)CC.CC[Sn](CC)CC	{1: 6, 2: 6}
Did not match all atoms present	14356-65-1	CCCCCCCCC(CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC(CCCCCCCC)OS(=O)(=O)[O-])OC(=O)CCCCCCCCC(CCCCCCCC)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 3, 2: 47, 3: 4, 22: 3, 28: 3, 29: 9}
Did not match all atoms present	143562-57-6	CC1=CC=CC=C1C2OCC(CO2)O	{1: 1, 11: 2, 12: 2, 14: 4, 20: 1, 23: 2}
Did not match all atoms present	143563-20-6	C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]\2C[C@H]3[C@@H]([C@H](C[C@](O3)(C[C@H](C[C@H](C[C@H](C[C@H](CC(=O)C[C@H](CC(=O)OC(C(/C=C/C=C/C=C\C=C/C=C/C=C/C=C2)C)[C@@H](C)CCC(CC(=O)C4=CC=C(C=C4)NC)O)O)O)O)O)O)O)O)C(=O)NCCN(C)C)O)NC(=O)CN(C)C)O.C([C@@H](C(=O)O)N)C(=O)O.C([C@@H](C(=O)O)N)C(=O)O	{1: 8, 2: 8, 3: 4, 33: 2, 11: 9, 12: 16, 13: 1, 14: 18, 20: 10, 22: 1, 23: 2, 24: 3, 25: 1, 27: 4, 28: 1, 30: 2, 31: 3}
Did not match all atoms present	1436-43-7	C1=CC=C2C(=C1)C=CC(=N2)C#N	{35: 1, 37: 1, 14: 6}
Did not match all atoms present	14360-50-0	CCCCCC(=O)C1=CC=CO1	{24: 1, 1: 1, 2: 4, 14: 3, 23: 1}
Did not match all atoms present	14362-12-0	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)O	{1: 12, 2: 1, 4: 4, 21: 2, 14: 4}
Did not match all atoms present	143621-35-6	C1=CC(=C(N=C1)C=NNC(=S)N)N	{34: 1, 35: 1, 6: 1, 7: 1, 14: 3, 30: 2, 31: 1}
Did not match all atoms present	14363-14-5	CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Zn]	{1: 12, 4: 4, 6: 2, 7: 2, 20: 2, 24: 2}
Did not match all atoms present	14364-93-3	[CH3-].[CH3-].[CH3-].I[Pt]	{19: 1}
Did not match all atoms present	14368-49-1	C1=CC(=CC=C1[N+]#N)[N+](=O)[O-]	{34: 1, 38: 1, 14: 4}
Did not match all atoms present	1437-15-6	C1=CC=NC(=C1)C=CC2=CC=CC=N2	{35: 2, 14: 8, 6: 2}
Did not match all atoms present	14370-23-1	C1CC2CC1CC2N=C=S	{8: 1, 34: 1, 11: 4, 12: 3}
Did not match all atoms present	14371-82-5	C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])S	{16: 3, 4: 1, 38: 1, 14: 3, 39: 1}
Did not match all atoms present	14371-84-7	COC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)OC)[N+](=O)[O-])[N+](=O)[O-]	{40: 2, 1: 2, 38: 2, 22: 2, 14: 6}
Did not match all atoms present	143715-88-2	CN(C)CCCNC1=C2C=CC(=CC2=NC3=CC=CC=C31)[N+](=O)[O-]	{1: 2, 2: 3, 35: 1, 38: 1, 33: 1, 14: 7, 31: 1}
Did not match all atoms present	143716-16-9	CC(C)C1=CC(=C(C(=C1)C(=O)O)[O-])C(C)C.C1=CC=C(C=C1)[Sn+](C2=CC=CC=C2)C3=CC=CC=C3	{27: 1, 1: 4, 3: 2, 14: 17}
Did not match all atoms present	14373-91-2	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Dy+3].[Dy+3]	{29: 12}
Did not match all atoms present	143731-32-2	CC[C@@H](COS(=O)(=O)C1=CC=C(C=C1)C)O	{1: 2, 2: 2, 3: 1, 14: 4, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	14374-45-9	CCCCCC#CC1=CC=CC=C1	{1: 1, 2: 4, 10: 2, 14: 5}
Did not match all atoms present	14374-77-7	[O-][Si]([O-])([O-])[O-].[Zn+2].[Zn+2]	{29: 4}
Did not match all atoms present	14374-92-6	CC=CC1=C(C=CC(=C1)C(C)C)C	{1: 4, 3: 1, 14: 3, 6: 2}
Did not match all atoms present	14377-68-5	C1CC(C1)(C#N)C2=CC=CC=C2	{11: 3, 13: 1, 14: 5, 37: 1}
Did not match all atoms present	1438-16-0	C1C(=O)N(C(=S)S1)N	{33: 1, 41: 1, 11: 1, 15: 1, 25: 1, 30: 1}
Did not match all atoms present	1438-25-1	C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)N/C=C\3/C=CC=CC3=O	{33: 1, 6: 2, 41: 1, 14: 9, 15: 3, 25: 2, 31: 1}
Did not match all atoms present	1438-30-8	CN1C=C(C(=C1)NC(=O)C2=CC(=CN2C)NC(=O)CN=C(N)N)C(=O)NCCC(=N)N	{1: 2, 2: 3, 36: 1, 33: 2, 7: 2, 34: 1, 14: 4, 24: 3, 30: 3, 31: 3}
Did not match all atoms present	1438-74-0	C=CP(=O)(Cl)Cl	{17: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	1438-79-5	C[Si](C)(C)O[Si](C)(C)C=C	{1: 5, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	1438-82-0	C[Si](C)O[Si](C)(C)C	{1: 5, 22: 1}
Did not match all atoms present	1438-86-4	C[Si]1(O[Si](O[Si](O1)(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C	{1: 2, 14: 20, 23: 3}
Did not match all atoms present	1438-91-1	CSCC1=CC=CO1	{40: 1, 1: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	1438-92-2	CC(=O)C(=O)C1=CC=CO1	{24: 2, 1: 1, 14: 3, 23: 1}
Did not match all atoms present	1438-94-4	C1=CN(C=C1)CC2=CC=CO2	{33: 1, 2: 1, 14: 7, 23: 1}
Did not match all atoms present	143800-06-0	CC1=CC=C(N1NC=O)C	{1: 2, 26: 1, 33: 1, 14: 2, 31: 1}
Did not match all atoms present	143800-07-1	CC1=CC=C(N1N(C)C=O)C	{1: 3, 26: 1, 14: 2, 33: 2}
Did not match all atoms present	14383-50-7	O=S([O-])([O-])=S	{29: 3}
Did not match all atoms present	14383-60-9	CC(CC1=CC=CC=C1)NC(=O)C	{1: 2, 2: 1, 3: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	143843-76-9	C(CN(CC(=O)[O-])CC(=O)[O-])C(=O)[O-].[K+]	{24: 3, 33: 1, 2: 4}
Did not match all atoms present	143879-80-5	C1=CC(=C(C(=C1C#N)F)F)F	{16: 3, 37: 1, 14: 2}
Did not match all atoms present	1439-36-7	CC(=O)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{24: 1, 1: 1, 14: 15, 6: 1}
Did not match all atoms present	1439-41-4	C(CP(=O)(CCC#N)CCC#N)C#N	{2: 6, 29: 1, 37: 3}
Did not match all atoms present	143984-56-9	CC1(CCCCC1)C2=C(C=CC(=C2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)O)OC	{1: 2, 11: 5, 13: 1, 14: 9, 22: 1, 27: 1}
Did not match all atoms present	144-00-3	CCCCCCC1(C(=O)NC(=NC1=O)[O-])CC.[Na+]	{32: 1, 1: 2, 2: 6, 35: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	144-02-5	CCC1(C(=O)NC(=NC1=O)[O-])CC.[Na+]	{32: 1, 1: 2, 2: 2, 35: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	144-11-6	C1CCC(CC1)C(CCN2CCCCC2)(C3=CC=CC=C3)O	{33: 1, 2: 2, 4: 1, 11: 10, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	144-12-7	C[N+]1(CCOCC1)CCC(C2=CC=CC=C2)(C3=CC=CS3)O.[I-]	{1: 1, 2: 2, 4: 1, 41: 1, 11: 4, 14: 8, 19: 1, 20: 1, 23: 1}
Did not match all atoms present	144-14-9	CCOC(=O)C1(CCN(CC1)CCC2=CC=C(C=C2)N)C3=CC=CC=C3	{1: 1, 2: 3, 33: 1, 11: 4, 13: 1, 14: 9, 28: 1, 30: 1}
Did not match all atoms present	144-21-8	C[As](=O)([O-])[O-].[Na+].[Na+]	{1: 1, 29: 3}
Did not match all atoms present	144-33-2	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)O)O.[Na+].[Na+]	{24: 2, 20: 1, 2: 2, 27: 1, 4: 1}
Did not match all atoms present	144-34-3	CN(C)C(=S)S[Se](SC(=S)N(C)C)(SC(=S)N(C)C)SC(=S)N(C)C	{40: 4, 1: 8, 33: 4, 7: 4}
Did not match all atoms present	144-35-4	C1C2(COP(O1)OC3=CC=CC=C3)COP(OC2)OC4=CC=CC=C4	{22: 2, 11: 4, 13: 1, 14: 10, 23: 4}
Did not match all atoms present	144-41-2	COP(=S)(OC)SCC(=O)N1CCOCC1	{1: 2, 2: 1, 33: 1, 40: 1, 11: 4, 22: 2, 23: 1, 24: 1}
Did not match all atoms present	144-55-8	C(=O)(O)[O-].[Na+]	{27: 1}
Did not match all atoms present	144-74-1	C1=CC(=CC=C1N)S(=O)(=O)[N-]C2=NC=CS2.[Na+]	{34: 1, 35: 1, 41: 1, 14: 6, 29: 2, 30: 1}
Did not match all atoms present	144-79-6	C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)Cl	{1: 1, 14: 10, 17: 1}
Did not match all atoms present	144-80-9	CC(=O)NS(=O)(=O)C1=CC=C(C=C1)N	{1: 1, 14: 4, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	144-82-1	CC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 2, 41: 1, 14: 4, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	144-83-2	C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{30: 1, 35: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	1440-97-7	CN(C)P(=O)(N(C)C)OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 4, 33: 2, 29: 1, 22: 1, 17: 5}
Did not match all atoms present	14400-94-3	C1=C(C(=C(C(=C1Br)Br)Br)O)Br	{18: 4, 21: 1, 14: 1}
Did not match all atoms present	14401-73-1	CC(=O)C1=CC(=CC(=C1)Br)Br	{24: 1, 1: 1, 18: 2, 14: 3}
Did not match all atoms present	14401-91-3	CC1=CC=CC=[NH+]1.[Cl-]	{32: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	14402-21-2	CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1C.[Cl-]	{1: 2, 2: 15, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	14402-67-6	C(=O)(C(=O)[O-])[O-].O.O.[K+].[Ti+4]	{24: 2}
Did not match all atoms present	14402-73-4	[Li+].[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Pt+2]	{}
Did not match all atoms present	14402-75-6	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[Cd+2]	{}
Did not match all atoms present	144025-03-6	B(C1=C(C=C(C=C1)F)F)(O)O	{16: 2, 20: 2, 14: 3}
Did not match all atoms present	14405-45-9	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[In+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	14405-49-3	C1=CC=C(C=C1)/C(=C\C(=O)C2=CC=CC=C2)/[O-].C1=CC=C(C=C1)/C(=C/C(=O)C2=CC=CC=C2)/[O-].C1=CC=C(C=C1)/C(=C/C(=O)C2=CC=CC=C2)/[O-].[Fe+3]	{24: 3, 14: 30, 6: 3, 7: 3}
Did not match all atoms present	14406-57-6	CC[NH+](CC)CCOC1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)NC3=CC=CC=C3.[Cl-]	{1: 2, 2: 4, 3: 1, 14: 14, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	14406-66-7	C1=CC=C2C(=C1)C=CC(=C2N=O)[O-].C1=CC=C2C(=C1)C=CC(=C2N=O)[O-].[Ni+2]	{34: 2, 29: 2, 14: 12}
Did not match all atoms present	14406-71-4	C1=CC=C(C(=C1)N/C=C/2\C(=O)C=CC=C2)N/C=C/3\C(=O)C=CC=C3.[Ni]	{25: 2, 31: 2, 14: 12, 6: 2, 15: 2}
Did not match all atoms present	14408-19-6	CCN(CC[N+]1=CC=CC=C1)C2=CC=CC=C2.[Cl-]	{1: 1, 2: 3, 33: 2, 14: 10, 17: 1}
Did not match all atoms present	14408-21-0	CCN(CC[N+]1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NC=C(S3)[N+](=O)[O-].[Cl-]	{1: 1, 2: 3, 35: 1, 38: 1, 33: 2, 41: 1, 34: 2, 14: 10, 17: 1}
Did not match all atoms present	1441-02-7	CC(=O)OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 1, 28: 1, 17: 5}
Did not match all atoms present	1441-22-1	C1=CC=C(C=C1)S[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{40: 1, 14: 20}
Did not match all atoms present	1441-56-1	[1H]C(=C([1H])C(=C([1H])[1H])[1H])[1H]	{5: 2, 6: 2}
Did not match all atoms present	1441-87-8	C1=CC=C(C(=C1)C(=O)Cl)O	{24: 1, 17: 1, 21: 1, 14: 4}
Did not match all atoms present	1441-99-2	CC(=O)C1=CC(=CC=C1)SC	{24: 1, 1: 2, 14: 4, 40: 1}
Did not match all atoms present	14411-56-4	CCC1=CC(=CC=C1)C(C)(C)C	{1: 4, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	14411-75-7	CC1=C(C(=CC=C1)C)C(C)C	{1: 4, 3: 1, 14: 3}
Did not match all atoms present	14415-44-2	C1=CC2=C(C=CC(=O)O2)C=C1N	{28: 1, 30: 1, 14: 5}
Did not match all atoms present	14415-66-8	C1COCC[NH+]1CCN2C=CC=C2C(=O)C3=CC=C(C=C3)Cl.[Cl-]	{33: 1, 2: 2, 11: 4, 14: 7, 17: 2, 23: 1, 24: 1}
Did not match all atoms present	14417-88-0	CCCCC/C=C/C/C=C/CCCCCCCC(=O)NC(C)C1=CC=CC=C1	{1: 2, 2: 12, 3: 1, 6: 4, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	14417-90-4	CCCCCCCCCC1=CC(=C(C=C1)O)C	{1: 2, 2: 8, 21: 1, 14: 3}
Did not match all atoms present	14418-26-9	CC12CN(P(N(C1)C)N(C2)C)C	{1: 4, 11: 3, 13: 1, 33: 3}
Did not match all atoms present	14418-80-5	CCC1=CN=C(C=C1NC2CCCCC2)C3=NN=CO3	{1: 1, 2: 1, 35: 3, 11: 5, 12: 1, 14: 3, 23: 1, 31: 1}
Did not match all atoms present	144194-96-7	C1C[C@H]2CN(C[C@H]2NC1)C3=C(C=C4C(=C3Cl)N(C=C(C4=O)C(=O)O)C5CC5)F	{32: 1, 33: 2, 11: 7, 12: 3, 14: 2, 16: 1, 17: 1, 25: 1, 27: 1}
Did not match all atoms present	144222-34-4	CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C2=CC=CC=C2)[C@@H](C3=CC=CC=C3)N	{1: 1, 3: 2, 14: 14, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	14425-64-0	COC1=CC=C(C=C1)CCBr	{1: 1, 2: 2, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	14426-25-6	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C	{1: 6, 15: 2, 33: 3, 14: 12, 7: 1}
Did not match all atoms present	14428-08-1	CCCCC(CC)CN(CC(CC)CCCC)C(=S)[S-].CCCCC(CC)CN(CC(CC)CCCC)C(=S)[S-].[Ni+2]	{1: 8, 2: 20, 3: 4, 33: 2, 7: 2}
Did not match all atoms present	144284-25-3	C1=C(C(=CC(=C1F)F)F)CO	{16: 3, 2: 1, 20: 1, 14: 2}
Did not match all atoms present	1443-44-3	CCC(=O)N(C1CCN(CC1)C(C)CC2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 2: 2, 3: 1, 33: 2, 11: 4, 12: 1, 14: 10, 24: 1}
Did not match all atoms present	1443-76-1	COC1=CC(=CC(=C1O)OC)C(=O)NN	{1: 2, 14: 2, 21: 1, 22: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	1443-80-7	CC(=O)C1=CC=C(C=C1)C#N	{24: 1, 1: 1, 37: 1, 14: 4}
Did not match all atoms present	14430-23-0	COC1=C(C=C2C(=C1)C=CN2)OC	{32: 1, 1: 2, 22: 2, 14: 4}
Did not match all atoms present	14432-12-3	C1=CN=C(C=C1N)Cl	{17: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	14434-47-0	CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.[Cr]	{1: 18, 4: 6, 6: 3, 7: 3, 20: 3, 24: 3}
Did not match all atoms present	14434-67-4	C1CCCN(CC1)C(=S)[S-].C1CCCN(CC1)C(=S)[S-].[Ni+2]	{33: 2, 11: 12, 7: 2}
Did not match all atoms present	14435-27-9	CC1C(C(CC(O1)OC2C(OC(CC2OC=O)OC3C(OC(CC3OC=O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)OC=O)OC=O	{1: 5, 11: 13, 12: 17, 13: 3, 14: 1, 15: 1, 20: 1, 22: 3, 23: 3, 26: 4, 28: 1}
Did not match all atoms present	14437-17-3	COC(=O)C(CC1=CC=C(C=C1)Cl)Cl	{1: 1, 2: 1, 3: 1, 14: 4, 17: 2, 28: 1}
Did not match all atoms present	14437-41-3	CC(=O)OC1=C(C=C(C=C1C(=O)NC2=CC=C(C=C2)Cl)I)I	{1: 1, 14: 6, 17: 1, 19: 2, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	14437-46-8	C1=CC(=CC=C1NC(=O)C2=CC(=CC(=C2O)I)I)Cl	{14: 6, 17: 1, 19: 2, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	14438-32-5	CC1=CC(=C(C(=C1)C(=O)O)N)C	{1: 2, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	14439-61-3	CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=C(C=C3)Cl	{1: 1, 35: 1, 33: 1, 11: 1, 14: 7, 15: 1, 17: 2, 25: 1}
Did not match all atoms present	1444-64-0	C1CCC(C(C1)C2=CC=CC=C2)O	{20: 1, 11: 4, 12: 2, 14: 5}
Did not match all atoms present	1444-65-1	C1CCC(=O)C(C1)C2=CC=CC=C2	{25: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	14442-19-4	C(#N)C#[N+][O-]	{34: 1, 29: 1, 37: 1}
Did not match all atoms present	14442-48-9	CCC(=C(C#N)C(=O)OCC)C1=CC=CC=C1	{1: 2, 2: 2, 37: 1, 7: 2, 14: 5, 28: 1}
Did not match all atoms present	144429-21-0	C=COCCCCOC(=O)C1=CC=CC=C1	{2: 4, 5: 1, 6: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	144437-67-2	O.[Ti].[Co].[W]	{}
Did not match all atoms present	14444-77-0	CCOC(OCC)OC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 22: 3, 14: 5}
Did not match all atoms present	14445-60-4	CN(C)P(=O)(C#N)N(C)C	{1: 4, 37: 1, 29: 1, 33: 2}
Did not match all atoms present	14446-13-0	O.O.O.[O-][Mn](=O)(=O)=O.[O-][Mn](=O)(=O)=O.[Sr+2]	{29: 8}
Did not match all atoms present	14447-89-3	O=[W]=O.I.I	{19: 2, 29: 2}
Did not match all atoms present	14448-18-1	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Ni+2].[Ni+2]	{29: 6, 22: 1}
Did not match all atoms present	14448-67-0	CN\1C2=CC=CC=C2S/C1=N\N.O.Cl	{1: 1, 34: 1, 33: 1, 41: 1, 14: 4, 17: 1, 30: 1}
Did not match all atoms present	14449-97-9	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])N	{25: 2, 38: 2, 30: 1, 14: 9, 31: 1}
Did not match all atoms present	1445-19-8	C1=CC=C(C=C1)NC2=CC=CC3=C2C(=CC=C3)S(=O)(=O)[O-].[Na+]	{29: 3, 14: 11, 31: 1}
Did not match all atoms present	1445-23-4	CC1=CC(=C(C=C1C)O)C(C)(C)C	{1: 5, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	1445-28-9	CC1(C(=NC2=CC=CC=C2)C(C1=NC3=CC=CC=C3)(C)C)C	{1: 4, 34: 2, 13: 2, 14: 10, 15: 2}
Did not match all atoms present	1445-29-0	CC1(C(=NC2=CC=CC=C2)C(C1=O)(C)C)C	{1: 4, 34: 1, 13: 2, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	1445-38-1	CCOP(=O)(NC1=CC=CC=C1)OCC	{1: 2, 2: 2, 14: 5, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	1445-69-8	C1=CC=C2C(=C1)C(=O)NNC2=O	{32: 2, 25: 2, 14: 4}
Did not match all atoms present	1445-75-6	CC(C)OP(=O)(C)OC(C)C	{1: 5, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	1445-79-0	C[Ga](C)C	{1: 3}
Did not match all atoms present	1445-91-6	C[C@@H](C1=CC=CC=C1)O	{1: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	14452-30-3	CC(=O)C1=CC(=CC=C1)I	{24: 1, 1: 1, 19: 1, 14: 4}
Did not match all atoms present	14452-34-7	CC1=CC(=C(C(=C1)[N+](=O)[O-])O)C	{1: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	14452-39-2	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Al+3]	{17: 3, 29: 12}
Did not match all atoms present	14452-59-6	[Li][Li]	{}
Did not match all atoms present	14452-64-3	[BH2]	{}
Did not match all atoms present	14452-76-7	[H-].[Mn]	{}
Did not match all atoms present	14452-81-4	[PbH2]	{}
Did not match all atoms present	14452-93-8	N#[O+]	{29: 1}
Did not match all atoms present	144528-14-3	CN(C)C1=CC=C(C=C1)/C=C/C2=NC3=CC=CC=C3S2	{1: 2, 35: 1, 6: 2, 33: 1, 41: 1, 14: 8}
Did not match all atoms present	14453-97-5	CC1=CC2=C(C=C1C)N(C3C(=N2)C(=O)N(C(=O)N3C)C)C	{1: 5, 35: 1, 33: 3, 12: 1, 14: 2, 15: 1, 25: 2}
Did not match all atoms present	14455-34-6	C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)O.[Na+]	{20: 1, 29: 5, 14: 6}
Did not match all atoms present	14456-47-4	[Br-].[Br-].[Br-].[Tb+3]	{18: 3}
Did not match all atoms present	14456-53-2	[Br-].[Br-].[Br-].[Lu+3]	{18: 3}
Did not match all atoms present	14457-64-8	O=[Al]	{29: 1}
Did not match all atoms present	14457-70-6	Cl[Se]Cl	{17: 2}
Did not match all atoms present	14457-85-3	B=S	{}
Did not match all atoms present	14457-87-5	[Br-].[Br-].[Br-].[Ce+3]	{18: 3}
Did not match all atoms present	144584-67-8	C1=CC(=C(C(=C1)Br)F)C(F)(F)F	{16: 4, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	14459-29-1	CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)C(C)O)C)C(=C4CCC(=O)O)C)C(=C3C)CCC(=O)O)C(C)O	{32: 2, 1: 6, 2: 4, 3: 2, 14: 4, 35: 2, 20: 2, 27: 2}
Did not match all atoms present	14459-33-7	CC(=O)/C=C(\O)/C1=CC=CC=C1.CC(=O)/C=C(\O)/C1=CC=CC=C1.CC(=O)/C=C(\O)/C1=CC=CC=C1.[Eu]	{1: 3, 6: 3, 7: 3, 14: 15, 20: 3, 24: 3}
Did not match all atoms present	1446-17-9	CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl.OP(=O)(O)O	{1: 3, 2: 5, 3: 1, 33: 1, 14: 5, 17: 1, 35: 1, 20: 3, 29: 1, 31: 1}
Did not match all atoms present	1446-34-0	C1=CC=C2C(=C1)C(=CC=C2O)C3=CC=C(C4=CC=CC=C43)O	{21: 2, 14: 12}
Did not match all atoms present	1446-61-3	CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)CN)C	{1: 4, 2: 1, 3: 1, 11: 5, 12: 1, 13: 2, 14: 3, 30: 1}
Did not match all atoms present	14460-02-7	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Fe+2].[Fe+2]	{}
Did not match all atoms present	14461-87-1	CC(=O)N(C1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)O)O	{1: 1, 33: 1, 11: 1, 14: 6, 20: 1, 21: 1, 24: 1}
Did not match all atoms present	14464-10-9	C1=CC=C(C=C1)COC(=O)CCO	{28: 1, 2: 3, 20: 1, 14: 5}
Did not match all atoms present	14464-47-2	[2H+]	{}
Did not match all atoms present	14465-96-4	C1CN1P(=S)(N)N2CC2	{33: 2, 11: 4, 30: 1}
Did not match all atoms present	14468-90-7	C[Si](C)(C)N1CCCC1=O	{1: 3, 11: 3, 33: 1, 25: 1}
Did not match all atoms present	14470-28-1	COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Cl	{1: 1, 4: 1, 22: 1, 14: 14, 17: 1}
Did not match all atoms present	14472-14-1	CC1=C(C=CC(=C1)O)Br	{1: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	14474-33-0	[Sc+3].[I-].[I-].[I-]	{19: 3}
Did not match all atoms present	14474-71-6	CC(C)C1C(=O)NC(C(=O)N1)CC2=CC=CC=C2	{32: 2, 1: 2, 2: 1, 3: 1, 12: 2, 14: 5, 25: 2}
Did not match all atoms present	14474-78-3	CC1C(=O)NC(C(=O)N1)CC2=CC=CC=C2	{32: 2, 1: 1, 2: 1, 12: 2, 14: 5, 25: 2}
Did not match all atoms present	14475-18-4	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Nd+3].[Nd+3]	{24: 3}
Did not match all atoms present	14475-38-8	O[Si]	{20: 1}
Did not match all atoms present	14475-98-0	CCCCCCCC/C=C\CCCCCCCC(=O)OCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 16, 6: 2, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	14476-01-8	CC1=CC=CC=C1C2=CC=CC3=CC=CC=C32	{1: 1, 14: 11}
Did not match all atoms present	144761-93-3	CC(CC=NC1=CC=CC=C1C(=O)OC)C2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 6: 1, 34: 1, 14: 9, 28: 1}
Did not match all atoms present	14477-72-6	O=C([O-])C(F)(F)F	{16: 3, 24: 1, 4: 1}
Did not match all atoms present	1448-16-4	CCCC(C(=C[N+]#N)[O-])C(=C[N+]#N)[O-]	{1: 1, 2: 2, 3: 1, 6: 2, 7: 2, 34: 2}
Did not match all atoms present	1448-87-9	C1=CC=C2C(=C1)N=CC(=N2)Cl	{17: 1, 35: 2, 14: 5}
Did not match all atoms present	14481-08-4	CC(C)(C)/C(=C\C(=O)C(C)(C)C)/O.CC(C)(C)/C(=C/C(=O)C(C)(C)C)/O.[Ni]	{1: 12, 4: 4, 6: 2, 7: 2, 20: 2, 24: 2}
Did not match all atoms present	14481-29-9	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[NH4+].[NH4+].[NH4+].[NH4+].[Fe+2]	{}
Did not match all atoms present	14483-17-1	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Pr+3]	{}
Did not match all atoms present	14483-18-2	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Ho+3]	{}
Did not match all atoms present	14483-19-3	O[Si](=O)O.[Mg].[Ca]	{20: 2, 29: 1}
Did not match all atoms present	14484-64-1	CN(C)C(=S)[S-].CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Fe+3]	{1: 6, 33: 3, 7: 3}
Did not match all atoms present	14484-69-6	F[Al-](F)(F)F.[K+]	{16: 4}
Did not match all atoms present	14485-20-2	[Li+].[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{14: 20}
Did not match all atoms present	14485-39-3	[Al+3].[OH-].[OH-].[OH-].[OH-]	{}
Did not match all atoms present	144851-61-6	C1=CC(=C(C(=C1)F)N)C(F)(F)F	{16: 4, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	14486-19-2	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Cd+2]	{16: 8}
Did not match all atoms present	14486-20-5	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Sb+3]	{16: 12}
Did not match all atoms present	14487-05-9	CC1C=CC=C(C(=O)NC2=CC3(C4=C5C(=C(C(=C4C2=O)O)C)OC(C5=O)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)OCC(=O)O3)C	{32: 1, 1: 9, 11: 1, 12: 8, 13: 2, 14: 6, 15: 2, 20: 2, 21: 1, 22: 1, 23: 3, 25: 3, 28: 2}
Did not match all atoms present	14488-85-8	CCCCCCCC/C=C\CCCCCCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 18, 6: 2}
Did not match all atoms present	144896-51-5	CC1=CC(=CC(=C1OCC2=CC=CC=C2)C)C=O	{1: 2, 2: 1, 26: 1, 22: 1, 14: 7}
Did not match all atoms present	1449-46-3	C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{2: 1, 18: 1, 14: 20}
Did not match all atoms present	1449-55-4	C1CCC(CC1)[Sn](C2CCCCC2)(C3CCCCC3)C4CCCCC4	{11: 20, 12: 4}
Did not match all atoms present	1449-64-5	C[GeH2]C	{1: 2}
Did not match all atoms present	1449-65-6	C[GeH3]	{1: 1}
Did not match all atoms present	1449-67-8	C1=C[Se]C(=C1)Cl	{17: 1, 14: 3}
Did not match all atoms present	1449-68-9	C1=C[Se]C(=C1)Br	{18: 1, 14: 3}
Did not match all atoms present	1449-91-8	CC12COP(OC1)OC2	{1: 1, 11: 3, 13: 1, 23: 3}
Did not match all atoms present	14491-01-1	CC1=CS1(=O)=O	{1: 1, 29: 2, 14: 1, 15: 1}
Did not match all atoms present	14492-59-2	C(=O)([O-])[O-].[OH-].[OH-].[OH-].[Mg+2].[Al+3]	{24: 1}
Did not match all atoms present	14493-01-7	[Br-].[Br-].[Br-].[Br-].[Pt+2]	{18: 4}
Did not match all atoms present	14495-51-3	CC1=C(C=CC(=C1)Cl)Br	{1: 1, 18: 1, 14: 3, 17: 1}
Did not match all atoms present	14496-35-6	CC1=CC=C(O1)CN(C)C	{1: 3, 2: 1, 33: 1, 14: 2, 23: 1}
Did not match all atoms present	14497-03-1	C1=CC(=CC=C1N)S(=O)(=O)N(CCC(=O)N)CCC(=O)N	{33: 1, 2: 4, 14: 4, 24: 2, 29: 2, 30: 3}
Did not match all atoms present	14497-29-1	C1=COC=C1CCl	{17: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	145-39-1	CC1=C(C(=C(C(=C1C)[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])C	{1: 6, 4: 1, 38: 2}
Did not match all atoms present	145-41-5	C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@@H]3[C@@H]2C(=O)C[C@@H]4[C@@]3(CCC(=O)C4)C)C	{1: 3, 2: 2, 3: 1, 11: 7, 12: 5, 13: 2, 24: 1, 25: 3}
Did not match all atoms present	145-42-6	CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[Na+]	{1: 3, 2: 4, 3: 1, 11: 7, 12: 8, 13: 2, 20: 3, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	145-48-2	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)S(=O)(=O)O)O	{25: 2, 20: 1, 21: 2, 14: 5, 29: 2}
Did not match all atoms present	145-49-3	C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)N)O)O	{25: 2, 30: 2, 21: 2, 14: 4}
Did not match all atoms present	145-50-6	C1=CC=C(C=C1)C(=C2C=CC(=O)C3=CC=CC=C23)C4=CC=C(C5=CC=CC=C54)O	{25: 1, 15: 1, 21: 1, 14: 17, 7: 1}
Did not match all atoms present	145-63-1	CC1=C(C=C(C=C1)C(=O)NC2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)NC(=O)C4=CC(=CC=C4)NC(=O)NC5=CC=CC(=C5)C(=O)NC6=C(C=CC(=C6)C(=O)NC7=C8C(=CC(=CC8=C(C=C7)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)C	{1: 2, 14: 22, 20: 6, 24: 5, 29: 12, 31: 6}
Did not match all atoms present	145-94-8	C1CC2=C(C=CC(=C2C1)Cl)O	{17: 1, 11: 3, 21: 1, 14: 2}
Did not match all atoms present	145-95-9	C1=NC2=C(N1)C(=S)N=CN2O	{32: 1, 33: 1, 35: 2, 21: 1, 14: 2}
Did not match all atoms present	1450-14-2	C[Si](C)(C)[Si](C)(C)C	{1: 6}
Did not match all atoms present	1450-16-4	C[Si](C)(C)[Si](C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 4, 14: 10}
Did not match all atoms present	1450-18-6	C[Si](C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 14: 15}
Did not match all atoms present	1450-23-3	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{14: 30}
Did not match all atoms present	1450-31-3	C1=CC=C(C=C1)C(=S)C2=CC=CC=C2	{14: 10, 7: 1}
Did not match all atoms present	1450-63-1	C1=CC=C(C=C1)C(=CC=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{14: 20, 6: 2, 7: 2}
Did not match all atoms present	1450-72-2	CC1=CC(=C(C=C1)O)C(=O)C	{24: 1, 1: 2, 21: 1, 14: 3}
Did not match all atoms present	1450-74-4	CC(=O)C1=C(C=CC(=C1)Cl)O	{24: 1, 1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	1450-85-7	C1=CNC(=S)N=C1	{32: 1, 35: 1, 14: 3}
Did not match all atoms present	14500-79-9	PI	{19: 1}
Did not match all atoms present	14500-81-3	FP	{16: 1}
Did not match all atoms present	14500-83-5	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)C5=NC6=C(S5)C(=C(C=C6)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 35: 2, 41: 2, 14: 12, 29: 6}
Did not match all atoms present	14500-84-6	P(=S)Cl	{17: 1}
Did not match all atoms present	14501-64-5	C1=CC=C2C(=C1)C3=CC(=C(C=C3N2)O)C(=O)O	{32: 1, 27: 1, 21: 1, 14: 6}
Did not match all atoms present	145022-44-2	CCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]	{1: 2, 2: 1, 4: 1, 33: 2, 14: 3, 16: 3, 29: 3}
Did not match all atoms present	145026-81-9	CCCOC1=NN(C(=O)N1C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC	{1: 3, 2: 2, 35: 1, 33: 2, 14: 4, 22: 1, 24: 1, 25: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	145026-88-6	CN1C(=NN(C1=O)C(=O)NS(=O)(=O)C2=CC=CC=C2OC(F)(F)F)OC	{1: 2, 35: 1, 4: 1, 33: 2, 14: 4, 16: 3, 22: 2, 24: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	145027-96-9	CCCOC1=NNC(=O)N1C	{32: 1, 1: 2, 2: 2, 35: 1, 33: 1, 22: 1, 25: 1}
Did not match all atoms present	14503-51-6	CC1=C(SC(=C1C)C)C	{1: 4, 41: 1}
Did not match all atoms present	14504-15-5	C1=CC=C(C=C1)C[N+]2=NOC(=C2CC(=O)N)[O-]	{33: 1, 2: 2, 35: 1, 14: 5, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	14507-19-8	O.O.O.[La]	{}
Did not match all atoms present	14508-49-7	C1=CN=C(C=N1)Cl	{17: 1, 35: 2, 14: 3}
Did not match all atoms present	1451-99-6	CC[Si]1(O[Si](O[Si](O[Si](O1)(CC)CC)(CC)CC)(CC)CC)CC	{1: 8, 2: 8, 23: 4}
Did not match all atoms present	145100-50-1	C1=CC=NC(=C1)N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F	{33: 1, 35: 1, 4: 2, 14: 4, 16: 6, 29: 4}
Did not match all atoms present	14511-33-2	C[Pb](C)(C)S[Pb](C)(C)C	{40: 1, 1: 6}
Did not match all atoms present	145129-54-0	COC(=O)C1=C(SC(=C1)Cl)Cl	{1: 1, 28: 1, 41: 1, 14: 1, 17: 2}
Did not match all atoms present	14515-39-0	O([Si](F)(F)F)[Si](F)(F)F	{16: 6, 22: 1}
Did not match all atoms present	14516-30-4	CCCN(CCC)C(=S)[S-].CCCN(CCC)C(=S)[S-].[Ni+2]	{1: 4, 2: 8, 33: 2, 7: 2}
Did not match all atoms present	14516-46-2	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[Pd+2]	{}
Did not match all atoms present	14519-07-4	[O-]Br(=O)=O.[O-]Br(=O)=O.[Zn+2]	{18: 2, 29: 6}
Did not match all atoms present	14519-17-6	[O-]Br(=O)=O.[O-]Br(=O)=O.[Mg+2]	{18: 2, 29: 6}
Did not match all atoms present	14519-18-7	[O-]Br(=O)=O.[O-]Br(=O)=O.[Sr+2]	{18: 2, 29: 6}
Did not match all atoms present	1452-15-9	C1=C(N=CS1)C#N	{41: 1, 35: 1, 37: 1, 14: 2}
Did not match all atoms present	1452-77-3	C1=CC=NC(=C1)C(=O)N	{24: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	14520-53-7	C=CCOC1=CC=CC=C1C(=O)N	{2: 1, 5: 1, 6: 1, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	14520-70-8	[NH4+].[O-]P(=O)([O-])[O-].[Cd+2]	{29: 4}
Did not match all atoms present	14521-14-3	F[Si](F)(F)[Si](F)(F)[Si](F)(F)F	{16: 8}
Did not match all atoms present	14521-96-1	CCCC(C)(C1C[C@@]23C=CC1(C4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)C)OC)O	{1: 4, 2: 2, 4: 1, 33: 1, 11: 4, 12: 3, 13: 3, 14: 4, 20: 1, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	145226-95-5	OS(=O)(=O)O.OS(=O)(=O)O.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{20: 4, 29: 8}
Did not match all atoms present	14523-22-9	C(=O)(Cl)Cl.[Rh]	{24: 1, 17: 2}
Did not match all atoms present	14523-25-2	CCCCCCCC1=NCC[N+]1(CCC(=O)O)CCOCCC(=O)O.[OH-]	{1: 1, 2: 12, 35: 1, 11: 2, 15: 1, 22: 1, 27: 2}
Did not match all atoms present	14525-25-8	O=[As]Cl	{17: 1, 29: 1}
Did not match all atoms present	14526-03-5	C(C(=O)[O-])Cl	{24: 1, 17: 1, 2: 1}
Did not match all atoms present	14527-26-5	CSC(=N)N.OS(=O)(=O)O	{1: 1, 36: 1, 7: 1, 40: 1, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	14527-51-6	CC1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C)C8=CC=C(C=C8)C)C9=CC=C(C=C9)C)N3	{32: 2, 1: 4, 35: 2, 14: 24}
Did not match all atoms present	14529-53-4	CCOC1=CC=CC=N1	{1: 1, 2: 1, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	14529-73-8	C1=CC=C2C=C3C4=C5C(=CC3=CC2=C1)C6=CC=CC7=C6C8=C(C=CC(=C58)C=C4)C9=CC1=CC=CC=C1C=C79	{14: 20}
Did not match all atoms present	1453-06-1	CC1=CC(=C(C=C1)C)CCCC(=O)O	{1: 2, 2: 3, 27: 1, 14: 3}
Did not match all atoms present	1453-58-3	CC1=CC=NN1	{32: 1, 1: 1, 35: 1, 14: 2}
Did not match all atoms present	1453-82-3	C1=CN=CC=C1C(=O)N	{24: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	14532-24-2	CCCCCCS(=O)(=O)Cl	{1: 1, 2: 5, 29: 2, 17: 1}
Did not match all atoms present	14533-63-2	CCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 2, 29: 3}
Did not match all atoms present	14533-84-7	C1(=C(C(=C(C(=C1F)F)F)F)F)OC(=O)C(F)(F)F	{16: 8, 28: 1, 4: 1}
Did not match all atoms present	14535-98-9	CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].[Ce+3]	{24: 3, 1: 3, 2: 30}
Did not match all atoms present	1454-80-4	C1=CC=C(C(=C1)C2=CC=CC=C2N)N	{30: 2, 14: 8}
Did not match all atoms present	14540-52-4	CC(C)(C)COP(OCC(C)(C)C)OCC(C)(C)C	{1: 9, 2: 3, 4: 3, 22: 3}
Did not match all atoms present	145401-57-6	CCCCCCC(CCCCCCCCCCC(=O)[O-])O.[Fe+3]	{24: 1, 1: 1, 2: 15, 3: 1, 20: 1}
Did not match all atoms present	145417-43-2	CNC1=CC2=C(C=C1)C(=O)/C(=N/NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=C2)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 1, 14: 9, 15: 2, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	145417-44-3	C=CC#N.C=CC1=CC=CC=C1.C1CC2C(O2)CC1COC(=O)C3CCC4C(C3)O4	{2: 1, 5: 2, 6: 2, 11: 6, 12: 6, 14: 5, 23: 2, 28: 1, 37: 1}
Did not match all atoms present	14542-71-3	CC1=C(C=C(C=C1Br)OC)Br	{1: 2, 18: 2, 22: 1, 14: 2}
Did not match all atoms present	14542-93-9	CC(C)(C)CC(C)(C)[N+]#[C-]	{1: 5, 2: 1, 4: 2, 34: 1}
Did not match all atoms present	14543-76-1	CC1=C(C=C(C=C1)CC(C)N)C.CC1=C(C=C(C=C1)CC(C)N)C.OS(=O)(=O)O	{1: 6, 2: 2, 3: 2, 14: 6, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	145432-51-5	C[C@H](C1=CC=CC=C1)[C@@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 4, 3: 2, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	14545-72-3	[N+](=O)([O-])OCl	{17: 1, 22: 1}
Did not match all atoms present	14546-38-4	CCC1=CC=C(C=C1)NO	{1: 1, 2: 1, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	14546-44-2	NNN=[N+]=[N-]	{34: 2, 30: 1, 31: 1}
Did not match all atoms present	14546-48-6	[Mn+3]	{}
Did not match all atoms present	14548-39-1	C1CC(=O)C2=C1C=CC(=C2)Br	{25: 1, 18: 1, 11: 2, 14: 3}
Did not match all atoms present	14548-46-0	C1=CC=C(C=C1)C(=O)C2=CC=NC=C2	{24: 1, 35: 1, 14: 9}
Did not match all atoms present	14548-47-1	COC1=CC=C(C=C1)C(=O)C2=CC=NC=C2	{24: 1, 1: 1, 35: 1, 22: 1, 14: 8}
Did not match all atoms present	14548-48-2	C1=CC(=CC=C1C(=O)C2=CC=NC=C2)Cl	{24: 1, 17: 1, 35: 1, 14: 8}
Did not match all atoms present	14548-85-7	C(=C/C(=O)O)\C(=O)O.N.N	{27: 2, 6: 2}
Did not match all atoms present	1455-13-6	[2H]OC	{1: 1, 20: 1}
Did not match all atoms present	1455-18-1	CC1=CSC2=CC=CC=C12	{1: 1, 14: 5, 41: 1}
Did not match all atoms present	1455-20-5	CCCCC1=CC=CS1	{1: 1, 2: 3, 14: 3, 41: 1}
Did not match all atoms present	1455-77-2	C1(=NC(=NN1)N)N	{32: 1, 35: 2, 30: 2}
Did not match all atoms present	14551-74-7	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].O.O.O.O.O.O.O.O.O.O.[Nd+3].[Nd+3]	{24: 6}
Did not match all atoms present	14552-35-3	C(CN)N.C(CN)N.[OH-].[OH-].[Cu+2]	{2: 4, 30: 4}
Did not match all atoms present	14553-09-4	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Pr+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	14556-13-9	CCC(C)C1=CC(=CC(=C1)O)C(C)CC	{1: 4, 2: 2, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	14557-50-7	CCN(CC)CCC(CC=C)(C1=CC=CC=C1)C(=O)OCC	{1: 3, 2: 6, 4: 1, 5: 1, 6: 1, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	1456-22-0	C1=CC=C(C=C1)C2=NC(=O)ON2	{32: 1, 35: 1, 28: 1, 14: 5}
Did not match all atoms present	1456-56-0	CC(=O)C(C(=O)C)N=NC1=CC=CC2=C1N=CC=C2	{1: 2, 34: 2, 3: 1, 14: 6, 35: 1, 24: 2}
Did not match all atoms present	14562-04-0	CC1=CC=C(C=C1)S(=O)(=O)OCC#N	{1: 1, 2: 1, 37: 1, 14: 4, 22: 1, 29: 2}
Did not match all atoms present	14564-35-3	[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Cl-].[Ru+2]	{17: 2, 29: 2, 14: 30}
Did not match all atoms present	14564-70-6	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[K+].[K+].[Co+2]	{}
Did not match all atoms present	14564-74-0	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].[K+]	{1: 1, 2: 11, 29: 3, 14: 4}
Did not match all atoms present	14567-52-3	O[Si](=O)O.[Ca+2]	{20: 2, 29: 1}
Did not match all atoms present	14567-90-9	O[Si](O)(O)O[Si](O)(O)O.[Mg+2].[Ca+2].[Ca+2]	{20: 6, 22: 1}
Did not match all atoms present	145679-05-6	[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Sb+3]	{}
Did not match all atoms present	145689-34-5	C1=CC(=C(C(=C1)F)F)CC#N	{16: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	1457-46-1	C1C(=O)N(C(=S)S1)C2=CC=CC=C2	{33: 1, 41: 1, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	1457-47-2	C=CCN1C(=O)CSC1=S	{33: 1, 2: 1, 5: 1, 6: 1, 41: 1, 11: 1, 15: 1, 25: 1}
Did not match all atoms present	1457-85-8	CCOC(=O)C(=O)NC1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	145703-76-0	CCCCCCCCCCCCNC1=NC(=NC(=N1)NC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 1, 2: 11, 35: 3, 34: 3, 14: 12, 15: 2, 17: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	14573-23-0	C1=CC(=C(C(=C1)Cl)CCN)Cl	{17: 2, 2: 2, 30: 1, 14: 3}
Did not match all atoms present	14575-84-9	C[C@@]12CC[C@@H]([C@@]1(C)CS(=O)(=O)[O-])[C@@H](C2=O)Br	{1: 2, 2: 1, 11: 2, 12: 2, 13: 2, 18: 1, 25: 1, 29: 3}
Did not match all atoms present	14579-03-4	C1CCC(C1)[Si](Cl)(Cl)Cl	{17: 3, 11: 4, 12: 1}
Did not match all atoms present	14579-90-9	CCC[Si](C)(C)N[Si](C)(C)CCC	{1: 6, 2: 4, 31: 1}
Did not match all atoms present	14579-91-0	C[Si](C)(CCl)N[Si](C)(C)CCl	{1: 4, 2: 2, 31: 1, 17: 2}
Did not match all atoms present	14580-22-4	CC1=NN(C(=O)C1)C2=CC=CC=C2Cl	{1: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	14580-91-7	CP(=C)(C)C	{1: 3, 5: 1}
Did not match all atoms present	14584-23-7	CCCC1=CC=C(C=C1)C2=CC=C(C=C2)CCC	{1: 2, 2: 4, 14: 8}
Did not match all atoms present	14586-40-4	CCCCCCCCCCCCCCCC[N+]1=CC=CC(=C1)C.[Cl-]	{1: 2, 2: 15, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	14586-49-3	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=NC=C1.[W]	{35: 1, 29: 5, 14: 5}
Did not match all atoms present	14586-54-0	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+2]	{17: 2, 35: 6, 29: 8, 14: 24}
Did not match all atoms present	14588-08-0	CC(=O)[O-].CC(=O)[O-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pd+2]	{24: 2, 1: 2, 14: 30}
Did not match all atoms present	14589-42-5	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Sm+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	14589-44-7	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Tm+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	14589-65-2	[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].OI(=O)=O.[Co+3]	{19: 1, 20: 1, 29: 2}
Did not match all atoms present	145899-78-1	CC(C)C1N(CCO1)CCOC(=O)OCCN2CCOC2C(C)C	{1: 4, 2: 4, 3: 2, 33: 2, 11: 4, 12: 2, 23: 2}
Did not match all atoms present	1459-00-3	CC(CBr)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 18: 1, 14: 5}
Did not match all atoms present	1459-09-2	CCCCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 15, 14: 5}
Did not match all atoms present	1459-10-5	CCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 13, 14: 5}
Did not match all atoms present	1459-11-6	CC(C)(C)C1=CC(=C(C=C1)C(C)(C)C)C(C)(C)C	{1: 9, 4: 3, 14: 3}
Did not match all atoms present	1459-55-8	CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3	{1: 1, 11: 6, 12: 3, 13: 1, 14: 4}
Did not match all atoms present	1459-93-4	COC(=O)C1=CC(=CC=C1)C(=O)OC	{1: 2, 28: 2, 14: 4}
Did not match all atoms present	14590-13-7	[NH4+].[O-]P(=O)([O-])[O-].[Co+2]	{29: 4}
Did not match all atoms present	14590-19-3	[O-][Se](=O)(=O)[O-].[Co+2]	{29: 4}
Did not match all atoms present	14590-38-6	[O-][Se](=O)[O-].[Sr+2]	{29: 3}
Did not match all atoms present	145926-28-9	CC1=CC=C(C=C1)C(C)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.Cl[Ru]Cl	{1: 3, 3: 1, 14: 36, 17: 2}
Did not match all atoms present	14593-04-5	C1=CC=C(C=C1)C(CCO)N	{2: 2, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	14593-43-2	C=CCOCC1=CC=CC=C1	{22: 1, 2: 2, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	14595-76-7	C[Si](C)(C)C(C1=CC=CC=C1)([Si](C)(C)C)[Si](C)(C)C	{1: 9, 4: 1, 14: 5}
Did not match all atoms present	14595-77-8	C[Si](C)(C)C(C1=CC=CC=C1)[Si](C)(C)C	{1: 6, 3: 1, 14: 5}
Did not match all atoms present	14596-50-0	COC1=C(C=C(C=C1)CN=C=S)OC	{1: 2, 2: 1, 8: 1, 34: 1, 14: 3, 22: 2}
Did not match all atoms present	146-06-5	COC1=CC2=C(C=CN=C2C=C1)[C@@H](C3CC4CCN3C[C@H]4C=C)OC(=O)O[C@H](C5CC6CCN5C[C@H]6C=C)C7=C8C=C(C=CC8=NC=C7)OC	{1: 2, 3: 2, 5: 2, 6: 2, 33: 2, 11: 8, 12: 6, 14: 10, 35: 2, 22: 2}
Did not match all atoms present	146-17-8	CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O	{32: 1, 1: 2, 2: 2, 3: 3, 33: 1, 14: 2, 35: 2, 20: 5, 22: 1, 25: 2, 29: 1}
Did not match all atoms present	146-22-5	C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3	{32: 1, 35: 1, 38: 1, 11: 1, 14: 8, 15: 1, 25: 1}
Did not match all atoms present	146-28-1	CC(=O)OCCN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.Cl.Cl	{1: 1, 2: 5, 33: 3, 41: 1, 11: 4, 14: 7, 17: 3, 28: 1}
Did not match all atoms present	146-36-1	C=CCN1CC2=CC=CC=C2C3=CC=CC=C3C1	{33: 1, 2: 1, 5: 1, 6: 1, 11: 2, 14: 8}
Did not match all atoms present	146-37-2	CCCCCCCCCCCC[N+]1=C(C=C(C2=CC=CC=C21)N)C.CC(=O)[O-]	{1: 3, 2: 11, 33: 1, 14: 5, 24: 1, 30: 1}
Did not match all atoms present	146-48-5	COC(=O)[C@H]1[C@H](CC[C@@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O	{32: 1, 1: 1, 33: 1, 11: 6, 12: 5, 14: 4, 20: 1, 28: 1}
Did not match all atoms present	146-54-3	CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F	{1: 2, 2: 3, 4: 1, 33: 2, 41: 1, 14: 7, 16: 3}
Did not match all atoms present	146-56-5	C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO.Cl.Cl	{33: 3, 2: 5, 4: 1, 41: 1, 11: 4, 14: 7, 16: 3, 17: 2, 20: 1}
Did not match all atoms present	146-59-8	CCN(CCCNC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC)CCCl.Cl.Cl	{1: 2, 2: 6, 35: 1, 33: 1, 14: 6, 17: 4, 22: 1, 31: 1}
Did not match all atoms present	146-75-8	C([C@H]([C@@H]1C(=C(C(=O)O1)O)O)O)O.[Na+].[Na+]	{2: 1, 3: 1, 12: 1, 15: 2, 20: 4, 28: 1}
Did not match all atoms present	146-77-0	C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=C(N=C2N)Cl	{33: 1, 2: 1, 35: 3, 12: 4, 14: 1, 17: 1, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	146-81-6	CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O	{24: 1, 1: 3, 27: 1, 4: 1, 14: 8}
Did not match all atoms present	146-84-9	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-].[Ag+]	{38: 3, 14: 2}
Did not match all atoms present	1460-02-2	CC(C)(C)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C	{1: 9, 4: 3, 14: 3}
Did not match all atoms present	1460-98-6	CC1=C(C=C(C=C1)C(C)C)C(C)C	{1: 5, 3: 2, 14: 3}
Did not match all atoms present	14600-07-8	C/C=C/COC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 2, 6: 2, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	14603-76-0	C[C@@](CC(=O)[O-])(C(=O)[O-])[NH3+]	{24: 2, 1: 1, 2: 1, 4: 1}
Did not match all atoms present	14607-25-1	CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=CC=C(C=C2)S(=O)(=O)NCCCl	{1: 1, 2: 6, 33: 1, 34: 2, 14: 7, 17: 1, 20: 2, 29: 2, 31: 1}
Did not match all atoms present	146070-34-0	C1=CC(=C(C=C1C(F)(F)F)F)C#N	{16: 4, 4: 1, 37: 1, 14: 3}
Did not match all atoms present	146070-35-1	C1=CC(=C(C(=C1)C(F)(F)F)F)C#N	{16: 4, 4: 1, 37: 1, 14: 3}
Did not match all atoms present	1461-15-0	C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C=C4OC5=CC(=C(C=C35)CN(CC(=O)O)CC(=O)O)O)O)CN(CC(=O)O)CC(=O)O	{33: 2, 2: 6, 13: 1, 14: 8, 21: 2, 23: 1, 27: 4, 28: 1}
Did not match all atoms present	1461-17-2	CCCC(C1=C(N(N(C1=O)C2=CC=CC=C2)C)C)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C	{1: 5, 2: 2, 3: 1, 33: 4, 14: 10, 25: 2}
Did not match all atoms present	1461-22-9	CCCC[Sn](CCCC)(CCCC)Cl	{1: 3, 2: 9, 17: 1}
Did not match all atoms present	1461-23-0	CCCC[Sn](CCCC)(CCCC)Br	{1: 3, 2: 9, 18: 1}
Did not match all atoms present	1461-25-2	CCCC[Sn](CCCC)(CCCC)CCCC	{1: 4, 2: 12}
Did not match all atoms present	14611-52-0	C[C@H](CC1=CC=CC=C1)N(C)CC#C.Cl	{1: 2, 2: 2, 3: 1, 33: 1, 9: 1, 10: 1, 14: 5, 17: 1}
Did not match all atoms present	14612-92-1	C[NH+](C)CCN(CC1=CC=C(C=C1)Br)C2=CC=CC=N2.[Cl-]	{1: 2, 2: 3, 35: 1, 33: 1, 14: 8, 17: 1, 18: 1}
Did not match all atoms present	146137-78-2	C1=CC(=C(C=C1C(F)(F)F)C=O)F	{16: 4, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	14616-31-0	O=PCl	{17: 1, 29: 1}
Did not match all atoms present	14616-93-4	N1P(=NP(=NP(=NP(=N[P+](N=P(N=P1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 14, 32: 1, 35: 6}
Did not match all atoms present	146167-73-9	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(F)(F)S(=O)(=O)O)(F)F)F)(F)F)F.C(=C(F)F)(F)F	{4: 5, 7: 4, 16: 17, 20: 1, 22: 2, 29: 2}
Did not match all atoms present	14617-95-9	CCCC(=O)OC1=CC=C(C=C1)OC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	146177-59-5	CC1=C(C2=NC=CN=C2C3=C1N(C(=N3)N)C)C	{1: 3, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	146177-60-8	CC1=CN=C2C(=C(C3=C(C2=N1)N=C(N3C)N)C)C	{1: 4, 35: 3, 30: 1, 14: 1, 33: 1}
Did not match all atoms present	146177-62-0	CC1=C(C2=C(C3=C1N=C(C(=N3)C)C)N=C(N2C)N)C	{1: 5, 35: 3, 30: 1, 33: 1}
Did not match all atoms present	146177-83-5	C(=O)(C(=O)O[Al])O[Al].O.O.O.O	{28: 2}
Did not match all atoms present	14618-10-1	C1C2=C(C=CC(=C2)[N+](=O)[O-])OS1(=O)=O	{38: 1, 11: 1, 29: 2, 14: 3, 23: 1}
Did not match all atoms present	14618-47-4	CC1=CC(=C(C=C1)NC(=O)C(F)(F)F)C	{1: 2, 4: 1, 14: 3, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	14618-48-5	CC1=CC(=C(C=C1)C)NC(=O)C(F)(F)F	{1: 2, 4: 1, 14: 3, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	14618-80-5	C1[C@@H](O1)COCC2=CC=CC=C2	{2: 2, 11: 1, 12: 1, 14: 5, 22: 1, 23: 1}
Did not match all atoms present	1462-37-9	C1=CC=C(C=C1)COCCBr	{2: 3, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	1462-84-6	CC1=C(N=C(C=C1)C)C	{1: 3, 35: 1, 14: 2}
Did not match all atoms present	14620-98-5	C1=CC2=C3C(=C1)C4C(C3=CC=C2)C5C4C6=CC=CC7=C6C5=CC=C7	{12: 4, 14: 12}
Did not match all atoms present	14621-11-5	N1=P(N=P(N=P(N=P1(Br)Br)(Br)Br)(Br)Br)(Br)Br	{18: 8, 35: 4}
Did not match all atoms present	14623-58-6	C1=NC(=S)NC(=C1N)N	{32: 1, 35: 1, 30: 2, 14: 1}
Did not match all atoms present	14623-75-7	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Ce+3].[Ce+3]	{24: 3}
Did not match all atoms present	146237-62-9	CC(C)(C)C1=NC=C(C=N1)[O-].[Na+]	{1: 3, 35: 2, 4: 1, 14: 2}
Did not match all atoms present	14624-13-6	CCCCCCCC[O-].CCCCCCCC[O-].CCCCCCCC[O-].[Al+3]	{1: 3, 2: 21, 29: 3}
Did not match all atoms present	14624-15-8	CCCCCCCCCCCC[O-].CCCCCCCCCCCC[O-].CCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 33, 29: 3}
Did not match all atoms present	14627-67-9	[Tl+3]	{}
Did not match all atoms present	14628-06-9	CC1=NC2=C(C=CC=C2OC(=O)NC)C=C1	{1: 2, 35: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	14629-45-9	CCCCCO[Si](C)(C)C	{1: 4, 2: 4, 22: 1}
Did not match all atoms present	14629-52-8	CCCCCO[Si](CC)(CC)CC	{1: 4, 2: 7, 22: 1}
Did not match all atoms present	14629-56-2	COC1=CC=C(C=C1)CO[Si](C)(C)C	{1: 4, 2: 1, 22: 2, 14: 4}
Did not match all atoms present	14629-58-4	C[Si](C)(C)OCCC1=CC=CC=C1	{1: 3, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	1463-01-0	CCC1=NC(=C(C=C1)C)C	{1: 3, 2: 1, 35: 1, 14: 2}
Did not match all atoms present	1463-08-7	CC(C)(CC1=CC=C(C=C1)Br)N.Cl	{1: 2, 2: 1, 4: 1, 14: 4, 17: 1, 18: 1, 30: 1}
Did not match all atoms present	1463-17-8	CC1=NC2=C(C=CC=C2C)C=C1	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	14630-40-1	C[Si](C)(C)C#C[Si](C)(C)C	{1: 6, 10: 2}
Did not match all atoms present	14630-42-3	CC(C)(C)C#C[Si](C)(C)C	{1: 6, 10: 2, 4: 1}
Did not match all atoms present	14632-40-7	CC1=C(C=CC(=C1)[N+](=O)[O-])N=CC2=CC=CC=C2	{1: 1, 34: 1, 38: 1, 14: 8, 6: 1}
Did not match all atoms present	14633-54-6	C1CC1SC2=CC=CC=C2	{40: 1, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	14634-91-4	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[O-]S(=O)(=O)[O-].[Fe+2]	{35: 6, 29: 4, 14: 24}
Did not match all atoms present	14634-93-6	CCN(C1=CC=CC=C1)C(=S)[S-].CCN(C1=CC=CC=C1)C(=S)[S-].[Zn+2]	{1: 2, 2: 2, 33: 2, 14: 10, 7: 2}
Did not match all atoms present	14635-33-7	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3SC=N4	{41: 1, 35: 1, 14: 9}
Did not match all atoms present	14635-75-7	[B-](F)(F)(F)F.N#[O+]	{16: 4, 29: 1}
Did not match all atoms present	14637-08-2	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)OC)CCCS(=O)(=O)[O-])C=C3N(C4=C(S3)C=CC(=C4)OC)CC	{1: 4, 2: 5, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 22: 2, 29: 3}
Did not match all atoms present	14637-34-4	[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[NH4+]	{14: 20}
Did not match all atoms present	146377-62-0	C1=CC=C(C=C1)CCC(F)F	{16: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	14638-93-8	[O-2].[O-2].[O-2].[K+].[V]	{}
Did not match all atoms present	14639-97-5	[NH4+].[NH4+].Cl[Zn-2](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	1464-33-1	CC1=NC=C(C(=C1O)COC)CO	{1: 2, 2: 2, 35: 1, 14: 1, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	1464-43-3	C(C(C(=O)O)N)[Se][Se]CC(C(=O)O)N	{27: 2, 2: 2, 3: 2, 30: 2}
Did not match all atoms present	1464-44-4	C1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	{2: 1, 12: 5, 14: 5, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	14640-56-3	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Co+2].[Co+2]	{29: 6, 22: 1}
Did not match all atoms present	14641-96-4	C[C@@](CO)(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)N3C.Cl	{1: 2, 2: 1, 4: 1, 33: 1, 11: 4, 12: 3, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	14642-79-6	C[Si](C)(C)OCC1=CC=CC=C1	{1: 3, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	14644-55-4	[O-][V](=O)=O.[Cs+]	{29: 3}
Did not match all atoms present	14644-61-2	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Zr+4]	{29: 8}
Did not match all atoms present	14644-70-3	[NH4+].[O-][As](=O)([O-])[O-].[Mg+2]	{29: 4}
Did not match all atoms present	14646-15-2	CN1CC(=CC2=CC(=C(C=C2)O)OC)C(=O)C1=O	{1: 2, 6: 1, 33: 1, 11: 1, 14: 3, 15: 1, 21: 1, 22: 1, 25: 2}
Did not match all atoms present	14646-29-8	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Lu+3]	{17: 3, 29: 12}
Did not match all atoms present	14647-23-5	C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl[Ni]Cl	{17: 2, 2: 2, 14: 20}
Did not match all atoms present	14648-50-1	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3]	{17: 6}
Did not match all atoms present	14649-03-7	C[C@@H](C1=CC=CC=C1)N=C=O	{1: 1, 34: 1, 3: 1, 8: 1, 14: 5, 29: 1}
Did not match all atoms present	14649-69-5	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Fe]	{29: 4, 14: 15}
Did not match all atoms present	1465-25-4	C1=CC=C2C(=C1)C=CC=C2NCCN.Cl.Cl	{17: 2, 2: 2, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	1465-26-5	C1=CC(=CC=C1CC(C(=O)O)N)N(CCCl)CCCl.Cl	{33: 1, 2: 5, 3: 1, 14: 4, 17: 3, 27: 1, 30: 1}
Did not match all atoms present	14650-08-9	Cl[Hg+]	{17: 1}
Did not match all atoms present	14650-81-8	C1=CC=C(C(=C1)N)[S-].C1=CC=C(C(=C1)N)[S-].[Zn+2]	{30: 2, 14: 8}
Did not match all atoms present	146504-32-7	CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC(CN(CC(COC4=CC=C(C=C4)C(C)(C)C5=CC=C(C=C5)OCC6CO6)O)C7=CC=C(C=C7)S(=O)(=O)C8=CC=C(C=C8)N(CC(COC9=CC=C(C=C9)C(C)(C)C1=CC=C(C=C1)OCC1CO1)O)CC(COC1=CC=C(C=C1)C(C)(C)C1=CC=C(C=C1)OCC1CO1)O)O	{1: 8, 2: 12, 3: 4, 4: 4, 33: 2, 11: 4, 12: 4, 14: 40, 20: 4, 22: 8, 23: 4, 29: 2}
Did not match all atoms present	14652-09-6	C[N+](C)(CCBr)N.[Br-]	{1: 2, 2: 2, 18: 2, 30: 1}
Did not match all atoms present	14654-63-8	C1=CC2=C(C=C1N)C3=NC4=NC(=NC5=C6C=CC(=CC6=C([N-]5)N=C7C8=C(C=C(C=C8)N)C(=N7)N=C2[N-]3)N)C9=C4C=CC(=C9)N.[Cu+2]	{35: 8, 30: 4, 14: 12}
Did not match all atoms present	146549-21-5	C=CC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{2: 2, 3: 1, 5: 1, 6: 1, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	146558-39-6	CC(C)(C)C(=C)C1=CC=C(C=C1)SC	{1: 4, 4: 1, 5: 1, 7: 1, 40: 1, 14: 4}
Did not match all atoms present	146558-40-9	CC(C)(C)C(=C)C1=CC(=C(C=C1)OC)Cl	{1: 4, 4: 1, 5: 1, 7: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	146558-41-0	CC1=CC(=CC(=C1)C(=C)C(C)(C)C)C	{1: 5, 4: 1, 5: 1, 14: 3, 7: 1}
Did not match all atoms present	146558-42-1	CC1=CC=CC(=C1)C(=C)C(C)(C)C	{1: 4, 4: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	146558-43-2	CC(C)(C)C(=C)C1=CC(=CC=C1)Cl	{1: 3, 4: 1, 5: 1, 7: 1, 14: 4, 17: 1}
Did not match all atoms present	146558-44-3	CC(C)(C)C(=C)C1=CC(=CC=C1)F	{1: 3, 4: 1, 5: 1, 7: 1, 14: 4, 16: 1}
Did not match all atoms present	146558-45-4	CC(C)(C)C(=C)C1=CC(=CC=C1)C(F)(F)F	{1: 3, 4: 2, 5: 1, 7: 1, 14: 4, 16: 3}
Did not match all atoms present	14657-86-4	CCCN(CCC)C(=O)C1=CC=CC=C1	{24: 1, 1: 2, 2: 4, 14: 5, 33: 1}
Did not match all atoms present	14658-94-7	C1=CC=C2C(=C(C=C2Cl)Cl)C=C1	{17: 2, 14: 6}
Did not match all atoms present	14658-95-8	C1=CC=C2C(=C(C=C2Br)Br)C=C1	{18: 2, 14: 6}
Did not match all atoms present	1466-67-7	C1=CC=C(C=C1)CNC(=O)NCC2=CC=CC=C2	{24: 1, 2: 2, 14: 10, 31: 2}
Did not match all atoms present	1466-76-8	COC1=C(C(=CC=C1)OC)C(=O)O	{1: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	1466-82-6	CC(=O)OC1=CC=CC=C1C(=O)OC(=O)C2=CC=CC=C2OC(=O)C	{1: 2, 28: 4, 14: 8}
Did not match all atoms present	1466-88-2	C1=CC=C(C(=C1)C=CC=O)[N+](=O)[O-]	{26: 1, 38: 1, 14: 4, 6: 2}
Did not match all atoms present	14663-23-1	C1C(=O)N=C(N1N=CC2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])[O-].[Na+]	{33: 1, 34: 1, 35: 1, 38: 1, 6: 1, 11: 1, 14: 6, 15: 1, 23: 1, 25: 1}
Did not match all atoms present	14663-71-9	C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(OCCCCl)OCCCCl	{2: 6, 38: 1, 14: 4, 17: 2, 22: 3, 29: 1}
Did not match all atoms present	14663-72-0	CC(COP(=O)(OCC(C)Cl)OC1=CC=C(C=C1)[N+](=O)[O-])Cl	{1: 2, 2: 2, 3: 2, 38: 1, 14: 4, 17: 2, 22: 3, 29: 1}
Did not match all atoms present	146631-00-7	B(C1=CC=C(C=C1)OCC2=CC=CC=C2)(O)O	{2: 1, 20: 2, 22: 1, 14: 9}
Did not match all atoms present	146632-12-4	C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])NN=C3C(=CC4=CC(=CC(=C4C3=O)NC5=NC(=NC(=N5)NC6=C7C(=C(C=C6)S(=O)(=O)[O-])C=C(C(=NNC8=CC=C(C=C8)S(=O)(=O)CCOS(=O)(=O)[O-])C7=O)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[K+].[K+].[K+]	{2: 2, 35: 3, 34: 2, 14: 15, 15: 4, 17: 1, 22: 1, 25: 2, 29: 23, 31: 4}
Did not match all atoms present	14666-78-5	CCOC(=O)OOC(=O)OCC	{1: 2, 2: 2}
Did not match all atoms present	14666-94-5	CCCCCCCC/C=C\CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[Co+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	14666-96-7	CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Co+2]	{24: 2, 1: 2, 2: 24, 6: 8}
Did not match all atoms present	14667-54-0	C1=CC=C2C(=C1)N=CN2C(=O)N3C=NC4=CC=CC=C43	{24: 1, 33: 2, 35: 2, 14: 10}
Did not match all atoms present	14667-55-1	CC1=CN=C(C(=N1)C)C	{1: 3, 35: 2, 14: 1}
Did not match all atoms present	1467-05-6	CCC1=CC=C(C=C1)CCl	{1: 1, 2: 2, 14: 4, 17: 1}
Did not match all atoms present	1467-40-9	C1=CC=C(C=C1)C(=O)CC(=O)CC(=O)C2=CC=CC=C2	{24: 3, 2: 2, 14: 10}
Did not match all atoms present	146714-97-8	COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=N3)C(=O)C4CCCCC4.Cl.Cl.Cl	{1: 1, 2: 2, 35: 1, 33: 3, 11: 9, 12: 1, 14: 8, 17: 3, 22: 1, 24: 1}
Did not match all atoms present	146727-62-0	CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)C#N)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 37: 1, 14: 4, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	14674-72-7	[O-]Cl=O.[O-]Cl=O.[Ca+2]	{17: 2, 29: 4}
Did not match all atoms present	14676-01-8	CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1	{1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	14678-02-5	CC1=NOC(=C1)N	{1: 1, 35: 1, 30: 1, 14: 1, 23: 1}
Did not match all atoms present	14679-13-1	CC1=CC(=C(C(=C1)C)C(=C)C)C	{1: 4, 5: 1, 14: 2, 7: 1}
Did not match all atoms present	14679-73-3	CCOC(=O)NNC1=NN=CC2=CC=CC=C21	{1: 1, 2: 1, 35: 2, 14: 5, 28: 1, 31: 2}
Did not match all atoms present	1468-26-4	C12=NNNC1=NC(=O)NC2=O	{32: 3, 25: 2, 35: 2}
Did not match all atoms present	1468-37-7	COC(=S)SSC(=S)OC	{40: 2, 1: 2, 22: 2, 7: 2}
Did not match all atoms present	1468-83-3	CC(=O)C1=CSC=C1	{24: 1, 1: 1, 14: 3, 41: 1}
Did not match all atoms present	1468-95-7	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CO	{2: 1, 20: 1, 14: 9}
Did not match all atoms present	14680-77-4	[B-](C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl.[K+]	{17: 4, 14: 16}
Did not match all atoms present	146817-69-8	CC(COCCCO)OCCCO.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CO)COCCCO	{1: 1, 2: 14, 3: 1, 8: 2, 34: 2, 14: 8, 20: 4, 22: 3, 29: 2}
Did not match all atoms present	14683-61-5	C1=CC2=C(C(=C1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)N=CC=C2	{35: 1, 12: 5, 14: 6, 20: 3, 22: 1, 23: 1, 27: 1}
Did not match all atoms present	14685-29-1	CCCC[Si]1(O[Si](O[Si](O[Si](O1)(C)CCCC)(C)CCCC)(C)CCCC)C	{1: 8, 2: 12, 23: 4}
Did not match all atoms present	14689-20-4	C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.[Na+].[Ce]	{33: 2, 2: 6, 27: 4}
Did not match all atoms present	14689-29-3	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[K+].[K+].[Zn+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	14689-45-3	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Cd+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	1469-57-4	C1=CC=C2C(=C1)C3C4=CC=CC=C4C2(C5=CC=CC=C35)CO	{20: 1, 2: 1, 12: 1, 13: 1, 14: 12}
Did not match all atoms present	1469-70-1	CCOC(=O)OCC=C	{1: 1, 2: 2, 5: 1, 6: 1}
Did not match all atoms present	1469-94-9	C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2O	{24: 2, 2: 1, 21: 1, 14: 9}
Did not match all atoms present	14690-00-7	C1=CC=C(C=C1)COC(CO)CO	{2: 3, 3: 1, 20: 2, 22: 1, 14: 5}
Did not match all atoms present	14691-44-2	[GeH3].[GeH3].[GeH2]	{}
Did not match all atoms present	14691-80-6	OP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+]	{20: 1, 29: 5, 22: 1}
Did not match all atoms present	14691-84-0	OP(=O)([O-])OP(=O)(O)[O-].[K+].[K+]	{20: 2, 29: 4, 22: 1}
Did not match all atoms present	14691-87-3	[OH-].[O-]I(=O)(=O)=O.[K+].[K+]	{19: 1, 29: 4}
Did not match all atoms present	146925-85-1	C1(=S)NC(=NC(=S)N1)[S-].[Ag+]	{32: 2, 35: 1}
Did not match all atoms present	14693-82-4	[O-]P(=O)([O-])[O-].[In+3]	{29: 4}
Did not match all atoms present	14694-95-2	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Rh]	{17: 1, 14: 45}
Did not match all atoms present	14695-95-5	N.N.N.N.N.N.[Co+3]	{}
Did not match all atoms present	146955-66-0	CCC(CO)(COCC=C)COCC=C.CCC(CO)(COCC=C)COCC=C.C1=CC(=CC=C1C(=O)O)N.C1=CC(=CC=C1C(=O)O)N.[Zr]	{1: 2, 2: 12, 4: 2, 5: 4, 6: 4, 14: 8, 20: 2, 22: 4, 27: 2, 30: 2}
Did not match all atoms present	146956-39-0	[Se](Br)Br	{18: 2}
Did not match all atoms present	146956-40-3	Br[W](Br)(Br)Br	{18: 4}
Did not match all atoms present	14696-77-6	[O-][Se](=O)(=O)[O-].[O-][Se](=O)(=O)[O-].[O-][Se](=O)(=O)[O-].[Al+3].[Al+3]	{29: 12}
Did not match all atoms present	14696-82-3	[N-]=[N+]=NI	{34: 2, 19: 1}
Did not match all atoms present	14698-07-8	CN1CCCC(=C(C2=CC=CS2)C3=CC=CS3)C1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 1, 2: 2, 4: 1, 33: 1, 7: 1, 41: 2, 11: 4, 14: 6, 15: 1, 20: 1, 27: 3}
Did not match all atoms present	14698-29-4	CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)O	{1: 1, 2: 1, 33: 1, 11: 1, 14: 3, 23: 2, 25: 1, 27: 1}
Did not match all atoms present	146987-99-7	CCC(CO)(COCC=C)COCC=C.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.[Zr]	{1: 1, 2: 6, 4: 1, 5: 5, 6: 5, 20: 1, 22: 2, 27: 3}
Did not match all atoms present	147-13-7	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=C(C(=CC=C7)Cl)C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Cu+2]	{17: 1, 35: 8, 14: 15}
Did not match all atoms present	147-20-6	CN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 3: 1, 33: 1, 11: 4, 12: 1, 14: 10, 22: 1}
Did not match all atoms present	147-24-0	CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 2, 2: 2, 3: 1, 33: 1, 14: 10, 17: 1, 22: 1}
Did not match all atoms present	147-47-7	CC1=CC(NC2=CC=CC=C12)(C)C	{32: 1, 1: 3, 13: 1, 14: 5, 15: 1}
Did not match all atoms present	147-52-4	CCOC1=C(C2=CC=CC=C2C=C1)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O	{1: 3, 2: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 6, 22: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	147-55-7	CC(C(=O)N[C@H]1[C@@H]2N(C1=O)[C@H](C(S2)(C)C)C(=O)O)OC3=CC=CC=C3	{1: 3, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 22: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	147-61-5	CC1=C(C(=O)NC(=O)N1)CO	{32: 2, 1: 1, 2: 1, 20: 1, 25: 2}
Did not match all atoms present	147-73-9	[C@@H]([C@@H](C(=O)[O-])O)(C(=O)[O-])O	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	147-82-0	C1=C(C=C(C(=C1Br)N)Br)Br	{18: 3, 30: 1, 14: 2}
Did not match all atoms present	147-84-2	CCN(CC)C(=S)S	{1: 2, 2: 2, 39: 1, 33: 1, 7: 1}
Did not match all atoms present	147-93-3	C1=CC=C(C(=C1)C(=O)O)S	{27: 1, 14: 4, 39: 1}
Did not match all atoms present	147-94-4	C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 2, 20: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	1470-35-5	C1=CC=C(C=C1)C2C(=O)C3=C(C2=O)C=C(C=C3)Br	{25: 2, 18: 1, 12: 1, 14: 8}
Did not match all atoms present	1470-37-7	CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C(=O)O	{1: 1, 34: 1, 6: 1, 14: 4, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	1470-57-1	CC1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 21: 1, 14: 8}
Did not match all atoms present	1470-61-7	CCN(CC)C(=S)[S-].[Ag+]	{1: 2, 2: 2, 33: 1, 7: 1}
Did not match all atoms present	1470-79-7	C1=CC(=CC=C1C(=O)C2=C(C=C(C=C2)O)O)O	{24: 1, 21: 3, 14: 7}
Did not match all atoms present	1470-94-6	C1CC2=C(C1)C=C(C=C2)O	{11: 3, 21: 1, 14: 3}
Did not match all atoms present	14700-00-6	N1=P(N=P(N=P(N=P1(F)F)(F)F)(F)F)(F)F	{16: 8, 35: 4}
Did not match all atoms present	14701-21-4	[Ag+]	{}
Did not match all atoms present	14701-22-5	[Ni+2]	{}
Did not match all atoms present	14704-14-4	COC[Si](C)(C)C	{1: 4, 2: 1, 22: 1}
Did not match all atoms present	14704-41-7	C1=C(NN=C1C(F)(F)F)C(F)(F)F	{16: 6, 32: 1, 35: 1, 4: 2, 14: 1}
Did not match all atoms present	14705-63-6	C1=CC=C(C=C1)C2C3C=CC(N3)C(C4=CC=C([N-]4)C(C5C=CC(N5)C(C6=CC=C2[N-]6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9.O=[V+2]	{32: 2, 35: 2, 12: 8, 29: 1, 14: 28}
Did not match all atoms present	147060-71-7	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)Cl)NCCOCCS(=O)(=O)CCCl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[K+]	{2: 8, 35: 3, 34: 1, 14: 7, 15: 2, 17: 2, 22: 2, 25: 1, 29: 13, 31: 3}
Did not match all atoms present	147060-72-8	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[K+]	{2: 2, 35: 3, 34: 1, 14: 7, 15: 2, 17: 2, 22: 1, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	14708-11-3	[B-](F)(F)(F)F.[Cu+]	{16: 4}
Did not match all atoms present	14708-13-5	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Mg+2]	{16: 8}
Did not match all atoms present	14708-14-6	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Ni+2]	{16: 8}
Did not match all atoms present	14708-49-7	N.N.N.N.[I-].[I-].[Pt+2]	{19: 2}
Did not match all atoms present	14709-62-7	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[N-]=O.[Fe+4].[Zn+2]	{29: 1}
Did not match all atoms present	14709-71-8	C1=CC=NC=C1.Cl[Cu]Cl	{17: 2, 35: 1, 14: 5}
Did not match all atoms present	1471-96-1	CCC1=C(C2=C(C(=O)C(=O)C(=C2C(=C1O)O)O)O)O	{1: 1, 2: 1, 15: 2, 20: 2, 21: 3, 25: 2}
Did not match all atoms present	147102-63-4	C1=CC(=C(C(=C1)Cl)Cl)OC2=C(C=C(C=C2)Cl)Cl	{17: 4, 22: 1, 14: 6}
Did not match all atoms present	147123-47-5	C1=CSC(=C1N)C(=O)N	{24: 1, 41: 1, 30: 2, 14: 2}
Did not match all atoms present	147129-85-9	CCCCCCCCO.CCCCCCCCO.CCCCCCCCOP(=O)(O)OP(=O)(O)OCCCCCCCC.[Zr]	{1: 4, 2: 28, 20: 4, 29: 2, 22: 3}
Did not match all atoms present	14716-89-3	CC1=NOC(=C1)CO	{1: 1, 2: 1, 35: 1, 14: 1, 20: 1, 23: 1}
Did not match all atoms present	14719-31-4	CC1=C(C(=CC=C1)NC(=O)C(F)(F)F)C	{1: 2, 4: 1, 14: 3, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	14719-83-6	COC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	14720-21-9	[F-].[F-].[F-].[Au+3]	{16: 3}
Did not match all atoms present	14720-22-0	B(F)(Cl)Br	{16: 1, 17: 1, 18: 1}
Did not match all atoms present	14720-23-1	B(F)(F)Br	{16: 2, 18: 1}
Did not match all atoms present	14720-25-3	B(F)(Br)Br	{16: 1, 18: 2}
Did not match all atoms present	14720-30-0	B(F)(F)Cl	{16: 2, 17: 1}
Did not match all atoms present	14720-31-1	B(F)(Cl)Cl	{16: 1, 17: 2}
Did not match all atoms present	14720-35-5	[B]N	{30: 1}
Did not match all atoms present	14720-70-8	CC(=O)O.CC(=O)O.C1=CC(=CC=C1CO)CO	{1: 2, 2: 2, 27: 2, 20: 2, 14: 4}
Did not match all atoms present	14721-21-2	[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Cu+2]	{17: 2, 29: 6}
Did not match all atoms present	14721-75-6	CC1=C(C(=C(C(=C1O)C)CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O)O)C	{1: 8, 2: 11, 3: 3, 4: 1, 20: 1, 21: 2}
Did not match all atoms present	14722-22-6	CC(=O)NC1=C(C=C2C(=C1)CC3=CC=CC=C32)I	{1: 1, 11: 1, 14: 6, 19: 1, 24: 1, 31: 1}
Did not match all atoms present	14722-38-4	CC1=CN=NC2=CC=CC=C12	{1: 1, 35: 2, 14: 5}
Did not match all atoms present	14722-82-8	C1=CC=C(C(=C1)NC(=O)/C=N/O)Cl	{34: 1, 6: 1, 14: 4, 17: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	14724-91-5	C1CC2=CC=C(CCC3=CC=C1C4=CC=CC=C34)C5=CC=CC=C25	{11: 4, 14: 12}
Did not match all atoms present	147241-85-8	CC1CC(C2=C(O1)C=C(C=C2)OCCN(C)C)C3=CC(=CC=C3)C(F)(F)F	{1: 3, 2: 2, 4: 1, 33: 1, 11: 1, 12: 2, 14: 7, 16: 3, 22: 1, 23: 1}
Did not match all atoms present	147253-67-6	C[C@@H]1CC[C@H](P1C2=CC=CC=C2P3[C@@H](CC[C@H]3C)C)C	{1: 4, 11: 4, 12: 4, 14: 4}
Did not match all atoms present	14726-19-3	CC(=O)/C=C(\O)/C1=CC=CC=C1.CC(=O)/C=C(\O)/C1=CC=CC=C1.CC(=O)/C=C(\O)/C1=CC=CC=C1.[La]	{1: 3, 6: 3, 7: 3, 14: 15, 20: 3, 24: 3}
Did not match all atoms present	14726-22-8	CC(=O)/C=C(\O)/C1=CC=CC=C1.CC(=O)/C=C(\O)/C1=CC=CC=C1.CC(=O)/C=C(\O)/C1=CC=CC=C1.[Sm]	{1: 3, 6: 3, 7: 3, 14: 15, 20: 3, 24: 3}
Did not match all atoms present	14726-36-4	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].[Zn+2]	{33: 2, 2: 4, 14: 20, 7: 2}
Did not match all atoms present	14726-58-0	CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCOCC2.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 2: 6, 33: 1, 11: 4, 34: 1, 14: 2, 17: 4, 22: 2, 23: 1}
Did not match all atoms present	147263-81-8	[H-].[H-].[H-].CN(C)C.[Al+3]	{1: 3, 33: 1}
Did not match all atoms present	14729-89-6	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Fe+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	14733-73-4	C1=CC2=C(C=C1Br)NC(=O)O2	{32: 1, 18: 1, 28: 1, 14: 3}
Did not match all atoms present	14737-86-1	CCCCCCN1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl	{1: 1, 2: 5, 25: 2, 33: 1, 17: 4}
Did not match all atoms present	14737-91-8	COC1=CC=CC=C1/C=C\C(=O)O	{1: 1, 22: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	14737-94-1	COC(=O)C(=CC1=CC=CC=C1)Cl	{1: 1, 6: 1, 7: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	1474-02-8	CCC(=O)N(C1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 2, 33: 2, 11: 4, 12: 1, 14: 10, 24: 1}
Did not match all atoms present	1474-78-8	CCOC(=O)P(=O)(OCC)OCC	{1: 3, 2: 3, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	1474-80-2	CCOP(=O)(OCC)OP(=O)(N(C)C)N(C)C	{1: 6, 2: 2, 29: 2, 22: 3, 33: 2}
Did not match all atoms present	14740-93-3	N1=P(N=P(N=P1(Cl)Cl)(Cl)Br)(Cl)Cl	{17: 5, 18: 1, 35: 3}
Did not match all atoms present	14742-53-1	C1=CSC(=C1)CN(CCCl)CCCl.Cl	{17: 3, 2: 5, 41: 1, 14: 3, 33: 1}
Did not match all atoms present	14745-61-0	CC1=C(C(=O)OC2=C1C=CC(=C2)OP(=O)(OCCCCCl)OCCCCCl)Cl	{1: 1, 2: 8, 14: 3, 17: 3, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	1475-11-2	CC(C1=CC(=C(C=C1)Cl)Cl)O	{1: 1, 3: 1, 20: 1, 14: 3, 17: 2}
Did not match all atoms present	1475-12-3	CC(C1=C(C=CC(=C1)Cl)Cl)O	{1: 1, 3: 1, 20: 1, 14: 3, 17: 2}
Did not match all atoms present	1475-13-4	CC(C1=C(C=C(C=C1)Cl)Cl)O	{1: 1, 3: 1, 20: 1, 14: 3, 17: 2}
Did not match all atoms present	14751-74-7	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].[Mn+2]	{1: 2, 33: 2, 11: 2, 14: 14, 24: 2, 29: 2}
Did not match all atoms present	14751-76-9	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].[Ni+2]	{1: 2, 33: 2, 11: 2, 14: 14, 24: 2, 29: 2}
Did not match all atoms present	14751-87-2	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].[Co+2]	{1: 2, 33: 2, 11: 2, 14: 14, 24: 2, 29: 2}
Did not match all atoms present	14751-90-7	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].[Cu+2]	{1: 2, 33: 2, 11: 2, 14: 14, 24: 2, 29: 2}
Did not match all atoms present	14751-97-4	CCN(CCO)C1=CC=C(C=C1)[N+]#N.CCN(CCO)C1=CC=C(C=C1)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 2: 6, 33: 2, 34: 2, 14: 8, 17: 4, 20: 2}
Did not match all atoms present	14752-75-1	CCCCCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 16, 14: 5}
Did not match all atoms present	147526-32-7	C1C(C1)C2=NC3=CC=CC=C3C(=C2/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-])C4=CC=C(C=C4)F.C1C(C1)C2=NC3=CC=CC=C3C(=C2/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-])C4=CC=C(C=C4)F.[Ca+2]	{2: 4, 3: 4, 6: 4, 11: 4, 12: 2, 14: 16, 16: 2, 35: 2, 20: 4, 24: 2}
Did not match all atoms present	14753-05-0	C1=CC=C2C3C4C(C(C2=C1)C5=C3C=C(C=C5)[N+](=O)[O-])C6C7=CC=CC=C7C4C8=CC=CC=C68	{12: 6, 38: 1, 14: 15}
Did not match all atoms present	14753-08-3	CC1=CC(=C(C=C1OC)C(C)C)OC	{1: 5, 3: 1, 22: 2, 14: 2}
Did not match all atoms present	14753-13-0	CC1=CC2=[N+](C=CC(=C2C=C1)[N+](=O)[O-])[O-]	{1: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	14753-14-1	C1=CC2=C(C=C[N+](=C2C=C1Cl)[O-])[N+](=O)[O-]	{17: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	147536-97-8	CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCO)OC4=CC=CC=C4OC	{1: 4, 2: 2, 35: 4, 4: 1, 14: 11, 20: 1, 22: 3, 29: 2, 31: 1}
Did not match all atoms present	14755-02-3	C1=CC(=CC(=C1)O)/C=C/C(=O)O	{27: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	14756-03-7	C1=CSC(=C1)C=CC=O	{41: 1, 26: 1, 14: 3, 6: 2}
Did not match all atoms present	1476-52-4	CCNCCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl	{1: 2, 2: 4, 3: 1, 14: 5, 17: 1, 35: 1, 31: 2}
Did not match all atoms present	1476-53-5	CC1=C(C=CC2=C1OC(=C(C2=O)NC(=O)C3=CC(=C(C=C3)O)CC=C(C)C)[O-])OC4C(C(C(C(O4)(C)C)OC)OC(=O)N)O.[Ca+2]	{1: 6, 2: 1, 6: 1, 7: 1, 12: 4, 13: 1, 14: 5, 20: 1, 21: 1, 22: 2, 23: 2, 24: 1, 25: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	14760-26-0	C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[Zn+2]	{1: 12, 34: 2}
Did not match all atoms present	14762-38-0	CC(C(C1=CC=CC=C1)NCCN)[N+](=O)[O-]	{1: 1, 2: 2, 3: 2, 38: 1, 14: 5, 30: 1, 31: 1}
Did not match all atoms present	14762-55-1	[3He]	{}
Did not match all atoms present	147624-13-3	CC1=C(C=CC=C1F)C=O	{16: 1, 1: 1, 26: 1, 14: 3}
Did not match all atoms present	14763-60-1	CS(=O)(=O)C1=CC=C(C=C1)O	{1: 1, 21: 1, 14: 4, 29: 2}
Did not match all atoms present	14763-61-2	CS(=O)(=O)C1=CC=CC(=C1)O	{1: 1, 21: 1, 14: 4, 29: 2}
Did not match all atoms present	14763-64-5	CS(=O)C1=CC=C(C=C1)O	{1: 1, 21: 1, 14: 4, 29: 1}
Did not match all atoms present	14763-77-0	[C-]#N.[C-]#N.[Cu+2]	{}
Did not match all atoms present	14764-02-4	C1CN(C(=S)N1)CN2CCN(CC2)CN3CCNC3=S	{32: 2, 33: 4, 2: 2, 11: 8, 15: 2}
Did not match all atoms present	14767-09-0	[O-]I(=O)=O.[Tl+]	{19: 1, 29: 3}
Did not match all atoms present	14767-37-4	CC(=O)C=C(C1=CC=CC=C1)[O-].CC(=O)C=C(C1=CC=CC=C1)[O-].O=[V+2]	{1: 2, 6: 2, 7: 2, 14: 10, 24: 2, 29: 1}
Did not match all atoms present	14768-11-7	[C-]#N.[C-]#N.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Fe+2]	{35: 4, 14: 16}
Did not match all atoms present	14768-15-1	CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.[Gd+3]	{24: 3, 1: 18, 4: 6, 6: 3, 7: 3}
Did not match all atoms present	147682-51-7	C1=CC(=C(C=C1S(=O)(=O)Cl)[N+](=O)[O-])O	{17: 1, 38: 1, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	14769-73-4	C1CSC2=N[C@H](CN21)C3=CC=CC=C3	{33: 1, 35: 1, 41: 1, 11: 3, 12: 1, 14: 5, 15: 1}
Did not match all atoms present	1477-19-6	CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)O	{1: 1, 2: 1, 14: 8, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	1477-20-9	CCN(CC1=CC=C(C=C1)CN(CC)C(=O)C(Cl)Cl)C(=O)C(Cl)Cl	{1: 2, 2: 4, 3: 2, 33: 2, 14: 4, 17: 4, 24: 2}
Did not match all atoms present	1477-39-0	CCC(C(CC(C)NC)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C	{1: 4, 2: 2, 3: 2, 4: 1, 14: 10, 28: 1, 31: 1}
Did not match all atoms present	1477-40-3	CC[C@@H](C(C[C@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C	{1: 5, 2: 2, 3: 2, 4: 1, 33: 1, 14: 10, 28: 1}
Did not match all atoms present	1477-42-5	CC1=C2C(=CC=C1)SC(=N2)N	{1: 1, 35: 1, 30: 1, 14: 3, 41: 1}
Did not match all atoms present	1477-50-5	C1=CC=C2C(=C1)C=C(N2)C(=O)O	{32: 1, 27: 1, 14: 5}
Did not match all atoms present	1477-55-0	C1=CC(=CC(=C1)CN)CN	{2: 2, 30: 2, 14: 4}
Did not match all atoms present	1477-79-8	CC1=CC=CC=C1C(C2=CC=CC=C2)(C(C)CN(C)C)O.Cl	{1: 4, 2: 1, 3: 1, 4: 1, 33: 1, 14: 9, 17: 1, 20: 1}
Did not match all atoms present	14770-96-8	COC1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 21: 1, 14: 8}
Did not match all atoms present	147703-65-9	CCC(COC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])NC(=O)C)O.[Na+]	{1: 2, 2: 2, 3: 1, 34: 4, 14: 11, 20: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	147783-69-5	CC1(CC(CC(N1C)(C)C)OC(=O)C(=CC2=CC=C(C=C2)OC)C(=O)OC3CC(N(C(C3)(C)C)C)(C)C)C	{1: 11, 33: 2, 6: 1, 7: 1, 11: 4, 12: 2, 13: 4, 14: 4, 22: 1, 28: 2}
Did not match all atoms present	14779-52-3	[2H]N([2H])C	{1: 1, 30: 1}
Did not match all atoms present	14779-73-8	Cl[Sn](Br)(Br)Br	{17: 1, 18: 3}
Did not match all atoms present	14779-78-3	CCCCCOC(=O)C1=CC=C(C=C1)N(C)C	{1: 3, 2: 4, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	1478-53-1	CCOP(=O)(C(F)F)OCC	{1: 2, 2: 2, 3: 1, 16: 2, 22: 2, 29: 1}
Did not match all atoms present	1478-61-1	C1=CC(=CC=C1C(C2=CC=C(C=C2)O)(C(F)(F)F)C(F)(F)F)O	{16: 6, 4: 3, 21: 2, 14: 8}
Did not match all atoms present	14781-45-4	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Cu+2]	{16: 12, 24: 2, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	14781-81-8	O=S(=O)([O-])S(=O)(=O)[O-]	{29: 6}
Did not match all atoms present	14783-09-6	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.Cl[Cu]Cl	{17: 2, 35: 2, 14: 8}
Did not match all atoms present	14783-10-9	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.Cl[Pd]Cl	{17: 2, 35: 2, 14: 8}
Did not match all atoms present	14783-59-6	C1=CC=C(C=C1)N/N=C(/[S-])\N=NC2=CC=CC=C2.C1=CC=C(C=C1)N/N=C(/[S-])\N=NC2=CC=CC=C2.[Hg+2]	{34: 6, 31: 2, 14: 20, 7: 2}
Did not match all atoms present	14786-27-7	C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{2: 1, 28: 1, 38: 1, 14: 9}
Did not match all atoms present	14787-38-3	CC1=CC(=C2C(=O)C=CC(=O)C2=C1)O	{1: 1, 21: 1, 14: 4, 25: 2}
Did not match all atoms present	1479-58-9	C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Br)N)F	{16: 1, 24: 1, 18: 1, 30: 1, 14: 7}
Did not match all atoms present	14794-69-5	CC1C2CCC3=C(C2OC1=O)C(=C(C=C3C)OC(=O)C)C	{1: 4, 11: 2, 12: 3, 14: 1, 28: 2}
Did not match all atoms present	14795-55-2	CCCCCCCCCC1=CC=C(C=C1)OCC(COC2=CC=C(C=C2)CCCCCCCCC)O	{1: 2, 2: 18, 3: 1, 14: 8, 20: 1, 22: 2}
Did not match all atoms present	14796-11-3	C1=CC=C(C=C1)N.OCl(=O)(=O)=O	{17: 1, 30: 1, 20: 1, 29: 3, 14: 5}
Did not match all atoms present	14796-94-2	CCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCC(=O)[O-].[Sr+2]	{24: 2, 1: 2, 2: 24}
Did not match all atoms present	14797-55-8	O=[N+]([O-])[O-]	{}
Did not match all atoms present	147977-82-0	C=O.C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ca+2]	{5: 1, 14: 10}
Did not match all atoms present	14798-03-9	[NH4+]	{}
Did not match all atoms present	14798-26-6	O=[N+]([O-])c1cc([N+](=O)[O-])c([O-])c([N+](=O)[O-])c1	{38: 3, 14: 2}
Did not match all atoms present	14799-93-0	CCCCCCCC[Si](C)(Cl)Cl	{1: 2, 2: 7, 17: 2}
Did not match all atoms present	14799-94-1	CCCCCC[Si](C)(Cl)Cl	{1: 2, 2: 5, 17: 2}
Did not match all atoms present	148-01-6	CC1=C(C=C(C=C1C(=O)N)[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 1: 1, 38: 2, 30: 1, 14: 2}
Did not match all atoms present	148-03-8	CC1=CC(=C(C2=C1O[C@](CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)O	{1: 7, 2: 9, 3: 3, 11: 2, 13: 1, 14: 1, 21: 1, 23: 1}
Did not match all atoms present	148-18-5	CCN(CC)C(=S)[S-].[Na+]	{1: 2, 2: 2, 33: 1, 7: 1}
Did not match all atoms present	148-24-3	C1=CC2=C(C(=C1)O)N=CC=C2	{35: 1, 21: 1, 14: 6}
Did not match all atoms present	148-25-4	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)O)O)S(=O)(=O)O	{20: 2, 21: 2, 14: 4, 29: 4}
Did not match all atoms present	148-32-3	CCN(CC)CC(C)(C)COC(=O)C(CO)C1=CC=CC=C1	{1: 4, 2: 5, 3: 1, 4: 1, 33: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	148-39-0	CC1=CC(=C(C(=C1)N/N=C/2\C=C(C=CC2=O)[N+](=O)[O-])O)NC(=O)C	{1: 2, 34: 1, 38: 1, 14: 5, 15: 2, 21: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	148-51-6	CC1=C(C(=NC=C1CO)C)O.Cl	{1: 2, 2: 1, 35: 1, 14: 1, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	148-53-8	COC1=CC=CC(=C1O)C=O	{1: 1, 22: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	148-56-1	C1=C(C(=CC2=C1NC=NS2(=O)=O)S(=O)(=O)N)C(F)(F)F	{32: 1, 35: 1, 4: 1, 14: 3, 16: 3, 29: 4, 30: 1}
Did not match all atoms present	148-64-1	CN(C)CCN(CC1=CC=C(S1)Cl)C2=CC=CC=N2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 5, 35: 1, 4: 1, 33: 2, 41: 1, 14: 6, 17: 1, 20: 1, 27: 3}
Did not match all atoms present	148-65-2	CN(C)CCN(CC1=CC=C(S1)Cl)C2=CC=CC=N2	{1: 2, 2: 3, 35: 1, 33: 2, 41: 1, 14: 6, 17: 1}
Did not match all atoms present	148-69-6	CCN(CCC#N)C1=CC=CC(=C1)C	{1: 2, 2: 3, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	148-71-0	CCN(CC)C1=CC(=C(C=C1)N)C	{1: 3, 2: 2, 30: 1, 14: 3, 33: 1}
Did not match all atoms present	148-72-1	CC[C@H]1[C@H](COC1=O)CC2=CN=CN2C.[N+](=O)(O)[O-]	{1: 2, 2: 2, 35: 1, 33: 1, 11: 1, 12: 2, 14: 2, 20: 1, 28: 1}
Did not match all atoms present	148-75-4	C1=CC(=CC2=CC(=C(C=C21)O)S(=O)(=O)O)S(=O)(=O)O	{20: 2, 21: 1, 14: 5, 29: 4}
Did not match all atoms present	148-78-7	C1=CC(=CC=C1C(=O)O)NC(=O)OC2=CC=C(C=C2)N(CCCl)CCCl	{33: 1, 2: 4, 14: 8, 17: 2, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	148-79-8	C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3	{32: 1, 41: 1, 35: 2, 14: 6}
Did not match all atoms present	148-82-3	C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCCl)CCCl	{33: 1, 2: 5, 3: 1, 14: 4, 17: 2, 27: 1, 30: 1}
Did not match all atoms present	148-85-6	C1=CC(=CC=C1C2=CC=C(C=C2)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)O)C(=O)O	{34: 2, 27: 2, 14: 16}
Did not match all atoms present	148-86-7	CC(=O)OC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 28: 1, 14: 9}
Did not match all atoms present	148-87-8	CCN(CCC#N)C1=CC=CC=C1	{1: 1, 2: 3, 37: 1, 14: 5, 33: 1}
Did not match all atoms present	148-90-3	CCN(CC)C1=CC=C(C=C1)[N+]#N.[Cl-]	{1: 2, 2: 2, 33: 1, 34: 1, 14: 4, 17: 1}
Did not match all atoms present	1480-19-9	COC1=CC=CC=C1N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F	{1: 1, 2: 3, 33: 2, 11: 4, 14: 8, 16: 1, 22: 1, 24: 1}
Did not match all atoms present	14802-03-0	CCCCC(CC)COP(=O)(CC(CC)CCCC)O	{1: 4, 2: 10, 3: 2, 20: 1, 22: 1, 29: 1}
Did not match all atoms present	14802-41-6	C1=CC=NC(=C1)C=CC2=CC=NC=C2	{35: 2, 14: 8, 6: 2}
Did not match all atoms present	14803-72-6	COC1=CC=C(C=C1)NC(=O)OC	{1: 2, 28: 1, 22: 1, 14: 4, 31: 1}
Did not match all atoms present	14804-32-1	CCC1=CC=CC=C1OC	{1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	14804-38-7	CC1=CC(=CC(=C1OC)C)Br	{1: 3, 18: 1, 22: 1, 14: 2}
Did not match all atoms present	14804-39-8	CC1=CC(=CC(=C1OC)C)[N+](=O)[O-]	{1: 3, 38: 1, 22: 1, 14: 2}
Did not match all atoms present	14804-59-2	C1=CC=C(C=C1)C(=CC=O)Br	{18: 1, 26: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	14807-75-1	C(=N)([NH3+])SSC(=N)[NH3+].[Cl-].[Cl-]	{40: 2, 17: 2, 36: 2, 7: 2}
Did not match all atoms present	14808-60-7	O=[Si]=O	{29: 2}
Did not match all atoms present	14808-79-8	O=S(=O)([O-])[O-]	{29: 4}
Did not match all atoms present	1481-27-2	CC(=O)C1=C(C=C(C=C1)F)O	{16: 1, 1: 1, 21: 1, 14: 3, 24: 1}
Did not match all atoms present	1481-41-0	C[Si](C)(CCC(F)(F)F)Cl	{16: 3, 1: 2, 2: 2, 4: 1, 17: 1}
Did not match all atoms present	1481-70-5	CC(C)C[C@@H](C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@H](CC4=CC=CC=C4)C=O)NC(=O)[C@H](CCCN)NC(=O)[C@H](C(=C)C)NC(=O)[C@H](CC5=CC=C(C=C5)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(=O)N)N	{1: 3, 2: 11, 3: 10, 5: 1, 7: 1, 11: 3, 12: 1, 14: 19, 33: 1, 21: 1, 24: 11, 26: 1, 30: 4, 31: 8}
Did not match all atoms present	1481-93-2	C1COC2=CC=CC=C2C1O	{20: 1, 11: 2, 12: 1, 14: 4, 23: 1}
Did not match all atoms present	14812-59-0	CC1(C(OP(O1)Cl)(C)C)C	{1: 4, 23: 2, 13: 2, 17: 1}
Did not match all atoms present	14813-29-7	CC(=O)OC1=CC(=C2C(=C1)OC(=C(C2=O)OC(=O)C)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 6, 25: 1, 28: 6, 14: 4, 23: 1}
Did not match all atoms present	14814-07-4	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Er+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	14814-09-6	CCO[Si](CCCS)(OCC)OCC	{1: 3, 2: 6, 22: 3, 39: 1}
Did not match all atoms present	14816-16-1	COP(=S)(OC)O/N=C(/C#N)\C1=CC=CC=C1	{1: 2, 34: 1, 37: 1, 7: 1, 14: 5, 22: 3}
Did not match all atoms present	14816-18-3	CCOP(=S)(OCC)O/N=C(\C#N)/C1=CC=CC=C1	{1: 2, 2: 2, 37: 1, 7: 1, 34: 1, 14: 5, 22: 3}
Did not match all atoms present	14816-67-2	CC(C)NCC(C1=CC(=C(C=C1)O)NS(=O)(=O)C)O.Cl	{1: 3, 2: 1, 3: 2, 14: 3, 17: 1, 20: 1, 21: 1, 29: 2, 31: 2}
Did not match all atoms present	14817-09-5	CCCCCCCCCCOC1=C(C=C(C=C1OC)C(=O)N)OC	{1: 3, 2: 9, 14: 2, 22: 3, 24: 1, 30: 1}
Did not match all atoms present	14818-53-2	CC1=CC(=CC(=C1)NC(=O)C(F)(F)F)C	{1: 2, 4: 1, 14: 3, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	1482-82-2	C1=CC=C(C=C1)C[Se][Se]CC2=CC=CC=C2	{2: 2, 14: 10}
Did not match all atoms present	14825-85-5	C1=CC=C(C=C1)C#CC2(C3=CC=CC=C3C(C4=CC=CC=C42)(C#CC5=CC=CC=C5)O)O	{10: 4, 20: 2, 13: 2, 14: 18}
Did not match all atoms present	148256-63-7	CCCCCCCCCCCCC1=C(SC(=C1)Br)Br	{1: 1, 2: 11, 18: 2, 14: 1, 41: 1}
Did not match all atoms present	14826-66-5	N.N.[Cl-].[Cl-].[Zn+2]	{17: 2}
Did not match all atoms present	148274-47-9	C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[Nd+3]	{1: 18, 34: 3}
Did not match all atoms present	1483-20-1	COC1=CC2=C(C=C1)OC(=O)S2	{1: 1, 28: 1, 22: 1, 14: 3, 41: 1}
Did not match all atoms present	1483-27-8	COC1=CC(=C(C=C1)OC)S	{1: 2, 22: 2, 14: 3, 39: 1}
Did not match all atoms present	1483-28-9	COC1=CC(=C(C=C1)OC)S(=O)(=O)Cl	{1: 2, 29: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	1483-41-6	C(CBr)N=C=S	{8: 1, 2: 2, 34: 1, 18: 1}
Did not match all atoms present	1483-58-5	C=CNC(=S)N	{30: 1, 31: 1, 5: 1, 6: 1, 7: 1}
Did not match all atoms present	1483-60-9	CCC(C)C1=C(C=C(C=C1)C)C	{1: 4, 2: 1, 3: 1, 14: 3}
Did not match all atoms present	1483-64-3	C1=CC=C(C=C1)C(CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 2, 3: 2, 14: 20}
Did not match all atoms present	1483-72-3	C1=CC=C(C=C1)[I+]C2=CC=CC=C2.[Cl-]	{17: 1, 19: 1, 14: 10}
Did not match all atoms present	1483-73-4	C1=CC=C(C=C1)[I+]C2=CC=CC=C2.[Br-]	{18: 1, 19: 1, 14: 10}
Did not match all atoms present	1483-82-5	C1=CC=C(C=C1)C#CCl	{17: 1, 10: 2, 14: 5}
Did not match all atoms present	14832-59-8	C1=CC=C(C=C1)N=C2N=NN=N2	{34: 1, 35: 4, 14: 5, 15: 1}
Did not match all atoms present	14835-14-4	F[Si](F)F	{16: 3}
Did not match all atoms present	14835-59-7	C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=CC=CC=C4C3=O	{25: 2, 14: 13, 33: 1}
Did not match all atoms present	14836-60-3	[N+](=O)(O)[O-].O.O.[Hg+]	{20: 1}
Did not match all atoms present	14838-15-4	C[C@H]([C@H](C1=CC=CC=C1)O)N	{1: 1, 3: 2, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	14838-45-0	C1CCN(CC1)CC(C2=NOC(=C2)C3=CC=CC=C3)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{33: 1, 2: 3, 3: 1, 4: 1, 11: 5, 14: 6, 35: 1, 20: 2, 23: 1, 27: 3}
Did not match all atoms present	14839-81-7	CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=NC6=C5N=CN=C6N)O)O)O)O)O	{32: 1, 1: 2, 2: 3, 3: 3, 33: 2, 12: 4, 14: 4, 35: 5, 20: 7, 22: 3, 23: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	1484-08-8	CCCCN1C2=CC=CC=C2C3=CC=CC=C31	{1: 1, 2: 3, 14: 8, 33: 1}
Did not match all atoms present	1484-09-9	CC(C)N1C2=CC=CC=C2C3=CC=CC=C31	{1: 2, 3: 1, 14: 8, 33: 1}
Did not match all atoms present	1484-10-2	CCCN1C2=CC=CC=C2C3=CC=CC=C31	{1: 1, 2: 2, 14: 8, 33: 1}
Did not match all atoms present	1484-12-4	CN1C2=CC=CC=C2C3=CC=CC=C31	{1: 1, 14: 8, 33: 1}
Did not match all atoms present	1484-13-5	C=CN1C2=CC=CC=C2C3=CC=CC=C31	{33: 1, 14: 8, 5: 1, 6: 1}
Did not match all atoms present	1484-19-1	CCC1=CNC2=CC=CC=C21	{32: 1, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	1484-26-0	C1=CC=C(C=C1)COC2=CC=CC(=C2)N	{2: 1, 30: 1, 22: 1, 14: 9}
Did not match all atoms present	1484-50-0	C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)Br	{24: 1, 18: 1, 3: 1, 14: 10}
Did not match all atoms present	1484-85-1	C1OC2=C(O1)C=C(C=C2)CCN	{2: 2, 11: 1, 30: 1, 14: 3, 23: 2}
Did not match all atoms present	1484-88-4	C1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O	{17: 1, 29: 4, 14: 17, 23: 1}
Did not match all atoms present	14842-81-0	C([C@@H](C(=O)[O-])N)C(=O)O.C(C(C(=O)[O-])N)C(=O)O.C(C(C(=O)[O-])N)C(=O)O.[Mg+2].[K+]	{24: 3, 27: 3, 2: 3, 3: 3, 30: 3}
Did not match all atoms present	148438-00-0	COC(=O)C1=CC(=CC=C1)OC(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 22: 1, 28: 1}
Did not match all atoms present	14844-07-6	O=S([O-])S(=O)[O-]	{29: 4}
Did not match all atoms present	14846-40-3	CC(C)[Pb](C(C)C)(C(C)C)C(C)C	{1: 8, 3: 4}
Did not match all atoms present	14847-51-9	CC1=CC(=C(C=C1)Br)O	{1: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	14847-54-2	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=C(C=CC(=C3)[N+](=O)[O-])O	{34: 1, 38: 1, 14: 9, 15: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	14848-01-2	C1=CC(=CC=C1C(=O)Cl)N=[N+]=[N-]	{24: 1, 17: 1, 34: 2, 14: 4}
Did not match all atoms present	148498-78-6	CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)N[C@H]2CSSC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CCCNC(=N)N)CC3=CC=CC=C3)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC4=CN=CN4)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC5=CC=C(C=C5)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC6=CC=CC=C6)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N7CCC[C@H]7C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N8CCC[C@H]8C(=O)N[C@@H](CCC(=O)N)C(=O)NCC(=O)N[C@@H](CC9=CC=C(C=C9)O)C(=O)N)NC(=O)CNC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC1=CC=C(C=C1)O)N	{32: 6, 1: 18, 2: 67, 3: 50, 36: 4, 33: 2, 7: 4, 40: 1, 41: 2, 11: 9, 12: 7, 14: 34, 35: 1, 20: 7, 21: 3, 24: 56, 25: 5, 27: 3, 30: 19, 31: 48}
Did not match all atoms present	1485-00-3	C1OC2=C(O1)C=C(C=C2)C=C[N+](=O)[O-]	{38: 1, 11: 1, 14: 3, 6: 2, 23: 2}
Did not match all atoms present	1485-07-0	C1=CC=C2C=C(C=CC2=C1)CCO	{2: 2, 20: 1, 14: 7}
Did not match all atoms present	1485-70-7	C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2	{24: 1, 2: 1, 14: 10, 31: 1}
Did not match all atoms present	1485-92-3	CC1(C2=CC=CC=C2N(C13C=CC4=CC=CC=C4O3)C)C	{1: 3, 33: 1, 13: 2, 14: 10, 23: 1}
Did not match all atoms present	148556-69-8	CC(=C)C(=O)[O-].CN(C)C(=O)C=C.[Na+]	{1: 3, 5: 2, 6: 1, 33: 1, 7: 1, 24: 2}
Did not match all atoms present	14856-75-8	CC(C1=CC=CC=C1)O[Si](C)(C)C	{1: 4, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	14856-79-2	C[Si](C)(C)NCC1=CC=CC=C1	{1: 3, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	14857-34-2	CCO[Si](C)C	{1: 3, 2: 1, 22: 1}
Did not match all atoms present	14858-54-9	CCCCCCCCCCCCCCCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 17, 29: 3, 22: 2}
Did not match all atoms present	14858-61-8	CCCCCCCCCCCCCCCCCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 19, 29: 3, 22: 2}
Did not match all atoms present	14858-73-2	CCCCC(CC)COC(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2}
Did not match all atoms present	1486-01-7	[2H]C1=C(C(=C(C(=C1[2H])[2H])C2=C(C(=C(C(=C2[2H])[2H])[2H])[2H])[2H])[2H])[2H]	{14: 10}
Did not match all atoms present	1486-28-8	CP(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 14: 10}
Did not match all atoms present	1486-51-7	C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)O	{2: 1, 27: 1, 22: 1, 14: 9}
Did not match all atoms present	14860-49-2	CC(CN(C)C)C(C)(CC1=CC=C(C=C1)Cl)O	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	14861-17-7	C1=CC(=CC=C1N)OC2=C(C=C(C=C2)Cl)Cl	{17: 2, 30: 1, 22: 1, 14: 7}
Did not match all atoms present	14864-11-0	[In+]	{}
Did not match all atoms present	14866-33-2	CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[Br-]	{1: 4, 2: 28, 18: 1}
Did not match all atoms present	14867-04-0	OP(=O)(O)OP(=O)(O)[O-]	{20: 3, 29: 3, 22: 1}
Did not match all atoms present	14868-03-2	C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)O)O	{17: 2, 21: 2, 14: 8, 7: 2}
Did not match all atoms present	14868-53-2	[SiH3][SiH2][SiH2][SiH2][SiH3]	{}
Did not match all atoms present	148684-81-5	CC(C)[O-].C=CC(=O)O.[K+]	{1: 2, 3: 1, 5: 1, 6: 1, 27: 1, 29: 1}
Did not match all atoms present	14869-39-7	CCOC1=CC=CC=C1C(=O)C	{24: 1, 1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	1487-18-9	C=CC1=CC=CO1	{14: 3, 5: 1, 6: 1, 23: 1}
Did not match all atoms present	14871-41-1	[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Ir]	{17: 1, 29: 1, 14: 30}
Did not match all atoms present	14871-79-5	[O-]P=O.[O-]P=O.[Ba+2]	{29: 4}
Did not match all atoms present	14871-92-2	C1=CC=NC(=C1)C2=CC=CC=N2.Cl[Pd]Cl	{17: 2, 35: 2, 14: 8}
Did not match all atoms present	14873-10-0	C1=C(NC=N1)CC(C(=O)[O-])N.C1=C(NC=N1)CC(C(=O)[O-])N.[Co+2]	{32: 2, 2: 2, 3: 2, 14: 4, 35: 2, 24: 2, 30: 2}
Did not match all atoms present	14873-63-3	C1=CC=C(C=C1)C#N.C1=CC=C(C=C1)C#N.[Cl-].[Cl-].[Pt+2]	{17: 2, 37: 2, 14: 10}
Did not match all atoms present	14873-92-8	CCSCC.CCSCC.Cl[Pt]Cl	{40: 2, 1: 4, 2: 4, 17: 2}
Did not match all atoms present	14874-59-0	O=[U]=O.Cl	{17: 1, 29: 2}
Did not match all atoms present	14874-70-5	F[B-](F)(F)F	{16: 4}
Did not match all atoms present	14874-82-9	C/C(=C/C(=O)C)/O.[C-]#[O+].[C-]#[O+].[Rh]	{1: 2, 6: 1, 7: 1, 20: 1, 24: 1, 29: 2}
Did not match all atoms present	14875-96-8	CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1[N-]2)C=C)C)C=C)C)C)CCC(=O)O)CCC(=O)O.[Fe+2]	{1: 4, 2: 4, 35: 4, 5: 2, 6: 2, 14: 4, 27: 2}
Did not match all atoms present	14877-29-3	[Ga+2]	{}
Did not match all atoms present	14877-30-6	[In+2]	{}
Did not match all atoms present	14877-41-9	CC(/C(=C/C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C/C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C/C(=O)C(C)(C)C)/O)(C)C.[Co]	{1: 18, 4: 6, 6: 3, 7: 3, 20: 3, 24: 3}
Did not match all atoms present	14878-41-2	[Co+9].[NH-]CC[NH-].[NH-]CC[NH-].[NH-]CC[NH-]	{2: 6, 36: 6}
Did not match all atoms present	14878-96-7	C[S-].C[S-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe]	{1: 2, 29: 6}
Did not match all atoms present	1488-42-2	C1=CC=C(C=C1)[I+]C2=CC=CC=C2C(=O)[O-]	{24: 1, 19: 1, 14: 9}
Did not match all atoms present	14881-92-6	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].[Zn+2]	{1: 2, 33: 2, 11: 2, 14: 14, 24: 2, 29: 2}
Did not match all atoms present	14882-18-9	C1=CC=C2C(=C1)C(=O)O[Bi]O2.O	{28: 1, 14: 4, 23: 1}
Did not match all atoms present	14883-62-6	C(CNCCNCCN)N.[Cl-].Cl[Rh-]Cl	{17: 3, 2: 6, 30: 2, 31: 2}
Did not match all atoms present	14884-70-9	CN(CC1=CC=CC=C1)[Si](C)(C)C	{1: 4, 2: 1, 14: 5, 33: 1}
Did not match all atoms present	14885-29-1	CC(C)C1=NC=C(N1C)[N+](=O)[O-]	{1: 3, 3: 1, 38: 1, 33: 1, 14: 1, 35: 1}
Did not match all atoms present	14885-60-0	[3HH]	{}
Did not match all atoms present	148864-94-2	CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)COC(=O)C6=CC=CC=C6)C(=O)O3)O)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O[C@H]8C[C@@H]([C@@H]([C@@H](O8)C)NC(=O)C)OC)OC)\C)C	{1: 10, 2: 2, 3: 1, 11: 6, 12: 17, 13: 2, 14: 12, 15: 3, 20: 2, 22: 4, 23: 5, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	1489-53-8	C1=CC(=C(C(=C1)F)F)F	{16: 3, 14: 3}
Did not match all atoms present	14890-36-9	B(F)(F)[Si](F)(F)[Si](F)(F)F	{16: 7}
Did not match all atoms present	14890-41-6	[V+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	14892-14-9	C(C(=O)O)OC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 2: 1, 27: 1, 22: 1}
Did not match all atoms present	14897-04-2	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Co+3]	{}
Did not match all atoms present	14899-07-1	CCNC1=CC2=C(C=C1)C(=C3C=CC(=NCC)C=C3O2)C4=CC=CC=C4C(=O)OCC	{1: 3, 2: 3, 34: 1, 14: 10, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	14899-50-4	O[Bi]=O	{20: 1, 29: 1}
Did not match all atoms present	14899-70-8	Cl[Bi]	{17: 1}
Did not match all atoms present	149-11-1	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Cu+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	149-15-5	CCCCN(CCCC)CCCOC(=O)C1=CC=C(C=C1)N.CCCCN(CCCC)CCCOC(=O)C1=CC=C(C=C1)N.OS(=O)(=O)O	{1: 4, 2: 18, 33: 2, 14: 8, 20: 2, 28: 2, 29: 2, 30: 2}
Did not match all atoms present	149-16-6	CCCCN(CCCC)CCCOC(=O)C1=CC=C(C=C1)N	{1: 2, 2: 9, 33: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	149-17-7	COC1=C/C(=C/NNC(=O)C2=CC=NC=C2)/C=CC1=O	{1: 1, 35: 1, 6: 1, 14: 7, 15: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	149-30-4	C1=CC=C2C(=C1)NC(=S)S2	{32: 1, 41: 1, 14: 4}
Did not match all atoms present	149-39-3	CCCCCCCCCCCCCCCCCC(=O)N(C)CCS(=O)(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 18, 29: 3, 33: 1}
Did not match all atoms present	149-44-0	C(O)S(=O)[O-].[Na+]	{2: 1, 20: 1, 29: 2}
Did not match all atoms present	149-45-1	C1=C(C=C(C(=C1S(=O)(=O)[O-])O)O)S(=O)(=O)[O-].[Na+].[Na+]	{21: 2, 14: 2, 29: 6}
Did not match all atoms present	149-46-2	C1=C(C=C(C(=C1S(=O)(=O)O)O)O)S(=O)(=O)O	{20: 2, 21: 2, 14: 2, 29: 4}
Did not match all atoms present	149-64-4	CCCC[N+]1([C@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)C(CO)C4=CC=CC=C4)C.[Br-]	{1: 2, 2: 4, 3: 1, 11: 2, 12: 5, 14: 5, 18: 1, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	149-74-6	C[Si](C1=CC=CC=C1)(Cl)Cl	{1: 1, 14: 5, 17: 2}
Did not match all atoms present	149-91-7	C1=C(C=C(C(=C1O)O)O)C(=O)O	{27: 1, 21: 3, 14: 2}
Did not match all atoms present	14901-16-7	C1=CC=C(C=C1)NC(=S)NC2=NC=CS2	{35: 1, 31: 2, 41: 1, 14: 7, 7: 1}
Did not match all atoms present	149013-84-3	C[Sn](C)(C)C[SiH](C1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 2: 1, 14: 10}
Did not match all atoms present	14902-91-1	[H-].[Ti+4]	{}
Did not match all atoms present	14905-79-4	CCC(C)SC1=CC=CC=C1	{40: 1, 1: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	14905-80-7	CC1=CC(=CC=C1)SC(C)C	{40: 1, 1: 3, 3: 1, 14: 4}
Did not match all atoms present	14905-81-8	CC1=CC=C(C=C1)SC(C)C	{40: 1, 1: 3, 3: 1, 14: 4}
Did not match all atoms present	14906-55-9	CCC1=CC=[N+](C=C1)[O-]	{1: 1, 2: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	14906-59-3	C1=C[N+](=CC=C1C#N)[O-]	{33: 1, 29: 1, 14: 4, 37: 1}
Did not match all atoms present	14906-61-7	COC1=C[N+](=CC=C1)[O-]	{1: 1, 33: 1, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	14906-64-0	C1=CC(=C[N+](=C1)[O-])C#N	{33: 1, 29: 1, 14: 4, 37: 1}
Did not match all atoms present	149099-23-0	CCOC1(OCCO1)CCS(=O)(=O)C2=CC=CC=C2	{1: 1, 2: 3, 11: 2, 13: 1, 14: 5, 22: 1, 23: 2, 29: 2}
Did not match all atoms present	1491-09-4	C1=CC=C2C(=C1)C=CC3=CC4=C(C5=CC=CC=C5S4)N=C32	{41: 1, 35: 1, 14: 11}
Did not match all atoms present	1491-10-7	C1=CC=C2C(=C1)C=CC3=NC4=C(C=C32)SC5=CC=CC=C54	{41: 1, 35: 1, 14: 11}
Did not match all atoms present	1491-41-4	CCOP(=O)(OCC)ON1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O	{1: 2, 2: 2, 33: 1, 14: 6, 22: 3, 25: 2, 29: 1}
Did not match all atoms present	1491-59-4	CC1=CC(=C(C(=C1CC2=NCCN2)C)O)C(C)(C)C	{32: 1, 1: 5, 2: 1, 35: 1, 4: 1, 11: 2, 14: 1, 15: 1, 21: 1}
Did not match all atoms present	149104-88-1	B(C1=CC=C(C=C1)S(=O)(=O)C)(O)O	{1: 1, 20: 2, 29: 2, 14: 4}
Did not match all atoms present	14911-67-2	[B-](Cl)(Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	14913-52-1	[Nd+3]	{}
Did not match all atoms present	14913-58-7	[Cl-].[Cl-].[Cl-].[Cl-].[F-].[Sb+5]	{16: 1, 17: 4}
Did not match all atoms present	14914-84-2	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Ho+3]	{17: 3}
Did not match all atoms present	149158-18-9	CCCCCCCS(=O)(=O)O	{1: 1, 2: 6, 20: 1, 29: 2}
Did not match all atoms present	14917-12-5	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Cr]	{29: 5, 14: 15}
Did not match all atoms present	14917-59-0	C1=CC(=CC=C1C(=O)N=[N+]=[N-])Br	{24: 1, 18: 1, 34: 2, 14: 4}
Did not match all atoms present	14918-69-5	C1=CC(=O)C2=C(C1=O)C(=C(C(=C2O)Cl)Cl)O	{17: 2, 21: 2, 14: 2, 25: 2}
Did not match all atoms present	149182-72-9	CC(C)(C)NC(=O)[C@@H]1CC2=CC=CC=C2CN1	{32: 1, 1: 3, 4: 1, 11: 2, 12: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	14919-77-8	C1=CC(=C(C(=C1CNNC(=O)C(CO)N)O)O)O.Cl	{2: 2, 3: 1, 14: 2, 17: 1, 20: 1, 21: 3, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	1492-02-0	CC(C)(C)C1=NN=C(S1)NS(=O)(=O)C2=CC=CC=C2	{1: 3, 35: 2, 4: 1, 41: 1, 14: 5, 29: 2, 31: 1}
Did not match all atoms present	1492-30-4	CCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 14, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	1492-54-2	CC1=C2C=CC3=CC=CC=C3C2=NC4=C1C=C5C=CC6=C7C5=C4C=CC7=CC=C6	{1: 1, 35: 1, 14: 14}
Did not match all atoms present	1492-55-3	CC1=C2C=C3C=CC4=C5C3=C(C2=NC6=C1C7=CC=CC=C7C=C6)C=CC5=CC=C4	{1: 1, 35: 1, 14: 14}
Did not match all atoms present	1492-87-1	CN(CCCCOC(=O)C=C)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 4, 5: 1, 6: 1, 33: 1, 16: 9, 28: 1, 29: 2}
Did not match all atoms present	1492-93-9	C1=CC(=CC=C1NC(=O)CF)N(CCCl)CCCl	{33: 1, 2: 5, 14: 4, 16: 1, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	14920-81-1	CC1=C(C(=CC=C1)C)C(=O)OC	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	14920-89-9	CC1=C(OC=C1)C	{1: 2, 14: 2, 23: 1}
Did not match all atoms present	14920-93-5	C[Si](C)(C1=CC=CC=C1)O[Si](C)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 22: 1, 14: 15}
Did not match all atoms present	14921-35-8	CCCOC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC	{1: 2, 34: 1, 6: 1, 2: 2, 14: 8, 22: 2}
Did not match all atoms present	14921-36-9	CCCOC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCC	{1: 2, 34: 1, 6: 1, 2: 3, 14: 8, 22: 2}
Did not match all atoms present	14921-46-1	CCCCOC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC	{1: 2, 34: 1, 6: 1, 2: 3, 14: 8, 22: 2}
Did not match all atoms present	14922-36-2	C1=CC(=CC=C1C(=O)C(=O)O)[N+](=O)[O-]	{24: 1, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	149245-03-4	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=NC=CC6=CC=CC=C65	{35: 1, 14: 22}
Did not match all atoms present	14926-29-5	CC(=O)OC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)O3)C5=C(O2)C=C(C=C5)OC(=O)C	{1: 2, 38: 1, 13: 1, 14: 9, 23: 1, 28: 3}
Did not match all atoms present	14928-91-7	CC1(C2=CC=CC=C2[N+](=C1/C=C/C3=CC=C(C=C3)N(CCC#N)CCC#N)C)C.[Cl-]	{1: 3, 2: 4, 37: 2, 6: 2, 33: 2, 13: 1, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	14929-11-4	CC(C)(C(=O)OCCCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)Cl	{1: 4, 2: 3, 4: 2, 14: 8, 17: 2, 22: 2, 28: 2}
Did not match all atoms present	1493-13-6	C(F)(F)(F)S(=O)(=O)O	{16: 3, 20: 1, 4: 1, 29: 2}
Did not match all atoms present	1493-27-2	C1=CC=C(C(=C1)[N+](=O)[O-])F	{16: 1, 38: 1, 14: 4}
Did not match all atoms present	1493-51-2	C1=CC(=CC=C1C(=O)CC(=O)C2=CC=C(C=C2)F)F	{16: 2, 24: 2, 2: 1, 14: 8}
Did not match all atoms present	1493-68-1	C12=C3C4=C(C(=C1C(=C(C(=C2C(=C(C3=C(C(=C4F)F)F)F)F)F)F)F)F)F	{16: 10}
Did not match all atoms present	14930-96-2	CC1CCCC(C=CC(=O)OC23C(C=CC1)C(C(=C)C(C2C(NC3=O)CC4=CC=CC=C4)C)O)O	{32: 1, 1: 2, 2: 1, 5: 1, 11: 4, 12: 7, 13: 1, 14: 9, 15: 1, 20: 2, 25: 1, 28: 1}
Did not match all atoms present	14931-83-0	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Co+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	14933-08-5	CCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]	{1: 3, 2: 14, 29: 3}
Did not match all atoms present	14933-76-7	CC[N+]1=C(SC2=CC=CC=C21)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 33: 1, 41: 1, 14: 8, 29: 3}
Did not match all atoms present	14934-37-3	CCN1C2=CC=CC=C2OC1=CC(=CC3=[N+](C4=CC=CC=C4O3)CC)C.[I-]	{1: 3, 2: 2, 33: 2, 6: 2, 7: 1, 14: 8, 15: 1, 19: 1, 23: 2}
Did not match all atoms present	14937-39-4	CN(C)C(N(C)C)P	{1: 4, 3: 1, 33: 2}
Did not match all atoms present	14937-45-2	CCCCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC.[Br-]	{1: 4, 2: 24, 18: 1}
Did not match all atoms present	14938-35-3	CCCCCC1=CC=C(C=C1)O	{1: 1, 2: 4, 21: 1, 14: 4}
Did not match all atoms present	14938-41-1	C[Ge]C.C[Ge]C.C[Ge](C)C.C[Ge](C)C	{1: 10}
Did not match all atoms present	14938-42-2	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C2=O)C=CC=C3S(=O)(=O)[O-].[K+].[K+]	{25: 2, 29: 6, 14: 6}
Did not match all atoms present	14939-17-4	O([GeH3])[GeH3]	{22: 1}
Did not match all atoms present	14939-42-5	[SbH2].[SbH2]	{}
Did not match all atoms present	14939-45-8	[SiH3][Se][SiH3]	{}
Did not match all atoms present	149391-23-1	C1CCC(CC1)[S-].C1CCC(CC1)[S-].Cl[Ti](Cl)(Cl)Cl	{17: 4, 11: 10, 12: 2}
Did not match all atoms present	14940-63-7	[2H]O	{}
Did not match all atoms present	14940-65-9	[3H]O[3H]	{}
Did not match all atoms present	14944-28-6	CC1(CCCC2=CC=CC=C21)O	{1: 1, 11: 3, 20: 1, 13: 1, 14: 4}
Did not match all atoms present	14945-24-5	CN(C)C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)N(C)C)C8=CC=C(C=C8)N(C)C)C9=CC=C(C=C9)N(C)C)N3	{32: 2, 1: 8, 35: 2, 14: 24, 33: 4}
Did not match all atoms present	14948-62-0	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.O.O.O.O.O.[Pr+3].[Pr+3]	{24: 3}
Did not match all atoms present	149488-93-7	C1=CC(=C(C(=C1)Cl)CCN)F	{16: 1, 17: 1, 2: 2, 30: 1, 14: 3}
Did not match all atoms present	14949-00-9	C1(=NN=C(S1)S(=O)(=O)N)N	{41: 1, 35: 2, 29: 2, 30: 2}
Did not match all atoms present	14949-69-0	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Ni+2]	{16: 12, 24: 2, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	14949-70-3	C(C(=O)C(F)(F)F)C(=O)C(F)(F)F.C(C(=O)C(F)(F)F)C(=O)C(F)(F)F.[Zn]	{16: 12, 24: 4, 2: 2, 4: 4}
Did not match all atoms present	149497-03-0	CC1=CC(=C(C(=C1)S(=O)(=O)O)N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C(=O)O)C.[Na+]	{1: 2, 34: 2, 35: 1, 33: 1, 12: 1, 14: 6, 15: 1, 20: 2, 25: 1, 27: 1, 29: 4}
Did not match all atoms present	149497-04-1	CC1=CC(=C(C(=C1)S(=O)(=O)O)N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C(=O)O)C	{1: 2, 34: 2, 35: 1, 33: 1, 12: 1, 14: 6, 15: 1, 20: 2, 25: 1, 27: 1, 29: 4}
Did not match all atoms present	1495-18-7	C(=S)(F)Cl	{16: 1, 17: 1, 7: 1}
Did not match all atoms present	1495-36-9	C(F)(F)(F)[Ge](Cl)(Cl)Cl	{16: 3, 17: 3, 4: 1}
Did not match all atoms present	1495-72-3	B(F)(F)F.C1=CC=C(C=C1)NC2=CC=CC=C2	{16: 3, 14: 10, 31: 1}
Did not match all atoms present	14950-87-9	[Au+].[C-]#N.[C-]#N	{}
Did not match all atoms present	149530-93-8	CC1=CC(=C(C(=C1)S(=O)(=O)[O-])NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])CNC5=C(C(=NC=N5)F)Cl.[Na+].[Na+]	{1: 1, 2: 1, 35: 2, 14: 8, 16: 1, 17: 1, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	14954-75-7	CC1=NN(C(=O)C1N/N=C\2/C3=CC=CC=C3C(=CC2=O)S(=O)(=O)O)C4=CC=CC=C4	{1: 1, 34: 1, 35: 1, 33: 1, 12: 1, 14: 10, 15: 3, 20: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	149552-52-3	CC(C1=CC=C(C=C1)Br)N=C=O	{1: 1, 34: 1, 3: 1, 8: 1, 14: 4, 18: 1, 29: 1}
Did not match all atoms present	149559-16-0	C1=CC2=C3C(=CC4=C2[C@@H]5[C@@H](O5)[C@H]([C@@H]4O)O)C=CC6=C(C=CC1=C63)[N+](=O)[O-]	{20: 2, 12: 4, 38: 1, 14: 7, 23: 1}
Did not match all atoms present	149564-66-9	[Li+].CC1=CC=C(C=C1)N2C(=O)C(=C(N2)C)NN=C3C=C(C=C(C3=O)S(=O)(=O)[O-])[N+](=O)[O-].CC1=C(C(=O)NN1)NN=C2C=C(C=CC2=O)Cl.[Na+].[Cr]	{32: 3, 1: 3, 34: 2, 38: 1, 33: 1, 14: 9, 15: 5, 17: 1, 25: 4, 29: 3, 31: 2}
Did not match all atoms present	1496-00-0	C1=CC=C(C=C1)CC2=CC(=CC=C2)F	{16: 1, 2: 1, 14: 9}
Did not match all atoms present	1496-02-2	C1=CC=C(C=C1)NNC(=O)C2=CC=C(C=C2)F	{16: 1, 24: 1, 14: 9, 31: 2}
Did not match all atoms present	1496-94-2	CCCP(=O)(CCC)CCC	{1: 3, 2: 6, 29: 1}
Did not match all atoms present	14960-63-5	CON1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C=O	{1: 1, 26: 1, 22: 1, 14: 9, 33: 1}
Did not match all atoms present	14961-85-4	CCC1(C(=O)NC(=O)N(C1=O)CCN(CC)CC)C2=CC=CC=C2.Cl	{32: 1, 1: 3, 2: 5, 33: 2, 13: 1, 14: 5, 17: 1, 25: 3}
Did not match all atoms present	149625-80-9	CC(C)[Si](C(C)C)(C(C)C)OC[C@@H]1[C@H]2[C@@H](C=CO1)OC(=O)O2	{1: 6, 2: 1, 3: 3, 12: 3, 14: 2, 22: 1, 23: 1}
Did not match all atoms present	14965-49-2	C[NH3+].[I-]	{1: 1, 19: 1}
Did not match all atoms present	14965-52-7	F[Si](Cl)(Cl)Cl	{16: 1, 17: 3}
Did not match all atoms present	1497-17-2	CC1(CC(=O)NC1=O)C2=CC=CC=C2	{32: 1, 1: 1, 11: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	1497-49-0	C1=CC=C(C=C1)NC=CC=CC=NC2=CC=CC=C2.Cl	{17: 1, 34: 1, 14: 10, 6: 5, 31: 1}
Did not match all atoms present	1497-68-3	CCOP(=S)(CC)Cl	{1: 2, 2: 2, 22: 1, 17: 1}
Did not match all atoms present	14970-38-8	C[N+]1=C(SC2=C1C=CC(=C2)OC)N=NN(C)C3=CC=C(C=C3)[N+](=O)[O-].[Cl-]	{1: 3, 34: 2, 38: 1, 33: 2, 41: 1, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	14970-40-2	C[N+]1=C(SC2=C1C=CC(=C2)OC)N=NC3=CC=C(C=C3)N(C)CCO.Cl[Zn-](Cl)Cl	{1: 3, 2: 2, 33: 2, 41: 1, 34: 2, 14: 7, 17: 3, 20: 1, 22: 1}
Did not match all atoms present	14971-42-7	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Mo]	{29: 5, 14: 15}
Did not match all atoms present	149717-54-4	CCN1C(=C(C(=C(C1=O)C(=O)N)C)CS(=O)(=O)[O-])O.[Na+]	{1: 2, 2: 2, 33: 1, 21: 1, 24: 1, 25: 1, 29: 3, 30: 1}
Did not match all atoms present	14972-90-8	[NH4+].F[Sb-](F)(F)F	{16: 4}
Did not match all atoms present	14973-89-8	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Br-].[Rh]	{18: 1, 14: 45}
Did not match all atoms present	14974-48-2	C(=O)(C(=O)[O-])[O-].[V+2]	{24: 2}
Did not match all atoms present	14975-23-6	B=[PH+]C	{1: 1}
Did not match all atoms present	14976-57-9	C[C@@](C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCC[C@H]3CCCN3C.C(=CC(=O)O)C(=O)O	{1: 2, 2: 2, 4: 1, 6: 2, 33: 1, 11: 3, 12: 1, 14: 9, 17: 1, 22: 1, 27: 2}
Did not match all atoms present	14977-37-8	OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.[Mg+2].[Mg+2].[K+].[K+]	{20: 6, 29: 6}
Did not match all atoms present	149793-69-1	C1=C(C=C(C=C1C(F)(F)F)F)C#N	{16: 4, 4: 1, 37: 1, 14: 3}
Did not match all atoms present	1498-40-4	CCP(Cl)Cl	{1: 1, 2: 1, 17: 2}
Did not match all atoms present	1498-42-6	CCOP(Cl)Cl	{1: 1, 2: 1, 22: 1, 17: 2}
Did not match all atoms present	1498-47-1	C=CCP(=O)(Cl)Cl	{17: 2, 2: 1, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	1498-51-7	CCOP(=O)(Cl)Cl	{1: 1, 2: 1, 29: 1, 22: 1, 17: 2}
Did not match all atoms present	1498-52-8	CCCCOP(=O)(Cl)Cl	{1: 1, 2: 3, 29: 1, 22: 1, 17: 2}
Did not match all atoms present	1498-64-2	CCOP(=S)(Cl)Cl	{1: 1, 2: 1, 22: 1, 17: 2}
Did not match all atoms present	1498-65-3	CN(C)P(=S)(Cl)Cl	{1: 2, 33: 1, 17: 2}
Did not match all atoms present	1498-88-0	CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)C=CC(=C4)[N+](=O)[O-])C)C	{1: 3, 38: 1, 33: 1, 13: 2, 14: 9, 23: 1}
Did not match all atoms present	1498-96-0	CCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 3, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	14982-80-0	[OH-].[Cl-].[Cl-].[Cr+3]	{17: 2}
Did not match all atoms present	14983-42-7	B(OCCOC)(OCCOC)OCCOC	{1: 3, 2: 6, 22: 6}
Did not match all atoms present	14983-92-7	CC1=CC=CC=C1NC(=O)OC	{1: 2, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	14984-21-5	C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)OC4=CC=CC=C4	{24: 1, 22: 2, 14: 18}
Did not match all atoms present	14984-38-4	C([C@H]([C@H]([C@@H](C(=O)C(=O)[O-])O)O)O)O.[Na+]	{24: 2, 2: 1, 3: 3, 20: 4}
Did not match all atoms present	14984-71-5	N(=O)[O-].N(=O)[O-].[Cu+2]	{34: 2, 29: 4}
Did not match all atoms present	14984-74-8	FPF	{16: 2}
Did not match all atoms present	14984-81-7	O=[Se](=O)(F)F	{16: 2, 29: 2}
Did not match all atoms present	149845-06-7	CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@H]([C@H](CC3=CC=CC=C3)NC(=O)[C@H](CC(=O)N)NC(=O)C4=NC5=CC=CC=C5C=C4)O.CS(=O)(=O)O	{1: 4, 2: 3, 3: 3, 4: 1, 33: 1, 11: 6, 12: 3, 14: 11, 35: 1, 20: 2, 24: 4, 29: 2, 30: 1, 31: 3}
Did not match all atoms present	14986-21-1	O([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl	{17: 6, 22: 1}
Did not match all atoms present	14986-57-3	[O-]S(=O)F.[K+]	{16: 1, 29: 2}
Did not match all atoms present	14986-60-8	[N-]=[N+]=NF	{16: 1, 34: 2}
Did not match all atoms present	14986-65-3	F[GeH2]F	{16: 2}
Did not match all atoms present	14986-84-6	[O-]P(=O)([O-])OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{29: 10, 22: 3}
Did not match all atoms present	14986-89-1	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Lu+3].[Lu+3]	{29: 12}
Did not match all atoms present	14986-91-5	[O-][Se](=O)(=O)[O-].[Mg+2]	{29: 4}
Did not match all atoms present	14986-94-8	[O-2].[V].[Mn+2]	{}
Did not match all atoms present	14988-07-9	Cl[Hg-](Cl)Cl	{17: 3}
Did not match all atoms present	1499-10-1	C1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=CC=CC=C42)C5=CC=CC=C5	{14: 18}
Did not match all atoms present	1499-21-4	C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)Cl	{17: 1, 29: 1, 14: 10}
Did not match all atoms present	1499-33-8	C[As+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]	{1: 1, 19: 1, 14: 15}
Did not match all atoms present	1499-53-2	CCOC(=O)CNC(=O)C1=CC=CC=C1	{1: 1, 2: 2, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	1499-54-3	C1=CC=C(C=C1)C(=O)NCC(=O)NO	{24: 2, 2: 1, 20: 1, 14: 5, 31: 2}
Did not match all atoms present	14994-35-5	CC1=CC(=CC(=C1N(C)C)C)F	{16: 1, 1: 4, 14: 2, 33: 1}
Did not match all atoms present	149947-19-3	C1=CC(=C(C=C1Br)F)/C=C/C(=O)O	{16: 1, 18: 1, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	14995-22-3	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Fe+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	14995-38-1	CCC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 29: 3, 14: 4}
Did not match all atoms present	149950-60-7	CCOCN1C(=C(C(=O)NC1=O)C(C)C)CC2=CC=CC=C2	{32: 1, 1: 3, 2: 3, 3: 1, 33: 1, 14: 5, 22: 1, 25: 2}
Did not match all atoms present	14996-02-2	O=S(=O)([O-])O	{20: 1, 29: 3}
Did not match all atoms present	14996-50-0	[2H]C1(C(C12CC2)([2H])[2H])[2H]	{11: 4, 13: 1}
Did not match all atoms present	14996-70-4	CN(C1=CC=CC=C1)N(C)C2=CC=CC=C2	{1: 2, 14: 10, 33: 2}
Did not match all atoms present	14996-78-2	C1CCC(C(=O)CC1)C2=CC=CC=C2	{25: 1, 11: 5, 12: 1, 14: 5}
Did not match all atoms present	14998-57-3	O=[Se](=O)([O-])O	{20: 1, 29: 3}
Did not match all atoms present	149982-43-4	CC(C1=CC=CC=C1)C2=C(C=CC(=C2)OC(=O)C)OC(=O)C.CC(=O)OC1=CC=C(C=C1)OC(=O)C.C1=CC(=CC=C1C(=O)O)C(=O)O	{27: 2, 1: 5, 3: 1, 28: 4, 14: 16}
Did not match all atoms present	149982-45-6	CC\1=CC(=O)N(C(=O)/C1=N/NC2=CC=C(C=C2)C(=O)NCC(C)NC(=O)C3=CC=C(C=C3)N/N=C\4/C(=CC(=O)N(C4=O)CCCN(C)C)C)CCCN(C)C.CC(C(=O)O)O.CC(=O)O	{1: 9, 2: 7, 3: 2, 33: 4, 34: 2, 14: 10, 15: 4, 20: 1, 24: 2, 25: 4, 27: 2, 31: 4}
Did not match all atoms present	14999-97-4	C1C2=C3C4=C5C(=O)CC6=C(C5=NC4=C7C=C8C(=C9C(=C4C(=O)CC5=C(C4=N9)C(=O)C4=CC=CC=C4C5=O)C4=C5CC(=O)C9=CC%10=CC=CC(=O)C%10=CC9=C5N=C84)C=C7C3=NC2=C2C=C3C(=O)C=CC=C3C=C2C1=O)C(=O)C1=CC=CC=C1C6=O	{25: 10, 11: 4, 35: 4, 14: 20, 15: 12}
Did not match all atoms present	149990-48-7	CC[P+](C1=CC=C(C=C1)C)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.CC(=O)[O-]	{24: 1, 1: 5, 2: 1, 14: 12}
Did not match all atoms present	150-13-0	C1=CC(=CC=C1C(=O)O)N	{27: 1, 30: 1, 14: 4}
Did not match all atoms present	150-19-6	COC1=CC=CC(=C1)O	{1: 1, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	150-30-1	C1=CC=C(C=C1)CC(C(=O)O)N	{27: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	150-33-4	C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N.C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N.[O-]S(=O)(=O)[O-]	{34: 2, 29: 4, 14: 18, 31: 2}
Did not match all atoms present	150-46-9	B(OCC)(OCC)OCC	{1: 3, 2: 3, 22: 3}
Did not match all atoms present	150-50-5	CCCCSP(SCCCC)SCCCC	{40: 3, 1: 3, 2: 9}
Did not match all atoms present	150-59-4	CCN(CCCC1=CC=CC=C1)CCCC2=CC=CC=C2	{1: 1, 2: 7, 14: 10, 33: 1}
Did not match all atoms present	150-60-7	C1=CC=C(C=C1)CSSCC2=CC=CC=C2	{40: 2, 2: 2, 14: 10}
Did not match all atoms present	150-61-8	C1=CC=C(C=C1)NCCNC2=CC=CC=C2	{2: 2, 14: 10, 31: 2}
Did not match all atoms present	150-68-5	CN(C)C(=O)NC1=CC=C(C=C1)Cl	{1: 2, 33: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	150-69-6	CCOC1=CC=C(C=C1)NC(=O)N	{1: 1, 2: 1, 14: 4, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	150-76-5	COC1=CC=C(C=C1)O	{1: 1, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	150-78-7	COC1=CC=C(C=C1)OC	{1: 2, 22: 2, 14: 4}
Did not match all atoms present	150-90-3	C(CC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 2: 2}
Did not match all atoms present	1500-91-0	CCC1=C(NC(=C1C)C(=O)C)C	{24: 1, 1: 4, 2: 1, 32: 1}
Did not match all atoms present	15001-27-1	CC(=O)C=CC1=CC(=C(C=C1)OC)OC	{24: 1, 1: 3, 22: 2, 14: 3, 6: 2}
Did not match all atoms present	15005-90-0	O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Cr+3].[Cr+3].[Cr+3]	{29: 8}
Did not match all atoms present	15008-36-3	CCN(CC)C1=CC(=C(C=C1)C(C2=CC=CC=C2)C3=C(C=C(C=C3)N(CC)CC)C)C	{1: 6, 2: 4, 3: 1, 14: 11, 33: 2}
Did not match all atoms present	15009-91-3	C1=CC=NC(=C1)[N+](=O)[O-]	{35: 1, 38: 1, 14: 4}
Did not match all atoms present	150099-94-8	[Li+].C1=C(C=C(C=C1C(=O)OCCO)S(=O)(=O)[O-])C(=O)OCCO	{28: 2, 2: 4, 20: 2, 29: 3, 14: 3}
Did not match all atoms present	1501-04-8	COC(=O)CCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	1501-05-9	C1=CC=C(C=C1)C(=O)CCCC(=O)O	{24: 1, 2: 3, 27: 1, 14: 5}
Did not match all atoms present	15010-23-8	CSCCC(C(=O)O)NC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 3, 3: 1, 40: 1, 14: 2, 17: 3, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	15012-36-9	CC1=CC=CC(=C1C)C(=O)OC	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	15014-25-2	C1=CC=C(C=C1)COC(=O)CC(=O)OCC2=CC=CC=C2	{2: 3, 28: 2, 14: 10}
Did not match all atoms present	15015-81-3	CCCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 15, 29: 3}
Did not match all atoms present	15015-84-6	C1=CC=C(C(=C1)C(=O)O)C(=O)O.C(C(CO)(CO)CO)O	{20: 4, 2: 4, 27: 2, 4: 1, 14: 4}
Did not match all atoms present	150151-21-6	CC1=CC=CC(=C1C)C2=C(C(=C(C=C2)N/N=C\3/C(=O)C=CC4=CC=CC=C43)C)C	{1: 4, 34: 1, 14: 11, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	15016-15-6	CCCCOC1=C(C=CC(=C1)N)C(=O)OCC[NH+](CC)CC.[Cl-]	{1: 3, 2: 7, 14: 3, 17: 1, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	15017-02-4	CC1=CC=CC=C1NC2=CC=C(C=C2)NC3=CC=CC=C3C	{1: 2, 14: 12, 31: 2}
Did not match all atoms present	15018-03-8	CC(C)(C)C1=CC(=C(C(=C1)C(=O)OC)O)C(C)(C)C	{1: 7, 4: 2, 21: 1, 14: 2, 28: 1}
Did not match all atoms present	1502-47-2	C1(=NC2=NC(=NC3=NC(=NC(=N1)N23)N)N)N	{33: 1, 35: 6, 30: 3}
Did not match all atoms present	1502-95-0	CC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)OC(=O)C)CCN3C.Cl	{1: 3, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 23: 1, 28: 2}
Did not match all atoms present	15020-57-2	CN(C)S(=O)(=O)C1=CC=C(C=C1)O	{1: 2, 33: 1, 21: 1, 14: 4, 29: 2}
Did not match all atoms present	15021-44-0	CCOC(CN=C(N)N)OCC.OS(=O)(=O)O	{1: 2, 2: 3, 3: 1, 7: 1, 34: 1, 20: 2, 22: 2, 29: 2, 30: 2}
Did not match all atoms present	15022-08-9	C=CCOC(=O)OCC=C	{2: 2, 5: 2, 6: 2}
Did not match all atoms present	150255-96-2	B(C1=CC(=CC=C1)C#N)(O)O	{20: 2, 37: 1, 14: 4}
Did not match all atoms present	15028-56-5	CC1(OCC(O1)COCC2=CC=CC=C2)C	{1: 2, 2: 2, 11: 1, 12: 1, 13: 1, 14: 5, 22: 1, 23: 2}
Did not match all atoms present	1503-49-7	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C#N	{24: 1, 37: 1, 14: 9}
Did not match all atoms present	1503-53-3	CC(=O)OC1=C(C=C(C=C1)Br)C(=O)O	{1: 1, 18: 1, 27: 1, 28: 1, 14: 3}
Did not match all atoms present	15030-72-5	CC(C)(C(=O)O)NC(=O)OCC1=CC=CC=C1	{1: 2, 2: 1, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	15035-72-0	[SH-]	{}
Did not match all atoms present	15036-31-4	C1=CC=C(C=C1)C=CC(=O)OOC(=O)C=CC2=CC=CC=C2	{28: 2, 14: 10, 6: 4}
Did not match all atoms present	150378-17-9	CC(C)(C)NC(=O)[C@@H]1CN(CCN1C[C@H](C[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H]3[C@@H](CC4=CC=CC=C34)O)O)CC5=CN=CC=C5	{1: 3, 2: 4, 3: 2, 4: 1, 33: 2, 11: 4, 12: 3, 14: 13, 35: 1, 20: 2, 24: 2, 31: 2}
Did not match all atoms present	15038-67-2	C1=CC=C(C(=C1)O)S(=O)(=O)C2=CC=CC=C2O	{21: 2, 14: 8, 29: 2}
Did not match all atoms present	150381-43-4	[H-].[OH-].[Fe+1]	{}
Did not match all atoms present	15039-07-3	OO.[O-]P(=O)([O-])OP(=O)([O-])[O-].[Na+]	{20: 2, 29: 6, 22: 1}
Did not match all atoms present	150393-25-2	[OH-].[OH-].[OH-].[OH-].[Fe+1]	{}
Did not match all atoms present	1504-55-8	CC(=CC1=CC=CC=C1)CO	{1: 1, 2: 1, 6: 1, 7: 1, 14: 5, 20: 1}
Did not match all atoms present	1504-58-1	C1=CC=C(C=C1)C#CCO	{2: 1, 20: 1, 10: 2, 14: 5}
Did not match all atoms present	1504-63-8	C1=CC(=CC=C1C=CCO)[N+](=O)[O-]	{2: 1, 38: 1, 20: 1, 14: 4, 6: 2}
Did not match all atoms present	1504-74-1	COC1=CC=CC=C1C=CC=O	{1: 1, 22: 1, 26: 1, 14: 4, 6: 2}
Did not match all atoms present	1504-75-2	CC1=CC=C(C=C1)C=CC=O	{1: 1, 26: 1, 14: 4, 6: 2}
Did not match all atoms present	150409-24-8	CC1=C(C=CC=C1N=C=O)N=C=O.C1CCC(=O)NCC1.C(COCCO)O	{32: 1, 1: 1, 2: 4, 8: 2, 11: 5, 34: 2, 14: 3, 20: 2, 22: 1, 25: 1, 29: 2}
Did not match all atoms present	15044-98-1	C=CCOC1=CC=CC(=C1)C(=O)NP(=O)(N2CC2)N3CC3	{33: 2, 2: 1, 5: 1, 6: 1, 11: 4, 14: 4, 22: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	15044-99-2	C=CCOC1=CC=C(C=C1)C(=O)NP(=O)(N2CC2)N3CC3	{33: 2, 2: 1, 5: 1, 6: 1, 11: 4, 14: 4, 22: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	150449-12-0	CC1=C(C=CC=C1N=C=O)N=C=O.C1CCOC1.C1CO1.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O	{1: 1, 2: 1, 34: 4, 8: 4, 11: 8, 13: 2, 14: 11, 23: 2, 29: 4}
Did not match all atoms present	15046-91-0	[Ag+2]	{}
Did not match all atoms present	1505-26-6	CCCC1(CCN(C1C)C)C2=CC(=CC=C2)O	{1: 3, 2: 2, 33: 1, 11: 2, 12: 1, 13: 1, 14: 4, 21: 1}
Did not match all atoms present	1505-50-6	CC1=CC=C(C=C1)CCC(=O)O	{1: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	150517-77-4	C1=C(C=C(C=C1C(F)(F)F)F)CN	{16: 4, 2: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	15054-54-3	CC(C)(C)NC(=O)NC1=CC=CC=C1	{24: 1, 1: 3, 4: 1, 14: 5, 31: 2}
Did not match all atoms present	15057-98-4	COC1=CC=CC=C1OC(=O)C2=CN=CC=C2	{1: 1, 35: 1, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	15059-52-6	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Dy+3]	{17: 3}
Did not match all atoms present	1506-15-6	COC1=C(C(=C2C(=C1)C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl	{1: 1, 22: 1, 14: 1, 17: 6}
Did not match all atoms present	1506-76-9	C1C2=CC(=C(C=C2CC3=CC(=C(C=C3CC4=CC(=C(C=C41)O)O)O)O)O)O	{11: 3, 21: 6, 14: 6}
Did not match all atoms present	15060-55-6	[NH4+].[NH4+].[SH-].[SH-].S=[Mo]=S	{}
Did not match all atoms present	15063-64-6	CC[Si](C)(C)[Si](C)(C)C	{1: 6, 2: 1}
Did not match all atoms present	15063-92-0	C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=NC(=NC(=N3)Cl)NC4=CC=C(C=C4)NC5=CC=CC=C5	{17: 1, 35: 3, 14: 18, 31: 4}
Did not match all atoms present	150632-04-5	CC(=C)C(=O)O.COC(=O)CCS.C=CC1=CC=CC=C1	{1: 2, 2: 2, 5: 2, 6: 1, 7: 1, 39: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	150646-67-6	C1=CC(=C(C=C1Cl)[N+](=O)[O-])[N+]#N	{17: 1, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	15067-26-2	[2H]C1=C(C2=C3C(=C1[2H])C(C(C3=C(C(=C2[2H])[2H])[2H])([2H])[2H])([2H])[2H])[2H]	{11: 2, 14: 6}
Did not match all atoms present	15068-08-3	CC(=O)OC1=CC=CC=C1CCl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	15068-35-6	CC1=CC=CC(=C1Cl)C(=O)O	{1: 1, 27: 1, 14: 3, 17: 1}
Did not match all atoms present	15072-60-3	[F-].[Ce]	{16: 1}
Did not match all atoms present	15074-16-5	CC(C1=CC=CC=C1)C(C(=O)C2=CC=CC=C2)O	{24: 1, 1: 1, 3: 2, 20: 1, 14: 10}
Did not match all atoms present	15074-54-1	C1=CC=C(C(=C1)OP(=O)(Cl)Cl)Cl	{17: 3, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	15075-85-1	CCCCCCCC/C=C\CCCCCCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 15, 29: 3, 6: 2}
Did not match all atoms present	150760-95-5	C(C#N)OC=O	{2: 1, 26: 1, 37: 1}
Did not match all atoms present	1508-65-2	CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.Cl	{1: 2, 2: 4, 4: 1, 33: 1, 10: 2, 11: 5, 12: 1, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	1508-75-4	CCN(CC1=CC=NC=C1)C(=O)C(CO)C2=CC=CC=C2	{1: 1, 2: 3, 3: 1, 33: 1, 14: 9, 35: 1, 20: 1, 24: 1}
Did not match all atoms present	15082-28-7	CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C4=CC=CC=C4	{1: 3, 35: 2, 4: 1, 14: 13, 23: 1}
Did not match all atoms present	15083-53-1	CC1=NN(C(=C1)OCCCN(C)C)C2=CC=CC=C2	{1: 3, 2: 3, 35: 1, 33: 2, 14: 6, 22: 1}
Did not match all atoms present	15084-51-2	CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)Cl	{1: 3, 4: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	15085-20-8	CC1=C2CCCC2=C(C=C1)C#N	{1: 1, 11: 3, 37: 1, 14: 2}
Did not match all atoms present	15086-20-1	CCN1C2=CC=CC=C2SC1=CC(=CC3=[N+](C4=CC=CC=C4S3)CC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 6: 2, 7: 1, 41: 2, 14: 12, 15: 1, 29: 3}
Did not match all atoms present	15086-27-8	C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Al+3]	{14: 15}
Did not match all atoms present	15086-94-9	C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C(=C4OC5=C(C(=C(C=C35)Br)O)Br)Br)O)Br	{13: 1, 14: 6, 18: 4, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	15087-68-0	C1=CC=C(C=C1)C(=O)OCCN(CCC#N)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl	{33: 1, 2: 4, 37: 1, 38: 1, 34: 2, 14: 12, 17: 1, 28: 1}
Did not match all atoms present	15088-30-9	C1CCN(CC1)C(=O)C2=CC=C(C=C2)C(=O)N3CCCCC3	{24: 2, 33: 2, 11: 10, 14: 4}
Did not match all atoms present	150884-56-3	CC(C)(C)OC(=O)N1C(O1)C2=CC=C(C=C2)C#N	{1: 3, 4: 1, 37: 1, 33: 1, 12: 1, 14: 4, 23: 1, 28: 1}
Did not match all atoms present	15089-03-9	COC1=CC=C(C=C1)C(=O)NNC2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9, 31: 2}
Did not match all atoms present	15089-07-3	C1=CC=C(C=C1)NNC(=O)C2=CC=C(C=C2)Cl	{24: 1, 17: 1, 14: 9, 31: 2}
Did not match all atoms present	15089-84-6	CC(=O)NC1=CC(=CC(=C1)N)C(=O)O	{1: 1, 14: 3, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	15090-10-5	CC1CCCCN1CCOC2=CC(=NN2CC3=CC=CC=C3)C	{1: 2, 2: 3, 35: 1, 33: 2, 11: 4, 12: 1, 14: 6, 22: 1}
Did not match all atoms present	15090-12-7	CC1=NN(C(=C1)OCCN2CCN(CC2)C)CC3=CC=CC=C3	{1: 2, 2: 3, 35: 1, 33: 3, 11: 4, 14: 6, 22: 1}
Did not match all atoms present	15090-13-8	CC1=NN(C(=C1)OCCCN(C)C)CC2=CC=CC=C2	{1: 3, 2: 4, 35: 1, 33: 2, 14: 6, 22: 1}
Did not match all atoms present	15090-16-1	CCCN(CCC)CCCOC1=CC(=NN1CC2=CC=CC=C2)C	{1: 3, 2: 8, 35: 1, 33: 2, 14: 6, 22: 1}
Did not match all atoms present	15091-30-2	C1C(C(CS1(=O)=O)Br)Br	{18: 2, 11: 2, 12: 2, 29: 2}
Did not match all atoms present	15092-05-4	[Fe+2].[OH-]	{}
Did not match all atoms present	15092-81-6	O=S(=O)([O-])OOS(=O)(=O)[O-]	{29: 6, 22: 2}
Did not match all atoms present	150929-88-7	CC1CCCC(=C1)C[Si](C)(C)C	{1: 4, 2: 1, 11: 3, 12: 1, 14: 1, 15: 1}
Did not match all atoms present	150929-92-3	CC1(CCCC(=C1)C[Si](C)(C)C)C	{1: 5, 2: 1, 11: 3, 13: 1, 14: 1, 15: 1}
Did not match all atoms present	15093-36-4	CC(C)NC(=S)NC1=CC=CC=C1	{31: 2, 1: 2, 3: 1, 14: 5, 7: 1}
Did not match all atoms present	15095-79-1	CCC(C)[Sn](C)(C)C	{1: 5, 2: 1, 3: 1}
Did not match all atoms present	15095-84-8	C[Sn](C)(C)C1CCCC1	{1: 3, 11: 4, 12: 1}
Did not match all atoms present	15096-02-3	CCOC(=O)C1=NN(/C(=N\NC2=CC=CC=C2)/C1=O)C3=CC=CC=C3	{1: 1, 2: 1, 35: 1, 33: 1, 34: 1, 14: 10, 15: 2, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	15096-05-6	CC1=C/C(=N/NC2=CC=C(C=C2)OC)/C(=O)C=C1	{1: 2, 34: 1, 14: 7, 15: 2, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	15096-52-3	F[Al-3](F)(F)(F)(F)F.[Na+].[Na+].[Na+]	{16: 6}
Did not match all atoms present	150965-73-4	CC1=C(C(=C(C(=C1Br)OC)Br)OC)C(=O)OC	{1: 4, 18: 2, 28: 1, 22: 2}
Did not match all atoms present	15097-49-1	C[Si](C)(C)N1CCCC1	{1: 3, 11: 4, 33: 1}
Did not match all atoms present	15098-87-0	O.O.O.[F-].[F-].[F-].[Al+3]	{16: 3}
Did not match all atoms present	151-01-9	CCOC(=S)S	{1: 1, 2: 1, 39: 1, 22: 1, 7: 1}
Did not match all atoms present	151-05-3	CC(=O)OC(C)(C)CC1=CC=CC=C1	{1: 3, 2: 1, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	151-06-4	CC(C)(CC1=CC=C(C=C1)Cl)N.Cl	{1: 2, 2: 1, 4: 1, 14: 4, 17: 2, 30: 1}
Did not match all atoms present	151-10-0	COC1=CC(=CC=C1)OC	{1: 2, 22: 2, 14: 4}
Did not match all atoms present	151-21-3	CCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 11, 29: 3, 22: 1}
Did not match all atoms present	151-41-7	CCCCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 11, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	151-50-8	[C-]#N.[K+]	{}
Did not match all atoms present	151-63-3	C(C#N)N.OS(=O)(=O)O	{2: 1, 20: 2, 29: 2, 30: 1, 37: 1}
Did not match all atoms present	151-73-5	C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COP(=O)([O-])[O-])O)C)O)F)C.[Na+].[Na+]	{1: 3, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 22: 1, 24: 1, 25: 1, 29: 3}
Did not match all atoms present	1510-16-3	CCCCCCCCCCCCS(=O)(=O)O	{1: 1, 2: 11, 20: 1, 29: 2}
Did not match all atoms present	151019-95-3	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)C)NC6=CC=CC(=C6)C	{1: 4, 2: 2, 33: 1, 13: 1, 14: 13, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	15103-99-8	COP(=O)(OC)P(=O)(OC)OC	{1: 4, 29: 2, 22: 4}
Did not match all atoms present	15104-46-8	COP(=O)(C1=CC=CC=C1P(=O)(OC)OC)OC	{1: 4, 22: 4, 14: 4, 29: 2}
Did not match all atoms present	15105-62-1	CS(=O)C1=CC=CC(=C1)O	{1: 1, 21: 1, 14: 4, 29: 1}
Did not match all atoms present	15108-51-7	C(=CC(=O)OC1=C(C(=C(C(=C1Br)Br)Br)Br)Br)C(=O)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br	{18: 10, 28: 2, 6: 2}
Did not match all atoms present	15108-72-2	CN1CCN(S1=O)C	{1: 2, 11: 2, 29: 1, 33: 2}
Did not match all atoms present	151085-82-4	C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)N/N=C\3/C=CC(=O)C(=C3)C(=O)[O-])N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-].[K+]	{34: 2, 14: 14, 15: 4, 24: 3, 25: 2, 31: 4}
Did not match all atoms present	15110-34-6	[SiH3][As]([SiH3])[SiH3]	{}
Did not match all atoms present	15110-74-4	C1C2=C(C3=C1C=C(C=C3)[N+](=O)[O-])C(=CC=C2)[N+](=O)[O-]	{11: 1, 38: 2, 14: 6}
Did not match all atoms present	151111-42-1	[O-].[O-].[O-].[Sb]	{}
Did not match all atoms present	15116-17-3	CC(C)CCC1=C(C=C(C=C1)O)O	{1: 2, 2: 2, 3: 1, 21: 2, 14: 3}
Did not match all atoms present	151169-75-4	B(C1=CC(=C(C=C1)Cl)Cl)(O)O	{17: 2, 20: 2, 14: 3}
Did not match all atoms present	15117-56-3	[Th]	{}
Did not match all atoms present	15118-03-3	O[Si](O)(O)O.[Mg].[Mg]	{20: 4}
Did not match all atoms present	15119-34-3	C1=CC=C2C(=C1)C=C(C(=O)O2)C#N	{28: 1, 37: 1, 14: 5}
Did not match all atoms present	15119-62-7	CC(=O)SC1=CC=C(C=C1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4, 40: 1}
Did not match all atoms present	151198-85-5	C(=O)(C(F)(F)F)NS(=O)(=O)C(F)(F)F	{16: 6, 24: 1, 4: 2, 29: 2, 31: 1}
Did not match all atoms present	1512-14-7	C(N=S(F)F)(F)(F)F	{16: 5, 34: 1, 4: 1}
Did not match all atoms present	15120-17-9	[O-][As](=O)=O.[Na+]	{29: 3}
Did not match all atoms present	15120-47-5	CC1=C(C=CC=C1C(=O)O)C(=O)O	{1: 1, 27: 2, 14: 3}
Did not match all atoms present	15120-50-0	C[Sb](C)(C)(C)C	{1: 5}
Did not match all atoms present	15121-11-6	C1C(OS(=O)O1)CCl	{2: 1, 11: 1, 12: 1, 17: 1, 23: 2, 29: 1}
Did not match all atoms present	15121-26-3	[V+2]	{}
Did not match all atoms present	15121-84-3	C1=CC=C(C(=C1)CCO)[N+](=O)[O-]	{2: 2, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	151227-85-9	[GaH3].[GaH3].[Sb]	{}
Did not match all atoms present	15123-26-9	Cl[Th](Cl)Cl	{17: 3}
Did not match all atoms present	15123-80-5	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Mo].[Mo]	{}
Did not match all atoms present	15123-82-7	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[W].[W]	{}
Did not match all atoms present	151258-40-1	C1=CC=C2C(=C1)C=CC3=C2C4=C5C3=CC(C(C5=CC=C4)O)O	{20: 2, 12: 2, 14: 10, 15: 1}
Did not match all atoms present	15126-31-5	[O-2].[Eu+3].[W]	{}
Did not match all atoms present	15128-82-2	C1=CC(=C(N=C1)[N+](=O)[O-])O	{38: 1, 35: 1, 21: 1, 14: 3}
Did not match all atoms present	15128-90-2	CC1=NC(=C(C=C1)O)[N+](=O)[O-]	{38: 1, 1: 1, 35: 1, 21: 1, 14: 2}
Did not match all atoms present	15129-01-8	C1=NC(=C(C2=NC(=O)NN21)N)Cl	{32: 1, 33: 1, 35: 2, 14: 1, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	1513-25-3	CC1=CC(=C(C=C1)F)Cl	{16: 1, 1: 1, 14: 3, 17: 1}
Did not match all atoms present	1513-65-1	C1=CC(=NC(=C1)F)F	{16: 2, 35: 1, 14: 3}
Did not match all atoms present	1513-69-5	C1=C(NC(=NC1=O)N)C(F)(F)F	{32: 1, 35: 1, 4: 1, 14: 1, 16: 3, 25: 1, 30: 1}
Did not match all atoms present	15131-84-7	C1=CC=C2C(=C1)C=CC3=C2C4C(O4)C5=CC=CC=C35	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	15133-82-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ni]	{14: 60}
Did not match all atoms present	15137-41-4	C1=CC=C2C(=C1)C=CC3=C2OC(=O)S3	{41: 1, 28: 1, 14: 6}
Did not match all atoms present	151378-31-3	C1=CC=C2C(=C1)C=CC3=C2C4=C5C36C(O6)C(C(C5=CC=C4)O)O	{20: 2, 12: 3, 13: 1, 14: 9, 23: 1}
Did not match all atoms present	15139-76-1	CCOC(=O)C1=NN(C(=O)C1N=NC2=CC=C(C3=CC=CC=C32)S(=O)(=O)[O-])C4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 1, 35: 1, 33: 1, 12: 1, 34: 2, 14: 10, 15: 1, 25: 1, 28: 1, 29: 6}
Did not match all atoms present	1514-52-9	C1=CC(=CC=C1[N+]#N)[N+](=O)[O-].F[P-](F)(F)(F)(F)F	{16: 6, 34: 1, 38: 1, 14: 4}
Did not match all atoms present	151411-98-2	C1=C(C=C(C(=C1F)CBr)F)F	{16: 3, 2: 1, 18: 1, 14: 2}
Did not match all atoms present	151412-02-1	C1=CC(=C(C(=C1F)CBr)F)F	{16: 3, 2: 1, 18: 1, 14: 2}
Did not match all atoms present	151412-12-3	CC1=C(C(=CC=C1)CBr)F	{16: 1, 1: 1, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	151436-58-7	CCNC(C)CC(C)NCC.[Cl-].[Cl-].[Pt+2]	{31: 2, 1: 4, 2: 3, 3: 2, 17: 2}
Did not match all atoms present	15145-69-4	C1=CC(=CC(=C1)Cl)C(Cl)Cl	{17: 3, 3: 1, 14: 4}
Did not match all atoms present	15146-00-6	CC1=CC(=C(C=C1)Cl)C(C)C	{1: 3, 3: 1, 14: 3, 17: 1}
Did not match all atoms present	151462-86-1	[OH-].[Sn+4]	{}
Did not match all atoms present	15148-80-8	CC1=CC(=C(C=C1)Cl)OCC(CNC(C)(C)C)O.Cl	{1: 4, 2: 2, 3: 1, 4: 1, 14: 3, 17: 2, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	15149-10-7	CC1=CC=C(C=C1)OCCO	{1: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	1515-72-6	CCCCN1C(=O)C2=CC=CC=C2C1=O	{1: 1, 2: 3, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	1515-78-2	C=C/C=C\C1=CC=CC=C1	{14: 5, 5: 1, 6: 3}
Did not match all atoms present	1515-81-7	COCC1=CC=C(C=C1)OC	{1: 2, 2: 1, 22: 2, 14: 4}
Did not match all atoms present	1515-95-3	CCC1=CC=C(C=C1)OC	{1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	15150-25-1	C1=CC=C(C=C1)C(=O)NC#N	{24: 1, 37: 1, 14: 5, 31: 1}
Did not match all atoms present	15150-39-7	CC1=CC=C(C=C1)OC(=O)CCl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	15151-00-5	CC1=[N+](C2=CC=CC=C2C=C1)CC=C.[Br-]	{1: 1, 2: 1, 5: 1, 6: 1, 33: 1, 14: 6, 18: 1}
Did not match all atoms present	15154-19-5	CC1=C(C(=NO1)C2=CC=C(O2)[N+](=O)[O-])C(=O)C	{1: 2, 35: 1, 38: 1, 14: 2, 23: 2, 24: 1}
Did not match all atoms present	15154-36-6	CCC[NH+](CCC)CCOC(=O)C1=CC=C(C=C1)N.[Cl-]	{1: 2, 2: 6, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	15154-37-7	CC(C)[NH+](CCCOC(=O)C1=CC=C(C=C1)N)C(C)C.[Cl-]	{1: 4, 2: 3, 3: 2, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	151574-10-6	CC(C)O.CC(=C)C(=O)O.C=CC(=O)[O-].[Na+]	{1: 3, 3: 1, 5: 2, 6: 1, 7: 1, 20: 1, 24: 1, 27: 1}
Did not match all atoms present	151574-12-8	CCNS(=O)(=O)C1=CC(=C(C(=C1C)Cl)N)Cl	{1: 2, 2: 1, 14: 1, 17: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	15158-11-9	[Cu+2]	{}
Did not match all atoms present	15158-64-2	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Eu+3]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	15158-67-5	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Ce]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	1516-08-1	[2H]C([2H])([2H])C([2H])([2H])O[2H]	{1: 1, 2: 1, 20: 1}
Did not match all atoms present	1516-21-8	COC1=CC=C(C=C1)N=O	{1: 1, 34: 1, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	1516-27-4	C[N+](C)(C)CC=C.[Cl-]	{1: 3, 2: 1, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	1516-32-1	CCCCNC(=S)N	{1: 1, 2: 3, 31: 1, 30: 1, 7: 1}
Did not match all atoms present	1516-37-6	COC1=CC=CC=C1NC(=S)N	{1: 1, 7: 1, 14: 4, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	1516-55-8	[B-]([N+](C)(C)C)(Cl)(Cl)Cl	{1: 3, 17: 3}
Did not match all atoms present	1516-60-5	C1=CC(=CC=C1[N-][N+]#N)[N+](=O)[O-]	{34: 2, 38: 1, 14: 4}
Did not match all atoms present	1516-74-1	C1=CC=C2C(=C1)NC(=N2)N=[N+]=[N-]	{32: 1, 34: 2, 35: 1, 14: 4}
Did not match all atoms present	1516-80-9	CCO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 22: 1, 14: 15}
Did not match all atoms present	151613-24-0	CC(C)[Si](CCC1=CC=CC=C1)(C(C)C)Cl	{1: 4, 2: 2, 3: 2, 14: 5, 17: 1}
Did not match all atoms present	15162-92-2	[O-]Br(=O)=O.[O-]Br(=O)=O.[O-]Br(=O)=O.[Nd+3]	{18: 3, 29: 9}
Did not match all atoms present	15162-93-3	[O-]Br(=O)=O.[O-]Br(=O)=O.[O-]Br(=O)=O.[Pr+3]	{18: 3, 29: 9}
Did not match all atoms present	15163-46-9	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[Na+]	{1: 1, 2: 11, 29: 3, 14: 4}
Did not match all atoms present	151637-59-1	CC1=CC=CC2=C1CC(NC2)C(=O)O	{32: 1, 1: 1, 11: 2, 12: 1, 14: 3, 27: 1}
Did not match all atoms present	15164-44-0	C1=CC(=CC=C1C=O)I	{26: 1, 19: 1, 14: 4}
Did not match all atoms present	15168-20-4	O.O.[O-][Se](=O)[O-].[Cu+2]	{29: 3}
Did not match all atoms present	15169-25-2	CC(=O)C(C(=O)C)[N+](=O)[O-].CC(=O)C(C(=O)C)[N+](=O)[O-].CC(=O)C(C(=O)C)[N+](=O)[O-].[Co]	{24: 6, 1: 6, 3: 3, 38: 3}
Did not match all atoms present	1517-05-1	C(CO)N=[N+]=[N-]	{2: 2, 20: 1, 34: 2}
Did not match all atoms present	1517-22-2	[2H]C1=C(C(=C2C(=C1[2H])C(=C(C3=C(C(=C(C(=C32)[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H]	{14: 10}
Did not match all atoms present	1517-52-8	[2H]C(=C([2H])C([2H])([2H])[2H])[2H]	{1: 1, 5: 1, 6: 1}
Did not match all atoms present	1517-53-9	[1H]C=C[1H]	{5: 2}
Did not match all atoms present	1517-55-1	[2H]/C(=C(/[2H])\C([2H])([2H])[2H])/C([2H])([2H])[2H]	{1: 2, 6: 2}
Did not match all atoms present	1517-63-1	CC1=CC=C(C=C1)C(C2=CC=CC=C2)O	{1: 1, 3: 1, 20: 1, 14: 9}
Did not match all atoms present	1517-68-6	C[C@@H](CC1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	1517-69-7	C[C@H](C1=CC=CC=C1)O	{1: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	1517-72-2	CC(C1=CC=CC2=CC=CC=C21)O	{1: 1, 3: 1, 20: 1, 14: 7}
Did not match all atoms present	15170-57-7	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Pt+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	151717-27-0	CCCCCOC1=CC(=C(C=C1)NC(=O)C)N	{1: 2, 2: 4, 14: 3, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	15172-86-8	CC1=C[N+](=CC=C1)CC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)C[N+]4=CC=CC(=C4)C.[Br-].[Br-]	{1: 2, 2: 2, 33: 2, 14: 16, 18: 2, 24: 2}
Did not match all atoms present	15174-69-3	CC1=C(C=CC(=C1)C=O)O	{1: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	151767-62-3	C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.[Zr]	{33: 2, 2: 12, 20: 6}
Did not match all atoms present	151776-26-0	C1CN(CCN1)C(=O)O[C@H]2C3=NC=CN=C3C(=O)N2C4=NC=C(C=C4)Cl	{32: 1, 33: 2, 35: 3, 11: 4, 12: 1, 14: 5, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	15179-96-1	CC1CN(C(=O)N1)/N=C/C2=CC=C(O2)[N+](=O)[O-]	{32: 1, 1: 1, 34: 1, 38: 1, 6: 1, 33: 1, 11: 1, 12: 1, 14: 2, 23: 1, 25: 1}
Did not match all atoms present	1518-16-7	C1=CC(=C(C#N)C#N)C=CC1=C(C#N)C#N	{37: 4, 14: 4, 7: 2}
Did not match all atoms present	1518-58-7	CC[NH2+]CC.CCN(CC)C(=S)[S-]	{1: 4, 2: 4, 33: 1, 7: 1}
Did not match all atoms present	1518-75-8	CCCC1=CSC=C1	{1: 1, 2: 2, 14: 3, 41: 1}
Did not match all atoms present	1518-83-8	C1CCC(C1)C2=CC=C(C=C2)O	{11: 4, 12: 1, 21: 1, 14: 4}
Did not match all atoms present	1518-84-9	C1CCC(C1)C2=CC=CC=C2O	{11: 4, 12: 1, 21: 1, 14: 4}
Did not match all atoms present	15180-03-7	C=CC[N+]12[C@@H]3C4(C5=CC=CC=C5N/6[C@H]4/C(=C\N7C8=CC=CC=C8C94[C@@H]7/C(=C6)/C5/C(=C\CO)/C[N+]([C@H]9C5)(CC4)CC=C)/C(C3)/C(=C\CO)/C1)CC2.[Cl-].[Cl-]	{33: 2, 2: 4, 5: 2, 6: 4, 11: 8, 12: 6, 13: 2, 14: 10, 15: 4, 17: 2, 20: 2}
Did not match all atoms present	15180-19-5	C1=CC=C(C=C1)COC(=O)NNC2=C(C(=NC=N2)Cl)N	{2: 1, 35: 2, 14: 6, 17: 1, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	15181-11-0	CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C	{1: 7, 4: 2, 14: 3}
Did not match all atoms present	15181-13-2	CCC1=CC(=CC(=C1)C(C)C)C(C)C	{1: 5, 2: 1, 3: 2, 14: 3}
Did not match all atoms present	15181-43-8	O=P([O-])([O-])F	{16: 1, 29: 3}
Did not match all atoms present	15181-46-1	O=S([O-])O	{20: 1, 29: 2}
Did not match all atoms present	15181-47-2	O=S(=O)([O-])F	{16: 1, 29: 3}
Did not match all atoms present	15181-48-3	O=S(=O)([O-])Cl	{17: 1, 29: 3}
Did not match all atoms present	15182-74-8	CC1=CC=CC=C1N=S=O	{40: 1, 1: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	151830-92-1	CC1=CC=C(C=C1)C(=O)[C@@H]2CCCC[C@H]2C(=O)O	{1: 1, 11: 4, 12: 2, 14: 4, 24: 1, 27: 1}
Did not match all atoms present	15184-93-7	[Tm+]	{}
Did not match all atoms present	15184-99-3	CN(C)CC1=CC(=CC=C1)OC	{1: 3, 2: 1, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	15185-43-0	CCN1C2=CC=CC=C2OC1=CC=CC=CC=CC3=[N+](C4=CC=CC=C4O3)CC.[I-]	{1: 2, 2: 2, 6: 7, 33: 2, 14: 8, 15: 1, 19: 1, 23: 2}
Did not match all atoms present	15186-51-3	CC1=C(OC=C1)CC=C(C)C	{1: 3, 2: 1, 6: 1, 7: 1, 14: 2, 23: 1}
Did not match all atoms present	15187-16-3	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Pb+2]	{35: 8, 14: 16}
Did not match all atoms present	15189-51-2	[Na+].Cl[Au-](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	1519-36-4	CC1=C2C(=C(C=C1)C)C(=O)C3=CC=CC=C3C2=O	{1: 2, 14: 6, 25: 2}
Did not match all atoms present	1519-39-7	CC1=CC=C(C=C1)[S@](=O)C	{1: 2, 29: 1, 14: 4}
Did not match all atoms present	1519-47-7	C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7.[Cl-].[Cl-]	{17: 2, 2: 2, 14: 34}
Did not match all atoms present	1519-59-1	C1=CC=C(C=C1)C=CC2=CC=CC=N2	{35: 1, 14: 9, 6: 2}
Did not match all atoms present	151900-44-6	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)SSCCCCCCSSC(=S)N(CC3=CC=CC=C3)CC4=CC=CC=C4	{40: 4, 33: 2, 2: 10, 14: 20, 7: 2}
Did not match all atoms present	15191-68-1	COC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 22: 1, 24: 2}
Did not match all atoms present	151910-11-1	CC(C)(C)OC(=O)NC1(CC1C2=CC=CC=C2)C(=O)O	{1: 3, 4: 1, 11: 1, 12: 1, 13: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	151911-57-8	CCCC(CC)CCCCCCC1=CC=CC=C1	{1: 2, 2: 9, 3: 1, 14: 5}
Did not match all atoms present	151911-64-7	CCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.O.[Ti].[Ti]	{1: 23, 2: 120, 3: 11, 20: 6, 22: 12, 29: 6}
Did not match all atoms present	151911-65-8	CC(C)CCCCCCCCCCOP(=O)(O)OP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OP(=O)(O)OCCCCCCCCCCC(C)C.[Zr]	{1: 12, 2: 60, 3: 6, 20: 6, 22: 9, 29: 6}
Did not match all atoms present	15194-58-8	[CH3-]	{}
Did not match all atoms present	15194-98-6	[O-][As]=O.[O-][As]=O.[Ca+2]	{29: 4}
Did not match all atoms present	15195-53-6	[F-].[F-].[F-].[Nb+3]	{16: 3}
Did not match all atoms present	15199-21-0	CC12CN(P(=O)(N(C1)C)N(C2)C)C	{1: 4, 33: 3, 11: 3, 13: 1, 29: 1}
Did not match all atoms present	15199-22-1	CC12CN(P(=S)(N(C1)C)N(C2)C)C	{1: 4, 11: 3, 13: 1, 33: 3}
Did not match all atoms present	15199-24-3	B=P12N(CC(CN1C)(CN2C)C)C	{1: 4, 11: 3, 13: 1, 33: 3}
Did not match all atoms present	15199-43-6	[2H]C([2H])([2H])OS(=O)(=O)OC([2H])([2H])[2H]	{1: 2, 29: 2, 22: 2}
Did not match all atoms present	152-02-3	C=CCN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O	{33: 1, 2: 1, 5: 1, 6: 1, 11: 7, 12: 2, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	152-11-4	CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl	{1: 7, 2: 5, 3: 1, 4: 1, 37: 1, 33: 1, 14: 6, 17: 1, 22: 4}
Did not match all atoms present	152-16-9	CN(C)P(=O)(N(C)C)OP(=O)(N(C)C)N(C)C	{1: 8, 29: 2, 22: 1, 33: 4}
Did not match all atoms present	152-18-1	COP(=S)(OC)OC	{1: 3, 22: 3}
Did not match all atoms present	152-20-5	COP(=O)(OC)SC	{40: 1, 1: 3, 29: 1, 22: 2}
Did not match all atoms present	152-43-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)OC5CCCC5	{1: 1, 9: 1, 10: 1, 11: 10, 12: 4, 13: 2, 14: 3, 20: 1, 22: 1}
Did not match all atoms present	152-47-6	COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 2, 14: 6, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	152-53-4	CC1(N=C(N=C(N1C2=CC=C(C=C2)Cl)N)N)C.Cl	{1: 2, 35: 2, 33: 1, 13: 1, 14: 4, 15: 2, 17: 2, 30: 2}
Did not match all atoms present	152-72-7	CC(=O)CC(C1=CC=C(C=C1)[N+](=O)[O-])C2=C(C3=CC=CC=C3OC2=O)O	{1: 1, 2: 1, 3: 1, 38: 1, 14: 8, 21: 1, 24: 1, 28: 1}
Did not match all atoms present	152-93-2	C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=C(NC(=NC2=O)N)N)O)O)O)O	{32: 1, 2: 1, 35: 1, 12: 5, 20: 4, 22: 1, 23: 1, 25: 1, 30: 2}
Did not match all atoms present	152-95-4	C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O	{2: 1, 12: 5, 14: 7, 20: 4, 21: 2, 22: 1, 23: 2, 25: 1}
Did not match all atoms present	1520-20-3	C=CC1=CC=C(C=C1)N=C=S	{8: 1, 14: 4, 34: 1, 5: 1, 6: 1}
Did not match all atoms present	1520-21-4	C=CC1=CC=C(C=C1)N	{14: 4, 30: 1, 5: 1, 6: 1}
Did not match all atoms present	1520-22-5	C=CN=C=S	{8: 1, 34: 1, 5: 1, 6: 1}
Did not match all atoms present	1520-26-9	C1=CC=C(C(=C1)NC(=S)N)O	{30: 1, 31: 1, 21: 1, 14: 4, 7: 1}
Did not match all atoms present	1520-31-6	CS(=N)(=O)C	{1: 2, 36: 1, 29: 1}
Did not match all atoms present	1520-42-9	C1=CC=C(C=C1)CC(C2=CC=CC=C2)C3=CC=CC=C3	{2: 1, 3: 1, 14: 15}
Did not match all atoms present	1520-45-2	CCC(CC1=CC=CC=C1)CC2=CC=CC=C2	{1: 1, 2: 3, 3: 1, 14: 10}
Did not match all atoms present	1520-46-3	CC(CC1=CC=CC=C1)CC2=CC=CC=C2	{1: 1, 2: 2, 3: 1, 14: 10}
Did not match all atoms present	1520-70-3	CCS(=O)(=O)N	{1: 1, 2: 1, 29: 2, 30: 1}
Did not match all atoms present	1520-71-4	CCC[Pb](CCC)(CCC)Cl	{1: 3, 2: 6, 17: 1}
Did not match all atoms present	1520-78-1	C[Pb](C)(C)Cl	{1: 3, 17: 1}
Did not match all atoms present	1520-96-3	[2H]C1=C(C2=C3C(=C1[2H])C4=C(C(=C(C5=C4C(=C(C(=C5[2H])[2H])[2H])C3=C(C(=C2[2H])[2H])[2H])[2H])[2H])[2H])[2H]	{14: 12}
Did not match all atoms present	152007-82-4	C(CN(CCNCC(=O)[O-])CC(=O)[O-])NCC(=O)[O-].[K+].[K+].[K+]	{24: 3, 33: 1, 2: 7, 31: 2}
Did not match all atoms present	152007-83-5	C1=CC(=CC=C1/C=C\2/C(=O)C3=C(S2)C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{6: 1, 41: 1, 14: 7, 15: 1, 25: 1, 29: 6}
Did not match all atoms present	15205-11-5	C1=CC(=C(C=C1F)Cl)CN	{16: 1, 17: 1, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	15205-15-9	C1=CC(=C(C(=C1)Cl)CN)F	{16: 1, 17: 1, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	15205-66-0	CS(=O)(=O)CCO	{1: 1, 2: 2, 20: 1, 29: 2}
Did not match all atoms present	15206-55-0	COC(=O)C(=O)C1=CC=CC=C1	{24: 1, 1: 1, 28: 1, 14: 5}
Did not match all atoms present	1521-38-6	COC1=CC=CC(=C1OC)C(=O)O	{1: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	15214-89-8	CC(C)(CS(=O)(=O)O)NC(=O)C=C	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	152155-79-8	CC(=O)N[C@@H](CSCCC1=CC=CC=C1O)C(=O)O	{1: 1, 2: 3, 3: 1, 40: 1, 14: 4, 21: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	15217-42-2	C1=CC=C2C(=C1)[N-]N=N2.[Na+]	{35: 3, 14: 4}
Did not match all atoms present	15218-44-7	C/C(=C(\Br)/C(=O)C)/[O-].C/C(=C(\Br)/C(=O)C)/[O-].C/C(=C(\Br)/C(=O)C)/[O-].[Co+3]	{24: 3, 1: 6, 18: 3, 7: 6}
Did not match all atoms present	152187-62-7	C1CCC(=O)OCC1.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O.C1=CC(=CC=C1OCCO)OCCO	{2: 5, 34: 2, 8: 2, 11: 7, 13: 2, 14: 12, 20: 2, 22: 2, 28: 1, 29: 2}
Did not match all atoms present	152187-64-9	CC1=C(C=CC=C1N=C=O)N=C=O.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O.C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{1: 1, 2: 1, 34: 4, 8: 4, 11: 2, 13: 2, 14: 17, 24: 1, 28: 4, 29: 4}
Did not match all atoms present	1522-13-0	C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)(C3=CC=CC=C3)O	{20: 1, 10: 2, 4: 1, 14: 15}
Did not match all atoms present	152211-15-9	C1=CC(=C(C(=C1)F)CO)C(F)(F)F	{16: 4, 20: 1, 2: 1, 4: 1, 14: 3}
Did not match all atoms present	15224-25-6	C1=CC=C(C=C1)C(=O)C2=CNC3=CC=CC=C32	{24: 1, 32: 1, 14: 10}
Did not match all atoms present	15224-88-1	CCCCCCCCCCCCC1CCCS(=O)(=O)O1	{1: 1, 2: 11, 11: 3, 12: 1, 23: 1, 29: 2}
Did not match all atoms present	15225-09-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)S(=O)(=O)CCO)S(=O)(=O)[O-])N.[Na+]	{2: 2, 14: 9, 20: 1, 25: 2, 29: 5, 30: 1, 31: 1}
Did not match all atoms present	1523-06-4	CC(=O)OC1=CC=CC(=C1)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	1523-11-1	CC(=O)OC1=CC2=CC=CC=C2C=C1	{1: 1, 28: 1, 14: 7}
Did not match all atoms present	1523-12-2	C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2[N+](=O)[O-]	{28: 1, 38: 1, 14: 9}
Did not match all atoms present	1523-19-9	COC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2	{1: 1, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	15230-48-5	Cl[GeH2]Cl	{17: 2}
Did not match all atoms present	15230-70-3	Cl[Th]Cl	{17: 2}
Did not match all atoms present	15230-79-2	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Lu+3]	{17: 3}
Did not match all atoms present	15231-78-4	CC1(OC(=O)C(C(=O)O1)C2=CC=CC=C2)C	{1: 2, 12: 1, 13: 1, 14: 5, 28: 2}
Did not match all atoms present	15231-91-1	C1=CC2=C(C=CC(=C2)Br)C=C1O	{18: 1, 21: 1, 14: 6}
Did not match all atoms present	15233-65-5	COC1=CC(=CC(=C1O)OC)O	{1: 2, 22: 2, 21: 2, 14: 2}
Did not match all atoms present	15237-44-2	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)[O-])O)O.[Na+]	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 5, 22: 3, 23: 1, 29: 4, 30: 1}
Did not match all atoms present	15238-00-3	[Co+2].[I-].[I-]	{19: 2}
Did not match all atoms present	152401-65-5	CCCCCCCCCCCCCCCCCC[P+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[I-]	{1: 4, 2: 38, 19: 1}
Did not match all atoms present	15242-92-9	CCCCP(CCCC)CCCC.CCCCP(CCCC)CCCC.[Ni](Br)Br	{1: 6, 2: 18, 18: 2}
Did not match all atoms present	15242-96-3	CCCCCCCCCCCCCCCCCC(=O)O.O.Cl[Cr]Cl.Cl[Cr]Cl	{1: 1, 2: 16, 27: 1, 17: 4}
Did not match all atoms present	15243-33-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Ru].[Ru].[Ru]	{29: 12}
Did not match all atoms present	15244-74-3	C(=O)(O)[O-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[N+](=O)(O)[O-].[Co+3]	{27: 1, 20: 1}
Did not match all atoms present	15245-44-0	C1=C(C(=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[O-])[N+](=O)[O-].[Pb+2]	{38: 3, 14: 1}
Did not match all atoms present	15246-55-6	C(C[NH-])[NH-].C(C[NH-])[NH-].C(C[NH-])[NH-].OCl(=O)(=O)=O.[Cr+3]	{17: 1, 2: 6, 20: 1, 29: 3, 36: 6}
Did not match all atoms present	15251-42-0	O=P([O-])([O-])OP(=O)(O)O	{20: 2, 29: 4, 22: 1}
Did not match all atoms present	15251-47-5	C1CCNC(C1)C2=CN=CC=C2.Cl	{32: 1, 35: 1, 11: 4, 12: 1, 14: 4, 17: 1}
Did not match all atoms present	15254-64-5	CC1=CC(=C2C(=C1)C=CC3=CC=CC=C32)C	{1: 2, 14: 8}
Did not match all atoms present	15258-73-8	C1=CC(=C(C(=C1)Cl)CO)Cl	{17: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	15258-80-7	C/C(=C/C(=O)N(CCCC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)N1)CO)CO)CCCN(C(=O)/C=C(/C)\CC(=O)O)[O-])CCCN(C(=O)/C=C(\C)/CC(=O)O)[O-])[O-])/CC(=O)O.[Fe+3]	{32: 6, 1: 3, 2: 14, 33: 3, 6: 3, 7: 3, 11: 1, 12: 5, 20: 2, 24: 3, 25: 6, 27: 3, 29: 3}
Did not match all atoms present	15258-91-0	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Cl-].[K+].[Pt+2]	{24: 2, 1: 4, 17: 1, 6: 2, 7: 2}
Did not match all atoms present	1526-73-4	C1=CC=C2C(=C1)C(=C(C(=O)C2=O)Cl)O	{17: 1, 20: 1, 25: 2, 14: 4, 15: 2}
Did not match all atoms present	15260-10-3	C[C@H]([C@@H](C(=O)O)NC(=O)OC(C)(C)C)OCC1=CC=CC=C1	{1: 4, 2: 1, 3: 2, 4: 1, 14: 5, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	15260-65-8	C=C(C1=CC=CC=C1)C2=CC=CC=N2	{35: 1, 5: 1, 14: 9, 7: 1}
Did not match all atoms present	15267-95-5	CCO[Si](CCl)(OCC)OCC	{1: 3, 2: 4, 22: 3, 17: 1}
Did not match all atoms present	15269-16-6	CC1=CC(=C(C=C1C(C)C)O)C(C)C	{1: 5, 3: 2, 21: 1, 14: 2}
Did not match all atoms present	15269-17-7	CC1=C(C=C(C=C1C(C)C)O)C(C)C	{1: 5, 3: 2, 21: 1, 14: 2}
Did not match all atoms present	1527-12-4	C1=CC=C(C=C1)SC2=CC=CC=C2C(=O)O	{40: 1, 27: 1, 14: 9}
Did not match all atoms present	1527-89-5	COC1=CC=CC(=C1)C#N	{1: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	1527-95-3	CCCCCCCCCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 8, 38: 2, 6: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	1527-96-4	CC=CC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 1, 6: 3, 38: 2, 14: 3, 31: 1}
Did not match all atoms present	1527-97-5	CCCCCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 4, 38: 2, 6: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	1527-98-6	CCCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 38: 2, 6: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	1527-99-7	CCCC[Sn](C)(C)C	{1: 4, 2: 3}
Did not match all atoms present	15270-08-3	COC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)OC)N	{24: 1, 1: 2, 30: 1, 22: 2, 14: 7}
Did not match all atoms present	15274-43-8	CCCCP(CCCC)CCCC.CCCCP(CCCC)CCCC.Cl[Ni]Cl	{1: 6, 2: 18, 17: 2}
Did not match all atoms present	15275-52-2	C1=CN=CC2=C3NC(=C21)NC4=C5C=CN=CC5=C([N-]4)NC6=C7C=NC=CC7=C(N6)NC8=C9C=NC=CC9=C(N3)[N-]8.[Cu+2]	{32: 6, 35: 6, 14: 12}
Did not match all atoms present	15278-86-1	[Br-].[Br-].[Br-].[Br-].[Rb+].[Rb+].[Pt+2]	{18: 4}
Did not match all atoms present	15278-97-4	CP(C)C.Cl[Au]	{1: 3, 17: 1}
Did not match all atoms present	1528-00-3	CCCC[Sn](C)(C)CCCC	{1: 4, 2: 6}
Did not match all atoms present	1528-01-4	CCCC[Sn](C)(CCCC)CCCC	{1: 4, 2: 9}
Did not match all atoms present	1528-48-9	CCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCC)C(=O)OCCCCCCC	{1: 3, 2: 18, 28: 3, 14: 3}
Did not match all atoms present	1528-49-0	CCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCC)C(=O)OCCCCCC	{1: 3, 2: 15, 28: 3, 14: 3}
Did not match all atoms present	1528-74-1	C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	1528-88-7	CC1=CC=CC=C1[Se]C	{1: 2, 14: 4}
Did not match all atoms present	15280-31-6	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N.CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 2: 4, 33: 2, 34: 2, 14: 18, 17: 4}
Did not match all atoms present	15280-53-2	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.O.[Gd+3]	{24: 3, 1: 3}
Did not match all atoms present	15280-58-7	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.O.[Yb+3]	{24: 3, 1: 3}
Did not match all atoms present	15282-88-9	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Pb+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	15283-45-1	OS(=O)(=O)[S-].OS(=O)(=O)[S-].[Na+].[Na+].[Na+].[Au]	{20: 2, 29: 4}
Did not match all atoms present	15283-51-9	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Fe+2]	{16: 8}
Did not match all atoms present	15284-15-8	CCC(=O)C(C[C@@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 10, 17: 1, 24: 1}
Did not match all atoms present	15284-31-8	C(CCl)N1C(=NN=N1)N	{17: 1, 2: 2, 35: 3, 30: 1, 33: 1}
Did not match all atoms present	15284-70-5	C1=CC=C(C(=C1)N=[N+]=[N-])N2N=C3C=CC=CC3=N2	{33: 1, 34: 2, 35: 2, 14: 8}
Did not match all atoms present	15285-15-1	CC1=NC(=NN1)Cl	{32: 1, 1: 1, 35: 2, 17: 1}
Did not match all atoms present	152894-10-5	C(C(F)(F)S(=O)(=O)NS(=O)(=O)C(C(F)(F)F)(F)F)(F)(F)F	{16: 10, 4: 4, 29: 4, 31: 1}
Did not match all atoms present	1529-17-5	C[Si](C)(C)OC1=CC=CC=C1	{1: 3, 22: 1, 14: 5}
Did not match all atoms present	1529-30-2	CC[Sn](CC)(CC)OC1=CC=CC=C1	{1: 3, 2: 3, 22: 1, 14: 5}
Did not match all atoms present	1529-40-4	C1=CC=C2C(=C1)C(C3=CC=CC=C32)C#N	{12: 1, 37: 1, 14: 8}
Did not match all atoms present	1529-41-5	C1=CC(=CC(=C1)Cl)CC#N	{17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	1529-47-1	C[Ge](C)(C)Cl	{1: 3, 17: 1}
Did not match all atoms present	1529-48-2	C[Ge](C)(Cl)Cl	{1: 2, 17: 2}
Did not match all atoms present	1529-57-3	CCCCCCCCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 57}
Did not match all atoms present	1529-58-4	CCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCC)CCCCCCCCCCCCCC	{1: 3, 2: 39}
Did not match all atoms present	1529-59-5	CCCCCCCCCCCC[Al](CCCCCCCCCCCC)CCCCCCCCCCCC	{1: 3, 2: 33}
Did not match all atoms present	1529-65-3	C[Si](C)(C=C)O[Si](C)(C=C)O[Si](C)(C)C=C	{1: 5, 22: 2, 5: 3, 6: 3}
Did not match all atoms present	15290-29-6	C[Si](C)(C)C1=CC=C(C=C1)C(=O)O	{1: 3, 27: 1, 14: 4}
Did not match all atoms present	15293-74-0	[Li+].B(=O)[O-].O.O	{29: 2}
Did not match all atoms present	15297-33-3	C[C@H](C1=CC=CC2=CC=CC=C21)NC	{1: 2, 3: 1, 14: 7, 31: 1}
Did not match all atoms present	15299-99-7	CCN(CC)C(=O)C(C)OC1=CC=CC2=CC=CC=C21	{1: 3, 2: 2, 3: 1, 33: 1, 14: 7, 22: 1, 24: 1}
Did not match all atoms present	153-18-4	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O	{1: 1, 2: 1, 12: 10, 14: 5, 20: 6, 21: 4, 22: 2, 23: 3, 25: 1}
Did not match all atoms present	153-32-2	C1CCC2=C(C1)C=CC3=CC4=C(CCC5=CC=CC=C54)C=C23	{11: 6, 14: 8}
Did not match all atoms present	153-34-4	C1CC2=C(C=C3C=CC4=CC=CC=C4C3=C2)C5=CC=CC=C51	{11: 2, 14: 12}
Did not match all atoms present	153-39-9	C1CCC2=C(C1)C=CC3=CC4=C(C=CC5=CC=CC=C54)C=C23	{11: 4, 14: 10}
Did not match all atoms present	153-61-7	CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CC3=CC=CS3)SC1)C(=O)O	{1: 1, 2: 2, 33: 1, 41: 2, 11: 1, 12: 2, 14: 3, 15: 2, 24: 1, 25: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	153-78-6	C1C2=CC=CC=C2C3=C1C=C(C=C3)N	{11: 1, 30: 1, 14: 7}
Did not match all atoms present	153-87-7	CC1=C(C2=CC(=C(C=C2N1)OC)OC)CCN3CCN(CC3)C4=CC=CC=C4	{32: 1, 1: 3, 2: 2, 33: 2, 11: 4, 14: 7, 22: 2}
Did not match all atoms present	153-94-6	C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	1530-03-6	CCC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 14: 10}
Did not match all atoms present	1530-04-7	CCCCCC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 4, 3: 1, 14: 10}
Did not match all atoms present	1530-05-8	CCCCCCC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 5, 3: 1, 14: 10}
Did not match all atoms present	1530-11-6	CCCC=C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 2, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	1530-12-7	C1=CC=C2C(=C1)C(C3=CC=CC=C32)C4C5=CC=CC=C5C6=CC=CC=C46	{12: 2, 14: 16}
Did not match all atoms present	1530-20-7	CCCCCC=C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 4, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	1530-32-1	CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 2: 1, 18: 1, 14: 15}
Did not match all atoms present	1530-35-4	C1=CC=C(C=C1)/C=C/C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{17: 1, 2: 1, 14: 20, 6: 2}
Did not match all atoms present	1530-37-6	CC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{1: 1, 2: 1, 14: 19, 17: 1}
Did not match all atoms present	1530-39-8	C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)Cl)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{17: 2, 2: 1, 14: 19}
Did not match all atoms present	1530-45-6	CCOC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 2: 2, 28: 1, 18: 1, 14: 15}
Did not match all atoms present	1530-48-9	CCCC[P+](CCCC)(CCCC)CC=C.[Cl-]	{1: 3, 2: 10, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	15301-40-3	CCOC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=N2	{1: 1, 2: 1, 35: 1, 14: 5, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	15301-48-1	CCC(=O)N1C2=CC=CC=C2N(C1=O)C3CCN(CC3)CCC(C#N)(C4=CC=CC=C4)C5=CC=CC=C5	{1: 1, 2: 3, 4: 1, 37: 1, 33: 3, 11: 4, 12: 1, 14: 14, 24: 1, 25: 1}
Did not match all atoms present	15301-50-5	C1=CC(=CC=C1C(=O)C(CCl)NC(=O)C(Cl)Cl)Cl	{2: 1, 3: 2, 14: 4, 17: 4, 24: 2, 31: 1}
Did not match all atoms present	15301-69-6	CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCN3CCCCC3)C4=CC=CC=C4	{1: 1, 2: 2, 33: 1, 11: 5, 14: 8, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	15304-57-1	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Sn+2]	{35: 8, 14: 16}
Did not match all atoms present	153049-45-7	CN(C)CC/C=C\1/C2=C(SC=C2)S(=O)CC3=CC=CC=C31.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 2, 6: 3, 33: 1, 41: 1, 11: 1, 14: 6, 15: 1, 27: 2, 29: 1}
Did not match all atoms present	15305-72-3	[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[Cl-].[Ru+8]	{17: 1}
Did not match all atoms present	15306-22-6	C1=CC=C(C(=C1)C=NCCC[N-]CCCN=CC2=CC=CC=C2[O-])[O-].[Co+3]	{2: 6, 34: 3, 14: 8, 6: 2}
Did not match all atoms present	15307-78-5	COC(=O)CC1=CC=CC=C1NC2=C(C=CC=C2Cl)Cl	{1: 1, 2: 1, 14: 7, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	15307-79-6	C1=CC=C(C(=C1)CC(=O)[O-])NC2=C(C=CC=C2Cl)Cl.[Na+]	{24: 1, 17: 2, 2: 1, 14: 7, 31: 1}
Did not match all atoms present	15307-86-5	C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl	{17: 2, 2: 1, 27: 1, 14: 7, 31: 1}
Did not match all atoms present	15308-34-6	C1=CC(=CC(=C1)O)C(CN)O.Cl	{2: 1, 3: 1, 14: 4, 17: 1, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	1531-12-0	C1CC[C@@]23CCN[C@@H]([C@@H]2C1)CC4=C3C=C(C=C4)O	{32: 1, 11: 7, 12: 2, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	1531-20-0	CC1=CN=C2C(=C1C)C=CC=C2[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 14: 4}
Did not match all atoms present	1531-25-5	COC1=CC2=C(C[C@@H]3[C@H]4[C@@]2(CCCC4)CCN3)C=C1	{32: 1, 1: 1, 11: 7, 12: 2, 13: 1, 14: 3, 22: 1}
Did not match all atoms present	1531-62-0	CCCCC1=NC2=CC=CC=C2C=C1C	{1: 2, 2: 3, 35: 1, 14: 5}
Did not match all atoms present	1531-77-7	C1C2=CC=CC=C2C(=O)C3=CC=CC=C3S1	{25: 1, 11: 1, 14: 8, 41: 1}
Did not match all atoms present	15310-87-9	CC1=CC(=C(C=C1)C)SCC(=O)O	{40: 1, 1: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	15311-09-8	C1=CN=CC=C1C2=NN=C(S2)C3=CC=NC=C3	{41: 1, 35: 4, 14: 8}
Did not match all atoms present	15317-78-9	CC(C)CN(CC(C)C)C(=S)[S-].CC(C)CN(CC(C)C)C(=S)[S-].[Ni+2]	{1: 8, 2: 4, 3: 4, 33: 2, 7: 2}
Did not match all atoms present	15318-33-9	[CH-]=O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ru+]	{17: 1, 29: 1, 14: 30}
Did not match all atoms present	15318-45-3	CS(=O)(=O)C1=CC=C(C=C1)[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O	{1: 1, 2: 1, 3: 3, 14: 4, 17: 2, 20: 2, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	15318-60-2	[NH4+].[NH4+].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.[Ce+3]	{}
Did not match all atoms present	1532-24-7	COC(=O)C1=C(C=CC(=N1)Cl)Cl	{1: 1, 35: 1, 28: 1, 14: 2, 17: 2}
Did not match all atoms present	1532-72-5	C1=CC=C2C=[N+](C=CC2=C1)[O-]	{33: 1, 29: 1, 14: 7}
Did not match all atoms present	1532-84-9	C1=CC=C2C(=C1)C=CN=C2N	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	1532-97-4	C1=CC=C2C(=C1)C=NC=C2Br	{18: 1, 35: 1, 14: 6}
Did not match all atoms present	15323-35-0	CC1C(C2=C(C1(C)C)C=C(C(=C2)C)C(=O)C)(C)C	{24: 1, 1: 7, 12: 1, 13: 2, 14: 2}
Did not match all atoms present	15325-61-8	CC(C)C=CC1=CC=CC=C1	{1: 2, 3: 1, 14: 5, 6: 2}
Did not match all atoms present	15328-87-7	C1=CC=C(C=C1)/C=C/C=C/2\C(=O)NC(=S)S2	{32: 1, 6: 3, 41: 1, 14: 5, 15: 2, 25: 1}
Did not match all atoms present	1533-03-5	CCC(=O)C1=CC(=CC=C1)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	1533-20-6	CC(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 3: 1, 14: 10}
Did not match all atoms present	1533-45-5	C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)C=CC4=CC=C(C=C4)C5=NC6=CC=CC=C6O5	{35: 2, 14: 16, 6: 2, 23: 2}
Did not match all atoms present	1533-64-8	C[N+]1=CC=CC(=C1)N/N=C/2\C(=O)C=CC3=CC=CC=C32.COS(=O)(=O)[O-]	{1: 2, 34: 1, 33: 1, 14: 10, 15: 1, 22: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	1533-65-9	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CN=CC=C3	{34: 1, 35: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	1533-77-3	CC(=O)NC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=C(C=C(C=C2)[N+](=O)[O-])OC	{1: 4, 2: 4, 38: 1, 33: 1, 34: 2, 14: 6, 22: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	15332-99-7	CC(=C)O[Si](C=C)(OC(=C)C)OC(=C)C	{1: 3, 22: 3, 5: 4, 6: 1, 7: 3}
Did not match all atoms present	15336-18-2	[NH4+].[NH4+].[NH4+].Cl[Rh-3](Cl)(Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	15336-73-9	CCOP(=O)(C(C)O)OCC	{1: 3, 2: 2, 3: 1, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	15336-98-8	CCCC[Sn](CCCC)(CC=C)CC=C	{1: 2, 2: 8, 5: 2, 6: 2}
Did not match all atoms present	15337-84-5	CC[SH+]CC.CC[SH+]CC.Cl[Pt]Cl	{1: 4, 2: 4, 17: 2}
Did not match all atoms present	153382-69-5	CCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.CC(C)CCCCCCCCCCOP(=O)(O)OCCCCCCCCCCC(C)C.O.[Zr].[Zr]	{1: 23, 2: 120, 3: 11, 20: 6, 22: 12, 29: 6}
Did not match all atoms present	15339-46-5	F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.[Mo]	{16: 18}
Did not match all atoms present	153436-22-7	C1=CC=C(C=C1)NC(=O)/C=C/C2=C(NC3=CC(=CC(=C32)Cl)Cl)C(=O)O	{32: 1, 6: 2, 14: 7, 17: 2, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	153454-44-5	CCCCCOC1=CC2=C(C=C1)[N-]N=N2.[Na+]	{1: 1, 2: 4, 35: 3, 22: 1, 14: 3}
Did not match all atoms present	15347-55-4	CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[Pb+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	15348-66-0	COC1=CC=C(C=C1)[N+]#N.Cl[Zn-2](Cl)(Cl)Cl	{1: 1, 34: 1, 22: 1, 14: 4, 17: 4}
Did not match all atoms present	1535-73-5	C1=CC(=CC(=C1)OC(F)(F)F)N	{16: 3, 30: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	1535-75-7	C1=CC=C(C(=C1)N)OC(F)(F)F	{16: 3, 30: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	1535-92-8	C1(=C(C(=C(C(=C1F)F)F)F)F)NC2=C(C(=C(C(=C2F)F)F)F)F	{16: 10, 31: 1}
Did not match all atoms present	15351-05-0	C[N+]1(CCCCCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[I-]	{1: 1, 2: 2, 4: 1, 11: 6, 14: 10, 19: 1, 24: 1, 30: 1}
Did not match all atoms present	15351-09-4	CC(C(=O)C1=CC=CC=C1)N(C)C	{24: 1, 1: 3, 3: 1, 14: 5, 33: 1}
Did not match all atoms present	15351-13-0	C1=CC(=CN=C1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@](O2)(COC(=O)C3=CN=CC=C3)O)OC(=O)C4=CN=CC=C4)OC(=O)C5=CN=CC=C5	{2: 2, 35: 4, 12: 3, 13: 1, 14: 16, 20: 1, 23: 1, 28: 4}
Did not match all atoms present	153567-18-1	C1CCC(CC1)(C2=CC3=CC=CC=C3S2)N4CCCC(C4)CF	{33: 1, 2: 1, 41: 1, 11: 9, 12: 1, 13: 1, 14: 5, 16: 1}
Did not match all atoms present	153568-80-0	C[N+](C)(CCOC(=O)C=C)CC1=CC=CC=C1.C[N+](C)(CC=C)CC=C.[Cl-].[Cl-]	{1: 4, 2: 5, 5: 3, 6: 3, 14: 5, 17: 2, 28: 1}
Did not match all atoms present	15359-96-3	CC1=CC=CC=C1OC(C)(C)C	{1: 4, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	15359-98-5	CC1=CC=C(C=C1)OC(C)(C)C	{1: 4, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	153590-16-0	CCC(C[O-])(COCC=C)COCC=C.CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].[Zr+4]	{1: 4, 2: 6, 4: 1, 5: 5, 6: 2, 7: 3, 22: 2, 24: 3, 29: 1}
Did not match all atoms present	153590-17-1	CCCCCOC1=CC(=C(C=C1)NC(=O)C)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	1536-23-8	C1=CC=C(C=C1)C(=O)C2=C(C(=C(C(=C2F)F)F)F)F	{16: 5, 24: 1, 14: 5}
Did not match all atoms present	15360-00-6	CC(C)(C)OC1=CC=C(C=C1)OC	{1: 4, 4: 1, 22: 2, 14: 4}
Did not match all atoms present	153608-51-6	CCCC[C-]1C=CC=C1.CCCC[C-]1C=CC=C1.CCCC[C-]1C=CC=C1.[Er+3]	{1: 3, 2: 9, 14: 12}
Did not match all atoms present	15361-86-1	CCNC(=S)N(C)C	{1: 3, 2: 1, 31: 1, 33: 1, 7: 1}
Did not match all atoms present	15364-25-7	C(CO)N(CCO)CCO.O=[V]	{33: 1, 2: 6, 20: 3, 29: 1}
Did not match all atoms present	15364-55-3	C1=CC=C2C(=C1)C3C4=CC=CC=C4C2(C5=CC=CC=C35)Br	{18: 1, 12: 1, 13: 1, 14: 12}
Did not match all atoms present	153640-63-2	C1CC(CCC1CO)CO.C1C=CCC2C1C(=O)OC2=O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{2: 2, 11: 6, 12: 4, 14: 5, 20: 2, 27: 1, 28: 4}
Did not match all atoms present	15365-25-0	COC1=CC(=C(C=C1)C(=O)OC)CBr	{1: 2, 2: 1, 14: 3, 18: 1, 22: 1, 28: 1}
Did not match all atoms present	15366-08-2	CC[CH-]C.[Mg+2].[Cl-]	{1: 2, 2: 1, 6: 1, 17: 1}
Did not match all atoms present	15371-06-9	CC(=O)NC1=CC=CC(=C1C(=O)O)C(=O)O	{24: 1, 1: 1, 27: 2, 14: 3, 31: 1}
Did not match all atoms present	15372-34-6	CCC1C2=C(CCC1(C)C(=O)O)C3=C(C=C2)C=C(C=C3)OC	{1: 3, 2: 1, 11: 2, 12: 1, 13: 1, 14: 5, 22: 1, 27: 1}
Did not match all atoms present	153733-75-6	CC1=CC2=CC=CC(=C2C1)C3=CC=CC=C3	{1: 1, 11: 1, 14: 9, 15: 1}
Did not match all atoms present	15374-45-5	C1=CC=C2C(=C1)C=CC=C2CCC3=CC=CC4=CC=CC=C43	{2: 2, 14: 14}
Did not match all atoms present	153745-22-3	C[C@@]12CCC(=O)N1[C@H](CO2)C3=CC=CC=C3	{1: 1, 33: 1, 11: 3, 12: 1, 13: 1, 14: 5, 23: 1, 25: 1}
Did not match all atoms present	15375-48-1	CCCN1C2=CC=CC=C2SC3=CC=CC=C31	{1: 1, 2: 2, 41: 1, 14: 8, 33: 1}
Did not match all atoms present	15375-94-7	CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1[N-]2)C)C(C)O)C)C(C)O)C)CCC(=O)[O-])CCC(=O)[O-].[Na+].[Na+].[Hg+2]	{1: 6, 2: 4, 3: 2, 14: 4, 35: 4, 20: 2, 24: 2}
Did not match all atoms present	1538-59-6	C1=CC=C(C=C1)[Sb](C2=CC=CC=C2)(C3=CC=CC=C3)(Br)Br	{18: 2, 14: 15}
Did not match all atoms present	1538-69-8	CCOP(=O)(C(C)C)OCC	{1: 4, 2: 2, 3: 1, 29: 1, 22: 2}
Did not match all atoms present	1538-74-5	CCCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	15385-57-6	I[Hg].I[Hg]	{19: 2}
Did not match all atoms present	15385-58-7	Br[Hg].Br[Hg]	{18: 2}
Did not match all atoms present	153857-27-3	C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C2C6=C(C=C5C=C4)C(C(C=C6)O)O	{20: 2, 12: 2, 14: 12}
Did not match all atoms present	15387-10-7	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(CNC(=O)C3=CN=CC=C3)C(C)C	{1: 4, 2: 1, 3: 1, 33: 3, 14: 9, 35: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	15387-45-8	CC(C)(C)OC(=O)NC(CCC(=O)N)C(=O)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 2: 2, 3: 1, 4: 1, 38: 1, 14: 4, 24: 1, 28: 2, 30: 1, 31: 1}
Did not match all atoms present	15388-48-4	C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+2]	{17: 2, 35: 6, 29: 8, 14: 24}
Did not match all atoms present	15389-19-2	O=P(=O)[O-]	{29: 3}
Did not match all atoms present	15389-73-8	C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+2]	{38: 3, 17: 2, 35: 6, 29: 8, 14: 21}
Did not match all atoms present	1539-04-4	C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3	{28: 2, 14: 14}
Did not match all atoms present	1539-06-6	CC(=O)NC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	1539-20-4	CC1=C(C(=CC=C1)N=C=S)C	{8: 1, 1: 2, 34: 1, 14: 3}
Did not match all atoms present	1539-42-0	C1=CC=NC(=C1)CNCC2=CC=CC=N2	{2: 2, 35: 2, 14: 8, 31: 1}
Did not match all atoms present	15390-83-7	O[B-](O)(O)O	{20: 4}
Did not match all atoms present	15391-24-9	CN(CCCN/C=C/1\C=CC=CC1=O)CCCN/C=C\2/C=CC=CC2=O.[Co]	{1: 1, 2: 6, 6: 2, 33: 1, 14: 8, 15: 2, 25: 2, 31: 2}
Did not match all atoms present	15391-62-5	C1CC2CC(C1)C3=CC=CC=C23	{11: 4, 12: 2, 14: 4}
Did not match all atoms present	15391-88-5	[Ag+].[C-]#N.[C-]#N	{}
Did not match all atoms present	15391-91-0	[OH-].[OH-].[Tl+3]	{}
Did not match all atoms present	15394-30-6	CCN(CC)C(=O)C1=CC=C(C=C1)C(=O)N(CC)CC	{24: 2, 1: 4, 2: 4, 14: 4, 33: 2}
Did not match all atoms present	15396-00-6	CO[Si](CCCN=C=O)(OC)OC	{1: 3, 2: 3, 8: 1, 34: 1, 22: 3, 29: 1}
Did not match all atoms present	153965-58-3	CC1=C(C=CC=C1N=C=O)N=C=O.CC(CO)O.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O	{1: 2, 2: 2, 3: 1, 8: 4, 11: 2, 13: 2, 14: 11, 34: 4, 20: 2, 29: 4}
Did not match all atoms present	154-02-9	C1=CC2=C(C=C1O)C(=CN2)CCO	{32: 1, 2: 2, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	154-06-3	CC1=CC2=C(C=C1)NC=C2C[C@@H](C(=O)O)N	{32: 1, 1: 1, 2: 1, 3: 1, 14: 4, 27: 1, 30: 1}
Did not match all atoms present	154-08-5	C1=CC2=C(C=C1F)C(=CN2)CC(C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 4, 16: 1, 27: 1, 30: 1}
Did not match all atoms present	154-23-4	C1[C@@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	{11: 1, 12: 2, 14: 5, 20: 1, 21: 4, 23: 1}
Did not match all atoms present	154-41-6	C[C@H]([C@H](C1=CC=CC=C1)O)N.Cl	{1: 1, 3: 2, 14: 5, 17: 1, 20: 1, 30: 1}
Did not match all atoms present	154-42-7	C1=NC2=C(N1)C(=S)N=C(N2)N	{32: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	154-69-8	CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=N2.Cl	{1: 2, 2: 3, 35: 1, 33: 2, 14: 9, 17: 1}
Did not match all atoms present	154-85-8	C1=C(NC(=O)NC1=O)C(=O)[O-].[Na+]	{24: 1, 25: 2, 14: 1, 32: 2}
Did not match all atoms present	154-87-0	CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOP(=O)(O)OP(=O)(O)O	{1: 2, 2: 3, 35: 2, 33: 1, 41: 1, 14: 2, 20: 3, 22: 2, 29: 2, 30: 1}
Did not match all atoms present	154-92-7	C1=CC=C(C=C1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O	{2: 3, 3: 1, 7: 1, 34: 1, 14: 5, 24: 1, 27: 1, 30: 2, 31: 1}
Did not match all atoms present	154-97-2	CN\1C=CC=C/C1=C\[NH+]=O.CS(=O)(=O)[O-]	{1: 2, 6: 1, 33: 1, 14: 4, 15: 1, 29: 4, 31: 1}
Did not match all atoms present	154-99-4	CC1=CC(=C(C=C1)CCNN)C.OS(=O)(=O)O	{1: 2, 2: 2, 14: 3, 20: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	1540-66-5	C(=S)(SC(F)(F)F)Cl	{16: 3, 17: 1, 4: 1, 40: 1, 7: 1}
Did not match all atoms present	15402-79-6	CC(CC1=C(C=C(C=C1OC)OC)OC)N	{1: 4, 2: 1, 3: 1, 14: 2, 22: 3, 30: 1}
Did not match all atoms present	15402-81-0	CC(CC1=C(C(=CC=C1)OC)OC)N	{1: 3, 2: 1, 3: 1, 14: 3, 22: 2, 30: 1}
Did not match all atoms present	1541-60-2	CC1=C2CSC3=CC=CC=C3C2=NC4=CC=CC=C14	{1: 1, 11: 1, 41: 1, 14: 8, 35: 1}
Did not match all atoms present	15411-43-5	C=CC1=CC(=CC=C1)N	{14: 4, 30: 1, 5: 1, 6: 1}
Did not match all atoms present	15419-94-0	C=CC(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{5: 1, 6: 1, 14: 8, 21: 1, 24: 1, 28: 1}
Did not match all atoms present	15421-84-8	CCN(CC)C1=CC(=NC2=NC=NN12)C	{1: 3, 2: 2, 35: 3, 14: 2, 33: 2}
Did not match all atoms present	15422-00-1	CC[NH+](CC)CCCOC(=O)C(C1=CC=CC=C1)(C(C)C)O.[Cl-]	{1: 4, 2: 5, 3: 1, 4: 1, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	15424-14-3	C1=CC=C(C=C1)C(=NNC2=CC=CC=C2)Cl	{17: 1, 34: 1, 31: 1, 14: 10, 7: 1}
Did not match all atoms present	15429-03-5	CC(=O)C1=CC=C[Se]1	{24: 1, 1: 1, 14: 3}
Did not match all atoms present	15429-04-6	C1=C[Se]C(=C1)[N+](=O)[O-]	{38: 1, 14: 3}
Did not match all atoms present	154301-53-8	CC(=C)C(=O)O.CC(C)(C)NC(=O)C=C.C=CC(=O)[O-].[NH4+]	{1: 4, 4: 1, 5: 3, 6: 2, 7: 1, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	15432-57-2	CCCCC(=O)[O-].CCCCC(=O)[O-].[Cu+2]	{24: 2, 1: 2, 2: 6}
Did not match all atoms present	15432-85-6	[O-][Sb](=O)([O-])[O-].[Na+].[Na+].[Na+]	{29: 4}
Did not match all atoms present	15435-71-9	CC(=O)[CH-]C(=O)C.[Na+]	{24: 2, 1: 2, 6: 1}
Did not match all atoms present	15435-77-5	[SiH2]=[SiH2]	{}
Did not match all atoms present	15436-11-0	CS(=O)(=O)C=CC1=CC=CC=C1	{1: 1, 14: 5, 6: 2, 29: 2}
Did not match all atoms present	15438-31-0	[Fe+2]	{}
Did not match all atoms present	15439-85-7	CC1=NC(=CC=C1)C.Cl	{1: 2, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	1544-68-9	C1=CC(=CC=C1N=C=S)F	{8: 1, 16: 1, 34: 1, 14: 4}
Did not match all atoms present	15440-82-1	CC1=CC=C(C=C1)S(=O)(=O)NCCCCNC(=O)C	{1: 2, 2: 4, 14: 4, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	15440-98-9	CCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 5, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	15442-64-5	CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1[N-]2)C=C)C)C=C)C)C)CCC(=O)O)CCC(=O)O.[Zn+2]	{1: 4, 2: 4, 35: 4, 5: 2, 6: 2, 14: 4, 27: 2}
Did not match all atoms present	15442-77-0	C1=CC(=C(C=C1C(=O)[O-])Cl)Cl.C1=CC(=C(C=C1C(=O)[O-])Cl)Cl.[Ni+2]	{24: 2, 17: 4, 14: 6}
Did not match all atoms present	15442-91-8	C1=C(C(=CC(=C1CBr)CBr)CBr)CBr	{2: 4, 18: 4, 14: 2}
Did not match all atoms present	15444-43-6	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Tl+3]	{16: 6, 24: 1, 4: 2, 6: 1, 7: 1}
Did not match all atoms present	15444-46-9	C(CN)N.C(CN)N.[Cl-].Cl[Ir+]Cl	{17: 3, 2: 4, 30: 4}
Did not match all atoms present	15444-66-3	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Mo]	{2: 2, 29: 4, 14: 20}
Did not match all atoms present	15445-15-5	NO.NO.NO.NO.[OH-].[OH-].[Pt+2]	{20: 4, 30: 4}
Did not match all atoms present	15445-66-6	C1CCN(CC1)C2=C(C(=C(C(=C2F)F)F)F)F	{16: 5, 33: 1, 11: 5}
Did not match all atoms present	15446-08-9	C1=CC(=CC=C1SCCCCO)Cl	{40: 1, 17: 1, 2: 4, 20: 1, 14: 4}
Did not match all atoms present	15446-39-6	CC(=O)NC1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)C	{24: 2, 1: 2, 34: 2, 14: 8, 31: 2}
Did not match all atoms present	154486-32-5	CCC(COCC=C)(COCC=C)COC(=O)NC1=CC=CC(=C1C)NC(=O)OCC=C	{1: 2, 2: 7, 4: 1, 5: 3, 6: 3, 14: 3, 22: 2, 28: 2, 31: 2}
Did not match all atoms present	15450-68-7	CC1=CP(=O)(CC1)C	{1: 2, 11: 2, 29: 1, 14: 1, 15: 1}
Did not match all atoms present	15450-79-0	CC1=CCP(=O)(C1)C	{1: 2, 11: 2, 29: 1, 14: 1, 15: 1}
Did not match all atoms present	15451-93-1	CCN(CC)CCN1C2=C(C=C(C=C2)C(=O)C)N=C1NC3=CC=C(C=C3)OCC	{1: 4, 2: 5, 35: 1, 33: 2, 14: 7, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	15452-89-8	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)S(=O)(=O)C2=C(C=CC(=C2)C(C)(C)CC(C)(C)C)O	{1: 10, 2: 2, 4: 4, 14: 6, 21: 2, 29: 2}
Did not match all atoms present	15455-85-3	CCCCCCCCCCCCOC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 14, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1}
Did not match all atoms present	15455-99-9	[SiH3][AsH2]	{}
Did not match all atoms present	154557-38-7	C[Si](C)(C)CC(CO[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 2: 2, 3: 1, 22: 2}
Did not match all atoms present	15457-05-3	C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]	{16: 3, 38: 2, 4: 1, 22: 1, 14: 7}
Did not match all atoms present	154591-46-5	CC[C@@H]1[C@H]([C@H](C(O1)[N+]2=CC=CC(=C2)C(=O)N)O)O.C1=NC2=C(C(=N1)N)N=C([C@@H]2C3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)O)O)O)SCC(=O)C(=O)CBr	{1: 1, 2: 4, 35: 3, 33: 1, 40: 1, 12: 9, 14: 5, 15: 1, 18: 1, 20: 7, 22: 2, 23: 2, 24: 3, 29: 2, 30: 2}
Did not match all atoms present	1546-80-1	C1=CN=C(NC1=O)C(F)(F)F	{32: 1, 35: 1, 4: 1, 14: 2, 16: 3, 25: 1}
Did not match all atoms present	15460-06-7	C1CCC(CC1)C2=CC(=C(C=C2)O)Br	{18: 1, 11: 5, 12: 1, 21: 1, 14: 3}
Did not match all atoms present	15460-48-7	C1CN1C(=O)NC2=CC(=C(C=C2)Cl)Cl	{33: 1, 11: 2, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	15460-68-1	O=P[O-]	{29: 2}
Did not match all atoms present	15467-20-6	C(C(=O)O)N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+]	{24: 2, 33: 1, 2: 3, 27: 1}
Did not match all atoms present	15469-38-2	O.O.O.[F-].[F-].[F-].[Fe+3]	{16: 3}
Did not match all atoms present	154730-83-3	CCN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N.[Na+]	{1: 1, 2: 1, 36: 1, 33: 1, 11: 5, 12: 1, 14: 8, 15: 5, 25: 1, 29: 5, 31: 2}
Did not match all atoms present	15474-63-2	[I-].[I-].[I-].[Dy+3]	{19: 3}
Did not match all atoms present	15475-06-6	CCOC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC	{1: 2, 34: 1, 6: 1, 2: 1, 14: 8, 22: 2}
Did not match all atoms present	15475-27-1	C1=CC=C(C=C1)[P-]C2=CC=CC=C2.[K+]	{14: 10}
Did not match all atoms present	15475-56-6	CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)[O-])C(=O)O.[Na+]	{1: 1, 2: 3, 3: 1, 33: 1, 14: 5, 35: 4, 24: 2, 27: 1, 30: 2, 31: 1}
Did not match all atoms present	15475-84-0	C1=CC(=CC=C1N)NN=C2C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 1, 14: 7, 15: 2, 20: 2, 21: 1, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	15477-76-6	O=[PH]([O-])[O-]	{29: 3}
Did not match all atoms present	1548-13-6	C1=CC(=CC=C1C(F)(F)F)N=C=O	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 29: 1}
Did not match all atoms present	1548-18-1	CC(=O)NC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F	{1: 1, 38: 2, 14: 2, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	1548-74-9	C1(=C(C(=C(C(=C1F)F)N)F)F)C(=O)N	{16: 4, 24: 1, 30: 2}
Did not match all atoms present	15480-00-9	C1=CC=C(C(=C1)OCCO)Cl	{17: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	15481-70-6	CC1=C(C=CC=C1N)N.Cl.Cl	{1: 1, 30: 2, 14: 3, 17: 2}
Did not match all atoms present	154810-33-0	C1CC[C@H]([C@H](C1)C(=O)C2=CC=C(C=C2)F)C(=O)O	{11: 4, 12: 2, 14: 4, 16: 1, 24: 1, 27: 1}
Did not match all atoms present	15482-60-7	CN(C)C(=S)C1=CC=CC=C1	{1: 2, 33: 1, 14: 5, 7: 1}
Did not match all atoms present	15484-00-1	CCOCCOCCOC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 8, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 22: 2}
Did not match all atoms present	15484-44-3	C(CCl)S(=O)(=O)O	{17: 1, 2: 2, 20: 1, 29: 2}
Did not match all atoms present	15484-80-7	CC(C)(C)C1=CC=C(C=C1)C(=O)OC=C	{1: 3, 4: 1, 5: 1, 6: 1, 14: 4, 28: 1}
Did not match all atoms present	15484-93-2	CCOC1=CC=C(C=C1)N=CC2=CC=C(C=C2)N(C)C	{1: 3, 2: 1, 6: 1, 33: 1, 34: 1, 14: 8, 22: 1}
Did not match all atoms present	15486-19-8	CC(=O)OC1=CC=C(C=C1)C=CC(=O)O	{1: 1, 27: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	15489-16-4	C1=C(C=C2C(=C1S(=O)(=O)[O-])O[Sb](O2)OC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].O.O.O.O.O.O.O.[Na+].[Na+].[Na+].[Na+].[Na+]	{29: 12, 22: 1, 14: 4, 23: 2}
Did not match all atoms present	15489-90-4	CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1[N-]2)C=C)C)C=C)C)C)CCC(=O)O)CCC(=O)O.O.[Fe+2]	{1: 4, 2: 4, 35: 4, 5: 2, 6: 2, 14: 4, 27: 2}
Did not match all atoms present	154906-08-8	CC(=O)OCCS(=O)(=O)CCNC(=O)NC1=C(C=CC(=C1)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC3=NC(=NC(=N3)Cl)NC4=C(C=C(C=C4)N=NC5=C(C=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)NCCS(=O)(=O)CCOC(=O)C.[Na+].[K+]	{1: 2, 2: 8, 35: 3, 34: 4, 14: 12, 17: 1, 24: 2, 28: 2, 29: 16, 31: 6}
Did not match all atoms present	154906-09-9	C(COCC[O-])O.[Zr+4]	{2: 4, 20: 1, 29: 1, 22: 1}
Did not match all atoms present	15492-48-5	CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.[Pr+3]	{24: 3, 1: 18, 4: 6, 6: 3, 7: 3}
Did not match all atoms present	15492-50-9	CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.[Sm]	{24: 6, 1: 18, 2: 3, 4: 6}
Did not match all atoms present	15492-52-1	CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.[Yb]	{24: 6, 1: 18, 2: 3, 4: 6}
Did not match all atoms present	15493-35-3	C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(C=O)O.[Cl-].[Cl-].[Ca+2]	{1: 2, 2: 1, 34: 2, 7: 2, 12: 14, 13: 1, 17: 2, 20: 7, 22: 2, 23: 2, 26: 1, 30: 4, 31: 1}
Did not match all atoms present	155-04-4	C1=CC=C2C(=C1)N=C(S2)[S-].C1=CC=C2C(=C1)N=C(S2)[S-].[Zn+2]	{41: 2, 35: 2, 14: 8}
Did not match all atoms present	155-09-9	C1C(C1N)C2=CC=CC=C2	{11: 1, 12: 2, 30: 1, 14: 5}
Did not match all atoms present	155-16-8	CN1C=C(C(=O)NC1=O)F	{32: 1, 1: 1, 33: 1, 14: 1, 16: 1, 25: 2}
Did not match all atoms present	155-41-9	C[N+]1([C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.[Br-]	{1: 2, 2: 1, 3: 1, 11: 2, 12: 5, 14: 5, 18: 1, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	155-58-8	COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O	{1: 1, 2: 1, 6: 2, 12: 5, 14: 6, 20: 4, 21: 2, 22: 2, 23: 1}
Did not match all atoms present	155-91-9	COC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)OC	{1: 2, 35: 2, 14: 5, 22: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	155-97-5	C[N+]1=CC=CC(=C1)OC(=O)N(C)C	{1: 3, 28: 1, 14: 4, 33: 2}
Did not match all atoms present	1550-35-2	C1=CC(=C(C=C1F)F)C=O	{16: 2, 26: 1, 14: 3}
Did not match all atoms present	15500-60-4	C[Si](C)(C)N(C=O)[Si](C)(C)C	{1: 6, 26: 1, 33: 1}
Did not match all atoms present	15500-65-9	C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@@H]([C@@H]2O)[N+]4(CCCCC4)C)CC[C@@H]5[C@@]3(C[C@@H]([C@H](C5)O)[N+]6(CCCCC6)C)C.[Br-].[Br-]	{1: 4, 11: 17, 12: 8, 13: 2, 18: 2, 20: 2}
Did not match all atoms present	15500-66-0	CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1[N+]4(CCCCC4)C)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-].[Br-]	{1: 6, 11: 17, 12: 8, 13: 2, 18: 2, 28: 2}
Did not match all atoms present	15500-73-9	COC1=CC=C(C=C1)C#[N+][O-]	{1: 1, 34: 1, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	15500-74-0	C1=CC(=CC=C1C#[N+][O-])Cl	{17: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	15500-96-6	CNC(=O)NC1=CC=CC=C1Cl	{24: 1, 1: 1, 31: 2, 14: 4, 17: 1}
Did not match all atoms present	15502-74-6	[O-][As]([O-])[O-]	{29: 3}
Did not match all atoms present	15503-86-3	CC=C1CC(C(C(=O)OCC2=CC[N+]3(C2C(CC3)OC1=O)[O-])(CO)O)C	{1: 2, 2: 1, 6: 1, 11: 5, 12: 3, 13: 1, 14: 1, 15: 2, 20: 2, 28: 2, 29: 1}
Did not match all atoms present	15507-13-8	CCCCOS(=O)(=O)O	{1: 1, 2: 3, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	15507-35-4	C1CC=C(C1)CC2=CC=CC=C2	{2: 1, 11: 3, 14: 6, 15: 1}
Did not match all atoms present	15507-52-5	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)OC)C)C	{1: 6, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1}
Did not match all atoms present	15509-05-4	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Hf+4]	{}
Did not match all atoms present	1551-06-0	CCC1=CC=CN1	{32: 1, 1: 1, 2: 1, 14: 3}
Did not match all atoms present	1551-09-3	CCCC1=CNC=C1	{32: 1, 1: 1, 2: 2, 14: 3}
Did not match all atoms present	1551-16-2	CCC1=CNC=C1	{32: 1, 1: 1, 2: 1, 14: 3}
Did not match all atoms present	1551-27-5	CCCC1=CC=CS1	{1: 1, 2: 2, 14: 3, 41: 1}
Did not match all atoms present	1551-39-9	C1(=C(C(=C(C(=C1F)F)F)C(=O)O)F)C(=O)O	{16: 4, 27: 2}
Did not match all atoms present	155122-63-7	C=O.C1=CC(=CC(=C1)O)[O-].[K+]	{5: 1, 14: 4, 21: 1}
Did not match all atoms present	15513-16-3	C1CCC(CC1)NC2=CC=CC=N2	{35: 1, 11: 5, 12: 1, 14: 4, 31: 1}
Did not match all atoms present	15513-74-3	[O-2].[Ho+3].[W]	{}
Did not match all atoms present	155174-21-3	[CH2]C1=CC=CC=C1O	{5: 1, 14: 4, 21: 1}
Did not match all atoms present	155174-22-4	[CH2]C1=CC(=CC=C1)O	{5: 1, 14: 4, 21: 1}
Did not match all atoms present	15519-25-2	C1=CC=C(C=C1)C[N+]2=CC=CC=C2	{33: 1, 2: 1, 14: 10}
Did not match all atoms present	15519-28-5	C(=O)(O)[O-].[Cs+]	{27: 1}
Did not match all atoms present	15519-73-0	CC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)C)O	{1: 2, 21: 2, 14: 6}
Did not match all atoms present	1552-42-7	CN(C)C1=CC=C(C=C1)C2(C3=C(C=C(C=C3)N(C)C)C(=O)O2)C4=CC=C(C=C4)N(C)C	{1: 6, 28: 1, 13: 1, 14: 11, 33: 3}
Did not match all atoms present	1552-46-1	CC1=CC2=C(C=C1)OC(=N2)C=CC3=CC=C(C=C3)C4=NC5=C(O4)C=CC(=C5)C	{1: 2, 35: 2, 14: 10, 6: 2, 23: 2}
Did not match all atoms present	1552-47-2	CC(C)(C)C1=CC2=C(C=C1)OC(=N2)C=CC3=CC=C(C=C3)C4=NC5=C(O4)C=CC(=C5)C(C)(C)C	{1: 6, 35: 2, 4: 2, 6: 2, 14: 10, 23: 2}
Did not match all atoms present	1552-94-9	C1=CC=C(C=C1)/C=C/C=C/C(=O)O	{27: 1, 14: 5, 6: 4}
Did not match all atoms present	1552-96-1	CN(C)C1=CC=C(C=C1)/C=C/C(=O)O	{1: 2, 27: 1, 14: 4, 6: 2, 33: 1}
Did not match all atoms present	15520-31-7	CC(C)(C)C(=O)[O-].CC(C)(C)C(=O)[O-].[Co+2]	{24: 2, 1: 6, 4: 2}
Did not match all atoms present	15521-65-0	CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Ni+2]	{1: 4, 33: 2, 7: 2}
Did not match all atoms present	15522-59-5	[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CCCC[N+](CCCC)(CCCC)CCCC	{1: 4, 2: 12, 14: 20}
Did not match all atoms present	15522-69-7	CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.[Dy+3]	{24: 3, 1: 18, 4: 6, 6: 3, 7: 3}
Did not match all atoms present	15522-71-1	CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.[Eu+3]	{24: 3, 1: 18, 4: 6, 6: 3, 7: 3}
Did not match all atoms present	15522-73-3	CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.[Ho]	{1: 18, 4: 6, 6: 3, 7: 3, 20: 3, 24: 3}
Did not match all atoms present	15523-24-7	[B-](CC)(CC)(CC)CC.[Na+]	{1: 4, 2: 4}
Did not match all atoms present	15525-64-1	C/C(=C/C(=O)C)/[O-].[Ag+]	{24: 1, 1: 2, 6: 1, 7: 1}
Did not match all atoms present	15526-61-1	CC1=C2C=CC=NC2=C3C(=C1)C=CC=N3.CC1=C2C=CC=NC2=C3C(=C1)C=CC=N3.CC1=C2C=CC=NC2=C3C(=C1)C=CC=N3.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+2]	{1: 3, 35: 6, 29: 8, 14: 21, 17: 2}
Did not match all atoms present	155272-58-5	CC1=CC(=O)OC2=C1C=CC(=C2)OCC[N+]3=CC=CC=C3.[Br-]	{1: 1, 2: 2, 33: 1, 14: 9, 18: 1, 22: 1, 28: 1}
Did not match all atoms present	15529-49-4	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Cl-].[Ru+2]	{17: 2, 14: 45}
Did not match all atoms present	15529-90-5	CCP(CC)CC.[Cl-].[Au+]	{1: 3, 2: 3, 17: 1}
Did not match all atoms present	1553-60-2	CC(C)CC1=CC=C(C=C1)CC(=O)O	{27: 1, 1: 2, 2: 2, 3: 1, 14: 4}
Did not match all atoms present	15532-75-9	C1CN(CCN1)C2=CC=CC(=C2)C(F)(F)F	{32: 1, 33: 1, 4: 1, 11: 4, 14: 4, 16: 3}
Did not match all atoms present	15534-95-9	C1CN(C(=S)N1CO)CO	{33: 2, 2: 2, 11: 2, 20: 2, 15: 1}
Did not match all atoms present	15535-69-0	CCCC[Sn+2]CCCC.C(C(C(=O)[O-])O)C(=O)[O-]	{24: 2, 1: 2, 2: 7, 3: 1, 20: 1}
Did not match all atoms present	15535-79-2	CCCCCCCC[Sn]1(OC(=O)CS1)CCCCCCCC	{1: 2, 2: 14, 11: 1, 28: 1, 41: 1}
Did not match all atoms present	15536-01-3	CCP(=O)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 1, 38: 1, 14: 4, 22: 2, 29: 1}
Did not match all atoms present	15536-54-6	O=S(=O)([O-])SSS(=O)(=O)[O-]	{40: 2, 29: 6}
Did not match all atoms present	155367-45-6	CC1=CC=CC2=C1CC(N(C2)C(=O)OC(C)(C)C)C(=O)O	{1: 4, 4: 1, 33: 1, 11: 2, 12: 1, 14: 3, 27: 1, 28: 1}
Did not match all atoms present	15537-76-5	CC(C)N=C(N)/N=C(\N)/NC1=CC(=C(C=C1)Cl)Cl.Cl	{1: 2, 34: 2, 3: 1, 7: 2, 14: 3, 17: 3, 30: 2, 31: 1}
Did not match all atoms present	155379-82-1	CC1=CC(=CC(=C1N)[N+](=O)[O-])N	{1: 1, 38: 1, 30: 2, 14: 2}
Did not match all atoms present	155379-83-2	CC1=CC(=C(C(=C1N)[N+](=O)[O-])C)N	{1: 2, 38: 1, 30: 2, 14: 1}
Did not match all atoms present	15538-90-6	C1=CC2=C(C=C1[N+](=O)[O-])C(=C(C#N)C#N)C3=C2C=CC(=C3)[N+](=O)[O-]	{38: 2, 15: 1, 37: 2, 14: 6, 7: 1}
Did not match all atoms present	15538-93-9	C(COC(C(F)(F)F)(C(F)(F)F)F)C[Si](Cl)(Cl)Cl	{16: 7, 17: 3, 2: 3, 4: 3, 22: 1}
Did not match all atoms present	1554-93-4	C12=C3C(=C(C(=C1C(=C(C2=C(C(=C3F)F)F)F)F)F)F)F	{16: 8, 15: 2}
Did not match all atoms present	15541-60-3	C1(=NC(=NC(=N1)N)N)N.OP(=O)(O)OP(=O)(O)O	{30: 3, 35: 3, 20: 4, 29: 2, 22: 1}
Did not match all atoms present	15543-40-5	[Zr+4]	{}
Did not match all atoms present	15545-48-9	CC1=C(C=C(C=C1)NC(=O)N(C)C)Cl	{1: 3, 33: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	15546-11-9	CCCC[Sn](OC(=O)/C=C\C(=O)OC)(OC(=O)/C=C\C(=O)OC)CCCC	{1: 4, 2: 6, 28: 4, 6: 4}
Did not match all atoms present	15546-12-0	CCCCC(COC(=O)/C=C\C(=O)O[Sn](OC(=O)/C=C\C(=O)OCC(CCCC)CC)(CCCC)CCCC)CC	{1: 6, 2: 16, 3: 2, 28: 4, 6: 4}
Did not match all atoms present	15546-16-4	CCCCOC(=O)/C=C\C(=O)O[Sn](OC(=O)/C=C\C(=O)OCCCC)(CCCC)CCCC	{1: 4, 2: 12, 28: 4, 6: 4}
Did not match all atoms present	15546-43-7	C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=CC=C5)C6=CC=CC=C6	{33: 2, 14: 28}
Did not match all atoms present	15547-17-8	CCC1=CC2=C(C=C1)C(=O)C3=C(C2=O)CCCC3	{1: 1, 2: 1, 11: 4, 14: 3, 15: 2, 25: 2}
Did not match all atoms present	15547-89-4	COC1=CC=CC(=C1)C2CCCCC2=O	{1: 1, 11: 4, 12: 1, 14: 4, 22: 1, 25: 1}
Did not match all atoms present	15548-61-5	C1=CC2=C(C=CC(=C2)Br)C=C1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O	{2: 1, 12: 5, 14: 6, 18: 1, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	1555-53-9	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	1555-56-2	C(C(COP(=O)([O-])[O-])O)O.[Na+].[Na+]	{2: 2, 3: 1, 20: 2, 29: 3, 22: 1}
Did not match all atoms present	1555-66-4	C1=CC=C(C=C1)N(CCC#N)CCC#N	{33: 1, 2: 4, 37: 2, 14: 5}
Did not match all atoms present	1555-80-2	C1=CC=C(C=C1)CC(=O)OC(=O)CC2=CC=CC=C2	{2: 2, 28: 2, 14: 10}
Did not match all atoms present	155522-06-8	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)NC5=NC(=NC(=N5)NC6=CC(=C(C=C6)S(=O)(=O)[O-])N)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{34: 1, 35: 3, 14: 12, 15: 2, 17: 1, 25: 1, 29: 12, 30: 1, 31: 3}
Did not match all atoms present	155522-14-8	CCN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(/C(=N\NC5=C(C=CC(=C5)NC(=O)C(CBr)Br)S(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 2: 2, 3: 1, 33: 1, 34: 1, 14: 11, 15: 2, 17: 1, 18: 2, 35: 3, 24: 1, 25: 1, 29: 9, 31: 3}
Did not match all atoms present	15553-50-1	[B-](F)(F)(F)F.CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC	{16: 4, 1: 4, 2: 20}
Did not match all atoms present	15553-52-3	C=O.C=O.C=O.Cl[Os](Cl)Cl.[Cs]	{17: 3, 5: 3}
Did not match all atoms present	155536-45-1	CCC[C@](C)([C@H]1CC23CCC1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)C)OC)O.Cl	{1: 4, 2: 2, 4: 1, 33: 1, 11: 6, 12: 3, 13: 3, 14: 2, 17: 1, 20: 1, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	15554-47-9	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Y+3]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	15555-71-2	C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+2]	{17: 2, 35: 6, 29: 8, 14: 48}
Did not match all atoms present	155569-91-8	CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)[NH2+]C)OC)OC)\C)C.C1=CC=C(C=C1)C(=O)[O-]	{1: 11, 2: 1, 3: 1, 11: 6, 12: 17, 13: 2, 14: 12, 15: 3, 20: 2, 22: 4, 23: 5, 24: 1, 28: 1}
Did not match all atoms present	1556-99-6	CC1=CC=CC2=C1C3=CC=CC=C3C2	{1: 1, 11: 1, 14: 7}
Did not match all atoms present	155622-18-7	CC1=C(C=C(C(=C1)C23CC4CC(C2)CC(C4)(C3)CN=C(CSS(=O)(=O)O)N)O)C	{1: 2, 2: 2, 34: 1, 7: 1, 40: 1, 11: 6, 12: 2, 13: 2, 14: 2, 20: 1, 21: 1, 29: 2, 30: 1}
Did not match all atoms present	15563-53-8	C1CCN(CC1)C(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3	{33: 1, 3: 1, 11: 5, 14: 10, 24: 1, 31: 1}
Did not match all atoms present	155632-41-0	CC1=C(SC(=C1C)C#N)C#N	{1: 2, 37: 2, 41: 1}
Did not match all atoms present	15565-25-0	COC1=C(C=C(C=C1)CCN2CCC(CC2)CC3=CC=CC=C3)OC.Cl	{1: 2, 2: 3, 33: 1, 11: 4, 12: 1, 14: 8, 17: 1, 22: 2}
Did not match all atoms present	15568-03-3	CC(C)N1C(=O)C2=CC=CC=C2SC1=N	{1: 2, 3: 1, 36: 1, 33: 1, 41: 1, 14: 4, 25: 1}
Did not match all atoms present	15569-85-4	CN1C(CCC1=O)C2=CN=CC=C2	{1: 1, 35: 1, 33: 1, 11: 2, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	15570-10-2	CC1=C(C=CC(=C1)C(C)(C)C)S	{1: 4, 4: 1, 14: 3, 39: 1}
Did not match all atoms present	15570-12-4	COC1=CC(=CC=C1)S	{1: 1, 22: 1, 14: 4, 39: 1}
Did not match all atoms present	15570-45-3	C1C(=C(C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5	{11: 1, 14: 20, 15: 4}
Did not match all atoms present	15571-58-1	CCCCCCCC[Sn](CCCCCCCC)(SCC(=O)OCC(CC)CCCC)SCC(=O)OCC(CC)CCCC	{40: 2, 1: 6, 2: 26, 3: 2, 28: 2}
Did not match all atoms present	15572-30-2	C1=CC2=C(C=CC(=C2)Br)C=C1O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O	{2: 1, 12: 5, 14: 6, 18: 1, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	15573-31-6	C(CP)C(Cl)Cl	{17: 2, 2: 2, 3: 1}
Did not match all atoms present	15573-38-3	C[Si](C)(C)P([Si](C)(C)C)[Si](C)(C)C	{1: 9}
Did not match all atoms present	15574-96-6	CN1CCC(=C2C3=C(CCC4=CC=CC=C42)SC=C3)CC1	{1: 1, 33: 1, 41: 1, 11: 6, 14: 6, 15: 2}
Did not match all atoms present	15577-76-1	C1C2C1C3CC2C4=CC=CC=C34	{11: 2, 12: 4, 14: 4}
Did not match all atoms present	155773-67-4	CCCCOC1=C2C=CC=CC2=C(C3=C4NC(=C31)NC5=C6C(=C([N-]5)NC7=C8C(=C(N7)NC9=C1C(=C(N4)[N-]9)C(=C2C=CC=CC2=C1OCCCC)OCCCC)C(=C1C=CC=CC1=C8OCCCC)OCCCC)C(=C1C=CC=CC1=C6OCCCC)OCCCC)OCCCC.[Cu+2]	{32: 6, 1: 8, 2: 24, 35: 2, 14: 16, 22: 8}
Did not match all atoms present	155773-71-0	CCCCOC1=CC=C(C2=C3NC(=C12)NC4=C5C(=CC=C(C5=C([N-]4)NC6=C7C(=CC=C(C7=C(N6)NC8=C9C(=CC=C(C9=C(N3)[N-]8)OCCCC)OCCCC)OCCCC)OCCCC)OCCCC)OCCCC)OCCCC.[Ni+2]	{32: 6, 1: 8, 2: 24, 35: 2, 14: 8, 22: 8}
Did not match all atoms present	15578-26-4	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Sn+2].[Sn+2]	{29: 6, 22: 1}
Did not match all atoms present	15578-36-6	[O-2].[Pr+3].[W]	{}
Did not match all atoms present	15578-46-8	[O-][W](=O)(=O)[O-].[Tm+3]	{29: 4}
Did not match all atoms present	15578-82-2	CC(=S)C1CCCC=C1O	{1: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
Did not match all atoms present	155789-83-6	CC1=NC2=C(C=C1)N=C(N2C)N	{1: 2, 35: 2, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	15579-17-6	[O-]S(=O)(=O)SS(=O)(=O)[O-]	{40: 1, 29: 6}
Did not match all atoms present	155798-37-1	CCN(CCCl)C1=CC=C(C=C1)OCCCCCNC2=C3C=CC=CC3=NC4=CC=CC=C42	{1: 1, 2: 8, 35: 1, 33: 1, 14: 12, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	1558-17-4	CC1=CC(=NC=N1)C	{1: 2, 35: 2, 14: 2}
Did not match all atoms present	1558-23-2	CC1=NN=C(N=N1)C	{1: 2, 35: 4}
Did not match all atoms present	1558-24-3	C([Si](Cl)(Cl)Cl)(Cl)Cl	{17: 5, 3: 1}
Did not match all atoms present	1558-25-4	C([Si](Cl)(Cl)Cl)Cl	{17: 4, 2: 1}
Did not match all atoms present	1558-31-2	C[Si](C(Cl)Cl)(Cl)Cl	{1: 1, 3: 1, 17: 4}
Did not match all atoms present	1558-67-4	C(=O)OC=O	{26: 2}
Did not match all atoms present	15580-32-2	C1=CC=C(C=C1)NC(=O)CC(=O)O	{24: 1, 2: 1, 27: 1, 14: 5, 31: 1}
Did not match all atoms present	15584-04-0	O=[As]([O-])([O-])[O-]	{29: 4}
Did not match all atoms present	15586-38-6	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Ni+2]	{29: 6, 22: 1}
Did not match all atoms present	15586-47-7	[O-][Se](=O)[O-].[Cs+].[Cs+]	{29: 3}
Did not match all atoms present	15586-55-7	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Er+3].[Er+3].[W].[W].[W]	{}
Did not match all atoms present	15586-66-0	O=[Ga].F	{16: 1, 29: 1}
Did not match all atoms present	15586-77-3	[O-][Si](=O)[O-].[Cs+].[Cs+]	{29: 3}
Did not match all atoms present	15587-38-9	P.[GeH3].[GeH3].[GeH3]	{}
Did not match all atoms present	15587-72-1	OS(=O)(=O)[O-].[Rb+]	{20: 1, 29: 3}
Did not match all atoms present	1559-81-5	CC1CCCC2=CC=CC=C12	{1: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	1559-86-0	C1=C(C(=C(C(=C1F)Br)F)F)F	{16: 4, 18: 1, 14: 1}
Did not match all atoms present	1559-87-1	C1(=C(C(=C(C(=C1F)Br)F)Br)F)F	{16: 4, 18: 2}
Did not match all atoms present	1559-88-2	C1=C(C(=C(C(=C1F)F)Br)F)F	{16: 4, 18: 1, 14: 1}
Did not match all atoms present	1559-97-3	C1CCC2C(C1)CC3=CC=CC=C23	{11: 5, 12: 2, 14: 4}
Did not match all atoms present	15590-62-2	[Li+].CCCCC(CC)C(=O)[O-]	{24: 1, 1: 2, 2: 4, 3: 1}
Did not match all atoms present	15593-51-8	[Li+].[Li+].[O-][Se](=O)[O-]	{29: 3}
Did not match all atoms present	15593-52-9	[Li+].[Li+].[O-][Se](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	15593-61-0	[O-][Se](=O)[O-].[Mg+2]	{29: 3}
Did not match all atoms present	15593-82-5	[O-][Si]([O-])([O-])O[Si]([O-])([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{29: 6, 22: 1}
Did not match all atoms present	15593-90-5	O=[Si]([O-])[O-]	{29: 3}
Did not match all atoms present	15595-91-2	B(F)(F)F.C1CCC(CC1)N	{16: 3, 11: 5, 12: 1, 30: 1}
Did not match all atoms present	15596-54-0	[Cr+].[O-].[OH-].[O].[O]	{}
Did not match all atoms present	15596-83-5	O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Tl+3]	{17: 3, 29: 12}
Did not match all atoms present	15597-40-7	FP(F)Br	{16: 2, 18: 1}
Did not match all atoms present	15597-43-0	C[Sn](C)(C)N=C=S	{8: 1, 1: 3, 34: 1}
Did not match all atoms present	15597-63-4	FP(Cl)Cl	{16: 1, 17: 2}
Did not match all atoms present	15597-76-9	C1=CC=C(C=C1)NC=C2C=C(C=CC2=O)Cl	{6: 1, 14: 8, 15: 2, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	15597-88-3	Cl[Cr](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	15599-91-4	N1=P(N=P(N=P1(F)F)(F)F)(F)F	{16: 6, 35: 3}
Did not match all atoms present	156-06-9	C1=CC=C(C=C1)CC(=O)C(=O)O	{24: 1, 2: 1, 27: 1, 14: 5}
Did not match all atoms present	156-08-1	CC(CC1=CC=CC=C1)N(C)CC2=CC=CC=C2	{1: 2, 2: 2, 3: 1, 14: 10, 33: 1}
Did not match all atoms present	156-10-5	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=O	{34: 1, 29: 1, 14: 9, 31: 1}
Did not match all atoms present	156-25-2	CN(C)C1=CC=C(C=C1)N=NC2=CN=CC=C2	{1: 2, 34: 2, 35: 1, 14: 8, 33: 1}
Did not match all atoms present	156-28-5	C1=CC=C(C=C1)CCN.Cl	{17: 1, 2: 2, 30: 1, 14: 5}
Did not match all atoms present	156-31-0	CC(CC1=CC=CC=C1)N.CC(CC1=CC=CC=C1)N.OS(=O)(=O)O	{1: 2, 2: 2, 3: 2, 14: 10, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	156-38-7	C1=CC(=CC=C1CC(=O)O)O	{2: 1, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	156-39-8	C1=CC(=CC=C1CC(=O)C(=O)O)O	{24: 1, 2: 1, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	156-41-2	C1=CC(=CC=C1CCN)Cl	{17: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	156-43-4	CCOC1=CC=C(C=C1)N	{1: 1, 2: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	156-51-4	C1=CC=C(C=C1)CCNN.OS(=O)(=O)O	{2: 2, 14: 5, 20: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	156-54-7	CCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 2}
Did not match all atoms present	156-62-7	C(#N)N.[Ca+2]	{37: 1, 30: 1}
Did not match all atoms present	156-72-9	CS(=O)(=O)OCOS(=O)(=O)C	{1: 2, 2: 1, 29: 4, 22: 2}
Did not match all atoms present	156-80-9	C(C(=O)[O-])C(=O)[O-]	{24: 2, 2: 1}
Did not match all atoms present	156-83-2	C1=C(N=C(N=C1Cl)N)N	{17: 1, 35: 2, 30: 2, 14: 1}
Did not match all atoms present	1560-06-1	C/C=C/CC1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	1560-09-4	CC/C=C\C1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	1560-28-7	C[Si](C)(C)[Si](C)(C)Cl	{1: 5, 17: 1}
Did not match all atoms present	1560-42-5	CCCCCCCCOP(=O)([O-])OCCCCCCCC.[Na+]	{1: 2, 2: 14, 29: 2, 22: 2}
Did not match all atoms present	1560-54-9	C=CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{18: 1, 2: 1, 14: 15, 5: 1, 6: 1}
Did not match all atoms present	1560-68-5	CCCC=CC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 38: 2, 6: 3, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	1560-69-6	CCC(=O)[O-].CCC(=O)[O-].[Co+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	15600-59-6	[O-][Sb](=O)([O-])[O-].[O-][Sb](=O)([O-])[O-].[Ba+2].[Ba+2].[Ba+2]	{29: 8}
Did not match all atoms present	15600-62-1	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Cd+2].[Cd+2]	{29: 6, 22: 1}
Did not match all atoms present	15605-36-4	O=[Ti].Cl	{17: 1, 29: 1}
Did not match all atoms present	15605-68-2	[Ga]I	{19: 1}
Did not match all atoms present	156052-68-5	CCC(C)(C(=O)CCl)NC(=O)C1=CC(=C(C(=C1)Cl)C)Cl	{1: 3, 2: 2, 4: 1, 14: 2, 17: 3, 24: 2, 31: 1}
Did not match all atoms present	15606-95-8	CCO[As](=O)(OCC)OCC	{1: 3, 2: 3, 29: 1, 22: 3}
Did not match all atoms present	15607-55-3	C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-].C1=CC=C(C=C1)/C(=C(/[S-])\C2=CC=CC=C2)/[S-].[Pt+4]	{14: 20, 7: 4}
Did not match all atoms present	156074-08-7	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)N[C@@H](CO)C(=O)NN	{2: 1, 3: 1, 14: 6, 20: 1, 21: 1, 24: 1, 25: 2, 30: 1, 31: 2}
Did not match all atoms present	15608-37-4	N1=P(N=P(N=P1(Br)Br)(Br)Br)(Cl)Br	{17: 1, 18: 5, 35: 3}
Did not match all atoms present	15609-81-1	[NH4+].[O-]P(=O)([O-])[O-].[Mn+2]	{29: 4}
Did not match all atoms present	1561-49-5	C1CCC(CC1)OC(=O)OOC(=O)OC2CCCCC2	{11: 10, 12: 2}
Did not match all atoms present	1561-92-8	CC(=C)CS(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 29: 3, 5: 1, 7: 1}
Did not match all atoms present	15610-76-1	[NH4+].[NH4+].Cl[Cu-2](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	15611-43-5	[H+].[H+].[H+].CCC1=C(C2=CC3=NC(=CC4=NC(=C(C5=NC(=C(C5=C([O-])[O-])C)C=C1[N-]2)CC(=O)[O-])C(C4C)CCC(=O)[O-])C(=C3C=C)C)C.[Mg+2]	{1: 5, 2: 4, 35: 4, 5: 1, 6: 1, 7: 1, 12: 2, 14: 3, 15: 11, 24: 2}
Did not match all atoms present	15614-67-2	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.O=[Pt]=O	{29: 2, 14: 30}
Did not match all atoms present	156150-67-3	C1=CC(=C(C=C1I)Cl)F	{16: 1, 17: 1, 19: 1, 14: 3}
Did not match all atoms present	1562-00-1	C(CS(=O)(=O)[O-])O.[Na+]	{2: 2, 20: 1, 29: 3}
Did not match all atoms present	1562-34-1	C=CS(=O)(=O)OC1=CC=CC=C1	{14: 5, 22: 1, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	1562-85-2	CN(C)C1=CC2=C(C=C1)[NH+]=C3C(=CC(=O)C(=C3O2)O)C(=O)O.[Cl-]	{32: 1, 1: 2, 33: 1, 14: 4, 17: 1, 21: 1, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	1562-93-2	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)O	{34: 2, 27: 1, 14: 9}
Did not match all atoms present	1562-94-3	COC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OC)[O-]	{1: 2, 34: 1, 33: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	156215-58-6	CN1C2=CC3=CC=CC=C3N=C2N=C1N	{1: 1, 35: 2, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	15622-65-8	CCC1=C(NC2=C1C(=O)C(CC2)CN3CCOCC3)C.Cl	{32: 1, 1: 2, 2: 2, 33: 1, 11: 6, 12: 1, 17: 1, 23: 1, 25: 1}
Did not match all atoms present	156243-44-6	CC1=CN=C2C=CC(=C(C2=N1)C)NC	{1: 3, 35: 2, 14: 3, 31: 1}
Did not match all atoms present	15625-59-9	CCCC[N+](CCCC)(CCCC)CCCC.[Cl-].[Cl-].[Cl-].ClI	{1: 4, 2: 12, 19: 1, 17: 4}
Did not match all atoms present	156275-96-6	CC(C)[Si](C(C)C)(C(C)C)S	{1: 6, 3: 3, 39: 1}
Did not match all atoms present	15629-92-2	C1=CC=C(C=C1)P(CCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl[Ni]Cl	{17: 2, 2: 3, 14: 20}
Did not match all atoms present	1563-01-5	CCN(CC)C1=CC(=O)C(=NNC2=C(C=CC(=C2)S(=O)(=O)O)O)C=C1	{1: 2, 2: 2, 33: 1, 34: 1, 14: 6, 15: 2, 20: 1, 21: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	1563-38-8	CC1(CC2=C(O1)C(=CC=C2)O)C	{1: 2, 11: 1, 13: 1, 14: 3, 21: 1, 23: 1}
Did not match all atoms present	1563-56-0	C1=CC=NC(=C1)C(=O)C2=C(C=CC(=C2)Br)N	{24: 1, 18: 1, 35: 1, 30: 1, 14: 7}
Did not match all atoms present	1563-66-2	CC1(CC2=C(O1)C(=CC=C2)OC(=O)NC)C	{1: 3, 11: 1, 13: 1, 14: 3, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	1563-67-3	CC1CC2=C(O1)C(=CC=C2)OC(=O)NC	{1: 2, 11: 1, 12: 1, 14: 3, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	1563-87-7	CC(=O)N(C1=CC=CC=C1)C(=O)C	{24: 2, 1: 2, 14: 5, 33: 1}
Did not match all atoms present	15630-64-5	CC(=O)N(CCCC1C(=O)NC(C(=O)NC(C(=O)NCC(=O)NCC(=O)NCC(=O)N1)CCCN(C(=O)C)[O-])CCCN(C(=O)C)[O-])[O-].[Fe+3]	{32: 6, 1: 3, 2: 9, 33: 3, 11: 3, 12: 3, 24: 3, 25: 6, 29: 3}
Did not match all atoms present	15630-89-4	C(=O)([O-])[O-].C(=O)([O-])[O-].OO.OO.OO.[Na+].[Na+].[Na+].[Na+]	{24: 2, 20: 6}
Did not match all atoms present	15631-58-0	CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.[Tm]	{24: 6, 1: 18, 2: 3, 4: 6}
Did not match all atoms present	15631-71-7	CN(CCO)C1=CC=C(C=C1)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 2: 2, 33: 1, 34: 1, 14: 4, 17: 3, 20: 1}
Did not match all atoms present	15632-39-0	CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.[Y]	{24: 6, 1: 18, 2: 3, 4: 6}
Did not match all atoms present	15635-87-7	C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.[Ir]	{24: 3, 1: 6, 20: 3, 6: 3, 7: 3}
Did not match all atoms present	15638-14-9	COC1=CC=C(C=C1)C=CC2=CC=C(C=C2)OC	{1: 2, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	15638-57-0	CC[PH+](CC)CC.CC[PH+](CC)CC.[C-]#N.[C-]#N.[Pd+2]	{1: 6, 2: 6}
Did not match all atoms present	1564-53-0	C1=CC=C(C=C1)C(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42	{24: 1, 14: 14}
Did not match all atoms present	1564-64-3	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2Br	{18: 1, 14: 9}
Did not match all atoms present	1564-71-2	C1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)Br	{25: 2, 18: 1, 30: 1, 14: 10, 31: 1}
Did not match all atoms present	15644-80-1	CC1=CC=CC2=C1NC(=CC2=O)C	{32: 1, 1: 2, 14: 4, 25: 1}
Did not match all atoms present	15646-46-5	CCOC=C1C(=O)OC(=N1)C2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 6: 1, 14: 5, 15: 2, 22: 1, 28: 1}
Did not match all atoms present	15647-08-2	CCCCC(CC)COP(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 2, 2: 5, 3: 1, 22: 3, 14: 10}
Did not match all atoms present	1565-71-5	CCC(CC)(C1=CC=CC=C1)O	{1: 2, 2: 2, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	1565-74-8	CC[C@H](C1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	1565-75-9	CCC(C)(C1=CC=CC=C1)O	{1: 2, 2: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	1565-94-2	CC(=C)C(=O)OCC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(COC(=O)C(=C)C)O)O	{1: 4, 2: 4, 3: 2, 4: 1, 5: 2, 7: 2, 14: 8, 20: 2, 22: 2, 28: 2}
Did not match all atoms present	15654-53-2	[Br-].[Br-].[Br-].[Br-].[Rb+].[Rb+].[Pd+2]	{18: 4}
Did not match all atoms present	15656-86-7	C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].[Ba+2]	{24: 2, 14: 4}
Did not match all atoms present	15660-29-4	[NH4+].F[Sn-](F)F	{16: 3}
Did not match all atoms present	15661-00-4	[NH4+].[NH4+].[Br-].[Br-].[Br-].[Br-].[Pd+2]	{18: 4}
Did not match all atoms present	15662-33-6	CC1CCC2(C3(CC4(C5(C(C(C3(C5(C2(C1O)O4)O)O)OC(=O)C6=CC=CN6)(C(C)C)O)C)O)C)O	{32: 1, 1: 5, 3: 1, 11: 3, 12: 3, 13: 8, 14: 3, 20: 6, 23: 1, 28: 1}
Did not match all atoms present	15663-61-3	CN(C)C1=C(C=C(C(=C1)Cl)[N+]#N)OC2=CC=C(C=C2)Cl.CN(C)C1=C(C=C(C(=C1)Cl)[N+]#N)OC2=CC=C(C=C2)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 34: 2, 33: 2, 14: 12, 17: 8, 22: 2}
Did not match all atoms present	15664-29-6	CCC1=C2C=C3C(=C4C(=O)[C@@H](C(=C5[C@H]([C@@H](C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C	{32: 2, 1: 6, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 25: 1, 27: 1, 28: 1}
Did not match all atoms present	15666-28-1	CCCCCCCCCCCCS[Sn](CCCC)(SCCCCCCCCCCCC)SCCCCCCCCCCCC	{40: 3, 1: 4, 2: 36}
Did not match all atoms present	15667-84-2	C(=O)(O)O.O=[Zr]	{27: 2, 29: 1}
Did not match all atoms present	156682-54-1	B(C1=CC(=CC=C1)OCC2=CC=CC=C2)(O)O	{2: 1, 20: 2, 22: 1, 14: 9}
Did not match all atoms present	15669-07-5	[H+].[H+].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Ca+2].[Ca+2].[Fe+2].[Fe+2].[Fe+2].[Fe+2].[Fe+2]	{29: 24}
Did not match all atoms present	1567-89-1	CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C	{1: 2, 34: 1, 38: 2, 7: 1, 14: 3, 31: 1}
Did not match all atoms present	15670-38-9	CCCCP(CCCC)CCCC.CCCCP(CCCC)CCCC.[Cl-].[Cl-].[Cl-].[Cl-].[Pt+2].[Pt+2]	{1: 6, 2: 18, 17: 4}
Did not match all atoms present	15676-16-1	CCN1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OC	{1: 2, 2: 2, 33: 1, 11: 3, 12: 1, 14: 3, 22: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	156768-16-0	C[C@@]1(CC2=C(C(=O)C1)C(=C3C(=C2)C=CC(=C3O)C4=C5C[C@@](CC(=O)C5=C(C6=C4C=CC=C6O)O)(C)O)O)O	{1: 2, 11: 4, 13: 2, 14: 6, 20: 2, 21: 4, 25: 2}
Did not match all atoms present	15679-09-1	CCC1=NC=CS1	{1: 1, 2: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	15679-12-6	CCC1=NC(=CS1)C	{1: 2, 2: 1, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	15679-13-7	CC1=CSC(=N1)C(C)C	{1: 3, 3: 1, 41: 1, 14: 1, 35: 1}
Did not match all atoms present	15679-24-0	CC1=CC2=C3C(=C1)C=CC4=CC(=CC(=C43)C=C2)C	{1: 2, 14: 8}
Did not match all atoms present	15679-25-1	CC1=C(C2=CC=CC3=C2C4=C(C=CC=C14)C=C3)C	{1: 2, 14: 8}
Did not match all atoms present	15679-95-5	[H+].[H+].C1CCC(C(C1)N(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Pd+2]	{24: 4, 33: 2, 2: 4, 11: 4, 12: 2}
Did not match all atoms present	1568-70-3	COC1=CC(=C(C=C1)O)[N+](=O)[O-]	{1: 1, 22: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	1568-80-5	CC1(CC2(CC(C3=C2C=C(C=C3)O)(C)C)C4=C1C=CC(=C4)O)C	{1: 4, 11: 2, 13: 3, 14: 6, 21: 2}
Did not match all atoms present	1568-83-8	CC(C)(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC	{1: 4, 4: 1, 22: 2, 14: 8}
Did not match all atoms present	15681-89-7	[2H][B-]([2H])([2H])[2H].[Na+]	{}
Did not match all atoms present	15682-87-8	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Na+].[Na+].[Pd+2]	{}
Did not match all atoms present	15684-00-1	[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[Re]	{29: 5}
Did not match all atoms present	15684-35-2	[B-](F)(F)(F)F.[B-](F)(F)(F)F.O.O.O.O.O.O.[Co+2]	{16: 8}
Did not match all atoms present	15684-36-3	[B-](F)(F)(F)F.[B-](F)(F)(F)F.O.O.O.O.O.O.[Ni+2]	{16: 8}
Did not match all atoms present	15686-51-8	CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCCC3CCCN3C	{1: 2, 2: 2, 4: 1, 33: 1, 11: 3, 12: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	15686-63-2	CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)OCCN(CC)CC	{1: 3, 2: 5, 33: 1, 14: 8, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	15686-71-2	CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)SC1)C(=O)O	{1: 1, 3: 1, 33: 1, 41: 1, 11: 1, 12: 2, 14: 5, 15: 2, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	15687-18-0	CC(C)(CC(C)(C1=CC=C(C=C1)Cl)O)O	{1: 3, 2: 1, 4: 2, 14: 4, 17: 1, 20: 2}
Did not match all atoms present	15687-27-1	CC(C)CC1=CC=C(C=C1)C(C)C(=O)O	{27: 1, 1: 3, 2: 1, 3: 2, 14: 4}
Did not match all atoms present	15687-37-3	C1=CC=C2C(=C1)C=C/C(=N\NC(=O)N)/C2=O	{34: 1, 14: 6, 15: 1, 24: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	1569-28-4	CCOC(=O)C12C3=C(C=C(C=C3)C)OC1(OC4=C2C=C(C=C4)C)C	{1: 4, 2: 1, 13: 2, 14: 6, 23: 2, 28: 1}
Did not match all atoms present	15690-24-1	C1=COC(=C1)/C=C/C(=O)O	{27: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	15692-07-6	CCP(CC)CC.CCP(CC)CC.Cl[Pt]Cl	{1: 6, 2: 6, 17: 2}
Did not match all atoms present	15696-40-9	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Os].[Os].[Os]	{29: 12}
Did not match all atoms present	15697-17-3	Cl[Cu+]	{17: 1}
Did not match all atoms present	157-03-9	C(CC(=C[N+]#N)[O-])C(C(=O)O)N	{2: 2, 3: 1, 6: 1, 7: 1, 34: 1, 27: 1, 30: 1}
Did not match all atoms present	1570-45-2	CCOC(=O)C1=CC=NC=C1	{1: 1, 2: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	1570-64-5	CC1=C(C=CC(=C1)Cl)O	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	1570-65-6	CC1=CC(=CC(=C1O)Cl)Cl	{1: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	1570-95-2	C1=CC=C(C=C1)C(CO)CO	{2: 2, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	15702-34-8	[O-][Se](=O)[O-].[Mn+2]	{29: 3}
Did not match all atoms present	15702-63-3	[H+].[H+].C1=CC2=C(C=CC(=C2N=C1)[O-])S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2N=C1)[O-])S(=O)(=O)[O-].[Co+2]	{35: 2, 29: 6, 14: 10}
Did not match all atoms present	15702-65-5	C1=CC2=C(C=CC(=C2N=C1)[O-])S(=O)(=O)O.C1=CC2=C(C=CC(=C2N=C1)[O-])S(=O)(=O)O.[Mn+2]	{35: 2, 20: 2, 29: 4, 14: 10}
Did not match all atoms present	15703-03-4	C[PH+](C)C.C[PH+](C)C.I[Pt]I	{1: 6, 19: 2}
Did not match all atoms present	15705-55-2	O=P1([O-])OP(=O)([O-])OP(=O)([O-])O1	{29: 6, 23: 3}
Did not match all atoms present	15707-23-0	CCC1=NC=CN=C1C	{1: 2, 2: 1, 35: 2, 14: 2}
Did not match all atoms present	15707-24-1	CCC1=NC=CN=C1CC	{1: 2, 2: 2, 35: 2, 14: 2}
Did not match all atoms present	15707-34-3	CCC1=CN=C(C(=N1)C)C	{1: 3, 2: 1, 35: 2, 14: 1}
Did not match all atoms present	15708-29-9	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[K+].[K+].[Cd+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	15708-41-5	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	15709-62-3	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C(#N)[S-].C(#N)[S-].[Ni+2]	{37: 2, 14: 30}
Did not match all atoms present	1571-08-0	COC(=O)C1=CC=C(C=C1)C=O	{1: 1, 26: 1, 28: 1, 14: 4}
Did not match all atoms present	1571-13-7	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)NC2=O	{32: 1, 17: 4, 25: 2}
Did not match all atoms present	1571-20-6	CCCCCCCCCCCCN1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl	{1: 1, 2: 11, 25: 2, 33: 1, 17: 4}
Did not match all atoms present	1571-30-8	C1=CC2=C(C(=C1)O)N=C(C=C2)C(=O)O	{35: 1, 27: 1, 21: 1, 14: 5}
Did not match all atoms present	1571-33-1	C1=CC=C(C=C1)P(=O)(O)O	{20: 2, 29: 1, 14: 5}
Did not match all atoms present	1571-72-8	C1=CC(=C(C=C1C(=O)O)N)O	{30: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	1571-86-4	CCCCC1=CC=C(C=C1)CCCC	{1: 2, 2: 6, 14: 4}
Did not match all atoms present	15712-02-4	CC[PH+](CC)CC.CC[PH+](CC)CC.[C-]#N.[C-]#N.[Pt+2]	{1: 6, 2: 6}
Did not match all atoms present	15715-19-2	C1C2=C(CC3=C1NC4=C(C3=O)C=CC=C4Cl)NC5=C(C2=O)C=CC=C5Cl	{32: 2, 17: 2, 11: 2, 14: 6, 25: 2}
Did not match all atoms present	15715-41-0	CCOP(C)OCC	{1: 3, 2: 2, 22: 2}
Did not match all atoms present	15716-30-0	CCOC(=O)C1=CC=C(C=C1)N(CCO)CCO	{1: 1, 2: 5, 33: 1, 14: 4, 20: 2, 28: 1}
Did not match all atoms present	15717-17-6	C1=CC=C(C(=C1)C(=S)N)Cl	{17: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	15717-25-6	C=CC(=O)OCCCS(=O)(=O)[O-].[Na+]	{2: 3, 28: 1, 5: 1, 6: 1, 29: 3}
Did not match all atoms present	15717-29-0	C1CCC(CC1)O[Si](OC2CCCCC2)(OC3CCCCC3)OC4CCCCC4	{11: 20, 12: 4, 22: 4}
Did not match all atoms present	1572-10-7	C1=CC=C(C=C1)C2=CC(=NN2)N	{32: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	1572-46-9	C1=CC=C(C=C1)CC2C3=CC=CC=C3C4=CC=CC=C24	{2: 1, 12: 1, 14: 13}
Did not match all atoms present	1572-95-8	C[C@H](CC1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	15721-02-5	C1=C(C(=CC(=C1Cl)N)Cl)C2=CC(=C(C=C2Cl)N)Cl	{17: 4, 30: 2, 14: 4}
Did not match all atoms present	15721-05-8	C[Si]1O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C	{1: 7, 23: 4}
Did not match all atoms present	15721-10-5	CC(=C)C(=O)OC1=CC=C(C=C1)C(=O)O	{1: 1, 5: 1, 7: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	15721-33-2	[Be+2].C[CH-]C.C[CH-]C	{1: 4, 6: 2}
Did not match all atoms present	15727-65-8	C#CC1=CC=CC2=CC=CC=C21	{9: 1, 10: 1, 14: 7}
Did not match all atoms present	15729-76-7	CCC1=CN=C(S1)CC	{1: 2, 2: 2, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	1573-51-9	C1=CC(=CC=C1N)NN=C2N=CC=N2	{34: 1, 35: 2, 14: 6, 15: 1, 30: 1, 31: 1}
Did not match all atoms present	15732-69-1	CC1[Se]C([Se]C([Se]1)C)C	{1: 3, 12: 3}
Did not match all atoms present	15733-63-8	C1=CC=C(C=C1)CCCCCCl	{17: 1, 2: 5, 14: 5}
Did not match all atoms present	15736-98-8	[C-]#[N+][O-].[Na+]	{34: 1, 29: 1}
Did not match all atoms present	157373-08-5	C1=CC(=C(C(=C1C(=O)Cl)F)F)F	{16: 3, 17: 1, 14: 2, 24: 1}
Did not match all atoms present	1574-10-3	C1=CC=C(C=C1)C=NNC(=O)N	{34: 1, 6: 1, 14: 5, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	1574-18-1	C1=CC2=C(C=CC(=C2C(=C1)O)Cl)Cl	{17: 2, 21: 1, 14: 5}
Did not match all atoms present	15742-33-3	[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].[NH2-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[Co].[Co+3]	{34: 6, 29: 12}
Did not match all atoms present	15743-20-1	C=CC(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].[Al+3]	{24: 3, 5: 3, 6: 3}
Did not match all atoms present	15743-44-9	C(C(=O)[O-])N.[K+]	{24: 1, 2: 1, 30: 1}
Did not match all atoms present	15745-93-4	C1=CC=C(C=C1)C2(C(=O)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4	{25: 2, 13: 1, 14: 15, 33: 1}
Did not match all atoms present	15745-94-5	CCC1(C(=O)N(C1=O)C2=CC=CC=C2)CC	{1: 2, 2: 2, 33: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	1575-95-7	CC(=O)NC(=O)C1=CC=CC=C1	{24: 2, 1: 1, 14: 5, 31: 1}
Did not match all atoms present	15750-23-9	[Fm]	{}
Did not match all atoms present	15750-47-7	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Ce+3].[Ce+3]	{24: 6}
Did not match all atoms present	15753-84-1	CC1=CC=CC(=C1)C=CC(=O)C	{24: 1, 1: 2, 14: 4, 6: 2}
Did not match all atoms present	15757-54-7	CC1(N=C(C2N1C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C	{1: 2, 35: 1, 38: 1, 33: 1, 12: 2, 13: 1, 14: 9, 15: 1}
Did not match all atoms present	157577-99-6	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)N=NC6=C(C=C(C=C6)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{34: 5, 14: 18, 15: 2, 25: 1, 29: 8, 30: 3, 31: 2}
Did not match all atoms present	1576-13-2	CCC(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 1, 2: 1, 3: 1, 21: 2, 14: 8}
Did not match all atoms present	1576-35-8	CC1=CC=C(C=C1)S(=O)(=O)NN	{1: 1, 30: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	1576-43-8	C1=CC(=CC=C1O)S(=O)(=O)N	{30: 1, 21: 1, 14: 4, 29: 2}
Did not match all atoms present	1576-48-3	C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2	{29: 2, 14: 12, 31: 1}
Did not match all atoms present	1576-67-6	CC1=CC2=C(C=C1)C=CC3=C2C=C(C=C3)C	{1: 2, 14: 8}
Did not match all atoms present	1576-69-8	CC1=CC2=C(C=C1)C3=C(C=C2)C=C(C=C3)C	{1: 2, 14: 8}
Did not match all atoms present	15761-96-3	CC1(COP(=O)(OC1)CC2=CC=CC=C2)C	{1: 2, 2: 1, 11: 2, 13: 1, 14: 5, 23: 2, 29: 1}
Did not match all atoms present	15762-07-9	C[C+]=O	{1: 1, 29: 1}
Did not match all atoms present	157627-98-0	CCN1C(=O)C(=C(/C(=N/NC2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)NC4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])/C1=O)C)CS(=O)(=O)[O-].[Na+]	{1: 2, 2: 2, 35: 2, 33: 1, 34: 1, 14: 7, 15: 3, 16: 2, 17: 1, 24: 1, 25: 2, 29: 6, 31: 3}
Did not match all atoms present	15764-16-6	CC1=CC(=C(C=C1)C=O)C	{1: 2, 26: 1, 14: 3}
Did not match all atoms present	15764-73-5	C1=CC(=CC=C1N)S(=O)(=O)CCOS(=O)(=O)[O-].[Na+]	{2: 2, 30: 1, 22: 1, 14: 4, 29: 5}
Did not match all atoms present	157643-56-6	C[C@@H]1[C@H](O[C@@H](C2=C1C(=C(C(=C2O)C(=O)O)O)C)O)C	{1: 3, 12: 3, 20: 1, 21: 2, 23: 1, 27: 1}
Did not match all atoms present	15769-72-9	CCO[Al](CC(C)C)CC(C)C	{1: 5, 2: 3, 3: 2, 22: 1}
Did not match all atoms present	15770-22-6	C([C@H]([C@H]([C@@H](C(=O)[O-])O)O)O)O.[K+]	{24: 1, 2: 1, 3: 3, 20: 4}
Did not match all atoms present	15772-26-6	C1=CC=C(C=C1)N(CCO)CCOC(=O)C=CC(=O)O	{33: 1, 2: 4, 6: 2, 14: 5, 20: 1, 27: 1, 28: 1}
Did not match all atoms present	15773-36-1	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N\NC3=CC=C(C=C3)N=NC4=CC=C(C=C4)N(CCO)CCO)C(=O)O	{33: 1, 2: 4, 34: 3, 14: 13, 15: 2, 20: 2, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	15773-52-1	CCCCCCCCCC(=O)O.[PbH4]	{1: 1, 2: 8, 27: 1}
Did not match all atoms present	15773-53-2	CCCCCC(=O)[O-].CCCCCC(=O)[O-].[PbH2+2]	{24: 2, 1: 2, 2: 8}
Did not match all atoms present	15773-55-4	CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].[Pb+2]	{24: 2, 1: 2, 2: 20}
Did not match all atoms present	15773-56-5	CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC(=O)[O-].[Pb+2]	{24: 2, 1: 2, 2: 28}
Did not match all atoms present	157730-35-3	CN1C2=C(N=C3C=NC=CC3=C2)N=C1N	{1: 1, 35: 3, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	157730-36-4	CN1C2=C(N=C3C=CN=CC3=C2)N=C1N	{1: 1, 35: 3, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	157730-37-5	CN1C2=C(N=C3C=CC=NC3=C2)N=C1N	{1: 1, 35: 3, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	15774-82-0	CC1=CC2=C(C=C1)SC3=CC=CC=C3C2=O	{1: 1, 41: 1, 14: 7, 25: 1}
Did not match all atoms present	1578-29-6	C[Si](C)(C)C1=CC=C(O1)[Si](C)(C)C	{1: 6, 14: 2, 23: 1}
Did not match all atoms present	1578-33-2	C[Si](C)(C)C1=CC=CO1	{1: 3, 14: 3, 23: 1}
Did not match all atoms present	1578-44-5	C[Si](C)(C1=CC=CO1)C2=CC=CO2	{1: 2, 14: 6, 23: 2}
Did not match all atoms present	1578-63-8	C1=CC=C(C=C1)C(C(=O)O)F	{16: 1, 27: 1, 3: 1, 14: 5}
Did not match all atoms present	15780-02-6	CCC[N+](CCC)(CCC)CCC.[O-]Cl(=O)(=O)=O	{1: 4, 2: 8, 29: 4, 17: 1}
Did not match all atoms present	15780-33-3	[O-][U](=O)(=O)O[U](=O)(=O)O[U](=O)(=O)[O-].[Ni+2]	{29: 8, 22: 2}
Did not match all atoms present	15780-96-8	CCCCCCCCCCO[P+](=O)OC1=CC=CC=C1	{1: 1, 2: 9, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	15782-03-3	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=CC(=C(C=C3)Cl)S(=O)(=O)[O-])C(=O)[O-].[Sr+2]	{34: 1, 14: 8, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	15782-04-4	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=C(C=C3)S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=C(C=C3)S(=O)(=O)[O-].[Ba+2]	{34: 2, 14: 20, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	157837-31-5	C1=CC(=CC(=C1)N)C2=CN=CO2	{35: 1, 30: 1, 14: 6, 23: 1}
Did not match all atoms present	15784-28-8	C=CCOC(=O)C1=CC=C(C=C1)Cl	{2: 1, 5: 1, 6: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	15785-09-8	[OH-].[OH-].[OH-].[Ce+3]	{}
Did not match all atoms present	15785-93-0	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[Hg]Cl	{17: 1, 38: 2, 14: 7, 31: 1}
Did not match all atoms present	15788-02-0	C1=CSC(=C1)C(=CC(=O)C(F)(F)F)O	{4: 1, 6: 1, 7: 1, 41: 1, 14: 3, 16: 3, 20: 1, 24: 1}
Did not match all atoms present	15788-16-6	C1=CC2=C(C=C1C(=O)O)NC=N2	{32: 1, 35: 1, 27: 1, 14: 4}
Did not match all atoms present	1579-40-4	CC1=CC=C(C=C1)OC2=CC=C(C=C2)C	{1: 2, 22: 1, 14: 8}
Did not match all atoms present	15790-15-5	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3	{1: 2, 34: 2, 35: 1, 33: 1, 12: 1, 14: 9, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	15791-78-3	C1=CC(=CC=C1CCO)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)[N+](=O)[O-])O	{2: 2, 38: 1, 14: 8, 20: 1, 21: 2, 25: 2, 31: 1}
Did not match all atoms present	157911-56-3	C1=C(C(=CC(=C1F)F)F)CBr	{16: 3, 2: 1, 18: 1, 14: 2}
Did not match all atoms present	15792-20-8	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])N/N=C/3\C4=CC=CC=C4C=C(C3=O)C(=O)[O-].[Sr+2]	{34: 1, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	15792-41-3	C1=CC=C(C(=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=C(C(=NC(=N4)Cl)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 35: 2, 14: 7, 15: 2, 17: 3, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	157928-97-7	CC1=C(C(=CC=C1)C)NC(=O)CN(C2=C(C=CC=C2C)C)C(=O)CN3CCCC3=O	{1: 4, 2: 2, 33: 2, 11: 3, 14: 6, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	157928-98-8	CC1CCN(C1=O)CC(=O)NC2=C(C=CC=C2C)C	{1: 3, 2: 1, 33: 1, 11: 2, 12: 1, 14: 3, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	157928-99-9	CC1CC(=O)N(C1)CC(=O)NC2=C(C=CC=C2C)C	{1: 3, 2: 1, 33: 1, 11: 2, 12: 1, 14: 3, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	15793-40-5	CC(CC(C1=CC=CC=C1)C2=CC=CC=C2)NC(C)(C)C	{1: 4, 2: 1, 3: 2, 4: 1, 14: 10, 31: 1}
Did not match all atoms present	15793-48-3	CCOC1=C(C=C(C=C1)Cl)N	{1: 1, 2: 1, 14: 3, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	15793-77-8	C1=CC=C2C(=C1)C=CC(=N2)NN	{35: 1, 30: 1, 14: 6, 31: 1}
Did not match all atoms present	157949-37-6	CC(C1=CC=CC=C1)C2=CC(=C(C(=C2)C(=O)O)[O-])C(C)C3=CC=CC=C3.CC(C1=CC=CC=C1)C2=CC(=C(C(=C2)C(=O)O)[O-])C(C)C3=CC=CC=C3.[Zn+2]	{27: 2, 1: 4, 3: 4, 14: 24}
Did not match all atoms present	15795-42-3	CC1=CC=C(C=C1)N=S=O	{40: 1, 1: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	157966-96-6	C/C=C/C1=CC(=C(C(=C1/C=C/C)S(=O)(=O)O)/C=C/C)/C=C/C.CC(C)N	{1: 6, 3: 1, 6: 8, 14: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	15799-79-8	CN(C)C1=CC(=CC=C1)OC	{1: 3, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	1580-19-4	C12=C(C(=C3C(=C1F)C(=C(C(=C3F)F)F)F)F)C(=C(C(=C2F)F)F)F	{16: 10}
Did not match all atoms present	1580-20-7	C12=C3C(=C(C(=C1C(=C(C(=C2F)F)F)F)F)F)C(=C(C(=C3F)F)F)F	{16: 10}
Did not match all atoms present	15801-69-1	CC1=C(C(=NN1C)C)Br	{1: 3, 18: 1, 35: 1, 33: 1}
Did not match all atoms present	15802-80-9	CC(C)(C)C1=CC=NN1	{32: 1, 1: 3, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	15804-19-0	C1=CC=C2C(=C1)NC(=O)C(=O)N2	{32: 2, 25: 2, 14: 4}
Did not match all atoms present	15805-42-2	C1=C(C(=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[O-])[N+](=O)[O-].[Ba+2]	{38: 3, 14: 1}
Did not match all atoms present	15806-20-9	C1=CC=C(C=C1)CNNC2=CC=CC=C2	{2: 1, 14: 10, 31: 2}
Did not match all atoms present	15807-67-7	C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+]	{29: 6, 14: 8}
Did not match all atoms present	158086-59-0	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[NH4+].[OH3+].[OH3+].[Cr+3]	{24: 4}
Did not match all atoms present	15814-45-6	C=CCOC(=O)CCC1=CC=CC=C1	{2: 3, 14: 5, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	1582-09-8	CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]	{1: 2, 2: 4, 4: 1, 38: 2, 33: 1, 14: 2, 16: 3}
Did not match all atoms present	1582-27-0	C1=CC(=CC=C1[N+]#N)Cl.F[P-](F)(F)(F)(F)F	{16: 6, 17: 1, 34: 1, 14: 4}
Did not match all atoms present	15821-13-3	CC1=NC2=CC=CC=C2C(=C1)C(=O)N	{24: 1, 1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	15821-36-0	C=CCCC1=NC(=NC(=N1)N)N	{35: 3, 2: 2, 30: 2, 5: 1, 6: 1}
Did not match all atoms present	15823-04-8	COC1=CC=C(C=C1)CCC(=O)OC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	15823-43-5	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Hf+4]	{29: 8}
Did not match all atoms present	15823-78-6	[OH-].[Tl+3]	{}
Did not match all atoms present	15825-70-4	C([C@H]([C@H]([C@@H]([C@@H](CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{2: 2, 3: 4, 22: 6}
Did not match all atoms present	15826-16-1	CCCCCCCCCCCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 13, 29: 3, 22: 2}
Did not match all atoms present	15826-37-6	C1=CC2=C(C(=C1)OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C(=O)[O-])O)C(=O)C=C(O2)C(=O)[O-].[Na+].[Na+]	{2: 2, 3: 1, 14: 8, 20: 1, 22: 2, 23: 2, 24: 2, 25: 2}
Did not match all atoms present	15826-91-2	[2H]C1=C(C(=C(C(=C1[2H])[2H])NC(=O)C)[2H])[2H]	{24: 1, 1: 1, 14: 5, 31: 1}
Did not match all atoms present	15827-34-6	CN(C)CC1=C(C(=CC=C1)CN(C)C)O	{1: 4, 2: 2, 21: 1, 14: 3, 33: 2}
Did not match all atoms present	158271-95-5	C1C=CC(=O)N1[C@@H](CO)C2=CC=CC=C2	{33: 1, 2: 1, 3: 1, 11: 1, 14: 7, 20: 1, 25: 1}
Did not match all atoms present	15829-53-5	O([Hg])[Hg]	{22: 1}
Did not match all atoms present	158296-69-6	CC1=C(C(=CC(=C1)C#N)Cl)N	{1: 1, 37: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	1583-58-0	C1=CC(=C(C=C1F)F)C(=O)O	{16: 2, 27: 1, 14: 3}
Did not match all atoms present	1583-67-1	C1=CC(=C(C(=C1)F)C(=O)O)C(=O)O	{16: 1, 27: 2, 14: 3}
Did not match all atoms present	1583-88-6	C1=CC(=CC=C1CCN)F	{16: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	15830-97-4	C1=CC=C(C=C1)CCNC2=C3C(=C(C=C2)NCCC4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O	{25: 2, 2: 4, 14: 16, 31: 2}
Did not match all atoms present	158366-46-2	CC(=O)C1=C(C=C(N1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 1: 1, 38: 3, 14: 1, 33: 1}
Did not match all atoms present	15842-29-2	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.[Ca+2]	{}
Did not match all atoms present	15843-24-0	CC[C]=O	{1: 1, 2: 1, 29: 1}
Did not match all atoms present	15845-29-1	C=[N]	{5: 1}
Did not match all atoms present	15845-52-0	OP(=O)([O-])[O-].[Pb+2]	{20: 1, 29: 3}
Did not match all atoms present	15845-66-6	CCO[P+](=O)O	{1: 1, 2: 1, 20: 1, 29: 1, 22: 1}
Did not match all atoms present	15846-14-7	COC1=C(C(=NC=N1)OC)[N+](=O)[O-]	{38: 1, 1: 2, 35: 2, 22: 2, 14: 1}
Did not match all atoms present	15849-99-7	C=CP(=S)(Cl)Cl	{17: 2, 5: 1, 6: 1}
Did not match all atoms present	1585-06-4	CCC1=CC=C(C=C1)OCC	{1: 2, 2: 2, 22: 1, 14: 4}
Did not match all atoms present	1585-07-5	CCC1=CC=C(C=C1)Br	{1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	1585-16-6	CC1=CC(=C(C(=C1)C)CCl)C	{1: 3, 2: 1, 14: 2, 17: 1}
Did not match all atoms present	1585-17-7	CC1=CC(=C(C(=C1CCl)C)CCl)C	{1: 3, 2: 2, 14: 1, 17: 2}
Did not match all atoms present	1585-40-6	C1=C(C(=C(C(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 5, 14: 1}
Did not match all atoms present	15852-73-0	C1=CC(=CC(=C1)Br)CO	{2: 1, 20: 1, 18: 1, 14: 4}
Did not match all atoms present	15853-39-1	NS(=O)(=O)[O-]	{29: 3, 30: 1}
Did not match all atoms present	15853-77-7	CCCC[Sn](OC(=O)/C=C\C(=O)OCCC)(OC(=O)/C=C\C(=O)OCCC)CCCC	{1: 4, 2: 10, 28: 4, 6: 4}
Did not match all atoms present	15854-58-7	COC1=CC=CC=C1C=CC(=O)OC	{1: 2, 22: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	15859-24-2	O[Si](O)(O)O.[Na]	{20: 4}
Did not match all atoms present	15859-81-1	Cl[I-]Cl.[Rb+]	{17: 2, 19: 1}
Did not match all atoms present	158599-21-4	CCCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 1, 2: 2, 12: 1, 14: 8}
Did not match all atoms present	1586-00-1	C1=CC=C(C=C1)CC2=CC=CC=C2CO	{2: 2, 20: 1, 14: 9}
Did not match all atoms present	1586-73-8	C[Si](C)(C)N([Si](C)(C)C)[Si](C)(C)C	{1: 9, 33: 1}
Did not match all atoms present	1586-92-1	CCO[Al](CC)CC	{1: 3, 2: 3, 22: 1}
Did not match all atoms present	15860-31-8	C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)C4=CC=CC=C4	{24: 1, 11: 1, 14: 12}
Did not match all atoms present	15861-24-2	C1=CC2=C(C=CN2)C=C1C#N	{32: 1, 37: 1, 14: 5}
Did not match all atoms present	15862-07-4	C1=CC=C(C=C1)C2=CC(=C(C=C2Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	15862-11-0	CCOC1=CC=C(C=C1)N(C(=O)C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 14: 4, 22: 1, 24: 1, 29: 1}
Did not match all atoms present	15862-31-4	C1=C(C=NC(=C1Br)N)[N+](=O)[O-]	{38: 1, 18: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	15863-22-6	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Mg+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	15863-41-9	CSC1=CC=C(C=C1)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4, 40: 1}
Did not match all atoms present	15864-32-1	C1=CC2=C(C=C1Br)SC(=N2)N	{41: 1, 18: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	158640-34-7	C1=CC(=CC=C1C(=NNC2=CC(=CC(=NC(=O)NCCS(=O)(=O)CCOS(=O)(=O)[O-])C2=O)S(=O)(=O)[O-])NNC3=C(C=CC(=C3)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)CCCl.[Na+].[Na+].[Na+].[Na+].[Cu]	{2: 6, 7: 1, 34: 2, 14: 9, 15: 3, 17: 1, 22: 1, 24: 2, 25: 1, 29: 13, 31: 4}
Did not match all atoms present	158681-13-1	CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl.Cl	{1: 1, 35: 1, 33: 2, 11: 5, 14: 7, 17: 4, 24: 1, 31: 1}
Did not match all atoms present	1587-04-8	CC1=CC=CC=C1CC=C	{1: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	15872-41-0	CCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 4, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	15872-42-1	CCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 6, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	15872-43-2	CCCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 8, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	15872-44-3	CCCCCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 10, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	15872-45-4	CCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 12, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	15872-46-5	CCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 13, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	15872-48-7	CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 15, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	15872-50-1	CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 17, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	15872-73-8	CC1=CC(=CC(=C1O)N)N	{1: 1, 30: 2, 21: 1, 14: 2}
Did not match all atoms present	15873-51-5	C1=CC(=CC=C1N)[N+](=O)[O-].Cl	{17: 1, 38: 1, 30: 1, 14: 4}
Did not match all atoms present	15876-51-4	C1=CC=C2/C(=N\NC3=CC=C(C=C3)S(=O)(=O)[O-])/C(=O)C=CC2=C1.C1=CC=C2/C(=N\NC3=CC=C(C=C3)S(=O)(=O)[O-])/C(=O)C=CC2=C1.C1=CC=C2/C(=N\NC3=CC=C(C=C3)S(=O)(=O)[O-])/C(=O)C=CC2=C1.[Al+3]	{34: 3, 14: 30, 15: 3, 25: 3, 29: 9, 31: 3}
Did not match all atoms present	15876-67-2	C[N+]1=CC=CC(=C1)OC(=O)N(C)CCCCCCN(C)C(=O)OC2=C[N+](=CC=C2)C.[Br-].[Br-]	{1: 4, 2: 6, 33: 4, 14: 8, 18: 2, 28: 2}
Did not match all atoms present	158760-95-3	CCCCOC(=O)C(=C)C.CC(=C)C(=O)OCCOP(=O)([O-])OCC[N+](C)(C)C	{1: 6, 2: 7, 5: 2, 7: 2, 22: 2, 28: 2, 29: 2}
Did not match all atoms present	1588-44-9	C=CCCCCC1=CC=CC=C1	{2: 4, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	1588-83-6	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])N	{38: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	1588-89-2	C1=CC=C(C=C1)C2=NC=CN=C2C3=CC=CC=C3	{35: 2, 14: 12}
Did not match all atoms present	15883-59-7	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)[O-])C=CC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{38: 2, 14: 6, 6: 2, 29: 6}
Did not match all atoms present	15886-84-7	CS(=O)(=O)OCCCOS(=O)(=O)C	{1: 2, 2: 3, 29: 4, 22: 2}
Did not match all atoms present	1589-60-2	C1CCC(CC1)(C2=CC=CC=C2)O	{11: 5, 20: 1, 13: 1, 14: 5}
Did not match all atoms present	1589-62-4	C1CCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])CC1	{34: 1, 38: 2, 11: 5, 14: 3, 15: 1, 31: 1}
Did not match all atoms present	15893-52-4	COC1=CC2=C(C=C1)N(C(=O)C(O2)O)O	{1: 1, 33: 1, 12: 1, 14: 3, 20: 2, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	15894-04-9	C1=CC(=CC=C1CS)F	{16: 1, 2: 1, 14: 4, 39: 1}
Did not match all atoms present	159-66-0	C1=CC=C2C(=C1)C3=CC=CC=C3C24C5=CC=CC=C5C6=CC=CC=C46	{13: 1, 14: 16}
Did not match all atoms present	159-68-2	C1=CC=C2C(=C1)C3=CC=CC=C3[Si]24C5=CC=CC=C5C6=CC=CC=C46	{14: 16}
Did not match all atoms present	1590-08-5	CC1CCC2=CC=CC=C2C1=O	{1: 1, 11: 2, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	1590-87-0	[Si][Si]	{}
Did not match all atoms present	15901-49-2	CC[Si]1(O[Si](O[Si](O1)(C)CC)(C)CC)C	{1: 6, 2: 3, 23: 3}
Did not match all atoms present	15903-58-9	CC1=CC=CC=C1C2=NC3=CC=CC=C3S2	{1: 1, 35: 1, 14: 8, 41: 1}
Did not match all atoms present	159035-03-7	[Li+].CC(C)([CH2-])CO[Si](C)(C)C	{1: 5, 2: 1, 4: 1, 5: 1, 22: 1}
Did not match all atoms present	15904-73-1	CC(CN1C2=C(C=C(C=C2)OC)SC3=CC=CC=C31)CN(C)C	{1: 4, 2: 2, 3: 1, 33: 2, 41: 1, 14: 7, 22: 1}
Did not match all atoms present	15905-32-5	C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C(=C4OC5=C(C(=C(C=C35)I)O)I)I)O)I	{13: 1, 14: 6, 19: 4, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	15905-86-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[U+4]	{}
Did not match all atoms present	15905-98-3	Cl[Fe+]Cl	{17: 2}
Did not match all atoms present	15906-92-0	[Cr+3].[OH-]	{}
Did not match all atoms present	15907-85-4	C1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Cl)Cl	{11: 5, 12: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	15909-92-9	C1=CC=C(C=C1)P(CCC#N)CCC#N	{2: 4, 37: 2, 14: 5}
Did not match all atoms present	15909-94-1	C1=C(C=C(C=C1C(=O)O)N2C(=S)N=NN2)C(=O)O	{32: 1, 33: 1, 27: 2, 14: 3, 35: 2}
Did not match all atoms present	159092-67-8	C1=CC2=C(C=CC3=C2C=C(C=C3)[N+](=O)[O-])C(=C1)[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	159092-69-0	C1=CC(=CC2=C1C=CC3=C2C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	159092-71-4	C1=CC=C2C3=C(C=C(C=C3)[N+](=O)[O-])C(=CC2=C1)[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	159092-72-5	C1=CC2=C(C(=C1)[N+](=O)[O-])C3=C(C=C2)C=CC(=C3)[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	159092-73-6	C1=CC=C2C(=C1)C=C(C3=C2C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	159092-76-9	C1=CC2=C3C(=C(C=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])C=CC=C3[N+](=O)[O-]	{38: 3, 14: 7}
Did not match all atoms present	159092-78-1	C1=CC2=C3C=C(C=CC3=C(C=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 7}
Did not match all atoms present	159092-79-2	C1=CC2=C3C=CC(=CC3=C(C=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 7}
Did not match all atoms present	159092-80-5	C1=CC2=CC(=C3C=C(C=CC3=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 7}
Did not match all atoms present	159092-81-6	C1=CC2=C3C=C(C=CC3=C(C=C2C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 7}
Did not match all atoms present	159092-84-9	C1=CC(=CC2=C3C=C(C=CC3=C(C=C21)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 7}
Did not match all atoms present	159092-85-0	C1=CC2=CC(=C3C=CC(=CC3=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 7}
Did not match all atoms present	1591-17-9	C1=CC=C(C=C1)C=CC(C#N)OC(=O)C2=CC=CC=C2	{3: 1, 28: 1, 14: 10, 6: 2, 37: 1}
Did not match all atoms present	1591-30-6	C1=CC(=CC=C1C#N)C2=CC=C(C=C2)C#N	{37: 2, 14: 8}
Did not match all atoms present	1591-31-7	C1=CC=C(C=C1)C2=CC=C(C=C2)I	{19: 1, 14: 9}
Did not match all atoms present	1591-95-3	C(=NC1=C(C(=C(C(=C1F)F)F)F)F)=O	{8: 1, 16: 5, 34: 1, 29: 1}
Did not match all atoms present	1591-99-7	CC1=C(C(=CC=C1)N=C=O)C	{8: 1, 1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	15912-75-1	C1=CC=C(C=C1)C(CC[PH3+])(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{2: 2, 4: 1, 18: 1, 14: 15}
Did not match all atoms present	15912-80-8	c1ccc([As+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1	{14: 20}
Did not match all atoms present	15914-23-5	CC1=C(C2=C(C=C1)C3=C(C=C2)C4=CC=CC=C4C=C3)C	{1: 2, 14: 10}
Did not match all atoms present	15918-62-4	COC1=CC2=C3C(=C(C=C2C(=C1)OC)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)O	{1: 2, 38: 1, 11: 1, 14: 4, 22: 2, 23: 2, 27: 1}
Did not match all atoms present	1592-00-3	C1=CC=C(C(=C1)N=C=O)Br	{8: 1, 18: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	1592-20-7	C=CC1=CC=C(C=C1)CCl	{17: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	1592-23-0	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	1592-31-0	C1=CC(=CC=C1C(Br)Br)C(Br)Br	{18: 4, 3: 2, 14: 4}
Did not match all atoms present	1592-38-7	C1=CC=C2C=C(C=CC2=C1)CO	{2: 1, 20: 1, 14: 7}
Did not match all atoms present	1592-49-0	C1=CC=C(C=C1)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O	{25: 2, 14: 13, 33: 1}
Did not match all atoms present	15921-15-0	CCCC[O-].CCCC[O-].[Mg+2]	{1: 2, 2: 6, 29: 2}
Did not match all atoms present	15921-42-3	[Be+2].CC[CH2-].CC[CH2-]	{1: 2, 2: 2, 5: 2}
Did not match all atoms present	159212-35-8	C1=CC=C(C=C1)CCN/C=C/2\C3=CC=CC=C3NC2=O	{32: 1, 2: 2, 6: 1, 14: 9, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	15922-78-8	On1ccccc1=S.[H].[Na]	{33: 1, 21: 1, 14: 4}
Did not match all atoms present	15923-42-9	C[NH+]1C2=C(CCNCC2)C3=CC=CC=C31.[Cl-]	{32: 1, 1: 1, 11: 4, 14: 4, 15: 2, 17: 1}
Did not match all atoms present	15923-57-6	CCCCOP(=O)(OCCCC)OCC1C(C(C(O1)N2C=NC3=C2NC=NC3=O)O)O	{32: 1, 1: 2, 2: 7, 35: 2, 33: 1, 12: 4, 14: 2, 20: 2, 22: 3, 23: 1, 25: 1, 29: 1}
Did not match all atoms present	15924-07-9	P1=PP=PP=P1	{}
Did not match all atoms present	159277-20-0	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)CCCCCCC6=CC=C(C=C6)N(CCCl)CCCl.Cl.Cl.Cl	{32: 2, 1: 1, 2: 10, 35: 2, 33: 3, 11: 4, 14: 10, 17: 5}
Did not match all atoms present	15930-53-7	C1OC2=C(O1)C=C(C(=C2)C=O)Br	{18: 1, 11: 1, 26: 1, 14: 2, 23: 2}
Did not match all atoms present	15930-75-3	N#S(F)(F)F	{16: 3}
Did not match all atoms present	15930-94-6	O.O.[O-][Cr](=O)(=O)[O-].[Zn].[Zn+2]	{29: 4}
Did not match all atoms present	15933-59-2	C[Si](C)N[Si](C)C	{1: 4, 31: 1}
Did not match all atoms present	15934-01-7	C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.N.N.N	{33: 2, 2: 6, 27: 4}
Did not match all atoms present	159394-71-5	C1=CC(=CC(=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-])C#N	{38: 1, 14: 8, 6: 2, 37: 1}
Did not match all atoms present	159394-73-7	C1=CC(=CC=C1/C=C\C2=CC=C(C=C2)[N+](=O)[O-])C#N	{38: 1, 14: 8, 6: 2, 37: 1}
Did not match all atoms present	1594-56-5	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SC#N	{40: 1, 38: 2, 37: 1, 14: 3}
Did not match all atoms present	15941-77-2	C(#N)[S]	{37: 1}
Did not match all atoms present	15942-48-0	CCC(C)(C)C1=CC(=C(C=C1)Cl)OC(=O)NC	{1: 4, 2: 1, 4: 1, 14: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	15945-07-0	C1=C(C(=CC(=C1Cl)Cl)Cl)S(=O)(=O)Cl	{17: 4, 29: 2, 14: 2}
Did not match all atoms present	159453-24-4	C1=CC=C(C=C1)COC(=O)N[C@@H](CSC2=CC=CC=C2)C(=O)O	{2: 2, 3: 1, 40: 1, 14: 10, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	159479-99-9	C=CC(=O)O.C(CO)N(CCO)CCO.OS(=O)[O-].[Na+]	{33: 1, 2: 6, 5: 1, 6: 1, 20: 4, 27: 1, 29: 2}
Did not match all atoms present	15948-68-2	F[La]F	{16: 2}
Did not match all atoms present	1595-01-3	CCCCCCC1=CC=C(C=C1)C	{1: 2, 2: 5, 14: 4}
Did not match all atoms present	1595-05-7	CCCCC1=CC=C(C=C1)C	{1: 2, 2: 3, 14: 4}
Did not match all atoms present	1595-06-8	CCC(C)C1=CC=CC=C1C	{1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	1595-07-9	CCCCCC1=CC=CC=C1C	{1: 2, 2: 4, 14: 4}
Did not match all atoms present	1595-09-1	CCCCCC1=CC=C(C=C1)C	{1: 2, 2: 4, 14: 4}
Did not match all atoms present	1595-11-5	CCCCC1=CC=CC=C1C	{1: 2, 2: 3, 14: 4}
Did not match all atoms present	1595-16-0	CCC(C)C1=CC=C(C=C1)C	{1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	15950-66-0	C1=CC(=C(C(=C1O)Cl)Cl)Cl	{17: 3, 21: 1, 14: 2}
Did not match all atoms present	15951-41-4	C[Si](C)(C)C([Si](C)(C)C)(Cl)Cl	{1: 6, 4: 1, 17: 2}
Did not match all atoms present	15952-61-1	C1OC2=C(O1)C=C(C(=C2)C=O)Cl	{17: 1, 26: 1, 11: 1, 14: 2, 23: 2}
Did not match all atoms present	15953-45-4	CC1=CC(=NN1)Cl	{32: 1, 1: 1, 35: 1, 14: 1, 17: 1}
Did not match all atoms present	15953-73-8	CC1=C(C(=NN1)C)Cl	{32: 1, 1: 2, 35: 1, 17: 1}
Did not match all atoms present	15954-91-3	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Cd+2]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	15954-94-6	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Pb+2]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	15954-98-0	[H+].[H+].C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Zn+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	159574-72-8	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC4=C(C=C3)C(=O)C(=NNC5=CC(=CC(=C5O)[N+](=O)[O-])S(=O)(=O)[O-])C(=C4)S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC4=C(C=C3)C(=O)C(=NNC5=CC(=CC(=C5O)[N+](=O)[O-])S(=O)(=O)[O-])C(=C4)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Cr+3]	{34: 4, 38: 2, 14: 24, 15: 6, 21: 2, 25: 4, 29: 12, 31: 4}
Did not match all atoms present	15959-61-2	CCCCC[N+](CCCCC)(CCCCC)CCCCC	{1: 4, 2: 16}
Did not match all atoms present	1596-09-4	CC1=CC(=C(C=C1)O)C2CCCCC2	{1: 1, 11: 5, 12: 1, 21: 1, 14: 3}
Did not match all atoms present	1596-52-7	C1=CC2=[N+](C=CC(=C2C=C1[N+](=O)[O-])[N+](=O)[O-])[O-]	{33: 1, 38: 2, 29: 1, 14: 5}
Did not match all atoms present	15960-05-1	C([C@@H](C(=O)[O-])[NH3+])C(F)(F)F	{16: 3, 24: 1, 2: 1, 3: 1, 4: 1}
Did not match all atoms present	15961-23-6	C(C[Ge](Cl)(Cl)Cl)C(=O)O	{17: 3, 2: 2, 27: 1}
Did not match all atoms present	159610-82-9	C1=CC=C(C=C1)/C=C/CC(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 2, 3: 1, 6: 2, 12: 1, 14: 13, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	159611-02-6	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=CO4)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 11, 23: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	15964-31-5	CC\1=C(NC(=C(/C1=C\2/C=CC(=C(C2=O)OC)OC)N)C3=NC4=C(C=C3)C(=O)C(=C5C4=NC(N5)(C)C)OC)C(=O)O	{32: 2, 1: 6, 35: 2, 13: 1, 14: 4, 15: 11, 22: 3, 25: 2, 27: 1, 30: 1}
Did not match all atoms present	15964-79-1	COC1=C(C=C(C=C1)CC(=O)OC)OC	{1: 3, 2: 1, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	15964-80-4	COC1=C(C=CC(=C1)CC(=O)OC)O	{1: 2, 2: 1, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	15964-99-5	N1=P(N=P(N=P1(Cl)Br)(Cl)Br)(Cl)Cl	{17: 4, 18: 2, 35: 3}
Did not match all atoms present	15965-00-1	N1=P(N=P(N=P1(Cl)Br)(Br)Br)(Cl)Br	{17: 2, 18: 4, 35: 3}
Did not match all atoms present	15965-30-7	C1=NC(=C(N1)Cl)Cl	{32: 1, 17: 2, 35: 1, 14: 1}
Did not match all atoms present	15965-31-8	C1=C(NC=N1)Cl	{32: 1, 17: 1, 35: 1, 14: 2}
Did not match all atoms present	15965-33-0	CC1=NC(=C(N1)Cl)Cl	{32: 1, 1: 1, 35: 1, 17: 2}
Did not match all atoms present	15965-54-5	COC1=CC2=C(C=C1)N=C(N2)Cl	{32: 1, 1: 1, 35: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	159660-85-2	COC(=O)C1=C(CCN(C1)CC2=CC=CC=C2)N	{1: 1, 2: 1, 33: 1, 11: 3, 14: 5, 15: 2, 28: 1, 30: 1}
Did not match all atoms present	15968-02-2	CC(C)(C)C1=CC(=CC(=C1)C(=O)[O-])C(=O)[O-].[K+].[K+]	{24: 2, 1: 3, 4: 1, 14: 3}
Did not match all atoms present	15968-05-5	C1=CC(=C(C(=C1)Cl)C2=C(C=CC=C2Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	159689-88-0	C1=CC(=CC(=C1)OC(F)(F)F)CBr	{2: 1, 4: 1, 14: 4, 16: 3, 18: 1, 22: 1}
Did not match all atoms present	15969-58-1	[Ti+2]	{}
Did not match all atoms present	15971-29-6	COC1=CC=C(C2=CC=CC=C21)C=O	{1: 1, 26: 1, 22: 1, 14: 6}
Did not match all atoms present	15971-88-7	C1CCCCCC(CCCCC1)C2=CC=CC=C2	{11: 11, 12: 1, 14: 5}
Did not match all atoms present	15972-60-8	CCC1=C(C(=CC=C1)CC)N(COC)C(=O)CCl	{1: 3, 2: 4, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	15973-59-8	C(C(=O)[O-])I.[K+]	{24: 1, 2: 1, 19: 1}
Did not match all atoms present	15974-14-8	N.N.N.N.[Pd+2]	{}
Did not match all atoms present	15975-93-6	CC(=[Cr])[O-].C[N+](C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]	{1: 5, 29: 5, 7: 1}
Did not match all atoms present	15978-08-2	C(C(C(C(C(=O)COP(=O)(O)O)O)O)O)O	{2: 2, 3: 3, 20: 6, 22: 1, 24: 1, 29: 1}
Did not match all atoms present	15978-93-5	N.N.[I-].[I-].[Pt+2]	{19: 2}
Did not match all atoms present	15979-19-8	CCN1C2=CC=CC=C2SC1=CC3=CC(=CC=CC4=CC(=CC5=[N+](C6=CC=CC=C6S5)CC)CC(C4)(C)C)CC(C3)(C)C.[I-]	{1: 6, 2: 2, 6: 5, 33: 2, 41: 2, 11: 4, 13: 2, 14: 10, 15: 5, 19: 1}
Did not match all atoms present	15986-80-8	CCCC1=NC=CN=C1C	{1: 2, 2: 2, 35: 2, 14: 2}
Did not match all atoms present	15986-81-9	CC1=NC=CN=C1C(C)C	{1: 3, 3: 1, 14: 2, 35: 2}
Did not match all atoms present	15987-00-5	CCCCC1=NC=CN=C1C	{1: 2, 2: 3, 35: 2, 14: 2}
Did not match all atoms present	15988-11-1	C1=CC=C(C=C1)N2C(=O)NNC2=O	{32: 2, 25: 2, 14: 5, 33: 1}
Did not match all atoms present	15990-66-6	C[Si](C)(C)O.C[Si](C)(C)O.C[Si](C)(C)O.C[Si](C)(C)O.[Ti]	{1: 12, 20: 4}
Did not match all atoms present	15995-72-9	CC(CC1=CC(=C(C=C1OC)OC)OC)N	{1: 4, 2: 1, 3: 1, 14: 2, 22: 3, 30: 1}
Did not match all atoms present	15997-44-1	C1CCC2=C(C1)C(=CC(=[O+]2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O	{17: 1, 11: 4, 29: 4, 14: 11, 23: 1}
Did not match all atoms present	15999-06-1	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O)OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)O)S(=O)(=O)O)OC	{1: 4, 34: 4, 14: 14, 20: 4, 22: 2, 24: 1, 29: 8, 31: 2}
Did not match all atoms present	1600-27-7	CC(=O)[O-].CC(=O)[O-].[Hg+2]	{24: 2, 1: 2}
Did not match all atoms present	1600-31-3	C1=C(C=C(C(=C1[N+](=O)[O-])N=[N+]=[N-])[N+](=O)[O-])[N+](=O)[O-]	{34: 2, 38: 3, 14: 2}
Did not match all atoms present	1600-44-8	C1CCS(=O)C1	{11: 4, 29: 1}
Did not match all atoms present	16000-39-8	COC1=C(C2=CC=CC=C2C=C1)C#N	{1: 1, 22: 1, 14: 6, 37: 1}
Did not match all atoms present	16001-93-7	COP(=O)(CP(=O)(OC)OC)OC	{1: 4, 2: 1, 29: 2, 22: 4}
Did not match all atoms present	16002-48-5	C1CO1.O	{11: 2, 23: 1}
Did not match all atoms present	16002-93-0	CCCC=CC1=CC=CC=C1	{1: 1, 2: 2, 14: 5, 6: 2}
Did not match all atoms present	16003-16-0	COC(=O)CSC1=CC=CO1	{1: 1, 2: 1, 40: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	16003-66-0	C1=CC=C(C=C1)S(=O)(=O)C(Br)Br	{18: 2, 3: 1, 29: 2, 14: 5}
Did not match all atoms present	16004-15-2	C1=CC(=CC=C1CBr)I	{2: 1, 19: 1, 18: 1, 14: 4}
Did not match all atoms present	16006-62-5	CCC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)CO)O)O	{1: 1, 2: 2, 35: 3, 33: 1, 12: 4, 14: 2, 20: 3, 23: 1}
Did not match all atoms present	16008-36-9	CC1=CC[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3C	{1: 2, 33: 1, 11: 4, 12: 3, 13: 1, 14: 3, 15: 1, 21: 1, 23: 1}
Did not match all atoms present	16009-13-5	CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1[N-]2)C=C)C)C=C)C)C)CCC(=O)O)CCC(=O)O.[Fe+3]	{1: 4, 2: 4, 35: 4, 5: 2, 6: 2, 14: 4, 27: 2}
Did not match all atoms present	16009-86-2	C/C(=C/C(=O)C)/O[Sn]O/C(=C\C(=O)C)/C	{24: 2, 1: 4, 22: 2, 6: 2, 7: 2}
Did not match all atoms present	1601-71-4	CCCCC1=C(C=CC(=C1)C)C	{1: 3, 2: 3, 14: 3}
Did not match all atoms present	1601-98-5	C1=CC(=CC=C1N=NC2=CC=C(C=C2)Br)Br	{18: 2, 34: 2, 14: 8}
Did not match all atoms present	16013-44-8	CC1=CC(=C(C=C1Cl)NN=C2C3=CC=CC=C3C=C(C2=O)C(=O)O)S(=O)(=O)O	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 20: 1, 25: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	16013-85-7	C1=CC(=NC(=C1[N+](=O)[O-])Cl)Cl	{17: 2, 35: 1, 38: 1, 14: 2}
Did not match all atoms present	16014-23-6	CC1=CC(=C(C=C1)NN=C2C3=CC=CC=C3C=C(C2=O)C(=O)O)S(=O)(=O)O	{1: 1, 34: 1, 14: 8, 15: 2, 20: 1, 25: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	16015-71-7	COC1=CC=CC(=C1)N2CCNCC2	{32: 1, 1: 1, 33: 1, 11: 4, 14: 4, 22: 1}
Did not match all atoms present	16017-30-4	CC1=CC(=C(C=C1)C#C)C	{1: 2, 10: 1, 14: 3, 9: 1}
Did not match all atoms present	16018-21-6	CC(CC1=CC=CC=C1)N2CCN(CC2)C3=CC=CC=C3.Cl.Cl	{1: 1, 2: 1, 3: 1, 33: 2, 11: 4, 14: 10, 17: 2}
Did not match all atoms present	16019-31-1	C=CCC1=C(N=CN=C1Cl)Cl	{2: 1, 35: 2, 5: 1, 6: 1, 14: 1, 17: 2}
Did not match all atoms present	16020-17-0	CC1=CC2=C(C=C1)C(=CC(=C2C)C)C	{1: 4, 14: 4}
Did not match all atoms present	16021-20-8	CCCC1=CC=CC=C1CC	{1: 2, 2: 3, 14: 4}
Did not match all atoms present	16024-82-1	COC(=O)C1=CC=CC=C1N=C=S	{8: 1, 1: 1, 34: 1, 28: 1, 14: 4}
Did not match all atoms present	16026-16-7	CCCCCCCCC=CCCCCCCCC(=O)N(C)CC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)N(C)CC(=O)[O-].[Ca+2]	{24: 4, 1: 4, 2: 30, 6: 4, 33: 2}
Did not match all atoms present	16029-98-4	C[Si](C)(C)I	{1: 3, 19: 1}
Did not match all atoms present	1603-40-3	CC1=C(N=CC=C1)N	{1: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	1603-41-4	CC1=CN=C(C=C1)N	{1: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	1603-79-8	CCOC(=O)C(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	1603-84-5	C(=O)=[Se]	{8: 1, 29: 1}
Did not match all atoms present	1603-91-4	CC1=CSC(=N1)N	{1: 1, 35: 1, 30: 1, 14: 1, 41: 1}
Did not match all atoms present	16032-41-0	CN(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2	{1: 2, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	16032-52-3	N1=P(N=P(N=P1(Cl)Br)(Cl)Br)(Cl)Br	{17: 3, 18: 3, 35: 3}
Did not match all atoms present	16033-21-9	CN=NNC1=CC=CC=C1	{1: 1, 34: 2, 14: 5, 31: 1}
Did not match all atoms present	16034-25-6	CCN(CC)C1=NC(=S)NC(=S)N1	{32: 2, 1: 2, 2: 2, 35: 1, 33: 1}
Did not match all atoms present	16034-77-8	CC(CN(C1=C(C=C(C(=C1I)N)I)I)C(=O)C)C(=O)O	{1: 2, 2: 1, 3: 1, 33: 1, 14: 1, 19: 3, 24: 1, 27: 1, 30: 1}
Did not match all atoms present	16034-99-4	COC1=CC=C(C=C1)/C=C/CBr	{1: 1, 2: 1, 6: 2, 14: 4, 18: 1, 22: 1}
Did not match all atoms present	16037-91-5	C([C@H]([C@@H]1[C@@H]([C@@H](O[Sb](=O)(O1)O[Sb]2(=O)O[C@@H]([C@@H]([C@@H](O2)C(=O)[O-])O)[C@@H](CO)O)C(=O)[O-])O)O)O.O.O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+]	{2: 2, 3: 2, 12: 6, 20: 6, 22: 1, 23: 4, 24: 2, 29: 2}
Did not match all atoms present	160370-04-7	CC1=[N+](C=CN1C(=O)N(C)C)C(=O)N(C)C.[Cl-]	{24: 2, 1: 5, 33: 4, 14: 2, 17: 1}
Did not match all atoms present	16038-76-9	OP(O)O.[Pb]	{20: 3}
Did not match all atoms present	16039-53-5	CC(C(=O)O)O.CC(C(=O)O)O.[Zn]	{27: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	16039-54-6	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Co+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	16039-55-7	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Cd+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	16040-69-0	C1=CC2=C(C=C1Cl)C3=NC4=NC(=NC5=C6C=CC(=CC6=C([N-]5)N=C7C8=C(C=C(C=C8)Cl)C(=N7)N=C2[N-]3)Cl)C9=C4C=CC(=C9)Cl.[Cu+2]	{17: 4, 35: 8, 14: 12}
Did not match all atoms present	16041-14-8	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Cd+2]	{}
Did not match all atoms present	16043-45-1	[Ti+4]	{}
Did not match all atoms present	160434-49-1	C1=CC(=C(C=C1C=CC(=O)O)Br)F	{16: 1, 18: 1, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	16045-17-3	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Th+4]	{17: 4, 29: 16}
Did not match all atoms present	16045-78-6	C[Si](C=C)(C=C)O[Si](C)(C=C)C=C	{1: 2, 22: 1, 5: 4, 6: 4}
Did not match all atoms present	16046-10-9	CC(=O)OCC[Si](C)(C)C	{1: 4, 2: 2, 28: 1}
Did not match all atoms present	16047-24-8	CC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N	{1: 1, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	16048-40-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)[N+]#N	{25: 2, 34: 1, 14: 7}
Did not match all atoms present	16048-57-0	C1=CC(=S)N(C=C1)[O-].C1=CC(=S)N(C=C1)[O-].[Cd+2]	{33: 2, 29: 2, 14: 8}
Did not match all atoms present	1605-18-1	CC(=C)C1=CC=C(C=C1)C(=C)C	{1: 2, 5: 2, 14: 4, 7: 2}
Did not match all atoms present	1605-53-4	CCP(CC)C1=CC=CC=C1	{1: 2, 2: 2, 14: 5}
Did not match all atoms present	1605-54-5	CP(C(F)(F)F)C(F)(F)F	{16: 6, 1: 1, 4: 2}
Did not match all atoms present	1605-65-8	CN(C)P(=O)(N(C)C)Cl	{1: 4, 33: 2, 29: 1, 17: 1}
Did not match all atoms present	1605-72-7	[C](Cl)Cl	{17: 2}
Did not match all atoms present	16050-72-9	[PH2-]	{}
Did not match all atoms present	16051-48-2	C(CO[N+](=O)[O-])O	{2: 2, 20: 1, 22: 1}
Did not match all atoms present	16051-77-7	C1[C@@H]([C@@H]2[C@H](O1)[C@@H](CO2)O[N+](=O)[O-])O	{20: 1, 11: 2, 12: 4, 22: 1, 23: 2}
Did not match all atoms present	160516-13-2	CC1=C2C(=NC=N1)N(C=N2)CC3=CC=CC=C3	{1: 1, 2: 1, 35: 3, 14: 7, 33: 1}
Did not match all atoms present	16052-06-5	C1CN(CCN1CCCS(=O)(=O)O)CCO	{33: 2, 2: 5, 11: 4, 20: 2, 29: 2}
Did not match all atoms present	160520-73-0	CCCCC(C(CCCC)C(=O)O)C(=O)O.N	{27: 2, 1: 2, 2: 6, 3: 2}
Did not match all atoms present	16053-58-0	CS(=O)(=O)[O-]	{1: 1, 29: 3}
Did not match all atoms present	16053-71-7	CC1=C2C(C(C3=CC=CC=C3C2=CC4=CC=CC=C14)O)O	{1: 1, 12: 2, 14: 9, 20: 2}
Did not match all atoms present	16054-12-9	C[Si]1(CC=CC1)C	{1: 2, 11: 2, 14: 2}
Did not match all atoms present	16054-20-9	CC(C)(C=CC(C)(C)[Si](C)(C)C)[Si](C)(C)C	{1: 10, 4: 2, 6: 2}
Did not match all atoms present	16054-35-6	C[Si](C)(C)C/C=C/C[Si](C)(C)C	{1: 6, 2: 2, 6: 2}
Did not match all atoms present	16055-33-7	CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)C.[I-]	{1: 2, 2: 1, 6: 1, 33: 2, 41: 1, 14: 10, 15: 1, 19: 1}
Did not match all atoms present	16056-11-4	C[N+](C)(C)C1=CC=CC=C1.[Br-]	{1: 3, 18: 1, 14: 5}
Did not match all atoms present	16056-72-7	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[V].[V].[Cd+2].[Cd+2]	{}
Did not match all atoms present	16056-95-4	O.O.[Cl-].[Cl-].[Sr+2]	{17: 2}
Did not match all atoms present	16057-15-1	[O-]S(=O)(=O)OS(=O)(=O)[O-]	{29: 6, 22: 1}
Did not match all atoms present	16059-99-7	C1(C(C(C(C(C1OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Mg+2].[Ca+2]	{12: 6, 29: 18, 22: 6}
Did not match all atoms present	1606-67-3	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)N	{30: 1, 14: 9}
Did not match all atoms present	16060-83-6	Cl[Zn+]	{17: 1}
Did not match all atoms present	16064-14-5	C1=CC2=C(C=C1Cl)C(=O)N=CN2	{32: 1, 17: 1, 35: 1, 14: 4, 25: 1}
Did not match all atoms present	16065-83-1	[Cr+3]	{}
Did not match all atoms present	16065-88-6	[Pd+2]	{}
Did not match all atoms present	16065-89-7	[Rh+3]	{}
Did not match all atoms present	16065-90-0	[Ce+4]	{}
Did not match all atoms present	16065-91-1	[Au+3]	{}
Did not match all atoms present	16065-92-2	[Th+4]	{}
Did not match all atoms present	16066-35-6	CC(C)C1=CC=C(C=C1)S(=O)(=O)O	{1: 2, 3: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	16066-38-9	CCCOC(=O)OOC(=O)OCCC	{1: 2, 2: 4}
Did not match all atoms present	16068-37-4	CCO[Si](CC[Si](OCC)(OCC)OCC)(OCC)OCC	{1: 6, 2: 8, 22: 6}
Did not match all atoms present	1607-00-7	C(C(CO)(CO)CO[N+](=O)[O-])O	{20: 3, 2: 4, 4: 1, 22: 1}
Did not match all atoms present	1607-17-6	C(C(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-])O	{20: 1, 2: 4, 4: 1, 22: 3}
Did not match all atoms present	1607-57-4	C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Br)C3=CC=CC=C3	{18: 1, 14: 15, 7: 2}
Did not match all atoms present	16071-80-0	[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)[O-])N=NC2=C(C=C3C(=C2[O-])C=CC(=C3S(=O)(=O)[O-])NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])[O-].[Cu+2]	{34: 2, 35: 3, 14: 6, 17: 2, 29: 9, 31: 1}
Did not match all atoms present	16071-86-6	C1=CC(=CC=C1C2=CC=C(C=C2)N=NC3=CC(=C(C=C3)[O-])C(=O)[O-])NN=C4C(=O)C=CC(=NNC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])C4=O.[Na+].[Na+].[Cu+2]	{34: 4, 14: 16, 24: 1, 25: 2, 29: 3, 31: 2}
Did not match all atoms present	160727-68-4	CCOC(=O)C(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31	{24: 1, 1: 1, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	16078-34-5	CC(=O)C1=CC2=C(C=C1)NCC2	{24: 1, 1: 1, 11: 2, 14: 3, 32: 1}
Did not match all atoms present	16078-71-0	CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)N	{1: 1, 2: 1, 35: 1, 33: 1, 14: 6, 28: 1, 30: 1}
Did not match all atoms present	160788-98-7	CC(C)(C)C1=CC=C(C=C1)O.C1=CC=C(C=C1)S(=O)(=O)O	{1: 3, 4: 1, 14: 9, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	1608-26-0	CN(C)P(N(C)C)N(C)C	{1: 6, 33: 3}
Did not match all atoms present	1608-36-2	COC(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	160828-79-5	C1=CC=C(C(=C1)C(=O)[O-])NN=C2C3=C(C=C(C=C3)S(=O)(=O)[O-])C=C(C2=O)S(=O)(=O)[O-].[Na+].[Al+3]	{34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	160828-81-9	CC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)N(C)C)C3=C(C=CC(=C3)S(=O)(=O)O)Cl.C1=CC=NC=C1	{1: 3, 35: 2, 6: 1, 33: 2, 14: 12, 15: 2, 17: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	160828-82-0	CCN\1C2=C(C=CC(=C2)S(=O)(=O)O)O/C1=C/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)O)C.CCN(CC)CC	{1: 5, 2: 4, 35: 1, 6: 2, 33: 3, 14: 7, 15: 3, 20: 2, 23: 1, 25: 1, 29: 4}
Did not match all atoms present	16083-20-8	CCCC[N+](CCCC)(CCCC)CCCC.C=CC(=O)[O-]	{24: 1, 1: 4, 2: 12, 5: 1, 6: 1}
Did not match all atoms present	16085-50-0	CC1NC(=S)N2N1C(=S)NC2C	{32: 2, 1: 2, 12: 2, 33: 2, 15: 2}
Did not match all atoms present	16087-24-4	CN(C)C1=CC=C(C=C1)[Si](C)(C)C	{1: 5, 14: 4, 33: 1}
Did not match all atoms present	16087-30-2	CC(=NCCN=C(C)CC(=O)C1=CC=CC=C1)CC(=O)C2=CC=CC=C2	{1: 2, 2: 4, 7: 2, 34: 2, 14: 10, 24: 2}
Did not match all atoms present	16087-65-3	F[Er]F	{16: 2}
Did not match all atoms present	16088-56-5	C(CO)NC1=C(C(=C(C(=C1Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)NCCO)Cl)Cl)Cl)Cl	{17: 8, 2: 4, 20: 2, 31: 2}
Did not match all atoms present	16088-84-9	CCCCCCCCCCN(CCCCCCCCCC)C1=CC=CC=C1	{1: 2, 2: 18, 14: 5, 33: 1}
Did not match all atoms present	16089-42-2	COC1=C(C=CC(=C1)N)N2CCCC2	{1: 1, 33: 1, 11: 4, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	16089-43-3	CC1=C(C=CC(=C1)N)N2CCCC2	{1: 1, 11: 4, 30: 1, 14: 3, 33: 1}
Did not match all atoms present	16089-48-8	C1=CC=C(C=C1)/C=C/C(=O)[O-].[K+]	{24: 1, 14: 5, 6: 2}
Did not match all atoms present	16089-60-4	[U+4]	{}
Did not match all atoms present	16089-66-0	C[N+](=CC1=CC=C(C=C1)OC)[O-]	{1: 2, 6: 1, 33: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	16089-70-6	C/[N+](=C\C1=CC=C(C=C1)C#N)/[O-]	{1: 1, 37: 1, 6: 1, 33: 1, 14: 4, 29: 1}
Did not match all atoms present	1609-19-4	CC[Si](CC)Cl	{1: 2, 2: 2, 17: 1}
Did not match all atoms present	1609-47-8	CCOC(=O)OC(=O)OCC	{1: 2, 2: 2}
Did not match all atoms present	16090-02-1	C1COCCN1C2=NC(=NC(=N2)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)N7CCOCC7)S(=O)(=O)[O-])S(=O)(=O)[O-])NC8=CC=CC=C8.[Na+].[Na+]	{33: 2, 35: 6, 6: 2, 11: 8, 14: 16, 23: 2, 29: 6, 31: 4}
Did not match all atoms present	16090-14-5	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(F)(F)S(=O)(=O)F)(F)F)F)(F)F)F	{16: 14, 4: 5, 29: 2, 22: 2, 7: 2}
Did not match all atoms present	16090-49-6	C[Ge](=S)C	{1: 2}
Did not match all atoms present	16091-18-2	CCCCCCCC[Sn]1(OC(=O)C=CC(=O)O1)CCCCCCCC	{1: 2, 2: 14, 28: 2, 14: 2}
Did not match all atoms present	16091-26-2	C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N	{24: 1, 30: 1, 14: 9, 31: 1}
Did not match all atoms present	16093-66-6	C[N+](C)(C)C1=CC=CC=C1.C1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 29: 3, 14: 10}
Did not match all atoms present	16094-31-8	CC(C)(C)C1=CC(=C(C=C1)O)C(=O)O	{1: 3, 27: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	16094-57-8	CC(CC1=C(C=CC(=C1)OC)OC)N.Cl	{1: 3, 2: 1, 3: 1, 14: 3, 17: 1, 22: 2, 30: 1}
Did not match all atoms present	16096-32-5	CC1=C2C=CNC2=CC=C1	{32: 1, 1: 1, 14: 5}
Did not match all atoms present	16096-89-2	[La+3]	{}
Did not match all atoms present	16099-54-0	CCCCCCCCCCCCCCCCCC(=O)NC1=CC=C(C=C1)NC(=O)CCCCCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 32, 14: 4, 31: 2}
Did not match all atoms present	1610-17-9	CCNC1=NC(=NC(=N1)OC)NC(C)C	{1: 4, 2: 1, 3: 1, 35: 3, 22: 1, 31: 2}
Did not match all atoms present	1610-18-0	CC(C)NC1=NC(=NC(=N1)OC)NC(C)C	{1: 5, 3: 2, 35: 3, 22: 1, 31: 2}
Did not match all atoms present	1610-22-6	C1CCC2C(C1)CCC3=C2C=CC4=C3CCCC4	{11: 10, 12: 2, 14: 2}
Did not match all atoms present	1610-39-5	C1CCC2=C3CCCCC3=C4CCCCC4=C2C1	{11: 12}
Did not match all atoms present	1610-51-1	C1CC2=CC3=C(CC3)C=C21	{11: 4, 14: 2}
Did not match all atoms present	161024-80-2	CC(C)(C)OC(=O)N[C@H](CC(=O)O)C1=CC=CC=C1	{1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	161050-58-4	CC1=CC(=CC(=C1)C(=O)N(C(C)(C)C)NC(=O)C2=C(C(=CC=C2)OC)C)C	{1: 7, 4: 1, 33: 1, 14: 6, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	16106-20-0	C1[C@H]([C@@H]2[C@H](O1)[C@H](CO2)O[N+](=O)[O-])O	{20: 1, 11: 2, 12: 4, 22: 1, 23: 2}
Did not match all atoms present	16108-48-8	CCOC(=O)C1=C(C=C(NC1=O)C)C	{32: 1, 1: 3, 2: 1, 14: 1, 25: 1, 28: 1}
Did not match all atoms present	16108-50-2	CC1=CC(=C(C(=C1)O)C(=O)C)C	{24: 1, 1: 3, 21: 1, 14: 2}
Did not match all atoms present	16109-37-8	C/C(=C(/C)\C[Si](C)(C)C)/C[Si](C)(C)C	{1: 8, 2: 2, 7: 2}
Did not match all atoms present	16109-68-5	C1=CC=C(C=C1)[N+](=NC2=CC=C(C=C2)Br)[O-]	{33: 1, 18: 1, 34: 1, 29: 1, 14: 9}
Did not match all atoms present	1611-31-0	CC(C)OP(=O)(O)OC(C)C	{1: 4, 3: 2, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	1611-83-2	CC(=C)C(=O)NC1=CC=CC=C1	{1: 1, 5: 1, 7: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	1611-92-3	CC1=CC(=CC(=C1)Br)Br	{1: 1, 18: 2, 14: 3}
Did not match all atoms present	16110-09-1	C1=CC(=NC=C1Cl)Cl	{17: 2, 35: 1, 14: 3}
Did not match all atoms present	16110-13-7	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)CO	{2: 1, 20: 1, 14: 11}
Did not match all atoms present	16110-89-7	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)Cl)S(=O)(=O)O	{35: 3, 14: 4, 17: 2, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	16110-98-8	C1=CC=C(C=C1)C(=CC(=O)O)C(=O)O	{27: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	16111-62-9	CCCCC(CC)COC(=O)OOC(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2}
Did not match all atoms present	16112-55-3	C1=CC=C(C=C1)NCC(COC2=CC=CC=C2)O	{2: 2, 3: 1, 14: 10, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	16118-22-2	C1=CC=C(C=C1)C=N	{36: 1, 14: 5, 6: 1}
Did not match all atoms present	16118-49-3	CCNC(=O)C(C)OC(=O)NC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	1612-03-9	CC(C)C#CC1=CC=CC=C1	{1: 2, 10: 2, 3: 1, 14: 5}
Did not match all atoms present	1612-64-2	CN(C)C1=CC=C(C=C1)C=CC2=NC3=CC=CC=C3C=C2	{1: 2, 35: 1, 14: 10, 6: 2, 33: 1}
Did not match all atoms present	1612-65-3	CN1CCC2=CC=CC=C2C1	{1: 1, 11: 3, 14: 4, 33: 1}
Did not match all atoms present	16128-42-0	CCCC[Pb](CCCC)(CCCC)N1C=CN=C1	{1: 3, 2: 9, 35: 1, 14: 3, 33: 1}
Did not match all atoms present	1613-17-8	CCCCCCCCCCCCCCCCCC[NH+](C)C.[Cl-]	{1: 3, 2: 17, 17: 1}
Did not match all atoms present	1613-32-7	CCCC1=NC2=CC=CC=C2C=C1	{1: 1, 2: 2, 35: 1, 14: 6}
Did not match all atoms present	1613-34-9	CCC1=NC2=CC=CC=C2C=C1	{1: 1, 2: 1, 35: 1, 14: 6}
Did not match all atoms present	1613-37-2	C1=CC=C2C(=C1)C=CC=[N+]2[O-]	{33: 1, 29: 1, 14: 7}
Did not match all atoms present	1613-66-7	C1=CC=C(C=C1)[Ge](C2=CC=CC=C2)(Cl)Cl	{17: 2, 14: 10}
Did not match all atoms present	16130-76-0	C1=CC(=CC=C1C(=O)[O-])C(=O)[O-].[Ca+2]	{24: 2, 14: 4}
Did not match all atoms present	16132-20-0	CC1=C(NC(=C1CCC(=O)OC)C)C(=O)OC	{32: 1, 1: 4, 2: 2, 28: 2}
Did not match all atoms present	161326-34-7	C[C@@]1(C(=O)N(C(=N1)SC)NC2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 35: 1, 33: 1, 40: 1, 13: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	161328-81-0	C[N+](=C1C=CC2=NC3=CC(=C(C=C3OC2=C1)N)OC)C.[Cl-]	{1: 3, 35: 1, 33: 1, 14: 5, 17: 1, 22: 1, 23: 1, 30: 1}
Did not match all atoms present	16133-26-9	C1=CC(=CN=C1)S	{35: 1, 14: 4, 39: 1}
Did not match all atoms present	16133-49-6	COC1=CC(=C(C=C1)[N+](=O)[O-])N	{1: 1, 30: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	16135-32-3	C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC=O	{17: 1, 26: 1, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	16136-32-6	C1=CC=C(C=C1)C(C2=CC=CC=C2)OCCN=C(N)N	{2: 2, 3: 1, 7: 1, 34: 1, 14: 10, 22: 1, 30: 2}
Did not match all atoms present	16136-58-6	CN1C2=CC=CC=C2C=C1C(=O)O	{1: 1, 27: 1, 14: 5, 33: 1}
Did not match all atoms present	161374-81-8	B(=O)[O-].[Na+]	{29: 2}
Did not match all atoms present	1614-12-6	C1=CC=C2C(=C1)N=NN2N	{33: 1, 35: 2, 30: 1, 14: 4}
Did not match all atoms present	16143-18-3	CC(C)(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)C=CC4=CC=C(C=C4)C5=CC=CC=C5	{1: 3, 35: 1, 4: 1, 6: 2, 14: 16, 23: 1}
Did not match all atoms present	16143-89-8	COC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C#N	{1: 1, 37: 1, 22: 1, 14: 14, 7: 2}
Did not match all atoms present	161436-13-1	COC1=C(C=C(C=C1)CC(=C)F)OC	{1: 2, 2: 1, 5: 1, 7: 1, 14: 3, 16: 1, 22: 2}
Did not match all atoms present	16144-91-5	C1CC2CC1C3=C(C=CC(=C23)O)O	{11: 3, 12: 2, 21: 2, 14: 2}
Did not match all atoms present	16144-94-8	COC(=O)C1=CC2=C(C=C1)C(=CC=C2)C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	16145-97-4	CC1=CC=C(C=C1)C(C)(C2CC2)O	{1: 2, 4: 1, 11: 2, 12: 1, 14: 4, 20: 1}
Did not match all atoms present	1615-02-7	C1=CC(=CC=C1/C=C/C(=O)O)Cl	{17: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	1615-15-2	CC1=NC=CN1CCO	{1: 1, 2: 2, 35: 1, 33: 1, 14: 2, 20: 1}
Did not match all atoms present	16152-65-1	CC1=CC(=C(C=C1)O)C2(CCCCC2)C	{1: 2, 11: 5, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	16153-13-2	B12CCCN1CCC2	{33: 1, 11: 6}
Did not match all atoms present	16154-78-2	CC1=CC2=C(C=C1)N3CCNC4C3=C2CCC4	{32: 1, 1: 1, 33: 1, 11: 5, 12: 1, 14: 3}
Did not match all atoms present	16155-94-5	CC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C	{1: 2, 35: 1, 14: 7, 23: 1}
Did not match all atoms present	161559-34-8	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCN(C)C3=CC=CC=C3	{1: 3, 2: 3, 35: 1, 33: 4, 14: 6, 25: 2}
Did not match all atoms present	16156-59-5	CS(=O)(=O)OC1=CC=CC=C1	{1: 1, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	161622-05-5	C1=C(C=C(C=C1C(F)(F)F)F)C(=O)O	{16: 4, 27: 1, 4: 1, 14: 3}
Did not match all atoms present	16165-68-7	CCCCCCCCCCP(=O)(OCC)OCC	{1: 3, 2: 11, 29: 1, 22: 2}
Did not match all atoms present	16166-89-5	[Be+2].[NH4+].[NH4+].[F-].[F-].[F-].[F-]	{16: 4}
Did not match all atoms present	16169-16-7	C1=CC(=CC=C1NO)[N+](=O)[O-]	{20: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	16169-17-8	C1=CC=C(C=C1)C2=CC=CC=C2NO	{20: 1, 14: 9, 31: 1}
Did not match all atoms present	161696-98-6	CC1=C(C=CC2=NC=CN=C12)NC	{1: 2, 35: 2, 14: 4, 31: 1}
Did not match all atoms present	161696-99-7	CC1=CN=C2C(=C(C=CC2=N1)NC)C	{1: 3, 35: 2, 14: 3, 31: 1}
Did not match all atoms present	161697-00-3	CC1=C(C=CC2=C1N=C(C(=N2)C)C)NC	{1: 4, 35: 2, 14: 2, 31: 1}
Did not match all atoms present	161697-01-4	CCC1=NC2=C(C(=C(C=C2)NC)C)N=C1CC	{1: 4, 2: 2, 35: 2, 14: 2, 31: 1}
Did not match all atoms present	161697-02-5	CC1=C(C=CC2=NC=C(N=C12)C3=CC=CC=C3)NC	{1: 2, 35: 2, 14: 8, 31: 1}
Did not match all atoms present	161697-03-6	CC1=C(C=CC2=C1N=C(C(=N2)C)C)N	{1: 3, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	161697-04-7	CC1=C(C=CC2=C1N=C(C(=N2)C)C)N(C)C	{1: 5, 35: 2, 14: 2, 33: 1}
Did not match all atoms present	1617-90-9	CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4[C@](C2)(C(=O)OC)O	{1: 2, 2: 1, 33: 2, 11: 6, 12: 1, 13: 2, 14: 4, 20: 1, 28: 1}
Did not match all atoms present	1617-99-8	COCCOCCNCC1COC2=CC=CC=C2O1	{1: 1, 2: 5, 11: 1, 12: 1, 14: 4, 22: 2, 23: 2, 31: 1}
Did not match all atoms present	16170-33-5	C1CCC(CC1)NS(=O)(=O)C2=NC3=CC=CC=C3S2	{35: 1, 41: 1, 11: 5, 12: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	161717-32-4	CCCCC1(COP(OC1)OC2=C(C=C(C=C2C(C)(C)C)C(C)(C)C)C(C)(C)C)CC	{1: 11, 2: 4, 4: 3, 11: 2, 13: 1, 14: 2, 22: 1, 23: 2}
Did not match all atoms present	16178-48-6	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)([O-])OP(=O)(O)[O-])O)O.[Na+].[Na+]	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 3, 22: 2, 23: 1, 29: 4, 30: 1}
Did not match all atoms present	16179-97-8	C1=CC=NC(=C1)CC(=O)O.Cl	{17: 1, 2: 1, 27: 1, 14: 4, 35: 1}
Did not match all atoms present	161793-17-5	C1=CC(=C(C(=C1C=O)F)F)F	{16: 3, 26: 1, 14: 2}
Did not match all atoms present	16180-10-2	CCCCCCC(=O)O.[Pb]	{1: 1, 2: 5, 27: 1}
Did not match all atoms present	16182-04-0	CCOC(=O)N=C=S	{8: 1, 1: 1, 2: 1, 28: 1, 34: 1}
Did not match all atoms present	16184-89-7	C1=CC(=CC=C1C(=O)C(F)(F)F)Br	{16: 3, 24: 1, 18: 1, 4: 1, 14: 4}
Did not match all atoms present	16185-96-9	CCC(=O)C1=CC=CC=C1C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	16188-37-7	C=C[Hg]Br	{18: 1, 5: 1, 6: 1}
Did not match all atoms present	16188-57-1	CC1=CC(=C(C=C1)O)I	{1: 1, 19: 1, 21: 1, 14: 3}
Did not match all atoms present	161908-09-4	CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4.CC(C)(C1=CC(=C(C(=C1)Br)O)Br)C2=CC(=C(C(=C2)Br)O)Br.C1=CC(=CC=C1N)S(=O)(=O)N	{1: 4, 2: 2, 4: 2, 11: 2, 12: 2, 14: 16, 18: 4, 21: 2, 22: 2, 23: 2, 29: 2, 30: 2}
Did not match all atoms present	16192-03-3	CC1=CC=C(C=C1)S(=O)(=O)C=C(C)C	{1: 3, 29: 2, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	16192-04-4	CC1=CC=C(C=C1)S(=O)(=O)CC(=C)C	{1: 2, 2: 1, 5: 1, 7: 1, 14: 4, 29: 2}
Did not match all atoms present	16192-08-8	CC1=CC=C(C=C1)S(=O)(=O)C=C=C	{1: 1, 5: 1, 6: 1, 8: 1, 14: 4, 29: 2}
Did not match all atoms present	16195-23-6	COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)N/N=C\3/C4=CC=CC=C4C=C(C3=O)C(=O)NC5=CC=CC=C5OC	{1: 2, 34: 1, 14: 17, 15: 2, 22: 2, 24: 2, 25: 1, 31: 3}
Did not match all atoms present	161957-55-7	C1=CC(=C(C(=C1)Cl)F)C(=O)O	{16: 1, 17: 1, 27: 1, 14: 3}
Did not match all atoms present	161970-71-4	C1C[C@@]2(N(C1=O)[C@H](CO2)C3=CC=CC=C3)C4=CC=CC=C4	{33: 1, 11: 3, 12: 1, 13: 1, 14: 10, 23: 1, 25: 1}
Did not match all atoms present	1620-21-9	CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl	{1: 1, 3: 1, 33: 2, 11: 4, 14: 9, 17: 2}
Did not match all atoms present	1620-64-0	CCOC(=O)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 7, 2: 1, 4: 2, 14: 2, 21: 1, 28: 1}
Did not match all atoms present	1620-68-4	CC1=CC(=C(C=C1)O)CC2=CC(=CC(=C2O)CC3=C(C=CC(=C3)C)O)C	{1: 3, 2: 2, 21: 3, 14: 8}
Did not match all atoms present	1620-75-3	CC1=CC=CC(=N1)C#N	{1: 1, 35: 1, 37: 1, 14: 3}
Did not match all atoms present	1620-93-5	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CSCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C	{1: 12, 2: 2, 4: 4, 40: 1, 14: 4, 21: 2}
Did not match all atoms present	1620-98-0	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=O	{1: 6, 26: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	16201-96-0	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N3C(=O)C=CC3=O	{25: 2, 34: 2, 14: 11, 33: 1}
Did not match all atoms present	16201-97-1	CC(=O)O[Si](OC(=O)C)(OC(=O)C)OC(=O)C	{1: 4, 28: 4}
Did not match all atoms present	16203-97-7	CC(=O)OC1=CC=CC2=CC3=C(C(=CC=C3)OC(=O)C)C(=C21)OC(=O)C	{1: 3, 28: 3, 14: 7}
Did not match all atoms present	16204-57-2	CC1=C(C2=C(C=C1)C(CC2)(C)C)C	{1: 4, 11: 2, 13: 1, 14: 2}
Did not match all atoms present	16205-84-8	CCOC(=O)C#C[Si](C)(C)C	{1: 4, 2: 1, 28: 1, 10: 2}
Did not match all atoms present	162050-09-1	C(C(=O)C1=C(C(=C(O1)[N+](=O)[O-])Cl)Cl)Br	{2: 1, 38: 1, 17: 2, 18: 1, 23: 1, 24: 1}
Did not match all atoms present	16206-19-2	C12=[N+](ON=C1N=C(N=C2N)N)[O-]	{33: 1, 35: 3, 30: 2, 23: 1}
Did not match all atoms present	16208-51-8	C(CS(=O)(=O)[O-])SSCCS(=O)(=O)[O-].[Na+].[Na+]	{40: 2, 2: 4, 29: 6}
Did not match all atoms present	162085-82-7	CCCCCCCOP(=O)(C)F	{16: 1, 1: 2, 2: 6, 29: 1, 22: 1}
Did not match all atoms present	162085-84-9	CCCCCOP(=O)(CC)F	{16: 1, 1: 2, 2: 5, 29: 1, 22: 1}
Did not match all atoms present	162085-85-0	CCCCCCCOP(=O)(CC)F	{16: 1, 1: 2, 2: 7, 29: 1, 22: 1}
Did not match all atoms present	162101-25-9	B(C1=C(C=CC=C1F)F)(O)O	{16: 2, 20: 2, 14: 3}
Did not match all atoms present	16212-05-8	C=CCS(=O)(=O)C1=CC=CC=C1	{2: 1, 14: 5, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	16212-06-9	C1=CC=C(C=C1)/C=C/S(=O)(=O)C2=CC=CC=C2	{14: 10, 6: 2, 29: 2}
Did not match all atoms present	16212-08-1	CC1=CC=C(C=C1)S(=O)(=O)/C=C/C2=CC=CC=C2	{1: 1, 14: 9, 6: 2, 29: 2}
Did not match all atoms present	16212-85-4	C1=CC=C(C=C1)C2=CC=C(SS2)C3=CC=CC=C3	{41: 2, 14: 12, 15: 2}
Did not match all atoms present	16213-85-7	CC1=CC(=C(C=C1)C)CC#N	{1: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	16214-27-0	C1C2=CC=CC=C2C(=O)C1=O	{25: 2, 11: 1, 14: 4}
Did not match all atoms present	16214-98-5	C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)O.[Cl-]	{17: 1, 2: 1, 27: 1, 14: 9, 33: 1}
Did not match all atoms present	16214-99-6	CC1=C[N+](=CC=C1)CC2=CC=CC=C2.[Cl-]	{1: 1, 2: 1, 33: 1, 14: 9, 17: 1}
Did not match all atoms present	16215-14-8	CS(=O)(=O)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	16215-49-9	CCCCOC(=O)OOC(=O)OCCCC	{1: 2, 2: 6}
Did not match all atoms present	16215-75-1	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC=CC=C3O)O	{24: 1, 21: 2, 14: 10, 31: 1}
Did not match all atoms present	16219-98-0	CN(C1=CC=CC=N1)N=O	{1: 1, 34: 1, 35: 1, 33: 1, 14: 4, 29: 1}
Did not match all atoms present	16219-99-1	CN(C1=CC=NC=C1)N=O	{1: 1, 34: 1, 35: 1, 33: 1, 14: 4, 29: 1}
Did not match all atoms present	1622-32-8	C(CCl)S(=O)(=O)Cl	{17: 2, 2: 2, 29: 2}
Did not match all atoms present	1622-57-7	CN1C2=CC=CC=C2N=C1N	{1: 1, 35: 1, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	1622-61-3	C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3Cl	{32: 1, 35: 1, 38: 1, 11: 1, 14: 7, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	1622-62-4	CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3F	{1: 1, 35: 1, 38: 1, 33: 1, 11: 1, 14: 7, 15: 1, 16: 1, 25: 1}
Did not match all atoms present	1622-79-3	CC1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F.Cl	{1: 1, 2: 3, 33: 1, 11: 4, 12: 1, 14: 4, 16: 1, 17: 1, 24: 1}
Did not match all atoms present	16222-66-5	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Tl+3].[Tl+3]	{29: 12}
Did not match all atoms present	16225-26-6	CC(C)(C)C1=CC(=CC(=C1)C(=O)O)C(C)(C)C	{1: 6, 27: 1, 4: 2, 14: 3}
Did not match all atoms present	162277-94-3	CN(C)C(=S)[S-].CN(C)C(=S)[S-].C(CNC(=S)[S-])NC(=S)[S-].[Zn+2].[Zn+2]	{1: 4, 2: 2, 31: 2, 33: 2, 7: 4}
Did not match all atoms present	1623-06-9	CCCOP(=O)(O)O	{1: 1, 2: 2, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	1623-08-1	C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2	{2: 2, 20: 1, 22: 2, 14: 10, 29: 1}
Did not match all atoms present	1623-14-9	CCOP(=O)(O)O	{1: 1, 2: 1, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	1623-19-4	C=CCOP(=O)(OCC=C)OCC=C	{2: 3, 22: 3, 5: 3, 6: 3, 29: 1}
Did not match all atoms present	1623-24-1	CC(C)OP(=O)(O)O	{1: 2, 3: 1, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	1623-95-6	C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)Cl	{24: 1, 17: 1, 22: 1, 14: 9}
Did not match all atoms present	1623-99-0	C1=CC=[C-]C=C1.[Na+]	{14: 5}
Did not match all atoms present	16230-71-0	C1C(C(=O)O1)(C2=CC=CC=C2)C3=CC=CC=C3	{11: 1, 28: 1, 13: 1, 14: 10}
Did not match all atoms present	162301-48-6	CCCOC1=C2CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=CC=CC(=C5O)CC1=CC=C2)OCCC)O	{1: 2, 2: 4, 11: 4, 14: 12, 21: 2, 22: 2}
Did not match all atoms present	16238-56-5	CC1=C2C(=C(C3=CC=CC=C13)CBr)C=CC4=CC=CC=C42	{1: 1, 2: 1, 18: 1, 14: 10}
Did not match all atoms present	16239-18-2	C1=CC2=C(C=CC(=C2Br)O)C=C1Br	{18: 2, 21: 1, 14: 5}
Did not match all atoms present	16239-84-2	C1=C(OC(=C1)[N+](=O)[O-])C=CC2=CSC(=N2)N	{35: 1, 6: 2, 38: 1, 41: 1, 14: 3, 23: 1, 30: 1}
Did not match all atoms present	16239-90-0	CC1=CC(=NN1)C2=CC=C(O2)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 14: 3, 23: 1}
Did not match all atoms present	1624-01-7	CN(C)[Si](N(C)C)(N(C)C)N(C)C	{1: 8, 33: 4}
Did not match all atoms present	1624-26-6	C1CC2=CC3=CC=CC=C3C=C2C1	{11: 3, 14: 6}
Did not match all atoms present	16240-52-1	C[N+]1(CCC2=CC(=C3C=C2[C@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)OC)O3)[N+](CCC6=CC(=C5OC)OC)(C)C)OC)C.[I-].[I-]	{1: 8, 11: 6, 12: 2, 14: 10, 19: 2, 22: 4, 23: 2}
Did not match all atoms present	16243-58-6	[B-]1(N2C=CC=[N+]2[B-]([N+]3=CC=CN31)(N4C=CC=N4)N5C=CC=N5)(N6C=CC=N6)N7C=CC=N7	{33: 8, 35: 4, 14: 18}
Did not match all atoms present	16243-87-1	COC1=C(C=CC(=C1)[N+]#N)N2CCCC2.Cl[Zn-](Cl)Cl	{1: 1, 34: 1, 33: 1, 11: 4, 14: 3, 17: 3, 22: 1}
Did not match all atoms present	16245-77-5	C1=CC(=CC=C1N)N.OS(=O)(=O)O	{30: 2, 20: 2, 29: 2, 14: 4}
Did not match all atoms present	16245-79-7	CCCCCCCCC1=CC=C(C=C1)N	{1: 1, 2: 7, 30: 1, 14: 4}
Did not match all atoms present	16248-90-1	CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Sn+2]	{1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	16249-87-9	CC(CC1=CC(=C(C=C1OC)OC)OC)N.Cl	{1: 4, 2: 1, 3: 1, 14: 2, 17: 1, 22: 3, 30: 1}
Did not match all atoms present	1625-84-9	C1=CC=C2C3C4=CC=CC=C4C(C2=C1)C(C3(C#N)C#N)(C#N)C#N	{12: 2, 13: 2, 14: 8, 37: 4}
Did not match all atoms present	1625-91-8	CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(C)(C)C	{1: 6, 4: 2, 14: 8}
Did not match all atoms present	1625-92-9	CC(C)(C)C1=CC=C(C=C1)C2=CC=CC=C2	{1: 3, 4: 1, 14: 9}
Did not match all atoms present	16251-45-9	C[C@H]1[C@H](OC(=O)N1)C2=CC=CC=C2	{32: 1, 1: 1, 12: 2, 14: 5, 28: 1}
Did not match all atoms present	16251-77-7	CC(CC=O)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 26: 1, 14: 5}
Did not match all atoms present	162578-86-1	CCCCCCCCCCCCCCCCCC[Si](CC(C)C)(CC(C)C)Cl	{1: 5, 2: 19, 3: 2, 17: 1}
Did not match all atoms present	1626-00-2	C[Ge](C)(C)C1=CC=CC=C1	{1: 3, 14: 5}
Did not match all atoms present	1626-24-0	C1=CC=C(C=C1)[Ge](C2=CC=CC=C2)(C3=CC=CC=C3)Cl	{17: 1, 14: 15}
Did not match all atoms present	16260-27-8	CCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 24}
Did not match all atoms present	162607-17-2	B(C1=CC=C(S1)Br)(O)O	{41: 1, 18: 1, 20: 2, 14: 2}
Did not match all atoms present	162607-18-3	B(C1=CC=C(S1)Cl)(O)O	{17: 1, 20: 2, 14: 2, 41: 1}
Did not match all atoms present	16262-48-9	C=Cc1ccc(C(=C)C)cc1	{1: 1, 14: 4, 5: 2, 6: 1, 7: 1}
Did not match all atoms present	16264-05-4	C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]	{33: 2, 11: 4, 38: 2, 14: 8}
Did not match all atoms present	16264-67-8	C1=CNC2=C1C(=C(C(=C2F)F)F)F	{16: 4, 32: 1, 14: 2}
Did not match all atoms present	16268-62-5	CNC1=NC(=NC(=N1)N(C)C)N(C)C	{1: 5, 35: 3, 33: 2, 31: 1}
Did not match all atoms present	16268-73-8	CCN(C)C1=NC(=NC(=N1)N(C)C)N(C)C	{1: 6, 2: 1, 35: 3, 33: 3}
Did not match all atoms present	16268-79-4	CN(C)C1=NC(=NC(=N1)N2CCCCC2)N(C)C	{1: 4, 11: 5, 35: 3, 33: 3}
Did not match all atoms present	16268-87-4	C1CCN(C1)C2=NC(=NC(=N2)N)N3CCCC3	{33: 2, 11: 8, 30: 1, 35: 3}
Did not match all atoms present	16269-05-9	C1=CC=C(C=C1)C(=O)CCCCCCCC(=O)O	{24: 1, 2: 7, 27: 1, 14: 5}
Did not match all atoms present	1627-06-1	C1=CC=C2C3C4C5=CC=CC=C5C(C(C2=C1)C6=CC=CC=C36)C7=CC=CC=C47	{12: 4, 14: 16}
Did not match all atoms present	1627-73-2	C1=CC=C(C=C1)C=NNC(=S)N	{34: 1, 6: 1, 7: 1, 14: 5, 30: 1, 31: 1}
Did not match all atoms present	1627-98-1	C[Si]1(C[Si](C1)(C)C)C	{1: 4, 11: 2}
Did not match all atoms present	1627-99-2	C[Si]1(C[Si](C[Si](C1)(C)C)(C)C)C	{1: 6, 11: 3}
Did not match all atoms present	16271-33-3	C1=CC(=C(C=C1Cl)Cl)S(=O)(=O)Cl	{17: 3, 29: 2, 14: 3}
Did not match all atoms present	16273-55-5	CN=CC1=CC=NC=C1	{1: 1, 34: 1, 35: 1, 14: 4, 6: 1}
Did not match all atoms present	16273-79-3	CCN(CC)CCC(C1=CC=CC=N1)N	{1: 2, 2: 4, 3: 1, 33: 1, 14: 4, 35: 1, 30: 1}
Did not match all atoms present	162739-47-1	CC(C)C1=NC(=CS1)CN(C)C(=O)N[C@@H](C(C)C)C(=O)NN(CC2=CC(=CC=C2)O)C[C@@H]([C@H](CC3=CC=CC=C3)NC(=O)OCC4=CN=CS4)O	{1: 5, 2: 5, 3: 5, 33: 2, 41: 2, 14: 12, 35: 2, 20: 1, 21: 1, 24: 2, 28: 1, 31: 3}
Did not match all atoms present	16274-76-3	C1(=NC(=NC(=N1)N)N)N.Cl	{17: 1, 35: 3, 30: 3}
Did not match all atoms present	162750-10-9	C1[C@H](C2=C(O1)C=C(C=C2)OCC3=C(C=CC=C3F)F)N(C(=O)N)O	{33: 1, 2: 1, 11: 1, 12: 1, 14: 6, 16: 2, 20: 1, 22: 1, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	16277-49-9	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=CC=C3OC	{1: 3, 22: 1, 14: 9}
Did not match all atoms present	16277-67-1	COCC=CC1=CC=CC=C1	{1: 1, 2: 1, 22: 1, 14: 5, 6: 2}
Did not match all atoms present	16279-54-2	C1=CC=C2C(=C1)C=CC(=C2NN=C3C4=C(C=C(C=C4)[N+](=O)[O-])C(=CC3=O)S(=O)(=O)O)O	{34: 1, 38: 1, 14: 10, 15: 2, 20: 1, 21: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	1628-89-3	COC1=CC=CC=N1	{1: 1, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	16283-36-6	C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].[Zn+2]	{27: 2, 14: 8}
Did not match all atoms present	162856-35-1	CC(C)(C)[Si](C)(C)N1[C@H](CC1=O)C(=O)O	{1: 5, 4: 1, 33: 1, 11: 1, 12: 1, 25: 1, 27: 1}
Did not match all atoms present	16286-54-7	CC1=C(C(=CC=C1)C)O[Si](C)(C)C	{1: 5, 22: 1, 14: 3}
Did not match all atoms present	16292-88-9	COC1=C(C=CC(=C1)N)[N+](=O)[O-]	{1: 1, 30: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	16297-14-6	CC1=C(C(=NC(=C1F)F)F)F	{16: 4, 1: 1, 35: 1}
Did not match all atoms present	162976-08-1	CCOC1=C(C(=C(C=C1)C=O)OCC)C	{1: 3, 2: 2, 26: 1, 22: 2, 14: 2}
Did not match all atoms present	16298-38-7	CC1=C(C(=CC(=C1)CC2=CC(=C(C(=C2)C(C)C)N)C)C(C)C)N	{1: 6, 2: 1, 3: 2, 30: 2, 14: 4}
Did not match all atoms present	16299-13-1	CN1CCN(CC1)CC2(C3=CC=CC=C3NC4=CC=CC=C42)OC	{32: 1, 1: 2, 2: 1, 33: 2, 11: 4, 13: 1, 14: 8, 22: 1}
Did not match all atoms present	1630-08-6	C1=C(C(=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])N)[N+](=O)[O-]	{38: 3, 30: 2, 14: 1}
Did not match all atoms present	1630-79-1	B(B(N(C)C)N(C)C)(N(C)C)N(C)C	{1: 8, 33: 4}
Did not match all atoms present	16308-92-2	CC1=CC(=C(C=C1)CO)C	{1: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	1631-26-1	C1=CC=C(C=C1)CN2C(=O)C=CC2=O	{25: 2, 2: 1, 14: 7, 33: 1}
Did not match all atoms present	1631-28-3	CC1=CC=C(C=C1)N2C(=O)C=CC2=O	{1: 1, 33: 1, 14: 6, 25: 2}
Did not match all atoms present	1631-29-4	C1=CC(=CC=C1N2C(=O)C=CC2=O)Cl	{17: 1, 33: 1, 14: 6, 25: 2}
Did not match all atoms present	1631-46-5	CC[GeH2]CC	{1: 2, 2: 2}
Did not match all atoms present	1631-70-5	C[Si](C)CC1=CC=CC=C1	{1: 2, 2: 1, 14: 5}
Did not match all atoms present	1631-73-8	C[Sn](C)C	{1: 3}
Did not match all atoms present	1631-78-3	C[SnH3]	{1: 1}
Did not match all atoms present	1631-83-0	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)Cl	{17: 1, 14: 10}
Did not match all atoms present	1631-84-1	C1=CC=C(C=C1)[Si](Cl)Cl	{17: 2, 14: 5}
Did not match all atoms present	16310-68-2	C1CCC2=C(C1)C=CC3=C2C=C4C(=C3)C=CC5=CC=CC=C54	{11: 4, 14: 10}
Did not match all atoms present	16315-07-4	COC1=CC=CC(=C1[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 22: 1, 14: 3}
Did not match all atoms present	16315-59-6	CN(C)C1=CC=C(C=C1)N=C=O	{1: 2, 34: 1, 33: 1, 8: 1, 14: 4, 29: 1}
Did not match all atoms present	163183-05-9	C1CN(CCN1CCN)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)C(=O)C(=NNC5=CC=C(C=C5)C(=O)NC6=CC=C(C=C6)NN=C7C(=CC8=C(C7=O)C=CC(=C8)NC9=NC(=NC(=N9)N1CCN(CC1)CCN)N1CCN(CC1)CCN)S(=O)(=O)[O-])C(=C4)S(=O)(=O)[O-])N1CCN(CC1)CCN.[Na+].[Na+]	{33: 8, 2: 8, 35: 6, 11: 16, 34: 2, 14: 16, 15: 4, 24: 1, 25: 2, 29: 6, 30: 4, 31: 5}
Did not match all atoms present	163184-22-3	C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC(=C(C(=C4)Br)O)Br)C5=CC(=C(C(=C5)Br)O)Br.C(=O)(Cl)Cl	{13: 1, 14: 12, 17: 2, 18: 4, 21: 2, 24: 1}
Did not match all atoms present	1632-76-4	CC1=NN=CC=C1	{1: 1, 35: 2, 14: 3}
Did not match all atoms present	1632-83-3	CN1C=NC2=CC=CC=C21	{1: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	1632-84-4	CSC1=CC=C(C=C1)N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 40: 1, 29: 1}
Did not match all atoms present	1632-89-9	[2H]C(=O)C([2H])([2H])[2H]	{1: 1, 26: 1}
Did not match all atoms present	1632-99-1	[2H]C([2H])([2H])C([2H])([2H])[2H]	{1: 2}
Did not match all atoms present	16320-20-0	C1=CC=C(C=C1)C(CCC#N)(CCC#N)C#N	{2: 4, 4: 1, 37: 3, 14: 5}
Did not match all atoms present	16322-14-8	CCOC(=O)N1CC=CC2=CC=CC=C21	{1: 1, 2: 1, 33: 1, 11: 1, 14: 6, 28: 1}
Did not match all atoms present	16322-19-3	C1=CC2=NON=C2C(=C1)[N+](=O)[O-]	{35: 2, 38: 1, 14: 3, 23: 1}
Did not match all atoms present	16323-43-6	C1=CC(=CC=C1C=CC(=O)O)C=CC(=O)O	{27: 2, 14: 4, 6: 4}
Did not match all atoms present	16324-27-9	C1=CC(=CC(=C1)S(=O)(=O)O)NC2=NC(=NC(=N2)NCCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC(=CC=C6)S(=O)(=O)O)NCCO)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+]	{2: 4, 35: 6, 6: 2, 14: 14, 20: 6, 29: 8, 31: 6}
Did not match all atoms present	16325-38-5	C(C1=C(C(=C(C(=C1Cl)Cl)CN=C=O)Cl)Cl)N=C=O	{8: 2, 17: 4, 2: 2, 34: 2, 29: 2}
Did not match all atoms present	16325-47-6	CC(=C)C(=O)[O-].[NH4+]	{24: 1, 1: 1, 5: 1, 7: 1}
Did not match all atoms present	16328-62-4	C1=CC2=C(NC(=O)N2)N=C1	{32: 2, 25: 1, 35: 1, 14: 3}
Did not match all atoms present	1633-05-2	C(=O)([O-])[O-].[Sr+2]	{24: 1}
Did not match all atoms present	1633-09-6	CC[Si](CC)(CC)[Si](CC)(CC)CC	{1: 6, 2: 6}
Did not match all atoms present	1633-22-3	C1CC2=CC=C(CCC3=CC=C1C=C3)C=C2	{11: 4, 14: 8}
Did not match all atoms present	1633-44-9	C1=CN=CC(=C1C#N)C#N	{35: 1, 37: 2, 14: 3}
Did not match all atoms present	1633-82-5	C(CS(=O)(=O)Cl)CCl	{17: 2, 2: 3, 29: 2}
Did not match all atoms present	1633-83-6	C1CCS(=O)(=O)OC1	{11: 4, 29: 2, 23: 1}
Did not match all atoms present	16330-03-3	CNC1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 31: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	16331-45-6	CCC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	16331-46-7	CCOC1=CC=C(C=C1)C(=O)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	16331-85-4	O[As](=O)(O)[O-].[Cs+]	{20: 2, 29: 2}
Did not match all atoms present	16335-98-1	CCOC(=O)NC1=NC2=C(C(=C1)NC(C3=CC=CC=C3)C4=CC=CC=C4)N=C(C(=N2)C5=CC=CC=C5)C6=CC=CC=C6	{1: 1, 2: 1, 3: 1, 14: 21, 35: 3, 28: 1, 31: 2}
Did not match all atoms present	16339-01-8	CN(C1=CC=C(C=C1)N=NC2=CC=CC=C2)N=O	{1: 1, 34: 3, 29: 1, 14: 9, 33: 1}
Did not match all atoms present	16339-28-9	B(OCC)(Cl)Cl	{1: 1, 2: 1, 22: 1, 17: 2}
Did not match all atoms present	16339-29-0	B(OCCC)(Cl)Cl	{1: 1, 2: 2, 22: 1, 17: 2}
Did not match all atoms present	1634-02-2	CCCCN(CCCC)C(=S)SSC(=S)N(CCCC)CCCC	{40: 2, 1: 4, 2: 12, 33: 2, 7: 2}
Did not match all atoms present	1634-09-9	CCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 3, 14: 7}
Did not match all atoms present	1634-11-3	CC(C)C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 3: 2, 14: 10}
Did not match all atoms present	1634-73-7	CCN(C1=C(C=C(C(=C1I)N)I)I)C(=O)CCC(=O)O	{1: 1, 2: 3, 33: 1, 14: 1, 19: 3, 24: 1, 27: 1, 30: 1}
Did not match all atoms present	1634-78-2	CCOC(=O)CC(C(=O)OCC)SP(=O)(OC)OC	{1: 4, 2: 3, 3: 1, 40: 1, 22: 2, 28: 2, 29: 1}
Did not match all atoms present	1634-82-8	C1=CC=C(C(=C1)C(=O)O)NN=C2C=CC(=O)C=C2	{34: 1, 14: 8, 15: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	163439-82-5	C1[C@H]([C@@H](CN1CC2=CC=CC=C2)O)O	{33: 1, 2: 1, 11: 2, 12: 2, 14: 5, 20: 2}
Did not match all atoms present	1635-61-6	C1=CC(=C(C=C1Cl)N)[N+](=O)[O-]	{17: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	1635-84-3	CC1=CC(=C(C(=C1)[N+](=O)[O-])N)C	{1: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	16350-99-5	C1=CC=C(C=C1)CN(C=O)C2=CC=CC=C2	{33: 1, 2: 1, 26: 1, 14: 10}
Did not match all atoms present	16354-50-0	CCC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C41)C	{1: 2, 2: 1, 14: 10}
Did not match all atoms present	16354-52-2	CCC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C41)CC	{1: 2, 2: 2, 14: 10}
Did not match all atoms present	16354-53-3	COC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C41)OC	{1: 2, 22: 2, 14: 10}
Did not match all atoms present	16354-54-4	CCCC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C41)C	{1: 2, 2: 2, 14: 10}
Did not match all atoms present	16354-55-5	CCC1=C2C(=C(C3=CC=CC=C31)C)C=CC4=CC=CC=C42	{1: 2, 2: 1, 14: 10}
Did not match all atoms present	16354-95-3	C1=CC=C(C=C1)C(C(CO)O)O	{2: 1, 3: 2, 20: 3, 14: 5}
Did not match all atoms present	16355-00-3	C1=CC=C(C=C1)[C@H](CO)O	{2: 1, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	16355-69-4	[2H]N=O	{36: 1, 29: 1}
Did not match all atoms present	16357-59-8	CCOC1C=CC2=CC=CC=C2N1C(=O)OCC	{1: 2, 2: 2, 33: 1, 12: 1, 14: 6, 22: 1, 28: 1}
Did not match all atoms present	1636-14-2	CCN(CC)P(C1=CC=CC=C1)N(CC)CC	{1: 4, 2: 4, 14: 5, 33: 2}
Did not match all atoms present	1636-34-6	CC(C1=CC=CC=C1)(C(C)(C2=CC=CC=C2)O)O	{1: 2, 4: 2, 14: 10, 20: 2}
Did not match all atoms present	1636-70-0	CC(=O)O[Sn](CC(C)(C)C1=CC=CC=C1)(CC(C)(C)C2=CC=CC=C2)CC(C)(C)C3=CC=CC=C3	{1: 7, 2: 3, 4: 3, 14: 15, 28: 1}
Did not match all atoms present	1636-82-4	CCCC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C	{1: 2, 2: 2, 38: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	1636-83-5	CCC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CC	{1: 2, 2: 2, 38: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	16361-01-6	C1CC2=C(C=C3C(=C2)C=CC4=CC=CC=C43)C5=CC=CC=C51	{11: 2, 14: 12}
Did not match all atoms present	16364-15-1	CC1=CC=C(C=C1)NC2=CC=C(C=C2)NC(C)CC(C)C	{1: 4, 2: 1, 3: 2, 14: 8, 31: 2}
Did not match all atoms present	16365-27-8	C1=CC(=CC=C1[N+](=O)[O-])OCCO	{2: 2, 38: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	16368-97-1	CCCCC(CC)COP(=O)(OCC(CC)CCCC)OC1=CC=CC=C1	{1: 4, 2: 10, 3: 2, 14: 5, 22: 3, 29: 1}
Did not match all atoms present	16371-55-4	C1=CC=C(C=C1)C(=O)N/N=C/C2=CC=CS2	{34: 1, 6: 1, 41: 1, 14: 8, 24: 1, 31: 1}
Did not match all atoms present	16372-96-6	C1=CC=C(C=C1)C2=CC(=CC(=C2)Br)Br	{18: 2, 14: 8}
Did not match all atoms present	16372-99-9	CC(C)(C)CC(C)(C)C1=CC(=C(C(=C1)Cl)O)CO	{1: 5, 2: 2, 4: 2, 14: 2, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	163733-96-8	C1=C(C=C(C(=C1F)F)F)N	{16: 3, 30: 1, 14: 2}
Did not match all atoms present	16375-90-9	CC1=C(C=CC(=C1)NC(=O)C)O	{24: 1, 1: 2, 21: 1, 14: 3, 31: 1}
Did not match all atoms present	16378-21-5	CCN1CCC(=C2C3=CC=CC=C3CCC4=CC=CC=C42)C1C	{1: 2, 2: 1, 33: 1, 11: 4, 12: 1, 14: 8, 15: 2}
Did not match all atoms present	16378-22-6	CCN1CCC(=C2C3=CC=CC=C3CCC4=CC=CC=C42)C1C.Cl	{1: 2, 2: 1, 33: 1, 11: 4, 12: 1, 14: 8, 15: 2, 17: 1}
Did not match all atoms present	163794-90-9	C1=C(C=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)[O-].C(CCCO)CCO.C(CCC(=O)O)CC(=O)O.[Na+]	{2: 10, 14: 3, 20: 3, 24: 1, 27: 3, 29: 2}
Did not match all atoms present	163794-91-0	CC(C)[Si](CCCC#N)(C(C)C)N(C)C	{1: 6, 2: 3, 3: 2, 37: 1, 33: 1}
Did not match all atoms present	163795-75-3	CCCN(CCCN(C)C)C1C/C(=C\C2=[N+](C3=CC=CC=C3S2)C)/C4=CC=CC=C4N1C5=CC=CC=C5	{1: 4, 2: 5, 6: 1, 33: 4, 41: 1, 11: 1, 12: 1, 14: 13, 15: 1}
Did not match all atoms present	1638-22-8	CCCCC1=CC=C(C=C1)O	{1: 1, 2: 3, 21: 1, 14: 4}
Did not match all atoms present	1638-63-7	CC(=O)OC(C1=CC=CC=C1)C(=O)Cl	{1: 1, 3: 1, 14: 5, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	1638-75-1	CP(=O)(C)CCl	{1: 2, 2: 1, 29: 1, 17: 1}
Did not match all atoms present	1638-86-4	CCOP(C1=CC=CC=C1)OCC	{1: 2, 2: 2, 22: 2, 14: 5}
Did not match all atoms present	16382-18-6	CCOC(=O)C1=CC2=CC(=C(C=C2N1)OC)OC	{32: 1, 1: 3, 2: 1, 14: 3, 22: 2, 28: 1}
Did not match all atoms present	16383-89-4	CCOC1=C(C=CC(=C1)[N+](=O)[O-])N	{1: 1, 2: 1, 38: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	16385-59-4	CCCC[N+](CCCC)(CCCC)CCCC.[O-][Re](=O)(=O)=O	{1: 4, 2: 12, 29: 4}
Did not match all atoms present	16386-65-5	C1=CC(=C(C(=C1)Cl)N)C2=CNC=C2Cl	{32: 1, 17: 2, 30: 1, 14: 5}
Did not match all atoms present	16388-74-2	CN(C)CCSC1=C(C2=C(C(=C1)NC3=CC=CC=C3)C(=O)C4=CC=CC=C4C2=O)N	{1: 2, 2: 2, 33: 1, 40: 1, 14: 10, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	16389-59-6	[H+].[H+].[H+].[H+].C1=CC(=CC=C1N=NC2=C(C=C3C=C(C(=C(C3=C2N)[O-])N=NC4=C(C=CC(=C4)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Cu+2]	{34: 4, 2: 2, 14: 9, 22: 1, 29: 14, 30: 1}
Did not match all atoms present	16389-88-1	C(=O)([O-])[O-].C(=O)([O-])[O-].[Mg+2].[Ca+2]	{24: 2}
Did not match all atoms present	1639-60-7	CCC(=O)O[C@](CC1=CC=CC=C1)(C2=CC=CC=C2)[C@H](C)CN(C)C.Cl	{1: 4, 2: 3, 3: 1, 4: 1, 33: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	1639-66-3	CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 15, 3: 1, 28: 2, 29: 3}
Did not match all atoms present	1639-79-8	C1CCN(CC1)CCN2C(=O)C(C(=O)N(C2=O)CCN3CCCCC3)(C4=CC=CC=C4)N5CCCCC5	{33: 5, 2: 4, 11: 15, 13: 1, 14: 5, 25: 3}
Did not match all atoms present	16393-88-7	C[Si](C)C.C[Sn](C)C	{1: 6}
Did not match all atoms present	16393-89-8	C[Ge](C)C.C[Sn](C)C	{1: 6}
Did not match all atoms present	16396-66-0	[Sm+2]	{}
Did not match all atoms present	16397-91-4	[Mn+2]	{}
Did not match all atoms present	1640-39-7	CC1=NC2=CC=CC=C2C1(C)C	{1: 3, 35: 1, 13: 1, 14: 4, 15: 1}
Did not match all atoms present	16400-51-4	C1=CC(=CC(=C1)Br)C2=CC(=CC=C2)Br	{18: 2, 14: 8}
Did not match all atoms present	16408-24-5	O.[Fe+3].[O-2]	{}
Did not match all atoms present	16408-25-6	[OH-].[OH-].[OH-].[OH-].[Zn+2]	{}
Did not match all atoms present	16409-24-8	CCCCCCCCOC(=O)C1=CC(=CC=C1)C	{1: 2, 2: 7, 28: 1, 14: 4}
Did not match all atoms present	1641-09-4	C1=CSC=C1C#N	{41: 1, 37: 1, 14: 3}
Did not match all atoms present	1641-17-4	CC1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OC)O	{24: 1, 1: 2, 22: 1, 21: 1, 14: 7}
Did not match all atoms present	1641-40-3	C1=CC=C2C(=C1)OP(O2)Cl	{17: 1, 14: 4, 23: 2}
Did not match all atoms present	1641-41-4	C1CC2=C(C1)C(=CC=C2)O	{11: 3, 21: 1, 14: 3}
Did not match all atoms present	1641-49-2	CCCCC[Si](C)(C)C	{1: 4, 2: 4}
Did not match all atoms present	1641-74-3	CCN(CC)CCOC(=O)C1=CN=CC=C1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 6, 35: 1, 4: 1, 33: 1, 14: 4, 20: 1, 27: 3, 28: 1}
Did not match all atoms present	16411-33-9	CCCCN[Si](C)(NCCCC)NCCCC	{1: 4, 2: 9, 31: 3}
Did not match all atoms present	16413-26-6	C1=CC(=CC(=C1)N=C=O)C#N	{8: 1, 34: 1, 29: 1, 14: 4, 37: 1}
Did not match all atoms present	16413-88-0	C#C[Sn](C#C)(C#C)C#C	{9: 4, 10: 4}
Did not match all atoms present	16414-34-9	C1=C(C=C(C(=C1O)O)Br)C=O	{18: 1, 26: 1, 21: 2, 14: 2}
Did not match all atoms present	16414-81-6	CC1=CC(=C(C=C1)O[Si](C)(C)C)C	{1: 5, 22: 1, 14: 3}
Did not match all atoms present	16415-12-6	CCCCCCCCCCCCCCCC[Si](OC)(OC)OC	{1: 4, 2: 15, 22: 3}
Did not match all atoms present	164150-85-0	CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=NC=C(C=C4)F)F.Cl	{1: 1, 35: 1, 33: 3, 11: 4, 14: 6, 16: 2, 17: 1, 25: 1, 27: 1}
Did not match all atoms present	16416-31-2	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]	{1: 2, 2: 16}
Did not match all atoms present	16416-32-3	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]	{1: 2, 2: 22}
Did not match all atoms present	16417-75-7	CCN(CC)CC(=O)NC1=C(C=CC2=CC=CC=C21)C	{1: 3, 2: 3, 33: 1, 14: 6, 24: 1, 31: 1}
Did not match all atoms present	16419-60-6	B(C1=CC=CC=C1C)(O)O	{1: 1, 20: 2, 14: 4}
Did not match all atoms present	1642-81-5	C1=CC(=CC=C1CCl)C(=O)O	{17: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	16420-13-6	CN(C)C(=S)Cl	{1: 2, 17: 1, 33: 1, 7: 1}
Did not match all atoms present	16424-98-9	CCCCCCC=C1CCCC1=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 5, 38: 2, 6: 1, 11: 3, 34: 1, 14: 3, 15: 2, 31: 1}
Did not match all atoms present	16426-64-5	C1=CC(=C(C=C1[N+](=O)[O-])Br)C(=O)O	{18: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	164265-61-6	[OH-].[Y+2]	{}
Did not match all atoms present	16427-65-9	CC1=C(C=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=C(C=C4)Cl	{1: 1, 34: 1, 14: 12, 15: 2, 17: 1, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	1643-15-8	CC1=CC(=CC=C1)OCC(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	1643-16-9	CC(C)C1=CC=C(C=C1)OCC(=O)O	{1: 2, 2: 1, 3: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	1643-19-2	CCCC[N+](CCCC)(CCCC)CCCC.[Br-]	{1: 4, 2: 12, 18: 1}
Did not match all atoms present	1643-20-5	CCCCCCCCCCCC[N+](C)(C)[O-]	{1: 3, 2: 11, 29: 1}
Did not match all atoms present	1643-28-3	C1=CC=C(C(=C1)CCC(=O)O)Cl	{17: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	1643-34-1	C1=CC=C(C(=C1)C=CC(=O)O)I	{27: 1, 19: 1, 14: 4, 6: 2}
Did not match all atoms present	1643-49-8	C1=CC=C(C(=C1)C=C2C3=CC=CC=C3C4=CC=CC=C42)Cl	{17: 1, 14: 12, 6: 1, 15: 1}
Did not match all atoms present	16430-32-3	CC(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31	{1: 1, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	16430-93-6	B(F)(F)F.C1=CC=C(C(=C1)N)Cl	{16: 3, 17: 1, 30: 1, 14: 4}
Did not match all atoms present	16431-49-5	C1=CC=C(C=C1)NC(=S)NN/C=C\2/C=CC=N2	{35: 1, 6: 1, 7: 1, 14: 8, 15: 1, 31: 3}
Did not match all atoms present	16431-85-9	C[N+](C)(C)C.C=CC(=O)[O-]	{24: 1, 1: 4, 5: 1, 6: 1}
Did not match all atoms present	16432-36-3	CC(=O)C=C(C1=CC=CC=C1)[O-].CC(=O)C=C(C1=CC=CC=C1)[O-].CC(=O)C=C(C1=CC=CC=C1)[O-].[Cr+3]	{24: 3, 1: 3, 14: 15, 6: 3, 7: 3}
Did not match all atoms present	16432-37-4	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)[O-])S(=O)(=O)C2=C(C=CC(=C2)C(C)(C)CC(C)(C)C)[O-].[Ni+2]	{1: 10, 2: 2, 4: 4, 29: 2, 14: 6}
Did not match all atoms present	16432-45-4	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=C(C=CC(=C3)S(=O)(=O)N)O	{34: 1, 14: 9, 15: 1, 21: 1, 25: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	16432-46-5	CC(=O)NC1=CC=C(C=C1)NC2=C(C=C(C=C2)N=NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 2, 38: 2, 14: 11, 24: 1, 31: 2}
Did not match all atoms present	16432-81-8	C=CC(=O)OCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{2: 2, 5: 1, 6: 1, 14: 8, 21: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	16433-43-5	CC(CCC(=O)O)C1=CC=CC=C1	{27: 1, 1: 1, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	16433-88-8	C1C2=C(C=CC(=C2)Br)C3=C1C=C(C=C3)Br	{18: 2, 11: 1, 14: 6}
Did not match all atoms present	16433-96-8	C#CC1=CC=CC=C1[N+](=O)[O-]	{9: 1, 10: 1, 38: 1, 14: 4}
Did not match all atoms present	16434-97-2	C1=CC=C(C=C1)C2=C(C=CC(=C2)Br)O	{18: 1, 21: 1, 14: 8}
Did not match all atoms present	16436-29-6	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.C1=CC=C(C=C1)C(=O)[O-]	{24: 1, 1: 4, 2: 20, 14: 5}
Did not match all atoms present	164391-52-0	CC1=C(C=C(C=C1)C2C3=CC(=CC(=C3OC2=O)C(C)(C)C)C(C)(C)C)C	{1: 8, 4: 2, 14: 5, 12: 1, 28: 1}
Did not match all atoms present	1644-21-9	C1=CC(=CC(=C1)OC(C(F)F)(F)F)[N+](=O)[O-]	{3: 1, 4: 1, 38: 1, 14: 4, 16: 4, 22: 1}
Did not match all atoms present	1644-22-0	C1=CC=C(C=C1)OC(C(F)(F)F)(F)F	{16: 5, 4: 2, 22: 1, 14: 5}
Did not match all atoms present	164455-27-0	C[C@H]1C[C@@H](C2=C(S1(=O)=O)SC(=C2)S(=O)(=O)N)N.Cl	{1: 1, 41: 1, 11: 1, 12: 2, 14: 1, 17: 1, 29: 4, 30: 2}
Did not match all atoms present	16448-54-7	C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Fe+3]	{24: 3, 33: 1, 2: 3}
Did not match all atoms present	16449-54-0	C1=CC=C(C(=C1)C(=O)[O-])NC2=CC=CC(=C2)C(F)(F)F.C1=CC=C(C(=C1)C(=O)[O-])NC2=CC=CC(=C2)C(F)(F)F.C1=CC=C(C(=C1)C(=O)[O-])NC2=CC=CC(=C2)C(F)(F)F.[Al+3]	{16: 9, 24: 3, 4: 3, 14: 24, 31: 3}
Did not match all atoms present	1645-07-4	C1=CC(=CC=C1C[NH+](CCCl)CCCl)F.[Cl-]	{16: 1, 17: 3, 2: 5, 14: 4}
Did not match all atoms present	1645-65-4	C1=CC(=CC=C1C(F)(F)F)N=C=S	{8: 1, 16: 3, 34: 1, 4: 1, 14: 4}
Did not match all atoms present	16450-78-5	[2H]C1(C(C(C(C(C(C(C(C(C(C(C1([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])[2H]	{11: 12}
Did not match all atoms present	164513-38-6	CC1=CC(=O)NC=C1Br	{32: 1, 1: 1, 18: 1, 14: 2, 25: 1}
Did not match all atoms present	16452-01-0	CC1=C(C=C(C=C1)N)OC	{1: 2, 30: 1, 22: 1, 14: 3}
Did not match all atoms present	16452-06-5	COC1=CC(=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 34: 1, 14: 7, 15: 2, 20: 2, 22: 1, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	16452-09-8	CC1=CC=C(C=C1)SC2=CC=CC=C2N	{40: 1, 1: 1, 30: 1, 14: 8}
Did not match all atoms present	16454-60-7	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Nd+3]	{}
Did not match all atoms present	16455-68-8	N.N.N.N.[Pt+2]	{}
Did not match all atoms present	16456-52-3	C1CNP(=O)(NC1)OC2=CC=CC=C2	{32: 2, 11: 3, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	16456-56-7	CCCCO[P+](=O)O	{1: 1, 2: 3, 20: 1, 29: 1, 22: 1}
Did not match all atoms present	16456-81-8	C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9)N3.[Cl-].[Cl-].[Cl-].[Fe+3]	{32: 2, 17: 3, 35: 2, 14: 28}
Did not match all atoms present	16458-09-6	[Al+3].[OH-]	{}
Did not match all atoms present	1646-26-0	CC(=O)C1=CC2=CC=CC=C2O1	{24: 1, 1: 1, 14: 5, 23: 1}
Did not match all atoms present	1646-53-3	CC1=CC(=C(C(=C1C)Br)C)C	{1: 4, 18: 1, 14: 1}
Did not match all atoms present	1646-54-4	CC1=C(C(=C(C(=C1Br)C)C)Br)C	{1: 4, 18: 2}
Did not match all atoms present	1646-87-3	CC(C)(/C=N/OC(=O)NC)S(=O)C	{1: 4, 34: 1, 4: 1, 6: 1, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	1646-88-4	CC(C)(/C=N/OC(=O)NC)S(=O)(=O)C	{1: 4, 34: 1, 4: 1, 6: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	16460-56-3	C1C2=CC=CC=C2CN(N1C3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 11: 2, 14: 14}
Did not match all atoms present	16461-94-2	C1=NNC(=C1Br)N	{32: 1, 18: 1, 35: 1, 30: 1, 14: 1}
Did not match all atoms present	164666-68-6	CC1=C(C=CC(=N1)Cl)N	{1: 1, 35: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	16469-16-2	[OH-].[OH-].[OH-].[Pr+3]	{}
Did not match all atoms present	16469-18-4	[OH-].[OH-].[OH-].[Gd+3]	{}
Did not match all atoms present	16469-19-5	[OH-].[OH-].[OH-].[Eu+3]	{}
Did not match all atoms present	16469-21-9	C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)N	{32: 1, 2: 1, 35: 3, 11: 5, 12: 1, 14: 1, 22: 1, 30: 1}
Did not match all atoms present	1647-06-9	CC(CC1=CC=CC=C1)C=C	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 14: 5}
Did not match all atoms present	16470-24-9	C1=CC(=CC=C1NC2=NC(=NC(=N2)N(CCO)CCO)NC3=C(C=C(C=C3)C=CC4=CC(=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 14, 20: 4, 29: 12, 31: 4}
Did not match all atoms present	16470-45-4	CC/C(=C\C1=[N+](C2=C(S1)C=CC3=CC=CC=C32)CCCS(=O)(=O)[O-])/C=C\4/N(C5=C(S4)C=CC6=CC=CC=C65)CCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 7, 33: 2, 6: 2, 7: 1, 41: 2, 14: 12, 15: 1, 29: 6}
Did not match all atoms present	16473-79-3	C1=CC(=C(C=C1N=NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)C=CC4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)O	{34: 2, 6: 4, 38: 2, 14: 12, 20: 4, 29: 8}
Did not match all atoms present	16475-45-9	C(=N[GeH3])=S	{8: 1, 34: 1}
Did not match all atoms present	16475-90-4	CC(=O)C1=CC(=C(C=C1)O)C(=O)OC	{24: 1, 1: 2, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	16478-18-5	C1(=C(C(=C(C(=C1Cl)Cl)I)Cl)Cl)Cl	{17: 5, 19: 1}
Did not match all atoms present	16478-59-4	C[N+]1(CCOC(C1)(C2=CC=C(C=C2)C3=CC=C(C=C3)C4(C[N+](CCO4)(C)C)O)O)C	{1: 4, 11: 6, 13: 2, 14: 8, 20: 2, 23: 2}
Did not match all atoms present	164780-85-2	CC(CO)CO.COC(=O)C1=CC=C(C=C1)C(=O)OC.C(COCCO)O	{1: 3, 2: 6, 3: 1, 14: 4, 20: 4, 22: 1, 28: 2}
Did not match all atoms present	164780-86-3	COC1=C(C=CC(=C1)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C4=CC=C(C=C4)N/N=C\5/C(=O)NC(=NC5=O)NC#N.C(CO)N(CCO)CCO.[Na+]	{32: 1, 1: 1, 2: 6, 35: 1, 37: 1, 33: 1, 34: 3, 14: 12, 15: 2, 20: 3, 22: 1, 24: 1, 25: 2, 29: 6, 31: 3}
Did not match all atoms present	164780-87-4	CCN(C1=CC=C(C=C1)C)C2=CC(=C(C=C2)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5OC)C)NC6=CC=CC=C6)O.OS(=O)(=O)O	{1: 4, 2: 1, 33: 1, 13: 1, 14: 18, 20: 2, 21: 1, 22: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	1648-99-3	C(C(F)(F)F)S(=O)(=O)Cl	{16: 3, 17: 1, 2: 1, 4: 1, 29: 2}
Did not match all atoms present	16480-60-7	Cl[Fe]Cl.Cl[Fe](Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	16481-54-2	COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O	{1: 3, 2: 1, 11: 2, 12: 9, 14: 4, 20: 4, 22: 4, 23: 3, 28: 1}
Did not match all atoms present	16483-18-4	C(CN)N.C(CN)N.[Cl-].[Cl-].[Pd+2]	{17: 2, 2: 4, 30: 4}
Did not match all atoms present	16483-98-0	C1=CC=C(C=C1)C2C(=N2)C3=CC=CC=C3	{35: 1, 12: 1, 14: 10, 15: 1}
Did not match all atoms present	16484-77-8	CC1=C(C=CC(=C1)Cl)O[C@H](C)C(=O)O	{1: 2, 3: 1, 14: 3, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	164843-77-0	CC1=C(C(=C(C(=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])C)S(=O)(=O)[O-])C)N.[Na+]	{1: 3, 14: 5, 25: 2, 29: 6, 30: 2, 31: 1}
Did not match all atoms present	16485-39-5	CCC(CC)(C1=CC=CC=C1)C(=O)OCCOCC[NH+](CC)CC.C(C(=O)O)C(CC(=O)[O-])(C(=O)O)O	{1: 4, 2: 10, 4: 2, 14: 5, 20: 1, 22: 1, 24: 1, 27: 2, 28: 1}
Did not match all atoms present	16487-37-9	CN1C2CCC1CC(C2)OC3=CC=CC=C3.Cl	{1: 1, 33: 1, 11: 4, 12: 3, 14: 5, 17: 1, 22: 1}
Did not match all atoms present	16488-48-5	CCCCNC1=CC=C(C=C1)C(=O)OCC[NH+](CC)CC.[Cl-]	{1: 3, 2: 7, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	16488-98-5	CC(C)(C#CCOC1=CC=CC=C1)O	{1: 2, 2: 1, 4: 1, 10: 2, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	1649-18-9	C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=N3	{33: 2, 2: 3, 35: 1, 11: 4, 14: 8, 16: 1, 24: 1}
Did not match all atoms present	1649-21-4	CC(CC1=CC=CC=C1)N2CCN(CC2)C(C)CC3=CC=CC=C3.Cl.Cl	{1: 2, 2: 2, 3: 2, 33: 2, 11: 4, 14: 10, 17: 2}
Did not match all atoms present	16490-80-5	C1=CC=C(C=C1)CNCCC(=O)N	{24: 1, 2: 3, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	16494-24-9	CCCCOC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCC	{1: 2, 2: 4, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	16494-25-0	CCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCC	{1: 2, 2: 5, 34: 2, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	16494-27-2	CCOC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)CCCCCCCCC=C	{1: 1, 2: 9, 5: 1, 6: 1, 34: 2, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	16494-36-3	CC1=CC=C(S1)I	{1: 1, 19: 1, 14: 2, 41: 1}
Did not match all atoms present	16495-13-9	C1[C@H](O1)COCC2=CC=CC=C2	{2: 2, 11: 1, 12: 1, 14: 5, 22: 1, 23: 1}
Did not match all atoms present	16495-62-8	CC1=CC(=[N+](N1C)C2=CC=CC=C2)N/N=C\3/C(=NC4=CC=CC=C43)C.Cl[Zn-](Cl)Cl	{1: 3, 34: 1, 35: 1, 33: 2, 14: 10, 15: 2, 17: 3, 31: 1}
Did not match all atoms present	165-42-4	C1=CC=C2C(=C1)C=CC23C=CC4=CC=CC=C34	{13: 1, 14: 12}
Did not match all atoms present	16501-01-2	COCCOC(=O)C1=CC=CC=C1C(=O)O	{1: 1, 2: 2, 14: 4, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	16503-53-0	C1=CC=C(C=C1)CC(C(=O)O)Br	{27: 1, 2: 1, 3: 1, 18: 1, 14: 5}
Did not match all atoms present	16503-95-0	COC1=C(C2=C(C=C1)C=CN=C2)OC	{1: 2, 35: 1, 22: 2, 14: 5}
Did not match all atoms present	165038-53-9	CC(COC)OCC(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 2, 3: 1, 22: 2}
Did not match all atoms present	165038-54-0	CCCOCC(C)OCC(C)OCC(=O)[O-].[Na+]	{24: 1, 1: 3, 2: 5, 3: 2, 22: 3}
Did not match all atoms present	165047-24-5	C1=C(C(=CC(=C1F)F)F)C=O	{16: 3, 26: 1, 14: 2}
Did not match all atoms present	16510-49-9	C1=CC=C(C=C1)C2C(=C2C3=CC=CC=C3)C4=CC=CC=C4	{12: 1, 14: 15, 15: 2}
Did not match all atoms present	16513-60-3	C1C2C=CC1C3=C2C=CC(=C3)C#N	{11: 1, 12: 2, 37: 1, 14: 5}
Did not match all atoms present	16513-72-7	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N	{28: 1, 37: 1, 14: 9}
Did not match all atoms present	16517-70-7	C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)O)O)N	{25: 2, 30: 2, 21: 2, 14: 4}
Did not match all atoms present	16518-17-5	C1=CC(=CN=C1)C(=O)[O-].[K+]	{24: 1, 35: 1, 14: 4}
Did not match all atoms present	16518-47-1	O=[As]([O-])(O)O	{20: 2, 29: 2}
Did not match all atoms present	16518-62-0	CN(C)C1=CC(=CC=C1)Br	{1: 2, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	16518-64-2	CN(C)C1=CC=CC(=C1)C(=O)OC	{1: 3, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	16520-62-0	C#CCCC1=CC=CC=C1	{9: 1, 2: 2, 10: 1, 14: 5}
Did not match all atoms present	16523-28-7	C1=CC(=C(C=C1CC2=CC(=C(C=C2)O)N)N)O	{2: 1, 30: 2, 21: 2, 14: 6}
Did not match all atoms present	16523-31-2	C1=C(C(=CC(=C1N)O)O)N.Cl.Cl	{17: 2, 30: 2, 21: 2, 14: 2}
Did not match all atoms present	16523-54-9	C1CCC(CC1)P(C2CCCCC2)Cl	{17: 1, 11: 10, 12: 2}
Did not match all atoms present	16523-89-0	C=CCP(CC=C)CC=C	{2: 3, 5: 3, 6: 3}
Did not match all atoms present	16524-23-5	CC1=CC=C(C=C1)NC2=CC=CC=C2C(=O)O	{1: 1, 27: 1, 14: 8, 31: 1}
Did not match all atoms present	16527-81-4	CCOP(=O)([O-])[O-].[Zn+2]	{1: 1, 2: 1, 29: 3, 22: 1}
Did not match all atoms present	1653-64-1	C1OC2=C(O1)C=C(C=C2)CCN.Cl	{2: 2, 11: 1, 14: 3, 17: 1, 23: 2, 30: 1}
Did not match all atoms present	1653-75-4	CC1=NC2=CC=CC=C2N1.Cl	{32: 1, 1: 1, 35: 1, 14: 4, 17: 1}
Did not match all atoms present	16532-02-8	C[Si](C)(CBr)Cl	{1: 2, 2: 1, 18: 1, 17: 1}
Did not match all atoms present	16532-78-8	C1=CC(=CC(=C1)CC#N)C#N	{2: 1, 37: 2, 14: 4}
Did not match all atoms present	16532-79-9	C1=CC(=CC=C1CC#N)Br	{2: 1, 18: 1, 14: 4, 37: 1}
Did not match all atoms present	16534-12-6	C1=C(C=C(C(=C1O)Br)O)C(=O)O	{18: 1, 27: 1, 21: 2, 14: 2}
Did not match all atoms present	16536-95-1	CC(C)CC(=S)N	{1: 2, 2: 1, 3: 1, 30: 1, 7: 1}
Did not match all atoms present	16539-99-4	CC1=C(C(=O)NC(=O)C1=NNC2=CC=C(C=C2)S(=O)(=O)N)C#N	{32: 1, 1: 1, 34: 1, 37: 1, 14: 4, 15: 3, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	1654-52-0	CC1=CC=C2C=CC=C2C=C1	{1: 1, 14: 7}
Did not match all atoms present	1654-55-3	CC1=CC2=CC=CC2=CC=C1	{1: 1, 14: 7}
Did not match all atoms present	16544-95-9	[SiH3]S[SiH3]	{40: 1}
Did not match all atoms present	165445-26-1	CCCCCCCCCCCCCCCCCCCCCCNC(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(=O)NC3CCCCC3	{1: 1, 2: 22, 11: 5, 12: 1, 14: 8, 24: 2, 31: 4}
Did not match all atoms present	165445-27-2	CCCCCCCCCCCCCCCCCCCCCCNC(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(=O)NCCCCCCCCCCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 43, 14: 8, 31: 4}
Did not match all atoms present	165445-28-3	CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)NC4CCCCC4	{1: 1, 2: 12, 11: 5, 12: 1, 14: 12, 24: 2, 31: 4}
Did not match all atoms present	165445-29-4	CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)CCCCCCCCCCCC	{24: 2, 1: 2, 2: 23, 14: 16, 31: 4}
Did not match all atoms present	16546-01-3	CCOC(=O)C1C(O1)C2=CC=C(C=C2)OC	{1: 2, 2: 1, 12: 2, 14: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	1655-35-2	C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{29: 6, 14: 6}
Did not match all atoms present	1655-41-0	CCCC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CCC	{1: 2, 2: 4, 38: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	1655-42-1	CC(C)CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C	{1: 3, 2: 1, 3: 1, 38: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	1655-43-2	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+]	{29: 6, 14: 6}
Did not match all atoms present	1655-68-1	COC1=CC=CC(=C1)OC2=CC=CC=C2	{1: 1, 22: 2, 14: 9}
Did not match all atoms present	1655-69-2	COC1=CC=C(C=C1)OC2=CC=CC=C2	{1: 1, 22: 2, 14: 9}
Did not match all atoms present	1655-70-5	COC1=CC=CC=C1OC2=CC=CC=C2OC	{1: 2, 22: 3, 14: 8}
Did not match all atoms present	1655-71-6	COC1=CC=CC(=C1)OC2=CC=CC=C2OC	{1: 2, 22: 3, 14: 8}
Did not match all atoms present	1655-74-9	COC1=CC=C(C=C1)OC2=CC=C(C=C2)OC	{1: 2, 22: 3, 14: 8}
Did not match all atoms present	165535-45-5	CCN=P(N=P(N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C	{1: 11, 2: 1, 34: 2, 33: 5}
Did not match all atoms present	165547-79-5	C1=CNC(=O)C(=C1Cl)[N+](=O)[O-]	{32: 1, 17: 1, 38: 1, 14: 2, 25: 1}
Did not match all atoms present	16555-77-4	C1=CC=C(C=C1)C(=O)NC(C(=O)O)O	{3: 1, 14: 5, 20: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	16558-32-0	CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=C(C=C(C=C2)S(=O)(=O)NCCCl)Cl	{1: 1, 2: 6, 33: 1, 34: 2, 14: 6, 17: 2, 20: 2, 29: 2, 31: 1}
Did not match all atoms present	1656-44-6	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)Cl	{17: 1, 38: 2, 29: 2, 14: 3}
Did not match all atoms present	1656-94-6	C1=CC(=CN=C1)CNCC2=CN=CC=C2	{2: 2, 35: 2, 14: 8, 31: 1}
Did not match all atoms present	16560-43-3	C1=CC=C2C(=C1)C(=CC=N2)I	{35: 1, 19: 1, 14: 6}
Did not match all atoms present	16566-64-6	C1=CC2=C(C3=C4C(=C2)C=CC5=CC6=C(C(=C54)C=C3)N=CC=C6)N=C1	{35: 2, 14: 12}
Did not match all atoms present	16567-18-3	C1=CC2=C(C(=C1)Br)N=CC=C2	{18: 1, 35: 1, 14: 6}
Did not match all atoms present	16568-66-4	C1CN(CCC1C2=CC=CC=C2)C(=O)N	{33: 1, 11: 4, 12: 1, 14: 5, 24: 1, 30: 1}
Did not match all atoms present	1657-16-5	CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 34: 2, 3: 1, 38: 1, 14: 9, 24: 2, 31: 1}
Did not match all atoms present	1657-32-5	C1=CC(=C[N+](=C1)[O-])N	{33: 1, 30: 1, 29: 1, 14: 4}
Did not match all atoms present	1657-60-9	CC(C)(C)C(C1=CC=CC=C1)(C2=CC=CC=C2)O	{1: 3, 4: 2, 14: 10, 20: 1}
Did not match all atoms present	1657-75-6	COC1=CC=CC=C1[Se]C	{1: 2, 22: 1, 14: 4}
Did not match all atoms present	16571-39-4	COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3	{1: 1, 34: 1, 6: 1, 14: 13, 22: 1, 28: 1}
Did not match all atoms present	16571-42-9	CCCCCC(=O)[O-].CCCCCC(=O)[O-].[Mn+2]	{24: 2, 1: 2, 2: 8}
Did not match all atoms present	16574-43-9	C1=CC=C2C(=C1)C3(C4=CC(=C(C(=C4OC5=C(C(=C(C=C53)Br)O)O)O)O)Br)OS2(=O)=O	{13: 1, 14: 6, 18: 2, 21: 4, 23: 2, 29: 2}
Did not match all atoms present	16577-52-9	[Li+].CCCCCCCC(=O)[O-]	{24: 1, 1: 1, 2: 6}
Did not match all atoms present	1658-08-8	C1CCC2=NC3=C(CCCC3)C=C2C1	{35: 1, 11: 8, 14: 1}
Did not match all atoms present	1658-42-0	COC(=O)CC1=CC=CC=N1	{1: 1, 2: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	16582-38-0	CC1=CC(=CC(=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	16582-59-5	C1=C(C=C2C(=C1Cl)N=C(S2)N)Cl	{17: 2, 35: 1, 30: 1, 14: 2, 41: 1}
Did not match all atoms present	16582-93-7	C1=C(C(=C(C(=C1F)F)F)F)C#N	{16: 4, 37: 1, 14: 1}
Did not match all atoms present	16583-06-5	C1=C(C(=C(C(=C1F)F)F)F)C=O	{16: 4, 26: 1, 14: 1}
Did not match all atoms present	16583-08-7	C1(=C(C(=C(C(=C1F)F)F)F)[N+](=O)[O-])C(=O)O	{16: 4, 27: 1, 38: 1}
Did not match all atoms present	16584-00-2	CN1N=C2C=CC=CC2=N1	{1: 1, 35: 2, 14: 4, 33: 1}
Did not match all atoms present	16587-32-9	CCCc1cc2ccccc2s1	{1: 1, 2: 2, 14: 5, 41: 1}
Did not match all atoms present	16587-33-0	C1CCC2=C(C1)C3=CC=CC=C3S2	{41: 1, 11: 4, 14: 4}
Did not match all atoms present	16587-39-6	C1=CC=C(C=C1)C2=C3C=CC=CC3=C(S2)C4=CC=CC=C4	{41: 1, 14: 14}
Did not match all atoms present	16587-40-9	CC1=CC=CC2=C1SC(=C2)C	{1: 2, 14: 4, 41: 1}
Did not match all atoms present	16587-47-6	CC1=CC2=C(C=C1)C=CS2	{1: 1, 14: 5, 41: 1}
Did not match all atoms present	16587-52-3	CC1=CC2=C(C=C1)C3=CC=CC=C3S2	{1: 1, 14: 7, 41: 1}
Did not match all atoms present	16588-02-6	C1=CC(=C(C=C1[N+](=O)[O-])C#N)Cl	{17: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	16588-06-0	C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])Cl	{24: 1, 17: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	16588-34-4	C1=CC(=C(C=C1C=O)[N+](=O)[O-])Cl	{17: 1, 26: 1, 38: 1, 14: 3}
Did not match all atoms present	16588-69-5	C1=CC(=C(C=C1Cl)C(F)(F)F)N=C=O	{34: 1, 4: 1, 8: 1, 14: 3, 16: 3, 17: 1, 29: 1}
Did not match all atoms present	16588-74-2	C1=C(C=C(C=C1C(F)(F)F)N=C=O)C(F)(F)F	{34: 1, 4: 2, 8: 1, 14: 3, 16: 6, 29: 1}
Did not match all atoms present	16590-41-3	C1CC1CN2CC[C@]34[C@@H]5C(=O)CC[C@]3([C@H]2CC6=C4C(=C(C=C6)O)O5)O	{33: 1, 2: 1, 11: 7, 12: 3, 13: 2, 14: 2, 20: 1, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	16591-56-3	C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9)[N-]3.[Fe+2]	{35: 4, 14: 28}
Did not match all atoms present	16595-48-5	CC1(C2=CC=CC=C2[N+](=C1/C=C/C=C/C=C/C=C/3\C(C4=CC=CC=C4N3C)(C)C)C)C.[O-]Cl(=O)(=O)=O	{1: 6, 6: 7, 33: 2, 13: 2, 14: 8, 15: 2, 17: 1, 29: 4}
Did not match all atoms present	16596-03-5	CC1=CC=C(C=C1)NC=NC2=CC=C(C=C2)C	{1: 2, 34: 1, 14: 8, 6: 1, 31: 1}
Did not match all atoms present	16597-35-6	CN1CCCN(C1=S)C	{1: 2, 11: 3, 33: 2, 15: 1}
Did not match all atoms present	1660-15-7	C1=CC(=C2C(=C1N)C(=O)NC2=O)N	{32: 1, 25: 2, 30: 2, 14: 2}
Did not match all atoms present	1660-93-1	CC1=CN=C2C(=C1C)C=CC3=C(C(=CN=C32)C)C	{1: 4, 35: 2, 14: 4}
Did not match all atoms present	1660-94-2	CCOP(=O)(CP(=O)(OCC)OCC)OCC	{1: 4, 2: 5, 29: 2, 22: 4}
Did not match all atoms present	1660-95-3	CC(C)OP(=O)(CP(=O)(OC(C)C)OC(C)C)OC(C)C	{1: 8, 2: 1, 3: 4, 29: 2, 22: 4}
Did not match all atoms present	16603-84-2	[AlH](Cl)Cl	{17: 2}
Did not match all atoms present	16605-91-7	C1=CC=C(C=C1)C2=C(C(=CC=C2)Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	16606-02-3	C1=CC(=CC=C1C2=C(C=CC(=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	16606-18-1	CN1CCN(P1(=O)C)C	{1: 3, 11: 2, 29: 1, 33: 2}
Did not match all atoms present	16606-47-6	C=C(CCC1=CC=CC=C1)C2=CC=CC=C2	{2: 2, 5: 1, 14: 10, 7: 1}
Did not match all atoms present	16606-55-6	C[C@@H]1COC(=O)O1	{1: 1, 11: 1, 12: 1}
Did not match all atoms present	1661-03-6	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Mg+2]	{35: 8, 14: 16}
Did not match all atoms present	16610-44-9	CC1=CC=CC=C1NC2=CC=CC=C2C(=O)O	{1: 1, 27: 1, 14: 8, 31: 1}
Did not match all atoms present	16610-81-4	C1=CC=C(C=C1)C=C(C#N)C2=CC=C(C=C2)Cl	{17: 1, 37: 1, 14: 9, 6: 1, 7: 1}
Did not match all atoms present	16611-15-7	C1=CC=C(C=C1)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]	{17: 1, 38: 1, 14: 8, 31: 1}
Did not match all atoms present	16616-82-3	CON1C2=CC=CC=C2C=C1C3=CC=CC=C3	{1: 1, 22: 1, 14: 10, 33: 1}
Did not match all atoms present	16617-46-2	C1=NNC(=C1C#N)N	{32: 1, 35: 1, 30: 1, 14: 1, 37: 1}
Did not match all atoms present	16618-72-7	C1C(C2=CC=CC=C2C1=O)C3=CC=CC=C3	{25: 1, 11: 1, 12: 1, 14: 9}
Did not match all atoms present	16619-12-8	C1C(C(=O)C2=CC=CC=C21)C3=CC=CC=C3	{25: 1, 11: 1, 12: 1, 14: 9}
Did not match all atoms present	1662-01-7	C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5	{35: 2, 14: 16}
Did not match all atoms present	16620-52-3	CN(C)CC1=CNC2=C1C=C(C=C2)OC	{32: 1, 1: 3, 2: 1, 33: 1, 14: 4, 22: 1}
Did not match all atoms present	16623-47-5	C1=CC=C2C(=C1)C(=CC(=O)C2=NNC3=C(C=C(C=C3)O)O)S(=O)(=O)O	{34: 1, 14: 8, 15: 2, 20: 1, 21: 2, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	166255-23-8	CCO[Si](CCCC1=C(C(=CC(=C1O)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)O)(OCC)OCC	{1: 3, 2: 6, 14: 11, 21: 2, 22: 3, 24: 2}
Did not match all atoms present	16629-19-9	C1=CSC(=C1)S(=O)(=O)Cl	{17: 1, 29: 2, 14: 3, 41: 1}
Did not match all atoms present	1663-45-2	C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 2, 14: 20}
Did not match all atoms present	1663-61-2	CCOC(C1=CC=CC=C1)(OCC)OCC	{1: 3, 2: 3, 4: 1, 22: 3, 14: 5}
Did not match all atoms present	16631-02-0	CC(=C)C(=O)[O-].[Ag+]	{24: 1, 1: 1, 5: 1, 7: 1}
Did not match all atoms present	16634-82-5	CC1=CC=C(C=C1)NC(=O)CCl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	16636-62-7	CC(=O)CC(=O)C1=CC=CC=C1O	{24: 2, 1: 1, 2: 1, 21: 1, 14: 4}
Did not match all atoms present	16637-13-1	CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)C	{24: 1, 1: 5, 3: 2, 14: 3, 31: 1}
Did not match all atoms present	16637-16-4	[O].[O].[U+2]	{}
Did not match all atoms present	16639-00-2	CCCCCC(=O)OCC[N+](C)(C)C	{1: 4, 2: 6, 28: 1}
Did not match all atoms present	1664-40-0	C1=CC=C(C=C1)NCCN	{2: 2, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	1664-59-1	COC(=O)/C=C/C1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 38: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	1664-98-8	[2H]C(=O)[2H]	{5: 1}
Did not match all atoms present	16642-79-8	C1=CC(=CC=C1CCC(=O)O)[N+](=O)[O-]	{2: 2, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	16642-87-8	C1=CC(=CC(=C1)C(F)(F)F)C=CC(=O)O	{16: 3, 27: 1, 4: 1, 14: 4, 6: 2}
Did not match all atoms present	16642-92-5	C1=CC(=CC=C1C=CC(=O)O)C(F)(F)F	{16: 3, 27: 1, 4: 1, 14: 4, 6: 2}
Did not match all atoms present	16643-15-5	CS[SiH3]	{40: 1, 1: 1}
Did not match all atoms present	16645-10-6	C1=CC(=CC=C1Cl)[Se]	{17: 1, 14: 4}
Did not match all atoms present	16648-69-4	CC(C(C1=CC=CC=C1)O)NCCC(=O)C2=CC(=CC=C2)OC.Cl	{1: 2, 2: 2, 3: 2, 14: 9, 17: 1, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	1665-00-5	[2H]C([2H])(Cl)Cl	{17: 2, 2: 1}
Did not match all atoms present	1665-01-6	[2H]C([2H])Cl	{1: 1, 17: 1}
Did not match all atoms present	1665-48-1	CC1=CC(=CC(=C1)OCC2CNC(=O)O2)C	{32: 1, 1: 2, 2: 1, 11: 1, 12: 1, 14: 3, 22: 1, 28: 1}
Did not match all atoms present	1665-59-4	CCN(CC)CCNC1=CC=CC=C1	{1: 2, 2: 4, 33: 1, 14: 5, 31: 1}
Did not match all atoms present	1665-79-8	CC1=C(OP(O1)(OC)(OC)OC)C	{1: 5, 23: 2, 22: 3, 15: 2}
Did not match all atoms present	16650-52-5	C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)O	{17: 1, 27: 1, 14: 6}
Did not match all atoms present	16652-64-5	C1=CC=C(C=C1)COC2=CC=C(C=C2)C[C@@H](C(=O)O)N	{2: 2, 3: 1, 14: 9, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	16654-64-1	CN(C)CCO[Si](C)(C)C	{1: 5, 2: 2, 22: 1, 33: 1}
Did not match all atoms present	16655-82-6	CC1(C(C2=C(O1)C(=CC=C2)OC(=O)NC)O)C	{1: 3, 12: 1, 13: 1, 14: 3, 20: 1, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	1666-13-3	C1=CC=C(C=C1)[Se][Se]C2=CC=CC=C2	{14: 10}
Did not match all atoms present	1666-96-2	C1=CC=C(C=C1)C2=CC3=CC=CC=C3N=C2	{35: 1, 14: 11}
Did not match all atoms present	16661-43-1	[SeH-]	{}
Did not match all atoms present	16662-47-8	CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C(=C2)OC)OC)OC	{1: 8, 2: 5, 3: 1, 4: 1, 37: 1, 33: 1, 14: 5, 22: 5}
Did not match all atoms present	16664-45-2	CC1=CC(=C2C=CC3=CC=CC=C3C2=C1)C	{1: 2, 14: 8}
Did not match all atoms present	16666-80-1	CC(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C	{1: 2, 14: 15, 7: 1}
Did not match all atoms present	166664-83-1	CN1C2=C(N=C3C(=C2)C=CC=N3)N=C1N	{1: 1, 35: 3, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	16669-42-4	CC(C)(C1=C(C(=C(C(=C1Cl)Cl)O)Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)O)Cl)Cl	{1: 2, 4: 1, 21: 2, 17: 8}
Did not match all atoms present	1667-00-1	C1CC1CC2=CC=CC=C2	{2: 1, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	1667-01-2	CC1=CC(=C(C(=C1)C)C(=O)C)C	{24: 1, 1: 4, 14: 2}
Did not match all atoms present	1667-04-5	CC1=CC(=C(C(=C1)C)Cl)C	{1: 3, 14: 2, 17: 1}
Did not match all atoms present	1667-11-4	C1=CC=C(C=C1)C2=CC=C(C=C2)CCl	{17: 1, 2: 1, 14: 9}
Did not match all atoms present	16671-27-5	O.O.O.[F-].[F-].[F-].[Cr+3]	{16: 3}
Did not match all atoms present	16672-39-2	CCCCOCCOCCOC(=O)C1=CC=CC=C1C(=O)OCCOCCOCCCC	{1: 2, 2: 14, 28: 2, 22: 4, 14: 4}
Did not match all atoms present	16672-87-0	C(CCl)P(=O)(O)O	{17: 1, 2: 2, 20: 2, 29: 1}
Did not match all atoms present	16674-78-5	CC(=O)[O-].CC(=O)[O-].O.O.O.O.[Mg+2]	{24: 2, 1: 2}
Did not match all atoms present	166773-08-6	C1N(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 11: 1, 35: 1, 14: 15, 15: 1}
Did not match all atoms present	1668-00-4	C1=CC=C(C(=C1)NN=C2C(=CC3=C(C2=O)C(=O)C(=NNC4=CC=CC=C4[As](=O)(O)O)C(=C3)S(=O)(=O)O)S(=O)(=O)O)[As](=O)(O)O	{34: 2, 14: 10, 20: 6, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	1668-19-5	CN(C)CC/C=C/1\C2=CC=CC=C2COC3=CC=CC=C31	{1: 2, 2: 2, 6: 1, 33: 1, 11: 1, 14: 8, 15: 1, 23: 1}
Did not match all atoms present	1668-53-7	CC1=CC(=C(C=C1)C2=NC(=C3C=CC(=O)C=C3O)N=C(N2)C4=C(C=C(C=C4)C)C)C	{32: 1, 1: 4, 35: 2, 14: 9, 15: 5, 20: 1, 25: 1}
Did not match all atoms present	1668-54-8	CC1=NC(=NC(=N1)OC)N	{1: 2, 35: 3, 30: 1, 22: 1}
Did not match all atoms present	16680-47-0	C[C@]12CC[C@H]3C(=CCC4=C3C=CC(=C4)OS(=O)(=O)[O-])[C@@H]1CCC2=O.[Na+]	{1: 1, 11: 5, 12: 2, 13: 1, 14: 4, 15: 1, 22: 1, 25: 1, 29: 3}
Did not match all atoms present	16681-70-2	C1=NNN=C1C(=O)O	{32: 1, 35: 2, 27: 1, 14: 1}
Did not match all atoms present	16681-72-4	CN1C(=NC=N1)Br	{1: 1, 18: 1, 35: 2, 14: 1, 33: 1}
Did not match all atoms present	16681-73-5	CN1C=NN=C1Br	{1: 1, 18: 1, 35: 2, 14: 1, 33: 1}
Did not match all atoms present	16687-42-6	C(=S)(N)[O-].[NH4+]	{30: 1, 7: 1}
Did not match all atoms present	16687-59-5	CCC1=NNN=N1	{32: 1, 1: 1, 2: 1, 35: 3}
Did not match all atoms present	16689-02-4	C1=C(SC(=C1)[N+](=O)[O-])C#N	{41: 1, 38: 1, 37: 1, 14: 2}
Did not match all atoms present	1669-83-6	C1=CC(=CC=C1N(CCI)CCI)S(=O)(=O)N	{33: 1, 2: 4, 14: 4, 19: 2, 29: 2, 30: 1}
Did not match all atoms present	1669-84-7	C1=CC=C(C=C1)N(CCI)CCI	{33: 1, 2: 4, 19: 2, 14: 5}
Did not match all atoms present	1669-98-3	CCS(=O)C	{1: 2, 2: 1, 29: 1}
Did not match all atoms present	16690-44-1	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)OC	{1: 2, 11: 1, 14: 6, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	16690-93-0	C(CN)C(=O)[O-].[Na+]	{24: 1, 2: 2, 30: 1}
Did not match all atoms present	16691-43-3	C1(=NC(=S)NN1)N	{32: 2, 35: 1, 30: 1}
Did not match all atoms present	16696-68-7	CC(=S)C1=CC=CC=C1	{1: 1, 14: 5, 7: 1}
Did not match all atoms present	166964-36-9	C1(=C(SC(=C1Br)Cl)Cl)S(=O)(=O)Cl	{17: 3, 18: 1, 29: 2, 41: 1}
Did not match all atoms present	16699-07-3	CN(C1=CC=C(C=C1)C=C2C=CC3=CC=CC=C32)N=O	{1: 1, 34: 1, 6: 1, 33: 1, 14: 10, 15: 1, 29: 1}
Did not match all atoms present	16699-10-8	CN(C1=CC=C(C=C1)C=CC2=CC=NC3=CC=CC=C23)N=O	{1: 1, 34: 1, 35: 1, 6: 2, 33: 1, 14: 10, 29: 1}
Did not match all atoms present	1670-14-0	C1=CC=C(C=C1)C(=N)N.Cl	{17: 1, 36: 1, 30: 1, 14: 5, 7: 1}
Did not match all atoms present	1670-81-1	C1=CC2=C(C=CN2)C=C1C(=O)O	{32: 1, 27: 1, 14: 5}
Did not match all atoms present	1670-82-2	C1=CC(=CC2=C1C=CN2)C(=O)O	{32: 1, 27: 1, 14: 5}
Did not match all atoms present	16700-97-3	CCCCCCCCCCCCCCCCCCOP(=O)([O-])OCCCCCCCCCCCCCCCCCC.CCCCCCCCCCCCCCCCCCOP(=O)([O-])OCCCCCCCCCCCCCCCCCC.[Zn+2]	{1: 4, 2: 68, 29: 4, 22: 4}
Did not match all atoms present	167004-78-6	CCCCOP(=O)(C)CCC(C#N)OC(=O)C	{1: 3, 2: 5, 3: 1, 37: 1, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	16707-41-8	C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)N4C(=O)C=CC4=O	{25: 2, 35: 1, 33: 1, 14: 10, 23: 1}
Did not match all atoms present	167078-11-7	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=CC(=O)[O-].[K+]	{1: 2, 2: 17, 5: 2, 6: 1, 7: 1, 24: 1, 28: 1}
Did not match all atoms present	167078-21-9	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=CC(=O)O.C(C(=O)[O-])NCO.[Na+]	{1: 2, 2: 19, 5: 2, 6: 1, 7: 1, 20: 1, 24: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	16709-86-7	C[Si](C)(CCl)C=C	{1: 2, 2: 1, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	1671-75-6	CCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 5, 14: 5}
Did not match all atoms present	1671-77-8	CCCCC(=O)C1=CC=C(C=C1)C	{24: 1, 1: 2, 2: 3, 14: 4}
Did not match all atoms present	1671-82-5	CN1C=CN=C1[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 2, 33: 1}
Did not match all atoms present	16712-20-2	[Li+].O.[Cl-]	{17: 1}
Did not match all atoms present	16712-64-4	C1=CC2=C(C=CC(=C2)O)C=C1C(=O)O	{27: 1, 21: 1, 14: 6}
Did not match all atoms present	16713-15-8	CCN(CC)C1=CC=C(C=C1)N.Cl.Cl	{1: 2, 2: 2, 33: 1, 14: 4, 17: 2, 30: 1}
Did not match all atoms present	16714-23-1	COC(=O)C1=CC=CC=C1N=[N+]=[N-]	{1: 1, 34: 2, 28: 1, 14: 4}
Did not match all atoms present	16714-40-2	CC1=CC=CC=C1O[Si](OC2=CC=CC=C2C)(OC3=CC=CC=C3C)OC4=CC=CC=C4C	{1: 4, 22: 4, 14: 16}
Did not match all atoms present	16714-54-8	CC1=CC(=CC=C1)O[Si](OC2=CC=CC(=C2)C)(OC3=CC=CC(=C3)C)OC4=CC=CC(=C4)C	{1: 4, 22: 4, 14: 16}
Did not match all atoms present	16715-79-0	CC(=O)CC(=O)NC1=C(C=C(C=C1)OC)OC	{1: 3, 2: 1, 14: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	16715-80-3	CC(=O)CC(=O)NC1=CC(=C(C=C1OC)OC)Cl	{1: 3, 2: 1, 14: 2, 17: 1, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	16716-11-3	C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC(=CC=C3)C4=CC(=CC=C4)C5=CC=CC(=C5)C6=CC=CC(=C6)C7=CC=CC(=C7)C8=CC=CC=C8	{14: 34}
Did not match all atoms present	16716-13-5	C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC(=CC=C3)C4=CC=CC(=C4)C5=CC=CC=C5	{14: 22}
Did not match all atoms present	16718-05-1	C1=CC=C(C=C1)S(=O)(=O)C2=CSC=C2	{41: 1, 29: 2, 14: 8}
Did not match all atoms present	16719-32-7	C[NH+](CC=C=C)CC1=CC=CC=C1.[Cl-]	{1: 1, 2: 2, 5: 1, 6: 1, 8: 1, 14: 5, 17: 1}
Did not match all atoms present	1672-48-6	C1(=C(NC(=S)NC1=O)N)N=O	{32: 2, 25: 1, 34: 1, 29: 1, 30: 1}
Did not match all atoms present	1672-63-5	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)O	{1: 2, 33: 2, 21: 1, 14: 5, 25: 1}
Did not match all atoms present	16721-45-2	C1=CC=C(C=C1)C=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{14: 20, 6: 1}
Did not match all atoms present	16721-80-5	[Na+].[SH-]	{}
Did not match all atoms present	16722-09-1	C[Si](C)(C)C1CO1	{1: 3, 11: 1, 12: 1, 23: 1}
Did not match all atoms present	16722-32-0	CCCCCCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O	{1: 1, 2: 15, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	16726-67-3	C1=CC2=C(C=CC=C2Br)C(=C1)C(=O)O	{18: 1, 27: 1, 14: 6}
Did not match all atoms present	16727-91-6	CC(C)CC1=CC=CC2=CC=CC=C21	{1: 2, 2: 1, 3: 1, 14: 7}
Did not match all atoms present	16728-01-1	COC1=CC=C(C=C1)C2(CC2)C(=O)O	{1: 1, 11: 2, 13: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	1673-47-8	C1=CC(=CC(=C1)Cl)C(=O)NN	{24: 1, 17: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	1673-59-2	C1=C(OC(=C1)[N+](=O)[O-])C(=O)NNC(=S)N	{38: 1, 7: 1, 14: 2, 23: 1, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	16731-55-8	[O-]S(=O)S(=O)(=O)[O-].[K+].[K+]	{29: 5}
Did not match all atoms present	16731-68-3	CCCCCCCCCCCC1=NC=CN1	{32: 1, 1: 1, 2: 10, 35: 1, 14: 2}
Did not match all atoms present	167316-27-0	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)N	{1: 1, 3: 2, 14: 14, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	16732-57-3	CCOC(=O)C1=CC2=C(N1)C=CC(=C2)[N+](=O)[O-]	{32: 1, 1: 1, 2: 1, 38: 1, 14: 4, 28: 1}
Did not match all atoms present	16733-97-4	[Li+].C1C=CC=[C-]1	{11: 1, 14: 3}
Did not match all atoms present	16734-12-6	[S-][S-]	{}
Did not match all atoms present	16735-69-6	CC1=CC=CC=C1CN=C=S	{8: 1, 1: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	16737-44-3	C1=CC=C(C=C1)OC(OC2=CC=CC=C2)OC3=CC=CC=C3	{3: 1, 22: 3, 14: 15}
Did not match all atoms present	16737-83-0	CCCCCCCCCCCCCCCC1=CC(=CC(=C1C)O)O	{1: 2, 2: 14, 21: 2, 14: 2}
Did not match all atoms present	1674-18-6	C1=CC=C(C=C1)C(=C=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{8: 1, 14: 20, 7: 2}
Did not match all atoms present	1674-30-2	C1=CC=C(C=C1)C(CCl)O	{17: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	1674-37-9	CCCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 6, 14: 5}
Did not match all atoms present	1674-38-0	CCCCCCCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 10, 14: 5}
Did not match all atoms present	1674-96-0	CCN(CC)CCC1(CCC(=O)NC1=O)C2=CC=CC=C2.Cl	{32: 1, 1: 2, 2: 4, 33: 1, 11: 2, 13: 1, 14: 5, 17: 1, 25: 2}
Did not match all atoms present	167412-23-9	C1=C(C=C(C=C1F)F)NC(=O)NN	{16: 2, 24: 1, 30: 1, 14: 3, 31: 2}
Did not match all atoms present	167415-27-2	C1=C(C(=CC(=C1F)Br)F)[N+](=O)[O-]	{16: 2, 18: 1, 38: 1, 14: 2}
Did not match all atoms present	16743-33-2	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.O.O.[Zn+2]	{16: 12, 24: 2, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	16744-98-2	C1=CC=C(C(=C1)N=C=O)F	{8: 1, 16: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	16749-13-6	[PH4+]	{}
Did not match all atoms present	1675-54-3	CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4	{1: 2, 2: 2, 4: 1, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2}
Did not match all atoms present	1675-57-6	C#C[Si](C#C)(C1=CC=CC=C1)C2=CC=CC=C2	{9: 2, 10: 2, 14: 10}
Did not match all atoms present	1675-58-7	C1=CC=C(C=C1)[GeH2]C2=CC=CC=C2	{14: 10}
Did not match all atoms present	1675-59-8	C#C[Ge](C#C)(C1=CC=CC=C1)C2=CC=CC=C2	{9: 2, 10: 2, 14: 10}
Did not match all atoms present	1675-60-1	C[Si](C)(C#C)C#C	{1: 2, 10: 2, 9: 2}
Did not match all atoms present	16752-60-6	O=P12OP3(=O)OP(=O)(O1)OP(=O)(O2)O3	{29: 4, 23: 6}
Did not match all atoms present	16757-80-5	CC1=CC2=CC=CC3=C2C4=C1C5=CC=CC=C5C=C4C=C3	{1: 1, 14: 11}
Did not match all atoms present	16757-81-6	CC1=C2C=CC3=CC4=CC=CC=C4C5=C3C2=C(C=C1)C=C5	{1: 1, 14: 11}
Did not match all atoms present	16757-82-7	CC1=CC2=C3C(=C1)C=CC4=CC5=CC=CC=C5C(=C43)C=C2	{1: 1, 14: 11}
Did not match all atoms present	16757-83-8	CC1=CC2=CC3=CC=CC=C3C4=C2C5=C(C=CC=C15)C=C4	{1: 1, 14: 11}
Did not match all atoms present	16757-84-9	CC1=C2C=CC3=CC4=CC=CC=C4C5=CC(=C(C2=C35)C=C1)C	{1: 2, 14: 10}
Did not match all atoms present	16757-85-0	CC1=C(C2=C3C(=C1)C=CC4=CC5=CC=CC=C5C(=C43)C=C2)C	{1: 2, 14: 10}
Did not match all atoms present	16757-86-1	CC1=CC(=C2C=CC3=C4C2=C1C=CC4=CC5=CC=CC=C35)C	{1: 2, 14: 10}
Did not match all atoms present	16757-87-2	CC1=C(C2=C3C(=C1)C=CC4=C3C(=CC5=CC=CC=C45)C=C2)C	{1: 2, 14: 10}
Did not match all atoms present	16757-88-3	CC1=C2C=CC3=C4C2=C(C=C1)C(=CC4=CC5=CC=CC=C35)C	{1: 2, 14: 10}
Did not match all atoms present	16757-89-4	CC1=C(C2=CC3=CC=CC=C3C4=C2C5=C(C=CC=C15)C=C4)C	{1: 2, 14: 10}
Did not match all atoms present	16757-90-7	CC1=C2C=CC3=C4C2=C(C=C1)C=CC4=C(C5=CC=CC=C35)C	{1: 2, 14: 10}
Did not match all atoms present	16757-91-8	CC1=C2C=CC3=C(C4=CC=CC=C4C5=C3C2=C(C=C1)C=C5)C	{1: 2, 14: 10}
Did not match all atoms present	16757-92-9	CC1=CC(=C2C=CC3=C(C4=CC=CC=C4C5=C3C2=C1C=C5)C)C	{1: 3, 14: 9}
Did not match all atoms present	16758-26-2	C1=CC=C(C=C1)N(C2=CC=CC=C2)[As]Cl	{17: 1, 14: 10, 33: 1}
Did not match all atoms present	16758-28-4	CC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)[N+](=CC=C6)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 14: 28, 24: 3, 29: 6, 31: 3}
Did not match all atoms present	1676-63-7	CCOC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	1676-73-9	C1=CC=C(C=C1)COC(=O)CC[C@@H](C(=O)O)N	{2: 3, 3: 1, 14: 5, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	1676-81-9	COC(=O)[C@H](CO)NC(=O)OCC1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 14: 5, 20: 1, 28: 2, 31: 1}
Did not match all atoms present	16760-11-5	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C)Cl	{1: 4, 33: 2, 14: 27, 17: 1, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	16760-12-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NC3=C[N+](=CC=C3)C)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C	{1: 5, 33: 2, 14: 27, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	16760-13-7	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C)N	{1: 4, 33: 2, 14: 27, 24: 4, 29: 6, 30: 1, 31: 4}
Did not match all atoms present	16760-14-8	CC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CC)N.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 14: 27, 24: 4, 29: 6, 30: 1, 31: 4}
Did not match all atoms present	16760-22-8	CC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 2, 33: 2, 14: 27, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	16760-23-9	CCC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CCC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 4, 33: 2, 14: 27, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	16761-12-9	CCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 5}
Did not match all atoms present	16761-13-0	[Li+].CCCCCCC(=O)[O-]	{24: 1, 1: 1, 2: 5}
Did not match all atoms present	167614-37-1	C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)S(=O)(=O)[O-])N)N.[Na+]	{24: 1, 30: 2, 29: 3, 14: 7, 31: 1}
Did not match all atoms present	167614-38-2	CCOC=O.C(COCCS)OCCS	{1: 1, 2: 7, 26: 1, 22: 2, 39: 2}
Did not match all atoms present	167614-39-3	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=CC(=O)[O-].[NH4+]	{1: 2, 2: 17, 5: 2, 6: 1, 7: 1, 24: 1, 28: 1}
Did not match all atoms present	167614-40-6	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OCC.CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OCC.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+6].[Cu+]	{1: 10, 2: 10, 33: 4, 14: 20, 23: 2, 28: 2}
Did not match all atoms present	167614-41-7	CN(CCCNS(=O)(=O)C1=CC2=C(C=C1)C3=NC4=C5C=C(C=CC5=C([N-]4)NC6=C7C=CC(=CC7=C(N6)N=C8C9=C(C=C(C=C9)S(=O)(=O)[O-])C(=NC2=N3)[N-]8)S(=O)(=O)NCCCN(C)CCO)S(=O)(=O)NCCCN(C)CCO)CCO.[Na+].[Cu+2]	{32: 2, 1: 3, 2: 15, 35: 6, 33: 3, 14: 12, 20: 3, 29: 9, 31: 3}
Did not match all atoms present	16766-27-1	COC1=C(C=C(C=C1)Cl)OC	{1: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	16766-29-3	COC1=CC(=C(C(=C1OC)Cl)Cl)Cl	{1: 2, 22: 2, 14: 1, 17: 3}
Did not match all atoms present	16766-30-6	COC1=C(C=CC(=C1)Cl)O	{1: 1, 22: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	1677-46-9	CN1C2=CC=CC=C2C(=CC1=O)O	{1: 1, 33: 1, 21: 1, 14: 5, 25: 1}
Did not match all atoms present	1677-87-8	CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2=CC=CC=C2	{1: 1, 34: 1, 38: 2, 7: 1, 14: 8, 31: 1}
Did not match all atoms present	16773-42-5	CC1=NC=C(N1CC(CCl)O)[N+](=O)[O-]	{1: 1, 2: 2, 3: 1, 38: 1, 33: 1, 14: 1, 17: 1, 35: 1, 20: 1}
Did not match all atoms present	16778-84-0	COC1=CC=C(C=C1)C(=O)N=C=S	{1: 1, 34: 1, 8: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	1678-25-7	C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2	{29: 2, 14: 10, 31: 1}
Did not match all atoms present	1678-52-0	CCOC(=O)C1=C(C=NC=C1)C(=O)OCC	{1: 2, 2: 2, 35: 1, 28: 2, 14: 3}
Did not match all atoms present	1678-56-4	CN(C)P1(=NP(=NP(=NP(=N1)(N(C)C)N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C)N(C)C	{1: 16, 35: 4, 33: 8}
Did not match all atoms present	16780-62-4	C1C(=O)NC2=CC=CC=C2C=N1	{32: 1, 25: 1, 11: 1, 14: 5, 35: 1}
Did not match all atoms present	16781-80-9	CC1=NC(=C(N1CC(CCl)O)I)[N+](=O)[O-]	{1: 1, 2: 2, 3: 1, 38: 1, 35: 1, 33: 1, 17: 1, 19: 1, 20: 1}
Did not match all atoms present	167832-66-8	COC1=C(C(=CC=C1)OCC2=CC=CC=C2)C#N	{1: 1, 2: 1, 22: 2, 14: 8, 37: 1}
Did not match all atoms present	16784-72-8	CCCCCCCCCC1=CC=CC=C1OP(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC	{1: 3, 2: 24, 22: 3, 14: 12}
Did not match all atoms present	16785-81-2	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[V].[V]	{29: 20}
Did not match all atoms present	16789-84-7	C1=C(C=C(C(=C1Br)O)C=O)[N+](=O)[O-]	{38: 1, 18: 1, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	1679-18-1	B(C1=CC=C(C=C1)Cl)(O)O	{17: 1, 20: 2, 14: 4}
Did not match all atoms present	1679-64-7	COC(=O)C1=CC=C(C=C1)C(=O)O	{1: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	1679-98-7	CCN(CC)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)N(CC)CC	{1: 4, 2: 4, 35: 2, 33: 2, 14: 8, 23: 1}
Did not match all atoms present	16790-49-1	CCCC(=O)NC1=NN=C(S1)S(=O)(=O)N	{1: 1, 2: 2, 35: 2, 41: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	16794-67-5	C1=CC(=CC=C1C(=O)N=C=S)Cl	{8: 1, 17: 1, 34: 1, 14: 4, 24: 1}
Did not match all atoms present	16794-68-6	CC1=CC=C(C=C1)C(=O)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4, 24: 1}
Did not match all atoms present	167940-09-2	C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+]	{34: 1, 14: 8, 15: 2, 25: 1, 29: 12, 30: 1, 31: 1}
Did not match all atoms present	16799-05-6	C1=CC(=CC(=C1)Cl)CCBr	{17: 1, 2: 2, 18: 1, 14: 4}
Did not match all atoms present	1680-11-1	CC1=CC(=NC(=N1)N=[N+]=[N-])N=[N+]=[N-]	{1: 1, 34: 4, 35: 2, 14: 1}
Did not match all atoms present	1680-16-6	CCCCOC(=O)CNC(=O)N1C2=CC=CC=C2N=C1N=[N+]=[N-]	{1: 1, 2: 4, 35: 1, 33: 1, 34: 2, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	1680-44-0	C1=CC=C(C=C1)C2=NNN=C2	{32: 1, 35: 2, 14: 6}
Did not match all atoms present	1680-51-9	CC1=CC2=C(CCCC2)C=C1	{1: 1, 11: 4, 14: 3}
Did not match all atoms present	1680-58-6	CCC(C)C1=CC=CC2=CC=CC=C21	{1: 2, 2: 1, 3: 1, 14: 7}
Did not match all atoms present	16800-47-8	CC#N.CC#N.CC#N.[C-]#[O+].[C-]#[O+].[C-]#[O+].[W]	{1: 3, 29: 3, 37: 3}
Did not match all atoms present	16802-50-9	CC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CC)Cl.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 14: 27, 17: 1, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	16804-70-9	C[C](C)C1=CC=CC=C1	{1: 2, 14: 5, 7: 1}
Did not match all atoms present	16806-93-2	C1CC2=C(C=CO2)C(=O)C1	{25: 1, 11: 3, 14: 2, 23: 1}
Did not match all atoms present	16808-85-8	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)OS(=O)(=O)O	{1: 1, 33: 1, 11: 1, 14: 7, 20: 1, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	1681-10-3	CC1=C2C(=NC(=N1)N)N=CN2	{32: 1, 1: 1, 35: 3, 30: 1, 14: 1}
Did not match all atoms present	1681-15-8	C1=C2C(=NC(=N1)Cl)N=CN2	{32: 1, 17: 1, 35: 3, 14: 2}
Did not match all atoms present	1681-37-4	C1=CN=CC(=C1N)[N+](=O)[O-]	{38: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	16812-54-7	S=[Ni]	{}
Did not match all atoms present	1682-20-8	C1(=C(C(=NC(=C1F)F)F)F)N	{16: 4, 35: 1, 30: 1}
Did not match all atoms present	1682-39-9	C1=CC2=C(C=C1F)N=C(O2)N	{16: 1, 35: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	16822-88-1	C1CN=C([NH2+]1)CC2=C(C=CC(=C2)F)N.[Cl-]	{2: 1, 35: 1, 11: 2, 14: 3, 15: 1, 16: 1, 17: 1, 30: 1}
Did not match all atoms present	16824-02-5	CCOC1C2=CC=CC=C2C(=O)O1	{1: 1, 2: 1, 12: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	16824-81-0	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-].[Zn+2]	{38: 6, 14: 4}
Did not match all atoms present	168267-41-2	B(C1=CC(=C(C=C1)F)F)(O)O	{16: 2, 20: 2, 14: 3}
Did not match all atoms present	16827-63-7	C(=C(\[O-])/C(F)(F)F)\C(=O)C(F)(F)F.C(=C(\[O-])/C(F)(F)F)\C(=O)C(F)(F)F.C(=C(\[O-])/C(F)(F)F)\C(=O)C(F)(F)F.[Ru+3]	{16: 18, 24: 3, 4: 6, 6: 3, 7: 3}
Did not match all atoms present	16828-95-8	N.N.N.N.[Cu+2]	{}
Did not match all atoms present	168297-84-5	CC1([C@@H](NC(=O)O1)C2=CC=CC=C2)C	{32: 1, 1: 2, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	16832-62-5	C1CCCN(CC1)SC2=NC3=CC=CC=C3S2	{33: 1, 35: 1, 40: 1, 41: 1, 11: 6, 14: 4}
Did not match all atoms present	16833-27-5	[O-2]	{}
Did not match all atoms present	16833-52-6	C1(=C(C(=O)C(=O)C(=O)C1=O)[O-])[O-].[Ba+2]	{25: 4}
Did not match all atoms present	16834-57-4	CCOP(=O)(CC1=CC=C(C=C1)N(CCO)CCO)OCC	{1: 2, 2: 7, 33: 1, 14: 4, 20: 2, 22: 2, 29: 1}
Did not match all atoms present	16836-95-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].[Ag+]	{1: 1, 29: 3, 14: 4}
Did not match all atoms present	16839-97-7	COC1=CC=CS1	{1: 1, 22: 1, 14: 3, 41: 1}
Did not match all atoms present	1684-14-6	C1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2C4=CC=CC=C4	{35: 2, 14: 14}
Did not match all atoms present	1684-42-0	CCN(CC)CC(CNC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC)O.Cl.Cl	{1: 3, 2: 4, 3: 1, 33: 1, 14: 6, 17: 3, 35: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	16841-46-6	C1CS(=O)(=O)CC=C1	{11: 3, 29: 2, 14: 2}
Did not match all atoms present	16841-48-8	C=CCS(=O)(=O)CC=C	{2: 2, 5: 2, 6: 2, 29: 2}
Did not match all atoms present	16841-51-3	C1CC=CS(=O)(=O)C1	{11: 3, 29: 2, 14: 2}
Did not match all atoms present	16844-87-4	O=[As]([O-])([O-])O	{20: 1, 29: 3}
Did not match all atoms present	16844-98-7	CCC(=O)O[Si](C)(C)C	{1: 4, 2: 1, 28: 1}
Did not match all atoms present	16844-99-8	CCCC(=O)O[Si](C)(C)C	{1: 4, 2: 2, 28: 1}
Did not match all atoms present	16845-29-7	O.Cl[Ru](Cl)Cl	{17: 3}
Did not match all atoms present	168456-95-9	CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)O)O.C1=CC(=CC=C1C(=O)O)C(=O)O	{1: 4, 2: 2, 3: 2, 4: 1, 14: 12, 20: 2, 22: 2, 27: 2}
Did not match all atoms present	16846-10-9	CC1=CC(=C(C(=C1)O)C(=O)OC)O	{1: 2, 28: 1, 21: 2, 14: 2}
Did not match all atoms present	1685-82-1	CC1=CC(=C2CCCC2=C1)C	{1: 2, 11: 3, 14: 2}
Did not match all atoms present	16851-82-4	C1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2	{33: 1, 29: 2, 14: 9}
Did not match all atoms present	16853-36-4	CNP(=O)(NC)N(C)C	{1: 4, 33: 1, 29: 1, 31: 2}
Did not match all atoms present	16853-85-3	[H-].[H-].[H-].[H-].[Li+].[Al+3]	{}
Did not match all atoms present	168560-79-0	C1CC(C2=C1C=C(C=C2)C(=O)O)(C(=O)O)N	{27: 2, 30: 1, 11: 2, 13: 1, 14: 3}
Did not match all atoms present	16858-02-9	C1=CC=NC(=C1)CN(CCN(CC2=CC=CC=N2)CC3=CC=CC=N3)CC4=CC=CC=N4	{33: 2, 2: 6, 35: 4, 14: 16}
Did not match all atoms present	16867-03-1	C1=CC(=C(N=C1)N)O	{30: 1, 35: 1, 21: 1, 14: 3}
Did not match all atoms present	16867-04-2	C1=CNC(=O)C(=C1)O	{32: 1, 25: 1, 21: 1, 14: 3}
Did not match all atoms present	16869-88-8	C1=CC=C(C=C1)CN2C=C(C(=O)N(C2=O)CC3=CC=CC=C3)N(CCF)CCF	{16: 2, 25: 2, 2: 6, 14: 11, 33: 3}
Did not match all atoms present	1687-51-0	C1=CC=C2C(=C1)C=NC(=N2)N	{35: 2, 30: 1, 14: 5}
Did not match all atoms present	1687-53-2	COC1=C(C=C(C=C1)N)O	{1: 1, 22: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	1687-61-2	CCC1=C(C=C(C=C1)C)O	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	1687-64-5	CCC1=CC=CC(=C1O)C	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	1687-65-6	CCC1=CC(=C(C=C1)C)O	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	16870-90-9	C1=NC2=C(N1[O-])C(=O)NC(=O)[NH2+]2	{32: 1, 33: 1, 35: 1, 14: 1, 25: 2, 29: 1}
Did not match all atoms present	16871-48-0	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sn+4]	{17: 6}
Did not match all atoms present	16871-50-4	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Re+4]	{17: 6}
Did not match all atoms present	16871-54-8	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Pt+4]	{17: 6}
Did not match all atoms present	16871-55-9	[Br-].[Br-].[Br-].[Br-].[Br-].[Br-].[Pt+4]	{18: 6}
Did not match all atoms present	16871-80-0	[N]=O.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sb]	{17: 6, 29: 1}
Did not match all atoms present	16872-09-6	[B]1[B][B][B][B][B]/C=C\[B][B][B][B]1	{14: 2}
Did not match all atoms present	16872-11-0	[H+].[B-](F)(F)(F)F	{16: 4}
Did not match all atoms present	168754-51-6	CCN(CC)CCCNS(=O)(=O)C1=CC2=C(C=C1)C(=O)C3=C(N2)C=C4C(=C3)NC5=C(C4=O)C=CC=C5S(=O)(=O)NCCCN(CC)CC	{32: 2, 1: 4, 2: 10, 33: 2, 14: 8, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	16879-01-9	COC1=CC2=C(C=C1)C(C(CS2)C3=CC=CC=C3)(C4=CC=C(C=C4)OCC[NH+]5CCCC5)O.[Cl-]	{1: 1, 2: 2, 41: 1, 11: 5, 12: 1, 13: 1, 14: 12, 17: 1, 20: 1, 22: 2}
Did not match all atoms present	16879-02-0	C1=CC(=O)NC(=C1)Cl	{32: 1, 17: 1, 14: 3, 25: 1}
Did not match all atoms present	1688-71-7	CCCC(=O)C1=CC=C(C=C1)N	{24: 1, 1: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	16881-77-9	CO[Si](C)OC	{1: 3, 22: 2}
Did not match all atoms present	168811-63-0	COC=O.COC(OC)[Si]CCCNCCN.C[Si]1(O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)C	{1: 11, 2: 5, 3: 1, 22: 2, 23: 4, 26: 1, 30: 1, 31: 1}
Did not match all atoms present	16883-16-2	CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl	{1: 1, 35: 1, 14: 5, 17: 1, 23: 1, 24: 1}
Did not match all atoms present	16883-45-7	[BH4-].C[N+](C)(C)C	{1: 4}
Did not match all atoms present	168833-80-5	C1=CC(=CC(=C1)OC(F)(F)F)C=CC(=O)O	{4: 1, 6: 2, 14: 4, 16: 3, 22: 1, 27: 1}
Did not match all atoms present	16885-99-7	CC(C)N1C=CC2=CC=CC=C21	{1: 2, 3: 1, 14: 6, 33: 1}
Did not match all atoms present	16887-79-9	C1=CN=CC=C1C(=O)[O-].[Na+]	{24: 1, 35: 1, 14: 4}
Did not match all atoms present	1689-64-1	C1=CC=C2C(=C1)C(C3=CC=CC=C32)O	{20: 1, 12: 1, 14: 8}
Did not match all atoms present	1689-73-2	C1=CC=C(C=C1)NC=C2C=CC(=O)C=C2	{25: 1, 31: 1, 14: 9, 6: 1, 15: 1}
Did not match all atoms present	1689-77-6	CC(C)(C)C1=CC=C(S1)C(C)(C)C	{1: 6, 4: 2, 14: 2, 41: 1}
Did not match all atoms present	1689-78-7	CC(C)(C)C1=CC=CS1	{1: 3, 4: 1, 14: 3, 41: 1}
Did not match all atoms present	1689-79-8	CC(C)(C)C1=CSC=C1	{1: 3, 4: 1, 14: 3, 41: 1}
Did not match all atoms present	1689-82-3	C1=CC=C(C=C1)NN=C2C=CC(=O)C=C2	{25: 1, 34: 1, 31: 1, 14: 9, 15: 1}
Did not match all atoms present	1689-83-4	C1=C(C=C(C(=C1I)O)I)C#N	{19: 2, 21: 1, 14: 2, 37: 1}
Did not match all atoms present	1689-84-5	C1=C(C=C(C(=C1Br)O)Br)C#N	{18: 2, 21: 1, 14: 2, 37: 1}
Did not match all atoms present	1689-89-0	C1=C(C=C(C(=C1[N+](=O)[O-])O)I)C#N	{38: 1, 19: 1, 21: 1, 14: 2, 37: 1}
Did not match all atoms present	1689-98-1	CCCCCCCC(=O)OC1=C(C=C(C=C1Cl)C#N)Cl	{1: 1, 2: 6, 37: 1, 14: 2, 17: 2, 28: 1}
Did not match all atoms present	1689-99-2	CCCCCCCC(=O)OC1=C(C=C(C=C1Br)C#N)Br	{1: 1, 2: 6, 37: 1, 14: 2, 18: 2, 28: 1}
Did not match all atoms present	16893-48-4	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)NC4=CC=C(C=C4)S(=O)(=O)O)Cl)S(=O)(=O)O)C5=CC(=C(C=C5Cl)S(=O)(=O)O)Cl	{1: 1, 34: 2, 35: 4, 33: 1, 12: 1, 14: 9, 15: 1, 17: 3, 20: 3, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	16893-49-5	C1=CC=C(C(=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)N)Cl)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 1, 35: 3, 14: 7, 15: 2, 17: 1, 20: 3, 25: 1, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	16893-93-9	[F-].[F-].[F-].[F-].[F-].[F-].[K+].[K+].[Sn+4]	{16: 6}
Did not match all atoms present	16894-10-3	C/C(=C\C(=O)C)/O[Sn](Br)(Br)O/C(=C/C(=O)C)/C	{1: 4, 6: 2, 7: 2, 18: 2, 22: 2, 24: 2}
Did not match all atoms present	16894-32-9	COC1=C(C=CC(=C1)N=NC2=C(C=C3C(=C2O)C=CC(=C3N=NC4=CC(=C(C=C4)O)C(=O)O)N)S(=O)(=O)O)N=NC5=C(C6=C(C(=C(C=C6C=C5S(=O)(=O)O)S(=O)(=O)O)N=NC7=C(C=C(C=C7)N=NC8=C(C=C9C(=C8O)C=CC(=C9N=NC1=CC(=C(C=C1)O)C(=O)O)N)S(=O)(=O)O)C(=O)O)N)O	{1: 1, 34: 12, 14: 20, 20: 4, 21: 5, 22: 1, 27: 3, 29: 8, 30: 3}
Did not match all atoms present	16894-53-4	O.[Cl-].[Cl-].[Sr+2]	{17: 2}
Did not match all atoms present	16899-25-5	CCCCCC1=C2CCCCC2=C3CCCCC3=N1.Cl	{1: 1, 2: 4, 11: 8, 35: 1, 17: 1}
Did not match all atoms present	16899-81-3	CC(C)[NH2+]CC(=O)C1=CC(=C(C=C1)O)O.[Cl-]	{1: 2, 2: 1, 3: 1, 14: 3, 17: 1, 21: 2, 24: 1}
Did not match all atoms present	1690-30-8	CCOC(=O)C1=CC=C(C=C1)N=C2C(C(=NC3=CC=C(C=C3)C(=O)OCC)C2(C)C)(C)C	{1: 6, 2: 2, 34: 2, 13: 2, 14: 8, 15: 2, 28: 2}
Did not match all atoms present	16902-25-3	Cl[Pt-2](Cl)(Cl)(Cl)(Cl)Cl.[Cs+]	{17: 6}
Did not match all atoms present	16903-35-8	Cl.[Au+3].[Cl-].[Cl-].[Cl-]	{17: 4}
Did not match all atoms present	16903-61-0	[B-].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cu+]	{14: 30}
Did not match all atoms present	16905-14-9	[K+].[K+].[I-].[I-].[I-].[I-].[I-].[I-].[Pt+4]	{19: 6}
Did not match all atoms present	16906-37-9	C1=CC=C(C=C1)CSC=CSCC2=CC=CC=C2	{40: 2, 2: 2, 14: 10, 6: 2}
Did not match all atoms present	16909-11-8	COC1=CC(=CC(=C1)/C=C/C(=O)O)OC	{1: 2, 22: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	16909-22-1	CC[N+](CC)(CC)CC.C1=CC=C(C=C1)C(=O)[O-]	{24: 1, 1: 4, 2: 4, 14: 5}
Did not match all atoms present	16909-78-7	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCO)O	{2: 2, 14: 8, 20: 1, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	16910-52-4	[Tm+2]	{}
Did not match all atoms present	16910-54-6	[Eu+2]	{}
Did not match all atoms present	16911-89-0	C1=CC=C(C=C1)SC(=S)Cl	{40: 1, 17: 1, 14: 5, 7: 1}
Did not match all atoms present	16914-68-4	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=C5)C=CC7=CC=CC=C76)C=C3	{14: 18}
Did not match all atoms present	16915-70-1	C1=C(OC(=C1)[N+](=O)[O-])/C=N/NC(=O)C2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-]	{34: 1, 38: 3, 6: 1, 14: 4, 21: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	16919-14-5	F[Nb-](F)(F)(F)(F)F.[K+]	{16: 6}
Did not match all atoms present	16919-18-9	F[P-](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	16919-31-6	[NH4+].[NH4+].F[Zr-2](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	16919-58-7	[NH4+].[NH4+].Cl[Pt-2](Cl)(Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	16919-73-6	Cl[Pd-2](Cl)(Cl)(Cl)(Cl)Cl.[K+].[K+]	{17: 6}
Did not match all atoms present	169198-26-9	CC1=CC=CC(=C1C)C2C3=CC(=CC(=C3OC2=O)C(C)(C)C)C(C)(C)C	{1: 8, 4: 2, 14: 5, 12: 1, 28: 1}
Did not match all atoms present	16920-93-7	[K+].[K+].Br[Pt-2](Br)(Br)(Br)(Br)Br	{18: 6}
Did not match all atoms present	16921-30-5	Cl[Pt-2](Cl)(Cl)(Cl)(Cl)Cl.[K+].[K+]	{17: 6}
Did not match all atoms present	16921-91-8	N#[O+].F[P-](F)(F)(F)(F)F	{16: 6, 29: 1}
Did not match all atoms present	16923-87-8	[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+].[Cs+]	{16: 6, 29: 18}
Did not match all atoms present	16924-00-8	F[Ta-2](F)(F)(F)(F)(F)F.[K+].[K+]	{16: 7}
Did not match all atoms present	16924-32-6	[B]B(C)C	{1: 2}
Did not match all atoms present	16924-51-9	[F-].[F-].[F-].[F-].[F-].[F-].[Na+].[Na+].[Sn+4]	{16: 6}
Did not match all atoms present	169243-86-1	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=C(C=C4)F)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	16925-26-1	[F-].[F-].[F-].[F-].[F-].[F-].[Na+].[Na+].[Zr+4]	{16: 6}
Did not match all atoms present	16925-39-6	[F-].[F-].[F-].[F-].[F-].[F-].[Si+4].[Ca+2]	{16: 6}
Did not match all atoms present	16926-70-8	CCOC(=O)C1=CC=C(C=C1)N=NC2C(=NN(C2=O)C3=CC=CC=C3)C	{1: 2, 2: 1, 35: 1, 33: 1, 12: 1, 34: 2, 14: 9, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	169265-76-3	CC(C)(C)C1=CC=C(C=C1)OC2CCCCC2O	{1: 3, 4: 1, 11: 4, 12: 2, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	16927-06-3	CCOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OCC)C(=O)O	{1: 2, 2: 2, 27: 2, 28: 2, 14: 2}
Did not match all atoms present	1693-28-3	C1=CC=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)C(F)(F)F	{16: 3, 25: 1, 4: 1, 14: 7, 41: 1}
Did not match all atoms present	1693-44-3	C[Si]1(O[Si](O[Si](O[Si](O1)(C)C)(C2=CC=CC=C2)C3=CC=CC=C3)(C)C)C	{1: 6, 14: 10, 23: 4}
Did not match all atoms present	1693-46-5	C[Si]1(O[Si](O[Si](O[Si](O1)(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C	{1: 2, 14: 30, 23: 4}
Did not match all atoms present	1693-47-6	C[Si]1(O[Si](O[Si](O[Si](O1)(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C)C)C	{1: 4, 14: 20, 23: 4}
Did not match all atoms present	1693-51-2	C[Si]1(O[Si](O[Si](O1)(C2=CC=CC=C2)C3=CC=CC=C3)(C)C)C	{1: 4, 14: 10, 23: 3}
Did not match all atoms present	1693-61-4	CC1C2CCC3=C(C2OC1=O)C(=C(C=C3C)OC)C	{1: 4, 11: 2, 12: 3, 14: 1, 22: 1, 28: 1}
Did not match all atoms present	1693-71-6	B(OCC=C)(OCC=C)OCC=C	{2: 3, 22: 3, 5: 3, 6: 3}
Did not match all atoms present	1693-86-3	CCCCCCC1=CSC=C1	{1: 1, 2: 5, 14: 3, 41: 1}
Did not match all atoms present	1693-94-3	CC1=CC(=O)N2C=CC=CC2=N1	{1: 1, 35: 1, 33: 1, 14: 5, 25: 1}
Did not match all atoms present	16932-49-3	COC1=C(C(=CC=C1)OC)C#N	{1: 2, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	169324-83-8	CCCCC(CC)C1=NN2C(=N1)C(=NC3=C(N=C(S3)N(CCCC)CCCC)C4=CC=CC=C4)C(=C(C2=O)C#N)C	{1: 5, 2: 10, 3: 1, 37: 1, 33: 2, 41: 1, 34: 1, 14: 5, 15: 3, 35: 3, 25: 1}
Did not match all atoms present	169331-80-0	C1=CC2=C3C(=C1)C4=CC=CC5=C4C6=C3C7=C2C=CC=C7C8=CC=CC5=C86	{14: 12}
Did not match all atoms present	16939-57-4	C=CC=CC1=CC=CC=C1	{14: 5, 5: 1, 6: 3}
Did not match all atoms present	1694-07-1	COC1=CC=C(C=C1)[Se]C	{1: 2, 22: 1, 14: 4}
Did not match all atoms present	1694-09-3	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](C)C)C=C3)C4=CC=C(C=C4)N(CC)CC5=CC(=CC=C5)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 4, 33: 3, 7: 1, 14: 20, 15: 2, 29: 6}
Did not match all atoms present	1694-57-1	C1=CC=C(C(=C1)C(=O)C2=CC=CC=N2)Cl	{24: 1, 17: 1, 35: 1, 14: 8}
Did not match all atoms present	1694-78-6	C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3	{32: 1, 35: 1, 11: 2, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	1694-92-4	C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)Cl	{17: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	16940-17-3	[B-](OC)(OC)OC.[Na+]	{1: 3, 22: 3}
Did not match all atoms present	16940-66-2	[B-].[Na+]	{}
Did not match all atoms present	16940-81-1	[H+].F[P-](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	16940-92-4	[NH4+].[NH4+].Cl[Ir-2](Cl)(Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	16940-97-9	Cl[Re-2](Cl)(Cl)(Cl)(Cl)Cl.[K+].[K+]	{17: 6}
Did not match all atoms present	16941-10-9	[AlH4-].[AlH4-].[Ca+2]	{}
Did not match all atoms present	16941-11-0	[NH4+].F[P-](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	16941-12-1	Cl.Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Pt+4]	{17: 6}
Did not match all atoms present	16941-15-4	C1=CC=[NH+]C=C1.F[P-](F)(F)(F)(F)F	{16: 6, 32: 1, 14: 5}
Did not match all atoms present	16944-14-2	CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O.C1CCC(CC1)NC2CCCCC2	{1: 3, 2: 1, 3: 1, 4: 1, 11: 10, 12: 2, 14: 4, 21: 1, 27: 1, 28: 1, 31: 2}
Did not match all atoms present	16947-63-0	CC1=CC(=CC(=C1N)C)[N+](=O)[O-]	{1: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	16947-69-6	C1=C(C(=CC(=C1Cl)Cl)Cl)OC(=O)Cl	{17: 4, 28: 1, 14: 2}
Did not match all atoms present	169473-81-8	C(=C/[As](/C=C/Cl)/C=C/Cl)\Cl	{17: 3, 6: 6}
Did not match all atoms present	16949-15-8	[Li+].[B-]	{}
Did not match all atoms present	1695-04-1	COC1=CC=CC=C1OC2=CC=CC=C2	{1: 1, 22: 2, 14: 9}
Did not match all atoms present	16950-06-4	[H+].[F-].[F-].[F-].[F-].[F-].[F-].[Sb]	{16: 6}
Did not match all atoms present	16954-96-4	[2H]C#CC#C[2H]	{9: 2, 10: 2}
Did not match all atoms present	16957-97-4	C1=CC=C2C(=C1)C(=CS2(=O)=O)Br	{18: 1, 29: 2, 14: 5, 15: 1}
Did not match all atoms present	16959-10-7	CC1=CC(=C(C(=C1N=C=O)C)N=C=O)C	{8: 2, 1: 3, 34: 2, 29: 2, 14: 1}
Did not match all atoms present	1696-17-9	CCN(CC)C(=O)C1=CC=CC=C1	{24: 1, 1: 2, 2: 2, 14: 5, 33: 1}
Did not match all atoms present	16960-08-0	CC(C1=CC=CC=C1)C2=CC=C(C=C2)OP(=O)(OC3=CC=C(C=C3)C(C)C4=CC=CC=C4)OC5=CC=C(C=C5)C(C)C6=CC=CC=C6	{1: 3, 3: 3, 22: 3, 14: 27, 29: 1}
Did not match all atoms present	16960-49-9	CCC(=O)C1=CC=C(C=C1)NC(=O)C	{24: 2, 1: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	16960-53-5	[NH4+].[NH4+].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sn+4]	{17: 6}
Did not match all atoms present	16961-80-1	O.O.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]	{16: 6, 29: 18}
Did not match all atoms present	16962-07-5	[B-].[B-].[B-].[Al+3]	{}
Did not match all atoms present	16962-40-6	[NH4+].[NH4+].[F-].[F-].[F-].[F-].[F-].[F-].[Ti+4]	{16: 6}
Did not match all atoms present	16965-08-5	CC(C)(C)OC(=O)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 3, 4: 1, 14: 2, 17: 3}
Did not match all atoms present	16966-40-8	C[Si](C)(C)N=C=[Se]	{8: 1, 1: 3, 34: 1}
Did not match all atoms present	16967-02-5	CCCCCCC#CC1=CC=CC=C1	{1: 1, 2: 5, 10: 2, 14: 5}
Did not match all atoms present	16968-19-7	C1=CC=C(C(=C1)CCC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]	{2: 2, 38: 2, 14: 8}
Did not match all atoms present	16969-10-1	C=CC(=O)OCC(COC1=CC=CC=C1)O	{2: 2, 3: 1, 5: 1, 6: 1, 14: 5, 20: 1, 22: 1, 28: 1}
Did not match all atoms present	1697-34-3	CS(=O)(=O)N1CCOCC1	{1: 1, 33: 1, 11: 4, 29: 2, 23: 1}
Did not match all atoms present	16970-55-1	[H+].[H+].[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2]	{17: 4}
Did not match all atoms present	16970-97-1	[B-](F)(F)(F)F.C[NH2+]C	{16: 4, 1: 2}
Did not match all atoms present	16971-11-2	[NH4+].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ce+3]	{29: 8}
Did not match all atoms present	16971-29-2	[BH4-]	{}
Did not match all atoms present	16971-33-8	[H-].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Ru+2]	{17: 1, 29: 1, 14: 45}
Did not match all atoms present	16971-49-6	N.N.N.N.[Cl-].[Cl-].[Cl-].[Cl-].[Pt+4]	{17: 4}
Did not match all atoms present	16972-61-5	N.N.[Ag+]	{}
Did not match all atoms present	16973-45-8	[As+5].[F-].[F-].[F-].[F-].[F-].[F-]	{16: 6}
Did not match all atoms present	16979-20-7	CC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C	{1: 2, 34: 1, 14: 8, 6: 1}
Did not match all atoms present	16979-36-5	B(=O)O[TlH2]	{29: 1, 22: 1}
Did not match all atoms present	1698-53-9	C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)Cl)Cl	{17: 2, 35: 1, 33: 1, 14: 6, 25: 1}
Did not match all atoms present	1698-60-8	C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)N)Cl	{33: 1, 35: 1, 14: 6, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	1698-80-2	C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC#N	{33: 1, 2: 2, 37: 1, 14: 8, 41: 1}
Did not match all atoms present	16982-00-6	CC1=CC=C(C=C1)[C@@]2(CCCC2(C)C)C	{1: 4, 11: 3, 13: 2, 14: 4}
Did not match all atoms present	16986-24-6	[B]1[B][B][B][B]C2[B]C([B]2)[B][B][B]1	{12: 2}
Did not match all atoms present	16986-83-7	CCC(=O)[O-].CCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	16987-02-3	CC(C(=O)[O-])Cl.[Na+]	{24: 1, 1: 1, 3: 1, 17: 1}
Did not match all atoms present	1699-03-2	C1=CC=C(C=C1)SCC2=CC=CC=C2C(=O)O	{40: 1, 2: 1, 27: 1, 14: 9}
Did not match all atoms present	1699-51-0	CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)OC)OC)OC	{1: 5, 2: 1, 33: 1, 11: 2, 12: 1, 14: 5, 22: 4}
Did not match all atoms present	1699-59-8	C1=CC=C(C=C1)COC2=C(C=C(C=C2)CCl)OCC3=CC=CC=C3	{17: 1, 2: 3, 22: 2, 14: 13}
Did not match all atoms present	16993-94-5	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)C(=O)[O-])C(=O)[O-])N.[Na+].[Na+]	{24: 2, 30: 2, 14: 6}
Did not match all atoms present	16995-14-5	[2H]C([2H])([2H])OCC	{1: 2, 2: 1, 22: 1}
Did not match all atoms present	16996-51-3	CCCCCC=CCC=CCCCCCCCC(=O)[O-].CCCCCC=CCC=CCCCCCCCC(=O)[O-].[Pb+2]	{24: 2, 1: 2, 2: 24, 6: 8}
Did not match all atoms present	16998-91-7	[B-]1N2C=CC=[N+]2[B-][N+]3=CC=CN31	{33: 4, 14: 6}
Did not match all atoms present	16998-93-9	[B-]1N2C=C(C=[N+]2[B-][N+]3=CC(=CN31)Br)Br	{33: 4, 18: 2, 14: 4}
Did not match all atoms present	1700-29-4	COC1=C(C=CC(=C1)CC#N)OCC2=CC=CC=C2	{1: 1, 2: 2, 22: 2, 14: 8, 37: 1}
Did not match all atoms present	1700-30-7	C1=CC=C(C=C1)COC2=CC=CC(=C2)CO	{2: 2, 20: 1, 22: 1, 14: 9}
Did not match all atoms present	1700-37-4	C1=CC=C(C=C1)COC2=CC=CC(=C2)C=O	{2: 1, 26: 1, 22: 1, 14: 9}
Did not match all atoms present	17000-00-9	C[NH3+]	{1: 1}
Did not match all atoms present	17003-70-2	C1=CC=C(C=C1)C([N+](=O)[O-])([N+](=O)[O-])F	{16: 1, 4: 1, 38: 2, 14: 5}
Did not match all atoms present	17005-59-3	C[Si](C)(C)OC1=CC=C(C=C1)Cl	{1: 3, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	17008-69-4	C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2C(=O)[C@@H]([C@]4([C@@]3(CC[C@@H]4C5=COC(=O)C=C5)O)C)O)O	{1: 2, 11: 7, 12: 6, 13: 3, 14: 3, 20: 3, 25: 1, 28: 1}
Did not match all atoms present	1701-69-5	CCC(=O)C1=CC=NC=C1	{24: 1, 1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	1701-71-9	CCCC(=O)C1=CC=NC=C1	{24: 1, 1: 1, 2: 2, 35: 1, 14: 4}
Did not match all atoms present	1701-73-1	CCCCC(=O)C1=CC=NC=C1	{24: 1, 1: 1, 2: 3, 35: 1, 14: 4}
Did not match all atoms present	1701-93-5	C(#N)[S-].[Ag+]	{37: 1}
Did not match all atoms present	17010-21-8	[F-].[F-].[F-].[F-].[F-].[F-].[Si+4].[Cd+2]	{16: 6}
Did not match all atoms present	17010-59-2	CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)N(C)C)Cl	{1: 3, 34: 2, 33: 1, 14: 7, 17: 1}
Did not match all atoms present	17010-60-5	CC1=C(C=C(C=C1)N=NC2=CC=C(C=C2)N(C)C)Cl	{1: 3, 34: 2, 33: 1, 14: 7, 17: 1}
Did not match all atoms present	17010-61-6	CN(C)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)Cl)Cl	{1: 2, 34: 2, 33: 1, 14: 7, 17: 2}
Did not match all atoms present	17010-62-7	CCC1=C(C=C(C=C1)N=NC2=CC=C(C=C2)N(C)C)C	{1: 4, 2: 1, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	17010-63-8	CCC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)N(C)C)C	{1: 4, 2: 1, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	17010-64-9	CCC1=C(C=C(C=C1)N=NC2=CC=C(C=C2)N(C)C)CC	{1: 4, 2: 2, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	17010-65-0	CCC1=CC(=CC=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 2: 1, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	17012-89-4	CC1=CC2=CC3=C(C=CC4=CC=CC=C43)C5=C2C(=C1)CC5	{1: 1, 11: 2, 14: 9}
Did not match all atoms present	17012-91-8	CC(=O)OC(C1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC=C41)OC(=O)C	{1: 2, 3: 1, 28: 2, 14: 11}
Did not match all atoms present	17013-01-3	C(=CC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 6: 2}
Did not match all atoms present	17014-71-0	[O-][O-].[K+].[K+]	{29: 2}
Did not match all atoms present	170141-63-6	CC(=O)C1=CC(=CC=C1)OC(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 22: 1, 24: 1}
Did not match all atoms present	17015-99-5	CC1=C(C(=O)C2=CC=CC=C2C1=O)Cl	{1: 1, 17: 1, 25: 2, 14: 4, 15: 2}
Did not match all atoms present	17016-43-2	CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)OP(=O)(O)O)C(C)C)C(C)C)O	{1: 6, 3: 2, 13: 1, 14: 8, 20: 2, 21: 1, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	17017-66-2	CCOC(=O)C1=CC2=CC=CC=C2N1CC3=CC=CC=C3	{1: 1, 2: 2, 28: 1, 14: 10, 33: 1}
Did not match all atoms present	17017-91-3	C1=C(C(=O)NC(=O)N1)S(=O)(=O)N	{32: 2, 25: 2, 30: 1, 29: 2, 14: 1}
Did not match all atoms present	17018-24-5	CC1=CC=CC=C1N=NC2=CC=C(C=C2)NC	{1: 2, 34: 2, 14: 8, 31: 1}
Did not match all atoms present	17018-66-5	C1=CC=C2C(=C1)C=CC=C2CNCC3=CC=C(C=C3)Cl.Cl	{17: 2, 2: 2, 14: 11, 31: 1}
Did not match all atoms present	1702-17-6	C1=CC(=NC(=C1Cl)C(=O)O)Cl	{17: 2, 27: 1, 14: 2, 35: 1}
Did not match all atoms present	17021-92-0	CO[Si](C)(C)C1=CC=C(C=C1)Br	{1: 3, 18: 1, 22: 1, 14: 4}
Did not match all atoms present	170222-39-6	CN(CCC(=O)OCCN1C(=O)C2=CC=CC=C2C1=O)C3=CC=C(C=C3)N=NC4=C(C=C(C=C4)[N+](=O)[O-])C#N	{1: 1, 2: 4, 37: 1, 38: 1, 33: 2, 34: 2, 14: 11, 25: 2, 28: 1}
Did not match all atoms present	17023-25-5	[Li+].O.O.[I-]	{19: 1}
Did not match all atoms present	17024-03-2	CCCC1=CC2=CC=CC=C2C3=CC=CC=C31	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	17024-17-8	C1=CC=C2C(=C1)C=CC3=C2C=CC=C3[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	17024-18-9	C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	17025-30-8	CN(C)C1=CC=C(C=C1)N=NC2=CC=NC3=CC=CC=C32	{1: 2, 34: 2, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	17025-47-7	C1=CC=C(C=C1)S(=O)(=O)C(Br)(Br)Br	{18: 3, 4: 1, 29: 2, 14: 5}
Did not match all atoms present	17026-29-8	O=[Re].F.F.F.F	{16: 4, 29: 1}
Did not match all atoms present	17026-42-5	C1=CC=C(C=C1)C(=O)OC(C(C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)O	{27: 2, 3: 2, 28: 2, 14: 10}
Did not match all atoms present	17026-47-0	CCCCCCCCCCCCCCCCOP(=O)([O-])OCCCCCCCCCCCCCCCC.[K+]	{1: 2, 2: 30, 29: 2, 22: 2}
Did not match all atoms present	17026-49-2	C1=C(C=C(C(=C1CO)O)CO)Cl	{17: 1, 2: 2, 20: 2, 21: 1, 14: 2}
Did not match all atoms present	17026-81-2	CCOC1=C(C=C(C=C1)NC(=O)C)N	{1: 2, 2: 1, 14: 3, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	17029-21-9	F[Re](F)(F)(F)(F)(F)F	{16: 7}
Did not match all atoms present	1703-46-4	CN(C)C1=CC=C(C=C1)CO	{1: 2, 2: 1, 20: 1, 14: 4, 33: 1}
Did not match all atoms present	1703-52-2	CCC1=CC=C(O1)C	{1: 2, 2: 1, 14: 2, 23: 1}
Did not match all atoms present	170306-62-4	CCOC1=C(C=C2[C@@H]([NH2+]CCC2=C1)CC#N)OCC	{1: 2, 2: 3, 37: 1, 11: 2, 12: 1, 14: 2, 22: 2}
Did not match all atoms present	17031-32-2	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cu+2]	{17: 2, 29: 8}
Did not match all atoms present	17036-31-6	CCCCCCCCOC(=O)/C=C\C(=O)O[Sn](OC(=O)/C=C\C(=O)OCCCCCCCC)(CCCC)CCCC	{1: 4, 2: 20, 28: 4, 6: 4}
Did not match all atoms present	170373-17-8	CC1=CSC(=C1N[C@@H](C)COC)C	{1: 4, 2: 1, 3: 1, 41: 1, 14: 1, 22: 1, 31: 1}
Did not match all atoms present	1704-04-7	C(C[Se]C(=N)[NH3+])[NH3+].[Br-].[Br-]	{2: 2, 36: 1, 18: 2, 7: 1}
Did not match all atoms present	1704-15-0	C1=CC=C(C=C1)C(=CC(=O)C2=CC=CC=C2)O	{24: 1, 20: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	17040-19-6	CCS(=O)(=O)CCSP(=O)(OC)OC	{40: 1, 1: 3, 2: 3, 29: 3, 22: 2}
Did not match all atoms present	17040-79-8	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)O	{34: 2, 20: 1, 29: 2, 14: 13, 31: 1}
Did not match all atoms present	17044-68-7	C1CCCC2=C(CC1)C=CC3=C2CCCCCC3	{11: 12, 14: 2}
Did not match all atoms present	17044-70-1	CC(=O)C1=CC(=C(C(=C1)Cl)O)Cl	{24: 1, 1: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	170449-34-0	C1=CC=NC(=C1)S(=O)(=O)CC#N	{2: 1, 35: 1, 29: 2, 14: 4, 37: 1}
Did not match all atoms present	17048-10-1	CCN(CC)[Si](N(CC)CC)(N(CC)CC)N(CC)CC	{1: 8, 2: 8, 33: 4}
Did not match all atoms present	17049-49-9	CCCCCCC[CH2-].[Mg+2].[Br-]	{1: 1, 2: 6, 18: 1, 5: 1}
Did not match all atoms present	170492-47-4	CS(=O)(=O)C1=CC2=C(C=C1)C=CN2O	{1: 1, 33: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	1705-85-7	CC1=CC2=C(C=CC3=CC=CC=C32)C4=CC=CC=C14	{1: 1, 14: 11}
Did not match all atoms present	1705-89-1	CC1=CC2=C(C=C1)C(=O)C3=CC=CC=C32	{1: 1, 14: 7, 25: 1}
Did not match all atoms present	17050-86-1	CN(C)C1=NC=NC2=C1N=NN2C3CCCC3	{1: 2, 35: 4, 33: 2, 11: 4, 12: 1, 14: 1}
Did not match all atoms present	17050-87-2	CSC1=NC=NC2=C1N=NN2C3CCCC3	{1: 1, 35: 4, 33: 1, 40: 1, 11: 4, 12: 1, 14: 1}
Did not match all atoms present	17050-88-3	C1CCC(C1)N2C3=NC=NC=C3N=N2	{33: 1, 11: 4, 12: 1, 14: 2, 35: 4}
Did not match all atoms present	17051-01-3	CCCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCCC)[O-]	{1: 2, 2: 6, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	170564-98-4	C1=CC=C(C=C1)[C@@H](CCO)N	{2: 2, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	17057-82-8	CC1CC2=CC=CC=C2C1C	{1: 2, 11: 1, 12: 2, 14: 4}
Did not match all atoms present	17057-88-4	CC1=CC(=CC(=C1)C2=CC=CC=C2)C	{1: 2, 14: 8}
Did not match all atoms present	17057-91-9	CC1=CC=CC2=CC(=CC(=C12)C)C	{1: 3, 14: 5}
Did not match all atoms present	17057-98-6	CC1C2=CC=CC=C2C3=C1C(=CC=C3)C	{1: 2, 12: 1, 14: 7}
Did not match all atoms present	17058-12-7	CC1CCCC2=C1NC3=CC=CC=C23	{32: 1, 1: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	17058-53-6	C1=CC=C(C=C1)SC2=CC(=O)C(=CC2=O)SC3=CC=CC=C3	{40: 2, 25: 2, 14: 12, 15: 2}
Did not match all atoms present	17059-44-8	CCCC1=CC=CC(=C1C)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	17059-45-9	CCCC1=C(C=CC=C1C)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	17059-48-2	Cc1ccc2c(c1)C(C)CC2	{1: 2, 11: 2, 12: 1, 14: 3}
Did not match all atoms present	17059-50-6	CCC1=CC2=CC=CC=C2C1	{1: 1, 2: 1, 11: 1, 14: 5, 15: 1}
Did not match all atoms present	17059-52-8	CC1=CC=CC2=C1OC=C2	{1: 1, 14: 5, 23: 1}
Did not match all atoms present	17059-55-1	CCC1=CC2=C(C=CC(=C2)C)C=C1	{1: 2, 2: 1, 14: 6}
Did not match all atoms present	1706-01-0	CC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C43	{1: 1, 14: 9}
Did not match all atoms present	1706-11-2	CC1=CC(=C(C=C1)C)OC	{1: 3, 22: 1, 14: 3}
Did not match all atoms present	1706-69-0	CCCCCCCCC1=C(C=CC(=C1)O)O	{1: 1, 2: 7, 21: 2, 14: 3}
Did not match all atoms present	1706-70-3	CCCCCCCCCCCCCCCCCCC1=C(C=CC(=C1)O)O	{1: 1, 2: 17, 21: 2, 14: 3}
Did not match all atoms present	1706-73-6	C1=CC=C(C=C1)CC2=C(C=CC(=C2)O)O	{2: 1, 21: 2, 14: 8}
Did not match all atoms present	17060-95-6	CC1(C(=O)N(C1(C)C)S(=O)(=O)Cl)C	{1: 4, 33: 1, 13: 2, 17: 1, 25: 1, 29: 2}
Did not match all atoms present	17061-90-4	C#CCOC1=C(C=C(C=C1)Cl)Cl	{2: 1, 9: 1, 10: 1, 14: 3, 17: 2, 22: 1}
Did not match all atoms present	17061-92-6	C#CCOC1=CC=CC=C1Cl	{2: 1, 9: 1, 10: 1, 14: 4, 17: 1, 22: 1}
Did not match all atoms present	17062-87-2	C1=C2C=C(C(=C(C2=C(C(=C1Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 2}
Did not match all atoms present	17064-47-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=C(O3)C=C(C=C4)C5=CC=CC=C5	{35: 1, 14: 17, 23: 1}
Did not match all atoms present	17064-77-6	C1=CC=C(C=C1)N=CC2=CC=CC=C2[N+](=O)[O-]	{34: 1, 38: 1, 14: 9, 6: 1}
Did not match all atoms present	170642-28-1	C=CC[C@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{2: 2, 3: 1, 5: 1, 6: 1, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	17068-20-1	C[Sn]1(C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C31)C	{1: 2, 29: 2, 14: 8}
Did not match all atoms present	17069-38-4	C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].[K+].[K+].[Pt+4]	{37: 6}
Did not match all atoms present	1707-03-5	C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)O	{20: 1, 29: 1, 14: 10}
Did not match all atoms present	1707-14-8	CC1C(OCCN1)C2=CC=CC=C2.Cl	{32: 1, 1: 1, 11: 2, 12: 2, 14: 5, 17: 1, 23: 1}
Did not match all atoms present	1707-67-1	C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=CC=C3Cl)C4=CC=CC=C4	{32: 1, 17: 1, 35: 1, 14: 14}
Did not match all atoms present	1707-68-2	C1=CC=C(C=C1)C2=C(N(C(=N2)C3=CC=CC=C3Cl)N4C(=C(N=C4C5=CC=CC=C5Cl)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8	{17: 2, 35: 2, 14: 28, 33: 2}
Did not match all atoms present	1707-75-1	C1=CC=C(C=C1)N(C2=CC=CC=C2)NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 38: 3, 14: 12, 31: 1}
Did not match all atoms present	1707-92-2	C1=CC=C(C=C1)COP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3	{2: 3, 22: 3, 14: 15, 29: 1}
Did not match all atoms present	1707-95-5	C1C(=C2C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4C1=O	{25: 3, 11: 1, 14: 8, 15: 2}
Did not match all atoms present	17070-07-4	CC(=O)C(=O)[O-].O.[Ca+2]	{24: 2, 1: 1}
Did not match all atoms present	17070-44-9	COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCNCCCl	{1: 1, 2: 5, 35: 1, 14: 6, 17: 2, 22: 1, 31: 2}
Did not match all atoms present	17070-70-1	C[Si](C)(CCCN=C=O)Cl	{1: 2, 2: 3, 8: 1, 34: 1, 17: 1, 29: 1}
Did not match all atoms present	170709-41-8	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C	{1: 2, 3: 2, 29: 4, 14: 18, 31: 2}
Did not match all atoms present	17074-42-9	CC[NH+](CC)CC[NH2+]C1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].[Cl-].[Cl-]	{1: 2, 2: 4, 35: 1, 38: 1, 14: 7, 17: 2}
Did not match all atoms present	17074-44-1	CC[NH+](CC)CCC[NH2+]C1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].[Cl-].[Cl-]	{1: 2, 2: 5, 35: 1, 38: 1, 14: 7, 17: 2}
Did not match all atoms present	17075-03-5	C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)N	{30: 1, 14: 9}
Did not match all atoms present	17075-14-8	CS(=O)(=O)C1=CC=CC=N1	{1: 1, 35: 1, 29: 2, 14: 4}
Did not match all atoms present	17078-27-2	CN(C)C1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)N(C)C	{24: 2, 1: 4, 14: 8, 33: 2}
Did not match all atoms present	1708-39-0	C1C(OC(O1)C2=CC=CC=C2)CO	{2: 1, 11: 1, 12: 2, 14: 5, 20: 1, 23: 2}
Did not match all atoms present	17082-09-6	C1=CC=C(C=C1)C=CC(=O)Cl	{24: 1, 17: 1, 14: 5, 6: 2}
Did not match all atoms present	17082-46-1	C[Si](C)O[Si](C)(O[Si](C)C)O[Si](C)C	{1: 7, 22: 3}
Did not match all atoms present	17082-61-0	C[Si](C)(C)OC1=C(CC1)O[Si](C)(C)C	{1: 6, 11: 2, 22: 2, 15: 2}
Did not match all atoms present	17082-69-8	C1=CC=NC(=C1)CC[Si](Cl)(Cl)Cl	{17: 3, 2: 2, 35: 1, 14: 4}
Did not match all atoms present	17082-70-1	C1=CN=CC=C1CC[Si](Cl)(Cl)Cl	{17: 3, 2: 2, 35: 1, 14: 4}
Did not match all atoms present	17083-85-1	[BH4-].CC[N+](CC)(CC)CC	{1: 4, 2: 4}
Did not match all atoms present	17084-02-5	C(CN(CC(=O)[O-])CC(=O)[O-])N(CCO)CC(=O)[O-].[Fe+3]	{24: 3, 33: 2, 2: 7, 20: 1}
Did not match all atoms present	17084-13-8	F[P-](F)(F)(F)(F)F.[K+]	{16: 6}
Did not match all atoms present	17085-91-5	CC(C)(C)C1=CC=CC2=CC=CC=C21	{1: 3, 4: 1, 14: 7}
Did not match all atoms present	17088-21-0	C=CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1	{14: 9, 5: 1, 6: 1}
Did not match all atoms present	17088-22-1	CCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	17088-28-7	CCOC(=O)C=CC1=CC=C(C=C1)C=CC(=O)OCC	{1: 2, 2: 2, 28: 2, 14: 4, 6: 4}
Did not match all atoms present	17088-72-1	CCCCCCCC[N+](CC)(CC)CCOC(=O)C(C1CCCC1)C2CCCC2.[Br-]	{1: 3, 2: 11, 3: 1, 11: 8, 12: 2, 18: 1, 28: 1}
Did not match all atoms present	1709-39-3	CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N	{1: 2, 2: 2, 33: 1, 14: 4, 29: 2, 30: 1}
Did not match all atoms present	1709-44-0	C1=CC(=CC(=C1)N)C=O	{26: 1, 30: 1, 14: 4}
Did not match all atoms present	1709-50-8	CCN(CC)S(=O)(=O)C1=CC=CC=C1	{1: 2, 2: 2, 29: 2, 14: 5, 33: 1}
Did not match all atoms present	1709-59-7	CN(C)S(=O)(=O)C1=CC=C(C=C1)N	{1: 2, 30: 1, 29: 2, 14: 4, 33: 1}
Did not match all atoms present	1709-63-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=O)C=CC3=O	{25: 4, 14: 6}
Did not match all atoms present	1709-70-2	CC1=C(C(=C(C(=C1CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C)CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C)CC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C	{1: 21, 2: 3, 4: 6, 21: 3, 14: 6}
Did not match all atoms present	17091-31-5	C1CCC(=O)[N-]CC1.[Mg+2].[Br-]	{25: 1, 18: 1, 11: 5, 35: 1}
Did not match all atoms present	17091-45-1	CC1=CSC(=[N+]1CC2=CC=CC=C2)C.[Br-]	{1: 2, 2: 1, 33: 1, 41: 1, 14: 6, 18: 1}
Did not match all atoms present	170918-42-0	CC1([C@H](NC(=O)O1)C2=CC=CC=C2)C	{32: 1, 1: 2, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	170924-52-4	C1=CC(=C(C(=C1)Cl)CS)F	{16: 1, 17: 1, 2: 1, 14: 3, 39: 1}
Did not match all atoms present	17095-24-8	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 4, 34: 3, 14: 10, 15: 2, 22: 2, 25: 1, 29: 16, 30: 1, 31: 1}
Did not match all atoms present	17096-07-0	CC(=C)C(=O)OCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 10, 2: 3, 5: 1, 7: 1, 22: 3, 28: 1}
Did not match all atoms present	17096-15-0	C1=CC=C2C(=C1)C=CC(=C2SC3=C(C=CC4=CC=CC=C43)O)O	{40: 1, 21: 2, 14: 12}
Did not match all atoms present	17096-47-8	CN(CCO[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 22: 1, 33: 1}
Did not match all atoms present	17097-76-6	CC(C)(CO)[C@H](C(=O)NCCCC(=O)[O-])O.CC(C)(CO)[C@H](C(=O)NCCCC(=O)[O-])O.[Ca+2]	{1: 4, 2: 8, 3: 2, 4: 2, 20: 4, 24: 4, 31: 2}
Did not match all atoms present	17099-80-8	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Cr+3]	{24: 3, 33: 2, 2: 6, 27: 1}
Did not match all atoms present	17099-81-9	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Fe+3]	{24: 3, 33: 2, 2: 6, 27: 1}
Did not match all atoms present	1710-98-1	CC(C)(C)C1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 3, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	17100-11-7	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Al+3]	{24: 3, 33: 2, 2: 6, 27: 1}
Did not match all atoms present	17108-85-9	[Cl-].[Cl-].[Cl-].[Ga+3]	{17: 3}
Did not match all atoms present	17109-49-8	CCOP(=O)(SC1=CC=CC=C1)SC2=CC=CC=C2	{1: 1, 2: 1, 40: 2, 14: 10, 22: 1, 29: 1}
Did not match all atoms present	1711-02-0	C1=CC(=CC=C1C(=O)Cl)I	{24: 1, 17: 1, 19: 1, 14: 4}
Did not match all atoms present	1711-05-3	COC1=CC=CC(=C1)C(=O)Cl	{24: 1, 1: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	1711-06-4	CC1=CC=CC(=C1)C(=O)Cl	{24: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	1711-07-5	C1=CC(=CC(=C1)F)C(=O)Cl	{16: 1, 17: 1, 14: 4, 24: 1}
Did not match all atoms present	1711-09-7	C1=CC(=CC(=C1)Br)C(=O)Cl	{24: 1, 17: 1, 18: 1, 14: 4}
Did not match all atoms present	1711-11-1	C1=CC(=CC(=C1)C(=O)Cl)C#N	{24: 1, 17: 1, 37: 1, 14: 4}
Did not match all atoms present	1711-42-8	C1=CC(=C(C(=C1C(=O)O)OO)OO)C(=O)O	{27: 2, 20: 2, 22: 2, 14: 2}
Did not match all atoms present	17110-51-9	CCCCCCCCC=CCCCCCCCCOC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 18, 3: 2, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1}
Did not match all atoms present	17112-07-1	C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Fe+2]	{16: 12, 35: 6, 14: 24}
Did not match all atoms present	17112-82-2	C1=CC=C2C(=C1)C=CC=C2CN=C=S	{8: 1, 2: 1, 34: 1, 14: 7}
Did not match all atoms present	17113-33-6	C1=CC=C(C=C1)C2=CC=CO2	{14: 8, 23: 1}
Did not match all atoms present	17113-79-0	CSC1=CC=C(C=C1)[Sn](C)(C)C	{40: 1, 1: 4, 14: 4}
Did not match all atoms present	17114-45-3	F[Fe]F.F[Fe](F)(F)F	{16: 6}
Did not match all atoms present	17114-78-2	CC(C)(C)C1C2=CC=CC=C2C3=CC=CC=C13	{1: 3, 4: 1, 14: 8, 12: 1}
Did not match all atoms present	17115-98-9	CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].[Ca+2].[Ca+2].[Ba+2]	{24: 6, 1: 6, 2: 6}
Did not match all atoms present	17116-13-1	F[Ti-2](F)(F)(F)(F)F.[Na+].[Na+]	{16: 6}
Did not match all atoms present	17117-34-9	C1=CC=C2C(=C1)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O	{25: 1, 38: 1, 14: 9}
Did not match all atoms present	1712-64-7	CC(C)O[N+](=O)[O-]	{1: 2, 3: 1, 22: 1}
Did not match all atoms present	1712-69-2	CC(=C)C1=CC=C(C=C1)OC	{1: 2, 22: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1712-70-5	CC(=C)C1=CC=C(C=C1)Cl	{1: 1, 17: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1712-71-6	CC(=C)C1=CC(=CC=C1)Cl	{1: 1, 17: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1712-74-9	CCOC(C)(C)C1=CC=CC=C1	{1: 3, 2: 1, 4: 1, 22: 1, 14: 5}
Did not match all atoms present	17122-21-3	C1=CC(=CC(=C1)[N+](=O)[O-])N=O	{34: 1, 38: 1, 29: 1, 14: 4}
Did not match all atoms present	17122-74-6	CCOC1=CC=C(C=C1)NC(=O)/C=N/O	{1: 1, 2: 1, 6: 1, 34: 1, 14: 4, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	17124-74-2	CCN(CC)CCSC(=NC1=CC=CC=C1)N.Br.Br	{1: 2, 2: 4, 33: 1, 7: 1, 40: 1, 34: 1, 14: 5, 18: 2, 30: 1}
Did not match all atoms present	171243-30-4	C1=C(C=C(C=C1C(F)(F)F)F)C(=O)Cl	{16: 4, 17: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	17125-84-7	[H+].[H+].C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Pd+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	17126-62-4	CCOC(=O)CCN=C=S	{8: 1, 1: 1, 2: 3, 28: 1, 34: 1}
Did not match all atoms present	17126-65-7	CCOC(=O)CCCN=C=S	{8: 1, 1: 1, 2: 4, 28: 1, 34: 1}
Did not match all atoms present	17126-75-9	COC1=CC=CC(=C1)N(CCO)CCO	{1: 1, 2: 4, 33: 1, 14: 4, 20: 2, 22: 1}
Did not match all atoms present	1713-07-1	CC(=O)NC1=C(C(=C(C(=C1I)N)I)C(=O)O)I	{1: 1, 19: 3, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	1713-15-1	CC(C)COC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 2, 3: 1, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	17132-74-0	CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@@H]6C7=CC(=C(C=C7CCN6C)OC)O3)OC)O)OC	{1: 5, 33: 2, 11: 6, 12: 2, 14: 10, 21: 1, 22: 3, 23: 2}
Did not match all atoms present	17135-78-3	C1=CC=C2C=C3C=C(C=CC3=CC2=C1)Cl	{17: 1, 14: 9}
Did not match all atoms present	17138-28-2	CCOC(=O)CC1=CC=C(C=C1)O	{1: 1, 2: 2, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	1714-29-0	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)Br	{18: 1, 14: 9}
Did not match all atoms present	17140-68-0	CCN(CC)CCN1C=NC2=C1C(=O)N(C(=O)N2C)C.Cl	{1: 4, 2: 4, 35: 1, 33: 4, 14: 1, 17: 1, 25: 2}
Did not match all atoms present	17140-78-2	CCC(=O)O[C@](CC1=CC=CC=C1)(C2=CC=CC=C2)[C@H](C)CN(C)C.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O	{1: 4, 2: 3, 3: 1, 4: 1, 33: 1, 14: 17, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	17140-81-7	C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)[N+](=O)[O-].O	{32: 1, 33: 1, 34: 1, 38: 1, 6: 1, 11: 1, 14: 2, 23: 1, 25: 2}
Did not match all atoms present	17140-86-2	C(CC(=O)[O-])C(C(=O)O)N.[NH4+]	{24: 1, 27: 1, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	17141-41-2	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Pd+4]	{17: 6}
Did not match all atoms present	171429-97-3	[Li+].C1=CC(=CC=C1C(=O)O)C(=O)O.C1=C(C=C(C=C1C(=O)OCCO)S(=O)(=O)[O-])C(=O)OCCO.C(CO)O	{2: 6, 14: 7, 20: 4, 27: 2, 28: 2, 29: 3}
Did not match all atoms present	17146-08-6	C[Si](C)(CCC1=CC=CC=C1)Cl	{1: 2, 2: 2, 14: 5, 17: 1}
Did not match all atoms present	17146-09-7	C[Si](C)(CCCC1=CC=CC=C1)Cl	{1: 2, 2: 3, 14: 5, 17: 1}
Did not match all atoms present	17146-95-1	CC1[C@@H]2CC3=C([C@]1(CCN2CC=C(C)C)C)C=C(C=C3)O.CC(C(=O)O)O	{1: 5, 2: 1, 3: 1, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 13: 1, 14: 3, 20: 1, 21: 1, 27: 1}
Did not match all atoms present	17148-49-1	COC1=NC=C(C=N1)F	{16: 1, 1: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	1715-33-9	CC12CC(C3C(C1CCC2(C(=O)COC(=O)CCC(=O)[O-])O)CCC4=CC(=O)C=CC34C)O.[Na+]	{1: 2, 2: 3, 11: 5, 12: 4, 13: 3, 14: 3, 15: 1, 20: 2, 24: 2, 25: 1, 28: 1}
Did not match all atoms present	1715-81-7	C1C2=C(C(=CC=C2)O)C(=O)C3=CC=CC=C31	{25: 1, 11: 1, 21: 1, 14: 7}
Did not match all atoms present	17151-09-6	C[Si](C)(C)C1=CC=CC=C1[Si](C)(C)C	{1: 6, 14: 4}
Did not match all atoms present	17151-27-8	CCO[Si](C)(C)CC1=CC=CC=C1	{1: 3, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	17154-34-6	C[Si](C)(C)P(C1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 14: 10}
Did not match all atoms present	17156-61-5	C[Si](C)(C)C1=CC(=C(C=C1[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	{1: 12, 14: 2}
Did not match all atoms present	17156-62-6	C[Si](C)(C)C1(C=CC(C=C1)([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	{1: 12, 13: 2, 14: 4}
Did not match all atoms present	17156-64-8	C[Si](C)(C#C)C1=CC=CC=C1	{1: 2, 10: 1, 14: 5, 9: 1}
Did not match all atoms present	17158-48-4	C[Si]1(CCC2=CC=CC=C21)C	{1: 2, 11: 2, 14: 4}
Did not match all atoms present	171599-83-0	CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{32: 1, 1: 4, 2: 5, 35: 2, 4: 1, 33: 3, 11: 4, 14: 3, 20: 1, 22: 1, 25: 1, 27: 3, 29: 2}
Did not match all atoms present	1716-09-2	CCOP(=S)(OCC)OC1=CC(=C(C=C1)SC)C	{40: 1, 1: 4, 2: 2, 22: 3, 14: 3}
Did not match all atoms present	1716-42-3	C1=CC(=CC=C1OCCCCl)F	{16: 1, 17: 1, 2: 3, 22: 1, 14: 4}
Did not match all atoms present	17164-77-1	C1=CC=C2C=C(C=CC2=C1)C3=CC4=CC=CC=C4S3	{41: 1, 14: 12}
Did not match all atoms present	17166-36-8	C=C=CP(=O)(Cl)Cl	{8: 1, 17: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	17167-98-5	CSC1=CC=C(C=C1)C(C(CO)N)O	{1: 1, 2: 1, 3: 2, 40: 1, 14: 4, 20: 2, 30: 1}
Did not match all atoms present	17169-61-8	[O-]P(=O)([O-])[O-].[Ca+2].[Ni+2]	{29: 4}
Did not match all atoms present	17171-74-3	CCCCC1=CC(=CC=C1)CCCC	{1: 2, 2: 6, 14: 4}
Did not match all atoms present	17174-98-0	C1=CC=C(C(=C1)C#N)C(=O)N	{24: 1, 30: 1, 14: 4, 37: 1}
Did not match all atoms present	17178-00-6	CC1=C(C=CC(=C1)Cl)S	{1: 1, 39: 1, 14: 3, 17: 1}
Did not match all atoms present	17178-10-8	CC1=CC=C(C=C1)S(=O)(=O)OCCOC	{1: 2, 2: 2, 22: 2, 14: 4, 29: 2}
Did not match all atoms present	17179-41-8	CCC1=CC2=CC=CC=C2C(=C1)C	{1: 2, 2: 1, 14: 6}
Did not match all atoms present	1718-34-9	C1=CC(=CC=C1N/N=C\2/C=CC(=O)C(=C2)C(=O)[O-])[N+](=O)[O-].[Na+]	{34: 1, 38: 1, 14: 7, 15: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	1718-50-9	C1=CC=C(C=C1)CCCCCC2=CC=CC=C2	{2: 5, 14: 10}
Did not match all atoms present	1718-51-0	[2H]C1=C(C(=C(C(=C1[2H])[2H])C2=C(C(=C(C(=C2[2H])[2H])C3=C(C(=C(C(=C3[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H]	{14: 14}
Did not match all atoms present	171809-19-1	C1=C(C=C(C(=C1[N+](=O)[O-])CO)[N+](=O)[O-])CO	{2: 2, 20: 2, 38: 2, 14: 2}
Did not match all atoms present	17181-37-2	[O-][Si]([O-])([O-])[O-]	{29: 4}
Did not match all atoms present	17181-49-6	CC1=CC=CC=C1OCC(COC2=CC=CC=C2C)O	{1: 2, 2: 2, 3: 1, 14: 8, 20: 1, 22: 2}
Did not match all atoms present	17185-29-4	[H-].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Rh]	{29: 1, 14: 45}
Did not match all atoms present	171850-29-6	C1=CNC2=CC(=CC(=C2C1=O)Cl)Cl	{32: 1, 17: 2, 14: 4, 25: 1}
Did not match all atoms present	171850-30-9	C1=C(C=C2C(=C1Cl)C(=O)C(=CN2)C(=O)O)Cl	{32: 1, 17: 2, 27: 1, 14: 3, 25: 1}
Did not match all atoms present	17186-60-6	CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC	{1: 2, 2: 1, 3: 1, 14: 5, 24: 2, 31: 2}
Did not match all atoms present	1719-06-8	[2H]C1=C(C(=C2C(=C3C(=C(C(=C(C3=C(C2=C1[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H]	{14: 10}
Did not match all atoms present	1719-53-5	CC[Si](CC)(Cl)Cl	{1: 2, 2: 2, 17: 2}
Did not match all atoms present	1719-57-9	C[Si](C)(CCl)Cl	{1: 2, 2: 1, 17: 2}
Did not match all atoms present	17192-80-2	CC1=CC=C(C=C1)SC2=C(C=C(C(=C2)OC)[N+]#N)OC.CC1=CC=C(C=C1)SC2=C(C=C(C(=C2)OC)[N+]#N)OC.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 6, 34: 2, 40: 2, 14: 12, 17: 4, 22: 4}
Did not match all atoms present	17194-00-2	[OH-].[OH-].[Ba+2]	{}
Did not match all atoms present	17194-82-0	C1=CC(=CC=C1CC(=O)N)O	{24: 1, 2: 1, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	17196-12-2	C[Si](C)(CCCCCCC=C)Cl	{1: 2, 2: 6, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	17199-24-5	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)Cl	{1: 5, 2: 1, 4: 2, 14: 3, 17: 1, 21: 1}
Did not match all atoms present	17199-29-0	C1=CC=C(C=C1)[C@@H](C(=O)O)O	{27: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	17199-54-1	CC[C@H](C(C[C@@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2)O	{1: 4, 2: 2, 3: 2, 4: 1, 33: 1, 14: 10, 20: 1}
Did not match all atoms present	17199-58-5	CC[C@H](C(C[C@@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C	{1: 5, 2: 2, 3: 2, 4: 1, 33: 1, 14: 10, 28: 1}
Did not match all atoms present	1720-32-7	C1=CC=C(C=C1)C=CC=CC=CC2=CC=CC=C2	{14: 10, 6: 6}
Did not match all atoms present	17200-29-2	C1=CC2=C(C=C1Cl)N=CO2	{17: 1, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	17201-43-3	C1=CC(=CC=C1CBr)C#N	{2: 1, 18: 1, 14: 4, 37: 1}
Did not match all atoms present	17202-49-2	C1=CC(=CC=C1C(=O)O)S(=O)(=O)N=[N+]=[N-]	{34: 2, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	17203-53-1	[CH2]CC1=CC=CC=C1	{2: 1, 5: 1, 14: 5}
Did not match all atoms present	17203-66-6	CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].[Ca+2].[Ca+2].[Pb+2]	{24: 6, 1: 6, 2: 6}
Did not match all atoms present	17206-03-0	C[N+](C)(CC1=CNC2=CC=CC=C21)[O-]	{32: 1, 1: 2, 2: 1, 29: 1, 14: 5}
Did not match all atoms present	17209-60-8	[F-].[Eu]	{16: 1}
Did not match all atoms present	17209-70-0	CCCCCCCC/C=C\CCCCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 15, 22: 1, 6: 2, 29: 3}
Did not match all atoms present	17209-76-6	CCCCOC(=O)C=CC(=O)O[Sn](CCCC)(CCCC)OC(=O)C=CC(=O)OCCCC	{1: 4, 2: 12, 28: 4, 6: 4}
Did not match all atoms present	1721-26-2	CCOC(=O)C1=C(N=CC=C1)C	{1: 2, 2: 1, 35: 1, 28: 1, 14: 3}
Did not match all atoms present	1721-89-7	CC1=CC2=CC=CC=C2N=C1C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	1721-93-3	CC1=NC=CC2=CC=CC=C12	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	17210-48-9	COC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)N)OC	{1: 2, 30: 1, 34: 2, 22: 2, 14: 7}
Did not match all atoms present	17213-57-9	COC1=CC(=CC(=C1)C(=O)Cl)OC	{24: 1, 1: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	17213-58-0	COC1=CC(=CC(=C1)C(=O)N)OC	{24: 1, 1: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	17215-44-0	C1=C(C(=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])C2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])N)[N+](=O)[O-])[N+](=O)[O-]	{38: 6, 30: 2, 14: 2}
Did not match all atoms present	17216-08-9	CC(=O)C1CCC2=CC=CC=C2C1=O	{1: 1, 11: 2, 12: 1, 14: 4, 24: 1, 25: 1}
Did not match all atoms present	17217-57-1	COC1=CC(=NC=C1)C2=NC=CC(=C2)OC	{1: 2, 35: 2, 22: 2, 14: 6}
Did not match all atoms present	17218-47-2	[F-].[F-].[F-].[F-].[F-].[K+].[Ni]	{16: 5}
Did not match all atoms present	1722-10-7	COC1=NN=C(C=C1)Cl	{1: 1, 35: 2, 22: 1, 14: 2, 17: 1}
Did not match all atoms present	1722-12-9	C1=CN=C(N=C1)Cl	{17: 1, 35: 2, 14: 3}
Did not match all atoms present	1722-26-5	[B].CCN(CC)CC	{1: 3, 2: 3, 33: 1}
Did not match all atoms present	1722-62-9	CC1=C(C(=CC=C1)C)NC(=O)C2CCCCN2C.Cl	{1: 3, 33: 1, 11: 4, 12: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	17222-37-6	[2H]C([2H])([2H])OC([2H])([2H])[2H]	{1: 2, 22: 1}
Did not match all atoms present	17228-63-6	CN1C(=O)C=CC=C1Cl	{1: 1, 25: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	17228-64-7	COC1=NC(=CC=C1)Cl	{1: 1, 35: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	1723-34-8	CC1=CSC2=C1C=CS2	{1: 1, 14: 3, 41: 2}
Did not match all atoms present	17230-87-4	C1C[NH+](CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)CCCC(=O)C3=CC=C(C=C3)F.[Cl-]	{2: 3, 4: 1, 11: 4, 13: 1, 14: 7, 16: 4, 17: 2, 20: 1, 24: 1}
Did not match all atoms present	17230-88-5	CC12CCC3C(C1CCC2(C#C)O)CCC4=CC5=C(CC34C)C=NO5	{1: 2, 35: 1, 9: 1, 10: 1, 11: 7, 12: 3, 13: 3, 14: 2, 15: 1, 20: 1, 23: 1}
Did not match all atoms present	17231-94-6	C1=C(C=C(C=C1Cl)Cl)S	{17: 2, 14: 3, 39: 1}
Did not match all atoms present	17231-95-7	C1=CC(=C(C(=C1)Cl)Cl)S	{17: 2, 14: 3, 39: 1}
Did not match all atoms present	17236-22-5	C1CS(=O)(=O)CC1I	{19: 1, 11: 3, 12: 1, 29: 2}
Did not match all atoms present	17236-58-7	C1=CSC(=C1)O	{41: 1, 21: 1, 14: 3}
Did not match all atoms present	17241-59-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)CO	{25: 2, 2: 1, 20: 1, 14: 7}
Did not match all atoms present	17242-52-3	[NH2-].[K+]	{}
Did not match all atoms present	17242-85-2	C[Si](C)(C)OC1=NC(=NC=C1F)O[Si](C)(C)C	{16: 1, 1: 6, 35: 2, 22: 2, 14: 1}
Did not match all atoms present	17243-39-9	CNCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24	{1: 1, 2: 1, 11: 2, 12: 1, 13: 1, 14: 8, 31: 1}
Did not match all atoms present	17249-75-1	C1=C(SC=C1Cl)Cl	{17: 2, 14: 2, 41: 1}
Did not match all atoms present	17249-76-2	C1=C(C(=CS1)Cl)Cl	{17: 2, 14: 2, 41: 1}
Did not match all atoms present	17249-77-3	C1=C(SC(=C1Cl)Cl)Cl	{17: 3, 14: 1, 41: 1}
Did not match all atoms present	17249-78-4	C1=C(C(=C(S1)Cl)Cl)Cl	{17: 3, 14: 1, 41: 1}
Did not match all atoms present	17249-79-5	C1=CSC(=C1Cl)Cl	{17: 2, 14: 2, 41: 1}
Did not match all atoms present	17249-80-8	C1=CSC=C1Cl	{17: 1, 14: 3, 41: 1}
Did not match all atoms present	17249-82-0	CC1=CC=C(S1)Cl	{1: 1, 41: 1, 14: 2, 17: 1}
Did not match all atoms present	17250-25-8	[H-].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ir]	{29: 1, 14: 45}
Did not match all atoms present	17252-51-6	C1=CN=CC=C1CCCC2=CC=NC=C2	{2: 3, 35: 2, 14: 8}
Did not match all atoms present	17252-77-6	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]	{1: 2, 2: 6}
Did not match all atoms present	17257-71-5	CO[C@@](C1=CC=CC=C1)(C(=O)O)C(F)(F)F	{1: 1, 4: 2, 14: 5, 16: 3, 22: 1, 27: 1}
Did not match all atoms present	1726-12-1	CCCCC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 3, 3: 1, 14: 10}
Did not match all atoms present	1726-14-3	CCC=C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	1726-65-4	CCCCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC	{1: 3, 2: 45}
Did not match all atoms present	1726-66-5	CCCCCCCCCC[Al](CCCCCCCCCC)CCCCCCCCCC	{1: 3, 2: 27}
Did not match all atoms present	1726-77-8	CCCCCCCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 6, 38: 2, 6: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	1726-94-9	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N=C=S	{8: 1, 34: 1, 4: 1, 14: 15}
Did not match all atoms present	17260-71-8	C1=CC(=CC(=C1)Cl)S(=O)(=O)N	{17: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	17261-28-8	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C(=O)O	{27: 1, 14: 14}
Did not match all atoms present	17263-64-8	CC1=CC=C(C=C1)C(=C[N+]#N)[O-]	{1: 1, 34: 1, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	17265-13-3	C(CCCC(=O)[O-])CCCC(=O)[O-].[Na+].[Na+]	{24: 2, 2: 7}
Did not match all atoms present	17267-51-5	CNC1=NN=NN1C	{1: 2, 35: 3, 33: 1, 31: 1}
Did not match all atoms present	17271-70-4	CC=CC1=CC(=CC=C1)C	{1: 2, 14: 4, 6: 2}
Did not match all atoms present	17272-45-6	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[La+3]	{17: 3}
Did not match all atoms present	17272-46-7	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Pr+3]	{17: 3}
Did not match all atoms present	17274-12-3	C1=C(C=C(C(=C1I)I)C(=O)[O-])I.[Na+]	{24: 1, 19: 3, 14: 2}
Did not match all atoms present	17277-58-6	COC(=O)CSC1=CC=CC=C1	{40: 1, 1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	17278-93-2	CC1=CC=CC2=CC3=C(C=C12)C4=CC=CC=C4C5=CC=CC=C53	{1: 1, 14: 13}
Did not match all atoms present	17279-30-0	C[C@@H](C1=CC=CC=C1)N.Cl	{1: 1, 3: 1, 30: 1, 14: 5, 17: 1}
Did not match all atoms present	17279-31-1	C[C@@H](C1=CC=CC=C1)N(C)C	{1: 3, 3: 1, 14: 5, 33: 1}
Did not match all atoms present	17282-00-7	CC1=CC(=C(N=C1)N)Br	{1: 1, 18: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	17283-75-9	CCCCCCCCCCCCCCCCCC(=O)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]	{24: 1, 1: 7, 2: 16, 3: 3, 29: 3}
Did not match all atoms present	17284-75-2	CCCCNC1=CC(=C(C=C1)C(=O)OCCN(C)C)O.Cl	{1: 3, 2: 5, 33: 1, 14: 3, 17: 1, 21: 1, 28: 1, 31: 1}
Did not match all atoms present	172890-93-6	[Li+].CC(C)(CNC1=CC(=C(C2=C1C(=O)C3=CC=CC=C3C2=O)N)S(=O)(=O)[O-])CNC4=NC(=NC(=N4)NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+]	{1: 2, 2: 2, 35: 3, 4: 1, 14: 8, 17: 1, 25: 2, 29: 9, 30: 1, 31: 3}
Did not match all atoms present	17292-62-5	C(#N)[NH-].[Na+]	{36: 1, 37: 1}
Did not match all atoms present	17295-26-0	CC(=O)OC1=CC2=C(C=C1)C=C(C=C2)C(=O)O	{1: 1, 27: 1, 28: 1, 14: 6}
Did not match all atoms present	17297-82-4	C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2N=CC=C4)CCO	{33: 3, 2: 5, 35: 1, 41: 1, 11: 4, 14: 7, 20: 1}
Did not match all atoms present	172975-69-8	B(C1=CC(=CC(=C1)C)C)(O)O	{1: 2, 20: 2, 14: 3}
Did not match all atoms present	1730-15-0	B12NCCCN1CCCN2	{32: 2, 33: 1, 11: 6}
Did not match all atoms present	1730-37-6	CC1=CC=CC2=C1CC3=CC=CC=C32	{1: 1, 11: 1, 14: 7}
Did not match all atoms present	1730-48-9	COC1=CC2=C(CCCC2)C=C1	{1: 1, 11: 4, 22: 1, 14: 3}
Did not match all atoms present	1730-66-1	C[Ge](C)(Br)Br	{1: 2, 18: 2}
Did not match all atoms present	1730-86-5	CCCC1=CC=CC=C1Cl	{1: 1, 2: 2, 14: 4, 17: 1}
Did not match all atoms present	17302-63-5	C[SH2+]	{1: 1}
Did not match all atoms present	17302-69-1	CCCC(=O)C1=CC=C(C=C1)CC2=CC=CC=C2	{24: 1, 1: 1, 2: 3, 14: 9}
Did not match all atoms present	17302-70-4	CCCC(=O)C1=CC=C(C=C1)CCC2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 1: 1, 2: 4, 38: 1, 14: 8}
Did not match all atoms present	17302-71-5	CCCC(=O)C1=CC=C(C=C1)CCC2=CC=C(C=C2)C(=O)CCC	{24: 2, 1: 2, 2: 6, 14: 8}
Did not match all atoms present	17302-82-8	CCOC(=O)C1=CC(=C(C(=C1)Cl)O)Cl	{1: 1, 2: 1, 14: 2, 17: 2, 21: 1, 28: 1}
Did not match all atoms present	17304-59-5	C1=CC(=CC=C1N)SS(=O)(=O)[O-].[Na+]	{40: 1, 30: 1, 29: 3, 14: 4}
Did not match all atoms present	17304-95-9	CC(C(C[O-])C(C)O)O.[Na+]	{1: 2, 2: 1, 3: 3, 20: 2, 29: 1}
Did not match all atoms present	17306-05-7	C[Si](C=C)(C1=CC=CC=C1)Cl	{1: 1, 14: 5, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	17306-34-2	C1=CC2=C(C=CC(=C2N=C1)O)N=C3C=CC(=O)C4=C3C=CC=N4	{34: 1, 35: 2, 14: 10, 15: 1, 21: 1, 25: 1}
Did not match all atoms present	17306-35-3	O=[As][O-]	{29: 2}
Did not match all atoms present	17306-43-3	C1=CN(C(=N1)[N+](=O)[O-])[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{33: 1, 2: 1, 35: 1, 38: 1, 12: 4, 14: 2, 20: 3, 23: 1}
Did not match all atoms present	1731-10-8	C[Ge]1(CC=CC1)C	{1: 2, 11: 2, 14: 2}
Did not match all atoms present	17311-31-8	C1=CC=C2C(=C1)N(C(=C([N+]2=O)CO)CO)[O-]	{33: 2, 2: 2, 20: 2, 29: 2, 14: 4}
Did not match all atoms present	17314-38-4	C[Sn](C)(C)CCC=C	{1: 3, 2: 2, 5: 1, 6: 1}
Did not match all atoms present	17314-92-0	CC(C)(C)CCC1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 14: 5}
Did not match all atoms present	1732-13-4	C1CC2=C3C(=CC=C4C3=C(CCC4)C=C2)C1	{11: 6, 14: 4}
Did not match all atoms present	1732-14-5	CC(=O)NC1=CC2=C3C(=C1)C=CC4=C3C(=CC=C4)C=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	1732-23-6	C1=CC2=C3C(=C1)C=CC4=C3C(=CC(=C4)N)C=C2	{30: 1, 14: 9}
Did not match all atoms present	1732-97-4	CC(=O)OC(COC(=O)C1=CC2=C(C=C1)C(=O)OC2=O)COC(=O)C3=CC4=C(C=C3)C(=O)OC4=O	{1: 1, 2: 2, 3: 1, 28: 7, 14: 6}
Did not match all atoms present	17321-47-0	COP(=S)(N)OC	{1: 2, 30: 1, 22: 2}
Did not match all atoms present	17321-48-1	CCOP(=S)(N)OCC	{1: 2, 2: 2, 30: 1, 22: 2}
Did not match all atoms present	17321-77-6	CN(C)CCCN1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.Cl	{1: 2, 2: 3, 33: 2, 11: 2, 14: 7, 17: 2}
Did not match all atoms present	17323-83-0	CCOP(=O)([O-])OCC.[Na+].[Na+]	{1: 2, 2: 2, 29: 2, 22: 2}
Did not match all atoms present	17325-85-8	C1=CC=C(C=C1)COC[C@H](CO)O	{2: 3, 3: 1, 20: 2, 22: 1, 14: 5}
Did not match all atoms present	17329-79-2	CCN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 4, 5: 1, 6: 1, 33: 1, 16: 9, 28: 1, 29: 2}
Did not match all atoms present	17329-87-2	C1=CC(=CC=C1NC(=O)CCl)[N+](=O)[O-]	{2: 1, 38: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	1733-12-6	CC1=C(C=CC(=C1)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4)O)C)O	{1: 2, 13: 1, 14: 10, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	1733-40-0	CC=CC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 6: 2, 31: 1}
Did not match all atoms present	1733-57-9	CCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 29: 1, 14: 10}
Did not match all atoms present	1733-63-7	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)C3=CC=CC=C3	{24: 1, 3: 1, 14: 15}
Did not match all atoms present	1733-76-2	C1=CC2=C(C=CC=C2CCl)C(=C1)CCl	{17: 2, 2: 2, 14: 6}
Did not match all atoms present	1733-96-6	CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC2=CC=CC=C21.[Cl-]	{1: 3, 2: 12, 14: 7, 17: 1}
Did not match all atoms present	17331-61-2	C[Si](C)(C)OC1=CN=NC(=N1)O[Si](C)(C)C	{1: 6, 35: 3, 22: 2, 14: 1}
Did not match all atoms present	17333-79-8	COC1=CC=C(C=C1)N=[N]	{1: 1, 34: 1, 22: 1, 14: 4}
Did not match all atoms present	17333-83-4	C1=CC=C(C(=C1)[N+]#N)Cl	{17: 1, 34: 1, 14: 4}
Did not match all atoms present	17333-84-5	C1=CC(=CC(=C1)Cl)[N+]#N	{17: 1, 34: 1, 14: 4}
Did not match all atoms present	17336-52-6	[H-].[H-].[Pu]	{}
Did not match all atoms present	17337-13-2	C1=CC=C(C=C1)C2=CC=CC=C2N=C=O	{8: 1, 34: 1, 29: 1, 14: 9}
Did not match all atoms present	1734-79-8	C1=CC(=CC=C1C=CC=O)[N+](=O)[O-]	{26: 1, 38: 1, 14: 4, 6: 2}
Did not match all atoms present	1734-91-4	CCN(CC)CCOC1=CC=CC=C1C2=CC=CC=C2.Cl	{1: 2, 2: 4, 33: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	17341-24-1	[Li+]	{}
Did not match all atoms present	17341-25-2	[Na+]	{}
Did not match all atoms present	17341-40-1	CC(C[N+](C)(C)NC(=O)C(=C)C)[O-]	{1: 4, 2: 1, 3: 1, 5: 1, 7: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	17341-83-2	C1=CC(=C(C=C1NC2=C(C(=NC(=N2)Cl)Cl)Cl)N/N=C\3/C=C(C4=C(C3=O)C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{34: 1, 35: 2, 14: 7, 15: 2, 17: 3, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	17342-21-1	CCCCCCCCCCCC[N+]1=CC=CC=C1.[O-]S(=O)(=O)[O-]	{1: 1, 2: 11, 29: 4, 14: 5, 33: 1}
Did not match all atoms present	17345-68-5	C1=CC(=C(C(=C1C(=O)CCl)O)O)O	{24: 1, 17: 1, 2: 1, 21: 3, 14: 2}
Did not match all atoms present	17348-69-5	C1=CC2=[N+](ON=C2C=C1Cl)[O-]	{17: 1, 35: 1, 33: 1, 14: 3, 23: 1}
Did not match all atoms present	1735-17-7	[2H]C1(C(C(C(C(C1([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])[2H]	{11: 6}
Did not match all atoms present	1735-82-6	CN(C)P(N(C)C)F	{16: 1, 1: 4, 33: 2}
Did not match all atoms present	1735-83-7	CN(C)P(N(C)C)(F)(F)F	{16: 3, 1: 4, 33: 2}
Did not match all atoms present	1735-84-8	C1(=C(C(=NC(=C1Cl)F)F)F)F	{16: 4, 17: 1, 35: 1}
Did not match all atoms present	17354-79-9	C1=CC(=CC=C1C=O)N(CCC#N)CCC#N	{33: 1, 2: 4, 26: 1, 14: 4, 37: 2}
Did not match all atoms present	17355-09-8	CC(C)[C@@H](C(=O)O)NC(=O)[C@H](CC1=CC=C(C=C1)O)N	{1: 2, 2: 1, 3: 3, 14: 4, 21: 1, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	17356-09-1	CC(C)C1=CC=C(C=C1)I	{19: 1, 1: 2, 3: 1, 14: 4}
Did not match all atoms present	17356-96-6	C1=CC=C2C=C3C=CC=CC3=CC2=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 21: 1, 14: 12}
Did not match all atoms present	17356-97-7	C1=CC=C2C(=C1)C=CC3=CC=CC=C32.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 21: 1, 14: 12}
Did not match all atoms present	17357-14-1	CC(=O)OC1=CNC2=C1C=C(C=C2)Br	{32: 1, 1: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	173584-44-6	COC(=O)[C@]12CC3=C(C1=NN(CO2)C(=O)N(C4=CC=C(C=C4)OC(F)(F)F)C(=O)OC)C=CC(=C3)Cl	{1: 2, 35: 1, 4: 1, 33: 2, 11: 2, 13: 1, 14: 7, 15: 1, 16: 3, 17: 1, 22: 1, 23: 1, 24: 1, 28: 2}
Did not match all atoms present	17359-54-5	C1=CC=C2C(=C1)N(C(=O)C(O2)O)O	{33: 1, 12: 1, 14: 4, 20: 2, 23: 1, 25: 1}
Did not match all atoms present	1736-34-1	CCN1C(=NC2=C1C=C(C(=C2)C(F)(F)F)Cl)C	{1: 2, 2: 1, 35: 1, 4: 1, 33: 1, 14: 2, 16: 3, 17: 1}
Did not match all atoms present	1736-60-3	C=CCC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	1736-71-6	C1=CC=C(C(=C1)C(F)(F)F)NC(=S)N	{4: 1, 7: 1, 14: 4, 16: 3, 30: 1, 31: 1}
Did not match all atoms present	1736-74-9	C1=CC(=CC=C1CO)OC(F)(F)F	{2: 1, 4: 1, 14: 4, 16: 3, 20: 1, 22: 1}
Did not match all atoms present	17362-17-3	C1=CC(=CC=C1CCC#N)O	{2: 2, 21: 1, 14: 4, 37: 1}
Did not match all atoms present	17363-02-9	[NH4+].[NH4+].[Br-].[Br-].[Br-].[Br-].[Br-].[Br-].[Pt+4]	{18: 6}
Did not match all atoms present	17364-14-6	C([C@@H]1[C@H](C([C@H](C(O1)OP(=O)(O)[O-])O)O)O)O.[Na+]	{2: 1, 12: 5, 20: 5, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	173678-72-3	C1=CC2=C3C4=C(C=C2)C=CC4=C5C=CC6=C5C3=C1C=C6	{14: 10}
Did not match all atoms present	17368-48-8	C1=CC=C(C(=C1)C(=O)O)O.C1=CC=C(C(=C1)C(=O)O)O.C(CN)N	{30: 2, 2: 2, 27: 2, 21: 2, 14: 8}
Did not match all atoms present	17369-59-4	CCC=C1C2=CC=CC=C2C(=O)O1	{1: 1, 2: 1, 6: 1, 14: 4, 15: 1, 28: 1}
Did not match all atoms present	1737-10-6	CC1=CC(=CC=C1)OC(C(F)F)(F)F	{1: 1, 3: 1, 4: 1, 14: 4, 16: 4, 22: 1}
Did not match all atoms present	1737-19-5	CC(=O)CC1=CC(=CC=C1)F	{16: 1, 1: 1, 2: 1, 14: 4, 24: 1}
Did not match all atoms present	1737-26-4	CC(C1=CC=C(C=C1)C(F)(F)F)O	{1: 1, 3: 1, 4: 1, 14: 4, 16: 3, 20: 1}
Did not match all atoms present	1737-93-5	C1(=C(C(=NC(=C1Cl)F)F)Cl)F	{16: 3, 17: 2, 35: 1}
Did not match all atoms present	17371-99-2	C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=S)N3	{32: 1, 14: 8, 23: 1}
Did not match all atoms present	17372-00-8	C1=CC(=CC2=CC3=C(C=C21)NC(=S)O3)S(=O)(=O)[O-].[Na+]	{32: 1, 29: 3, 14: 5, 23: 1}
Did not match all atoms present	17372-87-1	C1=CC=C(C(=C1)C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)Br)[O-])Br)Br)Br)C(=O)[O-].[Na+].[Na+]	{24: 1, 25: 1, 18: 4, 14: 6, 23: 1}
Did not match all atoms present	17373-93-2	CC1=CC=CC=C1COC(=O)C	{1: 2, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	17376-04-4	C1=CC=C(C=C1)CCI	{2: 2, 19: 1, 14: 5}
Did not match all atoms present	17377-95-6	COC1=CC=C(C=C1)NCC2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	17378-36-8	CCCCCCCCCCCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 15}
Did not match all atoms present	17380-19-7	CC(=O)C1=CNC2=C1C=C(C=C2)C#N	{24: 1, 1: 1, 37: 1, 14: 4, 32: 1}
Did not match all atoms present	17380-21-1	CC(C)C(=O)C1=CNC2=C1C=C(C=C2)C#N	{32: 1, 1: 2, 3: 1, 37: 1, 14: 4, 24: 1}
Did not match all atoms present	17380-83-5	C1CCC(CC1)(C2=CC=C(C=C2)Cl)O	{17: 1, 11: 5, 20: 1, 13: 1, 14: 4}
Did not match all atoms present	17381-88-3	C=CC[Sn](CC=C)(Br)Br	{2: 2, 18: 2, 5: 2, 6: 2}
Did not match all atoms present	17384-76-8	CC1=C(C=C2C(=C(C(=C(C2=C1)C)C)C)C)C	{1: 6, 14: 2}
Did not match all atoms present	17386-89-9	CCCC(=O)C1=CC(=C(C=C1)O)O	{24: 1, 1: 1, 2: 2, 21: 2, 14: 3}
Did not match all atoms present	17389-14-9	CCN1C2=CC=CC=C2SC1=CC=CC3=[N+](C4=CC=CC=C4S3)CC.[Br-]	{1: 2, 2: 2, 6: 3, 33: 2, 41: 2, 14: 8, 15: 1, 18: 1}
Did not match all atoms present	1739-00-0	C1=CC=C(C=C1)CCNC2=CC=CC=C2	{2: 2, 14: 10, 31: 1}
Did not match all atoms present	1739-53-3	B(CC)(Cl)Cl	{1: 1, 2: 1, 17: 2}
Did not match all atoms present	1739-84-0	CC1=NC=CN1C	{1: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	17394-77-3	CCOC(=O)C(=CNC1=CC2=C(C=C1)OCO2)C(=O)OCC	{1: 2, 2: 2, 6: 1, 7: 1, 11: 1, 14: 3, 23: 2, 28: 2, 31: 1}
Did not match all atoms present	173963-93-4	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=C(C=C4)C#N)C(=O)O	{2: 2, 3: 1, 37: 1, 12: 1, 14: 12, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	17397-85-2	CC1CC2=C(C(=CC=C2)O)C(=O)O1	{1: 1, 11: 1, 12: 1, 14: 3, 21: 1, 28: 1}
Did not match all atoms present	17398-16-2	CCC1=NC(=C(N=C1C)C)C	{1: 4, 2: 1, 35: 2}
Did not match all atoms present	1740-15-4	CC1(C2CCC1(C(C2)OC3=CC=C(C=C3)N)C)C	{1: 3, 11: 3, 12: 2, 13: 2, 14: 4, 22: 1, 30: 1}
Did not match all atoms present	1740-19-8	CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)O)C	{1: 4, 3: 1, 11: 5, 12: 1, 13: 2, 14: 3, 27: 1}
Did not match all atoms present	1740-57-4	C1=CC(=CC(=C1)C(=O)N)C(=O)N	{24: 2, 30: 2, 14: 4}
Did not match all atoms present	1740-97-2	CC1=C(C=CC(=C1)C(C)C)O	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	17400-65-6	CC1=CC2=C(C=CC=N2)C(=C1)N=NC3=CC=C(C=C3)N(C)C	{1: 3, 34: 2, 35: 1, 14: 9, 33: 1}
Did not match all atoms present	17400-68-9	CC1=C(C=CC(=C1)N=NC2=CC=CC3=C2C=CC=N3)N(C)C	{1: 3, 34: 2, 35: 1, 14: 9, 33: 1}
Did not match all atoms present	17400-69-0	CC1=CN=C2C=CC=C(C2=C1)N=NC3=CC=C(C=C3)N(C)C	{1: 3, 34: 2, 35: 1, 14: 9, 33: 1}
Did not match all atoms present	17400-70-3	CC1=C(C2=C(C=C1)N=CC=C2)N=NC3=CC=C(C=C3)N(C)C	{1: 3, 34: 2, 35: 1, 14: 9, 33: 1}
Did not match all atoms present	17401-48-8	CC1=CC2=NC3=C(C(=C2C=C1)C)C4=CC=CC=C4C=C3	{1: 2, 35: 1, 14: 9}
Did not match all atoms present	174013-29-7	CC(=O)C1=C(C=CC=C1F)C(F)(F)F	{16: 4, 1: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	17407-09-9	CC(=C)C(=O)OCCO[Si](C)(C)C	{1: 4, 2: 2, 5: 1, 7: 1, 22: 1, 28: 1}
Did not match all atoms present	17408-14-9	CC(=O)C1=CC=CC=C1C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4, 24: 1}
Did not match all atoms present	17408-59-2	CCCCCCCCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 7, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	17408-60-5	CCCCCCCC(CC)C1=CC=C(C=C1)O	{1: 2, 2: 7, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	17409-52-8	C1COCCN1C2=CC=C(C=C2)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{33: 1, 34: 1, 11: 4, 14: 4, 17: 3, 23: 1}
Did not match all atoms present	17414-04-9	C1=CC=C(C=C1)OCCSC2=CC=CC=C2	{40: 1, 2: 2, 22: 1, 14: 10}
Did not match all atoms present	17416-17-0	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC3=C2C=CC=N3	{1: 2, 34: 2, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	17416-18-1	CC1=NC2=C(C=C1)C(=CC=C2)N=NC3=CC=C(C=C3)N(C)C	{1: 3, 34: 2, 35: 1, 14: 9, 33: 1}
Did not match all atoms present	17416-20-5	CC1=C2C(=C(C=C1)N=NC3=CC=C(C=C3)N(C)C)C=CC=N2	{1: 3, 34: 2, 35: 1, 14: 9, 33: 1}
Did not match all atoms present	17416-21-6	CC1=C(C=CC(=C1)N(C)C)N=NC2=CC=CC3=C2C=CC=N3	{1: 3, 34: 2, 35: 1, 14: 9, 33: 1}
Did not match all atoms present	17417-09-3	C1=CC(=C(C=C1[N+](=O)[O-])C#N)F	{16: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	17418-58-5	C1=CC=C(C=C1)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N	{25: 2, 22: 1, 30: 1, 21: 1, 14: 10}
Did not match all atoms present	17418-59-6	C1=CC=C(C=C1)OCCOC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N	{2: 2, 14: 10, 21: 1, 22: 2, 25: 2, 30: 1}
Did not match all atoms present	17418-80-3	CN(C)S(=O)(=O)C1=CC(=C(C(=C1)Cl)N)Cl	{1: 2, 33: 1, 14: 2, 17: 2, 29: 2, 30: 1}
Did not match all atoms present	17419-19-1	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)NC3=C(C=C(C=C3)C(C)(C)C4=CC=CC=C4)C(C)(C)C5=CC=CC=C5	{1: 6, 4: 3, 14: 22, 31: 1}
Did not match all atoms present	1742-14-9	CC1=C(C=C(C=C1)C(C)C2=CC(=C(C=C2)C)C)C	{1: 5, 3: 1, 14: 6}
Did not match all atoms present	1742-90-1	CCC(=CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)C)C=C4N(C5=C(S4)C=CC6=CC=CC=C65)C.[Cl-]	{1: 3, 2: 1, 33: 2, 6: 2, 7: 1, 41: 2, 14: 12, 15: 1, 17: 1}
Did not match all atoms present	1742-95-6	C1=CC2=C(C=CC3=C2C(=C1)C(=O)NC3=O)N	{32: 1, 25: 2, 30: 1, 14: 5}
Did not match all atoms present	17420-29-0	CC(C)(C)C1=CC(=PC(=C1)C(C)(C)C)C(C)(C)C	{1: 9, 4: 3, 14: 2}
Did not match all atoms present	17420-30-3	C1=CC(=C(C=C1[N+](=O)[O-])C#N)N	{38: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	17422-32-1	C1=CC2=C(C=CN2)C=C1Cl	{32: 1, 17: 1, 14: 5}
Did not match all atoms present	17422-33-2	C1=CC(=CC2=C1C=CN2)Cl	{32: 1, 17: 1, 14: 5}
Did not match all atoms present	17422-74-1	C1=CC=C2C(=C1)C(=O)C(=CO2)C=O	{25: 1, 26: 1, 14: 5, 23: 1}
Did not match all atoms present	17423-08-4	CC1=CC(=NC(=C1)C)C.Cl	{1: 3, 35: 1, 14: 2, 17: 1}
Did not match all atoms present	17425-91-1	C[Si](C)(C)N(C1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 14: 10, 33: 1}
Did not match all atoms present	17427-00-8	CC(=O)OC1=CC=CC(=C1)[N+](C)(C)C.[I-]	{1: 4, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	17427-63-3	C1=CC2=C(C=CC(=[N+]=N)C2=O)C(=C1)S(=O)(=O)[O-].[Na+]	{34: 1, 36: 1, 14: 5, 15: 1, 25: 1, 29: 3}
Did not match all atoms present	17428-41-0	[As+5]	{}
Did not match all atoms present	1743-86-8	C1=CC=C(C(=C1)C(F)(F)F)N=C=S	{8: 1, 16: 3, 34: 1, 4: 1, 14: 4}
Did not match all atoms present	17432-37-0	CC1=CC(=C(C(=C1C)C=O)C)C	{1: 4, 26: 1, 14: 1}
Did not match all atoms present	17432-38-1	CC1=C(C(=C(C(=C1C)C)C=O)C)C	{1: 5, 26: 1}
Did not match all atoms present	17433-31-7	CC(=O)NNC(=O)C1=CC=CC=N1	{24: 2, 1: 1, 35: 1, 14: 4, 31: 2}
Did not match all atoms present	17433-39-5	CC1=NC=C(C(=C1O)C[NH3+])CSC(=O)C.[Br-]	{1: 2, 2: 2, 35: 1, 40: 1, 14: 1, 18: 1, 21: 1, 24: 1}
Did not match all atoms present	17438-50-5	CCCC(=O)C1=CC=C(C=C1)CCC2=CC=C(C=C2)N	{24: 1, 1: 1, 2: 4, 30: 1, 14: 8}
Did not match all atoms present	17439-11-1	[H+].[H+].F[Ti-2](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	1744-45-2	C1=C(C(=C(C(=C1F)F)C(=O)NO)F)F	{16: 4, 24: 1, 20: 1, 14: 1, 31: 1}
Did not match all atoms present	17448-96-3	CCOC(=O)C(=CC1=CC=CO1)C(=O)OCC	{1: 2, 2: 2, 6: 1, 7: 1, 14: 3, 23: 1, 28: 2}
Did not match all atoms present	17449-96-6	CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3.CCN(CC)CCNC(=O)COC1=CC=C(C=C1)Cl	{1: 3, 2: 8, 33: 3, 12: 1, 14: 14, 17: 1, 22: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	1745-16-0	CC=CCCC1=CC=CC=C1	{1: 1, 2: 2, 14: 5, 6: 2}
Did not match all atoms present	1745-32-0	CCN\1C2=CC=CC=C2S/C1=C\C(=C\C3=[N+](C4=CC=CC=C4S3)CC)\C.[Br-]	{1: 3, 2: 2, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 18: 1}
Did not match all atoms present	1745-72-8	C=C[Si](C=C)(Cl)Cl	{17: 2, 5: 2, 6: 2}
Did not match all atoms present	1745-77-3	C1=CC=C(C=C1)CC2=NC3=CC=CC=C3C=C2	{2: 1, 35: 1, 14: 11}
Did not match all atoms present	1745-81-9	C=CCC1=CC=CC=C1O	{2: 1, 14: 4, 5: 1, 6: 1, 21: 1}
Did not match all atoms present	1745-89-7	CC(C)(C1=CC(=C(C=C1)O)CC=C)C2=CC(=C(C=C2)O)CC=C	{1: 2, 2: 2, 4: 1, 5: 2, 6: 2, 14: 6, 21: 2}
Did not match all atoms present	17450-56-5	CCOC(=O)C=CC(=O)C1=CC=CC=C1	{1: 1, 2: 1, 6: 2, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	17451-18-2	CCOC(=O)/C(=C\C1=CC=CC=C1)/C(=O)C2=CC=CC=C2	{1: 1, 2: 1, 6: 1, 7: 1, 14: 10, 24: 1, 28: 1}
Did not match all atoms present	174514-06-8	CN1C=C[N+](=C1N=NC2=CC=C(C=C2)NC3=CC=C(C=C3)NC4=NC(=NC(=N4)N(C)C)NC5=CC=C(C=C5)NC6=CC=C(C=C6)N=NC7=[N+](C=CN7C)C)C.[Cl-]	{1: 6, 34: 4, 35: 3, 33: 5, 14: 20, 17: 1, 31: 4}
Did not match all atoms present	17452-08-3	C1=CC(=CC(=C1)N2C=CNC2=S)C(F)(F)F	{16: 3, 32: 1, 4: 1, 14: 6, 33: 1}
Did not match all atoms present	17452-18-5	C1=CC(=CC=C1C(F)(F)F)N2C=CNC2=S	{16: 3, 32: 1, 4: 1, 14: 6, 33: 1}
Did not match all atoms present	17452-23-2	C1=CC(=CC=C1N2C=CNC2=S)Br	{32: 1, 33: 1, 18: 1, 14: 6}
Did not match all atoms present	17452-26-5	C1=CC(=CC(=C1)F)N2C=CNC2=S	{16: 1, 32: 1, 14: 6, 33: 1}
Did not match all atoms present	17452-27-6	C1=CC(=CN=C1)N=C=S	{8: 1, 34: 1, 35: 1, 14: 4}
Did not match all atoms present	17453-87-1	C(C(C(C(C(COP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O	{2: 2, 3: 4, 20: 12, 29: 6, 22: 6}
Did not match all atoms present	17454-25-0	CN(C)P1OCCCO1	{1: 2, 11: 3, 33: 1, 23: 2}
Did not match all atoms present	17455-25-3	C1COCCOC2=CC=CC=C2OCCOCCOCCOCCOC3=CC=CC=C3OCCOCCO1	{11: 16, 14: 8, 23: 10}
Did not match all atoms present	1746-01-6	C1=C2C(=CC(=C1Cl)Cl)OC3=CC(=C(C=C3O2)Cl)Cl	{17: 4, 14: 4, 23: 2}
Did not match all atoms present	1746-03-8	C=CP(=O)(O)O	{20: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	1746-11-8	CC1CC2=CC=CC=C2O1	{1: 1, 11: 1, 12: 1, 14: 4, 23: 1}
Did not match all atoms present	1746-13-0	C=CCOC1=CC=CC=C1	{22: 1, 2: 1, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	1746-23-2	CC(C)(C)C1=CC=C(C=C1)C=C	{1: 3, 14: 4, 4: 1, 5: 1, 6: 1}
Did not match all atoms present	1746-81-2	CN(C(=O)NC1=CC=C(C=C1)Cl)OC	{1: 2, 33: 1, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	17466-45-4	CC1C(=O)NC2CC3=C(NC4=CC=CC=C34)SCC(C(=O)N5CC(CC5C(=O)N1)O)NC(=O)C(NC(=O)C(NC(=O)C(NC2=O)CC(C)(CO)O)C)C(C)O	{32: 7, 1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 41: 1, 11: 4, 12: 8, 14: 4, 20: 4, 25: 7}
Did not match all atoms present	17467-15-1	C1=CC=C(C=C1)C2=NSC(=N2)N	{41: 1, 35: 2, 30: 1, 14: 5}
Did not match all atoms present	174689-39-5	CCC1=CC=CC=C1OC[C@H](CN[C@H]2CCCC3=CC=CC=C23)O.C(=O)(C(=O)O)O	{1: 1, 2: 3, 3: 1, 11: 3, 12: 1, 14: 8, 20: 1, 22: 1, 27: 2, 31: 1}
Did not match all atoms present	17469-89-5	CN(C)[C@@H](CC1=CC=CC=C1)C(=O)O	{1: 2, 2: 1, 3: 1, 33: 1, 14: 5, 27: 1}
Did not match all atoms present	1747-57-5	C[Si]1(C[Si](C[Si](C[Si](C1)(C)C)(C)C)(C)C)C	{1: 8, 11: 4}
Did not match all atoms present	1747-60-0	COC1=CC2=C(C=C1)N=C(S2)N	{1: 1, 35: 1, 41: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	1747-99-5	CC[GeH3]	{1: 1, 2: 1}
Did not match all atoms present	17471-82-8	C1COC2=C(O1)C=CC(=C2)CN=C([NH3+])N.OS(=O)(=O)[O-]	{2: 1, 7: 1, 11: 2, 34: 1, 14: 3, 20: 1, 23: 2, 29: 3, 30: 1}
Did not match all atoms present	17477-29-1	CCC[Si](C)(C)Cl	{1: 3, 2: 2, 17: 1}
Did not match all atoms present	17477-67-7	CCCC(O)P(=O)(OCC)OCC	{1: 3, 2: 4, 3: 1, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	1748-15-8	C1CSC(=S)SC1	{41: 2, 11: 3, 15: 1}
Did not match all atoms present	17480-69-2	C[C@@H](C1=CC=CC=C1)NCC2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 14: 10, 31: 1}
Did not match all atoms present	17481-06-0	CC(=O)NC(CC1=CC=C(C=C1)F)C(=O)O	{1: 1, 2: 1, 3: 1, 14: 4, 16: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	17481-27-5	COC1=C(C=C(C=C1)C(=O)N)N	{24: 1, 1: 1, 30: 2, 22: 1, 14: 3}
Did not match all atoms present	174813-24-2	C1=CC=C(C=C1)/C=C/2\C(=O)NC(=S)S2	{32: 1, 6: 1, 41: 1, 14: 5, 15: 2, 25: 1}
Did not match all atoms present	17484-36-5	CC1=C(C=C(C=C1)OC)[N+](=O)[O-]	{1: 2, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	1749-04-8	CN(C)C1=CC=C(C=C1)C=NC2=CC=C(C=C2)OC	{1: 3, 34: 1, 6: 1, 33: 1, 14: 8, 22: 1}
Did not match all atoms present	1749-08-2	COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)OC	{1: 2, 22: 2, 34: 1, 14: 8, 6: 1}
Did not match all atoms present	17493-73-1	CC1=C(C(=CC=C1)C)N(COC(C)C)C(=O)CCl	{1: 4, 2: 2, 3: 1, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	17493-86-6	[Cu+]	{}
Did not match all atoms present	17496-08-1	CCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	17496-14-9	CC1CC2=CC=CC=C2C1=O	{1: 1, 11: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	174974-45-9	CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)[O-].[Na+]	{24: 1, 1: 5, 2: 14, 3: 4, 28: 3}
Did not match all atoms present	17498-71-4	CC(C)C(=C)C1=CC=CC=C1	{1: 2, 3: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	17499-98-8	CCC1C(C2=NC1=CC3=C(C4=C(C(C(=C4[N-]3)C5=NC(=CC6=NC(=C2)C(=C6C)C(=O)C)C(C5CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C(=O)OC)[O-])C)C.[Mg+2]	{1: 12, 2: 13, 3: 3, 6: 1, 7: 1, 12: 5, 14: 3, 15: 10, 35: 4, 24: 1, 28: 2}
Did not match all atoms present	1750-12-5	C1(=S)NN=C(N1N)NN	{32: 1, 33: 1, 35: 1, 30: 2, 31: 1}
Did not match all atoms present	1750-42-1	C1=CON=C1N	{35: 1, 30: 1, 14: 2, 23: 1}
Did not match all atoms present	1750-46-5	C1=C2C(=CC(=C1Cl)O)OC(=N2)N	{35: 1, 14: 2, 17: 1, 21: 1, 23: 1, 30: 1}
Did not match all atoms present	17501-44-9	CC(=CC(=O)C)O.CC(=CC(=O)C)O.CC(=CC(=O)C)O.CC(=CC(=O)C)O.[Zr]	{24: 4, 1: 8, 20: 4, 6: 4, 7: 4}
Did not match all atoms present	17505-25-8	C1=COC(=C1)/C(=C\C2=CC=C(O2)[N+](=O)[O-])/C3=NN=C(O3)N	{35: 2, 38: 1, 6: 1, 7: 1, 14: 5, 23: 3, 30: 1}
Did not match all atoms present	17508-17-7	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])ON	{30: 1, 38: 2, 22: 1, 14: 3}
Did not match all atoms present	17509-71-6	C1C=CC=C2C1=C3C4=C(C5=CC=CC=C5C4)C6=C(C3=C2)CC7=CC=CC=C76	{11: 3, 14: 12, 15: 2}
Did not match all atoms present	175097-45-7	CC1=CC2=C(N1C)N=C(N=C2N3CCCC3)N4CCCC4.OS(=O)(=O)O	{1: 2, 35: 2, 33: 3, 11: 8, 14: 1, 20: 2, 29: 2}
Did not match all atoms present	17510-46-2	CC(C)(C)C(=C)O[Si](C)(C)C	{1: 6, 4: 1, 5: 1, 22: 1, 7: 1}
Did not match all atoms present	17512-08-2	CC1=C(N(N=C1C)C)CC(=C=C)C	{1: 4, 2: 1, 35: 1, 5: 1, 33: 1, 8: 1, 7: 1}
Did not match all atoms present	17513-40-5	CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C14)C=O	{1: 1, 26: 1, 14: 10}
Did not match all atoms present	17513-58-5	CC(C)P(=O)(C(C)C)C(C)C	{1: 6, 3: 3, 29: 1}
Did not match all atoms present	175135-07-6	C1=CC=C2C(=C1)C=C(S2)C(=O)NN	{24: 1, 41: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	175135-11-2	C1CCC(CC1)C2=CC(=C(C(=C2)Br)N)Br	{18: 2, 11: 5, 12: 1, 30: 1, 14: 2}
Did not match all atoms present	175135-22-5	CCCSC1=C(C=CC=N1)C(=O)O	{1: 1, 2: 2, 35: 1, 40: 1, 14: 3, 27: 1}
Did not match all atoms present	175136-60-4	C1=CN(C=C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F	{16: 6, 33: 1, 4: 2, 14: 7}
Did not match all atoms present	175136-63-7	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=CC#N	{16: 6, 4: 2, 14: 3, 6: 2, 37: 1}
Did not match all atoms present	175136-66-0	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F	{16: 12, 24: 1, 4: 4, 14: 6}
Did not match all atoms present	175136-70-6	CC1=C(C(=C(C(=C1C)C)C(=O)C2=CC=CS2)C)C	{24: 1, 1: 5, 14: 3, 41: 1}
Did not match all atoms present	175137-46-9	C1CC1C2=CC(=NN2)N	{32: 1, 35: 1, 11: 2, 12: 1, 14: 1, 30: 1}
Did not match all atoms present	175137-61-8	CCCS(=O)(=O)CC#N	{1: 1, 2: 3, 29: 2, 37: 1}
Did not match all atoms present	17515-79-6	CCOC(=O)C1=C(OC(=C1)C=O)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 1, 16: 3, 23: 1, 26: 1, 28: 1}
Did not match all atoms present	17518-43-3	C[N+](C)(C)CCOC(=O)C1=CC=CC=C1.[I-]	{1: 3, 2: 2, 19: 1, 28: 1, 14: 5}
Did not match all atoms present	17518-47-7	C1=CC=C2C(=C1)C=CC=C2CC(=S)N	{2: 1, 30: 1, 14: 7, 7: 1}
Did not match all atoms present	1752-24-5	C1=CC(=CC=C1NC2=CC=C(C=C2)O)O	{21: 2, 14: 8, 31: 1}
Did not match all atoms present	1752-30-3	CC(=NNC(=S)N)C	{1: 2, 34: 1, 31: 1, 30: 1, 7: 2}
Did not match all atoms present	175205-10-4	COCC1=CC(=O)OC2=C1C=CC(=C2)N	{1: 1, 2: 1, 14: 4, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	175205-33-1	C1=CC=C(C(=C1)N=C=S)OC(F)(F)F	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 22: 1}
Did not match all atoms present	175205-39-7	CC1=C(C=C(C=C1)F)N=C=S	{8: 1, 1: 1, 34: 1, 14: 3, 16: 1}
Did not match all atoms present	17521-25-4	C1=CC(=CC=C1/C=C/2\C(=O)N(C(=S)S2)/N=C/C3=CC=C(C=C3)Cl)Cl	{33: 1, 34: 1, 6: 2, 41: 1, 14: 8, 15: 2, 17: 2, 25: 1}
Did not match all atoms present	17522-69-9	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Nd+3]	{17: 3, 29: 12}
Did not match all atoms present	17523-77-2	O(F)F.[K+].[Nb+5]	{16: 2, 22: 1}
Did not match all atoms present	17526-17-9	CCOCC1=C(C=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)O	{1: 1, 2: 2, 14: 5, 21: 2, 22: 1, 25: 2}
Did not match all atoms present	17526-24-8	CC(=O)OCC1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC=C41	{1: 1, 2: 1, 28: 1, 14: 11}
Did not match all atoms present	175277-76-6	C1=CC(=C(C=C1F)F)NC(=S)N	{16: 2, 31: 1, 30: 1, 14: 3, 7: 1}
Did not match all atoms present	175277-95-9	CCC1=CC=CC(=C1I)C	{1: 2, 2: 1, 19: 1, 14: 3}
Did not match all atoms present	175277-99-3	C1=CC(=C(C=C1F)Cl)S	{16: 1, 17: 1, 14: 3, 39: 1}
Did not match all atoms present	175278-11-2	C1=C(C=C(C(=C1F)I)Br)F	{16: 2, 18: 1, 19: 1, 14: 2}
Did not match all atoms present	175278-17-8	C1=CC(=C(C=C1OC(F)(F)F)Br)N	{4: 1, 14: 3, 16: 3, 18: 1, 22: 1, 30: 1}
Did not match all atoms present	17534-15-5	C1=CC=C(C(=C1)S)S	{14: 4, 39: 2}
Did not match all atoms present	17537-31-4	[2H]C([2H])([2H])C(=O)C1=CC=CC=C1	{24: 1, 1: 1, 14: 5}
Did not match all atoms present	17537-64-3	CC(=O)C1=CN(C2=CC=CC=C21)C(=O)C	{24: 2, 1: 2, 14: 5, 33: 1}
Did not match all atoms present	1754-47-8	CCCCCCCCOP(=O)(C1=CC=CC=C1)OCCCCCCCC	{1: 2, 2: 14, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	1754-49-0	CCOP(=O)(C1=CC=CC=C1)OCC	{1: 2, 2: 2, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	1754-55-8	CCOC(=O)C1=C(C=C(C=C1C)C)C	{1: 4, 2: 1, 28: 1, 14: 2}
Did not match all atoms present	1754-58-1	CNP(=O)(NC)OC1=CC=CC=C1	{1: 2, 31: 2, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	1754-88-7	CC=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 14: 15, 6: 1}
Did not match all atoms present	17540-75-9	CCC(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 8, 2: 1, 3: 1, 4: 2, 14: 2, 21: 1}
Did not match all atoms present	175442-95-2	CCCN(CCC)[C@@H]1CCC2=C(C1)C=CC(=C2)CS(=O)(=O)C3=CC=C(C=C3)OC	{1: 3, 2: 5, 33: 1, 11: 3, 12: 1, 14: 7, 22: 1, 29: 2}
Did not match all atoms present	175449-28-2	CC(C)[Si](C(C)C)(C(C)C1=CC=CC=C1)Cl	{1: 5, 3: 3, 14: 5, 17: 1}
Did not match all atoms present	175453-07-3	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CN=CC=C4)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	175453-08-4	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=C(C=C4)Cl)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 17: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	17549-30-3	CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Pb+2]	{1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	1755-47-1	C1=CC=C(C=C1)C=C(C=O)C2=CC=CC=C2	{26: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	1755-52-8	CCC1=C(CCC(C1C)C(=O)O)C2=CC=C(C=C2)OC	{1: 3, 2: 1, 11: 2, 12: 2, 14: 4, 15: 2, 22: 1, 27: 1}
Did not match all atoms present	17550-03-7	CC[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)OC)C)O	{1: 3, 2: 1, 11: 6, 12: 3, 13: 2, 14: 3, 20: 1, 22: 1}
Did not match all atoms present	17557-09-4	C[Si](C)(C)CC1=CC=C(C=C1)C[Si](C)(C)C	{1: 6, 2: 2, 14: 4}
Did not match all atoms present	17557-10-7	C[Si](C)(C)C(C1=CC=C(C=C1)C([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	{1: 12, 3: 2, 14: 4}
Did not match all atoms present	17557-11-8	C[Si](C)(C)C(C1=CC=C(C=C1)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C	{1: 18, 4: 2, 14: 4}
Did not match all atoms present	17557-67-4	CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N	{1: 1, 35: 1, 41: 1, 14: 3, 29: 2, 30: 1}
Did not match all atoms present	17557-81-2	C(#N)C1=NO[N+](=C1C#N)[O-]	{33: 1, 35: 1, 37: 2, 23: 1}
Did not match all atoms present	175587-61-8	CC1=CC=C(C=C1)[P+](=O)[O-].[K+]	{1: 1, 29: 2, 14: 4}
Did not match all atoms present	17560-51-9	CC1NC2=CC(=C(C=C2C(=O)N1C3=CC=CC=C3C)S(=O)(=O)N)Cl	{32: 1, 1: 2, 33: 1, 12: 1, 14: 6, 17: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	17563-48-3	CCCC[Sn](CC)(CC)I	{1: 3, 2: 5, 19: 1}
Did not match all atoms present	17564-64-6	C1=CC=C2C(=C1)C(=O)N(C2=O)CCl	{17: 1, 2: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	175643-58-0	CC1=CC(=CC=C1)[P+](=O)[O-].[K+]	{1: 1, 29: 2, 14: 4}
Did not match all atoms present	175643-59-1	CC1=CC=CC=C1[P+](=O)[O-].[K+]	{1: 1, 29: 2, 14: 4}
Did not match all atoms present	17567-17-8	[BH-](N1C(=CC(=N1)C)C)(N2C(=CC(=N2)C)C)N3C(=CC(=N3)C)C.[K+]	{1: 6, 35: 3, 14: 3, 33: 3}
Did not match all atoms present	1757-18-2	CCOP(=S)(OCC)OC(=CCl)C1=C(C=CC(=C1)Cl)Cl	{1: 2, 2: 2, 6: 1, 7: 1, 14: 3, 17: 3, 22: 3}
Did not match all atoms present	1757-72-8	CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C=O	{1: 1, 26: 1, 14: 9, 33: 1}
Did not match all atoms present	17570-76-2	CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Pb+2]	{1: 2, 29: 6}
Did not match all atoms present	17573-21-6	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=C(C=C5)O)C=C2	{21: 1, 14: 11}
Did not match all atoms present	17573-23-8	C1CC2=C(C=C1)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3	{11: 2, 14: 10}
Did not match all atoms present	17573-92-1	COC1=CSC=C1	{1: 1, 22: 1, 14: 3, 41: 1}
Did not match all atoms present	17573-93-2	C1(=C(C(=[N+](C(=C1Cl)Cl)[O-])Cl)Cl)Cl	{17: 5, 29: 1, 33: 1}
Did not match all atoms present	17574-08-2	C1C(=CC2=CC=C(C=C2)O)C(=O)C(=O)N1CCC3=CC=CC=C3	{33: 1, 2: 2, 6: 1, 11: 1, 14: 9, 15: 1, 21: 1, 25: 2}
Did not match all atoms present	17574-09-3	COC1=C(C=CC(=C1)C=C2CN(C(=O)C2=O)CCC3=CC=CC=C3)O	{1: 1, 2: 2, 6: 1, 33: 1, 11: 1, 14: 8, 15: 1, 21: 1, 22: 1, 25: 2}
Did not match all atoms present	17575-15-4	COC1=CC2=C(C=C1)C(=CC(=O)O2)O	{1: 1, 22: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	17575-26-7	C1=C(C=C2C(=C1O)C(=CC(=O)O2)O)O	{28: 1, 21: 3, 14: 3}
Did not match all atoms present	17576-63-5	C1=CC=C2C(=C1)C(=C(C=[N+]2[O-])F)[N+](=O)[O-]	{16: 1, 33: 1, 38: 1, 29: 1, 14: 5}
Did not match all atoms present	17576-88-4	CN(C)C1=CC=C(C=C1)N=NC2=CC(=CC=C2)Br	{1: 2, 18: 1, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	17577-28-5	CCOC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{1: 1, 2: 2, 28: 1, 14: 15, 17: 1}
Did not match all atoms present	17579-99-6	C[P+](OC1=CC=CC=C1)(OC2=CC=CC=C2)OC3=CC=CC=C3.[I-]	{1: 1, 19: 1, 22: 3, 14: 15}
Did not match all atoms present	175795-76-3	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N6CCC=C6)O	{1: 2, 2: 1, 33: 1, 11: 5, 12: 5, 13: 1, 14: 5, 20: 3, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2}
Did not match all atoms present	1758-10-7	CC1=CC(=CC=C1)OCC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 4, 22: 1}
Did not match all atoms present	1758-25-4	COC1=CC(=C(C=C1)OC)CC(=O)O	{1: 2, 2: 1, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	1758-46-9	C1=CC=C(C=C1)OCCN	{2: 2, 30: 1, 22: 1, 14: 5}
Did not match all atoms present	1758-64-1	C1=CC2=C(C(=C1)N)C(=O)C3=C(C2=O)C=C(C=C3)N	{25: 2, 30: 2, 14: 6}
Did not match all atoms present	1758-68-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)N)N	{25: 2, 30: 2, 14: 6}
Did not match all atoms present	1758-73-2	C(=N)(N)S(=O)O	{36: 1, 20: 1, 29: 1, 30: 1, 7: 1}
Did not match all atoms present	1758-85-6	CCC1=CC(=C(C=C1)C)CC	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	1758-88-9	CCC1=C(C=CC(=C1)C)C	{1: 3, 2: 1, 14: 3}
Did not match all atoms present	17584-12-2	CC1=C(N=NC(=N1)N)C	{1: 2, 35: 3, 30: 1}
Did not match all atoms present	17586-89-9	C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]	{40: 1, 41: 1, 35: 1, 38: 2, 14: 7}
Did not match all atoms present	17587-38-1	S1SSS[Se]SSS1	{41: 7}
Did not match all atoms present	17589-14-9	CC[CH-]C.CC[CH-]C.[Mg+2]	{1: 4, 2: 2, 6: 2}
Did not match all atoms present	175893-71-7	CC(=C)C(=O)NCCCN(C)C.C=CN1CCCC1=O.OS(=O)(=O)O	{1: 3, 2: 3, 5: 2, 6: 1, 7: 1, 11: 3, 20: 2, 24: 1, 25: 1, 33: 2, 29: 2, 31: 1}
Did not match all atoms present	1759-28-0	CC1=C(SC=N1)C=C	{1: 1, 35: 1, 5: 1, 6: 1, 41: 1, 14: 1}
Did not match all atoms present	1759-87-1	[2H]C([2H])([2H])CO	{1: 1, 2: 1, 20: 1}
Did not match all atoms present	17590-01-1	CC(CC1=CC=CC=C1)NC(C#N)C2=CC=CC=C2	{1: 1, 2: 1, 3: 2, 37: 1, 14: 10, 31: 1}
Did not match all atoms present	17594-47-7	CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.[Ba+2]	{24: 2, 1: 12, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	17596-79-1	C[C@H](CN)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	17597-70-5	CC1=CC(=C2C=CC3=C2C(=C1)C=C(C=C3C)C)C	{1: 4, 14: 6}
Did not match all atoms present	17598-02-6	CC1(C=CC2=C(O1)C=C(C=C2)OC)C	{1: 3, 22: 1, 13: 1, 14: 5, 23: 1}
Did not match all atoms present	17599-08-5	CCN(CC)CCCOC(=O)C1=CC=C(C=C1)N.Cl	{1: 2, 2: 5, 33: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	17599-09-6	CCC[NH+](CCC)CCCOC(=O)C1=CC=C(C=C1)N.[Cl-]	{1: 2, 2: 7, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	17599-81-4	O=S(=O)([O-])[O-].[Cu+].[Cu+]	{29: 4}
Did not match all atoms present	1760-24-3	CO[Si](CCCNCCN)(OC)OC	{1: 3, 2: 5, 30: 1, 22: 3, 31: 1}
Did not match all atoms present	1760-46-9	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4	{3: 2, 28: 2, 14: 20}
Did not match all atoms present	1760-62-9	C1CCC(CC1)CC(=O)/C=C/C2=CC(=CC=C2)Cl	{2: 1, 6: 2, 11: 5, 12: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	17600-72-5	CCOC1=CC=CC=C1OC	{1: 2, 2: 1, 22: 2, 14: 4}
Did not match all atoms present	17601-12-6	C1=CC=C(C=C1)OC2=CC=C(C=C2)[Sn](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=C(C=C5)OC6=CC=CC=C6	{22: 2, 14: 28}
Did not match all atoms present	17601-86-4	C1=CC=C(C=C1)C\2=NC3=CC=CC=C3/C2=N\NC4=CC(=C(C=C4Cl)Cl)Cl	{34: 1, 35: 1, 14: 11, 15: 2, 17: 3, 31: 1}
Did not match all atoms present	17601-94-4	C1=C(C=C(C(=C1Br)N)C#N)[N+](=O)[O-]	{18: 1, 38: 1, 30: 1, 14: 2, 37: 1}
Did not match all atoms present	17601-96-6	C1=CC(=C(C=C1S(=O)(=O)CCO)N)O	{2: 2, 14: 3, 20: 1, 21: 1, 29: 2, 30: 1}
Did not match all atoms present	176022-97-2	[Li+].COC(=O)C1=CC=C(C=C1)C(=O)OC.C1=C(C=C(C=C1C(=O)OCCO)S(=O)(=O)[O-])C(=O)OCCO.C(CO)O	{1: 2, 2: 6, 14: 7, 20: 4, 28: 4, 29: 3}
Did not match all atoms present	17606-31-4	CN(C)C(CSS(=O)(=O)C1=CC=CC=C1)CSS(=O)(=O)C2=CC=CC=C2	{1: 2, 2: 2, 3: 1, 33: 1, 40: 2, 14: 10, 29: 4}
Did not match all atoms present	17606-70-1	C1=CC=C(C=C1)/C=C/2\C(=O)OC(=N2)C3=CC=CC=C3	{35: 1, 28: 1, 14: 10, 6: 1, 15: 2}
Did not match all atoms present	17607-20-4	C1C(CO1)(CN=[N+]=[N-])CN=[N+]=[N-]	{34: 4, 2: 2, 11: 2, 13: 1, 23: 1}
Did not match all atoms present	17608-07-0	CC(C)CCCN=C=S	{8: 1, 1: 2, 2: 3, 3: 1, 34: 1}
Did not match all atoms present	17608-09-2	COC1=CC=CC=C1CN=C=S	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 22: 1}
Did not match all atoms present	17608-10-5	C1=CC(=CC=C1CCN=C=S)Cl	{8: 1, 17: 1, 2: 2, 34: 1, 14: 4}
Did not match all atoms present	17608-59-2	CC(C(C1=CC=CC=C1)O)N(C)N=O	{1: 2, 34: 1, 3: 2, 33: 1, 14: 5, 20: 1, 29: 1}
Did not match all atoms present	1761-56-4	C1=CC=C(C(=C1)NC=C2C=CC=CC2=O)O	{6: 1, 14: 8, 15: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	1761-61-1	C1=CC(=C(C=C1Br)C=O)O	{18: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	17610-00-3	CC(C)(C)C1=CC(=CC(=C1)C=O)C(C)(C)C	{1: 6, 26: 1, 4: 2, 14: 3}
Did not match all atoms present	17610-24-1	CC1=CC2=C(C=C1C(=O)C)C(CCC2(C)C)(C)C	{24: 1, 1: 6, 11: 2, 13: 2, 14: 2}
Did not match all atoms present	17612-91-8	CC(=O)SCC[NH3+].[Cl-]	{24: 1, 1: 1, 2: 2, 40: 1, 17: 1}
Did not match all atoms present	17614-74-3	CC1=CC(=C(C=C1)N=C=S)[N+](=O)[O-]	{8: 1, 1: 1, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	17615-73-5	C1=CC(=CC=C1N)S(=O)(=O)C2=C(C=C(C=C2)N)S(=O)(=O)N	{30: 3, 29: 4, 14: 7}
Did not match all atoms present	17616-23-8	[2H]C([2H])(C)N	{1: 1, 2: 1, 30: 1}
Did not match all atoms present	17617-23-1	CCN(CC)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F	{1: 2, 2: 4, 35: 1, 33: 2, 11: 1, 14: 7, 15: 1, 16: 1, 17: 1, 25: 1}
Did not match all atoms present	17617-59-3	C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F)CCN	{33: 1, 2: 2, 35: 1, 11: 1, 14: 7, 15: 1, 16: 1, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	17617-60-6	C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)O)F	{32: 1, 35: 1, 12: 1, 14: 7, 15: 1, 16: 1, 17: 1, 20: 1, 25: 1}
Did not match all atoms present	17618-85-8	CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=NNC4=C(C=CC(=C4)C(F)(F)F)Cl)C2=O	{1: 1, 34: 1, 4: 1, 14: 12, 15: 2, 16: 3, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	17619-97-5	C1=CC=C(C=C1)C2C(O2)C3=CC=CC=C3	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	1762-41-0	C1=CN=C(C=C1Cl)C2=NC=CC(=C2)Cl	{17: 2, 35: 2, 14: 6}
Did not match all atoms present	1762-95-4	C(#N)[S-].[NH4+]	{37: 1}
Did not match all atoms present	17622-94-5	C(CO[Si](OCCO)(OCCO)OCCO)O	{2: 8, 20: 4, 22: 4}
Did not match all atoms present	176236-88-7	C1C2C(O2)CC3=CC4=CC=CC=C4C=C31	{11: 2, 12: 2, 14: 6, 23: 1}
Did not match all atoms present	17625-03-5	C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)[O-].[Na+]	{24: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	17625-83-1	C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N	{24: 1, 30: 1, 14: 9, 31: 1}
Did not match all atoms present	17626-75-4	CCCC1=NC=CS1	{1: 1, 2: 2, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	17627-76-8	CC=CC1=CC2=C(C=C1)OCO2	{1: 1, 11: 1, 14: 3, 6: 2, 23: 2}
Did not match all atoms present	17627-77-9	C[C@H]1C2=C(C(=C(C=C2CCN1)OC)OC)O	{32: 1, 1: 3, 11: 2, 12: 1, 14: 1, 21: 1, 22: 2}
Did not match all atoms present	17627-78-0	CC1C2=C3C(=C(C=C2CCN1C)OC)OCO3	{1: 3, 33: 1, 11: 3, 12: 1, 14: 1, 22: 1, 23: 2}
Did not match all atoms present	17628-72-7	CO[C@@H](CO)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	1763-23-1	C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 17, 20: 1, 4: 8, 29: 2}
Did not match all atoms present	17630-76-1	C1=CC2=C(C=C1Cl)C(=O)C(=O)N2	{32: 1, 17: 1, 14: 3, 25: 2}
Did not match all atoms present	176317-02-5	C1=CC(=C(C(=C1F)F)F)Br	{16: 3, 18: 1, 14: 2}
Did not match all atoms present	17634-60-5	CC1=CN(C(=O)N=C1N)C	{1: 2, 35: 1, 33: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	17634-93-4	[Li+].C1=CC=C(C=C1)[O-]	{14: 5}
Did not match all atoms present	176365-29-0	C(C(=O)O)N(CC(=O)O)CC(=O)[O-].C(C(=O)O)N(CC(=O)[O-])CC(=O)[O-].[OH3+].[Na+].[Na+].[Na+].[Fe+2]	{24: 3, 33: 2, 2: 6, 27: 3}
Did not match all atoms present	17638-20-9	C1=C(C(=NC(=C1C#N)C#N)C#N)C#N	{35: 1, 37: 4, 14: 1}
Did not match all atoms present	17639-64-4	CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2	{1: 1, 29: 2, 14: 8, 33: 1}
Did not match all atoms present	1764-39-2	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)C(=CC5=CC=CC=C54)F	{16: 1, 14: 13}
Did not match all atoms present	17647-77-7	CC1=CC=CC=C2C1=CC=C2	{1: 1, 14: 7}
Did not match all atoms present	17648-03-2	C1CC(=O)C2=C(C3=CC=CC=C3C(=C2C1=O)O)O	{25: 2, 11: 2, 21: 2, 14: 4}
Did not match all atoms present	17648-05-4	CC(C)(CCC(C)(C)C1=CC=CC=C1)C2=CC=CC=C2	{1: 4, 2: 2, 4: 2, 14: 10}
Did not match all atoms present	17648-16-7	CN(P(Cl)Cl)P(Cl)Cl	{1: 1, 33: 1, 17: 4}
Did not match all atoms present	17648-18-9	CN(P(F)F)P(F)F	{16: 4, 1: 1, 33: 1}
Did not match all atoms present	1765-40-8	C(C1=C(C(=C(C(=C1F)F)F)F)F)Br	{16: 5, 2: 1, 18: 1}
Did not match all atoms present	1765-93-1	B(C1=CC=C(C=C1)F)(O)O	{16: 1, 20: 2, 14: 4}
Did not match all atoms present	17650-86-1	C[C@@H]1[C@H](CC[C@@H](O1)N2C=CC(=NC2=O)NC(=O)C3=CC=C(C=C3)NC(=O)[C@](C)(CO)N)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C)N(C)C)O)O	{1: 5, 2: 1, 35: 1, 4: 1, 33: 2, 11: 2, 12: 8, 14: 6, 20: 3, 22: 1, 23: 2, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	17650-98-5	C[C@H]([C@@H](C(=O)NCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N)NC(=O)[C@H](CC4=CC=C(C=C4)OS(=O)(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]5CCC(=O)N5)O	{32: 2, 1: 2, 2: 10, 3: 9, 40: 1, 11: 2, 12: 1, 14: 14, 20: 2, 22: 1, 24: 11, 25: 1, 27: 2, 29: 2, 30: 2, 31: 9}
Did not match all atoms present	17653-70-2	CC(CN)N.CC(CN)N.[Cl-].[Cl-].[Cl-].[Au+3]	{1: 2, 2: 2, 3: 2, 30: 4, 17: 3}
Did not match all atoms present	17653-76-8	CCC/C(=C/C(=O)CCC)/[O-].CCC/C(=C/C(=O)CCC)/[O-].[Cu+2]	{24: 2, 1: 4, 2: 8, 6: 2, 7: 2}
Did not match all atoms present	17654-88-5	C1=CC=C(C=C1)N2C(=S)SC(=S)N2	{32: 1, 33: 1, 14: 5, 41: 1}
Did not match all atoms present	17655-31-1	[NH2-]	{}
Did not match all atoms present	17655-74-2	CCO/C=C/C1=CC=CC=C1	{1: 1, 2: 1, 22: 1, 14: 5, 6: 2}
Did not match all atoms present	17658-06-9	C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)[O-])C5=CC=CC=C5	{33: 1, 14: 21}
Did not match all atoms present	17665-72-4	CN(C)C1=CC=C(C=C1)C(=CC=O)C2=CC=C(C=C2)N(C)C	{1: 4, 6: 1, 33: 2, 7: 1, 14: 8, 26: 1}
Did not match all atoms present	17666-24-9	CC(CC(CCC1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 3, 3: 2, 14: 15}
Did not match all atoms present	17667-23-1	CC1=CC(=C2C(=C1)C=CC(=C2O)C3=C(C4=C(C=C(C=C4C=C3)C)O)O)O	{1: 2, 21: 4, 14: 8}
Did not match all atoms present	17669-30-6	COC(=O)C1C(ON=C1C2=CC=CC=C2)C(=O)OC	{1: 2, 35: 1, 12: 2, 14: 5, 15: 1, 23: 1, 28: 2}
Did not match all atoms present	1767-12-0	CC(=O)NC1=CC=C(C=C1)NN=C2N=CC=N2	{1: 1, 34: 1, 35: 2, 14: 6, 15: 1, 24: 1, 31: 2}
Did not match all atoms present	17672-21-8	COC(=O)C1=C(C(=CC=C1)O)N	{1: 1, 30: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	17672-53-6	C(C(Cl)(Cl)Cl)OP(=O)(OCC(Cl)(Cl)Cl)Cl	{17: 7, 2: 2, 4: 2, 29: 1, 22: 2}
Did not match all atoms present	17676-08-3	CCN(CC)C(=O)C1CC2[C@@H](CC3=CNC4=CC=CC2=C34)N(C1)C.CCN(CC)C(=O)C1CC2[C@@H](CC3=CNC4=CC=CC2=C34)N(C1)C.C(C(C(=O)[O-])O)(C(=O)[O-])O	{32: 2, 1: 6, 2: 4, 3: 2, 33: 4, 11: 6, 12: 6, 14: 8, 20: 2, 24: 4}
Did not match all atoms present	176763-62-5	CC(C)(C)C1=CC(=C(C(=C1)C=N[C@@H]2CCCC[C@H]2N=CC3=CC(=CC(=C3[O-])C(C)(C)C)C(C)(C)C)[O-])C(C)(C)C.[Co+2]	{1: 12, 34: 2, 4: 4, 6: 2, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	1768-59-8	C1=CC=C(C=C1)NC(=S)NNC2=CC=CC=C2	{31: 3, 14: 10, 7: 1}
Did not match all atoms present	17683-09-9	CC1=CC=C(C=C1)NN=NCC2=CC=CC=C2	{1: 1, 2: 1, 34: 2, 14: 9, 31: 1}
Did not match all atoms present	17684-73-0	C1C2CC1C2(C3=CC=CC=C3)O	{20: 1, 11: 2, 12: 2, 13: 1, 14: 5}
Did not match all atoms present	17685-52-8	[CH-]=O.[CH-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe].[Fe+2]	{29: 12}
Did not match all atoms present	17687-37-5	C(=O)(N)N.[N+](=O)([O-])[O-]	{24: 1, 30: 2}
Did not match all atoms present	17688-68-5	C1CS(=O)(=O)CCN1C2=CC=CC=C2	{33: 1, 11: 4, 29: 2, 14: 5}
Did not match all atoms present	17689-77-9	CC[Si](OC(=O)C)(OC(=O)C)OC(=O)C	{1: 4, 2: 1, 28: 3}
Did not match all atoms present	1769-24-0	CC1=NC(=O)C2=CC=CC=C2N1	{32: 1, 1: 1, 35: 1, 14: 4, 25: 1}
Did not match all atoms present	1769-25-1	CC1=NC2=CC=CC=C2C(=O)N1C	{1: 2, 35: 1, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	1769-41-1	C1=CC=C(C=C1)NC(=O)/C=N\O	{34: 1, 6: 1, 14: 5, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	1769-99-9	C[NH+](C)CCCC1(C2=CC=CC=C2CCC3=CC=CC=C31)C#N.[Cl-]	{1: 2, 2: 3, 37: 1, 11: 2, 13: 1, 14: 8, 17: 1}
Did not match all atoms present	17691-19-9	C1=CC(=C(C=C1S(=O)(=O)[O-])[N+](=O)[O-])Cl.[Na+]	{17: 1, 38: 1, 29: 3, 14: 3}
Did not match all atoms present	17692-31-8	C1CN(CCN1CC(CO)O)C2=CC=CC=C2	{33: 2, 2: 2, 3: 1, 11: 4, 14: 5, 20: 2}
Did not match all atoms present	17692-34-1	C1CN(CCN1CCOCCOCCO)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl	{33: 2, 2: 6, 3: 1, 11: 4, 14: 9, 17: 1, 20: 1, 22: 2}
Did not match all atoms present	17692-39-6	C1COCCN1CCCC2=CC=C(C=C2)COC3=CC=CC=C3	{33: 1, 2: 4, 11: 4, 14: 9, 22: 1, 23: 1}
Did not match all atoms present	17692-51-2	CN1C[C@@H](C[C@H]2[C@H]1CC3=CN(C4=CC=CC2=C34)C)CNC(=O)OCC5=CC=CC=C5	{1: 2, 2: 2, 33: 2, 11: 3, 12: 3, 14: 9, 28: 1, 31: 1}
Did not match all atoms present	17695-46-4	CCCC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C	{1: 2, 2: 2, 28: 2, 14: 4}
Did not match all atoms present	17695-48-6	CCCCCCCCCCCCCCCC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C	{1: 2, 2: 14, 28: 2, 14: 4}
Did not match all atoms present	17696-37-6	CC1=CC(=C(C=C1C(C)(C)C)C)O	{1: 5, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	17696-53-6	COC1=CC(=CNC2=CC=CC=C2)C=CC1=O	{1: 1, 6: 1, 14: 8, 15: 2, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	17696-61-6	CCC(C)OC(=O)C1=CC=C(C=C1)O	{1: 2, 2: 1, 3: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	17696-69-4	CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)C(C)O)C)C(=C4CCC(=O)O)C)C(=C3C)CCC(=O)O)C(C)O.Cl.Cl	{32: 2, 1: 6, 2: 4, 3: 2, 14: 4, 17: 2, 35: 2, 20: 2, 27: 2}
Did not match all atoms present	17696-73-0	CS(=O)O	{1: 1, 20: 1, 29: 1}
Did not match all atoms present	17696-94-5	CCOC(=O)NNC(=O)NC1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 24: 1, 28: 1, 31: 3}
Did not match all atoms present	17697-12-0	C1=CC=C(C=C1)[Se](=O)O[Se](=O)C2=CC=CC=C2	{22: 1, 14: 10, 29: 2}
Did not match all atoms present	17700-09-3	C1=CC(=C(C(=C1[N+](=O)[O-])Cl)Cl)Cl	{17: 3, 38: 1, 14: 2}
Did not match all atoms present	17700-54-8	CC(=O)NC1=C(C=CC=C1Cl)Cl	{24: 1, 1: 1, 31: 1, 14: 3, 17: 2}
Did not match all atoms present	17700-55-9	CC1=C(C(=C(C=C1)Cl)NC(=O)C)Cl	{24: 1, 1: 2, 31: 1, 14: 2, 17: 2}
Did not match all atoms present	17701-76-7	CC(C)(C)CC(C)(C)N=C=S	{8: 1, 1: 5, 2: 1, 4: 2, 34: 1}
Did not match all atoms present	17702-11-3	COCCCN=C=S	{8: 1, 1: 1, 2: 3, 34: 1, 22: 1}
Did not match all atoms present	17702-41-9	[B][B][B][B][B][B][B][B][B][B]	{}
Did not match all atoms present	17702-57-7	CC1=C(C=CC(=C1)OC(=O)NC)N=CN(C)C	{1: 4, 34: 1, 6: 1, 33: 1, 14: 3, 28: 1, 31: 1}
Did not match all atoms present	17702-83-9	C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCCCCBr	{25: 2, 2: 8, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	177030-60-3	CCCOC1=NC(=O)NN1	{32: 2, 1: 1, 2: 2, 35: 1, 22: 1, 25: 1}
Did not match all atoms present	17704-22-2	C[Si]1(O[Si](O[Si](O[Si](O[Si](O1)(C)C=C)(C)C=C)(C)C=C)(C)C=C)C=C	{1: 5, 5: 5, 6: 5, 23: 5}
Did not match all atoms present	177087-92-2	CC1CCC(=C1)C[Si](C)(C)C	{1: 4, 2: 1, 11: 2, 12: 1, 14: 1, 15: 1}
Did not match all atoms present	177087-93-3	CC1(CCC(=C1)C[Si](C)(C)C)C	{1: 5, 2: 1, 11: 2, 13: 1, 14: 1, 15: 1}
Did not match all atoms present	17709-43-2	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)OP(=O)(OC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)OC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C	{1: 18, 4: 6, 14: 6, 21: 3, 22: 3, 29: 1}
Did not match all atoms present	17709-95-4	CN(C)C(=S)CC1=CC=CC=C1	{1: 2, 2: 1, 33: 1, 14: 5, 7: 1}
Did not match all atoms present	1771-18-2	COC1=CC2=C(C=C1)SC3=CC=CC=C3N2	{32: 1, 1: 1, 22: 1, 14: 7, 41: 1}
Did not match all atoms present	1771-19-3	COC1=CC2=C(C=C1)NC3=CC=CC=C3S2	{32: 1, 1: 1, 22: 1, 14: 7, 41: 1}
Did not match all atoms present	17710-62-2	C1=CC(=CC=C1NC(=S)OC2=CC=C(C=C2)Cl)Cl	{17: 2, 31: 1, 22: 1, 14: 8, 7: 1}
Did not match all atoms present	17710-63-3	CC(C)(C1=CC(=CC=C1)OC(=O)NC)O	{1: 3, 4: 1, 14: 4, 20: 1, 28: 1, 31: 1}
Did not match all atoms present	17710-64-4	CC(C)C1=CC(=CC(=C1O)C(C)C)OC(=O)NC	{1: 5, 3: 2, 14: 2, 21: 1, 28: 1, 31: 1}
Did not match all atoms present	17712-66-2	N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[K+].[K+].[K+].[Rh]	{34: 6, 29: 12}
Did not match all atoms present	17715-69-4	COC1=CC(=C(C=C1)Br)OC	{1: 2, 18: 1, 22: 2, 14: 3}
Did not match all atoms present	17719-22-1	CSCCNCC[NH+]=C(N)N.CSCCNCC[NH+]=C(N)N.[O-]S(=O)(=O)[O-]	{1: 2, 2: 8, 7: 2, 40: 2, 29: 4, 30: 4, 31: 4}
Did not match all atoms present	1772-10-7	CCC(C)C1=CC=CC(=C1)C	{1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	17722-17-7	C1=CC(=CC=C1NC(=O)CC#N)Cl	{2: 1, 37: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	17722-18-8	CCC(=O)NC1=CC=C(C=C1)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	1773-44-0	CC1=CC=CC=C1C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 1, 6: 1, 38: 2, 14: 7, 31: 1}
Did not match all atoms present	17734-21-3	C1=CC=C(C=C1)CCCCCN	{2: 5, 30: 1, 14: 5}
Did not match all atoms present	17737-65-4	CC1=C(C=CC=C1Cl)NC2=C(C=CC=N2)C(=O)O	{1: 1, 35: 1, 14: 6, 17: 1, 27: 1, 31: 1}
Did not match all atoms present	17739-47-8	N#P	{}
Did not match all atoms present	1774-34-1	C1=CC(=CC=C1O)S(=O)C2=CC=C(C=C2)O	{21: 2, 14: 8, 29: 1}
Did not match all atoms present	1774-35-2	CC1=CC=C(C=C1)S(=O)C2=CC=C(C=C2)C	{1: 2, 29: 1, 14: 8}
Did not match all atoms present	1774-47-6	C[S+](=O)(C)C.[I-]	{1: 3, 19: 1, 29: 1}
Did not match all atoms present	17741-62-7	C1CS(=O)(=O)CCN1C2=CC=C(C=C2)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl	{33: 1, 34: 2, 38: 1, 11: 4, 14: 6, 17: 2, 29: 2}
Did not match all atoms present	17742-69-7	COC1=C(C=C(C=C1Cl)[N+](=O)[O-])Cl	{1: 1, 38: 1, 22: 1, 14: 2, 17: 2}
Did not match all atoms present	17745-45-8	B(CCC)(O)O	{1: 1, 2: 2, 20: 2}
Did not match all atoms present	17747-43-2	CC(=O)OC1=CN=CC=C1	{1: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	1775-27-5	C1C(C(=O)C2=CC=CC=C21)Br	{25: 1, 18: 1, 11: 1, 12: 1, 14: 4}
Did not match all atoms present	1775-61-7	CN=C(C1=CC=CC=C1)OC	{1: 2, 34: 1, 22: 1, 14: 5, 7: 1}
Did not match all atoms present	1775-95-7	C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N	{24: 1, 38: 1, 30: 1, 14: 8}
Did not match all atoms present	17751-20-1	CC[NH+](CC)CC(=O)NC1=C(C=CC=C1Cl)Cl.[Cl-]	{1: 2, 2: 3, 14: 3, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	17752-85-1	C1=CC=C(C(=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 35: 3, 14: 7, 15: 2, 17: 2, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	177528-09-5	CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)[O-].[Na+]	{24: 1, 1: 6, 2: 14, 3: 5, 28: 4}
Did not match all atoms present	17754-68-6	CN(C1=CC=CC=C1)C2=CC=C(C=C2)N(C)C3=CC=CC=C3	{1: 2, 14: 14, 33: 2}
Did not match all atoms present	17754-90-4	CCN(CC)C1=CC(=C(C=C1)C=O)O	{1: 2, 2: 2, 33: 1, 14: 3, 21: 1, 26: 1}
Did not match all atoms present	17754-91-5	CCN(CC)C1=CC2=C(C=C1)C=C(C(=N)O2)C3=NC4=CC=CC=C4N3	{32: 1, 1: 2, 2: 2, 35: 1, 36: 1, 33: 1, 14: 8, 23: 1}
Did not match all atoms present	17755-37-2	C1=CC=C(C(=C1)O)SC2=CC=C(C=C2)O	{40: 1, 21: 2, 14: 8}
Did not match all atoms present	17756-05-7	C[As](C)(C)(F)F	{16: 2, 1: 3}
Did not match all atoms present	177570-73-9	CC(=C)P(=O)(O)OP(=O)(C(=C)C)O	{1: 2, 5: 2, 7: 2, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	1776-37-0	CC1=CC2=C(C=C1)NN=C2	{32: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	1776-66-5	B(C(C)C)(C(C)C)C(C)C	{1: 6, 3: 3}
Did not match all atoms present	1776-70-1	C1=CC=C(C=C1)S[As](SC2=CC=CC=C2)SC3=CC=CC=C3	{40: 3, 14: 15}
Did not match all atoms present	17760-13-3	C([Si](Cl)(Cl)Cl)(Cl)(Cl)Cl	{17: 6, 4: 1}
Did not match all atoms present	17760-68-8	C1C(=CC=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{11: 1, 14: 18, 15: 3}
Did not match all atoms present	17762-72-0	C1CNC(OC1)C2=CC=CC=C2	{32: 1, 11: 3, 12: 1, 14: 5, 23: 1}
Did not match all atoms present	17763-67-6	C1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F	{16: 3, 4: 1, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	17764-91-9	CCC(=O)C1=C(C(=CC=C1)Br)O	{1: 1, 2: 1, 14: 3, 18: 1, 21: 1, 24: 1}
Did not match all atoms present	17764-92-0	CCC(=O)C1=C(C=C(C=C1)Br)O	{1: 1, 2: 1, 14: 3, 18: 1, 21: 1, 24: 1}
Did not match all atoms present	17766-26-6	C1(=S)NC(=NC(=S)N1)[S-].[Na+].[Na+].[Na+]	{32: 2, 35: 1}
Did not match all atoms present	17766-62-0	CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC	{1: 6, 2: 1, 4: 1, 33: 2, 11: 4, 14: 6, 22: 3, 24: 1}
Did not match all atoms present	17766-63-1	COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=CC=CC=C3	{1: 3, 33: 2, 11: 4, 14: 7, 22: 3, 24: 1}
Did not match all atoms present	17766-66-4	COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl	{1: 3, 33: 2, 11: 4, 14: 6, 17: 1, 22: 3, 24: 1}
Did not match all atoms present	17766-68-6	COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC	{1: 4, 33: 2, 11: 4, 14: 6, 22: 4, 24: 1}
Did not match all atoms present	17766-70-0	COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC	{1: 4, 33: 2, 11: 4, 14: 6, 22: 4, 24: 1}
Did not match all atoms present	17766-75-5	CC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)OC)OC)OC	{1: 4, 33: 2, 11: 4, 14: 6, 22: 3, 24: 1}
Did not match all atoms present	17766-77-7	COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=CC=CC=N3	{1: 3, 35: 1, 33: 2, 11: 4, 14: 6, 22: 3, 24: 1}
Did not match all atoms present	17766-79-9	COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=NC=CS3	{1: 3, 35: 1, 33: 2, 41: 1, 11: 4, 14: 4, 22: 3, 24: 1}
Did not match all atoms present	1777-03-3	CC[Si](CC)(CC)C#C	{1: 3, 2: 3, 10: 1, 9: 1}
Did not match all atoms present	1777-82-8	C1=CC(=C(C=C1Cl)Cl)CO	{17: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	1777-84-0	CCOC1=C(C=C(C=C1)NC(=O)C)[N+](=O)[O-]	{1: 2, 2: 1, 38: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	17772-51-9	C1=CC=C2C(=C1)C=C(C(=C3C(=O)C4=CC=CC=C4C3=O)N2)O	{32: 1, 25: 2, 20: 1, 14: 9, 15: 3}
Did not match all atoms present	17774-08-2	CC(C)CC[Hg]Cl	{1: 2, 2: 2, 3: 1, 17: 1}
Did not match all atoms present	17774-09-3	CCCCCC[Hg]Cl	{1: 1, 2: 5, 17: 1}
Did not match all atoms present	17774-38-8	CC[Se]C1=CC=CC=C1	{1: 1, 2: 1, 14: 5}
Did not match all atoms present	17775-46-1	[Cl-].[Cl-].[Cl-].[Sc+3]	{17: 3}
Did not match all atoms present	177756-62-6	CC1=C(C=C(C=C1)C=O)F	{16: 1, 1: 1, 26: 1, 14: 3}
Did not match all atoms present	17776-78-2	C1=CC=C(C(=C1)OP(=O)(OC2=CC=CC=C2Cl)Cl)Cl	{17: 3, 22: 2, 14: 8, 29: 1}
Did not match all atoms present	17778-80-2	[O]	{}
Did not match all atoms present	17778-88-0	[N]	{}
Did not match all atoms present	1778-08-1	CN(C)C(=O)C1=CC=CC=C1O	{24: 1, 1: 2, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	1778-09-2	CC(=O)C1=CC=C(C=C1)SC	{24: 1, 1: 2, 14: 4, 40: 1}
Did not match all atoms present	17780-72-2	CN(CCCOC1=C(C=C(C=C1)Cl)Cl)CC#C	{1: 1, 2: 4, 33: 1, 9: 1, 10: 1, 14: 3, 17: 2, 22: 1}
Did not match all atoms present	17780-75-5	CN(CCCOC1=C(C=C(C=C1)Cl)Cl)CC#C.Cl	{1: 1, 2: 4, 33: 1, 9: 1, 10: 1, 14: 3, 17: 3, 22: 1}
Did not match all atoms present	17781-15-6	CC1(C(C2=C(O1)C(=CC=C2)O)O)C	{1: 2, 12: 1, 13: 1, 14: 3, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	17784-47-3	C1=CC=C2C(=C1)C=C3C=CC=CC3=N2.Cl	{17: 1, 35: 1, 14: 9}
Did not match all atoms present	17786-31-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co].[Co].[Co]	{29: 12}
Did not match all atoms present	17786-67-3	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Fe+3]	{16: 18, 24: 3, 4: 6, 6: 3, 7: 3}
Did not match all atoms present	17788-00-0	CC1=C(C=CC(=C1Cl)O)Cl	{1: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	17789-14-9	C1COC(O1)C2=CC(=CC=C2)Br	{18: 1, 11: 2, 12: 1, 14: 4, 23: 2}
Did not match all atoms present	1779-10-8	C1=CC2=C(C(=C(C=C2C=C1Br)C(=O)O)O)Br	{18: 2, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	1779-11-9	C1=CC(=CC2=CC(=C(C=C21)O)C(=O)O)Br	{18: 1, 27: 1, 21: 1, 14: 5}
Did not match all atoms present	1779-25-5	CC(C)C[Al](CC(C)C)Cl	{1: 4, 2: 2, 3: 2, 17: 1}
Did not match all atoms present	1779-48-2	C1=CC=C(C=C1)[P+](=O)O	{20: 1, 29: 1, 14: 5}
Did not match all atoms present	1779-49-3	C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 18: 1, 14: 15}
Did not match all atoms present	1779-51-7	CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 2: 3, 18: 1, 14: 15}
Did not match all atoms present	1779-58-4	COC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 2: 1, 28: 1, 18: 1, 14: 15}
Did not match all atoms present	17791-52-5	CC(C)(C)OC(=O)N[C@@H](CC1=CN=CN1)C(=O)O	{32: 1, 1: 3, 2: 1, 3: 1, 4: 1, 14: 2, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	17795-26-5	C=CCS(=O)C[C@@H](C(=O)O)N	{2: 2, 3: 1, 5: 1, 6: 1, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	17796-82-6	C1CCC(CC1)SN2C(=O)C3=CC=CC=C3C2=O	{33: 1, 40: 1, 11: 5, 12: 1, 14: 4, 25: 2}
Did not match all atoms present	177966-64-2	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=C(C=C4)F)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	177985-32-9	C1=CC(=C(C=C1F)Cl)CC(=O)O	{16: 1, 17: 1, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	1780-19-4	CC1CCC2=CC=CC=C2N1	{32: 1, 1: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	1780-31-0	CC1=CN=C(N=C1Cl)Cl	{1: 1, 35: 2, 14: 1, 17: 2}
Did not match all atoms present	1780-40-1	C1(=C(N=C(N=C1Cl)Cl)Cl)Cl	{17: 4, 35: 2}
Did not match all atoms present	17804-35-2	CCCCNC(=O)N1C2=CC=CC=C2N=C1NC(=O)OC	{1: 2, 2: 3, 35: 1, 33: 1, 14: 4, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	17804-49-8	C1=CC=C(C=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 35: 3, 14: 8, 15: 2, 17: 2, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	17814-85-6	C1=CC=C(C=C1)[P+](CCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{2: 4, 27: 1, 18: 1, 14: 15}
Did not match all atoms present	17816-11-4	CN(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N=C=S	{1: 2, 34: 1, 6: 2, 33: 1, 8: 1, 14: 8}
Did not match all atoms present	1782-89-4	C1CS1(=O)=O	{11: 2, 29: 2}
Did not match all atoms present	17822-71-8	C1=CC(=C(C=C1N(CCO)CCO)Cl)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])Cl	{33: 1, 2: 4, 38: 1, 34: 2, 14: 5, 17: 2, 18: 1, 20: 2}
Did not match all atoms present	17822-72-9	CCN(CC)CCOC1=CC=CC=C1C(=O)NC2=CC=CC=C2Cl	{1: 2, 2: 4, 33: 1, 14: 8, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	17822-74-1	CCN(CC)CCOC1=C(C=CC=C1C)C(=O)NC2=CC=CC=C2	{1: 3, 2: 4, 33: 1, 14: 8, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	17823-38-0	C(#N)C1=C(C(=C(C(=C1F)F)N)F)F	{16: 4, 37: 1, 30: 1}
Did not match all atoms present	17823-46-0	C1(=C(C(=C(C(=C1F)F)Br)F)F)C(F)(F)F	{16: 7, 18: 1, 4: 1}
Did not match all atoms present	178233-72-2	[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)C	{16: 20, 1: 3, 3: 1, 14: 8, 19: 1}
Did not match all atoms present	17824-83-8	C(#N)C1=C(C(=C(C(=N1)Cl)Cl)Cl)Cl	{17: 4, 35: 1, 37: 1}
Did not match all atoms present	17829-66-2	C(C(=O)[O-])N.C(C(=O)[O-])N.[Co+2]	{24: 2, 2: 2, 30: 2}
Did not match all atoms present	17829-86-6	CC(=O)O.CC(=O)O.CC(=O)O.[Sm]	{1: 3, 27: 3}
Did not match all atoms present	1783-25-1	CN(C)C=NC1=CC=CC=C1	{1: 2, 34: 1, 14: 5, 6: 1, 33: 1}
Did not match all atoms present	1783-81-9	CSC1=CC=CC(=C1)N	{40: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	1783-82-0	CCSC1=CC=CC(=C1)N	{40: 1, 1: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	17832-16-5	C=CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC=C)C(=O)OCC=C	{2: 3, 14: 3, 28: 3, 5: 3, 6: 3}
Did not match all atoms present	17834-19-4	CC(C(=O)O)NCC1=CC2=C(C=C1)OCO2	{1: 1, 2: 1, 3: 1, 11: 1, 14: 3, 23: 2, 27: 1, 31: 1}
Did not match all atoms present	17835-81-3	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ga+3]	{17: 3, 29: 12}
Did not match all atoms present	178374-78-2	CCC(=O)C1=CC(=C(C(=C1)F)O)F	{1: 1, 2: 1, 14: 2, 16: 2, 21: 1, 24: 1}
Did not match all atoms present	1784-04-9	COC(=O)[C@H](CCCN=C(N)N)NC(=O)C1=CC=CC=C1.Cl	{1: 1, 2: 3, 3: 1, 7: 1, 34: 1, 14: 5, 17: 1, 24: 1, 28: 1, 30: 2, 31: 1}
Did not match all atoms present	17841-44-0	CCCO[Si](CC)(CC)CC	{1: 4, 2: 5, 22: 1}
Did not match all atoms present	17841-46-2	CCC[Si](CCC)(CCC)OC	{1: 4, 2: 6, 22: 1}
Did not match all atoms present	17843-09-3	C[Si](C)(C)N1C2C3CCC(C3)C2N=N1	{1: 3, 11: 3, 12: 4, 35: 2, 33: 1}
Did not match all atoms present	178481-68-0	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)CCCC6=CC=C(C=C6)N(CCCl)CCCl	{32: 2, 1: 1, 2: 7, 35: 2, 33: 3, 11: 4, 14: 10, 17: 2}
Did not match all atoms present	17849-38-6	C1=CC=C(C(=C1)CO)Cl	{17: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	1785-02-0	C1=CC=C(C=C1)N2C(=O)N(C(=O)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4	{25: 3, 14: 15, 33: 3}
Did not match all atoms present	1785-51-9	C1=CC2=C3C(=CC=C4C3=C1C=CC4=O)C=CC2=O	{25: 2, 14: 8}
Did not match all atoms present	1785-61-1	C#CC1=CC(=CC=C1)C#C	{9: 2, 10: 2, 14: 4}
Did not match all atoms present	1785-74-6	C1CC2=CC=CC=C2C(=NO)C3=CC=CC=C31	{34: 1, 11: 2, 20: 1, 14: 8, 15: 1}
Did not match all atoms present	1785-95-1	C1=CC=C(C=C1)C(=O)C2C(=O)C3=CC=CC=C3C2=O	{24: 1, 25: 2, 12: 1, 14: 9}
Did not match all atoms present	1785-98-4	CC(=O)CC(C1C(=O)C2=CC=CC=C2C1=O)C3=CC=CC=C3	{1: 1, 2: 1, 3: 1, 12: 1, 14: 9, 24: 1, 25: 2}
Did not match all atoms present	17851-27-3	CCC1=C(C=C(C(=C1)C)C)C	{1: 4, 2: 1, 14: 2}
Did not match all atoms present	17851-53-5	CCCCOC(=O)C1=CC=CC=C1C(=O)OCC(C)C	{1: 3, 2: 4, 3: 1, 28: 2, 14: 4}
Did not match all atoms present	17852-98-1	CC1=CC(=C(C=C1)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-].[Ba+2]	{1: 1, 34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	17853-53-1	C1C=CCC23C1(CC=CC2)CS(=O)C3	{11: 6, 13: 2, 14: 4, 29: 1}
Did not match all atoms present	17853-54-2	C1C=CCC23C1(CC=CC2)CS(=O)(=O)C3	{11: 6, 13: 2, 14: 4, 29: 2}
Did not match all atoms present	17854-59-0	COC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)CN4CCCCC4	{1: 1, 2: 1, 33: 1, 11: 5, 14: 6, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	17857-14-6	C1=CC=C(C=C1)[P+](CCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{2: 3, 27: 1, 18: 1, 14: 15}
Did not match all atoms present	1786-81-8	CCCNC(C)C(=O)NC1=CC=CC=C1C.Cl	{1: 3, 2: 2, 3: 1, 14: 4, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	1786-87-4	C1=CC(=CC(=C1)C(=O)OO)C(=O)OO	{28: 2, 20: 2, 14: 4}
Did not match all atoms present	17861-06-2	CCOC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 1, 35: 3, 14: 2, 22: 1}
Did not match all atoms present	17861-60-8	CC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 8, 2: 1, 22: 2}
Did not match all atoms present	17861-62-0	N(=O)[O-].N(=O)[O-].[Ni+2]	{34: 2, 29: 4}
Did not match all atoms present	17864-15-2	C[Si](C)(C)C1=CC(=C(C=C1)[Si](C)(C)C)[Si](C)(C)C	{1: 9, 14: 3}
Did not match all atoms present	17864-93-6	C[Si](CCC1CCC=CC1)(Cl)Cl	{1: 1, 2: 2, 11: 3, 12: 1, 14: 2, 17: 2}
Did not match all atoms present	17865-07-5	CCC[Si](OC(=O)C)(OC(=O)C)OC(=O)C	{1: 4, 2: 2, 28: 3}
Did not match all atoms present	17865-32-6	CO[Si](C)(C1CCCCC1)OC	{1: 3, 11: 5, 12: 1, 22: 2}
Did not match all atoms present	17865-85-9	C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)C)C)C)C)C)C)C	{1: 8, 23: 12}
Did not match all atoms present	17869-07-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCO)N	{2: 2, 14: 5, 20: 1, 21: 1, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	17869-10-2	COCCOC1=C(C2=C(C(=C1)O)C(=O)C3=CC=CC=C3C2=O)N	{1: 1, 2: 2, 14: 5, 21: 1, 22: 2, 25: 2, 30: 1}
Did not match all atoms present	17869-11-3	COCCOCCOC1=C(C2=C(C(=C1)O)C(=O)C3=CC=CC=C3C2=O)N	{1: 1, 2: 4, 14: 5, 21: 1, 22: 3, 25: 2, 30: 1}
Did not match all atoms present	17869-27-1	C1CO[Si]2(OCCN1CCO2)CCCN	{33: 1, 2: 3, 11: 6, 30: 1, 23: 3}
Did not match all atoms present	17869-77-1	CC(C)(C#C)O[Si](C)(C)C	{1: 5, 10: 1, 4: 1, 22: 1, 9: 1}
Did not match all atoms present	1787-27-5	C1=CC=C2C=CC=CC2=C1.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 11}
Did not match all atoms present	1787-61-7	C1=CC=C2C(=C1)C=CC(=C2O)N/N=C\3/C4=C(C=C(C=C4)[N+](=O)[O-])C(=CC3=O)S(=O)(=O)[O-].[Na+]	{34: 1, 38: 1, 14: 10, 15: 2, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	17870-64-3	CO/C(=C(/C(=O)OC)\[N+]1=CC=CC2=CC=CC=C21)/[O-]	{1: 2, 33: 1, 7: 2, 14: 7, 22: 1, 28: 1}
Did not match all atoms present	17872-56-9	CC(CO)(CO)C(=O)NNC1=CC=CC=C1	{1: 1, 2: 2, 4: 1, 14: 5, 20: 2, 24: 1, 31: 2}
Did not match all atoms present	17873-08-4	C[Si](C)(C)CSC1=CC=CC=C1	{40: 1, 1: 3, 2: 1, 14: 5}
Did not match all atoms present	17873-13-1	C[Si](C)CCC1=CC=CC=C1	{1: 2, 2: 2, 14: 5}
Did not match all atoms present	17873-29-9	C[SiH](C)C1=CC=C(C=C1)[Si](C)(C)Cl	{1: 4, 14: 4, 17: 1}
Did not match all atoms present	17874-32-7	CC1=CC(=O)OC2=C1C=C(C=C2)C(C)(C)C	{1: 4, 4: 1, 14: 4, 28: 1}
Did not match all atoms present	17874-34-9	CC1=CC(=C2C(=C1)C(=CC(=O)O2)C)C(C)(C)C	{1: 5, 4: 1, 14: 3, 28: 1}
Did not match all atoms present	17877-17-7	C[Si](C)(C)CN1CCCCC1	{1: 3, 2: 1, 11: 5, 33: 1}
Did not match all atoms present	17877-23-5	CC(C)[Si](C(C)C)(C(C)C)O	{1: 6, 3: 3, 20: 1}
Did not match all atoms present	17878-44-3	C[Si](C)(C)OC1=CC=C(C=C1)Br	{1: 3, 18: 1, 22: 1, 14: 4}
Did not match all atoms present	17878-69-2	COC1=CC=CC2=C1C(=O)C3=C(C=C4C(=C3O2)[C@@H]5C=CO[C@@H]5O4)OC	{1: 2, 12: 2, 14: 6, 22: 2, 23: 3, 25: 1}
Did not match all atoms present	1788-10-9	CC(=O)C1=CC=C(C=C1)S(=O)(=O)Cl	{24: 1, 1: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	1788-31-4	C1=CC=C(C=C1)CC(=NO)CC2=CC=CC=C2	{2: 2, 20: 1, 34: 1, 14: 10, 7: 1}
Did not match all atoms present	1788-93-8	CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl	{1: 1, 35: 1, 33: 1, 14: 8, 17: 1, 25: 1}
Did not match all atoms present	17880-88-5	C1=CC2=C(C=C1C(=O)Cl)N=C(C(=N2)Cl)Cl	{24: 1, 17: 3, 35: 2, 14: 3}
Did not match all atoms present	17881-28-6	C[Si](C)(C)N=NC1=CC=CC=C1	{1: 3, 34: 2, 14: 5}
Did not match all atoms present	17881-49-1	C[Si](C)(C)OC(=O)C1=CC=CC=N1	{1: 3, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	17881-65-1	C[Si](C)(C)OC1=CC=CC=C1Cl	{1: 3, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	17881-88-8	CO[Si](C)(C)C1=CC=CC=C1	{1: 3, 22: 1, 14: 5}
Did not match all atoms present	17882-06-3	C[Si](C)(C)OS(=O)(=O)C1=CC=CC=C1	{1: 3, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	17882-66-5	C[Si]1(O[Si](O[Si](O[Si](O1)(C)C)(C)CCl)(C)C)C	{1: 7, 2: 1, 23: 4, 17: 1}
Did not match all atoms present	17882-91-6	C[Si](C)(C)CNC[Si](C)(C)C	{1: 6, 2: 2, 31: 1}
Did not match all atoms present	17882-94-9	CC[Si](C)(C)N[Si](C)(C)CC	{1: 6, 2: 2, 31: 1}
Did not match all atoms present	17887-09-1	CC[Si](CC)(CC)CCCN	{1: 3, 2: 6, 30: 1}
Did not match all atoms present	17887-41-1	CC(C)(C)[Si](C1=CC=CC=C1)(Cl)Cl	{1: 3, 4: 1, 14: 5, 17: 2}
Did not match all atoms present	17887-80-8	C[Si](C)(C)OCCCO[Si](C)(C)C	{1: 6, 2: 3, 22: 2}
Did not match all atoms present	17888-62-9	CCCCCCO[Si](C)(C)C	{1: 4, 2: 5, 22: 1}
Did not match all atoms present	1789-58-8	CC[Si](Cl)Cl	{1: 1, 2: 1, 17: 2}
Did not match all atoms present	17890-53-8	CCCCc1cc2ccccc2s1	{1: 1, 2: 3, 14: 5, 41: 1}
Did not match all atoms present	17891-65-5	C[Si](C)(C)CC(=C)[Si](C)(C)C	{1: 6, 2: 1, 5: 1, 7: 1}
Did not match all atoms present	17893-55-9	C1=CC(=CC=C1[N+](=O)[O-])[Se]CC(=O)O	{2: 1, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	17893-64-0	[O-]P(=O)([O-])[O-].[Cs+].[Cs+].[Cs+]	{29: 4}
Did not match all atoms present	17894-25-6	COC1=CC(=C(C=C1)OC)C(=O)NN	{1: 2, 14: 3, 22: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	17894-26-7	COC1=CC(=C(C(=C1)C(=O)O)OC)[N+](=O)[O-]	{38: 1, 1: 2, 27: 1, 22: 2, 14: 2}
Did not match all atoms present	17895-40-8	CC1=CC(=C(C=C1N)N)N=NC2=CC=C(C=C2)S(=O)(=O)O	{1: 1, 34: 2, 14: 6, 20: 1, 29: 2, 30: 2}
Did not match all atoms present	17902-23-7	C1CC(OC1)N2C=C(C(=O)NC2=O)F	{32: 1, 33: 1, 11: 3, 12: 1, 14: 1, 16: 1, 23: 1, 25: 2}
Did not match all atoms present	17903-05-8	COCCO[Si](C1=CC=CC=C1)(OCCOC)OCCOC	{1: 3, 2: 6, 22: 6, 14: 5}
Did not match all atoms present	17906-08-0	C[Si](C)(C)OC(=O)CCCCCCCC(=O)O[Si](C)(C)C	{1: 6, 2: 7, 28: 2}
Did not match all atoms present	17906-69-3	CCCO[Si](OCCC)(OC(=O)C)OC(=O)C	{1: 4, 2: 4, 28: 2, 22: 2}
Did not match all atoms present	17906-71-7	C[Si](C)(C)C1=CC=C(S1)[Si](C)(C)C	{1: 6, 14: 2, 41: 1}
Did not match all atoms present	17906-77-3	CCOC(=O)C(C[Si](C)(C)C)C(=O)C	{24: 1, 1: 5, 2: 2, 3: 1, 28: 1}
Did not match all atoms present	179090-36-9	C1=CC=C2C(=C1)C(=O)N(C2=O)CCC[C@H](C(=O)[O-])Br	{33: 1, 2: 3, 3: 1, 14: 4, 18: 1, 24: 1, 25: 2}
Did not match all atoms present	179113-90-7	B(C1=CC(=CC=C1)OC(F)(F)F)(O)O	{16: 3, 20: 2, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	17918-11-5	C1CN1CC(C2=CC=CC=C2)O	{33: 1, 2: 1, 3: 1, 11: 2, 14: 5, 20: 1}
Did not match all atoms present	1792-41-2	CC1=CC2=C(C=C1)N=C(N2)C	{32: 1, 1: 2, 35: 1, 14: 3}
Did not match all atoms present	17920-24-0	CC(=C)C1=CC=C(C=C1)[Si](C)(C)C	{1: 4, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	17921-76-5	C[Si](C)(C)O[As](=O)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 29: 1, 22: 3}
Did not match all atoms present	17922-87-1	CC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)CN	{1: 1, 2: 2, 3: 2, 14: 5, 24: 2, 27: 1, 30: 1, 31: 2}
Did not match all atoms present	17923-49-8	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Mo+4]	{}
Did not match all atoms present	17924-92-4	C[C@H]1CCCC(=O)CCC/C=C/C2=CC(=CC(=C2C(=O)O1)O)O	{1: 1, 11: 6, 12: 1, 14: 4, 21: 2, 25: 1, 28: 1}
Did not match all atoms present	17926-77-1	C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.O.[Sc].[Sc]	{27: 6}
Did not match all atoms present	17927-57-0	[B][B]Cl	{17: 1}
Did not match all atoms present	17927-72-9	CC([O-])C.CC([O-])C.C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Ti+4]	{1: 8, 3: 2, 6: 2, 7: 2, 24: 2, 29: 2}
Did not match all atoms present	17928-28-8	C[Si](C)(C)O[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 10, 22: 3}
Did not match all atoms present	17928-31-3	CO[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OC	{1: 10, 22: 5}
Did not match all atoms present	17929-01-0	C[N+](CC=C)(CC=C)CC=C.COS(=O)(=O)[O-]	{1: 2, 2: 3, 5: 3, 6: 3, 22: 1, 29: 3}
Did not match all atoms present	1793-07-3	COC(=O)C1=CC=CC=C1N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	1793-90-4	CC[Ge](CC)(CC)CC=C	{1: 3, 2: 4, 5: 1, 6: 1}
Did not match all atoms present	17932-62-6	CCO[Si](C(C)C#N)(OCC)OCC	{1: 4, 2: 3, 3: 1, 37: 1, 22: 3}
Did not match all atoms present	17933-03-8	B(C1=CC(=CC=C1)C)(O)O	{1: 1, 20: 2, 14: 4}
Did not match all atoms present	17933-09-4	B(C)(C)I	{1: 2, 19: 1}
Did not match all atoms present	17933-16-3	B(C)(Br)Br	{1: 1, 18: 2}
Did not match all atoms present	17933-85-6	CCO[Si](C=C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 5: 1, 6: 1, 14: 10, 22: 1}
Did not match all atoms present	17935-66-9	C=CC1=CC=CC2=C1C(=CC=C2)C=C	{14: 6, 5: 2, 6: 2}
Did not match all atoms present	17937-68-7	C=C[Si](C=C)(C1=CC=CC=C1)C2=CC=CC=C2	{14: 10, 5: 2, 6: 2}
Did not match all atoms present	17938-13-5	C[Si](C)(C)C#CC1=CC=C(C=C1)C#C[Si](C)(C)C	{1: 6, 10: 4, 14: 4}
Did not match all atoms present	1794-24-7	CCN(CC)P(=O)(N(CC)CC)Cl	{1: 4, 2: 4, 33: 2, 29: 1, 17: 1}
Did not match all atoms present	17948-33-3	CC(=C)C1CC2=C3C(=C(C=C2O1)O)C(=O)C4=CC=CC=C4N3C	{1: 2, 5: 1, 7: 1, 11: 1, 12: 1, 14: 5, 21: 1, 23: 1, 25: 1, 33: 1}
Did not match all atoms present	17949-75-6	O.O.O.O.[Cu]	{}
Did not match all atoms present	1795-01-3	CCC1=CSC=C1	{1: 1, 2: 1, 14: 3, 41: 1}
Did not match all atoms present	1795-05-7	CC1=CC(=C(S1)C)C	{1: 3, 14: 1, 41: 1}
Did not match all atoms present	1795-31-9	C[Si](C)(C)OP(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 22: 3}
Did not match all atoms present	1795-96-6	CCOC(=O)C(CC1=CC=CC=C1)N	{1: 1, 2: 2, 3: 1, 14: 5, 28: 1, 30: 1}
Did not match all atoms present	17950-40-2	CC[O+](CC)CC.F[P-](F)(F)(F)(F)F	{16: 6, 1: 3, 2: 3}
Did not match all atoms present	17955-46-3	CCCC[Sn](CCCC)CCCC.C[Si](C)C	{1: 6, 2: 9}
Did not match all atoms present	17957-38-9	CCCCOCC(OCCCC)(OCCCC)[SiH3]	{1: 3, 2: 10, 4: 1, 22: 3}
Did not match all atoms present	17958-39-3	C[C@@H]([C@](C(C)C)(C(=O)OCC1=CC[NH+]2[C@@H]1CCC2)O)O.[Cl-]	{1: 3, 2: 1, 3: 2, 4: 1, 11: 4, 12: 1, 14: 1, 15: 1, 17: 1, 20: 2, 28: 1}
Did not match all atoms present	17958-73-5	C1=CC=C(C=C1)NC2=NC(=NC(=N2)NCCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)NCCO)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 4, 35: 6, 6: 2, 14: 16, 20: 2, 29: 6, 31: 6}
Did not match all atoms present	17959-11-4	CC(C)OC1=CC=CC=C1OC(=O)NCC(=O)COC	{1: 3, 2: 2, 3: 1, 14: 4, 22: 2, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	17959-12-5	CC(C)OC1=CC=CC=C1OC(=O)N(C)C(=O)CSC	{1: 4, 2: 1, 3: 1, 33: 1, 40: 1, 14: 4, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	1796-05-0	C1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\[N+](=O)[O-])/[N+](=O)[O-]	{38: 2, 14: 10, 7: 2}
Did not match all atoms present	17960-21-3	CC(=O)C1=C(ON=C1C2=CC=C(O2)[N+](=O)[O-])C3=CC=CC=C3	{1: 1, 35: 1, 38: 1, 14: 7, 23: 2, 24: 1}
Did not match all atoms present	17962-31-1	C[Si]1(O[Si](O[Si](O1)(C)C2=CC=CC=C2)(C)C)C	{1: 5, 14: 5, 23: 3}
Did not match all atoms present	17962-38-8	CCOC(=O)C(C[Si](C)(C)C)C(=O)OCC	{1: 5, 2: 3, 3: 1, 28: 2}
Did not match all atoms present	17963-04-1	CCO[Si](C)(C)CCCOCC1CO1	{1: 3, 2: 5, 11: 1, 12: 1, 22: 2, 23: 1}
Did not match all atoms present	17964-10-2	CC[Si](CC)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 2, 14: 10}
Did not match all atoms present	17964-30-6	C[Si](C)(CC1=CC=CC=C1)CC2=CC=CC=C2	{1: 2, 2: 2, 14: 10}
Did not match all atoms present	17964-77-1	C[SiH](CCCl)C1=CC=CC=C1	{1: 1, 2: 2, 14: 5, 17: 1}
Did not match all atoms present	17965-47-8	C1C2=C(C3=C1SC=C3)SC=C2	{41: 2, 11: 1, 14: 4}
Did not match all atoms present	17969-20-9	C1=CC(=CC=C1C2=NC(=CS2)CC(=O)O)Cl	{2: 1, 35: 1, 41: 1, 14: 5, 17: 1, 27: 1}
Did not match all atoms present	1797-33-7	CCCCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 13, 29: 3, 14: 4}
Did not match all atoms present	1797-74-6	C=CCOC(=O)CC1=CC=CC=C1	{2: 2, 14: 5, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	17972-08-6	CN=CC1=CC=CC=C1Cl	{1: 1, 34: 1, 14: 4, 6: 1, 17: 1}
Did not match all atoms present	17976-92-0	C1=CC2=C3C(=C1)C(C(C3=CC=C2)O)O	{20: 2, 12: 2, 14: 6}
Did not match all atoms present	17977-68-3	C1=CC=C(C=C1)C[Sn](CC2=CC=CC=C2)(CC3=CC=CC=C3)OC=O	{2: 3, 26: 1, 14: 15}
Did not match all atoms present	17978-77-7	CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.[Pr+3]	{1: 9, 4: 12, 6: 3, 7: 3, 16: 21, 24: 3}
Did not match all atoms present	1798-04-5	CC(C)(C)C1=CC=C(C=C1)OCC(=O)O	{1: 3, 2: 1, 4: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	1798-06-7	C1=CC(=CC=C1CC(=O)O)I	{27: 1, 2: 1, 19: 1, 14: 4}
Did not match all atoms present	1798-09-0	COC1=CC=CC(=C1)CC(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	1798-11-4	C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)O	{38: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	1798-49-8	C1CN(COC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl	{33: 1, 2: 2, 3: 1, 11: 4, 14: 9, 17: 2, 22: 1, 23: 1}
Did not match all atoms present	1798-50-1	C1CNCCC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O.Cl	{32: 1, 4: 1, 11: 4, 12: 1, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	1798-84-1	C1CC1C2=CC=C(C=C2)Cl	{17: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	17980-09-5	CC1=CC2=C(C=C1)C3=CC=CC=C3C(=C2)C	{1: 2, 14: 8}
Did not match all atoms present	17980-32-4	CC(C)C[Si](CC(C)C)(OC)OC	{1: 6, 2: 2, 3: 2, 22: 2}
Did not match all atoms present	17980-47-1	CCO[Si](CC(C)C)(OCC)OCC	{1: 5, 2: 4, 3: 1, 22: 3}
Did not match all atoms present	17980-64-2	COCCO[Si](C)(OCCOC)OCCOC	{1: 4, 2: 6, 22: 6}
Did not match all atoms present	17985-72-7	C[Si](C)C1=CC=CC=C1[Si](C)C	{1: 4, 14: 4}
Did not match all atoms present	17986-01-5	CN=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 34: 1, 14: 15}
Did not match all atoms present	17988-31-7	C=CCO[Si](C=C)(OCC=C)OCC=C	{2: 3, 22: 3, 5: 4, 6: 4}
Did not match all atoms present	17988-70-4	CCN(C[Si](C)(C)C)C[Si](C)(C)C	{1: 7, 2: 3, 33: 1}
Did not match all atoms present	17989-95-6	C1CC2CC1CC2C3=CC=CC=C3	{11: 4, 12: 3, 14: 5}
Did not match all atoms present	179897-89-3	C1=CC(=C(C=C1Br)C#N)F	{16: 1, 18: 1, 37: 1, 14: 3}
Did not match all atoms present	179897-90-6	C1=C(C=C(C(=C1Br)Cl)Br)F	{16: 1, 17: 1, 18: 2, 14: 2}
Did not match all atoms present	17992-03-9	[Al-](Cl)(Cl)(Cl)Cl.[Cs+]	{17: 4}
Did not match all atoms present	17994-17-1	CC(=O)N1C=C(C2=C1C=CC(=C2)O)CCN	{1: 1, 2: 2, 33: 1, 14: 4, 21: 1, 24: 1, 30: 1}
Did not match all atoms present	17995-04-9	C[Si](C)(C)NC1=NC=NC2=C1N=CN2[Si](C)(C)C	{1: 6, 35: 3, 33: 1, 14: 2, 31: 1}
Did not match all atoms present	17995-33-4	C[Si]12C[Si]3(C[Si](C1)(C[Si](C2)(C3)C)C)C	{1: 4, 11: 6}
Did not match all atoms present	17998-91-3	CC(=O)O[Si](C)(C1=CC=CC=C1)OC(=O)C	{1: 3, 28: 2, 14: 5}
Did not match all atoms present	1800-29-9	C1(=C(C(=C(C(=C1F)F)F)F)F)N=[N+](C2=C(C(=C(C(=C2F)F)F)F)F)[O-]	{16: 10, 33: 1, 34: 1, 29: 1}
Did not match all atoms present	1800-40-4	C1=CC=C2C(=C1)OC3=C(S2)C=C(C=C3)F	{16: 1, 41: 1, 14: 7, 23: 1}
Did not match all atoms present	18000-27-6	[Li+].[Li+].[Li+].[Li+].C[Si-](C)C.C[Si-](C)C.C[Si-](C)C.C[Si-](C)C	{1: 12}
Did not match all atoms present	180006-15-9	CCCCCCCC[Si](C)(C)O[Si](C)(C)C	{1: 6, 2: 7, 22: 1}
Did not match all atoms present	18001-46-2	C[Si](C)(CC1=CC=CC=C1)C=C	{1: 2, 2: 1, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	18001-91-7	C[Si](C)(C)OCCCCO[Si](C)(C)C	{1: 6, 2: 4, 22: 2}
Did not match all atoms present	18002-79-4	C1CC[Si](CC1)(C2=CC=CC=C2)C3=CC=CC=C3	{11: 5, 14: 10}
Did not match all atoms present	18004-57-4	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=NO	{34: 1, 20: 1, 14: 9, 6: 1}
Did not match all atoms present	18005-40-8	CCOP(=S)(C)O	{1: 2, 2: 1, 20: 1, 22: 1}
Did not match all atoms present	1801-10-1	C1=CC(=CC(=C1)C(F)(F)F)C(=O)N	{16: 3, 24: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	1801-14-5	CN(C)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 2, 33: 1}
Did not match all atoms present	1801-42-9	C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C32)C4=CC=CC=C4	{25: 1, 14: 14, 15: 2}
Did not match all atoms present	18014-08-9	COCCCN1C(=O)C2=CC(=C3C4=CC=CC=C4SC5=C(C=C(C2=C35)C1=O)OC)[N+](=O)[O-]	{1: 2, 2: 3, 38: 1, 33: 1, 41: 1, 14: 6, 22: 2, 25: 2}
Did not match all atoms present	18015-86-6	[B](I)I	{19: 2}
Did not match all atoms present	18016-42-7	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)OCCOCCOC)C)C	{1: 6, 2: 7, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 22: 2}
Did not match all atoms present	18017-73-7	C1=CC=C(C=C1)CCCCCCCCCC(=O)O	{2: 9, 27: 1, 14: 5}
Did not match all atoms present	18018-33-2	CCN1C(=NC2=C1C=C(C(=C2)C(F)(F)F)[N+](=O)[O-])C	{1: 2, 2: 1, 35: 1, 4: 1, 38: 1, 33: 1, 14: 2, 16: 3}
Did not match all atoms present	18018-34-3	CCN1C(=NC2=C1C=C(C(=C2)C(F)(F)F)N)C	{1: 2, 2: 1, 35: 1, 4: 1, 33: 1, 14: 2, 16: 3, 30: 1}
Did not match all atoms present	180181-93-5	C1=CC=C(C=C1)C(CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 2, 3: 1, 12: 1, 14: 13, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1802-34-2	C1=CC=C(C=C1)CCCC2=CN=CC=C2	{2: 3, 35: 1, 14: 9}
Did not match all atoms present	1802-94-4	C[Sn]1(C2=CC=CC=C2OC3=CC=CC=C31)C	{1: 2, 14: 8, 23: 1}
Did not match all atoms present	18023-33-1	CC(C)O[Si](C=C)(OC(C)C)OC(C)C	{1: 6, 22: 3, 3: 3, 5: 1, 6: 1}
Did not match all atoms present	18023-52-4	CCCCCCC(C)O[Si](C)(C)C	{1: 5, 2: 5, 3: 1, 22: 1}
Did not match all atoms present	18024-11-8	CC1=C2C3=CC=CC=C3N(C2=C(C=C1)C)C	{1: 3, 14: 6, 33: 1}
Did not match all atoms present	18026-71-6	CN(C)[Si](C)(Cl)Cl	{1: 3, 33: 1, 17: 2}
Did not match all atoms present	18027-10-6	C[Si](C)(C)[O-].[Na+]	{1: 3, 29: 1}
Did not match all atoms present	18027-80-0	C[Si](C)(CCCC#N)O[Si](C)(C)CCCC#N	{1: 4, 2: 6, 37: 2, 22: 1}
Did not match all atoms present	18028-55-2	CC1=C2C3=CC=CC=C3NC2=C(C=C1)C	{32: 1, 1: 2, 14: 6}
Did not match all atoms present	1803-36-7	B(C)(C)Cl	{1: 2, 17: 1}
Did not match all atoms present	18030-61-0	C1=CC=C(C=C1)C2=CC=C(C=C2)[Si](Cl)(Cl)Cl	{17: 3, 14: 9}
Did not match all atoms present	18030-62-1	C1=CC=C(C=C1)C2=CC=CC=C2[Si](Cl)(Cl)Cl	{17: 3, 14: 9}
Did not match all atoms present	180322-79-6	CC(C)(C)OC(=O)N[C@]1(C[C@H]1C2=CC=CC=C2)C(=O)O	{1: 3, 4: 1, 11: 1, 12: 1, 13: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	180322-86-5	CC(C)(C)OC(=O)N[C@@]1(C[C@@H]1C2=CC=CC=C2)C(=O)O	{1: 3, 4: 1, 11: 1, 12: 1, 13: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	18036-81-2	C[Si](C)(C)C1=CC=C(C=C1)O[Si](C)(C)C	{1: 6, 22: 1, 14: 4}
Did not match all atoms present	18036-82-3	C[Si](C)(C)C1=CC=CC(=C1)O[Si](C)(C)C	{1: 6, 22: 1, 14: 4}
Did not match all atoms present	18036-88-9	C[Si](C)(C)C1CC2=CC=CC=C2C1	{1: 3, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	18037-10-0	C[Si](C)(C)NC1=NC(=NC=C1)O[Si](C)(C)C	{1: 6, 35: 2, 22: 1, 14: 2, 31: 1}
Did not match all atoms present	18037-63-3	CC1=C/C(=N/NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])OC)/C=CC1=O.[Na+]	{1: 2, 34: 3, 14: 10, 15: 2, 22: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	18038-55-6	C(#C[Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl	{17: 6, 10: 2}
Did not match all atoms present	18039-42-4	C1=CC=C(C=C1)C2=NNN=N2	{32: 1, 35: 3, 14: 5}
Did not match all atoms present	18039-45-7	C1=CC=C(C=C1)C2=NN(N=N2)C3=CC=CC=C3	{33: 1, 35: 3, 14: 10}
Did not match all atoms present	18039-69-5	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].O=[U+2]=O	{24: 2, 1: 4, 29: 2, 6: 2, 7: 2}
Did not match all atoms present	1804-87-1	CC(=C)C(=O)OCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 2, 5: 1, 7: 1, 28: 1, 29: 3}
Did not match all atoms present	1804-93-9	CCCOP(=O)(O)OCCC	{1: 2, 2: 4, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	18042-54-1	CC(=O)O[Si](C1=CC=CC=C1)(OC(=O)C)OC(=O)C	{1: 3, 28: 3, 14: 5}
Did not match all atoms present	18042-62-1	C[Si](C)(C)CN1C(=O)C2=CC=CC=C2C1=O	{1: 3, 2: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	18043-71-5	CC(C)[Si](C(C)C)O[Si](C(C)C)C(C)C	{1: 8, 3: 4, 22: 1}
Did not match all atoms present	18043-74-8	CCO[Si](C)(CC[Si](C)(OCC)OCC)OCC	{1: 6, 2: 6, 22: 4}
Did not match all atoms present	18046-21-4	C1=CC=C(C=C1)C2=NC(=C(S2)CC(=O)O)C3=CC=C(C=C3)Cl	{2: 1, 35: 1, 41: 1, 14: 9, 17: 1, 27: 1}
Did not match all atoms present	18048-61-8	CC(=O)C(C(=O)NC1=C(C=CC(=C1)OC)OC)N=NC2=CC=C(C=C2)SS(=O)(=O)[O-].[Na+]	{1: 3, 34: 2, 3: 1, 40: 1, 14: 7, 22: 2, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	1805-32-9	C1=CC(=C(C=C1CO)Cl)Cl	{17: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	1805-61-4	CC(C)CCC1=CC=C(C=C1)O	{1: 2, 2: 2, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	18051-18-8	CN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CC#N	{32: 1, 1: 1, 2: 1, 37: 1, 33: 1, 11: 3, 12: 3, 14: 4}
Did not match all atoms present	18052-80-7	C[Si](C)(C)C1=CC=CC2=CC=CC=C21	{1: 3, 14: 7}
Did not match all atoms present	18052-83-0	CCO[Si](C1CC2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)(OCC)OCC	{1: 3, 2: 3, 11: 1, 12: 1, 13: 3, 15: 2, 17: 6, 22: 3}
Did not match all atoms present	18053-31-1	CN(CC1=C(C=CC=C1Cl)NC(=O)C2=CC=CC=C2)CC(=O)N3CCOCC3	{1: 1, 2: 2, 33: 2, 11: 4, 14: 8, 17: 1, 23: 1, 24: 2, 31: 1}
Did not match all atoms present	18053-75-3	C[Si](C)(C)C1C=CC2=CC=CC=C12	{1: 3, 12: 1, 14: 6}
Did not match all atoms present	18054-10-9	C[Si](C)(C1=CC=C(C=C1)C(=O)O)O[Si](C)(C)C2=CC=C(C=C2)C(=O)O	{1: 4, 27: 2, 22: 1, 14: 8}
Did not match all atoms present	18055-70-4	CC1=CC=C(C=C1)[Si](C)(C)O[Si](C)(C)C2=CC=C(C=C2)C	{1: 6, 22: 1, 14: 8}
Did not match all atoms present	18057-24-4	C[Si](C)(CCl)OC1=CC=C(C=C1)O[Si](C)(C)CCl	{1: 4, 2: 2, 22: 2, 14: 4, 17: 2}
Did not match all atoms present	1806-23-1	C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)F)Cl	{16: 1, 17: 1, 14: 8, 24: 1}
Did not match all atoms present	1806-26-4	CCCCCCCCC1=CC=C(C=C1)O	{1: 1, 2: 7, 21: 1, 14: 4}
Did not match all atoms present	1806-29-7	C1=CC=C(C(=C1)C2=CC=CC=C2O)O	{21: 2, 14: 8}
Did not match all atoms present	1806-34-4	C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=C(C=C3)C4=NC=C(O4)C5=CC=CC=C5	{35: 2, 14: 16, 23: 2}
Did not match all atoms present	1806-54-8	CCCCCCCCOP(=O)(OCCCCCCCC)OCCCCCCCC	{1: 3, 2: 21, 29: 1, 22: 3}
Did not match all atoms present	180615-37-6	C1=CC=C(C=C1)NC2=C(C3=C(C(=C2NC4=CC=CC=C4)F)C5=NC6=C7C(=C([N-]6)N=C8C9=C(C(=C(C(=C9F)NC1=CC=CC=C1)NC1=CC=CC=C1)F)C(=NC1=C2C(=C([N-]1)N=C3N5)C(=C(C(=C2F)NC1=CC=CC=C1)NC1=CC=CC=C1)F)N8)C(=C(C(=C7F)NC1=CC=CC=C1)NC1=CC=CC=C1)F)F.O=[V+2]	{32: 2, 35: 6, 14: 40, 16: 8, 29: 1, 31: 8}
Did not match all atoms present	18063-02-0	C1=CC(=C(C(=C1)F)C(=O)Cl)F	{16: 2, 17: 1, 14: 3, 24: 1}
Did not match all atoms present	18063-03-1	C1=CC(=C(C(=C1)F)C(=O)N)F	{16: 2, 24: 1, 30: 1, 14: 3}
Did not match all atoms present	18066-68-7	CCOC(=O)CC1=CC(=C(C=C1)OC)OC	{1: 3, 2: 2, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	18067-13-5	C[N+]1([C@@H]2CC(C[C@H]1C3C2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.COS(=O)(=O)[O-]	{1: 3, 2: 1, 3: 1, 11: 2, 12: 5, 14: 5, 20: 1, 22: 1, 23: 1, 28: 1, 29: 3}
Did not match all atoms present	18067-44-2	C#CC1=C2C(=CC=C1)C=CC=C2C#C	{9: 2, 10: 2, 14: 6}
Did not match all atoms present	1807-29-0	CCCCCCCCC1=CC(=C(C=C1)O)CCCCCCCC	{1: 2, 2: 14, 21: 1, 14: 3}
Did not match all atoms present	1807-36-9	CC1=CC=CC2=C1OC(=O)C=C2	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	1807-55-2	CNC1=CC=C(C=C1)CC2=CC=C(C=C2)NC	{1: 2, 2: 1, 14: 8, 31: 2}
Did not match all atoms present	1808-12-4	C[NH+](C)CCOC(C1=CC=CC=C1)C2=CC=C(C=C2)Br.[Cl-]	{1: 2, 2: 2, 3: 1, 14: 9, 17: 1, 18: 1, 22: 1}
Did not match all atoms present	18081-08-8	C[Si](C)(C)OC1=CC2=CC=CC=C2C=C1	{1: 3, 22: 1, 14: 7}
Did not match all atoms present	18081-12-4	C[Si](C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)Cl	{1: 1, 14: 9, 17: 2}
Did not match all atoms present	18081-31-7	C[Si](C)(C)/C=C(\C=C)/[Si](C)(C)C	{1: 6, 5: 1, 6: 2, 7: 1}
Did not match all atoms present	180850-95-7	CNC1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)C(=O)NC)NC)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC=C(C=C6)C(=O)NC.[Na+].[Na+]	{1: 4, 35: 6, 6: 2, 14: 14, 24: 2, 29: 6, 31: 8}
Did not match all atoms present	18086-24-3	COC1=CC(=C(C=C1)OC)CC#N	{1: 2, 2: 1, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	18088-11-4	[OH-].[Rb+].[Rb+]	{}
Did not match all atoms present	1809-19-4	CCCCO[P+](=O)OCCCC	{1: 2, 2: 6, 29: 1, 22: 2}
Did not match all atoms present	1809-21-8	CCCOP(O)OCCC	{1: 2, 2: 4, 20: 1, 22: 2}
Did not match all atoms present	18090-13-6	C[Si](C)([O-])[O-].[Na+]	{1: 2, 29: 2}
Did not match all atoms present	18090-43-2	C[Si](C)(C)C1C=CC(C=C1)[Si](C)(C)C	{1: 6, 12: 2, 14: 4}
Did not match all atoms present	180913-77-3	CC(=O)NC1=C2C=CC3=C4C2=C(C=C1)C(=O)C(=O)C4=CC=C3	{24: 1, 1: 1, 31: 1, 14: 7, 25: 2}
Did not match all atoms present	18096-66-7	CC(=O)OCC1=CC2=CC=CC=C2C1	{1: 1, 2: 1, 11: 1, 14: 5, 15: 1, 28: 1}
Did not match all atoms present	18097-52-4	C1=CC=C(C=C1)C(=NO)C2=C(C=CC(=C2)Cl)N	{34: 1, 7: 1, 14: 8, 17: 1, 20: 1, 30: 1}
Did not match all atoms present	18098-86-7	C(COC(=O)Cl)C[Si](Cl)(Cl)Cl	{17: 4, 2: 3, 28: 1}
Did not match all atoms present	18099-59-7	CCCCCCCCCCOC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 9, 22: 1, 14: 4}
Did not match all atoms present	1810-62-4	CC1=CC2=C(C=C1)C(=CC(N2)(C)C)C	{32: 1, 1: 4, 13: 1, 14: 4, 15: 1}
Did not match all atoms present	18102-38-0	CC1=CC(=C(C(=C1)OC)[N+](=O)[O-])C	{1: 3, 38: 1, 22: 1, 14: 2}
Did not match all atoms present	18105-31-2	C[Si](C)(C)OC(=O)CCCCC(=O)O[Si](C)(C)C	{1: 6, 2: 4, 28: 2}
Did not match all atoms present	18105-63-0	CCC(C)O[Si](OC(C)CC)(OC(C)CC)Cl	{1: 6, 2: 3, 3: 3, 22: 3, 17: 1}
Did not match all atoms present	18107-40-9	CCCCCCO[Si](CC)(CC)CC	{1: 4, 2: 8, 22: 1}
Did not match all atoms present	18108-22-0	C1=CC=C(C=C1)C(N)P(=O)(O)O	{30: 1, 3: 1, 20: 2, 29: 1, 14: 5}
Did not match all atoms present	18108-24-2	CC(C)C(N)P(=O)(O)O	{1: 2, 3: 2, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	18109-81-4	CCC(C1=CC=CC=C1)C(=O)OCCOCCN(CC)CC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 9, 3: 1, 4: 1, 33: 1, 14: 5, 20: 1, 22: 1, 27: 3, 28: 1}
Did not match all atoms present	18113-03-6	COC1=CC(=C(C=C1)O)Cl	{1: 1, 22: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	18113-04-7	COC1=CC(=C(C=C1)Cl)O	{1: 1, 22: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	18113-14-9	COC1=C(C=C(C(=C1)Cl)O)Cl	{1: 1, 22: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	18113-81-0	CCC1=NC=C(C=C1)C	{1: 2, 2: 1, 35: 1, 14: 3}
Did not match all atoms present	18115-70-3	[Li+].CC(=CC(=O)C)[O-]	{24: 1, 1: 2, 6: 1, 7: 1}
Did not match all atoms present	18117-29-8	[BH4-].C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{2: 1, 14: 20}
Did not match all atoms present	1812-30-2	C1C(=O)NC2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=N3	{32: 1, 35: 2, 11: 1, 14: 7, 15: 1, 18: 1, 25: 1}
Did not match all atoms present	1812-51-7	CCC1=CC=CC=C1C2=CC=CC=C2	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	1812-53-9	CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC.[Cl-]	{1: 4, 2: 30, 17: 1}
Did not match all atoms present	18122-67-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC4=CC=C(C=C4)S(=O)(=O)Cl)N	{14: 9, 17: 1, 21: 1, 22: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	18122-72-0	[O-]I(=O)([O-])([O-])([O-])[O-].[Na+]	{19: 1, 29: 6}
Did not match all atoms present	181229-58-3	CC=O.CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N.C1=CC(=CC=C1C=O)O	{1: 2, 34: 1, 14: 13, 21: 1, 22: 1, 26: 2, 29: 2}
Did not match all atoms present	181231-66-3	CC(C)[Si](C(C)C)(C(C)C)N(C)C	{1: 8, 3: 3, 33: 1}
Did not match all atoms present	181231-67-4	CCCC[Si](C)(C)N(C)C	{1: 5, 2: 3, 33: 1}
Did not match all atoms present	18125-46-7	C1=CC(=CC=C1C[C@H](C(=O)O)N)F	{2: 1, 3: 1, 14: 4, 16: 1, 27: 1, 30: 1}
Did not match all atoms present	18127-01-0	CC(C)(C)C1=CC=C(C=C1)CCC=O	{1: 3, 2: 2, 4: 1, 26: 1, 14: 4}
Did not match all atoms present	181274-17-9	CN1C(=NN(C1=O)C(=O)[N-]S(=O)(=O)C2=CC=CC=C2OC(F)(F)F)OC.[Na+]	{1: 2, 34: 1, 35: 1, 4: 1, 33: 2, 14: 4, 16: 3, 22: 2, 24: 1, 25: 1, 29: 2}
Did not match all atoms present	18129-78-7	CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.Cl[Pt-2](Cl)(Cl)(Cl)(Cl)Cl	{1: 8, 2: 24, 17: 6}
Did not match all atoms present	1813-29-2	CC1=CC=C(C=C1)OC(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4, 28: 1}
Did not match all atoms present	18132-72-4	C[Si](C)(CCCCl)O[Si](C)(C)CCCCl	{1: 4, 2: 6, 22: 1, 17: 2}
Did not match all atoms present	18132-93-9	CCCCCCCO[Si](C)(C)C	{1: 4, 2: 6, 22: 1}
Did not match all atoms present	18134-58-2	C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)[Si](Cl)(Cl)Cl	{17: 9, 11: 1, 12: 1, 13: 3, 15: 2}
Did not match all atoms present	18135-14-3	COP(=O)(OC)[Si](C)(C)C	{1: 5, 29: 1, 22: 2}
Did not match all atoms present	18138-03-9	CCCC1=NC=CN=C1	{1: 1, 2: 2, 35: 2, 14: 3}
Did not match all atoms present	18138-04-0	CCC1=NC=C(N=C1CC)C	{1: 3, 2: 2, 35: 2, 14: 1}
Did not match all atoms present	18138-05-1	CCC1=CN=C(C(=N1)CC)C	{1: 3, 2: 2, 35: 2, 14: 1}
Did not match all atoms present	18138-14-2	CN(C)C(=O)C(=S)N	{24: 1, 1: 2, 33: 1, 30: 1, 7: 1}
Did not match all atoms present	18139-33-8	CN(C)CCCC1C2=CC=CC=C2OC3=C1C=C(C=C3)C(F)(F)F	{1: 2, 2: 3, 4: 1, 33: 1, 12: 1, 14: 7, 16: 3, 23: 1}
Did not match all atoms present	18141-42-9	C[Si](C)(OCCCl)OCCCl	{1: 2, 2: 4, 22: 2, 17: 2}
Did not match all atoms present	18142-53-5	CC(C[Si](Cl)(Cl)Cl)CCl	{1: 1, 2: 2, 3: 1, 17: 4}
Did not match all atoms present	18146-00-4	C[Si](C)(C)OCC=C	{1: 3, 2: 1, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	18147-17-6	C[Si](OCCCl)OCCCl	{1: 1, 2: 4, 22: 2, 17: 2}
Did not match all atoms present	18147-18-7	CC(C)(C)[Si](C)(Cl)Cl	{1: 4, 4: 1, 17: 2}
Did not match all atoms present	18147-81-4	COC(=O)CC[Si](Cl)(Cl)Cl	{1: 1, 2: 2, 28: 1, 17: 3}
Did not match all atoms present	18147-84-7	C=C(C[Si](Cl)(Cl)Cl)CCl	{17: 4, 2: 2, 5: 1, 7: 1}
Did not match all atoms present	18150-12-4	CC(=CC1=CC=CC=C1)C2=CC=NC=C2	{1: 1, 35: 1, 14: 9, 6: 1, 7: 1}
Did not match all atoms present	18151-85-4	CC(=C)C(=O)OCCC[Si](C)(C)O[Si](C)(C)C	{1: 6, 2: 3, 5: 1, 7: 1, 22: 1, 28: 1}
Did not match all atoms present	18151-86-5	CCO[Si](OCC)(OC(C)(C)C)OC(C)(C)C	{1: 8, 2: 2, 4: 2, 22: 4}
Did not match all atoms present	18152-79-9	CCOC(=O)C1=C(OC(=O)C(=C1C)Br)C	{1: 3, 2: 1, 28: 2, 18: 1}
Did not match all atoms present	18155-21-0	[SH3+]	{}
Did not match all atoms present	18156-15-5	C[Si](C)(CCCC#N)Cl	{1: 2, 2: 3, 37: 1, 17: 1}
Did not match all atoms present	18156-25-7	C[Si](C)(C)N=S=N[Si](C)(C)C	{40: 1, 1: 6, 34: 2}
Did not match all atoms present	18156-38-2	CO[Si](C)(C)O[Si](C)(C)C	{1: 6, 22: 2}
Did not match all atoms present	18156-74-6	C[Si](C)(C)N1C=CN=C1	{1: 3, 35: 1, 14: 3, 33: 1}
Did not match all atoms present	18156-91-7	C[Si](C)(C#C[Si](C)(C)Cl)Cl	{1: 4, 10: 2, 17: 2}
Did not match all atoms present	18157-17-0	C[Si](C)(C)OCCCl	{1: 3, 2: 2, 22: 1, 17: 1}
Did not match all atoms present	18157-31-8	C[Si](C)CCCCl	{1: 2, 2: 3, 17: 1}
Did not match all atoms present	1816-96-2	CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)C)C	{1: 3, 29: 2, 14: 7}
Did not match all atoms present	18162-48-6	CC(C)(C)[Si](C)(C)Cl	{1: 5, 4: 1, 17: 1}
Did not match all atoms present	18162-84-0	CCCCCCCC[Si](C)(C)Cl	{1: 3, 2: 7, 17: 1}
Did not match all atoms present	18163-34-3	CC(=O)OCC[Si](C)(Cl)Cl	{1: 2, 2: 2, 28: 1, 17: 2}
Did not match all atoms present	18163-47-8	C[Si](C)(C)C#CI	{1: 3, 10: 2, 19: 1}
Did not match all atoms present	18165-68-9	CCO[Si]OCC	{1: 2, 2: 2, 22: 2}
Did not match all atoms present	18165-76-9	C[Si](C)(C)CS	{1: 3, 2: 1, 39: 1}
Did not match all atoms present	18166-02-4	C[Si](C)(C)CN	{1: 3, 2: 1, 30: 1}
Did not match all atoms present	18166-44-4	CCC(C)O[Si](O)(OC(C)CC)OC(C)CC	{1: 6, 2: 3, 3: 3, 20: 1, 22: 3}
Did not match all atoms present	18166-67-1	C1=CC(=CC=C1/C=C/C(=O)N)[N+](=O)[O-]	{24: 1, 30: 1, 38: 1, 14: 4, 6: 2}
Did not match all atoms present	18168-01-9	CCNC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 33: 1, 14: 10, 24: 1, 31: 1}
Did not match all atoms present	18168-40-6	CC(C)(C1=CC=CC=C1)C2=CC=CC=C2O	{1: 2, 4: 1, 21: 1, 14: 9}
Did not match all atoms present	18169-57-8	CC(C)C[Si](Cl)(Cl)Cl	{1: 2, 2: 1, 3: 1, 17: 3}
Did not match all atoms present	1817-13-6	C1=CC(=NC(=C1Cl)C(Cl)(Cl)Cl)Cl	{17: 5, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	1817-47-6	CC(C)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 3: 1, 38: 1, 14: 4}
Did not match all atoms present	1817-57-8	CC(=O)C#CC1=CC=CC=C1	{24: 1, 1: 1, 10: 2, 14: 5}
Did not match all atoms present	1817-67-0	CC1=CC(=C(C=C1)O)C(C)C2=CC=CC=C2	{1: 2, 3: 1, 21: 1, 14: 8}
Did not match all atoms present	1817-68-1	CC1=CC(=C(C(=C1)C(C)C2=CC=CC=C2)O)C(C)C3=CC=CC=C3	{1: 3, 3: 2, 21: 1, 14: 12}
Did not match all atoms present	1817-73-8	C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)[N+](=O)[O-]	{18: 1, 38: 2, 30: 1, 14: 2}
Did not match all atoms present	1817-74-9	C1=CC(=CC=C1CC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{2: 1, 38: 2, 14: 8}
Did not match all atoms present	1817-77-2	C1=CC=C(C=C1)CC2=CC=C(C=C2)[N+](=O)[O-]	{2: 1, 38: 1, 14: 9}
Did not match all atoms present	18171-11-4	CC(C)O[Si](C)(C)CCl	{1: 4, 2: 1, 3: 1, 22: 1, 17: 1}
Did not match all atoms present	18171-56-7	C[Si](CCl)(CCl)Cl	{1: 1, 2: 2, 17: 3}
Did not match all atoms present	18171-59-0	C[Si](C)(C(Cl)Cl)Cl	{1: 2, 3: 1, 17: 3}
Did not match all atoms present	18171-74-9	CC(C)(C)[Si](Cl)(Cl)Cl	{1: 3, 4: 1, 17: 3}
Did not match all atoms present	18172-33-3	CC(=O)C1=C(C2C3C(CC4=C5C3=CNC5=CC=C4)C(N2C1=O)(C)C)O	{32: 1, 1: 3, 33: 1, 11: 1, 12: 3, 13: 1, 14: 4, 15: 2, 20: 1, 24: 1, 25: 1}
Did not match all atoms present	18173-64-3	CC(C)(C)[Si](C)(C)O	{1: 5, 4: 1, 20: 1}
Did not match all atoms present	18175-21-8	CC(=O)/C=C/C1=CC=C(C=C1)I	{24: 1, 1: 1, 19: 1, 14: 4, 6: 2}
Did not match all atoms present	18178-47-7	CC1CC(N(C2=C1C=C(C(=C2)C)C=C(C#N)C#N)CCOC(=O)NC3=CC=CC=C3)(C)C	{1: 4, 2: 2, 33: 1, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1, 14: 7, 28: 1, 37: 2, 31: 1}
Did not match all atoms present	18178-59-1	C[Si](C)(C)/C=C/[Si](C)(C)C	{1: 6, 6: 2}
Did not match all atoms present	18179-67-4	COC1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)[NH-].[Na+]	{1: 1, 35: 2, 36: 1, 14: 6, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	1818-06-0	CCCCOC(=O)C1=CC=C(C=C1)C(=O)O	{1: 1, 2: 3, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	1818-07-1	CCCCCCCCOC1=CC=CC=C1	{1: 1, 2: 7, 22: 1, 14: 5}
Did not match all atoms present	1818-27-5	CC(=O)C1=CC(=C(C=C1O)O)O	{24: 1, 1: 1, 21: 3, 14: 2}
Did not match all atoms present	1818-28-6	CC(=O)C1=CC(=C(C=C1OC)OC)OC	{24: 1, 1: 4, 22: 3, 14: 2}
Did not match all atoms present	1818-71-9	C1=NC2=C(NC(=O)N=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 1, 20: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	1818-95-7	CCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCC	{1: 2, 2: 8, 28: 2, 14: 4}
Did not match all atoms present	1818-96-8	CCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCCC	{1: 2, 2: 10, 28: 2, 14: 4}
Did not match all atoms present	18181-70-9	COP(=S)(OC)OC1=CC(=C(C=C1Cl)I)Cl	{1: 2, 19: 1, 22: 3, 14: 2, 17: 2}
Did not match all atoms present	18181-80-1	CC(C)OC(=O)C(C1=CC=C(C=C1)Br)(C2=CC=C(C=C2)Br)O	{1: 2, 3: 1, 4: 1, 14: 8, 18: 2, 20: 1, 28: 1}
Did not match all atoms present	18182-40-6	CN(C)C[Si](C)(C)C	{1: 5, 2: 1, 33: 1}
Did not match all atoms present	18186-71-5	CCCCCCCCCCCC[N+](CC)(CC)CC.[Br-]	{1: 4, 2: 14, 18: 1}
Did not match all atoms present	18187-24-1	CO[Si](C)(C)O[Si](C)(C)OC	{1: 6, 22: 3}
Did not match all atoms present	18187-39-8	C[Si](C)(C)C/C=C/Cl	{1: 3, 2: 1, 6: 2, 17: 1}
Did not match all atoms present	18187-50-3	C[Si]1(CCC=C1)C	{1: 2, 11: 2, 14: 2}
Did not match all atoms present	18189-02-1	CC(C)OC(=O)C1=CC=CC=C1N	{1: 2, 3: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	18189-05-4	CCCCCCOC(=O)C1=CC=CC=C1N	{1: 1, 2: 5, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	18189-08-7	CCCCOC(=O)C1=C(C=CC(=C1)Cl)N	{1: 1, 2: 3, 14: 3, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	18189-09-8	CCCCCCCOC(=O)C1=C(C=CC(=C1)Cl)N	{1: 1, 2: 6, 14: 3, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	18191-59-8	C=CC[SiH3]	{2: 1, 5: 1, 6: 1}
Did not match all atoms present	18194-24-6	CCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCC	{1: 5, 2: 28, 3: 1, 22: 2, 28: 2, 29: 2}
Did not match all atoms present	18198-39-5	c1ccc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1	{14: 20}
Did not match all atoms present	182-55-8	C1CCC2(CC1)OC3=CC=CC=C3O2	{11: 5, 13: 1, 14: 4, 23: 2}
Did not match all atoms present	1820-80-0	C1=C(NN=C1)N	{32: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	1820-81-1	C1=C(C(=O)NC(=O)N1)Cl	{32: 2, 17: 1, 14: 1, 25: 2}
Did not match all atoms present	1820-99-1	C1=CC(=C(C=C1SC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O	{40: 1, 27: 2, 21: 2, 14: 6}
Did not match all atoms present	18204-80-3	CC(=O)OCC[Si](Cl)(Cl)Cl	{1: 1, 2: 2, 28: 1, 17: 3}
Did not match all atoms present	18204-93-8	CCCCCC[Si](CCCCCC)(Cl)Cl	{1: 2, 2: 10, 17: 2}
Did not match all atoms present	182061-89-8	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)[O-])NNC3=C(C=C(C=C3)NC4=NC(=NC(=N4)N(CCO)CCO)NCCS(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{33: 1, 2: 6, 35: 3, 36: 1, 14: 7, 15: 5, 20: 2, 25: 1, 29: 9, 31: 4}
Did not match all atoms present	18207-47-1	C1=COC(=C1)C(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 3, 23: 1}
Did not match all atoms present	182073-88-7	C=O.C1C=CCC(C1C(=O)[O-])C(=O)OC2=CC=CC=C2.[Na+]	{5: 1, 11: 2, 12: 2, 14: 7, 24: 1, 28: 1}
Did not match all atoms present	18209-60-4	CN(C)[Si](C)(C)Cl	{1: 4, 33: 1, 17: 1}
Did not match all atoms present	18209-61-5	CC(C)[Si](C)C	{1: 4, 3: 1}
Did not match all atoms present	1821-12-1	C1=CC=C(C=C1)CCCC(=O)O	{2: 3, 27: 1, 14: 5}
Did not match all atoms present	1821-27-8	C1=CC(=CC=C1NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8, 31: 1}
Did not match all atoms present	1821-36-9	C1CCC(CC1)NC2=CC=CC=C2	{11: 5, 12: 1, 14: 5, 31: 1}
Did not match all atoms present	1821-39-2	CCCC1=CC=CC=C1N	{1: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	1821-47-2	CC1=CC2=C(C=C1)NC=C2CCN	{32: 1, 1: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	18212-12-9	C1=C(C=C(C(=C1[N+](=O)[O-])NC2=NC=NN2)[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 35: 2, 38: 3, 14: 3, 31: 1}
Did not match all atoms present	18212-29-8	C1=CC=C(C=C1)C2=CN=NS2	{41: 1, 35: 2, 14: 6}
Did not match all atoms present	18216-74-5	CC(CCC(=O)C)C1=CC=CC=C1	{24: 1, 1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	18217-00-0	COC1=CC=C(C=C1)CCCl	{1: 1, 2: 2, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	1822-73-7	C=CSC1=CC=CC=C1	{40: 1, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	18220-90-1	CCC1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 14: 9}
Did not match all atoms present	182212-42-6	CCCCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC(=C(C=C2)/C(=C\3/C=CC(=[N+](CCCC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3C)/C5=CC=C(C=C5)NC6=CC=C(C=C6)OCC)C.[Na+]	{1: 5, 2: 9, 33: 2, 7: 1, 14: 22, 15: 3, 22: 1, 29: 6, 31: 1}
Did not match all atoms present	18222-89-4	C1[Si]2(C[Si]3(C[Si]1(C[Si](C2)(C3)Cl)Cl)Cl)Cl	{17: 4, 11: 6}
Did not match all atoms present	182247-45-6	COC(=O)[C@@H](CC1=CC=CC=C1)CC(=O)[O-]	{1: 1, 2: 2, 3: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	18225-17-7	C[Si]12CCCN(CCO1)CCO2	{1: 1, 11: 7, 33: 1, 23: 2}
Did not match all atoms present	18226-17-0	C1=CC(=CC=C1N(CCO)CCO)[N+](=O)[O-]	{33: 1, 2: 4, 20: 2, 38: 1, 14: 4}
Did not match all atoms present	1823-14-9	C#CCCCC1=CC=CC=C1	{9: 1, 2: 3, 10: 1, 14: 5}
Did not match all atoms present	1823-18-3	CC(=C)C(=O)OCC(COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O)O	{1: 1, 2: 2, 3: 1, 5: 1, 7: 1, 14: 8, 20: 1, 21: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	1823-44-5	CC1=C/C(=N/NC2=NC=CS2)/C(=O)C=C1	{1: 1, 34: 1, 35: 1, 41: 1, 14: 5, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	1823-47-8	C1=CC=NC(=C1)N/C=C/2\C=CC=CC2=O	{35: 1, 6: 1, 14: 8, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	1823-59-2	C1=CC2=C(C=C1OC3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{28: 4, 22: 1, 14: 6}
Did not match all atoms present	1823-91-2	CC(C#N)C1=CC=CC=C1	{1: 1, 3: 1, 37: 1, 14: 5}
Did not match all atoms present	18230-61-0	CC(C)[Si](C(C)C)(OC)OC	{1: 6, 3: 2, 22: 2}
Did not match all atoms present	18230-84-7	CC(C)[SiH3]	{1: 2, 3: 1}
Did not match all atoms present	18233-24-4	C1=CC=C(C=C1)C2=NN/C(=C\3/C=CC=CC3=O)/O2	{32: 1, 35: 1, 14: 9, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	18236-15-2	CCO[Si](CCS)(OCC)OCC	{1: 3, 2: 5, 22: 3, 39: 1}
Did not match all atoms present	18236-89-0	CC(C)[Si](C)(Cl)Cl	{1: 3, 3: 1, 17: 2}
Did not match all atoms present	18237-15-5	C1=CC=C2C(=C1)C(=CN2)CCC[NH3+].[Cl-]	{32: 1, 17: 1, 2: 3, 14: 5}
Did not match all atoms present	18237-16-6	C1=CC=C2C(=C1)C(=CN2)CCCC[NH3+].[Cl-]	{32: 1, 17: 1, 2: 4, 14: 5}
Did not match all atoms present	18238-55-6	C1=CC=C2C(=C1)C2(F)F	{16: 2, 13: 1, 14: 4}
Did not match all atoms present	1824-81-3	CC1=NC(=CC=C1)N	{1: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	18240-50-1	C1=COC(=C1)CNCC2=CC=CO2	{2: 2, 31: 1, 14: 6, 23: 2}
Did not match all atoms present	18243-41-9	C[Si](C)(C)CBr	{1: 3, 2: 1, 18: 1}
Did not match all atoms present	18243-59-9	C[Si](C)(C)C#CBr	{1: 3, 10: 2, 18: 1}
Did not match all atoms present	18243-89-5	CN([Si](C)(C)C)[Si](C)(C)S[Si](C)(C)N(C)[Si](C)(C)C	{40: 1, 1: 12, 33: 2}
Did not match all atoms present	18244-79-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=C(C2=CC=CC=C2N1)C(=CC3=[N+](C4=C(S3)C=CC5=CC=CC=C54)C)C=C6N(C7=C(S6)C=CC8=CC=CC=C87)C	{32: 1, 1: 4, 33: 2, 6: 2, 7: 1, 41: 2, 14: 20, 15: 1, 29: 3}
Did not match all atoms present	18244-95-6	C[Si](C=C)(C=C)C=C	{1: 1, 5: 3, 6: 3}
Did not match all atoms present	18245-28-8	C[Si](C)(C)C1=CC=CS1	{1: 3, 14: 3, 41: 1}
Did not match all atoms present	18245-29-9	C1CC2CC1CC2[Si](Cl)(Cl)Cl	{17: 3, 11: 4, 12: 3}
Did not match all atoms present	18245-72-2	CCC(=O)SC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5, 40: 1}
Did not match all atoms present	18245-94-8	C[Si](C1CC2CC1C=C2)(Cl)Cl	{1: 1, 11: 2, 12: 3, 14: 2, 17: 2}
Did not match all atoms present	1825-21-4	COC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 1, 22: 1, 17: 5}
Did not match all atoms present	1825-30-5	C1=CC2=C(C=CC=C2Cl)C(=C1)Cl	{17: 2, 14: 6}
Did not match all atoms present	1825-31-6	C1=CC=C2C(=C1)C(=CC=C2Cl)Cl	{17: 2, 14: 6}
Did not match all atoms present	1825-58-7	CCO[Si](C)(C)C1=CC=CC=C1	{1: 3, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	1825-61-2	CO[Si](C)(C)C	{1: 4, 22: 1}
Did not match all atoms present	1825-62-3	CCO[Si](C)(C)C	{1: 4, 2: 1, 22: 1}
Did not match all atoms present	1825-63-4	CCCO[Si](C)(C)C	{1: 4, 2: 2, 22: 1}
Did not match all atoms present	1825-65-6	CCCCO[Si](C)(C)C	{1: 4, 2: 3, 22: 1}
Did not match all atoms present	1825-68-9	CO[Si](C)(C)Cl	{1: 3, 22: 1, 17: 1}
Did not match all atoms present	1825-82-7	CCO[Si](Cl)(Cl)Cl	{1: 1, 2: 1, 22: 1, 17: 3}
Did not match all atoms present	182500-26-1	C1=CC=C(C(=C1)N=C=O)OC(F)(F)F	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 22: 1, 29: 1}
Did not match all atoms present	18252-44-3	C1C[C@H]([C@H](C[C@@H]1CS(=O)(=O)O)CS(=O)(=O)O)CS(=O)(=O)O	{20: 3, 2: 3, 11: 3, 12: 3, 29: 6}
Did not match all atoms present	18252-79-4	[O].[O].[V+]	{}
Did not match all atoms present	18254-13-2	CC(C1=CC=CC=C1)C2=CC(=C(C(=C2)C(C)C3=CC=CC=C3)O)C(C)C4=CC=CC=C4	{1: 3, 3: 3, 21: 1, 14: 17}
Did not match all atoms present	18256-48-9	COC1=C(C=CC(=C1)C(=O)CO)O	{1: 1, 2: 1, 14: 3, 20: 1, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	182565-27-1	CC(C1=CC=C(C=C1)F)N=C=S	{1: 1, 34: 1, 3: 1, 8: 1, 14: 4, 16: 1}
Did not match all atoms present	18259-05-7	C1=CC=C(C=C1)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	1826-14-8	C1=CC=C(C=C1)C2=CSC(=N2)C3=CC=CC=C3	{41: 1, 35: 1, 14: 11}
Did not match all atoms present	1826-28-4	C1=CC=C(C=C1)C(=C2C=CC=CN2)N=O	{32: 1, 34: 1, 7: 1, 14: 9, 15: 1, 29: 1}
Did not match all atoms present	1826-56-8	CCN(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C	{1: 2, 2: 1, 38: 1, 33: 1, 14: 4, 24: 1}
Did not match all atoms present	18262-71-0	C1CCN[C@@H](C1)C2=CN=CC=C2.OS(=O)(=O)O	{32: 1, 35: 1, 11: 4, 12: 1, 14: 4, 20: 2, 29: 2}
Did not match all atoms present	18264-88-5	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3CC2	{24: 1, 1: 1, 11: 2, 14: 7, 31: 1}
Did not match all atoms present	18266-28-9	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Sr+2]	{29: 8}
Did not match all atoms present	18266-52-9	C1=CC(=C(C=C1N)[N+](=O)[O-])N.Cl.Cl	{17: 2, 38: 1, 30: 2, 14: 3}
Did not match all atoms present	18267-08-8	CC[O-].CC[O-].CC[O-].CC[O-].[Zr+4]	{1: 4, 2: 4, 29: 4}
Did not match all atoms present	18268-54-7	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=C(C4=CC=CC=C43)S(=O)(=O)O	{34: 1, 14: 12, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	18268-74-1	C[Si](C)([O-])[O-].[K+].[K+]	{1: 2, 29: 2}
Did not match all atoms present	18269-64-2	C/C=C/C(=O)O[Si](C)(C)C	{1: 4, 28: 1, 6: 2}
Did not match all atoms present	1827-91-4	C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCOCCO.Cl.Cl	{33: 3, 2: 7, 4: 1, 41: 1, 11: 4, 14: 7, 16: 3, 17: 2, 20: 1, 22: 1}
Did not match all atoms present	18270-17-2	CCCC#C[Si](C)(C)C	{1: 4, 2: 2, 10: 2}
Did not match all atoms present	18270-61-6	C1=CC=C(C=C1)C(=C(C#N)C#N)Cl	{17: 1, 37: 2, 14: 5, 7: 2}
Did not match all atoms present	18272-71-4	CCC(C)C1=CC=CC=C1OC	{1: 3, 2: 1, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	18272-84-9	CCCCC1=CC=C(C=C1)OC	{1: 2, 2: 3, 22: 1, 14: 4}
Did not match all atoms present	18274-34-5	C1=CC=C2C(C=CC(C2=C1)C(=O)O)C(=O)O	{27: 2, 12: 2, 14: 6}
Did not match all atoms present	18277-27-5	CCC(C)C1=NC=CS1	{1: 2, 2: 1, 3: 1, 41: 1, 14: 2, 35: 1}
Did not match all atoms present	18278-34-7	COC1=C(C=CC(=C1)O)C=O	{1: 1, 22: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	18278-82-5	Br[I-]Br.[Cs+]	{18: 2, 19: 1}
Did not match all atoms present	18279-67-9	CCO[Si](CCCl)(OCC)OCC	{1: 3, 2: 5, 22: 3, 17: 1}
Did not match all atoms present	18281-76-0	CSP(=O)(Cl)Cl	{40: 1, 1: 1, 29: 1, 17: 2}
Did not match all atoms present	18282-10-5	O=[Sn]=O	{29: 2}
Did not match all atoms present	18282-39-8	[TeH-]	{}
Did not match all atoms present	18282-40-1	CCC1=CC=CC=C1I	{1: 1, 2: 1, 19: 1, 14: 4}
Did not match all atoms present	18282-59-2	C1=CC(=C(C=C1Br)Cl)Cl	{17: 2, 18: 1, 14: 3}
Did not match all atoms present	18282-77-4	C=C=S	{8: 1, 5: 1}
Did not match all atoms present	18284-36-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Rh]	{14: 60}
Did not match all atoms present	18285-21-7	CC1=NN(C(=O)[C-]1N=NC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3OC)O)C4=CC=C(C=C4)OS(=O)(=S)O.[Na+].[Co]	{1: 2, 34: 2, 35: 1, 33: 1, 14: 11, 20: 1, 21: 1, 22: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	182869-22-3	CNCC1CCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)F)F)F	{1: 2, 2: 1, 33: 2, 11: 3, 12: 1, 14: 5, 16: 3, 22: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	18288-22-7	[BiH3]	{}
Did not match all atoms present	1829-00-1	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NN=NC4=CC=C(C=C4)C5=NC6=C(S5)C(=C(C=C6)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 35: 2, 41: 2, 14: 12, 29: 6, 31: 1}
Did not match all atoms present	1829-32-9	C1=CC(=C(C(=C1)Cl)O)C(=O)O	{17: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	1829-37-4	CC(=O)OC1=CC=CC=C1Br	{1: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	1829-40-9	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)O[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{22: 1, 14: 30}
Did not match all atoms present	18290-60-3	C1CC(CC=C1)CC[Si](Cl)(Cl)Cl	{17: 3, 2: 2, 11: 3, 12: 1, 14: 2}
Did not match all atoms present	18291-67-3	C[Si](C1CC2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)(Cl)Cl	{1: 1, 11: 1, 12: 1, 13: 3, 15: 2, 17: 8}
Did not match all atoms present	18291-80-0	C[Si](C)(C)OC(=O)CBr	{1: 3, 2: 1, 28: 1, 18: 1}
Did not match all atoms present	18292-29-0	CC[Si](C)(CC)C=C	{1: 3, 2: 2, 5: 1, 6: 1}
Did not match all atoms present	18292-38-1	CC(=C)C[Si](C)(C)C	{1: 4, 2: 1, 5: 1, 7: 1}
Did not match all atoms present	18292-97-2	CC1=C(C=CC(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 2}
Did not match all atoms present	18293-51-1	C[Si](C)(C)CSC#N	{40: 1, 1: 3, 2: 1, 37: 1}
Did not match all atoms present	18293-53-3	C[Si](C)(C)CC#N	{1: 3, 2: 1, 37: 1}
Did not match all atoms present	18293-54-4	C[Si](C)(C)N1C=NC=N1	{1: 3, 35: 2, 14: 2, 33: 1}
Did not match all atoms present	18297-63-7	C[Si](C)(C)NC(=O)N[Si](C)(C)C	{24: 1, 1: 6, 31: 2}
Did not match all atoms present	183-88-0	C1C[N+]2(CCN1)CC[N+]3(CCNCC3)CC2	{32: 2, 11: 12}
Did not match all atoms present	1830-68-8	CC(=C)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1830-77-9	CC1=CC=CC=C1NC(=O)C2=CC3=CC4=CC=CC=C4C=C3C=C2O	{24: 1, 1: 1, 21: 1, 14: 12, 31: 1}
Did not match all atoms present	18300-89-5	CCOC(=O)C(=C(C)C1=CC=CC=C1)C#N	{1: 2, 2: 1, 37: 1, 7: 2, 14: 5, 28: 1}
Did not match all atoms present	18301-46-7	C[Si](C)(C)C1=CC=NC=C1	{1: 3, 35: 1, 14: 4}
Did not match all atoms present	18301-56-9	CC(=C)C(=O)OCCC[Si](C)(Cl)Cl	{1: 2, 2: 3, 5: 1, 7: 1, 17: 2, 28: 1}
Did not match all atoms present	18304-19-3	[Be].O=[W]	{29: 1}
Did not match all atoms present	18306-29-1	C[Si](C)(C)OS(=O)(=O)O[Si](C)(C)C	{1: 6, 29: 2, 22: 2}
Did not match all atoms present	18306-73-5	C[Si](C)(C)C[Si](C)(C)CCl	{1: 5, 2: 2, 17: 1}
Did not match all atoms present	18306-79-1	CCO[Si](C)(C)CCCN	{1: 3, 2: 4, 30: 1, 22: 1}
Did not match all atoms present	1831-69-2	C1=CC=C(C=C1)S(=O)(=O)ON=C2C=CC(=O)C=C2	{34: 1, 14: 9, 15: 1, 22: 1, 25: 1, 29: 2}
Did not match all atoms present	18319-92-1	CCCCCCC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C	{1: 2, 2: 5, 28: 2, 14: 4}
Did not match all atoms present	1832-07-1	N#P(Cl)Cl	{17: 2}
Did not match all atoms present	1832-53-7	CCOP(=O)(C)O	{1: 2, 2: 1, 20: 1, 29: 1, 22: 1}
Did not match all atoms present	18323-58-5	CCCCCCCCC=CCCCCCCCC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C	{1: 2, 2: 14, 28: 2, 14: 4, 6: 2}
Did not match all atoms present	18323-96-1	CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/O)(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/O)(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/O)(C)C.[Yb]	{1: 9, 4: 12, 6: 3, 7: 3, 16: 21, 20: 3, 24: 3}
Did not match all atoms present	183249-37-8	C1C=CC2=C1C=CC3=C2C4=CC=CC=C4C=C3	{11: 1, 14: 10}
Did not match all atoms present	18328-11-5	C1=CC=C(C=C1)CCCC=O	{2: 3, 26: 1, 14: 5}
Did not match all atoms present	1833-27-8	C[Si](C)(CC1=CC=CC=C1)O[Si](C)(C)CC2=CC=CC=C2	{1: 4, 2: 2, 22: 1, 14: 10}
Did not match all atoms present	1833-31-4	C[Si](C)(CC1=CC=CC=C1)Cl	{1: 2, 2: 1, 14: 5, 17: 1}
Did not match all atoms present	1833-51-8	C[Si](C)(CCl)C1=CC=CC=C1	{1: 2, 2: 1, 14: 5, 17: 1}
Did not match all atoms present	1833-53-0	CC(=C)O[Si](C)(C)C	{1: 4, 5: 1, 22: 1, 7: 1}
Did not match all atoms present	18335-17-6	CCCCC(CCC)C1=CC=CC=C1	{1: 2, 2: 5, 3: 1, 14: 5}
Did not match all atoms present	18343-40-3	C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=NC(=NC(=N3)N(C4=CC=CC=C4)C5=CC=CC=C5)N(C6=CC=CC=C6)C7=CC=CC=C7	{33: 3, 35: 3, 14: 30}
Did not match all atoms present	18344-51-9	CC1=CC(=CN=C1N)[N+](=O)[O-]	{38: 1, 1: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	18346-04-8	CN1C=NC2=NC=NC=C21	{1: 1, 35: 3, 14: 3, 33: 1}
Did not match all atoms present	18347-39-2	CC1=CC(=C(C=C1OC)NC(=O)C2=CC=CC=C2)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 1, 14: 7, 17: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	1835-04-7	CCC(=O)C1=CC(=C(C=C1)OC)OC	{24: 1, 1: 3, 2: 1, 22: 2, 14: 3}
Did not match all atoms present	1835-11-6	CC(=O)C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC	{24: 1, 1: 2, 2: 1, 22: 2, 14: 8}
Did not match all atoms present	1835-14-9	CCC(=O)C1=CC(=C(C=C1)O)OC	{1: 2, 2: 1, 14: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	1835-49-0	C(#N)C1=C(C(=C(C(=C1F)F)C#N)F)F	{16: 4, 37: 2}
Did not match all atoms present	1835-61-6	C1=C(C(=C(C(=C1F)F)Cl)F)F	{16: 4, 17: 1, 14: 1}
Did not match all atoms present	1835-65-0	C(#N)C1=C(C(=C(C(=C1F)F)F)F)C#N	{16: 4, 37: 2}
Did not match all atoms present	18354-35-3	C1=CC(=CC=C1C(=O)N=C=O)F	{34: 1, 8: 1, 14: 4, 16: 1, 24: 1, 29: 1}
Did not match all atoms present	18355-50-5	CC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)[N+](=CC=C6)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 14: 28, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	18355-54-9	CC[N+]1=CC=CC2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC6=C(C=CC=[N+]6CC)C=C5.CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O	{1: 4, 2: 2, 33: 2, 14: 28, 20: 2, 24: 3, 29: 4, 31: 3}
Did not match all atoms present	18355-73-2	C1=CC(=C(C(=C1)F)F)C(=O)Cl	{16: 2, 17: 1, 14: 3, 24: 1}
Did not match all atoms present	18355-75-4	C1=CC(=C(C(=C1)F)F)C(=O)N	{16: 2, 24: 1, 30: 1, 14: 3}
Did not match all atoms present	18355-80-1	CC(=O)C1=C(C(=CC=C1)F)F	{16: 2, 1: 1, 14: 3, 24: 1}
Did not match all atoms present	18356-17-7	COP(=O)(C=C=C)OC	{1: 2, 5: 1, 6: 1, 8: 1, 22: 2, 29: 1}
Did not match all atoms present	18356-71-3	F[Si](F)(Cl)Cl	{16: 2, 17: 2}
Did not match all atoms present	18358-34-4	CCCCOP(=O)(CC)F	{16: 1, 1: 2, 2: 4, 29: 1, 22: 1}
Did not match all atoms present	18358-63-9	CNC1=CC=C(C=C1)C(=O)OC	{1: 2, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	1836-22-2	C1=CC=C(C(=C1)C(=O)[O-])N/N=C\2/C3=C(C=C(C=C3)S(=O)(=O)[O-])C=C(C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	1836-75-5	C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=C(C=C2)Cl)Cl	{17: 2, 38: 1, 22: 1, 14: 7}
Did not match all atoms present	1836-77-7	C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=C(C=C2Cl)Cl)Cl	{17: 3, 38: 1, 22: 1, 14: 6}
Did not match all atoms present	1836-87-9	C1=CC=C(C=C1)C=C2C3=CC=CC=C3C4=CC=CC=C42	{14: 13, 6: 1, 15: 1}
Did not match all atoms present	18360-24-2	CC/C(=C\C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)[O-])/C=C\4/N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCC(C)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 5, 3: 2, 33: 2, 6: 2, 7: 1, 14: 16, 15: 1, 23: 2, 29: 6}
Did not match all atoms present	18362-36-2	CC1=C(C(=CC=C1)O)C=O	{1: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	18362-51-1	COC1=CC=C(C=C1)C(=O)CC(=O)C2=CC=C(C=C2)OC	{24: 2, 1: 2, 2: 1, 22: 2, 14: 8}
Did not match all atoms present	18364-47-1	CNC1=CN=CC=C1	{1: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	18365-32-7	C[Si](C)(C)[Si]	{1: 3}
Did not match all atoms present	18365-41-8	C(=O)(C(=O)[O-])[O-].[Cs+].[Cs+]	{24: 2}
Did not match all atoms present	18365-42-9	C1=CC=C(C=C1)/C=C(/C=O)\Cl	{17: 1, 26: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	18366-27-3	CCCCCCCCC=CCCCCCCCCOCC(CC)OS(=O)(=O)O	{1: 2, 2: 17, 3: 1, 6: 2, 20: 1, 22: 2, 29: 2}
Did not match all atoms present	183673-66-7	CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{1: 3, 2: 1, 4: 1, 33: 1, 11: 4, 12: 1, 13: 1, 14: 8, 27: 1, 28: 2, 31: 1}
Did not match all atoms present	18368-63-3	CC1=NC(=CC=C1)Cl	{1: 1, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	18368-64-4	CC1=CN=C(C=C1)Cl	{1: 1, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	18368-76-8	CC1=C(N=CC=C1)Cl	{1: 1, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	1837-57-6	CCOC1=CC2=C(C3=C(C=C(C=C3)N)N=C2C=C1)N.CC(C(=O)O)O	{1: 2, 2: 1, 3: 1, 14: 6, 35: 1, 20: 1, 22: 1, 27: 1, 30: 2}
Did not match all atoms present	18370-11-1	CC1=CC=C(C=C1)C(=O)NC	{24: 1, 1: 2, 14: 4, 31: 1}
Did not match all atoms present	18371-33-0	C1=CC=C2C(=C1)N(C(=CC=CC=CC3=[N+](C4=CC=CC=C4S3)CCO)S2)CCO.[Br-]	{33: 2, 2: 4, 6: 5, 41: 2, 14: 8, 15: 1, 18: 1, 20: 2}
Did not match all atoms present	18378-20-6	C1=CC=C(C=C1)CNC2=CC=C(C3=NON=C23)[N+](=O)[O-]	{2: 1, 35: 2, 38: 1, 14: 7, 23: 1, 31: 1}
Did not match all atoms present	18378-89-7	C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O[C@@H]2C[C@@H](O[C@@H]([C@H]2O)C)OC3=CC4=CC5=C(C(=O)[C@H]([C@@H](C5)[C@@H](C(=O)[C@H]([C@@H](C)O)O)OC)O[C@H]6C[C@H]([C@@H]([C@H](O6)C)O)O[C@H]7C[C@H]([C@H]([C@H](O7)C)O)O[C@H]8C[C@]([C@@H]([C@H](O8)C)O)(C)O)C(=C4C(=C3C)O)O)O)O	{1: 9, 3: 3, 11: 6, 12: 21, 13: 1, 14: 2, 20: 9, 21: 2, 22: 6, 23: 5, 24: 1, 25: 1}
Did not match all atoms present	1838-08-0	CCCCCCCCCCCCCCCCCC[NH3+].[Cl-]	{1: 1, 2: 17, 17: 1}
Did not match all atoms present	1838-13-7	[B]N(C)C	{1: 2, 33: 1}
Did not match all atoms present	1838-56-8	CC(=O)NC1=C(C=C2C(=C1)CC3=CC=CC=C32)O	{1: 1, 11: 1, 14: 6, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	1838-59-1	C=CCOC=O	{2: 1, 26: 1, 5: 1, 6: 1}
Did not match all atoms present	18387-12-7	C[Si](C)(C)CCN1CC1	{1: 3, 2: 2, 11: 2, 33: 1}
Did not match all atoms present	18388-03-9	C[Si](C)(C)CC(=C)CCl	{1: 3, 2: 2, 17: 1, 5: 1, 7: 1}
Did not match all atoms present	18388-16-4	C1CCC(CC1)C[Si](Cl)(Cl)Cl	{17: 3, 2: 1, 11: 5, 12: 1}
Did not match all atoms present	18388-41-5	CC(=O)OCCC[Si](C)(C)C	{1: 4, 2: 3, 28: 1}
Did not match all atoms present	18388-45-9	CCO[Si](C)(CC=C)OCC	{1: 3, 2: 3, 22: 2, 5: 1, 6: 1}
Did not match all atoms present	18388-84-6	CCCCCCCCCO[Si](C)(C)C	{1: 4, 2: 8, 22: 1}
Did not match all atoms present	18388-99-3	CCCCN(C(=O)N(CC)CC)[Si](C)(C)C	{24: 1, 1: 6, 2: 5, 33: 2}
Did not match all atoms present	18389-56-5	CN1CCOP1N(C)C	{1: 3, 11: 2, 33: 2, 23: 1}
Did not match all atoms present	1839-18-5	C1=NC2=C(N1)C(=NC(=N2)Cl)N	{32: 1, 17: 1, 35: 3, 30: 1, 14: 1}
Did not match all atoms present	18395-30-7	CC(C)C[Si](OC)(OC)OC	{1: 5, 2: 1, 3: 1, 22: 3}
Did not match all atoms present	18395-80-7	CC(C)(C)O[Si](OC(C)(C)C)(Cl)Cl	{1: 6, 4: 2, 22: 2, 17: 2}
Did not match all atoms present	18395-90-9	CC(C)(C)[Si](C(C)(C)C)(Cl)Cl	{1: 6, 4: 2, 17: 2}
Did not match all atoms present	18395-92-1	CC(C)C[Si](CC(C)C)(Cl)Cl	{1: 4, 2: 2, 3: 2, 17: 2}
Did not match all atoms present	18395-93-2	CCCCCCC[Si](C)(Cl)Cl	{1: 2, 2: 6, 17: 2}
Did not match all atoms present	18397-07-4	CC[C@@H]1CN2CC[C@@]34[C@@H]2C[C@@H]1[C@@H]([C@@H]3NC5=CC=CC=C45)CO	{32: 1, 1: 1, 2: 2, 33: 1, 11: 4, 12: 5, 13: 1, 14: 4, 20: 1}
Did not match all atoms present	18398-36-2	C1=CC=C2C(=C1)C(=C(C(=O)C2=O)Cl)Cl	{17: 2, 25: 2, 14: 4, 15: 2}
Did not match all atoms present	1840-19-3	C1=CC(=CC(=C1)N=C=S)C(F)(F)F	{8: 1, 16: 3, 34: 1, 4: 1, 14: 4}
Did not match all atoms present	18401-43-9	CCO[Si](C1CC2CC1C=C2)(OCC)OCC	{1: 3, 2: 3, 11: 2, 12: 3, 14: 2, 22: 3}
Did not match all atoms present	18402-10-3	CCCCCCCCCCO[Si](C)(C)C	{1: 4, 2: 9, 22: 1}
Did not match all atoms present	18402-22-7	CCCCCCCCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 13, 17: 3}
Did not match all atoms present	18402-76-1	C[Si](C)(C1C=CC=C1)O[Si](C)(C)C2C=CC=C2	{1: 4, 12: 2, 22: 1, 14: 8}
Did not match all atoms present	18403-59-3	CC1CC(OC2=CC(=C(C=C12)O)C(C)(C)CC(C)(C)C)(C)C	{1: 8, 2: 1, 4: 2, 11: 1, 12: 1, 13: 1, 14: 2, 21: 1, 23: 1}
Did not match all atoms present	18406-05-8	C[Si](C)(C)NC1=CC=C(C=C1)C(=O)O[Si](C)(C)C	{1: 6, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	18406-41-2	CO[Si](CC[Si](OC)(OC)OC)(OC)OC	{1: 6, 2: 2, 22: 6}
Did not match all atoms present	18407-07-3	CCCCCCCCCCCC[Si](C)(Cl)Cl	{1: 2, 2: 11, 17: 2}
Did not match all atoms present	18408-42-9	C[Si](C)(C)C(CCCCCCCC(=O)[O-])(C(=O)[O-])[Si](C)(C)C	{24: 2, 1: 6, 2: 7, 4: 1}
Did not match all atoms present	1841-19-6	C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F	{32: 1, 33: 2, 2: 3, 3: 1, 11: 5, 13: 1, 14: 13, 16: 2, 25: 1}
Did not match all atoms present	18410-58-7	C[Si](C)(C)CC1=CC=CC2=CC=CC=C21	{1: 3, 2: 1, 14: 7}
Did not match all atoms present	18412-14-1	C[Si](C)(C)CC1=CC=CC=C1C[Si](C)(C)C	{1: 6, 2: 2, 14: 4}
Did not match all atoms present	18412-15-2	C[Si](C)(C)CC1=CC(=CC=C1)C[Si](C)(C)C	{1: 6, 2: 2, 14: 4}
Did not match all atoms present	18414-36-3	C1=CC=C(C=C1)C[Si](CC2=CC=CC=C2)(Cl)Cl	{17: 2, 2: 2, 14: 10}
Did not match all atoms present	18414-62-5	C[Si]1(C2=CC=CC=C2OC3=CC=CC=C31)C	{1: 2, 14: 8, 23: 1}
Did not match all atoms present	18415-23-1	C[Si](C)(C)C(=CC1=CC=CC=C1)[Si](C)(C)C	{1: 6, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	18417-89-5	C1=C(C2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=CN=C2N)C(=O)N	{33: 1, 2: 1, 35: 2, 12: 4, 14: 2, 20: 3, 23: 1, 24: 1, 30: 2}
Did not match all atoms present	18418-79-6	CCO[Si](C1=CC=C(C=C1)N(C)C)(OCC)OCC	{1: 5, 2: 3, 22: 3, 14: 4, 33: 1}
Did not match all atoms present	18419-53-9	C=C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)Cl	{17: 1, 14: 10, 5: 1, 6: 1}
Did not match all atoms present	1842-38-2	C1=CC=C(C=C1)C[Se]CC2=CC=CC=C2	{2: 2, 14: 10}
Did not match all atoms present	18420-09-2	CCO[Si](C)(C)O[Si](C)(C)OCC	{1: 6, 2: 2, 22: 3}
Did not match all atoms present	18420-49-0	CCC(=CC1=[N+](C2=CC=CC=C2C=C1)C)C=C3N(C4=CC=CC=C4S3)C.[I-]	{1: 3, 2: 1, 33: 2, 6: 2, 7: 1, 41: 1, 14: 10, 15: 1, 19: 1}
Did not match all atoms present	18420-56-9	CCC(=CC1=[N+](C2=CC3=CC=CC=C3C=C2S1)CC)C=C4N(C5=CC6=CC=CC=C6C=C5S4)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 3, 33: 2, 6: 2, 7: 1, 41: 2, 14: 16, 15: 1, 29: 3}
Did not match all atoms present	18423-69-3	C1[C@@H]([C@H]([C@H](O1)O)CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5	{2: 2, 11: 3, 12: 3, 14: 6, 20: 1, 23: 5}
Did not match all atoms present	18426-55-6	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCC(C)S(=O)(=O)[O-])C=C3N(C4=C(S3)C=CC(=C4)Cl)CC	{1: 3, 2: 4, 3: 1, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 17: 2, 29: 3}
Did not match all atoms present	18426-56-7	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CC)C=C3N(C4=C(S3)C=CC(=C4)Cl)CC.[Br-]	{1: 3, 2: 3, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 17: 2, 18: 1}
Did not match all atoms present	18429-70-4	CC1=CC=CC2=C1C(=CC3=CC4=CC=CC=C4C=C23)C	{1: 2, 14: 10}
Did not match all atoms present	18429-71-5	CC1=CC2=CC3=C4C=CC=C(C4=C(C=C3C=C2C=C1)C)C	{1: 3, 14: 9}
Did not match all atoms present	1843-03-4	CC1=CC(=C(C=C1C(C)CC(C2=CC(=C(C=C2C)O)C(C)(C)C)C3=CC(=C(C=C3C)O)C(C)(C)C)C(C)(C)C)O	{1: 13, 2: 1, 3: 2, 4: 3, 14: 6, 21: 3}
Did not match all atoms present	1843-05-6	CCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 1, 2: 7, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	1843-24-9	CC1=CC(=C(C=C1C(C2=CC(=C(C=C2C)O)C(C)(C)C)C(C)C)C(C)(C)C)O	{1: 10, 3: 2, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	1843-42-1	C1CS[Sb](O1)SCCO	{2: 2, 40: 1, 41: 1, 11: 2, 20: 1, 23: 1}
Did not match all atoms present	18431-36-2	CCCCCC[Hg]Br	{1: 1, 2: 5, 18: 1}
Did not match all atoms present	18433-40-4	[NH4+].[NH4+].[NH4+].[O-2].[O-2].[F-].[F-].[F-].[F-].[F-].[U]	{16: 5}
Did not match all atoms present	18433-97-1	CCCC1=NC(=CN=C1C)C	{1: 3, 2: 2, 35: 2, 14: 1}
Did not match all atoms present	18434-12-3	C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2C4=CC=CC=C4	{33: 1, 14: 15}
Did not match all atoms present	18437-57-5	CN(C)C1=CN=CC=C1	{1: 2, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	18437-78-0	C1=CC(=CC=C1F)P(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F	{16: 3, 14: 12}
Did not match all atoms present	18438-38-5	CSC1=CC=CC=N1	{40: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	1844-01-5	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O	{4: 1, 21: 2, 14: 18}
Did not match all atoms present	1844-53-7	C1=CC=C(C=C1)C2=CN3C(=N2)C=CC(=N3)Cl	{17: 1, 35: 2, 14: 8, 33: 1}
Did not match all atoms present	1844-54-8	C1=CC=C(C=C1)C2=CN3C(=N2)C=CC=N3	{33: 1, 35: 2, 14: 9}
Did not match all atoms present	18440-21-6	C1=CC=C(C=C1)NP2N(P(N2C3=CC=CC=C3)NC4=CC=CC=C4)C5=CC=CC=C5	{33: 2, 14: 20, 31: 2}
Did not match all atoms present	18440-30-7	C1=CC(=CC=C1NC(=NC2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]	{34: 1, 31: 2, 38: 3, 14: 12, 7: 1}
Did not match all atoms present	18441-43-5	CC1=CC2=C(C=C1)OC=C2	{1: 1, 14: 5, 23: 1}
Did not match all atoms present	18441-55-9	CCC1=C(C(=C(C=C1)C)C)O	{1: 3, 2: 1, 21: 1, 14: 2}
Did not match all atoms present	18441-56-0	CCCC1=CC(=C(C=C1)O)C	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	18441-60-6	CC1=CN=C(C(=C1C)C)C	{1: 4, 35: 1, 14: 1}
Did not match all atoms present	18441-61-7	CC1=CC=CC2=C1N=C(C=C2C)C	{1: 3, 35: 1, 14: 4}
Did not match all atoms present	18442-29-0	C#CC1=CC=CC=C1C2=CC=CC=C2C#C	{9: 2, 10: 2, 14: 8}
Did not match all atoms present	1845-11-0	COC1=CC2=C(C=C1)C(=C(CC2)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCC5	{1: 1, 2: 2, 33: 1, 11: 6, 14: 12, 15: 2, 22: 2}
Did not match all atoms present	18450-01-6	CC1=NC=C(N=C1C)CCC(C)C	{1: 4, 2: 2, 3: 1, 14: 1, 35: 2}
Did not match all atoms present	184538-58-7	CCOP(=O)(OCC)OCC.C1CO1.O=P(=O)OP(=O)=O	{1: 3, 2: 3, 11: 2, 22: 4, 23: 1, 29: 5}
Did not match all atoms present	18454-12-1	[O-][Cr](=O)(=O)[O-].O=[Pb].[Pb+2]	{29: 5}
Did not match all atoms present	18457-03-9	CCOC(=O)CC(=O)O[Si](C)(C)C	{1: 4, 2: 2, 28: 2}
Did not match all atoms present	18459-37-5	[Cs+]	{}
Did not match all atoms present	1846-73-7	CCCC(=O)C1=CC2=CC=CC=C2OC1=O	{24: 1, 1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	1846-76-0	CCOC(=O)C1=CC2=CC=CC=C2OC1=O	{1: 1, 2: 1, 28: 2, 14: 5}
Did not match all atoms present	18461-55-7	CC1=CC(=CC(=C1OC(=O)C)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 28: 1, 38: 2, 14: 2}
Did not match all atoms present	18462-64-1	CCN1C2=CC(=C(C=C2[N+](=C1/C=C/C=C/3\N(C4=CC(=C(C=C4N3CCCCS(=O)(=O)[O-])Cl)Cl)CC)CCCCS(=O)(=O)[O-])Cl)Cl.[Na+]	{1: 2, 2: 10, 6: 3, 33: 4, 14: 4, 15: 1, 17: 4, 29: 6}
Did not match all atoms present	18463-86-0	CN(C)C1=CC=C(C=C1)N=NC2=C3C(=CC=C2)NC=N3	{32: 1, 1: 2, 34: 2, 35: 1, 33: 1, 14: 8}
Did not match all atoms present	18466-11-0	COP(=S)(C)SCSC1=CC=C(C=C1)Cl	{1: 2, 2: 1, 40: 2, 14: 4, 17: 1, 22: 1}
Did not match all atoms present	18469-37-9	CN(C)C(=O)C1=CC=C(C=C1)Br	{24: 1, 1: 2, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	18469-44-8	CCCCCCCCCCCCCC(=O)N(C)CCS(=O)(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 14, 29: 3, 33: 1}
Did not match all atoms present	1847-58-1	CCCCCCCCCCCCOC(=O)CS(=O)(=O)O.[Na+]	{1: 1, 2: 12, 20: 1, 29: 2, 28: 1}
Did not match all atoms present	1847-63-8	COC1=CC2=C(C=C1)C(=C(CC2)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCC5.Cl	{1: 1, 2: 2, 33: 1, 11: 6, 14: 12, 15: 2, 17: 1, 22: 2}
Did not match all atoms present	1847-84-3	CCOC(=O)OC1=CC=CC=C1OC	{1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	184719-87-7	C1=CC2=C(C=C1N)C(=O)C(=NNC3=CC(=CC(=C3O)S(=O)(=O)[O-])[N+](=O)[O-])C(=C2)S(=O)(=O)[O-].C1=CC2=C(C=C1N)C=C(C(=NNC3=CC(=CC(=C3O)Cl)[N+](=O)[O-])C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cr]	{34: 2, 38: 2, 14: 12, 15: 4, 17: 1, 21: 2, 25: 2, 29: 9, 30: 2, 31: 2}
Did not match all atoms present	18472-30-5	[Er+3]	{}
Did not match all atoms present	18472-51-0	C1=CC(=CC=C1N/C(=N/C(=NCCCCCCN=C(/N=C(/NC2=CC=C(C=C2)Cl)\N)N)N)/N)Cl.C(O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)O.C(O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)O	{2: 8, 3: 8, 7: 4, 34: 4, 14: 8, 17: 2, 20: 10, 27: 2, 30: 4, 31: 2}
Did not match all atoms present	1848-41-5	COC1=NNC2=CC=CC=C21	{32: 1, 1: 1, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	1848-84-6	CCC1=NC2=CC=CC=C2N1	{32: 1, 1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	18480-07-4	[OH-].[OH-].[Sr+2]	{}
Did not match all atoms present	1849-01-0	CN1C2=CC=CC=C2NC1=O	{32: 1, 1: 1, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	1849-18-9	CCC(C)C1=CC(=C(C=C1)O)C(C)CC	{1: 4, 2: 2, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	1849-29-2	[2H]C([2H])([2H])O	{1: 1, 20: 1}
Did not match all atoms present	1849-36-1	C1=CC(=CC=C1[N+](=O)[O-])S	{38: 1, 14: 4, 39: 1}
Did not match all atoms present	1849-38-3	C#C[Si](C#C)(C#C)C#C	{9: 4, 10: 4}
Did not match all atoms present	1849-39-4	C[Si](C#C)(C#C)C#C	{1: 1, 10: 3, 9: 3}
Did not match all atoms present	18495-45-9	B1(SB(SB(S1)Br)Br)Br	{41: 3, 18: 3}
Did not match all atoms present	18496-25-8	[S-2]	{}
Did not match all atoms present	18498-01-6	C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl[Co]Cl	{17: 2, 2: 2, 14: 20}
Did not match all atoms present	18500-32-8	N[NH3+]	{30: 1}
Did not match all atoms present	185017-72-5	CC1=NC(=C(C=C1)Br)Cl	{1: 1, 18: 1, 35: 1, 14: 2, 17: 1}
Did not match all atoms present	18507-89-6	CCCCCCCCCCOC1=C(C=C2C(=C1)C(=O)C(=CN2)C(=O)OCC)OCC	{32: 1, 1: 3, 2: 11, 14: 3, 22: 2, 25: 1, 28: 1}
Did not match all atoms present	1851-09-8	C1=CC(=CC=C1S(=O)(=O)CC#N)Cl	{17: 1, 2: 1, 29: 2, 14: 4, 37: 1}
Did not match all atoms present	1851-22-5	C1=CC(=C[N+](=C1)[O-])Cl	{17: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	1851-71-4	CCOC(=S)SSSSC(=S)OCC	{40: 4, 1: 2, 2: 2, 22: 2, 7: 2}
Did not match all atoms present	1851-77-0	CCOC(=S)SSSC(=S)OCC	{40: 3, 1: 2, 2: 2, 22: 2, 7: 2}
Did not match all atoms present	18510-29-7	CCCC[Si](CCCC)(CCCC)C1=CC=CC=C1	{1: 3, 2: 9, 14: 5}
Did not match all atoms present	18513-98-9	COC1(C=CC(=CC1(OC)OC)C=CC2=CC=CC=C2)OC	{1: 4, 6: 2, 13: 2, 14: 8, 15: 1, 22: 4}
Did not match all atoms present	18515-18-9	CC1=CC(=CC(=C1[N+](=O)[O-])C)C=O	{1: 2, 26: 1, 38: 1, 14: 2}
Did not match all atoms present	18520-54-2	CCC[N+]1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=C[N+](=CC=C5)CCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 14: 28, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	18520-57-5	CCC[N+]1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=CC=[N+](C=C5)CCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 14: 28, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	18522-93-5	C1=CC=C(C=C1)S(=O)(=O)[NH-].[Na+]	{36: 1, 29: 2, 14: 5}
Did not match all atoms present	18522-98-0	CCOC(=O)C(=O)NC1=CC=C(C=C1)C	{1: 2, 2: 1, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	18523-22-3	C1=CC(=CC(=C1)Br)C(=O)CBr	{24: 1, 2: 1, 18: 2, 14: 4}
Did not match all atoms present	18523-48-3	C(C(=O)O)N=[N+]=[N-]	{2: 1, 27: 1, 34: 2}
Did not match all atoms present	18523-69-8	CC(=NNC1=NC(=CS1)C2=CC=C(O2)[N+](=O)[O-])C	{1: 2, 34: 1, 35: 1, 38: 1, 7: 1, 41: 1, 14: 3, 23: 1, 31: 1}
Did not match all atoms present	185307-39-5	C1=CC(=CC=C1N=NC2=C(C(=CC(=C2N)S(=O)(=O)[O-])N=NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N)S(=O)(=O)CCOS(=O)(=O)[O-].[Na+]	{34: 4, 2: 4, 14: 8, 22: 2, 29: 16, 30: 2}
Did not match all atoms present	18531-94-7	C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O	{21: 2, 14: 12}
Did not match all atoms present	18536-91-9	CCCCCCCCCCCC[Si](OCC)(OCC)OCC	{1: 4, 2: 14, 22: 3}
Did not match all atoms present	185379-39-9	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=CC=N4)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	185379-40-2	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=CC=N4)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	18538-45-9	C1=CC=C2C(=C1)NC(=N2)NC(=O)O	{32: 1, 35: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	18539-34-9	CC1=C(C(=CC=C1)C)C(C2=C(C=CC=C2C)C)OCC[NH+](C)C.[Cl-]	{1: 6, 2: 2, 3: 1, 14: 6, 17: 1, 22: 1}
Did not match all atoms present	18540-29-9	[Cr+6]	{}
Did not match all atoms present	18544-67-7	CC(C)CC[Si](Cl)(Cl)Cl	{1: 2, 2: 2, 3: 1, 17: 3}
Did not match all atoms present	18547-12-1	C[Si](C)(C)C[Sn](C[Si](C)(C)C)(C[Si](C)(C)C)C[Si](C)(C)C	{1: 12, 2: 4}
Did not match all atoms present	18547-13-2	C[Si](C)(C)C[Pb](C[Si](C)(C)C)(C[Si](C)(C)C)C[Si](C)(C)C	{1: 12, 2: 4}
Did not match all atoms present	18547-93-8	CC(=C)C(=O)OCCC[Si](C)(C)O[Si](C)(C)CCCOC(=O)C(=C)C	{1: 6, 2: 6, 5: 2, 7: 2, 22: 1, 28: 2}
Did not match all atoms present	1855-09-0	CC(C(C1=CC=CC=C1)O)O	{1: 1, 3: 2, 20: 2, 14: 5}
Did not match all atoms present	1855-36-3	CC1=C(C=C(C=C1)C2CO2)C	{1: 2, 11: 1, 12: 1, 14: 3, 23: 1}
Did not match all atoms present	18551-03-6	C[Si](C)(C)N1C=NC2=C1N=C(N=C2O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 35: 3, 22: 2, 14: 1, 33: 1}
Did not match all atoms present	18551-82-1	C[Si]1(C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C31)C	{1: 2, 29: 2, 14: 8}
Did not match all atoms present	18555-26-5	C1SC(=S)S1	{41: 2, 11: 1, 15: 1}
Did not match all atoms present	18559-59-6	COC1=CC(=CC(=C1OC)OC)C[C@H]2C3=CC(=C(C=C3CCN2)O)O.Cl	{32: 1, 1: 3, 2: 1, 11: 2, 12: 1, 14: 4, 17: 1, 21: 2, 22: 3}
Did not match all atoms present	18559-60-9	COC1=CC(=CC(=C1OC)OC)CC2C3=CC(=C(C=C3CC[NH2+]2)O)O.[Cl-]	{1: 3, 2: 1, 11: 2, 12: 1, 14: 4, 17: 1, 21: 2, 22: 3}
Did not match all atoms present	18559-92-7	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC3=C2SC=N3	{1: 2, 34: 2, 35: 1, 33: 1, 41: 1, 14: 8}
Did not match all atoms present	18559-94-9	CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O	{1: 3, 2: 2, 3: 1, 4: 1, 14: 3, 20: 2, 21: 1, 31: 1}
Did not match all atoms present	18559-95-0	CC(=O)N(C1=CC=C(C=C1)C=CC2=CC=CC=C2)O	{1: 1, 6: 2, 33: 1, 14: 9, 20: 1, 24: 1}
Did not match all atoms present	1856-05-9	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O[Si](C)(C)C)C)C	{1: 8, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 22: 1}
Did not match all atoms present	1856-98-0	CCC1=C(C(=O)NC1CC2=C(C(=C(N2)C=C3C(=C(C(=N3)CC4C(=C(C(=O)N4)CC)C)C)CCC(=O)O)CCC(=O)O)C)C	{32: 3, 1: 6, 2: 8, 35: 1, 6: 1, 12: 2, 15: 8, 25: 2, 27: 2}
Did not match all atoms present	18583-59-0	[BH2-](N1C=CC=N1)N2C=CC=N2.[K+]	{33: 2, 35: 2, 14: 6}
Did not match all atoms present	18583-60-3	[BH-](N1C=CC=N1)(N2C=CC=N2)N3C=CC=N3.[K+]	{33: 3, 35: 3, 14: 9}
Did not match all atoms present	18583-62-5	[BH-](N1C=CC=N1)(N2C=CC=N2)N3C=CC=N3.[Na+]	{33: 3, 35: 3, 14: 9}
Did not match all atoms present	18584-93-5	COC(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 28: 1, 31: 1}
Did not match all atoms present	18585-06-3	CCOC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 3, 16: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	18586-22-6	C[Si](C)(C=C)O[Si](C1=CC=CC=C1)(C2=CC=CC=C2)O[Si](C)(C)C=C	{1: 4, 14: 10, 22: 2, 5: 2, 6: 2}
Did not match all atoms present	18586-39-5	CCO[Si](CCP(C1=CC=CC=C1)C2=CC=CC=C2)(OCC)OCC	{1: 3, 2: 5, 22: 3, 14: 10}
Did not match all atoms present	18588-16-4	C1(=NNN=N1)N[N+](=O)[O-]	{32: 1, 35: 3, 38: 1, 31: 1}
Did not match all atoms present	18588-49-3	C1=CC=C(C=C1)C2=CN=C(N=C2N)N	{35: 2, 30: 2, 14: 6}
Did not match all atoms present	18588-50-6	CC1=C(C(=NC(=N1)N)N)C2=CC=CC=C2	{1: 1, 35: 2, 30: 2, 14: 5}
Did not match all atoms present	1859-09-2	[2H]C([2H])(C)O	{1: 1, 2: 1, 20: 1}
Did not match all atoms present	1859-39-8	C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2O	{33: 1, 21: 1, 14: 10}
Did not match all atoms present	1859-76-3	CNC1=CC=CC=C1C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	18591-81-6	CC1=CC(=S)C(=NN1)N	{32: 1, 1: 1, 35: 1, 30: 1, 14: 1}
Did not match all atoms present	18592-13-7	C1=C(NC(=O)NC1=O)CCl	{32: 2, 17: 1, 2: 1, 14: 1, 25: 2}
Did not match all atoms present	18594-05-3	CC(=O)C1=CC=C(C=C1)C2CCCCC2	{24: 1, 1: 1, 11: 5, 12: 1, 14: 4}
Did not match all atoms present	18601-87-1	O.[O-][Mo](=O)(=O)[O-].[Co+2]	{29: 4}
Did not match all atoms present	18603-17-3	CCCCCCCCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 12, 28: 1}
Did not match all atoms present	1861-32-1	COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl	{1: 2, 28: 2, 17: 4}
Did not match all atoms present	1861-40-1	CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]	{1: 2, 2: 4, 4: 1, 38: 2, 33: 1, 14: 2, 16: 3}
Did not match all atoms present	1861-44-5	CC(COCC1=C(C=CC(=C1Cl)Cl)Cl)O	{1: 1, 2: 2, 3: 1, 14: 2, 17: 3, 20: 1, 22: 1}
Did not match all atoms present	18615-86-6	CC1=CC(=O)C=CN1	{32: 1, 1: 1, 14: 3, 25: 1}
Did not match all atoms present	18618-55-8	O.O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Ce+3]	{17: 3}
Did not match all atoms present	18620-05-8	CC12OCP(CO1)CO2	{1: 1, 11: 3, 13: 1, 23: 3}
Did not match all atoms present	18622-13-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC4=CC=C(C=C4)O)N	{25: 2, 22: 1, 30: 1, 21: 2, 14: 9}
Did not match all atoms present	18622-23-6	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NN	{24: 1, 30: 1, 14: 9, 31: 1}
Did not match all atoms present	18622-28-1	C(=[N-])=NC#N.C(=[N-])=NC#N.[Zn+2]	{8: 2, 34: 2, 37: 2}
Did not match all atoms present	18623-11-5	CCCCCCCCCCCCCCCCCC[Si]	{1: 1, 2: 17}
Did not match all atoms present	18624-44-7	[Fe+2].[OH-].[OH-]	{}
Did not match all atoms present	18625-12-2	COC(=O)CCCOC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 3, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	18629-74-8	CC[Sn](CC)(CC)CC1=CC=CC=C1	{1: 3, 2: 4, 14: 5}
Did not match all atoms present	1863-63-4	C1=CC=C(C=C1)C(=O)[O-].[NH4+]	{24: 1, 14: 5}
Did not match all atoms present	18631-82-8	C1=CC=C(C=C1)C2=CC(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6	{14: 26}
Did not match all atoms present	186320-06-9	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CSC=C4)C(=O)O	{2: 2, 3: 1, 41: 1, 12: 1, 14: 11, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	18636-32-3	CC1=CC2=C(C=C1C)N(C3=NC(=O)N(C(=O)C3=N2)C)C	{1: 4, 35: 2, 33: 2, 14: 2, 25: 2}
Did not match all atoms present	18636-87-8	C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4[N+](=C32)[O-]	{33: 1, 35: 1, 29: 1, 14: 10}
Did not match all atoms present	18636-88-9	C1=CC=C2C(=C1)C=CC3=C2[N+](=O)C4=CC=CC=C4N3[O-]	{33: 2, 29: 2, 14: 10}
Did not match all atoms present	18638-99-8	COC1=CC(=CC(=C1OC)OC)CN	{1: 3, 2: 1, 30: 1, 22: 3, 14: 2}
Did not match all atoms present	1864-92-2	CCN(CC)C1=CC(=CC=C1)OCC	{1: 3, 2: 3, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	1864-94-4	C1=CC=C(C=C1)OC=O	{26: 1, 14: 5}
Did not match all atoms present	18640-58-9	CC(=O)C1=CC(=C(C=C1)Br)[N+](=O)[O-]	{24: 1, 1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	18640-60-3	CC(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	18640-74-9	CC(C)CC1=NC=CS1	{1: 2, 2: 1, 3: 1, 41: 1, 14: 2, 35: 1}
Did not match all atoms present	18643-08-8	CCCCCCCCCCCCCCCCCC[Si](C)(C)Cl	{1: 3, 2: 17, 17: 1}
Did not match all atoms present	18643-47-5	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=CC=C(C=C4)[N+](=O)[O-])O)C(C)(C)CC	{1: 6, 2: 6, 4: 2, 38: 1, 14: 12, 21: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	18643-84-0	COC(=O)C1=CC(=C(C=C1)C(=O)OC)Cl	{1: 2, 28: 2, 14: 3, 17: 1}
Did not match all atoms present	18643-86-2	COC(=O)C1=CC(=C(C=C1)C(=O)OC)Br	{1: 2, 18: 1, 28: 2, 14: 3}
Did not match all atoms present	186449-38-7	[In+3].[OH-]	{}
Did not match all atoms present	18648-22-1	C[NH+](C)CCC1=CSC2=CC=CC=C21.[Cl-]	{1: 2, 2: 2, 41: 1, 14: 5, 17: 1}
Did not match all atoms present	18649-05-3	OP(=O)(O)[O-].[Cs+]	{20: 2, 29: 2}
Did not match all atoms present	1865-01-6	C1=CC(=CC=C1[N+](=O)[O-])OC=O	{26: 1, 38: 1, 14: 4}
Did not match all atoms present	186517-29-3	C1=CC(=C(C(=C1C(F)(F)F)C=O)F)Cl	{16: 4, 17: 1, 26: 1, 4: 1, 14: 2}
Did not match all atoms present	18653-98-0	C1=CC=C(C(=C1)CNCCNCC2=CC=CC=C2O)O	{2: 4, 21: 2, 14: 8, 31: 2}
Did not match all atoms present	18656-21-8	CC(=O)NCC1=C(C(=C(C(=C1I)C(=O)O)I)NC(=O)C)I.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O	{1: 3, 2: 3, 3: 4, 19: 3, 20: 5, 24: 2, 27: 1, 31: 3}
Did not match all atoms present	18656-25-2	C1=CC=C(C=C1)C(C2=CC=CC=C2)OC/C(=N\O)/N.C(=C\C(=O)O)\C(=O)O	{2: 1, 3: 1, 6: 2, 7: 1, 34: 1, 14: 10, 20: 1, 22: 1, 27: 2, 30: 1}
Did not match all atoms present	18657-57-3	C1C=C(C2=CC=CC=C21)CCC3=CCC4=CC=CC=C43	{2: 2, 11: 2, 14: 10, 15: 2}
Did not match all atoms present	186589-03-7	C1=CC=C(C(=C1)N=C=O)OC(F)F	{34: 1, 3: 1, 8: 1, 14: 4, 16: 2, 22: 1, 29: 1}
Did not match all atoms present	186589-12-8	C1=CC(=C(C=C1Br)C(F)(F)F)N=C=S	{34: 1, 4: 1, 8: 1, 14: 3, 16: 3, 18: 1}
Did not match all atoms present	186598-40-3	CC(C)(C)N[Si]NC(C)(C)C	{1: 6, 4: 2, 31: 2}
Did not match all atoms present	1866-15-5	CC(=O)SCC[N+](C)(C)C.[I-]	{24: 1, 1: 4, 2: 2, 19: 1, 40: 1}
Did not match all atoms present	1866-16-6	CCCC(=O)SCC[N+](C)(C)C.[I-]	{24: 1, 1: 4, 2: 4, 19: 1, 40: 1}
Did not match all atoms present	1866-31-5	C=CCOC(=O)C=CC1=CC=CC=C1	{2: 1, 14: 5, 28: 1, 5: 1, 6: 3}
Did not match all atoms present	1866-38-2	C1=CC(=CC(=C1)Cl)/C=C/C(=O)O	{17: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	1866-39-3	CC1=CC=C(C=C1)/C=C/C(=O)O	{1: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	1866-43-9	CC1=NC2=C(C=CN2)C(=N1)NCC3=CC=CC=C3	{32: 1, 1: 1, 2: 1, 35: 2, 14: 7, 31: 1}
Did not match all atoms present	1866-73-5	CCC(=O)SCC[N+](C)(C)C.[I-]	{24: 1, 1: 4, 2: 3, 19: 1, 40: 1}
Did not match all atoms present	18662-53-8	C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].O.[Na+].[Na+].[Na+]	{24: 3, 33: 1, 2: 3}
Did not match all atoms present	1867-37-4	C1=CC=C(C=C1)CC(C#N)C#N	{2: 1, 3: 1, 37: 2, 14: 5}
Did not match all atoms present	1867-66-9	CNC1(CCCCC1=O)C2=CC=CC=C2Cl.Cl	{1: 1, 11: 4, 13: 1, 14: 4, 17: 2, 25: 1, 31: 1}
Did not match all atoms present	1867-72-7	CC(C)(C)[NH2+]CCCC[NH3+].[Cl-].[Cl-]	{1: 3, 2: 4, 4: 1, 17: 2}
Did not match all atoms present	18671-97-1	C1=CC2=NC(=CN=C2C=C1Cl)Cl	{17: 2, 35: 2, 14: 4}
Did not match all atoms present	1868-00-4	C1=CC(=CC(=C1)C(F)(F)F)C(=O)C2=CC(=CC=C2)C(F)(F)F	{16: 6, 24: 1, 4: 2, 14: 8}
Did not match all atoms present	18683-91-5	C1CC(CCC1NCC2=CC(=CC(=C2N)Br)Br)O	{2: 1, 11: 4, 12: 2, 14: 2, 18: 2, 20: 1, 30: 1, 31: 1}
Did not match all atoms present	18684-11-2	CCCCCCCCCCCCCCCCCC[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 2: 17, 29: 3, 22: 1}
Did not match all atoms present	18686-82-3	C1=NNC(=S)S1	{32: 1, 41: 1, 35: 1, 14: 1}
Did not match all atoms present	1869-77-8	CCN(CC(=O)OCC)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 8, 33: 1, 16: 17, 28: 1, 29: 2}
Did not match all atoms present	18694-40-1	CC1=CC(=NC(=N1)N2C(=CC(=N2)C)OC)OC	{1: 4, 35: 3, 22: 2, 14: 2, 33: 1}
Did not match all atoms present	18698-97-0	C1=CC=C(C(=C1)CC(=O)O)Br	{2: 1, 27: 1, 18: 1, 14: 4}
Did not match all atoms present	18699-48-4	CC(C)COC(=O)C1=CC=C(C=C1)C(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	187-83-7	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)C=CC5=C4C6=CC=CC=C6C=C5	{14: 16}
Did not match all atoms present	187-94-0	C1=CC2=C3C(=C1)C4=C5C(=CC=C4)C6=CC=CC7=C6C8=C9C(=C(C3=C58)C=C2)C=CC1=C9C7=CC=C1	{14: 16}
Did not match all atoms present	18704-37-5	C1=CC2=C(C(=C1)S(=O)(=O)Cl)N=CC=C2	{17: 1, 35: 1, 29: 2, 14: 6}
Did not match all atoms present	18708-70-8	C1=C(C=C(C(=C1Cl)[N+](=O)[O-])Cl)Cl	{17: 3, 38: 1, 14: 2}
Did not match all atoms present	1871-22-3	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=CC=C4)C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=CC=C7)C8=CC=CC=C8.[Cl-].[Cl-]	{1: 2, 35: 4, 33: 4, 14: 26, 17: 2, 22: 2}
Did not match all atoms present	1871-76-7	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)Cl	{24: 1, 17: 1, 3: 1, 14: 10}
Did not match all atoms present	18712-47-5	CC1=C(NN=C1C(C)(C)C)C(C)(C)C	{32: 1, 1: 7, 35: 1, 4: 2}
Did not match all atoms present	18713-51-4	C(C(CBr)OP(=O)(OC(CBr)CBr)OC(CBr)CBr)Br	{2: 6, 3: 3, 18: 6, 22: 3, 29: 1}
Did not match all atoms present	18713-58-1	CC(C)C(=O)C1=CC=C(C=C1)Cl	{24: 1, 1: 2, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	18714-16-4	C1=CC=C(C=C1)C2=CC(=NC=C2)C#N	{35: 1, 37: 1, 14: 8}
Did not match all atoms present	18714-34-6	C1=CC=C2C(=C1)C=CC(=N2)[N+](=O)[O-]	{35: 1, 38: 1, 14: 6}
Did not match all atoms present	18718-07-5	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Mn+2]	{29: 8}
Did not match all atoms present	18718-10-0	C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CNCC3=CC=CC=N3	{32: 3, 33: 1, 2: 3, 35: 1, 11: 10, 14: 8, 31: 1}
Did not match all atoms present	18719-22-7	C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl	{32: 1, 33: 1, 3: 1, 11: 4, 14: 9, 17: 2}
Did not match all atoms present	18719-76-1	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C([O+]=C4C=C(C=C(C4=C3)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O.[Cl-]	{1: 1, 2: 1, 12: 10, 14: 6, 17: 1, 20: 6, 21: 4, 22: 2, 23: 3}
Did not match all atoms present	18720-49-5	CC(C)(C)[NH3+].[O-]Cl(=O)(=O)=O	{1: 3, 4: 1, 29: 4, 17: 1}
Did not match all atoms present	18724-32-8	C[Si](C)(CCC1CCC2C(C1)O2)O[Si](C)(C)CCC3CCC4C(C3)O4	{1: 4, 2: 4, 11: 6, 12: 6, 22: 1, 23: 2}
Did not match all atoms present	18724-34-0	CC[Si](CC)(CC)CC1=CC=C(C=C1)C[Si](CC)(CC)CC	{1: 6, 2: 8, 14: 4}
Did not match all atoms present	18727-04-3	C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O.[Co+2]	{24: 2, 20: 1, 2: 2, 27: 1, 4: 1}
Did not match all atoms present	1873-54-7	CCC1=CC2=CC=CC=C2N=C1	{1: 1, 2: 1, 35: 1, 14: 6}
Did not match all atoms present	1873-55-8	CC1=CC2=CC=CC=C2[N+](=C1)[O-]	{1: 1, 29: 1, 14: 6, 33: 1}
Did not match all atoms present	1873-88-7	C[Si](O[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 22: 2}
Did not match all atoms present	1873-89-8	C[Si](C)(C)O[Si](O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 22: 3}
Did not match all atoms present	1873-92-3	C[Si](CC=C)(Cl)Cl	{1: 1, 2: 1, 5: 1, 6: 1, 17: 2}
Did not match all atoms present	18731-59-4	CC1=CC(=CC=C1)OC(=O)C2CCCCC2	{1: 1, 11: 5, 12: 1, 14: 4, 28: 1}
Did not match all atoms present	18733-06-7	CCCCCCCCC1=CC(=C(C=C1)O)N	{1: 1, 2: 7, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	18733-57-8	CCCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 19, 17: 3}
Did not match all atoms present	1874-14-2	CC(=O)OC(/C=C/C1=CC=C(O1)[N+](=O)[O-])OC(=O)C	{1: 2, 3: 1, 38: 1, 6: 2, 14: 2, 23: 1, 28: 2}
Did not match all atoms present	1874-22-2	C1=C(OC(=C1)[N+](=O)[O-])/C=C/C=O	{26: 1, 38: 1, 14: 2, 6: 2, 23: 1}
Did not match all atoms present	1874-23-3	COC(=O)C1=CC=C(O1)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	1874-58-4	C1=CC=C(C=C1)CSC2=NC(=NC3=C2NC=N3)N	{32: 1, 2: 1, 35: 3, 40: 1, 14: 6, 30: 1}
Did not match all atoms present	18740-59-5	C1=CC=C(C=C1)C[Si](CC2=CC=CC=C2)(CC3=CC=CC=C3)Cl	{17: 1, 2: 3, 14: 15}
Did not match all atoms present	18748-27-1	CC(C)COS(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	18748-91-9	CCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 16, 28: 1}
Did not match all atoms present	18748-98-6	CCCCCCCCCCCCCCCCCCO[Si](C)(C)C	{1: 4, 2: 17, 22: 1}
Did not match all atoms present	1875-48-5	C1=CC=C2C(=C1)C(=O)N(C2=O)N	{25: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	1875-88-3	C1=CC(=CC=C1CCO)Cl	{17: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	1875-89-4	CC1=CC(=CC=C1)CCO	{1: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	1875-92-9	C[NH+](C)CC1=CC=CC=C1.[Cl-]	{1: 2, 2: 1, 14: 5, 17: 1}
Did not match all atoms present	18753-19-0	C[Si](C)(C1=CC=CC2=CC=CC=C21)C3=CC=CC4=CC=CC=C43	{1: 2, 14: 14}
Did not match all atoms present	18755-36-7	CCOP(=O)(C)OC	{1: 3, 2: 1, 29: 1, 22: 2}
Did not match all atoms present	18755-43-6	CCCP(=O)(OC)OC	{1: 3, 2: 2, 29: 1, 22: 2}
Did not match all atoms present	18756-42-8	CC1=NN(C(=O)[C-]1N=NC2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)SS(=O)(=O)O.[Na+].[Cr]	{1: 1, 34: 2, 35: 1, 33: 1, 40: 1, 14: 8, 20: 1, 25: 1, 27: 1, 29: 2}
Did not match all atoms present	18756-44-0	CC1=NN(C(=O)[C-]1N=NC2=C(C=CC(=C2)S(=O)(=O)C)O)C3=CC=C(C=C3)OS(=O)(=S)O.[Na+].[Cr]	{1: 2, 34: 2, 35: 1, 33: 1, 14: 7, 20: 1, 21: 1, 22: 1, 25: 1, 29: 3}
Did not match all atoms present	187585-11-1	COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)N)N	{1: 1, 14: 7, 22: 1, 23: 1, 25: 1, 30: 2}
Did not match all atoms present	187585-43-9	COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 7, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	18760-80-0	C[C@H]([C@H](C1=CC=CC=C1)O)N(C)C.Cl	{1: 3, 3: 2, 33: 1, 14: 5, 17: 1, 20: 1}
Did not match all atoms present	18765-09-8	CCCCCCCC[Si](CCCCCCCC)CCCCCCCC	{1: 3, 2: 21}
Did not match all atoms present	18766-38-6	C[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 22, 23: 11}
Did not match all atoms present	187674-70-0	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC4=NC(=NC(=N4)SCCCS(=O)(=O)[O-])SCCCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 6, 35: 3, 40: 2, 34: 2, 14: 7, 22: 1, 29: 12, 31: 1}
Did not match all atoms present	18768-59-7	CCO[Si](OCC)(OCC)O[Si](OCC)(OCC)O[Si](OCC)(OCC)O[Si](OCC)(OCC)O[Si](OCC)(OCC)O[Si](OCC)(OCC)OCC	{1: 14, 2: 14, 22: 19}
Did not match all atoms present	1877-24-3	CCC(C(=O)OC1=C(C=CC=C1C)C)[NH+](CC)CC.[Cl-]	{1: 5, 2: 3, 3: 1, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	1877-53-8	CCCC(=O)O[C@@H]1[C@H]2COC(=O)[C@@H]2[C@@H](C3=CC4=C(C=C13)OCO4)C5=CC(=C(C(=C5)OC)O)OC	{1: 3, 2: 2, 11: 2, 12: 4, 14: 4, 21: 1, 22: 2, 23: 2, 28: 2}
Did not match all atoms present	1877-72-1	C1=CC(=CC(=C1)C(=O)O)C#N	{27: 1, 37: 1, 14: 4}
Did not match all atoms present	1877-73-2	C1=CC(=CC(=C1)[N+](=O)[O-])CC(=O)O	{2: 1, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	1877-75-4	COC1=CC=C(C=C1)OCC(=O)O	{1: 1, 2: 1, 27: 1, 22: 2, 14: 4}
Did not match all atoms present	1877-77-6	C1=CC(=CC(=C1)N)CO	{2: 1, 20: 1, 30: 1, 14: 4}
Did not match all atoms present	18770-76-8	CCCOC(=O)C(=CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC)C	{1: 3, 2: 2, 6: 2, 7: 1, 34: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	18771-85-2	C1=CC2=[N+](ON=C2C(=C1)[N+](=O)[O-])[O-]	{33: 1, 35: 1, 38: 1, 14: 3, 23: 1}
Did not match all atoms present	18772-36-6	C[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 20, 23: 10}
Did not match all atoms present	18773-38-1	C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)O	{17: 1, 21: 1, 14: 8}
Did not match all atoms present	18773-77-8	CN(C#N)C1=CC=CC=C1	{1: 1, 37: 1, 14: 5, 33: 1}
Did not match all atoms present	18775-06-9	CCN(CC)C(=S)C1=CC=CC=C1	{1: 2, 2: 2, 33: 1, 14: 5, 7: 1}
Did not match all atoms present	18777-54-3	CCCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)O	{1: 2, 2: 9, 3: 1, 14: 4, 20: 1, 29: 2}
Did not match all atoms present	18779-07-2	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Dy+3]	{24: 3, 1: 3}
Did not match all atoms present	1878-49-5	CC1=CC=CC=C1OCC(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	1878-65-5	C1=CC(=CC(=C1)Cl)CC(=O)O	{17: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	1878-66-6	C1=CC(=CC=C1CC(=O)O)Cl	{17: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	1878-67-7	C1=CC(=CC(=C1)Br)CC(=O)O	{2: 1, 27: 1, 18: 1, 14: 4}
Did not match all atoms present	1878-68-8	C1=CC(=CC=C1CC(=O)O)Br	{2: 1, 27: 1, 18: 1, 14: 4}
Did not match all atoms present	1878-82-6	C1=CC(=CC=C1C#N)OCC(=O)O	{2: 1, 27: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	1878-84-8	C1=CC(=CC=C1O)OCC(=O)O	{27: 1, 2: 1, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	1878-85-9	COC1=CC=CC=C1OCC(=O)O	{1: 1, 2: 1, 27: 1, 22: 2, 14: 4}
Did not match all atoms present	1878-87-1	C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)O	{38: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	1878-91-7	C1=CC(=CC=C1OCC(=O)O)Br	{27: 1, 2: 1, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	1878-94-0	C1=CC(=CC=C1OCC(=O)O)I	{27: 1, 2: 1, 19: 1, 22: 1, 14: 4}
Did not match all atoms present	18780-67-1	CCOC(=O)OC1=C(C=C(C=C1OC)C(=O)O)OC	{1: 3, 2: 1, 27: 1, 22: 2, 14: 2}
Did not match all atoms present	18781-31-2	CC1=C(SC2=CC=CC=C12)C(=O)C	{24: 1, 1: 2, 14: 4, 41: 1}
Did not match all atoms present	18781-42-5	CC1=CC2=C(S1)C=C(C=C2)C(=O)OC	{1: 2, 28: 1, 14: 4, 41: 1}
Did not match all atoms present	18786-24-8	C[C@H]1[C@H]2C[N+]3=C(C[C@@H]2C(=CO1)C(=O)OC)C4=C(C=C3)C5=CC=CC=C5N4	{32: 1, 1: 2, 33: 1, 11: 2, 12: 3, 14: 7, 15: 1, 23: 1, 28: 1}
Did not match all atoms present	18787-40-1	CCCCCCCCC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl	{1: 1, 2: 9, 33: 1, 11: 5, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	1879-09-0	CC1=CC(=C(C(=C1)C(C)(C)C)O)C	{1: 5, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	1879-16-9	COC1=CC=C(C=C1)SC	{40: 1, 1: 2, 22: 1, 14: 4}
Did not match all atoms present	1879-58-9	C1=CC(=CC(=C1)OCC(=O)O)C#N	{2: 1, 27: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	18790-57-3	CC(=CC1=C(C=CC(=C1)OC)OC)[N+](=O)[O-]	{1: 3, 6: 1, 38: 1, 7: 1, 14: 3, 22: 2}
Did not match all atoms present	18790-97-1	C1=CC(=CC=C1N)OCCOCCOCCO	{2: 6, 30: 1, 20: 1, 22: 3, 14: 4}
Did not match all atoms present	18791-21-4	CC/C(=C\1/C(=O)O[C@@H]([C@@H](C(=O)N[C@H]([C@@H]([C@H](C(=O)O1)C)O)CC2=CN=CC=C2)NC(=O)C3=C(C=CC=N3)O)C)/C	{32: 1, 1: 4, 2: 2, 35: 2, 7: 1, 12: 5, 14: 7, 15: 1, 20: 1, 21: 1, 24: 1, 25: 1, 28: 2, 31: 1}
Did not match all atoms present	18791-75-8	C1=C(SC=C1Br)C=O	{41: 1, 18: 1, 26: 1, 14: 2}
Did not match all atoms present	18791-98-5	C1=CSC(=C1Br)C#N	{41: 1, 18: 1, 37: 1, 14: 2}
Did not match all atoms present	18794-33-7	CSC1=CN=CC=C1	{40: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	18794-77-9	CCCCCCC1=CC=CS1	{1: 1, 2: 5, 14: 3, 41: 1}
Did not match all atoms present	18794-78-0	CCCCCCCC1=CC=CS1	{1: 1, 2: 6, 14: 3, 41: 1}
Did not match all atoms present	18795-58-9	CCCCOP(=O)(OCCCC)OC=C(Cl)Cl	{1: 2, 2: 6, 6: 1, 7: 1, 17: 2, 22: 3, 29: 1}
Did not match all atoms present	18796-01-5	CC1(C(=[N+](C(N1O)(C)C)[O-])C2=CC=CC=C2)C	{1: 4, 33: 2, 13: 2, 14: 5, 15: 1, 20: 1, 29: 1}
Did not match all atoms present	18799-75-2	C(F)(F)(F)SPSC(F)(F)F	{16: 6, 40: 2, 4: 2}
Did not match all atoms present	188-00-1	C1=CC=C2C(=C1)C3=C4C(=CC=C3)C5=C6C(=CC=C5)C7=CC=CC8=C7C9=C(C=C2C4=C69)C1=CC=CC=C81	{14: 18}
Did not match all atoms present	188-11-4	C1=CC2=C3C(=C1)C4=C5C6=C(C=CC(=C36)C=C2)C7=C8C5=C(C=C4)C9=CC=CC1=C9C8=C(C=C1)C=C7	{14: 16}
Did not match all atoms present	188-42-1	C1=CC=C2C3=C4C(=CC2=C1)C=C5C=CC6=C7C5=C4C(=CC7=CC8=CC=CC=C68)C=C3	{14: 16}
Did not match all atoms present	188-52-3	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)C=CC5=CC=CC=C54	{14: 14}
Did not match all atoms present	188-72-7	C1=CC2=C3C(=C1)C4=C5C(=CC=C6C5=C(C=C4)C7=CC=CC8=C7C6=CC=C8)C3=CC=C2	{14: 16}
Did not match all atoms present	188-84-1	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=C6C=CC7=CC8=CC=CC=C8C9=C7C6=C5C=C9)C=C3	{14: 18}
Did not match all atoms present	188-89-6	C1=CC2=C3C(=C1)C=C4C5=CC=CC6=C5C(=CC=C6)C7=C4C3=C(C=C2)C=C7	{14: 14}
Did not match all atoms present	188-96-5	C1=CC2=C3C(=C1)C=CC4=C3C(=C5C=CC6=C7C5=C4C=CC7=CC=C6)C=C2	{14: 14}
Did not match all atoms present	18800-51-6	CC1=C(C(=CC=C1)S)C	{1: 2, 14: 3, 39: 1}
Did not match all atoms present	18800-53-8	CC1=C(C=C(C=C1)S)C	{1: 2, 14: 3, 39: 1}
Did not match all atoms present	18801-00-8	CC(C)(C)C1=CC2=CC3=CC=CC=C3C=C2C=C1	{1: 3, 4: 1, 14: 9}
Did not match all atoms present	18801-63-3	CC1=C(C(=C(C(=C1C)[N+](=O)[O-])[N+](=O)[O-])C)C	{1: 4, 38: 2}
Did not match all atoms present	18803-19-5	C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O	{24: 1, 38: 1, 21: 1, 14: 8}
Did not match all atoms present	1881-37-4	CC12CCC3C(C1CC[C@@H]2O)CCC4=C3C=CC(=C4F)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 2, 16: 1, 20: 1, 21: 1}
Did not match all atoms present	1881-75-0	CC1=C2C=C(C=CC2=CC3=C1C=CC4=CC=CC=C43)F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	1881-76-1	CC1=C2C=CC(=CC2=CC3=C1C=CC4=CC=CC=C43)F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	18810-58-7	[N-]=[N+]=[N-].[N-]=[N+]=[N-].[Ba+2]	{34: 2}
Did not match all atoms present	18811-70-6	C1=CC=C(C=C1)NC(=O)NC2=CC3=NNN=C3C=C2	{24: 1, 32: 1, 35: 2, 14: 8, 31: 2}
Did not match all atoms present	18812-51-6	CCCP(=O)(OCC)OCC	{1: 3, 2: 4, 29: 1, 22: 2}
Did not match all atoms present	18816-28-9	CCCCCCCCCCCCCCCCCCO[Si](OCCCCCCCCCCCCCCCCCC)(OCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCC	{1: 4, 2: 68, 22: 4}
Did not match all atoms present	18819-45-9	C1=COC(=C1)C(=CC2=CC=C(O2)[N+](=O)[O-])C(=O)N	{38: 1, 6: 1, 7: 1, 14: 5, 23: 2, 24: 1, 30: 1}
Did not match all atoms present	1882-26-4	CNC(=O)OCC1=NC(=CC=C1)COC(=O)NC	{1: 2, 2: 2, 35: 1, 14: 3, 28: 2, 31: 2}
Did not match all atoms present	1882-69-5	COC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O	{38: 1, 1: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	18820-29-6	S=[Mn]	{}
Did not match all atoms present	18820-56-9	F[Pt]F	{16: 2}
Did not match all atoms present	18820-63-8	N#SF	{16: 1, 40: 1}
Did not match all atoms present	18820-87-6	C1=CC=NC(=C1)C2=CC=CC=N2.Cl.Cl	{17: 2, 35: 2, 14: 8}
Did not match all atoms present	18826-29-4	C1=CC=C(C=C1)C#CC2=C3C=CC=CC3=C(C4=CC5=CC=CC=C5C=C42)C#CC6=CC=CC=C6	{10: 4, 14: 20}
Did not match all atoms present	18826-61-4	CC1=CC(=CC=C1)CC(=O)C	{24: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	18826-62-5	CC#CC1=CC(=CC=C1)C	{1: 2, 10: 2, 14: 4}
Did not match all atoms present	188264-84-8	CC(C)(C)C1=CC(=C(C(=C1)C=N[C@H]2CCCC[C@@H]2N=CC3=CC(=CC(=C3[O-])C(C)(C)C)C(C)(C)C)[O-])C(C)(C)C.[Co+2]	{1: 12, 34: 2, 4: 4, 6: 2, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	1883-32-5	C1=CC=C(C=C1)C(CO)C2=CC=CC=C2	{2: 1, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	1883-75-6	C1=C(OC(=C1)CO)CO	{2: 2, 20: 2, 14: 2, 23: 1}
Did not match all atoms present	1883-78-9	CC(C)SCC1=CC=CO1	{1: 2, 2: 1, 3: 1, 40: 1, 14: 3, 23: 1}
Did not match all atoms present	18835-47-7	CC1=C(C(=CC=C1)C)N(C)C(=O)C	{24: 1, 1: 4, 14: 3, 33: 1}
Did not match all atoms present	18838-38-5	CN(CC(=O)O)/C(=N/P(=O)([O-])[O-])/N.[K+].[K+]	{1: 1, 2: 1, 33: 1, 7: 1, 34: 1, 27: 1, 29: 3, 30: 1}
Did not match all atoms present	18839-90-2	CC/C(=C(/CC)\C1=CC=C(C=C1)OC)/C2=CC=C(C=C2)O	{1: 3, 2: 2, 7: 2, 14: 8, 21: 1, 22: 1}
Did not match all atoms present	18841-76-4	C1=CC=C(C=C1)NN=C[C@@H]([C@H]([C@H]([C@@H](CO)O)O)O)O	{2: 1, 3: 4, 6: 1, 34: 1, 14: 5, 20: 5, 31: 1}
Did not match all atoms present	188432-91-9	C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O.C1=CC(=CC=C1C2=CC=C(C=C2)Br)Br	{18: 2, 13: 1, 14: 24, 21: 2}
Did not match all atoms present	18846-91-8	COC1=CC=CC=C1N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4	{1: 1, 34: 1, 14: 14, 15: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	18848-96-9	C[Si](C)(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)[Si](C)(C)C)C3=CC=C(C=C3)[Si](C)(C)C	{1: 9, 14: 12}
Did not match all atoms present	1885-07-0	C1=CC(=CC=C1[C@H]2[C@@H](O2)CO)[N+](=O)[O-]	{2: 1, 38: 1, 12: 2, 14: 4, 20: 1, 23: 1}
Did not match all atoms present	1885-14-9	C1=CC=C(C=C1)OC(=O)Cl	{17: 1, 28: 1, 14: 5}
Did not match all atoms present	1885-29-6	C1=CC=C(C(=C1)C#N)N	{30: 1, 14: 4, 37: 1}
Did not match all atoms present	1885-35-4	COC1=CC(=CC(=C1OC)OC)C#N	{1: 3, 22: 3, 14: 2, 37: 1}
Did not match all atoms present	1885-38-7	C1=CC=C(C=C1)/C=C/C#N	{14: 5, 6: 2, 37: 1}
Did not match all atoms present	18851-77-9	[N-3]	{}
Did not match all atoms present	18852-54-5	S([GeH3])[GeH3]	{40: 1}
Did not match all atoms present	18853-26-4	COP(=S)(OC)OC1=NOC(=C1)C2=CC=CC=C2	{1: 2, 35: 1, 22: 3, 14: 6, 23: 1}
Did not match all atoms present	18853-32-2	C1=C(C(=CS1)C#N)C#N	{41: 1, 37: 2, 14: 2}
Did not match all atoms present	18853-40-2	C1=C(SC(=C1)C#N)C#N	{41: 1, 37: 2, 14: 2}
Did not match all atoms present	18854-01-8	CCOP(=S)(OCC)OC1=NOC(=C1)C2=CC=CC=C2	{1: 2, 2: 2, 35: 1, 14: 6, 22: 3, 23: 1}
Did not match all atoms present	18855-13-5	C1=CC(=CC(=C1)O)C2=CC=C(C=C2)O	{21: 2, 14: 8}
Did not match all atoms present	18855-52-2	CCOP(=O)(C(N(C)C)P(=O)(OCC)OCC)OCC	{1: 6, 2: 4, 3: 1, 33: 1, 22: 4, 29: 2}
Did not match all atoms present	18856-63-8	CCC1=CC=C(C=C1)N=C=S	{8: 1, 1: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	18857-59-5	C1C(=O)N(C(=O)N1/N=C/C=C\C2=CC=C(O2)[N+](=O)[O-])CO	{33: 2, 2: 1, 38: 1, 6: 3, 11: 1, 34: 1, 14: 2, 20: 1, 23: 1, 25: 2}
Did not match all atoms present	188582-62-9	C1=CC(=C(C=C1Br)F)CO	{16: 1, 2: 1, 20: 1, 18: 1, 14: 3}
Did not match all atoms present	188596-18-1	CCN(CC)CC.C(C(F)(F)S(=O)(=O)NS(=O)(=O)C(C(F)(F)F)(F)F)(F)(F)F	{1: 3, 2: 3, 4: 4, 33: 1, 16: 10, 29: 4, 31: 1}
Did not match all atoms present	1886-26-6	CC(CC1=CC(=CC=C1)C(F)(F)F)N	{1: 1, 2: 1, 3: 1, 4: 1, 14: 4, 16: 3, 30: 1}
Did not match all atoms present	1886-45-9	CN(C)CCCC1C2=CC=CC=C2CSC3=CC=CC=C13	{1: 2, 2: 3, 33: 1, 41: 1, 11: 1, 12: 1, 14: 8}
Did not match all atoms present	1886-57-3	CC(C)(C)C1=CC=CC=C1[N+](=O)[O-]	{1: 3, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	1886-75-5	CC(C)(C)S(=O)(=O)C(C)(C)C	{1: 6, 4: 2, 29: 2}
Did not match all atoms present	18864-76-1	CC(C)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 2, 3: 1, 14: 9}
Did not match all atoms present	18865-46-8	CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C(=C(C5=N4)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)C7CC(CN7C(=O)C(NC6=O)C(C)C)O)C)C)C(C)C)C)N)C	{32: 2, 1: 16, 3: 4, 33: 6, 11: 7, 12: 11, 14: 2, 35: 1, 20: 1, 23: 1, 24: 2, 25: 9, 28: 2, 30: 1, 31: 2}
Did not match all atoms present	18865-48-0	CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C(=C(C5=N4)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)C7CC(=O)CN7C(=O)C(NC6=O)C(C)C)C)C)C(C)C)C)N)C	{32: 2, 1: 16, 3: 4, 33: 6, 11: 7, 12: 10, 14: 2, 35: 1, 23: 1, 24: 2, 25: 10, 28: 2, 30: 1, 31: 2}
Did not match all atoms present	18865-75-3	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Th+4]	{16: 24, 24: 4, 4: 8, 6: 4, 7: 4}
Did not match all atoms present	18868-43-4	O=[Mo]=O	{29: 2}
Did not match all atoms present	18868-46-7	C(C(Cl)(Cl)Cl)OP(=O)(Cl)Cl	{17: 5, 2: 1, 4: 1, 29: 1, 22: 1}
Did not match all atoms present	18868-66-1	CCC1=C2C(=CC3=CC=CC=C31)C=CC4=CC=CC=C42	{1: 1, 2: 1, 14: 11}
Did not match all atoms present	18869-29-9	CC1=CC=C(C=C1)C=CC2=CC=C(C=C2)C	{1: 2, 14: 8, 6: 2}
Did not match all atoms present	18869-73-3	CC(=O)N1C2=CC=CC=C2C(C1=O)(C3=CC=C(C=C3)OC(=O)C)C4=CC=C(C=C4)OC(=O)C	{1: 3, 33: 1, 13: 1, 14: 12, 24: 1, 25: 1, 28: 2}
Did not match all atoms present	1887-02-1	C1(=C(C(=O)C(=C(C1=O)O)[O-])[O-])O.[Na+].[Na+]	{25: 2, 20: 2, 15: 4}
Did not match all atoms present	1887-29-2	C1=CC=C(C=C1)S(=O)(=S)[O-].[Na+]	{29: 2, 14: 5}
Did not match all atoms present	188738-71-8	CC1=CC2=CC=CC=C2S1=O	{1: 1, 29: 1, 14: 5, 15: 1}
Did not match all atoms present	18877-96-8	C1=CC=C(C=C1)COC(=O)NCCC#N	{2: 3, 28: 1, 37: 1, 14: 5, 31: 1}
Did not match all atoms present	18879-05-5	C1CCOC1.O	{11: 4, 23: 1}
Did not match all atoms present	18879-06-6	CC(=O)C.O	{24: 1, 1: 2}
Did not match all atoms present	1888-75-1	[Li+].C[CH-]C	{1: 2, 6: 1}
Did not match all atoms present	1888-87-5	CC(C)C[Al](Cl)Cl	{1: 2, 2: 1, 3: 1, 17: 2}
Did not match all atoms present	18880-00-7	CC(C)(C)C1=CC=C(C=C1)CBr	{1: 3, 2: 1, 4: 1, 18: 1, 14: 4}
Did not match all atoms present	18880-04-1	C1=CC(=C(C=C1CBr)Cl)Cl	{17: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	188815-30-7	C1=C(C=C(C=C1C(F)(F)F)F)C=O	{16: 4, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	18886-16-3	C1=CC=C(C(=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 35: 3, 14: 8, 15: 2, 17: 2, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	18886-42-5	CCC(=O)OC(CC)(C1CCN(C1)C)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O	{1: 3, 2: 2, 4: 1, 6: 2, 33: 1, 11: 3, 12: 1, 14: 5, 27: 2, 28: 1}
Did not match all atoms present	18888-98-7	C1=CC=C(C=C1)NC2=C(C=C(C=C2)OC3=CC(=C(C=C3)NC4=CC=CC=C4)N)N	{30: 2, 22: 1, 14: 16, 31: 2}
Did not match all atoms present	1889-59-4	CCS(=O)(=O)C=C	{1: 1, 2: 1, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	1889-67-4	CC(C)(C1=CC=CC=C1)C(C)(C)C2=CC=CC=C2	{1: 4, 4: 2, 14: 10}
Did not match all atoms present	18895-06-2	C1=CC2=COC=C2C=CC1=O	{25: 1, 14: 6, 23: 1}
Did not match all atoms present	189-43-5	C1=CC=C2C=C3C4=C5C(=CC3=CC2=C1)C=CC6=CC7=CC8=CC=CC=C8C=C7C(=C65)C=C4	{14: 18}
Did not match all atoms present	189-45-7	C1=CC=C2C=C3C4=C5C(=CC3=CC2=C1)C=CC6=C5C(=CC7=CC8=CC=CC=C8C=C67)C=C4	{14: 18}
Did not match all atoms present	189-55-9	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=CC6=CC=CC=C6C(=C54)C=C3	{14: 14}
Did not match all atoms present	189-58-2	C1=CC=C2C(=C1)C=C3C=CC4=CC5=CC=CC=C5C6=NN=C2C3=C46	{35: 2, 14: 12}
Did not match all atoms present	189-64-0	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC6=CC=CC=C56)C=C3	{14: 14}
Did not match all atoms present	189-92-4	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4N=CC=C5)C=C2	{35: 1, 14: 11}
Did not match all atoms present	189-96-8	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C6C4=C3C=CC6=CC=C5	{14: 14}
Did not match all atoms present	18903-01-0	C1CN(CCN1)CC=CC2=CC=CC=C2	{32: 1, 33: 1, 2: 1, 6: 2, 11: 4, 14: 5}
Did not match all atoms present	18903-54-3	B12CCCCN1CCCC2	{33: 1, 11: 8}
Did not match all atoms present	18904-54-6	CO/C=C(/[C@H]1C[C@H]2C3=C(CCN2C[C@@H]1C=C)C4=CC=CC=C4N3)\C(=O)OC	{32: 1, 1: 2, 5: 1, 6: 2, 7: 1, 11: 4, 12: 3, 14: 4, 22: 1, 33: 1, 28: 1}
Did not match all atoms present	18905-29-8	C1=NC2=C(N1)C(=O)N=C(N2O)N	{32: 1, 33: 1, 35: 2, 14: 1, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	18908-07-1	COC1=CC=CC(=C1)N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	18909-18-7	C1=CC=C(C=C1)C(=C2C=CC(C=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6	{12: 1, 15: 1, 4: 1, 14: 29, 7: 1}
Did not match all atoms present	18909-68-7	[B-](F)(F)(F)F.[Rb+]	{16: 4}
Did not match all atoms present	18909-69-8	[B-](F)(F)(F)F.[Cs+]	{16: 4}
Did not match all atoms present	1891-90-3	C1=CC(=CC=C1C(=O)N)C(F)(F)F	{16: 3, 24: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	1891-95-8	C1=C(C=C(C(=C1Cl)O)Cl)C#N	{17: 2, 21: 1, 14: 2, 37: 1}
Did not match all atoms present	18911-76-7	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Y+3]	{16: 18, 24: 3, 4: 6, 6: 3, 7: 3}
Did not match all atoms present	18912-01-1	C[N+]1=CC=CC2=C1C=C(C=C2)OC(=O)N(C)C.[I-]	{1: 3, 19: 1, 28: 1, 14: 6, 33: 2}
Did not match all atoms present	18917-82-3	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Pb+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	18917-83-4	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Hg+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	18917-91-4	CC(C(=O)[O-])O.CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Al+3]	{24: 3, 1: 3, 3: 3, 20: 3}
Did not match all atoms present	18917-93-6	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Mg+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	18917-95-8	C1=CC=C(C(=C1)C(=O)[O-])[O-].C1=CC=C(C(=C1)C(=O)[O-])[O-].O.O.O.O.[Mg+2]	{24: 2, 14: 8}
Did not match all atoms present	18919-39-6	C[Si](C)(C)OC[C@H]([C@@H]([C@@H]([C@H](CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 18, 2: 2, 3: 4, 22: 6}
Did not match all atoms present	18919-94-3	C[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 24, 23: 12}
Did not match all atoms present	1892-26-8	C(COP(=O)(O)O)O	{2: 2, 20: 3, 29: 1, 22: 1}
Did not match all atoms present	1892-43-9	C1=CC(=CC=C1OCCO)Cl	{17: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	1892-54-2	C1=CC=C2C(=C1)C=CC3=C2C=C(C=C3)N	{30: 1, 14: 9}
Did not match all atoms present	1892-80-4	CC(CC1=CC=CC=C1)NCCN2C=NC3=C2C(=O)N(C(=O)N3C)C.Cl	{1: 3, 2: 3, 3: 1, 33: 3, 14: 6, 17: 1, 35: 1, 25: 2, 31: 1}
Did not match all atoms present	18921-70-5	CC1=C(C=CC2=C1C(=NC(=N2)N)N)CNC3=CC=C(C=C3)C(=O)NC(CC(=O)O)C(=O)O	{1: 1, 2: 2, 3: 1, 14: 6, 35: 2, 24: 1, 27: 2, 30: 2, 31: 2}
Did not match all atoms present	18922-54-8	CC1=CC=C(C=C1)S(=O)(=O)N=S(C(C)C)C(C)C	{1: 5, 34: 1, 3: 2, 29: 2, 14: 4}
Did not match all atoms present	18923-26-7	[Ce+3]	{}
Did not match all atoms present	18923-27-8	[Yb+3]	{}
Did not match all atoms present	18924-91-9	CCC1CN1C2=NC(=NC(=N2)N3CC3CC)N4CC4CC	{1: 3, 2: 3, 35: 3, 33: 3, 11: 3, 12: 3}
Did not match all atoms present	18925-69-4	CN(C)C(=O)CC1=CC=CC=C1	{24: 1, 1: 2, 2: 1, 14: 5, 33: 1}
Did not match all atoms present	18927-05-4	COC1=CC=CC(=C1)CC(=O)OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	18928-76-2	C(C[Si](CCO)(CCO)CCO)O	{2: 8, 20: 4}
Did not match all atoms present	1893-33-0	C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N	{33: 2, 2: 3, 11: 9, 13: 1, 14: 4, 16: 1, 24: 2, 30: 1}
Did not match all atoms present	1893-52-3	CCN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 6, 5: 1, 6: 1, 33: 1, 16: 13, 28: 1, 29: 2}
Did not match all atoms present	18930-98-8	C1CC2=C(C=C1)C3=C(C=C2)C4=CC=CC=C4C=C3	{11: 2, 14: 10}
Did not match all atoms present	18931-77-6	CC1=CC(=C(C=C1)NC=O)Cl	{1: 1, 26: 1, 31: 1, 14: 3, 17: 1}
Did not match all atoms present	18931-82-3	CC1=CC(=C(C=C1)Cl)NC=O	{1: 1, 26: 1, 31: 1, 14: 3, 17: 1}
Did not match all atoms present	18933-05-6	O.O.[Mn]	{}
Did not match all atoms present	18933-33-0	C[N+](C)(C)CC(CC#N)O.[Cl-]	{1: 3, 2: 2, 3: 1, 37: 1, 17: 1, 20: 1}
Did not match all atoms present	18936-66-8	CCOP(=S)(C1=CC=CC=C1)OC2=CC(=C(C=C2Cl)Br)Cl	{1: 1, 2: 1, 14: 7, 17: 2, 18: 1, 22: 2}
Did not match all atoms present	18936-75-9	C1=CC=C2C(=C1)C=CC3=C2C=C4C=C(C=CC4=N3)N	{35: 1, 30: 1, 14: 10}
Did not match all atoms present	18936-78-2	CC1=CC=CC2=C(C3=C(C4=CC=CC=C4C=C3)N=C12)C=O	{1: 1, 26: 1, 35: 1, 14: 9}
Did not match all atoms present	18938-24-4	C[Si](C)(C)C=C([Si](C)(C)C)[Si](C)(C)C	{1: 9, 6: 1, 7: 1}
Did not match all atoms present	18939-61-2	OS(=O)(=O)O.[Cu]	{20: 2, 29: 2}
Did not match all atoms present	18942-46-6	CC(C)(C)OC(=O)N[C@@H](CSCC1=CC=C(C=C1)OC)C(=O)O	{1: 4, 2: 2, 3: 1, 4: 1, 40: 1, 14: 4, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	18942-49-9	CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	189450-92-8	[Fe+6].[OH-].[OH-].[OH-].[OH-]	{}
Did not match all atoms present	18946-64-0	[F-].[Lu+3]	{16: 1}
Did not match all atoms present	1895-39-2	C(=O)(C(F)(F)Cl)[O-].[Na+]	{16: 2, 17: 1, 4: 1, 24: 1}
Did not match all atoms present	1895-98-3	C1=CC=C(C=C1)C=CC2=C3C=CC=CC3=CC4=CC=CC=C42	{14: 14, 6: 2}
Did not match all atoms present	18956-87-1	C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)Cl	{24: 1, 17: 1, 41: 1, 14: 8, 33: 1}
Did not match all atoms present	18957-53-4	CCCN1C(=CC(NC1=S)(C)C)C	{32: 1, 1: 4, 2: 2, 33: 1, 13: 1, 14: 1, 15: 2}
Did not match all atoms present	18960-54-8	CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.CC(C)(C)C(=O)CC(=O)C(C)(C)C.[Ce]	{24: 8, 1: 24, 2: 4, 4: 8}
Did not match all atoms present	18961-95-0	CC1=CC=C(C=C1)OP(=S)(Cl)Cl	{1: 1, 22: 1, 14: 4, 17: 2}
Did not match all atoms present	18961-96-1	C1=CC=C(C=C1)OP(=S)(Cl)Cl	{17: 2, 22: 1, 14: 5}
Did not match all atoms present	18962-05-5	CC(C)OC1=CC=C(C=C1)C=O	{1: 2, 26: 1, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	189624-85-9	CC1=C(C(C([C@@](N1)(C)C2=CC=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OC)C6=CC(=CC=C6)[N+](=O)[O-])C(=O)OC=C.Cl.Cl	{32: 1, 1: 3, 3: 1, 5: 1, 6: 1, 33: 2, 11: 4, 12: 2, 13: 1, 14: 18, 15: 2, 17: 2, 38: 1, 28: 2}
Did not match all atoms present	18967-27-6	CC(=C)C(=O)OC1=C(C=C(C=C1Cl)Cl)Cl	{1: 1, 5: 1, 7: 1, 14: 2, 17: 3, 28: 1}
Did not match all atoms present	18967-35-6	COC(=O)CCN=C=S	{8: 1, 1: 1, 2: 2, 28: 1, 34: 1}
Did not match all atoms present	18967-41-4	C1=CC(=C(C=C1Cl)Cl)CN=C=S	{8: 1, 17: 2, 2: 1, 34: 1, 14: 3}
Did not match all atoms present	18967-44-7	C1=CC=C(C(=C1)CN=C=S)Cl	{8: 1, 17: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	18968-99-5	C1=CC=C(C=C1)C2C(=O)N=C(O2)N.[OH-].[OH-].[Mg+2]	{35: 1, 12: 1, 14: 5, 15: 1, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	18969-93-2	CN1C=NC2=C3C1=CC=C4C3=C(CC4)C=C2	{1: 1, 11: 2, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	1897-45-6	C(#N)C1=C(C(=C(C(=C1Cl)Cl)Cl)C#N)Cl	{17: 4, 37: 2}
Did not match all atoms present	1897-52-5	C1=CC(=C(C(=C1)F)C#N)F	{16: 2, 37: 1, 14: 3}
Did not match all atoms present	1897-96-7	CCOC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C	{1: 2, 2: 1, 35: 1, 33: 1, 14: 8, 22: 1, 25: 1}
Did not match all atoms present	18970-30-4	CC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(C)C	{1: 4, 3: 2, 14: 8}
Did not match all atoms present	18970-44-0	CCc1ccccc1C(C)C	{1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	18971-59-0	CCCCC[N+]#[C-]	{1: 1, 2: 4, 34: 1}
Did not match all atoms present	18972-56-0	O.O.O.O.O.O.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2]	{16: 6, 29: 18}
Did not match all atoms present	18972-69-5	CC(CN)N.CC(CN)N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ni+2].[Au+].[Au+]	{1: 2, 2: 2, 3: 2, 30: 4}
Did not match all atoms present	18973-22-3	[Np+2].[O].[O]	{}
Did not match all atoms present	18973-62-1	[C-]#N.[C-]#N.[Cu+]	{}
Did not match all atoms present	18974-18-0	[C-]#N.[C-]#N.[C-]#N.[C-]#N.C(CN)N.C(CN)N.[Cu+2].[Au+].[Au+]	{2: 4, 30: 4}
Did not match all atoms present	18974-19-1	[C-]#N.[C-]#N.[C-]#N.[C-]#N.C(CN)N.C(CN)N.C(CN)N.[Zn+2].[Au+].[Au+]	{2: 6, 30: 6}
Did not match all atoms present	18974-20-4	[C-]#N.[C-]#N.[C-]#N.[C-]#N.C(CN)N.C(CN)N.[Cd+2].[Au+].[Au+]	{2: 4, 30: 4}
Did not match all atoms present	18978-78-4	CC1=NC2=C(C=CC=C2N)C=C1	{1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	18979-50-5	CCCOC1=CC=C(C=C1)O	{1: 1, 2: 2, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	18979-53-8	CCCCCOC1=CC=C(C=C1)O	{1: 1, 2: 4, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	18979-55-0	CCCCCCOC1=CC=C(C=C1)O	{1: 1, 2: 5, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	18979-60-7	CCCC1=C(C=C(C=C1)O)O	{1: 1, 2: 2, 21: 2, 14: 3}
Did not match all atoms present	18979-62-9	CC(C)CC1=C(C=C(C=C1)O)O	{1: 2, 2: 1, 3: 1, 21: 2, 14: 3}
Did not match all atoms present	18979-72-1	CCCCOC1=CC=CC(=C1)O	{1: 1, 2: 3, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	18979-94-7	CCCCCCC1=C(C=CC(=C1)Cl)O	{1: 1, 2: 5, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	18980-00-2	CCC1=CC(=C(C=C1)O)Cl	{1: 1, 2: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	189807-20-3	C1=CC(=C(C(=C1F)C(=O)Cl)F)F	{16: 3, 17: 1, 14: 2, 24: 1}
Did not match all atoms present	189807-21-4	C1=CC(=C(C=C1F)C(F)(F)F)C(=O)Cl	{16: 4, 17: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	18982-54-2	C1=CC=C(C(=C1)CO)Br	{2: 1, 20: 1, 18: 1, 14: 4}
Did not match all atoms present	18984-16-2	C1=CC(=C(C=C1C=C[N+](=O)[O-])Cl)Cl	{17: 2, 38: 1, 14: 3, 6: 2}
Did not match all atoms present	18984-80-0	CC[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](C3=C4C=C(C=CC4=NC=C3)OCCC(C)C)O.Cl.Cl	{1: 3, 2: 3, 3: 2, 33: 1, 11: 4, 12: 3, 14: 5, 17: 2, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	18987-38-7	C[Se+](C)C.[Cl-]	{1: 3, 17: 1}
Did not match all atoms present	18987-59-2	CN(C)CC1=CC=CC=[C-]1.CN(C)CC1=CC=CC=[C-]1.Cl[Pd+].Cl[Pd+]	{1: 4, 2: 2, 33: 2, 14: 8, 17: 2}
Did not match all atoms present	1899-02-1	C[N+](C)(C)C1=CC=CC=C1.[OH-]	{1: 3, 14: 5}
Did not match all atoms present	1899-24-7	C1=C(OC(=C1)Br)C=O	{18: 1, 26: 1, 14: 2, 23: 1}
Did not match all atoms present	1899-74-7	C[Si](C)(C)CC1=CC=CC=C1[Si](C)(C)C	{1: 6, 2: 1, 14: 4}
Did not match all atoms present	18990-42-6	C(=C(/O)\C(F)(F)F)\C(=O)C(F)(F)F.C(=C(/O)\C(F)(F)F)\C(=O)C(F)(F)F.C(=C(/O)\C(F)(F)F)\C(=O)C(F)(F)F.[Sc]	{4: 6, 6: 3, 7: 3, 16: 18, 20: 3, 24: 3}
Did not match all atoms present	18992-80-8	CC(=O)C1=CC(=CC=C1)N(C)C	{24: 1, 1: 3, 14: 4, 33: 1}
Did not match all atoms present	18992-85-3	COC1=CC2=C(C=C1)NC3=CC=CC=C32	{32: 1, 1: 1, 22: 1, 14: 7}
Did not match all atoms present	18993-50-5	CCCCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 6}
Did not match all atoms present	18993-53-8	CCCCCCCCCCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 12}
Did not match all atoms present	18995-35-2	CC(C)(C)OC1=CC=C(C=C1)Cl	{1: 3, 4: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	18996-35-5	C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.[Na+]	{24: 1, 20: 1, 2: 2, 27: 2, 4: 1}
Did not match all atoms present	18997-57-4	CC1=CC(=O)OC2=C1C=CC(=C2)OC3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O	{1: 1, 2: 1, 12: 5, 14: 4, 20: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	18997-62-1	CC1=C(C(=CC=C1)N=NC2=CC=C(C=C2)N(C)C)C	{1: 4, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	190-03-4	C1=CC=C2C(=C1)C=CC3=CC4=C(C5=C6C(=C4)C=CC7=C6C(=CC=C7)C=C5)N=C32	{35: 1, 14: 15}
Did not match all atoms present	190-05-6	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C5C=CC6=C7C5=C4C=CC7=CC=C6)C=C32	{14: 16}
Did not match all atoms present	190-07-8	C1=CC=C2C(=C1)C=CC3=C2C=C4C=C5C=CC6=C7C5=C(C4=N3)C=CC7=CC=C6	{35: 1, 14: 15}
Did not match all atoms present	190-23-8	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C5C6=CC=CC=C6C7=CC=CC=C7C5=C8C9=CC=CC=C9C1=CC=CC=C1C8=C24	{14: 24}
Did not match all atoms present	190-24-9	C1=CC2=C3C=CC=C4C3=C5C6=C2C(=C1)C7=C8C6=C9C1=C(C8=CC=C7)C=CC=C1C1=CC=CC2=C1C9=C5C1=C4C=CC=C21	{14: 18}
Did not match all atoms present	190-26-1	C1=CC2=C3C4=C1C=CC5=CC6=C7C8=C(C=CC9=C8C1=C(C=C9)C=C(C3=C1C7=C54)C=C2)C=C6	{14: 14}
Did not match all atoms present	190-31-8	C1=CC2=CC3=C4C5=C(C=CC6=C5C7=C(C=C6)C=C8C=CC=C9C8=C7C4=C2C9=C1)C=C3	{14: 14}
Did not match all atoms present	190-36-3	C1=CC=C2C(=C1)C=C3C=CC=C4C3=C2C5=C6C4=CC=CC6=CC7=CC=CC=C75	{14: 16}
Did not match all atoms present	190-39-6	C1=CC2=CC3=C4C(=CC=C3)C5=CC=CC6=C5C7=C8C(=C6)C=CC=C8C(=C1)C2=C47	{14: 14}
Did not match all atoms present	190-47-6	C1=CC2=C3C(=C1)C4=C5C6=C(C=C4)C=C7C=CC8=C9C7=C6C1=C(C9=CC=C8)C=CC4=C1C5=C3C(=C4)C=C2	{14: 16}
Did not match all atoms present	190-55-6	C1=CC2=CC3=C4C5=C(C=C3)C=C6C=CC=C7C6=C5C8=C9C4=C2C(=C1)C=C9C=CC8=C7	{14: 14}
Did not match all atoms present	190-66-9	C1=CC=C2C3=C4C5=C(C2=C1)C=CC6=C5C7=C(C=C6)C=CC8=C7C4=C(C=C3)C9=CC=CC=C89	{14: 16}
Did not match all atoms present	190-70-5	C1=CC=C2C3=C4C5=C(C=CC6=C5C7=C(C=C6)C=CC8=C7C4=C(C2=C1)C=C8)C=C3	{14: 14}
Did not match all atoms present	190-71-6	C1=CC2=C3C(=C1)C4=C5C6=C(C=CC7=C6C(=CC=C7)C8=C5C3=C(C=C2)C=C8)C=C4	{14: 14}
Did not match all atoms present	190-72-7	C1=CC=C2C3=C4C5=C(C=C3)C=CC6=C5C7=C(C=CC8=C7C4=C(C2=C1)C=C8)C9=CC=CC=C69	{14: 16}
Did not match all atoms present	190-74-9	C1=CC=C2C=C3C4=C5C6=C(C=CC7=C6C8=C(C=C7)C=CC9=C8C5=C(C3=CC2=C1)C=C9)C=C4	{14: 16}
Did not match all atoms present	190-81-8	C1=CC=C2C3=C4C5=C(C2=C1)C=CC=C5C6=CC=CC7=C6C4=C(C=C3)C8=CC=CC=C78	{14: 16}
Did not match all atoms present	190-84-1	C1=CC=C2C3=C4C5=C(C=CC=C5C6=CC=CC7=C6C4=C(C2=C1)C=C7)C=C3	{14: 14}
Did not match all atoms present	190-85-2	C1=CC=C2C=C3C4=C5C6=C(C=CC=C6C7=CC=CC8=C7C5=C(C3=CC2=C1)C=C8)C=C4	{14: 16}
Did not match all atoms present	190-87-4	C1=CC=C2C3=C4C(=CC2=C1)C5=CC=CC6=C5C7=C(C=CC(=C47)C=C3)C8=CC=CC=C68	{14: 16}
Did not match all atoms present	190-90-9	CCCCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 8, 2: 5, 22: 2}
Did not match all atoms present	190-93-2	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=C6C=CC7=C8C6=C5C9=CC=CC=C9C8=CC=C7)C=C3	{14: 18}
Did not match all atoms present	190-95-4	C1=CC=C2C3=C4C5=C(C=CC6=C5C(=CC=C6)C7=CC=CC(=C74)C2=C1)C=C3	{14: 14}
Did not match all atoms present	1900-85-2	CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2	{1: 1, 28: 1, 14: 9}
Did not match all atoms present	19003-87-3	C.C.CCC(=CC1=[N+](C2=CC=CC=C2S1)C)C=C3N(C4=CC=CC=C4S3)C.[Br-]	{1: 3, 2: 1, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 18: 1}
Did not match all atoms present	19005-95-9	CC1=C(NC(=C1C(=O)C)C)C	{24: 1, 1: 4, 32: 1}
Did not match all atoms present	19007-91-1	C=CC1=CC=C(C=C1)N2C(=O)C=CC2=O	{25: 2, 14: 6, 5: 1, 6: 1, 33: 1}
Did not match all atoms present	1901-26-4	CC(=CC1=CC=CC=C1)C(=O)C	{24: 1, 1: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	19010-65-2	CCCCCN(CCCCC)C(=S)[S-].CCCCCN(CCCCC)C(=S)[S-].[Cd+2]	{1: 4, 2: 16, 33: 2, 7: 2}
Did not match all atoms present	19010-66-3	CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Pb+2]	{1: 4, 33: 2, 7: 2}
Did not match all atoms present	19010-79-8	C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].[Cd+2]	{27: 2, 14: 8}
Did not match all atoms present	19010-96-9	CCCCCCCCCCCN=C=S	{8: 1, 1: 1, 2: 10, 34: 1}
Did not match all atoms present	19011-77-9	C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F)CCO	{33: 1, 2: 2, 35: 1, 11: 1, 14: 7, 15: 1, 16: 1, 17: 1, 20: 1, 25: 1}
Did not match all atoms present	19013-10-6	CCOC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 21: 1, 28: 1}
Did not match all atoms present	19013-11-7	CC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	190133-94-9	CN1CCC2=CC(=C(C=C2[C@@H]3[C@@H]1CCC4=CC=CC=C34)O)Cl.Cl	{1: 1, 33: 1, 11: 4, 12: 2, 14: 6, 17: 2, 21: 1}
Did not match all atoms present	19014-05-2	CCCCCCCCCCCCC1=CC=C(C=C1)C[N+](C)(C)C.[Cl-]	{1: 4, 2: 12, 14: 4, 17: 1}
Did not match all atoms present	19015-11-3	COC1=CC=C(C=C1)NC(=S)NN/C=C\2/C=CC=N2	{1: 1, 35: 1, 6: 1, 7: 1, 14: 7, 15: 1, 22: 1, 31: 3}
Did not match all atoms present	19016-67-2	C1=CC=C(C=C1)C(=CC2=CC=CC=C2[N+](=O)[O-])C#N	{37: 1, 38: 1, 14: 9, 6: 1, 7: 1}
Did not match all atoms present	19019-10-4	CC1(C2=CC=CC=C2SC3=CC=CC=C31)C	{1: 2, 13: 1, 14: 8, 41: 1}
Did not match all atoms present	19020-26-9	CCC1=CC=NC2=CC=CC=C12	{1: 1, 2: 1, 35: 1, 14: 6}
Did not match all atoms present	19020-81-6	CC1=CC(=CC=C1)N/N=C\2/C=C(C=CC2=O)C	{1: 2, 34: 1, 14: 7, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	19024-50-1	CCOC(=O)C1=CC=C(C=C1)C(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	190280-71-8	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C=C1CC3=CC4=C(C=C3)C=C(C=C4)S(=O)(=O)[O-].C(CO)[NH+](CCO)CCO.C(CO)[NH+](CCO)CCO	{2: 13, 20: 6, 29: 6, 14: 12}
Did not match all atoms present	190319-95-0	CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(S1)Br)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 41: 1, 14: 2, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	19034-13-0	O.O.[O-][Se](=O)[O-].[Co+2]	{29: 3}
Did not match all atoms present	19035-79-1	CCCCCCCCCCCCCCCCOP(=O)(O)[O-].[K+]	{1: 1, 2: 15, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	19037-74-2	CCCCCCCCCCCC[N+](C)(C)CCOCC[N+](C)(C)CCCCCCCCCCCC.[Cl-].[Cl-]	{1: 6, 2: 26, 22: 1, 17: 2}
Did not match all atoms present	19039-44-2	C1=NC2=C(N1)C(=O)N=C(N2O)N.C1=NC2=C(N1)C(=O)N=C(N2O)N.Cl	{32: 2, 33: 2, 35: 4, 14: 2, 17: 1, 21: 2, 25: 2, 30: 2}
Did not match all atoms present	1904-31-0	CN1C=CC(=N1)N	{1: 1, 35: 1, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	1904-58-1	C1=CC=C(C(=C1)C(=O)NN)N	{24: 1, 30: 2, 14: 4, 31: 1}
Did not match all atoms present	1904-98-9	C1=NC2=C(N1)C(=NC(=N2)N)N	{32: 1, 35: 3, 30: 2, 14: 1}
Did not match all atoms present	19040-62-1	CC1=CC(=C(C=C1)C)S(=O)(=O)Cl	{1: 2, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	19042-19-4	CC(C(=O)[O-])O.CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Nd+3]	{24: 3, 1: 3, 3: 3, 20: 3}
Did not match all atoms present	19044-88-3	CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N)[N+](=O)[O-]	{1: 2, 2: 4, 38: 2, 33: 1, 14: 2, 29: 2, 30: 1}
Did not match all atoms present	19045-70-6	C1=CC(=CC=C1NC2=C(C(=NC(=N2)Cl)Cl)Cl)S(=O)(=O)[O-].[Na+]	{17: 3, 35: 2, 29: 3, 14: 4, 31: 1}
Did not match all atoms present	19045-75-1	CCCCCCCCCCCCCCCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 15, 29: 3, 22: 1}
Did not match all atoms present	19045-78-4	CCCCCCCCOP(=O)([O-])OCCCCCCCC.[K+]	{1: 2, 2: 14, 29: 2, 22: 2}
Did not match all atoms present	19045-79-5	CCCCCCCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 7, 29: 3, 22: 1}
Did not match all atoms present	19047-79-1	CCCN(CCC)C(=S)SCCC	{40: 1, 1: 3, 2: 6, 33: 1, 7: 1}
Did not match all atoms present	19047-85-9	CCCCCCCCCCCCCCCCCCO[P+](=O)OCCCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 29: 1, 22: 2}
Did not match all atoms present	19050-48-7	CCCSC1=C(C(=NC(=C1Cl)Cl)Cl)Cl	{40: 1, 1: 1, 2: 2, 35: 1, 17: 4}
Did not match all atoms present	19052-32-5	CCOC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)O)N=N[C-]3C(=NN(C3=O)C4=CC=C(C=C4)OS(=O)(=S)O)C.[Na+].[Co]	{1: 2, 2: 1, 35: 1, 33: 1, 34: 2, 14: 11, 20: 1, 21: 1, 22: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	19056-01-0	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)[N+](=CC=C6)C	{1: 4, 33: 2, 14: 28, 24: 3, 29: 6, 31: 3}
Did not match all atoms present	19056-03-2	CCC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)[N+](=CC=C6)CCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 14: 28, 24: 3, 29: 6, 31: 3}
Did not match all atoms present	19056-06-5	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)C(=O)NC5=CC6=C(C=C5)[N+](=CC=C6)C	{1: 4, 33: 2, 14: 28, 24: 3, 29: 6, 31: 3}
Did not match all atoms present	1906-57-6	CCOC(=O)C(=O)[O-].[K+]	{24: 1, 1: 1, 2: 1, 28: 1}
Did not match all atoms present	19060-37-8	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C	{1: 4, 33: 2, 14: 28, 24: 3, 29: 6, 31: 3}
Did not match all atoms present	19060-39-0	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=C[N+](=CC=C5)C	{1: 4, 6: 2, 33: 2, 14: 28, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	19060-40-3	CCC[N+]1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=C[N+](=CC=C5)CCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 4, 6: 2, 33: 2, 14: 28, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	19060-43-6	CC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 6: 2, 33: 2, 14: 28, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	19060-44-7	CCC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 4, 6: 2, 33: 2, 14: 28, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	19060-45-8	CCCC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CCCC	{1: 2, 2: 6, 6: 2, 33: 2, 14: 20, 24: 4, 31: 4}
Did not match all atoms present	19064-18-7	C1=CC(=C(C(=C1)F)CO)F	{16: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	19064-24-5	C1=CC(=C(C(=C1)F)[N+](=O)[O-])F	{16: 2, 38: 1, 14: 3}
Did not match all atoms present	19064-25-6	C1=CC(=C(C(=C1)F)N=[N+](C2=C(C=CC=C2F)F)[O-])F	{16: 4, 33: 1, 34: 1, 29: 1, 14: 6}
Did not match all atoms present	19064-64-3	CC1=CC(=NN=C1Cl)Cl	{1: 1, 35: 2, 14: 1, 17: 2}
Did not match all atoms present	190650-04-5	CC(=O)NCCC1=C(C=CC2=C1C=CN2)OC	{32: 1, 1: 2, 2: 2, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	1907-13-7	CC[Sn](CC)(CC)OC(=O)C	{1: 4, 2: 3, 28: 1}
Did not match all atoms present	1907-33-1	[Li+].CC(C)(C)[O-]	{1: 3, 4: 1, 29: 1}
Did not match all atoms present	1907-65-9	CCCCNS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 3, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	1907-69-3	CCOC(=CC(=O)C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 6: 1, 7: 1, 14: 10, 22: 1, 24: 1}
Did not match all atoms present	19072-57-2	CC[N+]1(C(CCCC1C)C)CC.[Br-]	{1: 4, 2: 2, 11: 3, 12: 2, 18: 1}
Did not match all atoms present	19072-79-8	CCCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C	{1: 13, 2: 2, 3: 1, 4: 4, 14: 4, 21: 2}
Did not match all atoms present	19073-56-4	[C-]#N.[Rb+]	{}
Did not match all atoms present	19074-59-0	CC1=CC(=C(C=C1)C)OP(=O)(OC2=C(C=CC(=C2)C)C)OC3=C(C=CC(=C3)C)C	{1: 6, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	19075-26-4	CCOC(=O)CC[N+](C)(C)C.[I-]	{1: 4, 2: 3, 19: 1, 28: 1}
Did not match all atoms present	19077-97-5	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N=C(N)N	{1: 1, 34: 1, 7: 1, 14: 4, 24: 1, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	19077-98-6	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=N2	{1: 1, 35: 1, 14: 8, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	190774-47-1	C1=CC(=C(C=C1Br)Cl)N=C=O	{34: 1, 8: 1, 14: 3, 17: 1, 18: 1, 29: 1}
Did not match all atoms present	190774-48-2	C1=C(C=C(C(=C1F)N=C=O)Br)F	{34: 1, 8: 1, 14: 2, 16: 2, 18: 1, 29: 1}
Did not match all atoms present	190774-50-6	CC1=CC(=C(C=C1)F)N=C=O	{1: 1, 34: 1, 8: 1, 14: 3, 16: 1, 29: 1}
Did not match all atoms present	190774-51-7	C1=CC(=C(C=C1F)[N+](=O)[O-])N=C=O	{34: 1, 38: 1, 8: 1, 14: 3, 16: 1, 29: 1}
Did not match all atoms present	190774-52-8	C1=CC(=C(C(=C1)N=C=O)F)C(F)(F)F	{34: 1, 4: 1, 8: 1, 14: 3, 16: 4, 29: 1}
Did not match all atoms present	190774-53-9	C1=CC(=C(C(=C1)F)N=C=O)C(F)(F)F	{34: 1, 4: 1, 8: 1, 14: 3, 16: 4, 29: 1}
Did not match all atoms present	190774-54-0	C1=CC(=C(C=C1F)C(F)(F)F)N=C=O	{34: 1, 4: 1, 8: 1, 14: 3, 16: 4, 29: 1}
Did not match all atoms present	190774-56-2	CC1=CC(=C(C=C1)OC)N=C=S	{8: 1, 1: 2, 34: 1, 22: 1, 14: 3}
Did not match all atoms present	190774-57-3	CCCC1=CC=CC=C1N=C=O	{1: 1, 2: 2, 8: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	190774-58-4	C1=CC(=C(C(=C1N=C=O)F)F)F	{8: 1, 16: 3, 34: 1, 29: 1, 14: 2}
Did not match all atoms present	1908-23-2	CCC1=NC2=C(C(=N1)Cl)NC=N2	{32: 1, 1: 1, 2: 1, 35: 3, 14: 1, 17: 1}
Did not match all atoms present	1908-87-8	CN1CCSC1=S	{1: 1, 41: 1, 11: 2, 33: 1, 15: 1}
Did not match all atoms present	1908-88-9	CC1(CSC(=S)N1)C	{32: 1, 1: 2, 41: 1, 11: 1, 13: 1, 15: 1}
Did not match all atoms present	19083-26-2	CC1=CC(=CC(=C1)OP(=O)(OCC2C(C(C(O2)N3C=NC4=C3NC=NC4=S)OC(=O)C)OC(=O)C)OC5=CC(=CC(=C5)C)C)C	{32: 1, 1: 6, 2: 1, 35: 2, 33: 1, 12: 4, 14: 8, 22: 3, 23: 1, 28: 2, 29: 1}
Did not match all atoms present	19083-81-9	CC[N+]1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=C(C=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CC)OC)OC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 6, 2: 2, 33: 2, 14: 26, 22: 2, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	19083-82-0	CCC[N+]1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=C(C=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CCC)OC)OC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 6, 2: 4, 33: 2, 14: 26, 22: 2, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	19086-20-5	O.O.O.[O-]S(=O)[O-].[Mg+2]	{29: 3}
Did not match all atoms present	19088-74-5	C(=O)(O)[O-].[Rb+]	{27: 1}
Did not match all atoms present	19089-55-5	C1=C(C=C(C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)O.[Na+].[Na+]	{27: 1, 29: 6, 14: 3}
Did not match all atoms present	19092-03-6	CN(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 3, 33: 1}
Did not match all atoms present	19094-56-5	C1=CC(=C(C=C1I)C(=O)O)Cl	{27: 1, 17: 1, 19: 1, 14: 3}
Did not match all atoms present	19097-37-1	C[Ge](C)(C)C#CC(F)(F)F	{16: 3, 1: 3, 10: 2, 4: 1}
Did not match all atoms present	19098-16-9	NO.OP(=O)(O)O	{20: 4, 29: 1, 30: 1}
Did not match all atoms present	19098-17-0	O.O.[Mg+2].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	19099-93-5	C1CN(CCC1=O)C(=O)OCC2=CC=CC=C2	{33: 1, 2: 1, 11: 4, 14: 5, 25: 1, 28: 1}
Did not match all atoms present	191-07-1	C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC7=C6C3=C(C=C2)C=C7	{14: 12}
Did not match all atoms present	191-13-9	C1=CC=C2C(=C1)C=C3C=CC4=CC5=C6C(=CC7=CC=CC=C75)C=CC8=CC2=C3C4=C86	{14: 16}
Did not match all atoms present	191-20-8	C1=CC=C2C(=C1)C=C3C=CC4=CC5=CC=CC=C5C6=C4C3=C2C7=CC=CC=C76	{14: 16}
Did not match all atoms present	191-24-2	C1=CC2=C3C(=C1)C4=CC=CC5=C4C6=C(C=C5)C=CC(=C36)C=C2	{14: 12}
Did not match all atoms present	191-26-4	C1=CC2=C3C(=C1)C=C4C=CC5=C6C4=C3C(=CC6=CC=C5)C=C2	{14: 12}
Did not match all atoms present	191-27-5	C1=CC2=C3C(=C1)N=C4C=CC5=C6C4=C3C(=NC6=CC=C5)C=C2	{35: 2, 14: 10}
Did not match all atoms present	191-28-6	C1=CC2=C3C(=C1)OC4=C5C3=C(C=C2)OC6=CC=CC(=C65)C=C4	{14: 10, 23: 2}
Did not match all atoms present	191-30-0	C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C6=CC=CC=C6C5=CC=C4	{14: 14}
Did not match all atoms present	191-46-8	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C6C=CC7=C8C6=C(C(=C54)C=C3)C9=CC=CC=C9C8=CC=C7	{14: 18}
Did not match all atoms present	191-48-0	C1=CC2=C3C(=C1)C4=C5C6=CC=CC7=C6C(=CC=C7)C5=C8C9=CC=CC1=C9C(=CC=C1)C8=C4C3=CC=C2	{14: 18}
Did not match all atoms present	191-53-7	C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C(C=C4)C6=C7C(=C25)C=CC8=C7C(=CC=C8)C9=CC=CC=C96	{14: 18}
Did not match all atoms present	191-68-4	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC=C5C6=CC=CC=C64	{14: 16}
Did not match all atoms present	191-79-7	C1=CC2=C3C(=C1)C4=C5C(=CC=C4)C6=C7C(=C5C3=CC=C2)C=CC=C7C8=CC=CC9=C8C6=CC=C9	{14: 18}
Did not match all atoms present	191-85-5	C1=CC=C2C(=C1)C=C3C=CC=C4C3=C2C5=CC=CC6=C5C4=CC=C6	{14: 14}
Did not match all atoms present	191-87-7	C1=CC=C2C(=C1)C=C3C=CC=C4C3=C2C5=CC=CC6=CC7=CC=CC=C7C4=C65	{14: 16}
Did not match all atoms present	1910-42-5	C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C.[Cl-].[Cl-]	{1: 2, 33: 2, 14: 8, 17: 2}
Did not match all atoms present	1910-68-5	CN1C2=CC=CC=C2/C(=N/NC(=S)N)/C1=O	{1: 1, 34: 1, 33: 1, 7: 1, 14: 4, 15: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	19109-66-1	CCCCC[N+](C)(C)C.[I-]	{1: 4, 2: 4, 19: 1}
Did not match all atoms present	19109-87-6	O=[U]=O.F	{16: 1, 29: 2}
Did not match all atoms present	1911-24-6	C[Si](C1=CC=CO1)C2=CC=CO2	{1: 1, 14: 6, 23: 2}
Did not match all atoms present	19111-74-1	CC1=C(C(=CC=C1)C)C#[N+][O-]	{1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	19112-42-6	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5	{3: 1, 4: 1, 14: 25}
Did not match all atoms present	19115-30-1	COC1=CC=C(C=C1)C(C#C)O	{1: 1, 3: 1, 9: 1, 10: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	19116-23-5	CC1=C/C(=N/NC2=CC(=CC=C2)Cl)/C(=O)C=C1	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	19116-37-1	C1CN1C(=S)NC2=CC=CC=C2	{31: 1, 33: 1, 11: 2, 14: 5, 7: 1}
Did not match all atoms present	19116-61-1	CO[Si](CCCOC(C(F)(F)F)(C(F)(F)F)F)(OC)OC	{16: 7, 1: 3, 2: 3, 4: 3, 22: 4}
Did not match all atoms present	1912-24-9	CCNC1=NC(=NC(=N1)Cl)NC(C)C	{1: 3, 2: 1, 3: 1, 17: 1, 35: 3, 31: 2}
Did not match all atoms present	1912-25-0	CCN(CC)C1=NC(=NC(=N1)NC(C)C)Cl	{1: 4, 2: 2, 3: 1, 33: 1, 17: 1, 35: 3, 31: 1}
Did not match all atoms present	1912-26-1	CCNC1=NC(=NC(=N1)Cl)N(CC)CC	{1: 3, 2: 3, 35: 3, 33: 1, 17: 1, 31: 1}
Did not match all atoms present	1912-28-3	CCS(=O)(=O)OC	{1: 2, 2: 1, 29: 2, 22: 1}
Did not match all atoms present	1912-30-7	CCOS(=O)(=O)CC	{1: 2, 2: 2, 29: 2, 22: 1}
Did not match all atoms present	1912-31-8	CCCOS(=O)(=O)C	{1: 2, 2: 2, 29: 2, 22: 1}
Did not match all atoms present	1912-32-9	CCCCOS(=O)(=O)C	{1: 2, 2: 3, 29: 2, 22: 1}
Did not match all atoms present	1912-33-0	COC(=O)CC1=CNC2=CC=CC=C21	{32: 1, 1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	1912-84-1	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Sn+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	19120-39-9	C1=CC=C(C=C1)CCC(C2=CC=CC=C2)C3=CC=CC=C3	{2: 2, 3: 1, 14: 15}
Did not match all atoms present	19120-62-8	CC(C)CO.CC(C)CO.CC(C)CO.O=[V]	{1: 6, 2: 3, 3: 3, 20: 3, 29: 1}
Did not match all atoms present	19121-56-3	B=P	{}
Did not match all atoms present	19126-15-9	COC1C2=CC=CC=C2C3=CC=CC=C13	{1: 1, 12: 1, 22: 1, 14: 8}
Did not match all atoms present	1913-72-0	CC1=CC(=NC2=C1C(=O)N=CN2)C	{32: 1, 1: 2, 35: 2, 14: 2, 25: 1}
Did not match all atoms present	19131-99-8	C[C@@H](C1=CC=CC=C1)NC	{1: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	19137-90-7	CC[NH+]1CCCC1C2=CNC3=CC=CC=C32.[Cl-]	{32: 1, 1: 1, 2: 1, 11: 3, 12: 1, 14: 5, 17: 1}
Did not match all atoms present	1914-58-5	C1=CC=C(C=C1)C=CCC(=O)O	{2: 1, 27: 1, 14: 5, 6: 2}
Did not match all atoms present	1914-61-0	C1=CC=C(C=C1)C=CCC(=O)S	{24: 1, 2: 1, 14: 5, 6: 2, 39: 1}
Did not match all atoms present	1914-78-9	CCOC(=O)C1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 35: 1, 33: 1, 12: 1, 34: 2, 14: 10, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	1914-99-4	C1=CC(=C(C=C1Cl)P(=O)(O)O)NN=C2C(=CC3=C(C2=O)C(=O)C(=NNC4=C(C=C(C=C4)Cl)P(=O)(O)O)C(=C3)S(=O)(=O)O)S(=O)(=O)O	{34: 2, 14: 8, 17: 2, 20: 6, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	19141-40-3	C[C@@H](CO)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	19141-82-3	CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 45, 29: 3}
Did not match all atoms present	19142-68-8	CC(CN1CCN(CC1)CCOCCO)CN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl	{1: 1, 2: 6, 3: 1, 33: 3, 41: 1, 11: 4, 14: 7, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	19142-71-3	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=C(C=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C)Cl)Cl	{1: 4, 33: 2, 14: 26, 17: 2, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	19143-28-3	COC(=O)CCC(C(=O)N)N1C(=O)C2=CC=CC=C2C1=O	{1: 1, 2: 2, 3: 1, 33: 1, 14: 4, 24: 1, 25: 2, 28: 1, 30: 1}
Did not match all atoms present	19145-60-9	CN1C2CCC1CC(C2)OC(=O)C3=CC=CC=C3	{1: 1, 33: 1, 11: 4, 12: 3, 14: 5, 28: 1}
Did not match all atoms present	19146-99-7	CCCC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 6, 33: 2, 14: 28, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	1915-77-1	CC1=C(C=CC=C1Cl)N2C(=NC3=CC=CC=C3C2=O)C	{1: 2, 35: 1, 33: 1, 14: 7, 17: 1, 25: 1}
Did not match all atoms present	19153-00-5	CC1=NC2=CN=C(N=C2N=C1C)N	{1: 2, 35: 4, 30: 1, 14: 1}
Did not match all atoms present	19153-98-1	[O-]S(=O)OS(=O)[O-].[O-]S(=O)OS(=O)[O-].[Na+].[Na+].[Na+].[Au+]	{29: 8, 22: 2}
Did not match all atoms present	19153-99-2	[O-]S(=O)[O-].[O-]S(=O)[O-].[K+].[K+].[K+].[Au+]	{29: 6}
Did not match all atoms present	19154-24-6	[H+].[H+].[H+].[H+].[H+].C1=CC(=C(C=C1Cl)N/N=C\2/C(=O)C3=C(C=C(C=C3C=C2S(=O)(=O)O)S(=O)(=O)O)O)O.C1=CC(=C(C=C1Cl)N/N=C\2/C(=O)C3=C(C=C(C=C3C=C2S(=O)(=O)O)S(=O)(=O)O)O)O.[Cr]	{34: 2, 14: 12, 15: 4, 17: 2, 20: 4, 21: 4, 25: 2, 29: 8, 31: 2}
Did not match all atoms present	19154-30-4	[H+].[H+].[H+].C1=CC=C2/C(=N/NC3=C(C=CC(=C3)S(=O)(=O)O)O)/C(=O)C=CC2=C1.C1=CC=C2/C(=N/NC3=C(C=CC(=C3)S(=O)(=O)O)O)/C(=O)C=CC2=C1.[Cr]	{34: 2, 14: 18, 15: 2, 20: 2, 21: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	19154-31-5	[H+].[H+].[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C4=CC=CC=C43)S(=O)(=O)[O-])[O-])[O-].[Cr+3]	{34: 4, 29: 6, 14: 22}
Did not match all atoms present	19155-24-9	CC1(C2=CC=CC=C2NC1=O)C	{32: 1, 1: 2, 13: 1, 14: 4, 25: 1}
Did not match all atoms present	19158-51-1	CC1=CC=C(C=C1)S(=O)(=O)C#N	{1: 1, 29: 2, 14: 4, 37: 1}
Did not match all atoms present	19159-68-3	C1=C(C=C(C(=C1[N+](=O)[O-])N=NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{34: 2, 38: 6, 14: 4}
Did not match all atoms present	1916-07-0	COC1=CC(=CC(=C1OC)OC)C(=O)OC	{1: 4, 28: 1, 22: 3, 14: 2}
Did not match all atoms present	1916-08-1	COC1=CC(=CC(=C1OC)O)C(=O)O	{1: 2, 22: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	1916-59-2	C1=CC=C2C(=C1)N=C3C=C(C(=O)C=C3O2)N	{25: 1, 35: 1, 30: 1, 14: 6, 23: 1}
Did not match all atoms present	19163-05-4	B(C)(C)SC	{40: 1, 1: 3}
Did not match all atoms present	19163-08-7	B(C)(SC)SC	{40: 2, 1: 3}
Did not match all atoms present	19164-41-1	CC1=CC2=NO[N+](=C2C=C1)[O-]	{1: 1, 35: 1, 33: 1, 14: 3, 23: 1}
Did not match all atoms present	19168-23-1	[NH4+].[NH4+].Cl[Pd-2](Cl)(Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	1917-15-3	CC1=CC=C(O1)C(=O)O	{1: 1, 27: 1, 14: 2, 23: 1}
Did not match all atoms present	19172-47-5	COC1=CC=C(C=C1)P2(=S)SP(=S)(S2)C3=CC=C(C=C3)OC	{1: 2, 22: 2, 14: 8, 41: 2}
Did not match all atoms present	19173-40-1	C1=CC(=CC=C1C(=NN)N)C(=NN)N	{34: 2, 30: 4, 14: 4, 7: 2}
Did not match all atoms present	19176-60-4	C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])N	{38: 1, 28: 1, 30: 1, 14: 8}
Did not match all atoms present	19177-04-9	CC1=CC(=CC=C1)OC(C)C	{1: 3, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	19179-31-8	COC1=CC(=CC(=C1)C#N)OC	{1: 2, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	19179-36-3	C1=C(C=C(C=C1O)O)C#N	{21: 2, 14: 3, 37: 1}
Did not match all atoms present	1918-00-9	COC1=C(C=CC(=C1C(=O)O)Cl)Cl	{1: 1, 27: 1, 22: 1, 14: 2, 17: 2}
Did not match all atoms present	1918-02-1	C1(=C(C(=NC(=C1Cl)Cl)C(=O)O)Cl)N	{17: 3, 27: 1, 30: 1, 35: 1}
Did not match all atoms present	1918-11-2	CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)NC)C(C)(C)C	{1: 8, 31: 1, 4: 2, 14: 2, 28: 1}
Did not match all atoms present	1918-13-4	C1=CC(=C(C(=C1)Cl)C(=S)N)Cl	{17: 2, 30: 1, 14: 3, 7: 1}
Did not match all atoms present	1918-16-7	CC(C)N(C1=CC=CC=C1)C(=O)CCl	{1: 2, 2: 1, 3: 1, 33: 1, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	1918-18-9	COC(=O)NC1=CC(=C(C=C1)Cl)Cl	{1: 1, 31: 1, 28: 1, 14: 3, 17: 2}
Did not match all atoms present	1918-77-0	C1=CSC(=C1)CC(=O)O	{41: 1, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	1918-79-2	CC1=CC=C(S1)C(=O)O	{1: 1, 27: 1, 14: 2, 41: 1}
Did not match all atoms present	1918-82-7	C=CC1=CC=CS1	{41: 1, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	19181-26-1	[Be+2].[F-].[F-].[F-]	{16: 3}
Did not match all atoms present	19182-11-7	CCC1=C(C2=CC=CC=C2C=C1)CC	{1: 2, 2: 2, 14: 6}
Did not match all atoms present	19182-13-9	CCC1=CC2=C(C=C1)C(=CC=C2)CC	{1: 2, 2: 2, 14: 6}
Did not match all atoms present	19189-02-7	CC(C)C1=C(C=CC(=C1)OC(=O)NC)O	{1: 3, 3: 1, 14: 3, 21: 1, 28: 1, 31: 1}
Did not match all atoms present	19189-19-6	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Gd+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	19189-20-9	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Sm+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	1919-48-8	C1=CC=C(C=C1)OC2=NC(=NC(=N2)OC3=CC=CC=C3)OC4=CC=CC=C4	{35: 3, 22: 3, 14: 15}
Did not match all atoms present	1919-91-1	COC1=CC=CC=C1NC(=O)C2=C(C=C3C=CC(=CC3=C2)Br)OP(=O)(O)O	{1: 1, 14: 9, 18: 1, 20: 2, 22: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	19197-14-9	C1=CC=C(C=C1)N=NC2C(=NNC2=O)N	{32: 1, 34: 2, 35: 1, 12: 1, 14: 5, 15: 1, 25: 1, 30: 1}
Did not match all atoms present	19198-94-8	CC1=CC=CC=C1N2CCC2	{1: 1, 11: 3, 14: 4, 33: 1}
Did not match all atoms present	19199-06-5	CC1=C(C(=CC=C1)C)N2CCC2	{1: 2, 11: 3, 14: 3, 33: 1}
Did not match all atoms present	19199-82-7	C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CBr	{2: 1, 38: 1, 28: 1, 18: 1, 14: 4}
Did not match all atoms present	192-46-1	C1=CC=C2C=C3C4=C5C(=CC3=CC2=C1)C6=CC=CC=C6C7=CC8=CC9=CC=CC=C9C=C8C(=C75)C=C4	{14: 20}
Did not match all atoms present	192-47-2	C1=CC=C2C3=C4C(=CC2=C1)C5=CC=CC=C5C6=CC7=CC=CC=C7C(=C64)C=C3	{14: 16}
Did not match all atoms present	192-51-8	C1=CC=C2C3=C4C(=CC=C3)C5=CC=CC=C5C6=CC=CC(=C64)C2=C1	{14: 14}
Did not match all atoms present	192-54-1	C1=CC=C2C=C3C4=C5C(=CC=C4)C6=CC7=CC=CC=C7C=C6C8=CC=CC(=C85)C3=CC2=C1	{14: 18}
Did not match all atoms present	192-59-6	C1=CC=C2C=C3C4=CC=CC5=C4C6=C(C=CC=C6C3=CC2=C1)C7=CC=CC=C57	{14: 16}
Did not match all atoms present	192-60-9	C1=CC=C2C=C3C=C4C5=CC=CC6=C5C7=C(C=CC=C7C4=CC3=CC2=C1)C8=CC=CC=C68	{14: 18}
Did not match all atoms present	192-65-4	C1=CC=C2C3=C4C(=CC2=C1)C5=CC=CC=C5C6=CC=CC(=C64)C=C3	{14: 14}
Did not match all atoms present	192-70-1	C1=CC=C2C=C3C4=C5C(=CC3=CC2=C1)C6=CC=CC=C6C7=CC=CC(=C75)C=C4	{14: 16}
Did not match all atoms present	192-97-2	C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C(C=CC=C25)C=C4	{14: 12}
Did not match all atoms present	1920-05-4	CCCCCCCCCCCC[NH+](C)C.CC(=O)[O-]	{24: 1, 1: 4, 2: 11}
Did not match all atoms present	1920-90-7	CCCC[Pb](CCCC)(CCCC)CCCC	{1: 4, 2: 12}
Did not match all atoms present	19200-21-6	[N+](=O)=O.F[P-](F)(F)(F)(F)F	{16: 6, 34: 1, 29: 2}
Did not match all atoms present	19202-04-1	C1COCCN1C(=O)C2=CC=C(C=C2)Cl	{33: 1, 11: 4, 14: 4, 17: 1, 23: 1, 24: 1}
Did not match all atoms present	19210-54-9	C1CSC(=N)S1.OS(=O)(=O)O	{36: 1, 41: 2, 11: 2, 15: 1, 20: 2, 29: 2}
Did not match all atoms present	19216-56-9	COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC=CO4)N)OC	{1: 2, 35: 2, 33: 2, 11: 4, 14: 5, 22: 2, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	19217-79-9	CCP(=C=O)(C(=C=O)C=C=O)C(=C=O)C=C=O.[Mo]	{1: 1, 2: 1, 6: 2, 7: 2, 8: 5, 29: 5}
Did not match all atoms present	19218-16-7	C1CN1S(=O)(=O)CCCS(=O)(=O)N2CC2	{33: 2, 2: 3, 11: 4, 29: 4}
Did not match all atoms present	19219-81-9	CC1=C(C(=C(C(=C1C)Cl)Cl)Cl)C	{1: 3, 17: 3}
Did not match all atoms present	19219-85-3	CCC(CC)CC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5}
Did not match all atoms present	19219-98-8	CC1=CC2=C(C=C1C)OC(=N2)C	{1: 3, 35: 1, 14: 2, 23: 1}
Did not match all atoms present	19219-99-9	CC1=NC2=C(O1)C=CC(=C2)Cl	{1: 1, 23: 1, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	1922-99-2	C1=CC=C(C=C1)CC([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl	{17: 6, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	19223-55-3	CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(CS(=O)(=O)[O-])O	{1: 3, 2: 15, 3: 1, 20: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	19224-23-8	C1=CC=C2C(=C1)N=C(S2)SNCCOCCNSC3=NC4=CC=CC=C4S3	{2: 4, 35: 2, 40: 2, 41: 2, 14: 8, 22: 1, 31: 2}
Did not match all atoms present	19224-26-1	CC(COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 28: 2, 14: 10}
Did not match all atoms present	19224-27-2	C1=CC=C(C=C1)C(=O)OCCCCOC(=O)C2=CC=CC=C2	{2: 4, 28: 2, 14: 10}
Did not match all atoms present	19224-35-2	CC1=CC(=CC=C1)C[Hg]Cl	{1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	19227-07-7	C1=CC=C(C=C1)C2=CC3=CC=CC=CC3=C2	{14: 12}
Did not match all atoms present	19227-22-6	C1(=C(C2=N[Se]N=C2C(=C1F)F)F)F	{16: 4, 35: 2}
Did not match all atoms present	1923-01-9	C[Si](C)(C)C(=C)C1=CC=CC=C1	{1: 3, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	1923-70-2	CCCC[N+](CCCC)(CCCC)CCCC.[O-]Cl(=O)(=O)=O	{1: 4, 2: 12, 29: 4, 17: 1}
Did not match all atoms present	1923-76-8	CCCC(=O)NC1=C(C=C(C(=C1I)/C=C(\CC)/C(=O)[O-])I)I.[Na+]	{1: 2, 2: 3, 6: 1, 7: 1, 14: 1, 19: 3, 24: 2, 31: 1}
Did not match all atoms present	19230-27-4	C1=CC(=C(C(=C1)Br)Cl)Br	{17: 1, 18: 2, 14: 3}
Did not match all atoms present	19230-28-5	C1=CC(=C(C(=C1)Cl)I)Cl	{17: 2, 19: 1, 14: 3}
Did not match all atoms present	19232-22-5	C[Si](C)(C)C#CC(=O)[O-]	{24: 1, 1: 3, 10: 2}
Did not match all atoms present	19232-39-4	CCOC(=O)[CH-]C(=O)C.[Na+]	{24: 1, 1: 2, 2: 1, 28: 1, 6: 1}
Did not match all atoms present	19236-14-7	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Pr+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	19236-15-8	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Nd+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	19237-84-4	COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC=CO4)N)OC.Cl	{1: 2, 35: 2, 33: 2, 11: 4, 14: 5, 17: 1, 22: 2, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	19238-49-4	C(CC(=O)[O-])C(C(=O)[O-])N.[Ca+2]	{24: 2, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	19241-15-7	CC1=CC(=C(C=C1)C)N=C=S	{8: 1, 1: 2, 34: 1, 14: 3}
Did not match all atoms present	19241-16-8	CC1=C(C(=CC=C1)C)N=C=S	{8: 1, 1: 2, 34: 1, 14: 3}
Did not match all atoms present	19241-17-9	CC1=C(C=C(C=C1)N=C=S)C	{8: 1, 1: 2, 34: 1, 14: 3}
Did not match all atoms present	19241-18-0	CC1=CC(=C(C=C1C)N=C=S)C	{8: 1, 1: 3, 34: 1, 14: 2}
Did not match all atoms present	19241-19-1	CCC1=CC=CC=C1N=C=S	{8: 1, 1: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	19241-20-4	CCC1=CC(=CC=C1)N=C=S	{8: 1, 1: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	19241-24-8	CC(C)(C)C1=CC=C(C=C1)N=C=S	{8: 1, 1: 3, 34: 1, 4: 1, 14: 4}
Did not match all atoms present	19241-35-1	CC1=C(C=CC=C1Cl)N=C=S	{8: 1, 1: 1, 34: 1, 14: 3, 17: 1}
Did not match all atoms present	19241-36-2	CC1=C(C=C(C=C1)Cl)N=C=S	{8: 1, 1: 1, 34: 1, 14: 3, 17: 1}
Did not match all atoms present	19241-37-3	CC1=C(C=C(C=C1)N=C=S)Cl	{8: 1, 1: 1, 34: 1, 14: 3, 17: 1}
Did not match all atoms present	19241-38-4	CC1=C(C=CC(=C1)Br)N=C=S	{8: 1, 1: 1, 18: 1, 34: 1, 14: 3}
Did not match all atoms present	19241-39-5	CC1=CC(=C(C=C1)N=C=S)Br	{8: 1, 1: 1, 18: 1, 34: 1, 14: 3}
Did not match all atoms present	192439-46-6	CN\1COCN(/C1=N\[N+](=O)[O-])CC2=CN=C(S2)SC3=CC=CC=C3	{1: 1, 2: 1, 35: 1, 38: 1, 33: 2, 40: 1, 41: 1, 11: 2, 34: 1, 14: 6, 15: 1, 23: 1}
Did not match all atoms present	19245-07-9	CC1=C(C(=CC=C1)C)OC(=O)C(C2=CC=CC=C2)N3CCN(CC3)CCO.Cl	{1: 2, 2: 2, 3: 1, 33: 2, 11: 4, 14: 8, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	19245-41-1	CCC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O	{1: 7, 2: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	19245-42-2	CC(C)C1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O	{1: 8, 3: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	19246-04-9	CC(C)CC(=O)NC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	19246-24-3	CC1C(C(=O)NC(C(=O)NC(C(=O)NCC(=O)N2CCC(C2C(=O)NC(=CC3=CNC4=CC=CC=C43)C(=O)NC(C(=O)NC(C(=O)N5CCC(C5C(=O)O1)O)C(C(C)C)O)C(C)C6=CNC7=CC=CC=C76)O)C)C(C)O)NC(=O)C(CO)NC(=O)CC(C(=O)O)N	{32: 8, 1: 6, 2: 2, 3: 6, 6: 1, 33: 2, 11: 5, 12: 10, 14: 10, 15: 1, 20: 5, 24: 2, 25: 8, 27: 1, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	19247-68-8	C1=COC(=C1)C=NC2=CC=C(C=C2)N=CC3=CC=CO3	{34: 2, 14: 10, 6: 2, 23: 2}
Did not match all atoms present	19248-13-6	CCN(CCN)C1=CC=CC(=C1)C	{1: 2, 2: 3, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	19255-35-7	CN(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])N	{1: 1, 38: 2, 30: 1, 14: 3, 33: 1}
Did not match all atoms present	19255-90-4	CCCC(=NC1=CC=CC=C1)SCC	{1: 2, 2: 3, 7: 1, 40: 1, 34: 1, 14: 5}
Did not match all atoms present	19256-31-6	CCOC(C(=O)CC1=CC=CC=C1)OCC	{1: 2, 2: 3, 3: 1, 14: 5, 22: 2, 24: 1}
Did not match all atoms present	19258-92-5	N1P(=NP(=N[P+](N=P(N=P1(F)F)(F)F)(F)F)(F)F)(F)F	{16: 10, 32: 1, 35: 4}
Did not match all atoms present	19258-93-6	N1=P(N=P(N=P(N=P(N=P(N=P1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 12, 35: 6}
Did not match all atoms present	19259-08-6	C1=C(C(=CS1)I)I	{41: 1, 19: 2, 14: 2}
Did not match all atoms present	19259-11-1	C1(=C(SC(=C1I)I)I)I	{41: 1, 19: 4}
Did not match all atoms present	19262-20-5	CC(C1=CC=CC=C1)C(C)(C)C	{1: 4, 3: 1, 4: 1, 14: 5}
Did not match all atoms present	19262-93-2	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Cd+2]	{29: 6, 22: 1}
Did not match all atoms present	1927-61-3	C1CCOC(C1)OCCC2=CC=CC=C2	{2: 2, 11: 4, 12: 1, 14: 5, 22: 1, 23: 1}
Did not match all atoms present	1927-94-2	C1=CC(=C(C(=C1)Cl)O)C=O	{17: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	1927-95-3	CC(=O)OC1=CC=C(C=C1)Br	{1: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	19270-93-0	CC(C)(CCCNC1=NC=NC2=C1NC=N2)CO	{32: 1, 1: 2, 2: 4, 35: 3, 4: 1, 14: 2, 20: 1, 31: 1}
Did not match all atoms present	19270-99-6	C1=CC(=CC=C1CN2C=NC3=CN=CN=C32)S(=O)(=O)N	{33: 1, 2: 1, 35: 3, 14: 7, 29: 2, 30: 1}
Did not match all atoms present	19274-72-7	C1=CC=C(C=C1)C(=O)C2=CC=CC3=C2C(=CC=C3)C(=O)C4=CC=CC=C4	{24: 2, 14: 16}
Did not match all atoms present	19275-09-3	C1=CC=C(C=C1)N2C(=O)C3=CC4=CC=CC=C4C=C3N=N2	{25: 1, 35: 2, 14: 11, 33: 1}
Did not match all atoms present	19277-56-6	CCCCOC(=O)C1=CC=C(C=C1)C	{1: 2, 2: 3, 28: 1, 14: 4}
Did not match all atoms present	19277-91-9	CCC1=CC=C(C=C1)[O-].[Na+]	{1: 1, 2: 1, 14: 4}
Did not match all atoms present	1928-37-6	COC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 1, 14: 2, 17: 3, 22: 1, 28: 1}
Did not match all atoms present	1928-38-7	COC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	1928-43-4	CCCCC(CC)COC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 6, 3: 1, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	1928-44-5	CCCCCCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 8, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	1928-45-6	CCCCOCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 7, 14: 3, 17: 2, 22: 2, 28: 1}
Did not match all atoms present	1928-57-0	CCCCOCCOCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 9, 14: 3, 17: 2, 22: 3, 28: 1}
Did not match all atoms present	19287-45-7	B#B	{}
Did not match all atoms present	19288-59-6	CC(=C)C(=O)OCCNC1=CC=CC=C1	{1: 1, 2: 2, 5: 1, 7: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	1929-29-9	COC1=CC=C(C=C1)CCC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	1929-56-2	CCOC(=O)C1=NN(C(=O)C1N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C3=CC=CC=C3	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 12: 1, 34: 2, 14: 8, 15: 1, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	1929-73-3	CCCCOCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 6, 14: 3, 17: 2, 22: 2, 28: 1}
Did not match all atoms present	1929-82-4	C1=CC(=NC(=C1)Cl)C(Cl)(Cl)Cl	{17: 4, 35: 1, 4: 1, 14: 3}
Did not match all atoms present	1929-86-8	CC1=C(C=CC(=C1)Cl)OC(C)C(=O)[O-].[K+]	{1: 2, 3: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	1929-88-0	CNC(=O)NC1=NC2=CC=CC=C2S1	{1: 1, 35: 1, 41: 1, 14: 4, 24: 1, 31: 2}
Did not match all atoms present	19293-56-2	CC(=O)NCCSSCCCCS(=O)[O-].[Na+]	{1: 1, 2: 6, 40: 2, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	19293-72-2	COC1=CC=C(C=C1)C(=NOC)C2=CC=C(C=C2)OC	{1: 3, 34: 1, 22: 3, 14: 8, 7: 1}
Did not match all atoms present	19295-81-9	CCCCCCCCCC1=C(C=CC(=C1C(=O)[O-])C(=O)[O-])CCCCCCC	{24: 2, 1: 2, 2: 14, 14: 2}
Did not match all atoms present	193-09-9	C1=CC=C2C=C3C4=CC=CC5=C4C6=C(C=CC=C6C3=CC2=C1)C=C5	{14: 14}
Did not match all atoms present	193-11-3	C1=CC=C2C=C3C=C4C5=CC=CC6=C5C7=C(C=CC=C7C4=CC3=CC2=C1)C=C6	{14: 16}
Did not match all atoms present	193-39-5	C1=CC=C2C(=C1)C3=C4C2=CC5=CC=CC6=C5C4=C(C=C6)C=C3	{14: 12}
Did not match all atoms present	193-43-1	C1=CC2=C3C=CC4=C5C=CC=CC5=C6C4=C3C(=C2C=C1)C=C6	{14: 12}
Did not match all atoms present	193-44-2	C1=CC=C2C(=C1)C3=C4C5=C2SSC5=C6C=CC=CC6=C4SS3	{41: 4, 14: 8}
Did not match all atoms present	193-98-6	C1=CC2=C3C(=C1)C=CC4=C3C(=CN=C4)C=C2	{35: 1, 14: 9}
Did not match all atoms present	1930-72-9	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C#N	{17: 1, 38: 2, 37: 1, 14: 2}
Did not match all atoms present	1930-92-3	CC1=C(C=C(C=C1)[N+]#[C-])[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	19303-34-5	CC(=CC(C)(CC(C)(C)C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3	{1: 4, 2: 1, 4: 2, 6: 1, 7: 1, 14: 15}
Did not match all atoms present	19307-74-5	CCC(=O)C#CC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 10: 2, 14: 5}
Did not match all atoms present	19309-90-1	CC(=C)C(=O)OCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 8, 2: 3, 5: 1, 7: 1, 22: 2, 28: 1}
Did not match all atoms present	19311-79-6	CN1C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 35: 1, 14: 11, 33: 1}
Did not match all atoms present	19311-91-2	CCN(CC)C(=O)C1=CC=CC=C1O	{1: 2, 2: 2, 33: 1, 14: 4, 21: 1, 24: 1}
Did not match all atoms present	19312-06-2	CC1(COC(=N1)C2=CC=CC=C2)C	{1: 2, 35: 1, 11: 1, 13: 1, 14: 5, 15: 1, 23: 1}
Did not match all atoms present	19315-64-1	CCOC1=CC=C(C=C1)N(C(=O)C)O	{1: 2, 2: 1, 33: 1, 14: 4, 20: 1, 22: 1, 24: 1}
Did not match all atoms present	19316-37-1	CN(C)P(=O)(N)N	{1: 2, 29: 1, 30: 2, 33: 1}
Did not match all atoms present	19319-11-0	C[Si](C)(C)/C=C\C1=CC=CC=C1	{1: 3, 14: 5, 6: 2}
Did not match all atoms present	19319-86-9	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Cu](Br)Br	{18: 2, 35: 2, 14: 8}
Did not match all atoms present	19319-88-1	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]	{35: 2, 14: 8}
Did not match all atoms present	1932-32-7	C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9, 31: 2}
Did not match all atoms present	1932-50-9	C(C(=O)[O-])O.[K+]	{24: 1, 2: 1, 20: 1}
Did not match all atoms present	1932-84-9	C1=CC=C(C=C1)COC(=O)CCCCCCCC(=O)OCC2=CC=CC=C2	{2: 9, 28: 2, 14: 10}
Did not match all atoms present	19321-38-1	CC1CCC(CC1[O-])C(C)C.[Na+]	{11: 3, 1: 3, 3: 1, 12: 3, 29: 1}
Did not match all atoms present	19326-49-9	[Li+].C(=O)(C(Cl)(Cl)Cl)[O-]	{24: 1, 17: 3, 4: 1}
Did not match all atoms present	193293-71-9	CC1=C2C(=CC=C1)N=NN2Cl	{1: 1, 35: 2, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	1933-50-2	CC(=O)NC1=CC=C(C=C1)N=NN(C)C	{1: 3, 34: 2, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	19333-15-4	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C6N4[Si](N7C(=NC2=N3)C8=CC=CC=C8C7=NC9=NC(=N6)C1=CC=CC=C19)(O)O	{33: 2, 35: 6, 20: 2, 14: 16, 15: 4}
Did not match all atoms present	193338-72-6	CC(C)(C)C1=CC=CC=C1NCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 14: 4, 31: 1}
Did not match all atoms present	19335-11-6	C1=CC2=C(C=C1N)C=NN2	{32: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	193353-34-3	B(C1=C(C=CC(=C1)F)F)(O)O	{16: 2, 20: 2, 14: 3}
Did not match all atoms present	1934-16-3	CCNC1=CC2=C(C=C1C)N=C3C=C(C(=[NH+]CC)C=C3S2)C.[Cl-]	{1: 4, 2: 2, 35: 1, 41: 1, 14: 4, 17: 1, 31: 2}
Did not match all atoms present	1934-20-9	C1=CC=C(C=C1)N/N=C\2/C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-].[Na+]	{34: 1, 14: 10, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	1934-21-0	C1=CC(=CC=C1N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 1, 34: 2, 35: 1, 12: 1, 14: 8, 15: 1, 24: 1, 25: 1, 29: 6}
Did not match all atoms present	1934-75-4	C(#N)[N-]C#N.[Na+]	{34: 1, 37: 2}
Did not match all atoms present	1934-92-5	CN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 10, 33: 1}
Did not match all atoms present	19342-01-9	C[C@H](C1=CC=CC=C1)N(C)C	{1: 3, 3: 1, 14: 5, 33: 1}
Did not match all atoms present	19343-78-3	CC1CCNC2=CC=CC=C12	{32: 1, 1: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	193486-83-8	CCN(CCC(=O)OCCOC(=O)CCl)C1=CC(=C(C=C1)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)F)Cl)C	{1: 2, 2: 6, 33: 1, 34: 2, 14: 5, 16: 1, 17: 3, 28: 2, 29: 2}
Did not match all atoms present	193486-91-8	CC(C)OC(=O)/C=C/C(=O)OC(C)C.CC(=O)OC=C.C=CC1=CC=CC=C1	{1: 5, 3: 2, 5: 2, 6: 4, 14: 5, 28: 3}
Did not match all atoms present	19351-91-8	CC(=O)NCC1=CC=CC2=CC=CC=C21	{24: 1, 1: 1, 2: 1, 14: 7, 31: 1}
Did not match all atoms present	19353-92-5	CN(C)C1=CC=C(C=C1)C(=O)NN	{1: 2, 33: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	193533-92-5	CC1=C(C(=C(C=C1)F)F)F	{16: 3, 1: 1, 14: 2}
Did not match all atoms present	193551-21-2	COC1=NC=CC(=N1)C2=C(N=CN2C3CCC(CC3)O)C4=CC=C(C=C4)F	{1: 1, 35: 3, 33: 1, 11: 4, 12: 2, 14: 7, 16: 1, 20: 1, 22: 1}
Did not match all atoms present	193561-59-0	CC1=C(C(=CC=C1)C)OC(=O)C.C1=CC=C(C(=C1)C(=O)O)O	{1: 3, 27: 1, 28: 1, 21: 1, 14: 7}
Did not match all atoms present	193562-40-2	CCCCCCCCCC1=CC=CC=C1O.CC1CO1.C=O.C1CO1	{1: 2, 2: 8, 5: 1, 11: 3, 12: 1, 14: 4, 21: 1, 23: 2}
Did not match all atoms present	19357-83-6	F[W](F)(F)(F)F	{16: 5}
Did not match all atoms present	19357-86-9	I[Yb]I	{19: 2}
Did not match all atoms present	19359-62-7	CCN=C(C1=C(N=NC=N1)N)N	{1: 1, 2: 1, 35: 3, 7: 1, 34: 1, 14: 1, 30: 2}
Did not match all atoms present	1936-15-8	C1=CC=C(C=C1)N/N=C\2/C(=O)C=CC3=CC(=CC(=C32)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 9, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	1936-51-2	CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C.Cl	{1: 3, 2: 2, 3: 1, 33: 2, 41: 1, 14: 8, 17: 1}
Did not match all atoms present	19360-67-9	C1=CC(=CC=C1C(=O)O)OCC(=O)O	{2: 1, 27: 2, 22: 1, 14: 4}
Did not match all atoms present	19361-41-2	CC(=O)NC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C43	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	19361-62-7	[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=C([2H])[2H])[2H])[2H])[2H]	{14: 5, 5: 1, 6: 1}
Did not match all atoms present	19367-79-4	COCC[Hg]O[Si](=O)O[Hg]CCOC	{1: 2, 2: 4, 29: 1, 22: 4}
Did not match all atoms present	1937-35-5	C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)NNC5=C6C(=CC(=CC6=O)S(=O)(=O)[O-])C=CC5=N)S(=O)(=O)[O-].[Na+].[Na+]	{34: 2, 36: 1, 14: 17, 15: 5, 25: 1, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	1937-37-7	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)C5=CC=C(C=C5)N=NC6=C(C=C(C=C6)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 5, 14: 18, 15: 2, 25: 1, 29: 6, 30: 3, 31: 1}
Did not match all atoms present	19372-00-0	C[Si](C)(C)C=CC1=CC=CC=C1	{1: 3, 14: 5, 6: 2}
Did not match all atoms present	19372-20-4	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Ni+2]	{29: 6, 22: 1}
Did not match all atoms present	19377-75-4	C1=COC(=C1)C(CO)O	{2: 1, 3: 1, 20: 2, 14: 3, 23: 1}
Did not match all atoms present	19379-90-9	CCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]	{1: 1, 2: 16, 20: 2, 14: 5, 17: 1}
Did not match all atoms present	1938-32-5	CCCC1=CC2=C(C=C1CCl)OCO2	{1: 1, 2: 3, 11: 1, 14: 2, 17: 1, 23: 2}
Did not match all atoms present	19380-02-0	CN1C(=CC=NC1=O)N	{1: 1, 35: 1, 33: 1, 14: 2, 25: 1, 30: 1}
Did not match all atoms present	19381-50-1	C1=CC2=C(C=CC(=C2N=O)[O-])C=C1S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2N=O)[O-])C=C1S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2N=O)[O-])C=C1S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Fe+3]	{34: 3, 29: 12, 14: 15}
Did not match all atoms present	19383-97-2	C1=CC=C(C=C1)C2=CC=CC3=CC4=C(C=CC5=CC=CC=C54)C=C32	{14: 16}
Did not match all atoms present	19386-45-9	C1=C(C(=C(C(=C1Cl)Cl)O)CC2=C(C(=C(C=C2Cl)Cl)Cl)O)Cl	{17: 6, 2: 1, 21: 2, 14: 2}
Did not match all atoms present	19387-83-8	CC1=CC(=CC(=C1CCl)C)C(C)(C)C	{1: 5, 2: 1, 4: 1, 14: 2, 17: 1}
Did not match all atoms present	19387-91-8	CCS(=O)(=O)CCN1C(=NC=C1[N+](=O)[O-])C	{1: 2, 2: 3, 35: 1, 38: 1, 33: 1, 14: 1, 29: 2}
Did not match all atoms present	193885-59-5	CCCCCCCC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 1, 2: 8, 3: 1, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1939-21-5	C1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)C(F)(F)F	{2: 1, 4: 1, 14: 9, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	1939-22-6	CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)C(F)(F)F	{1: 1, 4: 1, 14: 8, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	1939-26-0	CCCC(C)C(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 2, 2: 2, 3: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	1939-27-1	CC(C)C(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 2, 3: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	1939-29-3	C1=CC(=CC(=C1)NC(=O)C(Cl)(Cl)Cl)C(F)(F)F	{4: 2, 14: 4, 16: 3, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	1939-99-7	C1=CC=C(C=C1)CS(=O)(=O)Cl	{17: 1, 2: 1, 29: 2, 14: 5}
Did not match all atoms present	19393-92-1	C1=CC(=C(C(=C1)Cl)Br)Cl	{17: 2, 18: 1, 14: 3}
Did not match all atoms present	19393-96-5	C1=C(C=C(C(=C1Cl)Br)Cl)Cl	{17: 3, 18: 1, 14: 2}
Did not match all atoms present	19394-61-7	C1=CC=C(C=C1)C2=CC=CC=C2N=C=S	{8: 1, 34: 1, 14: 9}
Did not match all atoms present	19395-58-5	C1COCCN1CC(=O)N2CN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4	{33: 3, 2: 1, 11: 5, 14: 9, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	19395-74-5	CC1N(C(=O)C2=CC=CC=C2N1C(=O)CN3CCOCC3)C4=CC=CC=C4.Cl	{1: 1, 2: 1, 33: 3, 11: 4, 12: 1, 14: 9, 17: 1, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	19395-78-9	C1COCCN1CC(=O)N2CN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4.Cl	{33: 3, 2: 1, 11: 5, 14: 9, 17: 1, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	19396-06-6	C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)[C@@H](C(=O)O)NC(=O)[C@H]([C@@H]([C@H](COC(=O)N)O)O)N)O)O)CO	{32: 1, 33: 1, 2: 2, 3: 4, 12: 4, 14: 1, 20: 5, 23: 1, 24: 1, 25: 2, 27: 1, 28: 1, 30: 2, 31: 1}
Did not match all atoms present	19398-61-9	CC1=C(C=CC(=C1)Cl)Cl	{1: 1, 14: 3, 17: 2}
Did not match all atoms present	194-03-6	C1=CC2=C3C(=C1)C=NC4=CC=CC(=C43)C=C2	{35: 1, 14: 9}
Did not match all atoms present	194-32-1	C1=CC=C2C=CC3=CC=C4C3=C2C(=C1)C=C4	{14: 10}
Did not match all atoms present	194-59-2	C1=CC=C2C(=C1)C=CC3=C2C4=C(N3)C=CC5=CC=CC=C54	{32: 1, 14: 12}
Did not match all atoms present	194-62-7	C1=CC=C2C(=C1)C=CC3=C2C4=C(N3)C=CC5=C4N=CC=C5	{32: 1, 35: 1, 14: 11}
Did not match all atoms present	194-65-0	C1=CC=C2C(=C1)C=CC3=C2C4=C(S3)C=CC5=CC=CC=C54	{41: 1, 14: 12}
Did not match all atoms present	194-69-4	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C5=CC=CC=C5C=C4	{14: 14}
Did not match all atoms present	1940-20-1	C1=C(C(=C(C(=C1Cl)Cl)Cl)O)CC2=C(C(=CC(=C2Cl)Cl)Cl)O	{17: 6, 2: 1, 21: 2, 14: 2}
Did not match all atoms present	1940-42-7	C1=C(C(=CC(=C1Cl)Br)Cl)O	{17: 2, 18: 1, 21: 1, 14: 2}
Did not match all atoms present	1940-57-4	C1=CC=C2C(=C1)C(C3=CC=CC=C32)Br	{18: 1, 12: 1, 14: 8}
Did not match all atoms present	19402-64-3	C1=CC=C(C=C1)S(=O)(=O)[O-].[NH4+]	{29: 3, 14: 5}
Did not match all atoms present	19402-71-2	C1=CC=C2C(=C1)C=CC=C2[O-].[K+]	{14: 7}
Did not match all atoms present	19402-87-0	C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=CC=CC=C42	{33: 1, 2: 1, 14: 13}
Did not match all atoms present	19406-51-0	CC1=C(C=C(C=C1[N+](=O)[O-])N)[N+](=O)[O-]	{1: 1, 38: 2, 30: 1, 14: 2}
Did not match all atoms present	19406-86-1	CC1=C(C=C(C=C1)C(=O)N)N	{24: 1, 1: 1, 30: 2, 14: 3}
Did not match all atoms present	19407-28-4	CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C)C	{1: 5, 3: 1, 11: 5, 12: 1, 13: 2, 14: 3}
Did not match all atoms present	19407-42-2	CC(=O)NC1=C(C(=CC=C1)Cl)C(=O)O	{1: 1, 14: 3, 17: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	19408-74-3	C1=C2C(=C(C(=C1Cl)Cl)Cl)OC3=C(C(=C(C=C3O2)Cl)Cl)Cl	{17: 6, 14: 2, 23: 2}
Did not match all atoms present	1941-19-1	C[P+](C)(C)C.[Cl-]	{1: 4, 17: 1}
Did not match all atoms present	1941-24-8	C[N+](C)(C)C.[N+](=O)([O-])[O-]	{1: 4}
Did not match all atoms present	1941-26-0	CC[N+](CC)(CC)CC.[N+](=O)([O-])[O-]	{1: 4, 2: 4}
Did not match all atoms present	1941-27-1	CCCC[N+](CCCC)(CCCC)CCCC.[N+](=O)([O-])[O-]	{1: 4, 2: 12}
Did not match all atoms present	1941-30-6	CCC[N+](CCC)(CCC)CCC.[Br-]	{1: 4, 2: 8, 18: 1}
Did not match all atoms present	19413-36-6	CN(C)C(=S)S[Sn](C)(C)SC(=S)N(C)C	{40: 2, 1: 6, 33: 2, 7: 2}
Did not match all atoms present	19415-73-7	[SiH3][Te][SiH3]	{}
Did not match all atoms present	19415-86-2	C[As](=C)(C)C	{1: 3, 5: 1}
Did not match all atoms present	19416-70-7	C1=CC(=CC=C1C(=O)[O-])[N+](=O)[O-].[NH4+]	{24: 1, 38: 1, 14: 4}
Did not match all atoms present	1942-61-6	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=C=O	{8: 1, 34: 3, 29: 1, 14: 9}
Did not match all atoms present	19420-29-2	C1=CC=C(C=C1)OC2=CC3=CC=CC=C3C=C2	{22: 1, 14: 12}
Did not match all atoms present	19423-81-5	O.[Cl-].[Cl-].[Cl-].[Gd+3]	{17: 3}
Did not match all atoms present	19423-87-1	O.[Cl-].[Cl-].[Cl-].[Yb+3]	{17: 3}
Did not match all atoms present	19426-03-0	[C]#N.[C]#N.[C]#N.[C]#N.[Hg-2]	{}
Did not match all atoms present	19426-59-6	C/C(=C\C(=O)C)/[O-].C/C(=C\C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[K+].[Pt+2]	{24: 3, 1: 6, 6: 3, 7: 3}
Did not match all atoms present	19429-30-2	CC(C)(C)[Sn](C(C)(C)C)(Cl)Cl	{1: 6, 4: 2, 17: 2}
Did not match all atoms present	1943-11-9	CCCCCCCCC[N+](C)(C)C.[Br-]	{1: 4, 2: 8, 18: 1}
Did not match all atoms present	1943-79-9	CNC(=O)OC1=CC=CC=C1	{1: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	1943-82-4	C1=CC=C(C=C1)CCN=C=O	{8: 1, 2: 2, 34: 1, 29: 1, 14: 5}
Did not match all atoms present	1943-87-9	COC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	1943-95-9	C1CCC(CC1)C2=CC(=CC=C2)O	{11: 5, 12: 1, 21: 1, 14: 4}
Did not match all atoms present	1943-96-0	C1CC2CC1CC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O	{11: 4, 12: 2, 13: 1, 14: 8, 21: 2}
Did not match all atoms present	1943-97-1	C1CC2C(C1)C3CC2CC3(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O	{11: 5, 12: 4, 13: 1, 14: 8, 21: 2}
Did not match all atoms present	19433-86-4	COC1=CC(=C(C=C1)N)S(=O)(=O)[O-].[Na+]	{1: 1, 30: 1, 22: 1, 14: 3, 29: 3}
Did not match all atoms present	19433-93-3	CCN(CC)C1=C(C=CC(=C1)NC(=O)C)OC	{1: 4, 2: 2, 33: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	19433-94-4	CCN(CCC#N)C1=C(C=CC(=C1)NC(=O)C)OC	{1: 3, 2: 3, 37: 1, 33: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	19437-20-8	CC(C(=O)C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O	{1: 1, 3: 1, 33: 1, 14: 9, 24: 1, 25: 2}
Did not match all atoms present	19437-26-4	C1=CC=NC(=C1)C(=O)C2=CC=CC=N2	{24: 1, 35: 2, 14: 8}
Did not match all atoms present	19438-10-9	COC(=O)C1=CC(=CC=C1)O	{1: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	19438-61-0	CC1=CC2=C(C=C1)C(=O)OC2=O	{1: 1, 28: 2, 14: 3}
Did not match all atoms present	19438-85-8	C1CC(C1C2=NC(=NC(=N2)N)N)C3=NC(=NC(=N3)N)N	{35: 6, 11: 2, 12: 2, 30: 4}
Did not match all atoms present	1944-12-3	CC(CC1=CC=C(C=C1)O)NCC(C2=CC(=CC(=C2)O)O)O.Br	{1: 1, 2: 2, 3: 2, 14: 7, 18: 1, 20: 1, 21: 3, 31: 1}
Did not match all atoms present	19447-62-2	CC(=O)O[Hg]C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 34: 2, 28: 1, 14: 8, 33: 1}
Did not match all atoms present	194497-74-0	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OP(=O)(OC2=CC=CC(=C2)CCCCCCCCCCCCCCC)OC3=CC=CC(=C3)CCCCCCCCCCCCCCC	{1: 3, 2: 42, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	1945-32-0	C(CC[NH2+]CCC[NH3+])C[NH3+].C(CC[NH2+]CCC[NH3+])C[NH3+].OP(=O)([O-])[O-].OP(=O)([O-])[O-].OP(=O)([O-])[O-]	{2: 14, 20: 3, 29: 9}
Did not match all atoms present	1945-78-4	C1=CC=C2C(=C1)N=C(S2)CC3=NC4=CC=CC=C4S3	{41: 2, 2: 1, 35: 2, 14: 8}
Did not match all atoms present	1945-84-2	C#CC1=CC=CC=N1	{9: 1, 10: 1, 35: 1, 14: 4}
Did not match all atoms present	1945-92-2	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCO	{2: 2, 20: 1, 38: 2, 14: 3, 31: 1}
Did not match all atoms present	19455-20-0	CC(C)C(=O)[O-].[K+]	{24: 1, 1: 2, 3: 1}
Did not match all atoms present	19455-21-1	CCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 3}
Did not match all atoms present	19455-76-6	C(C(=O)[O-])C(=O)[O-].O.[Ca+2]	{24: 2, 2: 1}
Did not match all atoms present	19456-73-6	CC1=C(C=CC(=C1C)N(C)C)N=NC2=CC=[N+](C=C2)[O-]	{1: 4, 34: 2, 29: 1, 14: 6, 33: 2}
Did not match all atoms present	19456-74-7	CC1=C(C=CC(=C1)N=NC2=C(C=[N+](C=C2)[O-])C)N(C)C	{1: 4, 34: 2, 29: 1, 14: 6, 33: 2}
Did not match all atoms present	19456-75-8	CC1=CC(=C(C=C1N(C)C)C)N=NC2=CC=[N+](C=C2)[O-]	{1: 4, 34: 2, 29: 1, 14: 6, 33: 2}
Did not match all atoms present	19456-77-0	CC1=C[N+](=CC(=C1N=NC2=CC=C(C=C2)N(C)C)C)[O-]	{1: 4, 34: 2, 29: 1, 14: 6, 33: 2}
Did not match all atoms present	19458-95-8	COC(=O)C1=CC=CC2=C1C=CC=C2C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	194590-84-6	CC(=O)NC1=CC(=C(C=C1N2N=C3C(=CC(=C(C3=N2)Cl)N)Br)OC)N(CCOC)CCOC	{1: 4, 2: 4, 35: 2, 33: 2, 14: 3, 17: 1, 18: 1, 22: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	1946-74-3	CC(C)C1=C(C(=O)C=CC=C1)O	{1: 2, 3: 1, 21: 1, 14: 4, 25: 1}
Did not match all atoms present	19463-48-0	COC1=C(C(=CC(=C1)C=O)Cl)O	{1: 1, 14: 2, 17: 1, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	19464-55-2	CC(C)[Sn](C(C)C)(C(C)C)OC(=O)C	{1: 7, 3: 3, 28: 1}
Did not match all atoms present	19469-81-9	[Al-].[H].[H].[H].[H]	{}
Did not match all atoms present	1947-00-8	C1=CC=C(C=C1)COC(=O)NCCCCCC(=O)O	{2: 6, 27: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	1947-37-1	CSCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)N	{32: 1, 1: 1, 2: 5, 3: 4, 40: 1, 14: 10, 24: 4, 27: 1, 30: 2, 31: 3}
Did not match all atoms present	1947-62-2	CS(=O)(=O)OCC(C(COS(=O)(=O)C)O)O	{1: 2, 2: 2, 3: 2, 20: 2, 22: 2, 29: 4}
Did not match all atoms present	19471-12-6	C1=CC(=CC(=C1)N)CC2=CC(=CC=C2)N	{2: 1, 30: 2, 14: 8}
Did not match all atoms present	19471-27-3	CC1=[N+](C=C(C(=C1)N=NC2=CC=C(C=C2)N(C)C)C)[O-]	{1: 4, 34: 2, 29: 1, 14: 6, 33: 2}
Did not match all atoms present	19472-73-2	C1=CC=C(C=C1)NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)N(CCO)CCO)S(=O)(=O)O)S(=O)(=O)O.C(CO)N	{33: 2, 2: 10, 35: 6, 6: 2, 14: 16, 20: 7, 29: 4, 30: 1, 31: 4}
Did not match all atoms present	19472-74-3	C1=CC=C(C(=C1)CC#N)Br	{2: 1, 18: 1, 14: 4, 37: 1}
Did not match all atoms present	194725-26-3	CCCCCCCCOC(=O)C1=CC=CC=C1C	{1: 2, 2: 7, 28: 1, 14: 4}
Did not match all atoms present	19473-05-3	COC1=C(C=CC(=C1)C(O)S(=O)(=O)[O-])O.[Na+]	{1: 1, 3: 1, 14: 3, 20: 1, 21: 1, 22: 1, 29: 3}
Did not match all atoms present	19473-96-2	COC(=O)C1=CC=C(C=C1)C=CC(=O)O	{1: 1, 27: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	1948-33-0	CC(C)(C)C1=C(C=CC(=C1)O)O	{1: 3, 4: 1, 21: 2, 14: 3}
Did not match all atoms present	1948-92-1	C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{30: 1, 38: 1, 29: 2, 14: 8}
Did not match all atoms present	19480-43-4	CCCCOCCOC(=O)COC1=C(C=C(C=C1)Cl)C	{1: 2, 2: 6, 14: 3, 17: 1, 22: 2, 28: 1}
Did not match all atoms present	19482-05-4	CCCCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCCCC)[O-]	{1: 2, 2: 8, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	1949-07-1	CN1CCN(CC1)C(=O)CC(C2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl.Cl	{1: 1, 2: 1, 4: 1, 33: 2, 11: 4, 14: 12, 17: 4, 24: 1}
Did not match all atoms present	1949-45-7	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)N(C)C(=O)C)I	{1: 3, 33: 1, 19: 3, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	19493-25-5	CC[N+](CC)(CCO)CC1=CC=CC=C1.[Cl-]	{1: 2, 2: 5, 20: 1, 14: 5, 17: 1}
Did not match all atoms present	19493-44-8	C1=CC=C2C(=C1)C=CN=C2Cl	{17: 1, 35: 1, 14: 6}
Did not match all atoms present	19495-80-8	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ti+3].[Ti+3]	{29: 12}
Did not match all atoms present	19499-61-7	CNCC1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	195-06-2	C1=CC=C2C(=C1)C=CC3=C2C4=CC5=CC=CC=C5C=C4C=C3	{14: 14}
Did not match all atoms present	195-19-7	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4C=C3	{14: 12}
Did not match all atoms present	195-52-8	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)SC=C4	{41: 1, 14: 10}
Did not match all atoms present	195-84-6	C1=CC=C2C(=C1)C3=NC4=CC=CC=C4C5=NC6=CC=CC=C6C(=N2)N35	{33: 1, 35: 3, 14: 12}
Did not match all atoms present	1950-85-2	CS(=O)(=S)[O-].[Na+]	{1: 1, 29: 2}
Did not match all atoms present	19500-94-8	CC(=O)C1=CC(=C2C(=C1N)C(=O)C3=CC=CC=C3C2=O)N	{24: 1, 1: 1, 30: 2, 14: 5, 25: 2}
Did not match all atoms present	19506-85-5	CC(C)C(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O	{1: 2, 3: 2, 33: 1, 14: 4, 25: 2, 27: 1}
Did not match all atoms present	195071-87-5	[O-].[O-].[Tl+]	{}
Did not match all atoms present	1951-25-3	CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCCN(CC)CC)I	{1: 3, 2: 7, 33: 1, 14: 6, 19: 2, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	1951-56-0	CC(C)NC(=O)/C=C/C1=CC=C(O1)[N+](=O)[O-]	{1: 2, 3: 1, 38: 1, 6: 2, 14: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	19513-05-4	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.[Mn+3]	{24: 3, 1: 3}
Did not match all atoms present	19519-45-0	CC1=C(OC(=N1)C(C)C)C	{1: 4, 3: 1, 35: 1, 23: 1}
Did not match all atoms present	19519-71-2	CC1=C(C(=CC=C1)C)N=O	{1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	195190-88-6	C1C[C@@H]([C@@H](C[C@H]1C2=CC=CC=C2)CO)N	{2: 1, 11: 3, 12: 3, 14: 5, 20: 1, 30: 1}
Did not match all atoms present	1952-11-0	CN1CCC(CC1)OC(=O)C2(CCCC2)C3=CC=CC=C3.Cl	{1: 1, 33: 1, 11: 8, 12: 1, 13: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	1952-62-1	CCN(CC)CC(=O)NC1=CC2=C(C=C1)N(C3=CC=CC=C3S2)C	{1: 3, 2: 3, 33: 2, 41: 1, 14: 7, 24: 1, 31: 1}
Did not match all atoms present	19520-38-8	CC(=CC=CC1=CC=CC=C1)C(=O)C	{24: 1, 1: 2, 14: 5, 6: 3, 7: 1}
Did not match all atoms present	19520-88-8	CC(=O)OCCN(CC1=CC=CC=C1)CC2=CC=CC=C2	{1: 1, 2: 4, 28: 1, 14: 10, 33: 1}
Did not match all atoms present	19523-57-0	CCOC1=C(C2=CC=CC=C2C=C1)C=O	{1: 1, 2: 1, 26: 1, 22: 1, 14: 6}
Did not match all atoms present	19525-59-8	C1=CC=C(C=C1)NCC(=O)O.[K+]	{2: 1, 27: 1, 14: 5, 31: 1}
Did not match all atoms present	19526-81-9	C1=CC(=CC(=C1)S(=O)(=O)CCOS(=O)(=O)[O-])N/N=C/2\C=CC3=C(C2=O)C=CC=C3S(=O)(=O)[O-].[Na+].[Na+]	{2: 2, 34: 1, 14: 9, 15: 1, 22: 1, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	19529-00-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ru]	{14: 60}
Did not match all atoms present	19529-38-5	C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O.[Na+].[Na+].[Fe]	{33: 3, 2: 9, 27: 5}
Did not match all atoms present	19529-53-4	F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.[Pt]	{16: 12}
Did not match all atoms present	1953-54-4	C1=CC2=C(C=CN2)C=C1O	{32: 1, 21: 1, 14: 5}
Did not match all atoms present	1953-56-6	CS(=O)(=O)OC/C=C/COS(=O)(=O)C	{1: 2, 2: 2, 22: 2, 6: 2, 29: 4}
Did not match all atoms present	1953-99-7	C(#N)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C#N	{17: 4, 37: 2}
Did not match all atoms present	19542-77-9	CC(=O)N[C@@H](CSCC1=CC=CC=C1)C(=O)O	{1: 1, 2: 2, 3: 1, 40: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	19545-26-7	CC(=O)O[C@@H]1C[C@]2([C@@H](CCC2=O)C3=C1[C@]4([C@H](OC(=O)C5=COC(=C54)C3=O)COC)C)C	{1: 4, 2: 1, 11: 3, 12: 3, 13: 2, 14: 1, 15: 2, 22: 1, 23: 1, 25: 2, 28: 2}
Did not match all atoms present	19546-20-4	CCC(CC)(CC)CC1=C(C=C(C=C1)C(C)(C)C2=CC(=C(C=C2)O)CC(CC)(CC)CC)O	{1: 8, 2: 8, 4: 3, 21: 2, 14: 6}
Did not match all atoms present	19547-38-7	COC(=N)C1=CC=CC=N1	{1: 1, 35: 1, 36: 1, 7: 1, 14: 4, 22: 1}
Did not match all atoms present	1955-21-1	C1=C(C=C(C(=C1I)O)I)O	{19: 2, 21: 2, 14: 2}
Did not match all atoms present	1955-46-0	COC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]	{1: 1, 27: 1, 28: 1, 38: 1, 14: 3}
Did not match all atoms present	19550-60-8	CC1=CC(=C(C=C1)C)CCC(C)CCCC(C)C	{1: 5, 2: 5, 3: 2, 14: 3}
Did not match all atoms present	19552-67-1	CCCCOC(=O)CC[N+](C)(C)C.[I-]	{1: 4, 2: 5, 19: 1, 28: 1}
Did not match all atoms present	19559-54-7	CCC(=O)[O-].[Rb+]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	19559-59-2	C(C(=O)[O-])(Cl)Cl.[K+]	{24: 1, 17: 2, 3: 1}
Did not match all atoms present	19560-66-8	CN1CCCN(C2=CC=CC=C21)C	{1: 2, 11: 3, 14: 4, 33: 2}
Did not match all atoms present	19561-70-7	C1=C(OC(=C1)[N+](=O)[O-])/C=[N+](/CCO)\[O-]	{33: 1, 2: 2, 38: 1, 6: 1, 14: 2, 20: 1, 23: 1, 29: 1}
Did not match all atoms present	19562-30-2	CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCCC3)C(=O)O	{1: 1, 2: 1, 35: 2, 33: 2, 11: 4, 14: 2, 25: 1, 27: 1}
Did not match all atoms present	19564-40-0	CC1=CC=CC=C1CCC=O	{1: 1, 2: 2, 26: 1, 14: 4}
Did not match all atoms present	19567-78-3	O.O.O.O.O.O.[Na+].[Na+].Cl[Ir-2](Cl)(Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	19573-22-9	C1CCC(CC1)N=[N+]=[N-]	{34: 2, 11: 5, 12: 1}
Did not match all atoms present	19578-68-8	C1=CC=C(C=C1)COC2=CC=C(C=C2)I	{2: 1, 19: 1, 22: 1, 14: 9}
Did not match all atoms present	19579-46-5	CCOC1=CC=C(C=C1)N=C(N)N=C(N)N.Cl	{1: 1, 2: 1, 7: 2, 34: 2, 14: 4, 17: 1, 22: 1, 30: 3}
Did not match all atoms present	19583-15-4	O.[Co+2]	{}
Did not match all atoms present	19584-30-6	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Rh].[Rh].[Rh].[Rh]	{29: 12}
Did not match all atoms present	19585-43-4	[B-](F)(F)(F)F.C1COCCN1	{16: 4, 32: 1, 11: 4, 23: 1}
Did not match all atoms present	19588-08-0	CC(=O)C(C1=CC=CC=C1)C(=O)CC2=CC=CC=C2	{24: 2, 1: 1, 2: 1, 3: 1, 14: 10}
Did not match all atoms present	19589-59-4	CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 11, 29: 3, 14: 4}
Did not match all atoms present	19591-17-4	CC(=O)NC1=CC=CC=C1I	{24: 1, 1: 1, 19: 1, 14: 4, 31: 1}
Did not match all atoms present	19592-09-7	N#[O+].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Ru+2]	{17: 5, 29: 1}
Did not match all atoms present	19595-66-5	CC1=CC(=CC(=C1N(C)C)C)N=NC2=CC=[N+](C=C2)[O-]	{1: 4, 34: 2, 29: 1, 14: 6, 33: 2}
Did not match all atoms present	19597-96-7	CC(=O)OC1CC2=CC=CC=C2C1OC(=O)C	{1: 2, 11: 1, 12: 2, 14: 4, 28: 2}
Did not match all atoms present	19598-90-4	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Gd+3]	{}
Did not match all atoms present	195993-13-6	C1=CC2=C(C(=C1)C(=O)C3=CNC4=C3C=CC=C4C(=O)O)C(=CC=C2)C(=O)O	{24: 1, 32: 1, 27: 2, 14: 10}
Did not match all atoms present	196-28-1	C1=CC=C2C(=C1)C=CC3=CC4=C5C(=C32)C=CC6=CC=CC(=C65)C=C4	{14: 14}
Did not match all atoms present	196-42-9	C1=CC=C2C=C3C4=C5C(=CC3=CC2=C1)C=CC6=C5C(=CC=C6)C=C4	{14: 14}
Did not match all atoms present	196-45-2	C1=CC=C2C=C3C=C4C5=C6C(=CC4=CC3=CC2=C1)C=CC7=C6C(=CC=C7)C=C5	{14: 16}
Did not match all atoms present	196-62-3	C1=CC=C2C=C3C(=CC2=C1)C4=CC5=CC=CC=C5C=C4C6=CC7=CC=CC=C7C=C36	{14: 18}
Did not match all atoms present	196-64-5	C1=CC=C2C(=C1)C=CC3=C2C4=CC5=CC=CC=C5C=C4C6=CC=CC=C36	{14: 16}
Did not match all atoms present	196-78-1	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4C5=CC=CC=C35	{14: 14}
Did not match all atoms present	196-79-2	C1=CC=C2C(=C1)C=CC3=C2C4=C(C5=CC=CC=C35)N=CC=C4	{35: 1, 14: 13}
Did not match all atoms present	1961-02-0	C1=CC(=CC(=C1)[Hg]C2=CC=CC(=C2)F)F	{16: 2, 14: 8}
Did not match all atoms present	1961-96-2	C1=CC=C(C=C1)C2C=CC3=CC=CC=C23	{12: 1, 14: 11}
Did not match all atoms present	196109-17-8	C=COCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCOC=C)C(=O)OCCCCOC=C	{2: 12, 5: 3, 6: 3, 14: 3, 22: 3, 28: 3}
Did not match all atoms present	19614-16-5	CSC1=CC=CC=C1Br	{40: 1, 1: 1, 18: 1, 14: 4}
Did not match all atoms present	1962-08-9	CC(=C)C1=CC=C(C=C1)N	{1: 1, 30: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	1962-74-9	CCCOC(=O)C1=CC=C(C=C1)C(=O)OCCC	{1: 2, 2: 4, 28: 2, 14: 4}
Did not match all atoms present	1962-75-0	CCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCC	{1: 2, 2: 6, 28: 2, 14: 4}
Did not match all atoms present	19622-19-6	CCSC(=O)NCCC[NH+](C)C.[Cl-]	{1: 3, 2: 4, 40: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	19624-01-2	F[Zn+]	{16: 1}
Did not match all atoms present	19624-22-7	[B][B][B][B][B]	{}
Did not match all atoms present	1963-36-6	COC1=CC=C(C=C1)C=CC=O	{1: 1, 22: 1, 26: 1, 14: 4, 6: 2}
Did not match all atoms present	19634-89-0	CC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)C	{1: 2, 14: 12}
Did not match all atoms present	1964-45-0	CC1=CC2=C(C=C1)SC=C2C	{1: 2, 14: 4, 41: 1}
Did not match all atoms present	19648-85-2	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Mg+2]	{16: 12, 24: 2, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	19648-88-5	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.[Pb+2]	{16: 12, 24: 2, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	19649-68-4	C1=CC=C(C=C1)CCN(CCC#N)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl	{33: 1, 2: 4, 37: 1, 38: 1, 34: 2, 14: 12, 17: 1}
Did not match all atoms present	1965-09-9	C1=CC(=CC=C1O)OC2=CC=C(C=C2)O	{22: 1, 21: 2, 14: 8}
Did not match all atoms present	1965-81-7	C1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O)NC6=CC=CC7=C6C(=O)C8=CC=CC=C8C7=O	{25: 4, 35: 3, 22: 1, 14: 19, 31: 2}
Did not match all atoms present	1965-82-8	C1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O)OC6=CC=CC=C6	{25: 2, 35: 3, 22: 2, 14: 17, 31: 1}
Did not match all atoms present	19650-79-4	[OH-].[Cu+2]	{}
Did not match all atoms present	19651-81-1	Cl[Pd+]	{17: 1}
Did not match all atoms present	19652-32-5	C1=C(C=C(C(=C1Br)O)C=O)Cl	{17: 1, 18: 1, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	196521-82-1	CC1=CC(=C(C=C1)[O-])N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=NC4=C(C=CC(=C4)C)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+].[K+].[K+]	{1: 2, 34: 4, 14: 12, 6: 2, 29: 6}
Did not match all atoms present	19655-56-2	CCC1=CC=CC2=C1N=CC=C2	{1: 1, 2: 1, 35: 1, 14: 6}
Did not match all atoms present	19655-60-8	CCC1=CC2=C(C=C1)N=CC=C2	{1: 1, 2: 1, 35: 1, 14: 6}
Did not match all atoms present	1966-58-1	CNC(=O)OCC1=CC(=C(C=C1)Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	1966-65-0	CCC(C)(C#CC1=CC=CC=C1)O	{1: 2, 2: 1, 4: 1, 10: 2, 14: 5, 20: 1}
Did not match all atoms present	19660-77-6	CCC1=C2C=C3C(=C(C(=N3)C(=C4[C@H]([C@@H](C(=N4)C=C5C(=C(C(=CC(=C1C)N2)N5)C=C)C)C)CCC(=O)O)CC(=O)O)C(=O)O)C	{32: 2, 1: 5, 2: 4, 35: 2, 5: 1, 6: 1, 12: 2, 14: 3, 27: 3}
Did not match all atoms present	19666-30-9	CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl	{1: 5, 3: 1, 4: 1, 33: 1, 14: 2, 17: 2, 35: 1, 22: 1, 28: 1}
Did not match all atoms present	1967-16-4	CC(C#C)OC(=O)NC1=CC(=CC=C1)Cl	{1: 1, 3: 1, 9: 1, 10: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	1967-25-5	C1=CC(=CC=C1NC(=O)N)Br	{24: 1, 18: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	1967-99-3	CC1=C2CCCCC2=NN1	{32: 1, 1: 1, 11: 4, 35: 1}
Did not match all atoms present	196707-32-1	CC(C)(C)OC(=O)N[C@H](C1=CC=C(C=C1)F)C(=O)[O-]	{1: 3, 3: 1, 4: 1, 14: 4, 16: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	19675-63-9	C1=CC(=CC=C1C=CC(=O)O)C(=O)O	{27: 2, 14: 4, 6: 2}
Did not match all atoms present	19689-86-2	COC1=CC=CC(=C1CBr)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 18: 1, 22: 1}
Did not match all atoms present	1969-73-9	C1=CC=C(C(=C1)CC=O)[N+](=O)[O-]	{2: 1, 38: 1, 26: 1, 14: 4}
Did not match all atoms present	19692-45-6	CC(C)(C)C1=CC=C(C=C1)CCl	{1: 3, 2: 1, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	19694-02-1	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)O	{27: 1, 14: 9}
Did not match all atoms present	19694-10-1	C1=CC(=C(C=C1C(=O)N)N)Cl	{24: 1, 17: 1, 30: 2, 14: 3}
Did not match all atoms present	196965-94-3	CCN1/C(=C\C(=C2C(=O)N(C(=O)N(C2=O)CCOC)CCOC)/C=C\3/N(C4=C(S3)C=CC5=CC=CC=C54)CC)/SC6=C1C7=CC=CC=C7C=C6.Cl	{1: 4, 2: 6, 33: 4, 6: 2, 7: 1, 41: 2, 14: 12, 15: 3, 17: 1, 22: 2, 25: 3}
Did not match all atoms present	197-61-5	C1=CC=C2C(=C1)C3=C4C2=C5C=CC=C6C5=C(C4=CC=C3)C7=CC=CC=C76	{14: 14}
Did not match all atoms present	197-69-3	C1=CC=C2C3=C4C(=CC=C3)C5=CC=CC6=C5C(=CC7=CC=CC=C67)C4=CC2=C1	{14: 16}
Did not match all atoms present	197-73-9	C1=CC=C2C=C3C4=C5C(=CC=C4)C6=CC7=CC8=CC=CC=C8C=C7C9=C6C(=CC=C9)C5=CC3=CC2=C1	{14: 20}
Did not match all atoms present	197-74-0	C1=CC=C2C3=C4C(=CC=C3)C5=CC6=CC=CC=C6C7=C5C(=CC=C7)C4=CC2=C1	{14: 16}
Did not match all atoms present	197013-45-9	CC(C)OC(=O)[C@H]([C@@H](C(=O)OC(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 10, 3: 4, 28: 2, 22: 2}
Did not match all atoms present	19704-60-0	CCCCCC(=O)O[Sn](CCCC)(CCCC)OC(=O)CCCCC	{1: 4, 2: 14, 28: 2}
Did not match all atoms present	19704-83-7	CCCCCC=CCC=CCCCCCCCC(=O)[O-].CCCCCC=CCC=CCCCCCCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 24, 6: 8}
Did not match all atoms present	19706-58-2	CCCCCCCCCCCCCCCCOC(=O)C=CC(=O)O[Sn](CCCC)(CCCC)OC(=O)C=CC(=O)OCCCCCCCCCCCCCC	{1: 4, 2: 34, 28: 4, 6: 4}
Did not match all atoms present	19708-81-7	COC(=S)SC	{40: 1, 1: 2, 22: 1, 7: 1}
Did not match all atoms present	19709-52-5	[H-].[H-].[Li+]	{}
Did not match all atoms present	1971-46-6	CC1=C(N(C2=CC=CC=C12)C)C	{1: 3, 14: 4, 33: 1}
Did not match all atoms present	19714-73-9	CC1=CC=CC(=C1)C2CC2	{1: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	19715-19-6	CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)(C)C	{1: 6, 27: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	19716-21-3	CC1=CC2=C(C=CN=C2C(=C1)C)C=CC3=CC=C(C=C3)N(C)C	{1: 4, 35: 1, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	19716-56-4	C1CNC(C2=CC=CC=C21)CC3=CC=CC=C3	{32: 1, 2: 1, 11: 2, 12: 1, 14: 9}
Did not match all atoms present	19716-78-0	CCCCCCCCCC(=O)NCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(C)C(=O)NC(C)C(=O)OC	{32: 1, 1: 4, 2: 10, 3: 3, 14: 5, 24: 4, 28: 1, 31: 4}
Did not match all atoms present	19717-79-4	C1=CC2=C3NC(=C2C=C1)NC4=C5C=CC=CC5=C6N4[Ga](N7C(=C8C=CC=CC8=C7NC9=C1C=CC=CC1=C(N9)N6)N3)Cl	{32: 6, 17: 1, 14: 16, 33: 2}
Did not match all atoms present	19717-98-7	[H+].[H+].[H+].[H+].[H+].C1=CC(=C(C=C1[N+](=O)[O-])N/N=C\2/C(=O)C3=C(C=C(C=C3C=C2S(=O)(=O)O)S(=O)(=O)O)N)O.C1=CC(=C(C=C1[N+](=O)[O-])N/N=C\2/C(=O)C3=C(C=C(C=C3C=C2S(=O)(=O)O)S(=O)(=O)O)N)O.[Cr]	{34: 2, 38: 2, 14: 12, 15: 4, 20: 4, 21: 2, 25: 2, 29: 8, 30: 2, 31: 2}
Did not match all atoms present	19718-45-7	CCCOC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 2, 22: 1, 14: 7}
Did not match all atoms present	19719-28-9	C1=CC(=C(C=C1Cl)Cl)CC(=O)O	{17: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	1972-08-3	CCCCCC1=CC2=C([C@@H]3C=C(CC[C@H]3C(O2)(C)C)C)C(=C1)O	{1: 4, 2: 4, 11: 2, 12: 2, 13: 1, 14: 3, 15: 1, 21: 1, 23: 1}
Did not match all atoms present	19720-42-4	CC(C)CC(C)NC1=C2C(=C(C=C1)NC(C)CC(C)C)C(=O)C3=CC=CC=C3C2=O	{1: 6, 2: 2, 3: 4, 14: 6, 25: 2, 31: 2}
Did not match all atoms present	19721-74-5	C(C(S(=O)(=O)C(CCl)Cl)Cl)Cl	{17: 4, 2: 2, 3: 2, 29: 2}
Did not match all atoms present	197251-71-1	CS(=O)(=O)C1=CC(=C(C=C1)C(C=O)C=O)[N+](=O)[O-]	{1: 1, 3: 1, 38: 1, 14: 3, 26: 2, 29: 2}
Did not match all atoms present	19727-83-4	C1CNC2=C1C=CC(=C2)[N+](=O)[O-]	{32: 1, 11: 2, 38: 1, 14: 3}
Did not match all atoms present	19728-41-7	CC(C)(C)C1=CC=CC=C1S	{1: 3, 4: 1, 14: 4, 39: 1}
Did not match all atoms present	19728-43-9	CC(C)(C)C1=CC(=C(C=C1)S)C(C)(C)C	{1: 6, 4: 2, 14: 3, 39: 1}
Did not match all atoms present	19728-63-3	C[C@H]([C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1)O	{1: 1, 2: 1, 3: 2, 14: 5, 20: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1973-05-3	C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=CC=C3)NC4=CC=CC=C4	{35: 3, 14: 15, 31: 3}
Did not match all atoms present	1973-09-7	C1=CC=C(C=C1)NC2=NC(=NC(=N2)Cl)NC3=CC=CC=C3	{17: 1, 35: 3, 14: 10, 31: 2}
Did not match all atoms present	1973-22-4	CCC1=CC=CC=C1Br	{1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	19735-89-8	CC1=CC(=O)N(N1)C2=CC=CC=C2	{32: 1, 1: 1, 33: 1, 14: 6, 25: 1}
Did not match all atoms present	19740-00-2	C1=CC=C(C=C1)CCCCCCCCCCCCCCCCCC(=O)O	{2: 17, 27: 1, 14: 5}
Did not match all atoms present	19748-58-4	COC1=CC=CC(=C1)C2=NN=C(O2)C3=CC(=CC=C3)OC	{1: 2, 35: 2, 22: 2, 14: 8, 23: 1}
Did not match all atoms present	1975-44-6	C1=CC2=C(C=CC=C2[N+](=O)[O-])C(=C1)C(=O)O	{27: 1, 38: 1, 14: 6}
Did not match all atoms present	1975-50-4	CC1=C(C=CC=C1[N+](=O)[O-])C(=O)O	{1: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	1975-52-6	CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O	{1: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	19750-95-9	CC1=C(C=CC(=C1)Cl)N=CN(C)C.Cl	{1: 3, 34: 1, 6: 1, 33: 1, 14: 3, 17: 2}
Did not match all atoms present	19752-09-1	C1=CC(=C(C=C1CN=C=O)Cl)Cl	{2: 1, 8: 1, 34: 1, 14: 3, 17: 2, 29: 1}
Did not match all atoms present	19752-55-7	C1=C(C=C(C=C1Cl)Br)Cl	{17: 2, 18: 1, 14: 3}
Did not match all atoms present	19753-69-6	CC(C)[Si](=[Si](C(C)C)C(C)C)C(C)C	{1: 8, 3: 4}
Did not match all atoms present	19755-53-4	C1=CC(=C(N=C1)Br)[N+](=O)[O-]	{18: 1, 35: 1, 38: 1, 14: 3}
Did not match all atoms present	19756-04-8	C[N-]C.C[N-]C.C[N-]C.C[N-]C.[Zr+4]	{1: 8, 34: 4}
Did not match all atoms present	19756-52-6	CCC(C)C1=CC(=C(C=C1)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N)C(C)CC	{1: 4, 2: 2, 3: 2, 14: 8, 21: 1, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	1976-28-9	C1=CC(=CN=C1)C(=O)[O-].C1=CC(=CN=C1)C(=O)[O-].C1=CC(=CN=C1)C(=O)[O-].[Al+3]	{24: 3, 35: 3, 14: 12}
Did not match all atoms present	19763-77-0	C[N+]1(CCC23[C@@H]4C(=O)C=C[C@@]2([C@H]1CC5=C3[C@H](O4)C(C=C5)OC)O)[O-]	{1: 2, 11: 3, 12: 4, 13: 2, 14: 4, 15: 2, 20: 1, 22: 1, 23: 1, 25: 1, 29: 1}
Did not match all atoms present	19764-96-6	CC1(C2=CC=CC=C2[N+](=C1C=CC=CC=CC=C3C(C4=CC=CC=C4N3C)(C)C)C)C.[I-]	{1: 6, 6: 7, 33: 2, 13: 2, 14: 8, 15: 2, 19: 1}
Did not match all atoms present	19766-54-2	CN(C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2	{1: 2, 33: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	19766-89-3	CCCCC(CC)C(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 4, 3: 1}
Did not match all atoms present	19767-45-4	C(CS(=O)(=O)[O-])S.[Na+]	{2: 2, 29: 3, 39: 1}
Did not match all atoms present	19768-02-6	C1=CC=C(C=C1)C2=NON=C2C3=CC=CC=C3	{35: 2, 14: 10, 23: 1}
Did not match all atoms present	1977-10-2	CN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)Cl	{1: 1, 35: 1, 33: 2, 11: 4, 14: 7, 15: 1, 17: 1, 23: 1}
Did not match all atoms present	1977-11-3	CN1CCN(CC1)C2=NC3=CC=CC=C3CC4=CC=CC=C42	{1: 1, 35: 1, 33: 2, 11: 5, 14: 8, 15: 1}
Did not match all atoms present	1977-37-3	CCCS(=O)(=O)C	{1: 2, 2: 2, 29: 2}
Did not match all atoms present	19770-75-3	CCN(CC)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2	{1: 2, 2: 2, 33: 1, 14: 9, 29: 2, 31: 1}
Did not match all atoms present	19774-82-4	CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCCN(CC)CC)I.Cl	{1: 3, 2: 7, 33: 1, 14: 6, 17: 1, 19: 2, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	19779-06-7	CCCCCC[O-].[Na+]	{1: 1, 2: 5, 29: 1}
Did not match all atoms present	1978-04-7	C1(=C(C(=C(C(=C1F)F)F)F)C(F)(F)F)C(F)(F)F	{16: 10, 4: 2}
Did not match all atoms present	19782-68-4	C[N-]C.C[N-]C.C[N-]C.C[N-]C.[Hf+4]	{1: 8, 34: 4}
Did not match all atoms present	19783-14-3	O.O.[Pb]	{}
Did not match all atoms present	19788-35-3	CC1=CC(=NO1)C(=O)OC	{1: 2, 35: 1, 28: 1, 14: 1, 23: 1}
Did not match all atoms present	19788-37-5	CC1=C(C(=NO1)C)CCl	{1: 2, 2: 1, 23: 1, 35: 1, 17: 1}
Did not match all atoms present	19789-69-6	C1=CC2=C(C=C[N+](=C2C(=C1)F)[O-])[N+](=O)[O-]	{16: 1, 33: 1, 38: 1, 29: 1, 14: 5}
Did not match all atoms present	1979-36-8	CC(=O)C1=C(C=CC(=C1)F)F	{16: 2, 1: 1, 14: 3, 24: 1}
Did not match all atoms present	19794-93-5	C1CN(CCN1CCCN2C(=O)N3C=CC=CC3=N2)C4=CC(=CC=C4)Cl	{33: 4, 2: 3, 35: 1, 11: 4, 14: 8, 17: 1, 25: 1}
Did not match all atoms present	19798-94-8	CC1(CCNCO1)C2=CC=CC=C2	{32: 1, 1: 1, 11: 3, 13: 1, 14: 5, 23: 1}
Did not match all atoms present	19799-42-9	C1=CC=C(C=C1)C2=C(SC(=C2C3=CC=CC=C3)C(=O)O)C(=O)O	{41: 1, 27: 2, 14: 10}
Did not match all atoms present	198-46-9	C1=CC=C2C(=C1)C=C3C4=CC=CC4=CC5=C3C2=CC=C5	{14: 12}
Did not match all atoms present	198-55-0	C1=CC2=C3C(=C1)C4=CC=CC5=C4C(=CC=C5)C3=CC=C2	{14: 12}
Did not match all atoms present	198-96-9	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C5=CC=CC=C5N4	{32: 1, 14: 12}
Did not match all atoms present	1980-93-4	CC1(C2=CC=CC=C2NC1=CC=C3C=CC(=O)C=C3)C	{32: 1, 1: 2, 6: 2, 13: 1, 14: 8, 15: 2, 25: 1}
Did not match all atoms present	19806-17-8	C1=CC(=CC(=C1)CC(=O)O)CC(=O)O	{2: 2, 27: 2, 14: 4}
Did not match all atoms present	19808-30-1	C1=C(C(=O)NC=N1)Br	{32: 1, 25: 1, 18: 1, 35: 1, 14: 2}
Did not match all atoms present	1981-38-0	C1=CC=C(C=C1)C2=CC3=CC4=CC=CC=C4C=C3C=C2	{14: 14}
Did not match all atoms present	1981-58-4	CC1=CC(=NC(=N1)[N-]S(=O)(=O)C2=CC=C(C=C2)N)C.[Na+]	{1: 2, 34: 1, 35: 2, 14: 5, 29: 2, 30: 1}
Did not match all atoms present	19810-31-2	C1=CC=C(C=C1)COCC(=O)Cl	{24: 1, 17: 1, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	19812-93-2	C1=CC(=CC=C1C#N)C2=CC=C(C=C2)O	{21: 1, 14: 8, 37: 1}
Did not match all atoms present	198126-85-1	CCN1C[C@@]2(CC[C@@H](C34[C@@H]2CC(C31)C56[C@H]4C[C@@H]([C@H](C5)C(=C)[C@H]6O)O)OC(=O)C7=CC=CC=C7)C	{1: 2, 2: 1, 5: 1, 33: 1, 11: 6, 12: 8, 13: 3, 14: 5, 15: 1, 20: 2, 28: 1}
Did not match all atoms present	19814-71-2	CC1=CC(=CC=C1)OC2=CC=CC(=C2)C	{1: 2, 22: 1, 14: 8}
Did not match all atoms present	19814-75-6	CC1(C2=CC=CC=C2OC3=CC=CC=C31)C	{1: 2, 13: 1, 14: 8, 23: 1}
Did not match all atoms present	19816-88-7	CC1=CC=C(C=C1)S(=O)(=O)NN=C(CC2=CC=CC=C2)CC3=CC=CC=C3	{1: 1, 2: 2, 7: 1, 34: 1, 14: 14, 29: 2, 31: 1}
Did not match all atoms present	19819-95-5	C1=CC=C(C(=C1)CCO)Cl	{17: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	19819-98-8	CC1=CC=CC=C1CCO	{1: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	1982-36-1	C[NH+]1CCC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.[Cl-].[Cl-]	{11: 5, 1: 1, 3: 1, 14: 9, 17: 3}
Did not match all atoms present	1982-37-2	CN1CCC(C1)CN2C3=CC=CC=C3SC4=CC=CC=C42	{1: 1, 2: 1, 33: 2, 41: 1, 11: 3, 12: 1, 14: 8}
Did not match all atoms present	1982-47-4	CN(C)C(=O)NC1=CC=C(C=C1)OC2=CC=C(C=C2)Cl	{1: 2, 33: 1, 14: 8, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	1982-67-8	CS(=N)(=O)CCC(C(=O)O)N	{1: 1, 2: 2, 3: 1, 36: 1, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	1982-69-0	COC1=C(C=CC(=C1C(=O)[O-])Cl)Cl.[Na+]	{24: 1, 1: 1, 22: 1, 14: 2, 17: 2}
Did not match all atoms present	19824-55-6	CC[N-]CC.CC[N-]CC.CC[N-]CC.CC[N-]CC.[Hf+4]	{1: 8, 2: 8, 34: 4}
Did not match all atoms present	19824-56-7	C[N-]C.C[N-]C.C[N-]C.C[N-]C.[V+4]	{1: 8, 34: 4}
Did not match all atoms present	19824-58-9	C[N-]C.C[N-]C.C[N-]C.C[N-]C.C[N-]C.[Nb+5]	{1: 10, 34: 5}
Did not match all atoms present	19824-59-0	C[N-]C.C[N-]C.C[N-]C.C[N-]C.C[N-]C.[Ta+5]	{1: 10, 34: 5}
Did not match all atoms present	19824-89-6	C1CN(CCN1CCCN2C3=CC=CC=C3SC4=CC(=CN=C42)Cl)CCO.Cl.Cl	{33: 3, 2: 5, 35: 1, 41: 1, 11: 4, 14: 6, 17: 3, 20: 1}
Did not match all atoms present	19829-31-3	CCC(=O)C1=CC(=CC=C1)Br	{24: 1, 1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	19829-72-2	C1=CC(=C(C(=C1C(=O)O)O)O)C(=O)O	{27: 2, 21: 2, 14: 2}
Did not match all atoms present	1983-26-2	C(P(=O)(Cl)Cl)Cl	{17: 3, 2: 1, 29: 1}
Did not match all atoms present	1983-34-2	CN1C(=O)CC(=O)N(C1=O)C2=CC(=CC=C2)Cl	{1: 1, 33: 2, 11: 1, 14: 4, 17: 1, 25: 3}
Did not match all atoms present	1983-41-1	CN1C=C[N+](=C1N=NC2=CC=C(C=C2)N)C.COS(=O)(=O)[O-]	{1: 3, 34: 2, 33: 2, 14: 6, 22: 1, 29: 3, 30: 1}
Did not match all atoms present	1983-95-5	COC1=C(C=C(C=C1)[N+](=O)[O-])[N+]#[C-]	{1: 1, 34: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	19831-37-9	CCCCCOC(CN1CCCCC1)C2=CC=CC=C2.Cl	{1: 1, 2: 5, 3: 1, 33: 1, 11: 5, 14: 5, 17: 1, 22: 1}
Did not match all atoms present	19832-98-5	CC1CCC(=O)C2=CC=CC=C12	{1: 1, 11: 2, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	19833-96-6	COC(=O)C(C1CCCC1)(C2=CC=CC=C2)O	{1: 1, 4: 1, 11: 4, 12: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	19834-02-7	C1CCC(CC1)N.OS(=O)(=O)O	{20: 2, 11: 5, 12: 1, 29: 2, 30: 1}
Did not match all atoms present	19838-08-5	CC1=NC=CN=C1N	{1: 1, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	1984-04-9	[C-]#[N+]C1=CC=CC2=CC=CC=C21	{34: 1, 14: 7}
Did not match all atoms present	1984-06-1	CCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 6}
Did not match all atoms present	1984-15-2	C(P(=O)(O)O)P(=O)(O)O	{2: 1, 20: 4, 29: 2}
Did not match all atoms present	1984-23-2	[C-]#[N+]C1=CC=C(C=C1)[N+](=O)[O-]	{34: 1, 38: 1, 14: 4}
Did not match all atoms present	1984-58-3	COC1=C(C=CC(=C1)Cl)Cl	{1: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	1984-59-4	COC1=C(C(=CC=C1)Cl)Cl	{1: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	1984-65-2	COC1=C(C=CC=C1Cl)Cl	{1: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	1984-87-8	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OCC[NH+](CCO)CCO.[Cl-]	{2: 6, 3: 1, 14: 10, 17: 1, 20: 2, 28: 1}
Did not match all atoms present	19840-99-4	CC1=CC(=O)NC2=C1C=CC(=C2)N	{32: 1, 1: 1, 30: 1, 14: 4, 25: 1}
Did not match all atoms present	19841-73-7	C1CNCCC1C(C2=CC=CC=C2)C3=CC=CC=C3	{11: 4, 32: 1, 3: 1, 12: 1, 14: 10}
Did not match all atoms present	19842-76-3	C1=C(C(=C(C(=C1F)F)C=O)F)F	{16: 4, 26: 1, 14: 1}
Did not match all atoms present	19845-69-3	C1=CC=C(C=C1)P(CCCCCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 6, 14: 20}
Did not match all atoms present	19846-06-1	CCCC(C1=CC=CC=C1)(C(=O)OCC)C(=O)OCC	{1: 3, 2: 4, 4: 1, 14: 5, 28: 2}
Did not match all atoms present	19847-12-2	C1=CN=C(C=N1)C#N	{35: 2, 37: 1, 14: 3}
Did not match all atoms present	1985-12-2	C1=CC(=CC=C1N=C=S)Br	{8: 1, 18: 1, 34: 1, 14: 4}
Did not match all atoms present	1985-57-5	CCCC(C)(C)C1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 14: 5}
Did not match all atoms present	1985-59-7	CC1(CCCC2=CC=CC=C21)C	{1: 2, 11: 3, 13: 1, 14: 4}
Did not match all atoms present	1985-96-2	CC(C)(CC1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 1, 4: 1, 14: 10}
Did not match all atoms present	1985-97-3	CCC(C)(CC)C1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 14: 5}
Did not match all atoms present	19851-61-7	C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3	{2: 2, 28: 2, 14: 14}
Did not match all atoms present	19851-68-4	CC(C)[N-]C(C)C.CC(C)[N-]C(C)C.CC(C)[N-]C(C)C.[Cr+3]	{1: 12, 34: 3, 3: 6}
Did not match all atoms present	19853-09-9	C1=CC=C(C=C1)C2=CC=CC=C2CBr	{2: 1, 18: 1, 14: 9}
Did not match all atoms present	19853-79-3	CC1=C(C=CC(=C1Cl)N)Cl	{1: 1, 30: 1, 14: 2, 17: 2}
Did not match all atoms present	198545-46-9	C1=CC=C(C(=C1)C[C@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)F	{2: 2, 3: 1, 12: 1, 14: 12, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	198545-72-1	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC(=CC=C4)F)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	198545-76-5	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=C(C=C4)Br)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	198560-68-8	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC(=CC=C4)F)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	198561-04-5	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=C(C=C4)Br)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	198561-07-8	C#CC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{2: 2, 3: 1, 9: 1, 10: 1, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	1986-00-1	C1=CC=C2C(=C1)C3=C(C2=O)C=CC=C3O	{25: 1, 21: 1, 14: 7}
Did not match all atoms present	1986-81-8	C1=CC(=C[N+](=C1)[O-])C(=O)N	{24: 1, 33: 1, 30: 1, 29: 1, 14: 4}
Did not match all atoms present	1986-89-6	CCCCCCCCS(=O)CCCCCCCC	{1: 2, 2: 14, 29: 1}
Did not match all atoms present	1986-90-9	CCCCCS(=O)CCCCC	{1: 2, 2: 8, 29: 1}
Did not match all atoms present	198625-33-1	CC1=CC(=C(C=C1)C)C(=O)C2=CC3=C(C=C2)C(=O)C(=C4C(=CC5=CC=CC=C5N4)O)C3=O	{32: 1, 1: 2, 14: 11, 15: 3, 20: 1, 24: 1, 25: 2}
Did not match all atoms present	19864-71-2	C[N+](C)(CCCN1C2=CC=CC=C2CCC3=CC=CC=C31)[O-].Cl	{1: 2, 2: 3, 33: 1, 11: 2, 14: 8, 17: 1, 29: 1}
Did not match all atoms present	19865-30-6	C=CCOCC(COP(OCC(COCC=C)Cl)OCC(COCC=C)Cl)Cl	{2: 9, 3: 3, 5: 3, 6: 3, 17: 3, 22: 6}
Did not match all atoms present	19868-02-1	C1=CN=C(N=C1)N.Cl	{17: 1, 35: 2, 30: 1, 14: 3}
Did not match all atoms present	1987-50-4	CCCCCCCC1=CC=C(C=C1)O	{1: 1, 2: 6, 21: 1, 14: 4}
Did not match all atoms present	19872-93-6	COC1=CC(=NC(=C1)C(=O)OC)C(=O)OC	{1: 3, 35: 1, 28: 2, 22: 1, 14: 2}
Did not match all atoms present	19875-60-6	CCN(CC)C(=O)N[C@@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C.C(=C\C(=O)O)\C(=O)O	{32: 1, 1: 3, 2: 2, 6: 2, 33: 2, 11: 2, 12: 2, 14: 5, 15: 1, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	19879-06-2	C[C@@H]1[C@@]2([C@@H](C[C@H](O1)C3=C2C(=O)C4=C(C3=O)C(=C5[C@H]6[C@H](CC(=O)O6)OC(C5=C4O)C)O)O)O	{1: 2, 11: 2, 12: 6, 13: 1, 15: 2, 20: 2, 21: 2, 23: 2, 25: 2, 28: 1}
Did not match all atoms present	19879-97-1	CC=CO[Si](C)(C)C	{1: 4, 22: 1, 6: 2}
Did not match all atoms present	1988-88-1	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C#N	{1: 6, 4: 2, 21: 1, 14: 2, 37: 1}
Did not match all atoms present	1988-89-2	CC(C1=CC=CC=C1)C2=CC=C(C=C2)O	{1: 1, 3: 1, 21: 1, 14: 9}
Did not match all atoms present	19881-18-6	C1=CC(=CC=C1N=C=S)OC2=CC=C(C=C2)[N+](=O)[O-]	{8: 1, 34: 1, 38: 1, 22: 1, 14: 8}
Did not match all atoms present	19882-03-2	CCC12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2O)O)CCC4=C3C=CC(=C4)O	{1: 1, 2: 1, 11: 5, 12: 5, 13: 1, 14: 3, 20: 2, 21: 1}
Did not match all atoms present	19883-57-9	C1=CC(=CC=C1[C@@H](C(=O)O)N)F	{16: 1, 27: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	198830-41-0	[O-].[Ti+2]	{}
Did not match all atoms present	198830-43-2	[OH-].[OH-].[Ti+3]	{}
Did not match all atoms present	198830-58-9	[Ni+4].[OH-].[OH-].[OH-]	{}
Did not match all atoms present	1989-33-9	C1=CC=C2C(=C1)C(C3=CC=CC=C32)C(=O)O	{27: 1, 12: 1, 14: 8}
Did not match all atoms present	1989-53-3	COC1=C(C(=CC=C1)OC)C(=O)Cl	{24: 1, 1: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	19895-44-4	CC(C)NC(=O)NC1=CC=CC=C1	{24: 1, 1: 2, 3: 1, 14: 5, 31: 2}
Did not match all atoms present	19899-80-0	C1(=NC(=O)N=C(N1)N[N+](=O)[O-])N[N+](=O)[O-]	{32: 1, 25: 1, 35: 2, 38: 2, 31: 2}
Did not match all atoms present	1990-11-0	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)/C=C/C5=CC=CC=C5)C)C	{1: 5, 2: 3, 3: 2, 6: 2, 11: 8, 12: 5, 13: 2, 14: 6, 15: 1, 28: 1}
Did not match all atoms present	1990-34-7	CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]	{32: 1, 1: 1, 2: 1, 3: 1, 38: 1, 14: 9, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	1990-90-5	CC1=C(C=CN=C1)N	{1: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	19900-65-3	CCC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)CC)N	{1: 2, 2: 3, 30: 2, 14: 6}
Did not match all atoms present	19900-69-7	CC(C)C1=CC(=CC(=C1N)C(C)C)CC2=CC(=C(C(=C2)C(C)C)N)C(C)C	{1: 8, 2: 1, 3: 4, 30: 2, 14: 4}
Did not match all atoms present	19900-84-6	COCN=C=S	{8: 1, 1: 1, 2: 1, 34: 1, 22: 1}
Did not match all atoms present	19901-15-6	[2H]C([2H])([2H])C=O	{1: 1, 26: 1}
Did not match all atoms present	19909-44-5	C1=CC=C(C=C1)C(=O)C(=O)C(=O)C(=O)C2=CC=CC=C2	{24: 4, 14: 10}
Did not match all atoms present	19909-64-9	CC1=CC=C(C=C1)C(=O)C(=O)C(=O)C(=O)C2=CC=C(C=C2)C	{24: 4, 1: 2, 14: 8}
Did not match all atoms present	19909-65-0	CC1=CC(=C(C(=C1)C)C(=O)C(=O)C(=O)C(=O)C2=C(C=C(C=C2C)C)C)C	{24: 4, 1: 6, 14: 4}
Did not match all atoms present	19910-65-7	CCC(C)OC(=O)OOC(=O)OC(C)CC	{1: 4, 2: 2, 3: 2}
Did not match all atoms present	199116-08-0	CC(C)OP(=O)(C)O[Si](C)(C)C	{1: 6, 3: 1, 29: 1, 22: 2}
Did not match all atoms present	1992-48-9	CC(C)O[Si](OC(C)C)(OC(C)C)OC(C)C	{1: 8, 3: 4, 22: 4}
Did not match all atoms present	19924-43-7	COC1=CC=CC(=C1)CC#N	{1: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	19926-22-8	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C(=C32)C=O)C=O	{26: 2, 14: 10}
Did not match all atoms present	199277-69-5	CCCCCCC(CCCCCCCCCCC(=O)OCC(CC)CCCC)OC(=O)C1=CC=CC=C1	{1: 3, 2: 20, 3: 2, 28: 2, 14: 5}
Did not match all atoms present	1993-03-9	B(C1=CC=CC=C1F)(O)O	{16: 1, 20: 2, 14: 4}
Did not match all atoms present	19931-81-8	CC(C)(C)OOC(C)(C)C1=CC(=CC(=C1)C(C)(C)OOC(C)(C)C)C(C)(C)OOC(C)(C)C	{1: 15, 4: 6, 22: 6, 14: 3}
Did not match all atoms present	19931-87-4	C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2CCC#N	{33: 1, 2: 2, 37: 1, 14: 10}
Did not match all atoms present	19932-60-6	CCCC1=NC=NN1	{32: 1, 1: 1, 2: 2, 35: 2, 14: 1}
Did not match all atoms present	19932-64-0	C(=C(N=[N+]=[N-])[O-])[N+]#N	{34: 3, 6: 1, 7: 1}
Did not match all atoms present	19932-84-4	C1=CC2=C(C=C1Cl)OC(=O)N2	{32: 1, 17: 1, 28: 1, 14: 3}
Did not match all atoms present	19932-85-5	C1=CC2=C(C=C1Br)OC(=O)N2	{32: 1, 18: 1, 28: 1, 14: 3}
Did not match all atoms present	19933-24-5	C1=CSC(=C1)C2=CC=NN2	{32: 1, 41: 1, 35: 1, 14: 5}
Did not match all atoms present	19937-59-8	CN(C)C(=O)NC1=CC(=C(C=C1)OC)Cl	{1: 3, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	1994-57-6	CC1=C2C=CC3=C(C2=CC4=CC=CC=C14)C=C(C=C3)F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	19947-22-9	CCC(C=C)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 14: 5}
Did not match all atoms present	19947-39-8	C1=CC(=CC=C1C(CC(=O)O)N)Cl	{2: 1, 3: 1, 14: 4, 17: 1, 27: 1, 30: 1}
Did not match all atoms present	19947-75-2	CC1=C(ON=C1C)N	{1: 2, 35: 1, 30: 1, 23: 1}
Did not match all atoms present	1995-76-2	CC(=O)NC(C1=CC=CC=C1)(C2=CC=CC=C2)C(F)(F)F	{1: 1, 4: 2, 14: 10, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	19952-47-7	C1=CC2=C(C(=C1)Cl)N=C(S2)N	{17: 1, 35: 1, 30: 1, 14: 3, 41: 1}
Did not match all atoms present	19952-58-0	CCCCC1(COP(OC1)Cl)CC	{1: 2, 2: 4, 11: 2, 13: 1, 17: 1, 23: 2}
Did not match all atoms present	19956-97-9	CC1=CC2=C(CC(O2)(C)C)C=C1	{1: 3, 11: 1, 13: 1, 14: 3, 23: 1}
Did not match all atoms present	19957-45-0	C1=CC(=CC=C1NNS(=O)(=O)C2=CC=C(C=C2)Cl)Cl	{17: 2, 29: 2, 14: 8, 31: 2}
Did not match all atoms present	19958-58-8	CC(=O)ON(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 28: 1, 14: 10, 33: 1}
Did not match all atoms present	1996-29-8	C1=CC(=C(C=C1Cl)F)Br	{16: 1, 17: 1, 18: 1, 14: 3}
Did not match all atoms present	1996-41-4	C1=CC(=C(C=C1F)Cl)O	{16: 1, 17: 1, 21: 1, 14: 3}
Did not match all atoms present	1996-44-7	C1=CC(=C(C=C1F)F)S	{16: 2, 14: 3, 39: 1}
Did not match all atoms present	19961-52-5	CCC1=CN=C(S1)C	{1: 2, 2: 1, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	19961-53-6	CCC1=NC=C(S1)C	{1: 2, 2: 1, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	19962-21-1	C1=CC=C(C=C1)OCC2=CC(=CC=C2)F	{16: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	19962-23-3	COC1=CC(=CC=C1)OCC2=CC=CC=C2	{1: 1, 2: 1, 22: 2, 14: 9}
Did not match all atoms present	19962-37-9	CC(=O)NC1=NC(=O)C2=C(N1)N=CN2	{32: 2, 1: 1, 35: 2, 14: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	19964-11-5	I[Hg-](I)I	{19: 3}
Did not match all atoms present	19975-63-4	CC1(C(N(C(=S)S1)C)(C)O)C	{1: 4, 33: 1, 41: 1, 13: 2, 15: 1, 20: 1}
Did not match all atoms present	19978-61-1	C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl[Pd]Cl	{17: 2, 2: 2, 14: 20}
Did not match all atoms present	1998-64-7	C1=NC2=NC(=NC(=C2N1)C(F)(F)F)Cl	{32: 1, 35: 3, 4: 1, 14: 1, 16: 3, 17: 1}
Did not match all atoms present	19980-22-4	CCC=CO[Si](C)(C)C	{1: 4, 2: 1, 22: 1, 6: 2}
Did not match all atoms present	19980-43-9	C[Si](C)(C)OC1=CCCC1	{1: 3, 11: 3, 22: 1, 14: 1, 15: 1}
Did not match all atoms present	199808-02-1	C1=CC=C2C(=C1)C(=O)N(C2=O)CCCNCCCN3C(=O)C4=CC=CC=C4C3=O.Cl	{33: 2, 2: 6, 14: 8, 17: 1, 25: 4, 31: 1}
Did not match all atoms present	19982-87-7	C1=CC(=CC=C1/C(=N\[NH+]=C(N)N)/C2=CC=C(C=C2)F)C(F)(F)F.[Cl-]	{34: 1, 4: 1, 7: 2, 14: 8, 16: 4, 17: 1, 30: 2, 31: 1}
Did not match all atoms present	19985-79-6	CC(C)(C)C1=C(C1=O)C(C)(C)C	{1: 6, 4: 2, 25: 1}
Did not match all atoms present	19986-35-7	CN(C)CN1C2=C(C=CC(=C2)Cl)OC1=O	{1: 2, 2: 1, 33: 2, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	1999-45-7	CC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)N	{1: 1, 2: 1, 3: 2, 14: 5, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	1999-85-5	CC(C)(C1=CC(=CC=C1)C(C)(C)O)O	{1: 4, 4: 2, 14: 4, 20: 2}
Did not match all atoms present	19992-69-9	CN(C)N=NC1=CN=CC=C1	{1: 2, 34: 2, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	19996-03-3	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2Cl)CCl	{17: 2, 2: 1, 14: 8}
Did not match all atoms present	19997-53-6	C1C(OC2=CC=CC=C21)CBr	{2: 1, 11: 1, 12: 1, 14: 4, 18: 1, 23: 1}
Did not match all atoms present	200-23-7	C1=CC=C2C(=C1)C3=CC=CC4=C3C(=CC=C4)O2	{14: 10, 23: 1}
Did not match all atoms present	2000-43-3	C1=CC=C(C=C1)C(C(Cl)(Cl)Cl)O	{17: 3, 3: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	20000-96-8	C1=CC=C(C(=C1)C2=CC=C(O2)C=O)[N+](=O)[O-]	{26: 1, 38: 1, 14: 6, 23: 1}
Did not match all atoms present	20004-12-0	CCCCCCCCCCCCOC(=O)CS[Sn](CCCC)(CCCC)SCC(=O)OCCCCCCCCCCCC	{40: 2, 1: 4, 2: 30, 28: 2}
Did not match all atoms present	20004-62-0	CC1=CC(=C2C3=C4C(=CC(=C13)O)C(C(=O)C5=C(C=C(C(=C45)C2=O)O)O)(C)C)O	{1: 3, 25: 2, 13: 1, 14: 3, 21: 4}
Did not match all atoms present	20009-26-1	CCCOC1=CC=CC2=CC=CC=C21	{1: 1, 2: 2, 22: 1, 14: 7}
Did not match all atoms present	2001-29-8	C1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)Br	{24: 1, 2: 1, 18: 1, 14: 9}
Did not match all atoms present	2001-32-3	C1=CC=C(C(=C1)CCC(=O)O)[N+](=O)[O-]	{2: 2, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	2001-45-8	C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{17: 1, 14: 20}
Did not match all atoms present	2001-81-2	CC[N+](CC)(CC)CCOC(=O)C(C1CCCC1)C2CCCC2.[Br-]	{1: 3, 2: 5, 3: 1, 11: 8, 12: 2, 18: 1, 28: 1}
Did not match all atoms present	2001-89-0	C(C(C(=O)[O-])N)C(=O)[O-].[K+].[K+]	{24: 2, 2: 1, 3: 1, 30: 1}
Did not match all atoms present	2001-91-4	CCN1CCCC1COC(=O)C(C2CCCC2)(C3=CC=CC=C3)O.Cl	{1: 1, 2: 2, 4: 1, 33: 1, 11: 7, 12: 2, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	2001-93-6	C1=CNC(=S)NC1=S	{32: 2, 14: 2}
Did not match all atoms present	2001-94-7	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[K+].[K+]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	20011-41-0	CCCCCCCCCCCCCCCCCCOC(=O)CCCC(=O)[O-]	{24: 1, 1: 1, 2: 20, 28: 1}
Did not match all atoms present	20017-67-8	C1=CC=C(C=C1)C(CCO)C2=CC=CC=C2	{2: 2, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	20017-68-9	C1=CC=C(C=C1)C(CCBr)C2=CC=CC=C2	{2: 2, 3: 1, 18: 1, 14: 10}
Did not match all atoms present	20018-09-1	CC1=CC=C(C=C1)S(=O)(=O)C(I)I	{19: 2, 1: 1, 3: 1, 29: 2, 14: 4}
Did not match all atoms present	2002-59-7	C1=NC2=C(N1)C(=S)NC(=O)N2	{32: 3, 25: 1, 35: 1, 14: 1}
Did not match all atoms present	2002-92-8	C(CC(=O)O)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 2: 2, 27: 1}
Did not match all atoms present	20020-02-4	C1=CC=C2C(=C1)C(=C(C(=C2Cl)Cl)Cl)Cl	{17: 4, 14: 4}
Did not match all atoms present	20020-13-7	C1=CC(=CC=C1N[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 4, 31: 1}
Did not match all atoms present	20024-90-2	CCCC1=CC=C(C=C1)CC	{1: 2, 2: 3, 14: 4}
Did not match all atoms present	20024-91-3	CCCC1=CC=CC(=C1)CC	{1: 2, 2: 3, 14: 4}
Did not match all atoms present	20029-52-1	C1CCC(CC1)C2=CC=C(C=C2)C(=O)O	{27: 1, 11: 5, 12: 1, 14: 4}
Did not match all atoms present	2003-86-3	C[Si](C)(C)[Si](C)([Si](C)(C)C)[Si](C)(C)C	{1: 10}
Did not match all atoms present	20033-08-3	C1C(C(C(C(C1(I)I)(O)O)(I)I)C2=CC=CC=C2)(I)I	{11: 1, 12: 1, 13: 4, 14: 5, 19: 6, 20: 2}
Did not match all atoms present	20034-71-3	CC(C)C1=CC=CC=C1CCl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	20039-37-6	C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]	{32: 2, 22: 1, 14: 10, 29: 6}
Did not match all atoms present	20039-91-2	CC1=CC(=C(C(=C1)Br)O)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	200398-40-9	C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)CCN4CCN(C4=O)C5=CC=CC=C5	{33: 3, 2: 2, 35: 1, 11: 6, 12: 1, 14: 8, 16: 1, 23: 1, 25: 1}
Did not match all atoms present	2004-03-7	CC1=C2C(=NC=N1)N=CN2	{32: 1, 1: 1, 35: 3, 14: 2}
Did not match all atoms present	2004-06-0	C1=NC2=C(C(=N1)Cl)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 17: 1, 20: 3, 23: 1}
Did not match all atoms present	2004-07-1	C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=C(N=C2Cl)N	{33: 1, 2: 1, 35: 3, 12: 4, 14: 1, 17: 1, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	2004-14-0	[Li+].C[Si](C)(C)[O-]	{1: 3, 29: 1}
Did not match all atoms present	20043-92-9	CCCCCCCCCCCCCCCCCCNC(=O)C1=C(C2=CC=CC=C2C=C1)O	{1: 1, 2: 17, 14: 6, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	20043-94-1	CCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 11, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	20045-34-5	C1=CC(=C(C(=C1)O)O)[O-].[K+]	{21: 2, 14: 3}
Did not match all atoms present	20048-27-5	C1=CC(=CC=C1N)N=C2C=C(C(=NC3=CC=C(C=C3)N)C=C2N)N	{34: 2, 30: 4, 14: 10, 15: 4}
Did not match all atoms present	20048-48-0	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C3=CC=CC=C3.[Cl-]	{1: 4, 2: 3, 33: 1, 34: 2, 14: 13, 17: 1, 24: 1}
Did not match all atoms present	20048-92-4	CC[N+]1=C(C=CC2=CC=CC=C21)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 29: 3, 14: 10, 33: 1}
Did not match all atoms present	2005-08-5	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)Cl	{17: 1, 28: 1, 14: 9}
Did not match all atoms present	2005-10-9	C1=CC=C2C(=C1)C3=CC=CC=C3OC2=O	{28: 1, 14: 8}
Did not match all atoms present	20056-66-0	CCCCCC1=CC(=CC=C1)O	{1: 1, 2: 4, 21: 1, 14: 4}
Did not match all atoms present	20057-09-4	C1=CC=C2C(=C1)C=CC3=C2C(C(C=C3)O)O	{20: 2, 12: 2, 14: 8}
Did not match all atoms present	20057-70-9	[Bi+3].[Cl-].[Cl-].[Cl-].[Cl-]	{17: 4}
Did not match all atoms present	20062-22-0	C1=C(C=C(C(=C1[N+](=O)[O-])C=CC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 6, 14: 4, 6: 2}
Did not match all atoms present	20064-40-8	CC1=NSC(=N1)S(=O)(=O)C2=CC=C(C=C2)Cl	{1: 1, 35: 2, 41: 1, 14: 4, 17: 1, 29: 2}
Did not match all atoms present	20064-41-9	CC1=CC=C(C=C1)S(=O)(=O)C2=NC(=NS2)C	{1: 2, 35: 2, 29: 2, 14: 4, 41: 1}
Did not match all atoms present	20069-40-3	CSC1=NC(=S)SN1	{32: 1, 1: 1, 35: 1, 41: 1, 40: 1}
Did not match all atoms present	2007-20-7	C1=CC2=C(C(=C(C=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])O)N.[Na+].[Na+]	{30: 1, 21: 1, 14: 4, 29: 6}
Did not match all atoms present	20071-09-4	C1CC(C1C2=CC=CC=C2)C3=CC=CC=C3	{11: 2, 12: 2, 14: 10}
Did not match all atoms present	20073-51-2	CCCCCCCCCC1=CC(=C(C(=C1)CN(CCO)CCO)O)CN(CCO)CCO	{1: 1, 2: 18, 33: 2, 14: 2, 20: 4, 21: 1}
Did not match all atoms present	20074-52-6	[Fe+3]	{}
Did not match all atoms present	20074-79-7	CCOP(=O)(CC1=CC=C(C=C1)N)OCC	{1: 2, 2: 3, 14: 4, 22: 2, 29: 1, 30: 1}
Did not match all atoms present	2008-39-1	CNC.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O	{1: 2, 2: 1, 14: 3, 17: 2, 22: 1, 27: 1, 31: 1}
Did not match all atoms present	2008-58-4	C1=CC(=C(C(=C1)Cl)C(=O)N)Cl	{24: 1, 17: 2, 30: 1, 14: 3}
Did not match all atoms present	2008-59-5	[C-]#[N+]C1=CC(=CC=C1)[N+](=O)[O-]	{34: 1, 38: 1, 14: 4}
Did not match all atoms present	2008-62-0	COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#[C-]	{1: 1, 34: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	200818-32-2	C(CN(CC(=O)O)CC(=O)O)C(=O)[O-].[K+]	{24: 1, 33: 1, 2: 4, 27: 2}
Did not match all atoms present	20082-71-7	C[Si](C)(C1=C(C(=C(C(=C1F)F)F)F)F)Cl	{16: 5, 1: 2, 17: 1}
Did not match all atoms present	2009-03-2	CNCCC1=CNC2=C1C=C(C=C2)OC	{32: 1, 1: 2, 2: 2, 14: 4, 22: 1, 31: 1}
Did not match all atoms present	2009-52-1	CNC1=NC=NC2=C1N=CN2C	{1: 2, 35: 3, 33: 1, 14: 2, 31: 1}
Did not match all atoms present	20098-48-0	C1=C(C=C(C(=C1Cl)Cl)Cl)[N+](=O)[O-]	{17: 3, 38: 1, 14: 2}
Did not match all atoms present	20099-89-2	C1=CC(=CC=C1C#N)C(=O)CBr	{24: 1, 2: 1, 18: 1, 14: 4, 37: 1}
Did not match all atoms present	201-06-9	C1=CC=C2C3=C4C(=CC=C3)C=CC4=CC2=C1	{14: 10}
Did not match all atoms present	201-42-3	C1C2=CC=CC3=C2C4=C1C5=C(C=C4C=C3)C6=CC=CC=C6C=C5	{11: 1, 14: 12}
Did not match all atoms present	2010-06-2	C1=CC=C(C=C1)C2=CSC(=N2)N	{41: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	2010-61-9	CC1=CC=C(C=C1)C(C(F)(F)F)(C(F)(F)F)O	{16: 6, 1: 1, 4: 3, 14: 4, 20: 1}
Did not match all atoms present	20103-09-7	C1=C(C(=CC(=C1Cl)N)Cl)N	{17: 2, 30: 2, 14: 2}
Did not match all atoms present	20103-10-0	C1=C(C=C(C(=C1Cl)O)Cl)O	{17: 2, 21: 2, 14: 2}
Did not match all atoms present	20107-37-3	CC(C)(C)C=C[Si](C)(C)C	{1: 6, 4: 1, 6: 2}
Did not match all atoms present	20109-39-1	CC(COC(C)COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2	{1: 2, 2: 2, 3: 2, 14: 10, 22: 1, 28: 2}
Did not match all atoms present	20109-59-5	C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-].[Na+]	{16: 13, 24: 1, 4: 6}
Did not match all atoms present	2011-66-7	C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N)Cl	{24: 1, 17: 1, 38: 1, 30: 1, 14: 7}
Did not match all atoms present	2011-67-8	CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3	{1: 1, 35: 1, 38: 1, 33: 1, 11: 1, 14: 8, 15: 1, 25: 1}
Did not match all atoms present	20115-23-5	CCCCC(=O)OC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	20116-65-8	CC1=CC(=C(C=C1)C(=O)OC)C(=O)OC	{1: 3, 28: 2, 14: 3}
Did not match all atoms present	2012-00-2	CCOP(=O)(C1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 9, 22: 2, 29: 1}
Did not match all atoms present	2012-74-0	CC(C)C(C1=CC=C(C=C1)Cl)C(=O)O	{27: 1, 1: 2, 3: 2, 14: 4, 17: 1}
Did not match all atoms present	2012-81-9	CC(C)C(C#N)C1=CC=C(C=C1)Cl	{1: 2, 3: 2, 37: 1, 14: 4, 17: 1}
Did not match all atoms present	20120-33-6	COP(=O)(CCC(=O)NCO)OC	{1: 2, 2: 3, 20: 1, 22: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	20123-68-6	C1CC1[NH2+]CC(C2=CC(=CC=C2)[NH3+])O.[Cl-].[Cl-]	{2: 1, 3: 1, 11: 2, 12: 1, 14: 4, 17: 2, 20: 1}
Did not match all atoms present	20123-80-2	C1=CC(=C(C=C1O)S(=O)(=O)[O-])O.C1=CC(=C(C=C1O)S(=O)(=O)[O-])O.[Ca+2]	{21: 4, 14: 6, 29: 6}
Did not match all atoms present	2013-26-5	CCC(=O)C(=O)[O-].[Na+]	{24: 2, 1: 1, 2: 1}
Did not match all atoms present	20133-93-1	C1=CC=C2C(=C1)C=CC=C2OCC(CCl)O	{2: 2, 3: 1, 14: 7, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	20137-53-5	F[Ta-](F)(F)(F)(F)F.[K+]	{16: 6}
Did not match all atoms present	20139-55-3	CC1=C(C=CC(=C1)Cl)NC(=O)CC(=O)C	{1: 2, 2: 1, 14: 3, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	20139-66-6	CCOC1=CC=C(C=C1)NC(=O)C(C(=O)C)N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=C(C=C4)OCC)Cl)Cl	{1: 4, 2: 2, 3: 2, 34: 4, 14: 14, 17: 2, 22: 2, 24: 4, 31: 2}
Did not match all atoms present	20139-72-4	CC(=O)C(C(=O)NC1=CC(=C(C=C1OC)Cl)OC)N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC(=C(C=C4OC)Cl)OC)Cl)Cl	{1: 6, 34: 4, 3: 2, 14: 10, 17: 4, 22: 4, 24: 4, 31: 2}
Did not match all atoms present	2014-22-4	CC[NH+](CC)CC(=O)OC1=C(C=CC=C1C)C.[Cl-]	{1: 4, 2: 3, 28: 1, 14: 3, 17: 1}
Did not match all atoms present	2014-25-7	CC1=C(C(=CC=C1)C)OC(=O)CN2CCCCC2.Cl	{1: 2, 2: 1, 33: 1, 11: 5, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	2014-27-9	CC[NH+](CC)C(C)C(=O)OC1=C(C=CC=C1C)C.[Cl-]	{1: 5, 2: 2, 3: 1, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	2014-30-4	CC[NH+](CC)C(C)C(=O)OC1=C(C=CC=C1Cl)C.[Cl-]	{1: 4, 2: 2, 3: 1, 14: 3, 17: 2, 28: 1}
Did not match all atoms present	2014-32-6	CC[NH+](CC)CC(=O)OC1=C(C=C(C=C1C)C)C.[Cl-]	{1: 5, 2: 3, 28: 1, 14: 2, 17: 1}
Did not match all atoms present	2014-83-7	C1=CC(=C(C(=C1)Cl)CCl)Cl	{17: 3, 2: 1, 14: 3}
Did not match all atoms present	20143-13-9	C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{10: 2, 4: 1, 14: 20}
Did not match all atoms present	20145-50-0	CC1=C(C(=C(C(=C1C)C)COC)C)C	{1: 6, 2: 1, 22: 1}
Did not match all atoms present	2015-28-3	C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO.Cl.Cl	{33: 3, 2: 5, 41: 1, 11: 4, 14: 7, 17: 3, 20: 1}
Did not match all atoms present	2015-56-7	C1=CC=C(C=C1)OP(=O)(N)OC2=CC=CC=C2	{30: 1, 22: 2, 14: 10, 29: 1}
Did not match all atoms present	20150-89-4	CC1=CC(=C2C=CC=NC2=C1)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	20153-98-4	COC1=CC(=CC(=C1OC)OC)C(=O)OCCCN2CCCN(CC2)CCCOC(=O)C3=CC(=C(C(=C3)OC)OC)OC.Cl.Cl	{1: 6, 2: 6, 33: 2, 11: 5, 14: 4, 17: 2, 22: 6, 28: 2}
Did not match all atoms present	201532-42-5	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=CS4)C(=O)O	{2: 2, 3: 1, 41: 1, 12: 1, 14: 11, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	20154-03-4	C1=C(NN=C1)C(F)(F)F	{16: 3, 32: 1, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	20154-25-0	CC(C)(CCNC1=NC2=C(C3=CC=CC=C3N2C)N=N1)O	{1: 3, 2: 2, 35: 3, 4: 1, 33: 1, 14: 4, 20: 1, 31: 1}
Did not match all atoms present	20156-62-1	C[Si](C)(C)N(N([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	{1: 12, 33: 2}
Did not match all atoms present	2016-04-8	CN(C)C(OCC1=CC=CC=C1)OCC2=CC=CC=C2	{1: 2, 2: 2, 3: 1, 33: 1, 14: 10, 22: 2}
Did not match all atoms present	2016-36-6	C[N+](C)(C)CCO.C1=CC=C(C(=C1)C(=O)O)[O-]	{1: 3, 2: 2, 27: 1, 20: 1, 14: 4}
Did not match all atoms present	20161-55-1	CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3O2.[Cl-]	{1: 4, 35: 1, 33: 2, 14: 6, 17: 1, 23: 1}
Did not match all atoms present	20167-22-0	C1=C(N=C(S1)N)CSC(=N)N.Cl.Cl	{2: 1, 35: 1, 36: 1, 7: 1, 40: 1, 41: 1, 14: 1, 17: 2, 30: 2}
Did not match all atoms present	20168-99-4	CC1=C(C2=C(N1C(=O)C=CC3=CC=CC=C3)C=CC(=C2)OC)CC(=O)O	{1: 2, 2: 1, 6: 2, 33: 1, 14: 8, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	20170-21-2	CC(C(=O)NC1=CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3)N(C)C	{1: 3, 3: 1, 33: 2, 14: 11, 35: 1, 24: 1, 31: 1}
Did not match all atoms present	20170-32-5	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)O	{1: 6, 2: 2, 4: 2, 14: 2, 21: 1, 27: 1}
Did not match all atoms present	20172-41-2	CCCCCCCCCCN=CC1=CC=CC=C1	{1: 1, 2: 9, 34: 1, 14: 5, 6: 1}
Did not match all atoms present	20173-04-0	CNCC1=CN=CC=C1	{1: 1, 2: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	20174-68-9	CC1=C2C(=CC=C1)SC(=N2)NN	{1: 1, 35: 1, 41: 1, 14: 3, 30: 1, 31: 1}
Did not match all atoms present	201743-52-4	C1COC(O[C@@H]1CBr)C2=CC=CC=C2	{2: 1, 11: 2, 12: 2, 14: 5, 18: 1, 23: 2}
Did not match all atoms present	20175-19-3	CCCCCCCC(=CC1=CC=CC=C1)C=O	{1: 1, 2: 6, 6: 1, 7: 1, 14: 5, 26: 1}
Did not match all atoms present	20175-28-4	[O-].[O-].[O-].[O].[Sb]	{}
Did not match all atoms present	20176-43-6	[O-][V](=O)=O.[Rb+]	{29: 3}
Did not match all atoms present	2018-61-3	CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O	{1: 1, 2: 1, 3: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	2018-66-8	CC(C)C[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1	{1: 2, 2: 2, 3: 2, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	2018-90-8	C1=CC=C2C=C(C=CC2=C1)CN	{2: 1, 30: 1, 14: 7}
Did not match all atoms present	20182-56-3	C1=CC(=CC=C1NC2=NC(=NC(=N2)NCCO)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])NCCO)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 4, 35: 6, 6: 2, 14: 14, 20: 2, 29: 12, 31: 6}
Did not match all atoms present	20184-94-5	CN(C(=S)SC)N	{40: 1, 1: 2, 33: 1, 30: 1, 7: 1}
Did not match all atoms present	20185-55-1	CC(C)C1=CC=C(C=C1)C(=O)OC	{1: 3, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	20187-55-7	C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=N2)OCC(=O)O	{33: 1, 2: 2, 35: 1, 14: 9, 22: 1, 27: 1}
Did not match all atoms present	2019-14-9	CCCCCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-]	{1: 3, 2: 9, 4: 1, 14: 10, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	2019-34-3	C1=CC(=CC=C1CCC(=O)O)Cl	{17: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	2019-69-4	CCN(CC)C(=O)C(C1=CC=CC=C1)O	{1: 2, 2: 2, 3: 1, 33: 1, 14: 5, 20: 1, 24: 1}
Did not match all atoms present	2019-75-2	CC(CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)N(C)C.Cl	{1: 3, 2: 1, 3: 1, 4: 1, 33: 1, 14: 10, 17: 1, 24: 1, 30: 1}
Did not match all atoms present	20190-03-8	C1CCC(CC1)[NH3+].C1CCC(CC1)NC(=O)[O-]	{24: 1, 11: 10, 12: 2, 31: 1}
Did not match all atoms present	20193-56-0	Cl[W](Cl)Cl	{17: 3}
Did not match all atoms present	20193-58-2	F[Mo](F)F	{16: 3}
Did not match all atoms present	20195-06-6	CCCSP(=O)(OCC)OCC	{40: 1, 1: 3, 2: 4, 29: 1, 22: 2}
Did not match all atoms present	20198-87-2	CCCCCCCCCCCCCCCCCCNCC1=CC=CC=C1	{1: 1, 2: 18, 14: 5, 31: 1}
Did not match all atoms present	202-03-9	C1=CC=C2C3=C4C(=CC=CC4=CC2=C1)C=C3	{14: 10}
Did not match all atoms present	202-33-5	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC=C5C4=C3C=C5	{14: 12}
Did not match all atoms present	202-94-8	C1C2=CC=CC3=C2C4=C1C5=CC=CC=C5C=C4C=C3	{11: 1, 14: 10}
Did not match all atoms present	202-98-2	C1C2=CC=CC3=C2C4=C(C=C3)C5=CC=CC=C5C=C41	{11: 1, 14: 10}
Did not match all atoms present	20200-22-0	CNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]	{1: 1, 4: 1, 38: 1, 14: 3, 16: 3, 31: 1}
Did not match all atoms present	20200-64-0	CC1(C2=CC=CC=C2N(C13C=CC4=CC(=CC(=C4O3)[N+](=O)[O-])[N+](=O)[O-])C)C	{1: 3, 38: 2, 33: 1, 13: 2, 14: 8, 23: 1}
Did not match all atoms present	20201-60-9	CC1C2CC(C(C2)C1(C)C)C3=CC(=C(C=C3)O)OC	{1: 4, 11: 2, 12: 4, 13: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	20201-72-3	CC1C2CC(C(C2)C1(C)C)C3=CC(=C(C=C3)OC)O	{1: 4, 11: 2, 12: 4, 13: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	20201-75-6	CC1C2CC(C(C2)C1(C)C)C3=C(C(=CC=C3)OC)O	{1: 4, 11: 2, 12: 4, 13: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	20203-47-8	C1CCC(CC1)N.O[Cr](=O)(=O)O	{20: 2, 11: 5, 12: 1, 29: 2, 30: 1}
Did not match all atoms present	20205-60-1	F[Mo]F	{16: 2}
Did not match all atoms present	20206-64-8	C1=CC=C(C=C1)NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)N(CCO)CCO)S(=O)(=O)O)S(=O)(=O)O.C(CO)N.C(CO)N	{33: 2, 2: 12, 35: 6, 6: 2, 14: 16, 20: 8, 29: 4, 30: 2, 31: 4}
Did not match all atoms present	2021-28-5	CCOC(=O)CCC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	2021-58-1	C1=CSC(=C1)CC(C(=O)O)N	{2: 1, 3: 1, 41: 1, 14: 3, 27: 1, 30: 1}
Did not match all atoms present	20210-97-3	C1=CC=C(C(=C1)C(=O)OCCOC(=O)C2=CC=CC=C2O)O	{2: 2, 28: 2, 21: 2, 14: 8}
Did not match all atoms present	20211-64-7	C1C=CC1C2=CC=CC=C2	{11: 1, 12: 1, 14: 7}
Did not match all atoms present	20211-76-1	O.[Cl-].[Cl-].[Cl-].[La+3]	{17: 3}
Did not match all atoms present	20213-95-0	C[Ge](C)C.C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 14: 15}
Did not match all atoms present	20216-88-0	CCCCC(CCCC)C1=CC=CC=C1	{1: 2, 2: 6, 3: 1, 14: 5}
Did not match all atoms present	20217-01-0	C1C(O1)COC2=C(C=C(C=C2)Br)Br	{2: 1, 11: 1, 12: 1, 14: 3, 18: 2, 22: 1, 23: 1}
Did not match all atoms present	20217-54-3	CN(C)P(OC)OC	{1: 4, 22: 2, 33: 1}
Did not match all atoms present	20218-55-7	C[C@@H](C1=CC=CC2=CC=CC=C21)NC	{1: 2, 3: 1, 14: 7, 31: 1}
Did not match all atoms present	20219-84-5	C1=CC=NC=C1.C1=CC=NC=C1.C1=CC2=C3NC(=C2C=C1)NC4=C5C=CC=CC5=C([N-]4)NC6=C7C=CC=CC7=C(N6)NC8=C9C=CC=CC9=C(N3)[N-]8.[Fe+2]	{32: 6, 35: 4, 14: 26}
Did not match all atoms present	2022-67-5	CC(C)C1=CC=CC=C1F	{16: 1, 1: 2, 3: 1, 14: 4}
Did not match all atoms present	2022-78-8	C1=C(C=NC(=O)N1)F	{16: 1, 25: 1, 35: 1, 14: 2, 32: 1}
Did not match all atoms present	2022-85-7	C1=NC(=O)NC(=C1F)N	{32: 1, 35: 1, 14: 1, 16: 1, 25: 1, 30: 1}
Did not match all atoms present	20220-77-3	COC1=CC=CC=C1N=C=NC2=CC=CC=C2OC	{8: 1, 1: 2, 34: 2, 22: 2, 14: 8}
Did not match all atoms present	20223-20-5	O[Os](=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	20223-84-1	[H+].[H+].CC1(C(CCC1(C)C(=O)[O-])C(=O)NCC(C[Hg+])OC)C.C(C(=O)[O-])[S-]	{1: 4, 2: 3, 3: 1, 11: 2, 12: 1, 13: 2, 22: 1, 24: 3, 31: 1}
Did not match all atoms present	20228-27-7	CCOC1=CC=CC=C1C(=O)N/N=C(\C)/C(=O)O	{1: 2, 2: 1, 7: 1, 34: 1, 14: 4, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	2023-60-1	CC1=C2C=CC3=CC=CC=C3C2=C(C4=C1C(=CC=C4)F)C	{16: 1, 1: 2, 14: 9}
Did not match all atoms present	2023-61-2	CC1=C2C=CC3=CC=CC=C3C2=C(C4=C1C=CC=C4F)C	{16: 1, 1: 2, 14: 9}
Did not match all atoms present	20232-11-5	CC1=CC2=C(C=CC2)C=C1	{1: 1, 11: 1, 14: 5}
Did not match all atoms present	202325-55-1	C(CN=N)C[O-].[K+]	{2: 3, 34: 1, 36: 1, 29: 1}
Did not match all atoms present	20236-55-9	C1=C(C(=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])O)[N+](=O)[O-].[Ba+2]	{38: 3, 21: 2, 14: 1}
Did not match all atoms present	20237-98-3	C1CC(=CC2=CC=C(C=C2)N=[N+]=[N-])C(=O)C(=CC3=CC=C(C=C3)N=[N+]=[N-])C1	{34: 4, 6: 2, 11: 3, 14: 8, 15: 2, 25: 1}
Did not match all atoms present	20239-99-0	CCC1=C2C=C3C(=C4C(=O)[C@@H](C(=C5[C@H]([C@@H](C(=N5)C=C6C(=C(C(=CC(=C1C=O)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C	{32: 2, 1: 5, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 25: 1, 26: 1, 27: 1, 28: 1}
Did not match all atoms present	2024-70-6	CCSCC1=CC=CO1	{40: 1, 1: 1, 2: 2, 14: 3, 23: 1}
Did not match all atoms present	2024-83-1	COC1=C(C=C(C=C1)C#N)OC	{1: 2, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	2024-88-6	CC(C)(C1=CC=C(C=C1)OC(=O)Cl)C2=CC=C(C=C2)OC(=O)Cl	{1: 2, 4: 1, 28: 2, 14: 8, 17: 2}
Did not match all atoms present	20240-98-6	CC1=CC=CC=C1N=NN(C)C	{1: 3, 34: 2, 14: 4, 33: 1}
Did not match all atoms present	20241-03-6	CC1=CC(=CC=C1)N=NN(C)C	{1: 3, 34: 2, 14: 4, 33: 1}
Did not match all atoms present	20241-55-8	C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{24: 1, 31: 1, 21: 1, 14: 9, 29: 6}
Did not match all atoms present	20241-68-3	C1=CC(=CC(=C1)S(=O)(=O)CCO)NC(=O)C2=CC=C(C=C2)N	{2: 2, 14: 8, 20: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	20241-74-1	CCC1=C(C(=CC=C1)CC)NC2=C3C(=C(C=C2)NC4=C(C=CC=C4CC)CC)C(=O)C5=CC=CC=C5C3=O	{1: 4, 2: 4, 31: 2, 14: 12, 25: 2}
Did not match all atoms present	20241-75-2	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NC5=CC=C(C=C5)C	{1: 2, 31: 2, 21: 2, 14: 12, 25: 2}
Did not match all atoms present	20241-76-3	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)[N+](=O)[O-])O	{25: 2, 38: 1, 21: 2, 14: 9, 31: 1}
Did not match all atoms present	20241-79-6	C1=CC(=CC=C1CCO)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)N)O	{2: 2, 14: 8, 20: 1, 21: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	20242-28-8	CCC1=NOC(=C1)C2=CC=[N+](C=C2)C.[Cl-]	{1: 2, 2: 1, 35: 1, 33: 1, 14: 5, 17: 1, 23: 1}
Did not match all atoms present	20244-21-7	C1=CC=C(C(=C1)O)[O-].[Na+]	{21: 1, 14: 4}
Did not match all atoms present	20246-69-9	CCCCCNC(=S)[S-].CCCCCNC(=S)[S-].[Cd+2]	{1: 2, 2: 8, 31: 2, 7: 2}
Did not match all atoms present	20249-05-2	CCOC1=C(C=C(C=C1)NC(=O)C)N(CCOC(=O)C)CCOC(=O)C	{1: 4, 2: 5, 33: 1, 14: 3, 22: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	2025-40-3	CCOC(=O)C(=CC1=CC=CC=C1)C#N	{1: 1, 2: 1, 37: 1, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	20253-17-2	CCN(CC)C(=S)S[Sn](CC)(CC)CC	{40: 1, 1: 5, 2: 5, 33: 1, 7: 1}
Did not match all atoms present	20256-54-6	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC	{1: 4, 2: 20}
Did not match all atoms present	20259-31-8	CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Fe+3]	{24: 3, 1: 3, 2: 60}
Did not match all atoms present	2026-08-6	C1=CC2=C(C(=C1)CO)C(=CC=C2)CO	{2: 2, 20: 2, 14: 6}
Did not match all atoms present	20260-53-1	C1=CC(=CN=C1)C(=O)Cl.Cl	{24: 1, 17: 2, 35: 1, 14: 4}
Did not match all atoms present	20261-24-9	CC1=C(C=CC=C1Cl)C2=CC=CC=C2	{1: 1, 14: 8, 17: 1}
Did not match all atoms present	20262-55-9	C1=CC2=C(C=C1C(=O)O)C(=O)NC2=O	{32: 1, 25: 2, 27: 1, 14: 3}
Did not match all atoms present	20263-06-3	C(C(C(=O)O)N)P(=O)(O)O	{2: 1, 3: 1, 20: 2, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	20263-47-2	O=[Ta].F.F.F	{16: 3, 29: 1}
Did not match all atoms present	20265-96-7	C1=CC(=CC=C1N)Cl.Cl	{17: 2, 30: 1, 14: 4}
Did not match all atoms present	20265-97-8	COC1=CC=C(C=C1)N.Cl	{1: 1, 30: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	20266-65-3	CC(CO[N+](=O)[O-])O	{1: 1, 2: 1, 3: 1, 20: 1, 22: 1}
Did not match all atoms present	202667-43-4	[Li+].[Li+].C1CN(CCN1CCNC2=NC(=NC(=N2)NC3=CC(=C(C=C3)N=NC4=C(C=C5C=C(C=C(C5=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)Cl)C6=NC(=NC(=N6)Cl)NC7=CC(=C(C=C7)N=NC8=C(C=C9C=C(C=C(C9=C8)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N.[Na+].[Na+].[K+].[K+]	{33: 2, 2: 2, 35: 6, 11: 4, 34: 4, 14: 14, 17: 2, 24: 2, 29: 18, 30: 2, 31: 5}
Did not match all atoms present	20268-51-3	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)[N+](=O)[O-]	{38: 1, 14: 11}
Did not match all atoms present	20268-52-4	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)Cl	{17: 1, 14: 11}
Did not match all atoms present	2027-17-0	CC(C)C1=CC2=CC=CC=C2C=C1	{1: 2, 3: 1, 14: 7}
Did not match all atoms present	2027-19-2	CCCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 2, 14: 7}
Did not match all atoms present	20271-20-9	COC(=O)C1=C(N=CN1)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 14: 1, 28: 1}
Did not match all atoms present	20272-14-4	C(=CC(=O)[O-])C(=O)O.[K+]	{24: 1, 27: 1, 6: 2}
Did not match all atoms present	20273-42-1	C1COCCN1CCNC2=C3C=CC=CC3=NC4=CC=CC=C42	{33: 1, 2: 2, 35: 1, 11: 4, 14: 8, 23: 1, 31: 1}
Did not match all atoms present	20277-69-4	CS(=O)[O-].[Na+]	{1: 1, 29: 2}
Did not match all atoms present	20279-21-4	C1CC2C3=CC=CC=C3C4=C2C(=CC=C4)C1	{11: 3, 12: 1, 14: 7}
Did not match all atoms present	20279-29-2	CC(C)C(=O)OC1=CC=CC=C1	{1: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	20279-53-2	CC(C)COC(=O)C1=CC=CO1	{1: 2, 2: 1, 3: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	20279-69-0	CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Ca+2]	{1: 4, 33: 2, 7: 2}
Did not match all atoms present	2028-76-4	C1=CC(=CC(=C1)[N+](=O)[O-])[N+]#N.[Cl-]	{17: 1, 34: 1, 38: 1, 14: 4}
Did not match all atoms present	20282-28-4	CCCC1=CC=CC=C1C2=CC=CC=C2	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	20282-30-8	CC(C)C1=CC=CC(=C1)C2=CC=CC=C2	{1: 2, 3: 1, 14: 9}
Did not match all atoms present	20282-70-6	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]#N)OC)[N+]#N	{1: 2, 34: 2, 22: 2, 14: 6}
Did not match all atoms present	202865-57-4	C1=C(C=C(C(=C1Br)Cl)F)Cl	{16: 1, 17: 2, 18: 1, 14: 2}
Did not match all atoms present	202865-61-0	COC1=CC(=C(C(=C1)F)Br)F	{16: 2, 1: 1, 18: 1, 22: 1, 14: 2}
Did not match all atoms present	202865-71-2	C1=CC(=C(C=C1Br)C=CC(=O)O)F	{16: 1, 18: 1, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	202865-82-5	CCC(=O)C1=CC(=C(C=C1)F)Br	{1: 1, 2: 1, 14: 3, 16: 1, 18: 1, 24: 1}
Did not match all atoms present	20289-26-3	C1=CC=C(C=C1)COC2=CC=CC3=C2C=CN3	{32: 1, 2: 1, 22: 1, 14: 10}
Did not match all atoms present	2029-94-9	CCOC1=C(C=C(C=C1)C=O)OCC	{1: 2, 2: 2, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	20291-72-9	CC1=C(C2=C(C=C1)C3=CC=CC=C3C=C2)C	{1: 2, 14: 8}
Did not match all atoms present	20291-73-0	CC1=CC=CC2=C1C=C(C3=CC=CC=C23)C	{1: 2, 14: 8}
Did not match all atoms present	20291-74-1	CC1=CC2=C(C=C1)C=CC3=C2C=CC=C3C	{1: 2, 14: 8}
Did not match all atoms present	202925-04-0	C1=C(C=C(C(=C1Br)Cl)F)Br	{16: 1, 17: 1, 18: 2, 14: 2}
Did not match all atoms present	20295-60-7	C1=CC(=CC=C1NCCS)F	{16: 1, 2: 2, 39: 1, 14: 4, 31: 1}
Did not match all atoms present	20297-05-6	CCCCCCCCCCCCOCCOCCOCCOCCOP(=O)(O)OCCOCCOCCOCCOCCCCCCCCCCCC	{1: 2, 2: 38, 20: 1, 29: 1, 22: 10}
Did not match all atoms present	202982-63-6	C1=CC(=C(C=C1Cl)F)CN.Cl	{16: 1, 17: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	202982-65-8	C1=CC(=C(C=C1Cl)F)C=CC(=O)O	{16: 1, 17: 1, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	203-11-2	C1=CC=C2C(=C1)C=C3C=C4C=CC=CC4=C5C3=C2C6=CC=CC=C65	{14: 14}
Did not match all atoms present	203-12-3	C1=CC2=C3C(=C1)C4=CC=CC5=C4C3=C(C=C2)C=C5	{14: 10}
Did not match all atoms present	203-18-9	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC6=C5C4=CC=C6	{14: 14}
Did not match all atoms present	203-20-3	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC=C5C4=C3C6=CC=CC=C65	{14: 14}
Did not match all atoms present	203-33-8	C1=CC=C2C(=C1)C=C3C=CC=C4C3=C2C5=CC=CC=C54	{14: 12}
Did not match all atoms present	203-64-5	C1C2=CC=CC3=C2C4=C(C=CC=C41)C=C3	{11: 1, 14: 8}
Did not match all atoms present	203-80-5	C1C=CC2=CC=CC3=C2C1=CC=C3	{11: 1, 14: 8}
Did not match all atoms present	203-85-0	C1C2=CC=CC3=C2C(=CC=C3)CS1	{41: 1, 11: 2, 14: 6}
Did not match all atoms present	20302-25-4	CC[N+]1=CC=CC(=C1)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=C[N+](=CC=C5)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 6: 2, 33: 2, 14: 28, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	20304-86-3	CC1=CC2=NON=C2C=C1	{1: 1, 35: 2, 14: 3, 23: 1}
Did not match all atoms present	2031-67-6	CCO[Si](C)(OCC)OCC	{1: 4, 2: 3, 22: 3}
Did not match all atoms present	2031-79-0	CC[Si]1(O[Si](O[Si](O1)(CC)CC)(CC)CC)CC	{1: 6, 2: 6, 23: 3}
Did not match all atoms present	2031-90-5	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]	{1: 2, 2: 3}
Did not match all atoms present	2031-95-0	[2H]C([2H])([2H])C	{1: 2}
Did not match all atoms present	20312-36-1	C1=CC=C(C=C1)C[C@@H](C(=O)O)O	{27: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	20313-52-4	C(=O)([O-])[O-].C(=O)([O-])[O-].[Ca+2].[Ba+2]	{24: 2}
Did not match all atoms present	2032-04-4	C=CC=[N+]=[N-]	{34: 1, 5: 1, 6: 2}
Did not match all atoms present	2032-33-9	CCCNCC1=CC=CC=C1	{1: 1, 2: 3, 14: 5, 31: 1}
Did not match all atoms present	2032-59-9	CC1=C(C=CC(=C1)OC(=O)NC)N(C)C	{1: 4, 28: 1, 33: 1, 14: 3, 31: 1}
Did not match all atoms present	2032-65-7	CC1=CC(=CC(=C1SC)C)OC(=O)NC	{40: 1, 1: 4, 28: 1, 14: 2, 31: 1}
Did not match all atoms present	20321-02-2	C(=O)(C(=O)[O-])O.[NH3+]N	{24: 1, 27: 1, 30: 1}
Did not match all atoms present	20322-78-5	CCN1C2=CC=CC=C2N(C3=CC4=[N+](C5=CC=CC=C5N=C4C=C31)C)CC.COS(=O)(=O)[O-]	{1: 4, 2: 2, 35: 1, 33: 3, 14: 10, 22: 1, 29: 3}
Did not match all atoms present	20323-74-4	CCOC(=O)C1=CC(=C(C=C1N)OC)OC	{1: 3, 2: 1, 14: 2, 22: 2, 28: 1, 30: 1}
Did not match all atoms present	20324-87-2	C1=CC2=C(C=C(C=C2C=C1NC(=O)NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{24: 1, 31: 2, 21: 2, 14: 10, 29: 6}
Did not match all atoms present	20325-40-0	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N.Cl.Cl	{1: 2, 30: 2, 22: 2, 14: 6, 17: 2}
Did not match all atoms present	20326-12-9	CC1=CC(=NN1)CCN2CCN(CC2)C3=CC(=CC=C3)Cl	{32: 1, 1: 1, 2: 2, 35: 1, 33: 2, 11: 4, 14: 5, 17: 1}
Did not match all atoms present	20328-87-4	CC[N+]1=C(SCC1)C=CNC2=CC(=C(C=C2)NC=CC3=[N+](CCS3)CC)C(=O)O.[I-].[I-]	{1: 2, 2: 2, 6: 4, 33: 2, 41: 2, 11: 4, 14: 3, 15: 2, 19: 2, 27: 1, 31: 2}
Did not match all atoms present	20328-96-5	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Sb+3]	{}
Did not match all atoms present	2033-76-3	C1=CC(=CC=C1OCCBr)Cl	{17: 1, 2: 2, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	2033-89-8	COC1=C(C=C(C=C1)O)OC	{1: 2, 22: 2, 21: 1, 14: 3}
Did not match all atoms present	2033-94-5	CC(C#C)(C(C1=CC=CC=C1)O)O	{1: 1, 3: 1, 4: 1, 9: 1, 10: 1, 14: 5, 20: 2}
Did not match all atoms present	20330-45-4	CC(=O)NC1=CC=C(C=C1)C(C)(C)C	{24: 1, 1: 4, 4: 1, 14: 4, 31: 1}
Did not match all atoms present	20330-52-3	CCCCCC1=CC=C(C=C1)NC(=O)C	{24: 1, 1: 2, 2: 4, 14: 4, 31: 1}
Did not match all atoms present	20330-90-9	COC(=O)C1=CC(=CC(=C1)Cl)C(=O)OC	{1: 2, 28: 2, 14: 3, 17: 1}
Did not match all atoms present	20331-25-3	CCC(C)C1=CC=C(C=C1)NC(=O)C	{1: 3, 2: 1, 3: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	20332-10-9	C1=CC=C(C=C1)[Sn](=S)C2=CC=CC=C2	{14: 10}
Did not match all atoms present	20332-12-1	CCCCCCCCCCCCCCCCCCN1C(=O)C2=CC=CC=C2C1=O	{1: 1, 2: 17, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	20333-40-8	CCCC[Se][Se]CCCC	{1: 2, 2: 6}
Did not match all atoms present	20333-41-9	CC1=CC(=CC=C1)SSC2=CC=CC(=C2)C	{40: 2, 1: 2, 14: 8}
Did not match all atoms present	20336-15-6	CC(C)(C)C1=CC(=NC(=C1)C(C)(C)C)C(C)(C)C	{1: 9, 35: 1, 4: 3, 14: 2}
Did not match all atoms present	203399-48-8	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC(=CC(=C4O3)S(=O)(=O)O)S(=O)(=O)N	{1: 2, 2: 2, 35: 1, 33: 1, 14: 6, 20: 1, 23: 1, 28: 1, 29: 4, 30: 1}
Did not match all atoms present	2034-22-2	C1(=C(N=C(N1)Br)Br)Br	{32: 1, 18: 3, 35: 1}
Did not match all atoms present	2034-41-5	CC(CC(=O)C1=CC=CC=C1)N	{1: 1, 2: 1, 3: 1, 14: 5, 24: 1, 30: 1}
Did not match all atoms present	20342-00-1	C1=CC=C(C=C1)P2C=CC=C2	{14: 9}
Did not match all atoms present	20344-49-4	O[Fe]=O	{20: 1, 29: 1}
Did not match all atoms present	20346-77-4	[SbH3]	{}
Did not match all atoms present	20346-99-0	[BH4-].[Rb+]	{}
Did not match all atoms present	20348-09-8	C1C(=O)NC2=C(O1)C=CC=N2	{32: 1, 35: 1, 11: 1, 14: 3, 23: 1, 25: 1}
Did not match all atoms present	20349-39-7	C1=CC2=C(C=C(C=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{21: 1, 14: 5, 29: 6}
Did not match all atoms present	20349-44-4	CC(=O)NC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)[O-])O.[Na+]	{1: 1, 14: 5, 21: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	2035-66-7	[C-]#N.[C-]#N.[Pd+2]	{}
Did not match all atoms present	2035-93-0	CC(CC(C)(C)C1=CC=CC=C1)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	2035-94-1	CCC(CO)C1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	20352-84-5	C1=C(C=C(C(=C1Cl)N)C#N)[N+](=O)[O-]	{17: 1, 38: 1, 30: 1, 14: 2, 37: 1}
Did not match all atoms present	20354-26-1	CN1C(=O)N(OC1=O)C2=CC(=C(C=C2)Cl)Cl	{1: 1, 33: 2, 14: 3, 17: 2, 25: 1, 28: 1}
Did not match all atoms present	20357-25-9	COC1=C(C=C(C(=C1)C=O)[N+](=O)[O-])OC	{1: 2, 26: 1, 38: 1, 22: 2, 14: 2}
Did not match all atoms present	20357-59-9	C1=CC=C(C=C1)N(/C=C/2\C=CC=CC2=O)O	{33: 1, 6: 1, 14: 9, 15: 1, 20: 1, 25: 1}
Did not match all atoms present	20357-70-4	COC1=CC2=C(C=C1)OC3=CC=CC=C32	{1: 1, 22: 1, 14: 7, 23: 1}
Did not match all atoms present	20357-79-3	C1C(C(C2=CC=CC=C21)Br)Br	{18: 2, 11: 1, 12: 2, 14: 4}
Did not match all atoms present	2036-39-7	[2H]C1=C(SC(=C1[2H])[2H])[2H]	{41: 1, 14: 4}
Did not match all atoms present	2036-41-1	CC1=CN=CN=C1	{1: 1, 35: 2, 14: 3}
Did not match all atoms present	20364-09-4	CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC(=C(C(=C2O)Cl)C)Cl)C(C)(C)CC	{1: 7, 2: 3, 4: 2, 14: 4, 17: 2, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	20365-77-9	CSC1=CC2=S(S1)SC(=C2)C3=CC=CC=C3	{40: 1, 1: 1, 41: 2, 14: 7, 15: 3}
Did not match all atoms present	20367-32-2	CCCOC1=CC=C(C=C1)NC(=O)C	{1: 2, 2: 2, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	20369-61-3	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)N=[N+]=[N-])OC(=O)C)OC(=O)C)OC(=O)C	{1: 4, 2: 1, 12: 5, 34: 2, 23: 1, 28: 4}
Did not match all atoms present	20369-63-5	CCC[CH2-].CCC[CH2-].CCC[CH2-].CN(C)C(=S)[S-].[Sn+4]	{1: 5, 2: 6, 33: 1, 5: 3, 7: 1}
Did not match all atoms present	2037-26-5	[2H]C1=C(C(=C(C(=C1[2H])[2H])C([2H])([2H])[2H])[2H])[2H]	{1: 1, 14: 5}
Did not match all atoms present	2037-31-2	C1=CC(=CC(=C1)Cl)S	{17: 1, 14: 4, 39: 1}
Did not match all atoms present	20373-56-2	CCN(C1CC1)C(=O)C2=CC(=NC(=C2)Cl)Cl	{1: 1, 2: 1, 35: 1, 33: 1, 11: 2, 12: 1, 14: 2, 17: 2, 24: 1}
Did not match all atoms present	20375-42-2	CC(=O)OC1=CC=CC(=C1)C=CC(=O)O	{1: 1, 27: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	203785-59-5	C[Si](C)(CCl)OC1=CC=C(C=C1)Cl	{1: 2, 2: 1, 22: 1, 14: 4, 17: 2}
Did not match all atoms present	2038-57-5	C1=CC=C(C=C1)CCCN	{2: 3, 30: 1, 14: 5}
Did not match all atoms present	20383-28-2	CC(C)N(C(C)C)C(=O)C1=CC=CC=C1	{24: 1, 1: 4, 3: 2, 14: 5, 33: 1}
Did not match all atoms present	20386-33-8	CC1=C(C(=C(C(=C1C)C)C(=O)C2=CC=CC=C2)C)C	{24: 1, 1: 5, 14: 5}
Did not match all atoms present	20387-34-2	CCN1C2=C(C=CC(=C2)C)SC1=CC(=CC3=[N+](C4=C(S3)C=CC(=C4)C)CC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 6, 2: 2, 33: 2, 6: 2, 7: 1, 41: 2, 14: 10, 15: 1, 29: 3}
Did not match all atoms present	20389-38-2	C1=CC=C(C=C1)N2C(=NN=N2)[S-].[Ag+]	{33: 1, 35: 3, 14: 5}
Did not match all atoms present	2039-06-7	C1=CC=C(C=C1)C2=NC(=NN2)C3=CC=CC=C3	{32: 1, 35: 2, 14: 10}
Did not match all atoms present	2039-49-8	C1=CC=C(C=C1)C2=CC(=NO2)C3=CC=CC=C3	{35: 1, 14: 11, 23: 1}
Did not match all atoms present	2039-62-5	C1=CC(=CC=C1C(CN)O)O	{2: 1, 3: 1, 14: 4, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	2039-67-0	COC1=CC=CC(=C1)CCN	{1: 1, 2: 2, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	2039-76-1	CC(=O)C1=CC2=C(C=CC3=CC=CC=C32)C=C1	{24: 1, 1: 1, 14: 9}
Did not match all atoms present	2039-80-7	CN(C)C1=CC=C(C=C1)C=C	{1: 2, 14: 4, 5: 1, 6: 1, 33: 1}
Did not match all atoms present	2039-82-9	C=CC1=CC=C(C=C1)Br	{14: 4, 18: 1, 5: 1, 6: 1}
Did not match all atoms present	2039-83-0	C=CC1=CC(=C(C=C1)Cl)Cl	{17: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	2039-85-2	C=CC1=CC(=CC=C1)Cl	{17: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	2039-86-3	C=CC1=CC(=CC=C1)Br	{14: 4, 18: 1, 5: 1, 6: 1}
Did not match all atoms present	2039-87-4	C=CC1=CC=CC=C1Cl	{17: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	2039-88-5	C=CC1=CC=CC=C1Br	{14: 4, 18: 1, 5: 1, 6: 1}
Did not match all atoms present	2039-89-6	CC1=CC(=C(C=C1)C)C=C	{1: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	2039-90-9	CC1=C(C(=CC=C1)C)C=C	{1: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	2039-93-2	CCC(=C)C1=CC=CC=C1	{1: 1, 2: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	2039-96-5	C[Si](C)(C)CCCS(=O)(=O)[O-].[Na+]	{1: 3, 2: 3, 29: 3}
Did not match all atoms present	20396-66-1	[2H]B([2H])[2H].[2H]B([2H])[2H]	{}
Did not match all atoms present	20397-61-9	C1=CC=C(C=C1)C=C(C(=O)O)F	{16: 1, 27: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	20398-06-5	CC[O-].[Tl+]	{1: 1, 2: 1, 29: 1}
Did not match all atoms present	204-02-4	C1=CC2=C3C(=C1)NC=NC3=CC=C2	{32: 1, 35: 1, 14: 7}
Did not match all atoms present	204-14-8	C1SC2=CC=CC3=C2C(=CC=C3)S1	{41: 2, 11: 1, 14: 6}
Did not match all atoms present	204-34-2	C1=NC2=NC=NC3=NC=NC(=N1)N23	{33: 1, 35: 6, 14: 3}
Did not match all atoms present	2040-00-8	CC[Al](CC)I	{1: 2, 2: 2, 19: 1}
Did not match all atoms present	2040-01-9	CC1=C(C(=C(C(=C1C)C)C(=O)C)C)C	{24: 1, 1: 6}
Did not match all atoms present	2040-04-2	CC(=O)C1=C(C=CC=C1OC)OC	{24: 1, 1: 3, 22: 2, 14: 3}
Did not match all atoms present	2040-05-3	CC(=O)C1=C(C=CC=C1Cl)Cl	{24: 1, 1: 1, 14: 3, 17: 2}
Did not match all atoms present	2040-07-5	CC1=CC(=C(C=C1C(=O)C)C)C	{24: 1, 1: 4, 14: 2}
Did not match all atoms present	2040-10-0	CC1=CC(=CC(=C1C(=O)C)C)C(C)(C)C	{24: 1, 1: 6, 4: 1, 14: 2}
Did not match all atoms present	2040-14-4	CCC(=O)C1=CC=CC=C1C	{24: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	2040-52-0	C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.[Th]	{27: 4}
Did not match all atoms present	2040-90-6	C1=CC(=C(C(=C1)Cl)O)F	{16: 1, 17: 1, 21: 1, 14: 3}
Did not match all atoms present	20403-41-2	CCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCC(=O)[O-].[Pb+2]	{24: 2, 1: 2, 2: 24}
Did not match all atoms present	20405-19-0	CC1=C(C=CC(=C1)Cl)OCC(=O)O.C(CO)NCCO	{1: 1, 2: 5, 14: 3, 17: 1, 20: 2, 22: 1, 27: 1, 31: 1}
Did not match all atoms present	20405-64-5	[Cu].[Cu].[Se]	{}
Did not match all atoms present	2041-14-7	C(CP(=O)(O)O)N	{2: 2, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	2041-19-2	C1=CC=C2C(=C1)C3=C(C2=O)C=CC(=C3)Br	{25: 1, 18: 1, 14: 7}
Did not match all atoms present	2041-74-9	CCN(CC)CCOC1=CC=C(C=C1)/C(=C(/C)\C2=CC=C(C=C2)OC)/C3=CC=C(C=C3)OC	{1: 5, 2: 4, 33: 1, 7: 2, 14: 12, 22: 3}
Did not match all atoms present	20414-85-1	CN=[S@@](=O)(C)C1=CC=CC=C1	{1: 2, 34: 1, 29: 1, 14: 5}
Did not match all atoms present	20416-08-4	COC(=O)C1=COC(=C1)CC2=CC=CC=C2	{1: 1, 2: 1, 28: 1, 14: 7, 23: 1}
Did not match all atoms present	20416-12-0	CCOC(=O)CCC1(OCCO1)CC2=CC=CC=C2	{1: 1, 2: 4, 11: 2, 13: 1, 14: 5, 23: 2, 28: 1}
Did not match all atoms present	20416-14-2	CCOC(=O)C1=COC(=C1)CC2=CC=CC=C2	{1: 1, 2: 2, 28: 1, 14: 7, 23: 1}
Did not match all atoms present	2042-14-0	CC1=C(C=C(C=C1)O)[N+](=O)[O-]	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	2042-37-7	C1=CC=C(C(=C1)C#N)Br	{18: 1, 37: 1, 14: 4}
Did not match all atoms present	20420-07-9	CC=CCP(Cl)Cl	{1: 1, 2: 1, 6: 2, 17: 2}
Did not match all atoms present	20420-15-9	C/C=C/CP(=S)(OC(C)C)OC(C)C	{1: 5, 2: 1, 3: 2, 22: 2, 6: 2}
Did not match all atoms present	20424-95-7	C(C(=O)[O-])F.C(C(=O)[O-])F.[Cu+2]	{16: 2, 24: 2, 2: 2}
Did not match all atoms present	20427-22-9	CN1C=NC2=CN=CN=C21	{1: 1, 35: 3, 14: 3, 33: 1}
Did not match all atoms present	20427-56-9	O=[Ru](=O)(=O)=O	{29: 4}
Did not match all atoms present	20427-58-1	[OH-].[OH-].[Zn+2]	{}
Did not match all atoms present	20427-59-2	[OH-].[OH-].[Cu+2]	{}
Did not match all atoms present	20427-84-3	CCCCCCCCCC1=CC=C(C=C1)OCCOCCO	{1: 1, 2: 12, 20: 1, 22: 2, 14: 4}
Did not match all atoms present	2043-24-5	CN1C(=O)CCC1=S	{1: 1, 11: 2, 25: 1, 33: 1, 15: 1}
Did not match all atoms present	2043-38-1	CC(C)CC1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl	{32: 2, 1: 2, 2: 1, 3: 1, 12: 1, 14: 2, 17: 1, 29: 4, 30: 1}
Did not match all atoms present	20430-33-5	C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)C#N)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{17: 1, 2: 1, 37: 1, 14: 19}
Did not match all atoms present	20432-29-5	C1=CC=C(C=C1)/C=C(\C2=CC=CC=C2)/C(=O)N	{24: 1, 30: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	20436-02-6	CC1(C(CCC1(C)C(=O)[O-])C(=O)NCC(C[Hg]SCC(=O)[O-])OC)C.[Na+].[Na+]	{1: 4, 2: 3, 3: 1, 40: 1, 11: 2, 12: 1, 13: 2, 22: 1, 24: 3, 31: 1}
Did not match all atoms present	204376-00-1	CC(C)CN(CC(C)C)C(=S)SC(=S)N(CC(C)C)CC(C)C	{1: 8, 2: 4, 3: 4, 33: 2, 40: 1, 7: 2}
Did not match all atoms present	2044-27-1	CN1C=CC=CC1=S	{1: 1, 14: 4, 33: 1}
Did not match all atoms present	2044-56-6	[Li+].CCCCCCCCCCCCOS(=O)(=O)[O-]	{1: 1, 2: 11, 29: 3, 22: 1}
Did not match all atoms present	2044-72-6	CC(=O)CC(=O)NC1=C(C=CC(=C1)Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2, 24: 2, 31: 1}
Did not match all atoms present	2044-73-7	C1=CC=NC(=C1)CS	{2: 1, 35: 1, 14: 4, 39: 1}
Did not match all atoms present	2044-88-4	CNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 3, 31: 1}
Did not match all atoms present	20440-93-1	C1=CC(=CC=C1N(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 38: 3, 14: 12}
Did not match all atoms present	20440-95-3	CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C	{1: 2, 14: 13, 33: 1}
Did not match all atoms present	204401-86-5	CC(C)CCCCCCCOCCCN(CCC(=O)O)CCC(=O)[O-].[K+]	{1: 2, 2: 14, 3: 1, 33: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	204401-87-6	CCOC(=O)OCC.C=C(F)F.C(=C(F)F)F	{1: 2, 2: 2, 5: 1, 6: 1, 7: 2, 16: 5}
Did not match all atoms present	20442-79-9	C1=CC=C(C=C1)C2=CC(=CC=C2)I	{19: 1, 14: 9}
Did not match all atoms present	20443-98-5	C1=CC(=C(C(=C1)Cl)CBr)Cl	{17: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	20445-31-2	CO[C@](C1=CC=CC=C1)(C(=O)O)C(F)(F)F	{1: 1, 4: 2, 14: 5, 16: 3, 22: 1, 27: 1}
Did not match all atoms present	20445-33-4	CO[C@](C1=CC=CC=C1)(C(=O)Cl)C(F)(F)F	{1: 1, 4: 2, 14: 5, 16: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	20448-86-6	CCN(CC)CCCOC(=O)C1(CC2CCC1C2)C3=CC=CC=C3	{1: 2, 2: 5, 33: 1, 11: 4, 12: 2, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	20449-79-0	CCC(C)C(C(=O)NCC(=O)NC(C)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCCCN)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(C(C)O)C(=O)NC(C(C)O)C(=O)NCC(=O)NC(CC(C)C)C(=O)N1CCCC1C(=O)NC(C)C(=O)NC(CC(C)C)C(=O)NC(C(C)CC)C(=O)NC(CO)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC(C(C)CC)C(=O)NC(CCCCN)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCCN)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)N)C(=O)N)NC(=O)CN	{32: 1, 1: 22, 2: 34, 3: 33, 36: 2, 33: 1, 7: 2, 11: 3, 12: 1, 14: 5, 20: 3, 24: 28, 30: 9, 31: 26}
Did not match all atoms present	2045-00-3	C1=CC=C(C(=C1)N)[As](=O)(O)O	{30: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	2045-18-3	C1=CC(=CC=C1C(=O)O)N(CCBr)CCBr	{33: 1, 2: 4, 27: 1, 18: 2, 14: 4}
Did not match all atoms present	2045-19-4	C1=CC=C(C=C1)N(CCBr)CCBr	{33: 1, 2: 4, 18: 2, 14: 5}
Did not match all atoms present	2045-41-2	C1=CC(=CC=C1N(CCCl)CCCl)S(=O)(=O)N	{33: 1, 2: 4, 14: 4, 17: 2, 29: 2, 30: 1}
Did not match all atoms present	2045-52-5	CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 2, 2: 3, 33: 2, 14: 10, 17: 1}
Did not match all atoms present	2045-70-7	C1=C(SC(=C1[N+](=O)[O-])N)[N+](=O)[O-]	{41: 1, 38: 2, 30: 1, 14: 1}
Did not match all atoms present	2045-79-6	COC1=CC=CC=C1CCN	{1: 1, 2: 2, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	20451-53-0	C=CS(=O)C1=CC=CC=C1	{14: 5, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	20452-51-1	CCOC(=O)C(CC1=C(C=CC(=C1)OC)OC)C(=O)OCC	{1: 4, 2: 3, 3: 1, 14: 3, 22: 2, 28: 2}
Did not match all atoms present	20455-01-0	C1=CC=CC2=C(C=C1)C=C2	{14: 8}
Did not match all atoms present	20458-99-5	CCC1=C(C(=CC=C1)CC)N=C=O	{1: 2, 2: 2, 8: 1, 34: 1, 14: 3, 29: 1}
Did not match all atoms present	20459-60-3	CC(C)CC(N)P(=O)(O)O	{1: 2, 2: 1, 3: 2, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	20459-61-4	CCC(C)C(N)P(=O)(O)O	{1: 2, 2: 1, 3: 2, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	20459-66-9	C(P(=S)(CCl)Cl)Cl	{17: 3, 2: 2}
Did not match all atoms present	2046-17-5	COC(=O)CCCC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	2046-18-6	C1=CC=C(C=C1)CCCC#N	{2: 3, 37: 1, 14: 5}
Did not match all atoms present	20460-79-1	CN(C1=CC=CC=C1)N/N=C/2\C(=NC=N2)C(=O)N	{1: 1, 34: 1, 35: 2, 33: 1, 14: 6, 15: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	20466-33-5	[Li+].CCCCCCCCCCCCCCCC(=O)[O-]	{24: 1, 1: 1, 2: 14}
Did not match all atoms present	20469-61-8	CC1=CC(=C(C(=C1)OC)C)C	{1: 4, 22: 1, 14: 2}
Did not match all atoms present	20469-63-0	COC1=CC(=C(C=C1)I)OC	{1: 2, 19: 1, 22: 2, 14: 3}
Did not match all atoms present	20469-71-0	C(=S)(NN)S.NN	{39: 1, 31: 1, 30: 3, 7: 1}
Did not match all atoms present	2047-14-5	CCOP(=S)(OCC)SCC(=O)N	{1: 2, 2: 3, 40: 1, 22: 2, 24: 1, 30: 1}
Did not match all atoms present	2047-21-4	CC1=CC(=CC(=C1C)C)C(=O)C	{24: 1, 1: 4, 14: 2}
Did not match all atoms present	2047-30-5	C[NH+](C)CC/C=C\1/C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.[Cl-]	{1: 2, 2: 2, 6: 1, 11: 2, 14: 7, 15: 1, 17: 2}
Did not match all atoms present	2048-07-9	CC1=CC=CC=C1C(=O)C(=O)C2=CC=CC=C2C	{24: 2, 1: 2, 14: 8}
Did not match all atoms present	2048-50-2	C1=CC=C(C=C1)CONC(=O)N	{2: 1, 14: 5, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	20480-66-4	C1CCC2C(C1)CCC3=CC=CC=C23	{11: 6, 12: 2, 14: 4}
Did not match all atoms present	20480-67-5	C1CC[C@@H]2[C@@H](C1)CCC3=CC=CC=C23	{11: 6, 12: 2, 14: 4}
Did not match all atoms present	204841-19-0	B(C1=CC(=CC=C1)C(=O)C)(O)O	{24: 1, 1: 1, 20: 2, 14: 4}
Did not match all atoms present	20485-22-7	CCCC(=O)OC1=CN(C2=CC=CC=C21)C	{1: 2, 2: 2, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	20485-41-0	CC1=C(SC=N1)C(=O)O	{1: 1, 27: 1, 41: 1, 14: 1, 35: 1}
Did not match all atoms present	20485-53-4	C(C(=C[N+]#N)[O-])Cl	{17: 1, 2: 1, 34: 1, 6: 1, 7: 1}
Did not match all atoms present	20485-55-6	C(=C(C(Cl)(Cl)Cl)[O-])[N+]#N	{17: 3, 34: 1, 4: 1, 6: 1, 7: 1}
Did not match all atoms present	20485-57-8	CC1=CC2=C(C=C1)C3=CC=CC4=C3C2=CC=C4	{1: 1, 14: 9}
Did not match all atoms present	2049-55-0	[B].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	2049-57-2	CC(=C)P	{1: 1, 5: 1, 7: 1}
Did not match all atoms present	2049-73-2	CCOC1=CC(=CC=C1)OCC	{1: 2, 2: 2, 22: 2, 14: 4}
Did not match all atoms present	2049-92-5	CCC(C)(C)C1=CC=C(C=C1)N	{1: 3, 2: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	2049-94-7	CC(C)CCC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	2049-95-8	CCC(C)(C)C1=CC=CC=C1	{1: 3, 2: 1, 4: 1, 14: 5}
Did not match all atoms present	2049-96-9	CCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 14: 5}
Did not match all atoms present	20492-39-1	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Ti+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	20492-50-6	C1=CC=NC=C1.C1=CC=NC=C1.O=[Cr](=O)=O	{35: 2, 29: 3, 14: 10}
Did not match all atoms present	20495-12-9	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=C5)C=CC7=C6C8=CC=CC=C8C=C7)C=C3	{14: 20}
Did not match all atoms present	20495-14-1	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=CC7=C6C8=C(C=C7)C=CC9=CC=CC=C98)C=C5)C=C3	{14: 22}
Did not match all atoms present	205-12-9	C1C2=C(C3=CC=CC=C31)C4=CC=CC=C4C=C2	{11: 1, 14: 10}
Did not match all atoms present	205-25-4	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4N3	{32: 1, 14: 10}
Did not match all atoms present	205-43-6	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4S3	{41: 1, 14: 10}
Did not match all atoms present	205-82-3	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC5=C4C3=CC=C5	{14: 12}
Did not match all atoms present	205-83-4	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C5=CC=CC6=C5C4=CC=C6	{14: 14}
Did not match all atoms present	205-94-7	C1=CC=C2C3=C4C(C2=C1)C5=CC=CC=C5C4=CC=C3	{12: 1, 14: 11}
Did not match all atoms present	205-97-0	C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC5=C4C3=CC6=CC=CC=C56	{14: 14}
Did not match all atoms present	205-99-2	C1=CC=C2C3=C4C(=CC=C3)C5=CC=CC=C5C4=CC2=C1	{14: 12}
Did not match all atoms present	2050-03-5	CCC(C)(C)C1=CC=C(C=C1)OC	{1: 4, 2: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	2050-04-6	CCCCCOC1=CC=CC=C1	{1: 1, 2: 4, 22: 1, 14: 5}
Did not match all atoms present	2050-07-9	CC(C)CCC(=O)C1=CC=CC=C1	{24: 1, 1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	2050-08-0	CCCCCOC(=O)C1=CC=CC=C1O	{1: 1, 2: 4, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	2050-14-8	C1=CC=C(C(=C1)NN=C2C=CC=CC2=O)O	{34: 1, 14: 8, 15: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	2050-24-0	CCC1=CC(=CC(=C1)C)CC	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	2050-25-1	C1=CC=C(C=C1)COCCOCCO	{2: 5, 20: 1, 22: 2, 14: 5}
Did not match all atoms present	2050-43-3	CC1=CC(=C(C=C1)NC(=O)C)C	{24: 1, 1: 3, 14: 3, 31: 1}
Did not match all atoms present	2050-46-6	CCOC1=CC=CC=C1OCC	{1: 2, 2: 2, 22: 2, 14: 4}
Did not match all atoms present	2050-47-7	C1=CC(=CC=C1OC2=CC=C(C=C2)Br)Br	{18: 2, 22: 1, 14: 8}
Did not match all atoms present	2050-48-8	C1=CC(=CC=C1S(=O)(=O)C2=CC=C(C=C2)Br)Br	{18: 2, 29: 2, 14: 8}
Did not match all atoms present	2050-49-9	C1=CC=C2C(=C1)C(=CC(=C2O)Br)Br	{18: 2, 21: 1, 14: 5}
Did not match all atoms present	2050-66-0	C1=CC(=C(C=C1Cl)[N+](=O)[O-])SSC2=C(C=C(C=C2)Cl)[N+](=O)[O-]	{40: 2, 17: 2, 38: 2, 14: 6}
Did not match all atoms present	2050-67-1	C1=CC(=CC(=C1)Cl)C2=CC(=CC=C2)Cl	{17: 2, 14: 8}
Did not match all atoms present	2050-68-2	C1=CC(=CC=C1C2=CC=C(C=C2)Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	2050-69-3	C1=CC=C2C(=C1)C=CC(=C2Cl)Cl	{17: 2, 14: 6}
Did not match all atoms present	2050-72-8	C1=CC2=C(C=CC(=C2)Cl)C(=C1)Cl	{17: 2, 14: 6}
Did not match all atoms present	2050-73-9	C1=CC2=C(C=C(C=C2)Cl)C(=C1)Cl	{17: 2, 14: 6}
Did not match all atoms present	2050-74-0	C1=CC2=C(C(=C1)Cl)C(=CC=C2)Cl	{17: 2, 14: 6}
Did not match all atoms present	2050-75-1	C1=CC=C2C=C(C(=CC2=C1)Cl)Cl	{17: 2, 14: 6}
Did not match all atoms present	2050-76-2	C1=CC=C2C(=C1)C(=CC(=C2O)Cl)Cl	{17: 2, 21: 1, 14: 5}
Did not match all atoms present	2050-78-4	CCCCCCCCCCO[N+](=O)[O-]	{1: 1, 2: 9, 22: 1}
Did not match all atoms present	2050-89-7	C1=CC(=CC(=C1)N)C2=CC(=CC=C2)N	{30: 2, 14: 8}
Did not match all atoms present	2050-94-4	CCCCCOC(=O)OCCCCC	{1: 2, 2: 8}
Did not match all atoms present	2050-95-5	CC(C)CCOC(=O)OCCC(C)C	{1: 4, 2: 4, 3: 2}
Did not match all atoms present	20503-92-8	C1COCN1C2=CC=CC=C2	{33: 1, 11: 3, 14: 5, 23: 1}
Did not match all atoms present	2051-05-0	CCCCCOS(=O)OCCCCC	{1: 2, 2: 8, 29: 1, 22: 2}
Did not match all atoms present	2051-07-2	COC1=CC=C(C=C1)C=CC(=O)C=CC2=CC=C(C=C2)OC	{24: 1, 1: 2, 22: 2, 14: 8, 6: 4}
Did not match all atoms present	2051-10-7	C1=CC=C2C(=C1)C=CC3=C2C(=O)C(=O)C4=CC=CC=C34	{25: 2, 14: 10}
Did not match all atoms present	2051-18-5	CC(C)C1=CC=C(C=C1)CCl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	2051-24-3	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 10}
Did not match all atoms present	2051-53-8	CC1=C(C=C(C=C1)C(C)C)N	{1: 3, 3: 1, 30: 1, 14: 3}
Did not match all atoms present	2051-60-7	C1=CC=C(C=C1)C2=CC=CC=C2Cl	{17: 1, 14: 9}
Did not match all atoms present	2051-61-8	C1=CC=C(C=C1)C2=CC(=CC=C2)Cl	{17: 1, 14: 9}
Did not match all atoms present	2051-62-9	C1=CC=C(C=C1)C2=CC=C(C=C2)Cl	{17: 1, 14: 9}
Did not match all atoms present	2051-79-8	CCN(CC)C1=CC(=C(C=C1)N)C.Cl	{1: 3, 2: 2, 33: 1, 14: 3, 17: 1, 30: 1}
Did not match all atoms present	2051-82-3	CCN(C1=CC=C(C=C1)N)C(=O)C	{1: 2, 2: 1, 33: 1, 14: 4, 24: 1, 30: 1}
Did not match all atoms present	2051-84-5	CC(C)CCNC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	2051-85-6	C1=CC=C(C=C1)NN=C2C=CC(=O)C=C2O	{34: 1, 14: 8, 15: 2, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	2051-89-0	C1=CC(=CC=C1C2=CC(=C(C=C2)N)S(=O)(=O)O)N	{30: 2, 20: 1, 29: 2, 14: 7}
Did not match all atoms present	2051-90-3	C1=CC=C(C=C1)C(C2=CC=CC=C2)(Cl)Cl	{17: 2, 4: 1, 14: 10}
Did not match all atoms present	2051-95-8	C1=CC=C(C=C1)C(=O)CCC(=O)O	{24: 1, 2: 2, 27: 1, 14: 5}
Did not match all atoms present	2051-96-9	CC(C(=O)OCC1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	2051-97-0	C1=CC=C(C=C1)CN2C=CC=C2	{33: 1, 2: 1, 14: 9}
Did not match all atoms present	2051-98-1	C1CC2=CC=CC3=C(C=CC1=C23)Br	{18: 1, 11: 2, 14: 5}
Did not match all atoms present	20511-12-0	C1=CC(=NC=C1I)N	{35: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	20513-25-1	CC1(C(=S)NC(=S)N1)C	{32: 2, 1: 2, 13: 1, 15: 2}
Did not match all atoms present	2052-06-4	CCN(CC)C1=CC=C(C=C1)Br	{1: 2, 2: 2, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	2052-07-5	C1=CC=C(C=C1)C2=CC=CC=C2Br	{18: 1, 14: 9}
Did not match all atoms present	2052-14-4	CCCCOC(=O)C1=CC=CC=C1O	{1: 1, 2: 3, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	2052-46-2	CN(C)C1=CC=C(C=C1)N.Cl	{1: 2, 33: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	2052-49-5	CCCC[N+](CCCC)(CCCC)CCCC.[OH-]	{1: 4, 2: 12}
Did not match all atoms present	20520-98-3	C1C[C@H]([C@H](C1)O)C[NH2+]CC2=CC=CC=C2	{20: 1, 2: 2, 11: 3, 12: 2, 14: 5}
Did not match all atoms present	20527-10-0	CC1=CC=C([As]1C2=CC=CC=C2)C	{1: 2, 14: 7, 15: 2}
Did not match all atoms present	2053-25-0	CC[NH+](CC)CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CC3=CC=C(C=C3)OCC.[Cl-]	{1: 3, 2: 6, 35: 1, 38: 1, 33: 1, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	20532-03-0	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=CC5=CC=CC=C5C6=CC=CC=C64	{14: 18}
Did not match all atoms present	20534-12-7	B1(C(=C(B(C(=C1C)C)F)C)C)F	{16: 2, 1: 4, 15: 4}
Did not match all atoms present	20535-82-4	CN1C=NC2=C1N=CN(C2=O)C	{1: 2, 35: 2, 33: 2, 14: 2, 25: 1}
Did not match all atoms present	20537-88-6	C(CN)CNCCSP(=O)(O)O	{2: 5, 40: 1, 20: 2, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	20538-35-6	CN1CCC(C1)(CO)C2=CC=CC=C2	{1: 1, 2: 1, 33: 1, 11: 3, 13: 1, 14: 5, 20: 1}
Did not match all atoms present	20539-12-2	[O-]P(=O)([O-])[O-].[Na+].[Zn+2]	{29: 4}
Did not match all atoms present	2054-35-5	C1CC2=CC=CC=C2SC1	{41: 1, 11: 3, 14: 4}
Did not match all atoms present	20541-49-5	C1=CC(=CC=C1Cl)[Se][Se]C2=CC=C(C=C2)Cl	{17: 2, 14: 8}
Did not match all atoms present	20541-54-2	C1=CC=C2C(=C1)C(=CC(=C2[N+]#N)O)S(=O)(=O)O	{34: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	20544-37-0	C1C2(COP(=O)(O1)CC3=CC=CC=C3)COP(=O)(OC2)CC4=CC=CC=C4	{2: 2, 11: 4, 13: 1, 14: 10, 23: 4, 29: 2}
Did not match all atoms present	20546-50-3	CN1CCO[Si](OCC1)(C)C	{1: 3, 11: 4, 33: 1, 23: 2}
Did not match all atoms present	20548-54-3	S=[Ca]	{}
Did not match all atoms present	2055-40-5	CC(C)C1=CC=C(C=C1)C=C	{1: 2, 14: 4, 3: 1, 5: 1, 6: 1}
Did not match all atoms present	2055-46-1	C1CNC(=S)NC1	{32: 2, 11: 3, 15: 1}
Did not match all atoms present	20550-47-4	C[As]1[As]([As]([As]([As]1C)C)C)C	{1: 5}
Did not match all atoms present	20551-10-4	CN1C2=CC=CC3=C2C(=CC=C3)N=C1N	{1: 1, 35: 1, 30: 1, 14: 6, 33: 1}
Did not match all atoms present	205526-26-7	C1=CC=C(C(=C1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)F	{2: 2, 3: 1, 12: 1, 14: 12, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	205526-34-7	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=C(C=C4)C#N)C(=O)O	{2: 2, 3: 1, 37: 1, 12: 1, 14: 12, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	205526-36-9	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=CC(=C4)C#N)C(=O)O	{2: 2, 3: 1, 37: 1, 12: 1, 14: 12, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	205526-37-0	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=CC(=C4)C#N)C(=O)O	{2: 2, 3: 1, 37: 1, 12: 1, 14: 12, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	205528-32-1	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CSC=N4)C(=O)[O-]	{2: 2, 3: 1, 41: 1, 12: 1, 14: 10, 35: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	205528-33-2	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CSC=N4)C(=O)O	{2: 2, 3: 1, 41: 1, 12: 1, 14: 10, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	20555-91-3	C1=CC(=C(C=C1I)Cl)Cl	{17: 2, 19: 1, 14: 3}
Did not match all atoms present	20556-89-2	CCCC[Sn](CCCC)(OC(=O)C1=CC=C(C=C1)C(C)(C)C)OC(=O)C2=CC=C(C=C2)C(C)(C)C	{1: 8, 2: 6, 4: 2, 14: 8, 28: 2}
Did not match all atoms present	2056-98-6	C1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O	{33: 1, 2: 1, 35: 1, 11: 1, 12: 3, 14: 2, 20: 5, 22: 3, 23: 1, 25: 1, 29: 3, 30: 1}
Did not match all atoms present	20561-39-1	[At-]	{}
Did not match all atoms present	20561-58-4	[Re+]	{}
Did not match all atoms present	20563-00-2	CCCCCCCCCCCCCCCCCC(=O)[O-].[Cu+]	{24: 1, 1: 1, 2: 16}
Did not match all atoms present	20567-38-8	COC1=C(C=C(C(=C1)C=CC(=O)O)[N+](=O)[O-])OC	{1: 2, 6: 2, 38: 1, 14: 2, 22: 2, 27: 1}
Did not match all atoms present	205676-17-1	C1=CC(=CC=C1C(=CO)C=O)Cl	{6: 1, 7: 1, 14: 4, 17: 1, 20: 1, 26: 1}
Did not match all atoms present	20568-80-3	COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)N/N=C\3/C4=CC=CC=C4C=C(C3=O)C(=O)NC5=CC(=C(C=C5OC)OC)Cl	{1: 3, 34: 1, 14: 15, 15: 2, 17: 1, 22: 3, 24: 2, 25: 1, 31: 3}
Did not match all atoms present	205680-83-7	C1=CC(=C(C(=C1)C(C=O)C=O)[N+](=O)[O-])C(=O)O	{27: 1, 26: 2, 3: 1, 38: 1, 14: 3}
Did not match all atoms present	2057-34-3	CC=CCC(CC=CC)C1=CC=NC=C1	{1: 2, 2: 2, 3: 1, 6: 4, 14: 4, 35: 1}
Did not match all atoms present	2057-42-3	CC=CCC(CC=CC)C1=CC=CC=N1	{1: 2, 2: 2, 3: 1, 6: 4, 14: 4, 35: 1}
Did not match all atoms present	2057-43-4	CC=CCCC1=CC=CC=N1	{1: 1, 2: 2, 35: 1, 14: 4, 6: 2}
Did not match all atoms present	2057-47-8	C1=CC=C(C=C1)CCC(CCC2=CC=CC=C2)C3=CC=NC=C3	{35: 1, 2: 4, 3: 1, 14: 14}
Did not match all atoms present	2057-49-0	C1=CC=C(C=C1)CCCC2=CC=NC=C2	{2: 3, 35: 1, 14: 9}
Did not match all atoms present	2057-82-1	CC(C)C=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 34: 1, 3: 1, 38: 2, 6: 1, 14: 3, 31: 1}
Did not match all atoms present	2057-84-3	CCCCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 38: 2, 6: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	20570-25-6	COP1OC2=CC=CC=C2O1	{1: 1, 22: 1, 14: 4, 23: 2}
Did not match all atoms present	20570-96-1	C1=CC=C(C=C1)CNN.Cl.Cl	{17: 2, 2: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	20571-42-0	CCN(CC)C1=CC2=C(C=C1)C=CC(=O)O2	{1: 2, 2: 2, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	205744-82-7	C1=CC(=C(C=C1Cl)[N+](=O)[O-])C(C=O)C=O	{17: 1, 26: 2, 3: 1, 38: 1, 14: 3}
Did not match all atoms present	205744-84-9	C1=CC=C2C(=C1)N=CC(=N2)C(C=O)C=O	{35: 2, 26: 2, 3: 1, 14: 5}
Did not match all atoms present	205764-96-1	[Li+].CNC(=O)CN(C)C1=NC(=NC(=N1)NC2=CC(=C(C=C2)S(=O)(=O)[O-])N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=C(C=CC(=C5)NC6=NC(=NC(=N6)Cl)N(C)CC(=O)NC)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[K+]	{1: 4, 2: 2, 35: 6, 33: 2, 34: 3, 14: 8, 15: 2, 17: 2, 24: 2, 25: 1, 29: 12, 30: 1, 31: 5}
Did not match all atoms present	2058-46-0	C[C@@]1([C@H]2[C@@H]([C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O)O.Cl	{1: 3, 33: 1, 12: 4, 13: 2, 14: 3, 15: 4, 17: 1, 20: 5, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	2058-52-8	CN1CCN(CC1)C2=NC3=CC=CC=C3SC4=C2C=C(C=C4)Cl	{1: 1, 35: 1, 33: 2, 41: 1, 11: 4, 14: 7, 15: 1, 17: 1}
Did not match all atoms present	2058-62-0	CC1=CC(=CC=C1)N=NC2=CC=C(C=C2)NC	{1: 2, 34: 2, 14: 8, 31: 1}
Did not match all atoms present	2058-66-4	CCN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 2, 2: 1, 34: 2, 14: 9, 33: 1}
Did not match all atoms present	2058-67-5	CCNC1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 1, 2: 1, 34: 2, 14: 9, 31: 1}
Did not match all atoms present	2058-74-4	CN1C2=CC=CC=C2C(=O)C1=O	{1: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	20582-71-2	Cl[Hg-2](Cl)(Cl)Cl.[K+].[K+]	{17: 4}
Did not match all atoms present	20583-44-2	C1=CC=C2C(=C1)C(=O)N(C2=O)C=CCl	{17: 1, 33: 1, 14: 4, 6: 2, 25: 2}
Did not match all atoms present	20587-61-5	C1=CC=C(C=C1)C(=O)OCCOCCO	{28: 1, 2: 4, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	205873-26-3	CN[C@@H](C1=CC(=CC=C1)C(F)(F)F)[C@H](C2=CC(=CC=C2)C(F)(F)F)NC	{1: 2, 3: 2, 4: 2, 14: 8, 16: 6, 31: 2}
Did not match all atoms present	205873-28-5	COC(=O)C1=CC2=C(N1)C=CC(=C2)S(=O)(=O)C	{32: 1, 1: 2, 28: 1, 29: 2, 14: 4}
Did not match all atoms present	20589-63-3	C1=CC2=C3C(=C1)C4=C5C(=CC=C4)C(=CC=C5C3=CC=C2)[N+](=O)[O-]	{38: 1, 14: 11}
Did not match all atoms present	2059-76-9	C1=CC(=CC=C1N=C=S)I	{8: 1, 34: 1, 19: 1, 14: 4}
Did not match all atoms present	20591-23-5	CCN1C(=CC=CC2=CC=[N+](C3=CC=CC=C23)CC)C=CC4=CC=CC=C41.[I-]	{1: 2, 2: 2, 6: 3, 33: 2, 14: 12, 15: 1, 19: 1}
Did not match all atoms present	20595-30-6	C1=CC(=CC(=C1)F)C=CC(=O)O	{16: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	20595-45-3	C1=CC(=C(C=C1Cl)Cl)/C=C/C(=O)O	{17: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	205985-96-2	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(C=O)C=O	{27: 1, 26: 2, 3: 1, 38: 1, 14: 3}
Did not match all atoms present	206-00-8	C1=CC=C2C(=C1)C3=CC=CC4=CC5=C(C2=C43)C=CC=N5	{35: 1, 14: 11}
Did not match all atoms present	206-06-4	C1=CC=C2C=C3C4=C5C(=CC=C4)C6=CC=CC=C6C5=CC3=CC2=C1	{14: 14}
Did not match all atoms present	206-44-0	C1=CC=C2C(=C1)C3=CC=CC4=C3C2=CC=C4	{14: 10}
Did not match all atoms present	206-49-5	C1=CC2=C3C(=C1)C4=C(C3=CC=C2)N=CC=C4	{35: 1, 14: 9}
Did not match all atoms present	206-56-4	C1=CC=C2C(=C1)C3=CC=CC4=C3C2=NC=C4	{35: 1, 14: 9}
Did not match all atoms present	2060-89-1	C[Si](C)(C)C1=CC(=CC=C1)[Si](C)(C)C	{1: 6, 14: 4}
Did not match all atoms present	20603-88-7	O.O.[Cl-].[Cl-].[Mn+2]	{17: 2}
Did not match all atoms present	206060-42-6	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC(=CC=C4)[N+](=O)[O-])C(=O)O	{2: 2, 3: 1, 38: 1, 12: 1, 14: 12, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	2061-56-5	CC12CCC3C(C1CC[C@]2(C#CC(F)(F)F)O)CCC4=C3C=CC(=C4)O	{1: 1, 4: 1, 10: 2, 11: 6, 12: 3, 13: 2, 14: 3, 16: 3, 20: 1, 21: 1}
Did not match all atoms present	20611-21-6	C1=CC=C(C=C1)S(=O)(=O)CCO	{2: 2, 20: 1, 29: 2, 14: 5}
Did not match all atoms present	20619-16-3	O=[GeH2]	{29: 1}
Did not match all atoms present	20619-78-7	CC1=CC(N(C2=CC=CC=C12)N=O)(C)C	{1: 3, 34: 1, 33: 1, 13: 1, 14: 5, 15: 1, 29: 1}
Did not match all atoms present	2062-25-1	C1=CC=C(C(=C1)/C=C/C(=O)O)C(F)(F)F	{16: 3, 27: 1, 4: 1, 14: 4, 6: 2}
Did not match all atoms present	2062-77-3	C1CN(CCC1(C2=CC(=CC=C2)C(F)(F)F)O)CCCC(=O)C3=CC=C(C=C3)F.Cl	{33: 1, 2: 3, 4: 1, 11: 4, 13: 1, 14: 8, 16: 4, 17: 1, 20: 1, 24: 1}
Did not match all atoms present	2062-78-4	C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F	{32: 1, 33: 2, 2: 3, 3: 1, 11: 4, 12: 1, 14: 12, 16: 2, 25: 1}
Did not match all atoms present	2062-84-2	C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(=O)C4=CC=C(C=C4)F	{32: 1, 33: 2, 2: 3, 11: 4, 12: 1, 14: 8, 16: 1, 24: 1, 25: 1}
Did not match all atoms present	20620-82-0	C1=CC=C2C(=C1)N=C3N2C4=CC=CC5=C4C3=CC=C5	{33: 1, 35: 1, 14: 10}
Did not match all atoms present	20624-25-3	CCN(CC)C(=S)[S-].O.O.O.[Na+]	{1: 2, 2: 2, 33: 1, 7: 1}
Did not match all atoms present	20627-28-5	CC1=CC2=CC=CC=C2C3=CC4=CC=CC=C4C(=C13)C	{1: 2, 14: 10}
Did not match all atoms present	20627-31-0	CC1=CC=CC2=C1C=C3C=CC4=CC=CC=C4C3=C2C	{1: 2, 14: 10}
Did not match all atoms present	20627-73-0	COC(C1=CC=CC=C1[N+](=O)[O-])OC	{38: 1, 1: 2, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	20628-33-5	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)Cl)N	{17: 1, 30: 1, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	20628-59-5	C1COC(=S)O1	{23: 2, 11: 2, 15: 1}
Did not match all atoms present	2063-88-9	C1C2C=CC1N(C=C2)S(=O)(=O)C3=CC=CC=C3	{33: 1, 11: 1, 12: 2, 29: 2, 14: 9}
Did not match all atoms present	2063-89-0	C1CC2CC1C=CN2S(=O)(=O)C3=CC=CC=C3	{33: 1, 11: 3, 12: 2, 29: 2, 14: 7}
Did not match all atoms present	20633-11-8	CCCCCCO[N+](=O)[O-]	{1: 1, 2: 5, 22: 1}
Did not match all atoms present	20634-12-2	N.N.N.N.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Pt+2]	{}
Did not match all atoms present	20636-14-0	COCCCCOC1=CC=CC=C1	{1: 1, 2: 4, 22: 2, 14: 5}
Did not match all atoms present	20637-02-9	COC(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 3, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	20637-03-0	COC(=O)CCCC1=CC=C(C=C1)C#N	{1: 1, 2: 3, 28: 1, 37: 1, 14: 4}
Did not match all atoms present	20637-05-2	COC(=O)CCCC1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 3, 28: 1, 14: 4}
Did not match all atoms present	20637-07-4	COC(=O)CCCC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 2: 3, 28: 1, 14: 9}
Did not match all atoms present	20637-08-5	COC1=CC=C(C=C1)CCCC(=O)OC	{1: 2, 2: 3, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	20637-09-6	COC(=O)CCCC1=CC=C(C=C1)N	{1: 1, 2: 3, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	20638-10-2	O=[Se]([O-])O	{20: 1, 29: 2}
Did not match all atoms present	20638-52-2	C1COCCC1C2=CC=CC=C2	{11: 4, 12: 1, 14: 5, 23: 1}
Did not match all atoms present	2064-23-5	CC(CN1C2=CC=CC=C2CCC3=CC=CC=C31)N(C)C	{1: 3, 2: 1, 3: 1, 33: 2, 11: 2, 14: 8}
Did not match all atoms present	206439-02-3	CCC1=CC(=CC(=C1NC(=O)CCl)CC)O	{1: 2, 2: 3, 14: 2, 17: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	20644-97-7	[O].[V+2]	{}
Did not match all atoms present	20645-04-9	CC(=O)[O-].CC(=O)[O-].O=[Zr+2]	{24: 2, 1: 2, 29: 1}
Did not match all atoms present	2065-23-8	COC(=O)COC1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	2065-27-2	COC1=C(C(=CC=C1)OC)C(=O)OC	{1: 3, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	2065-66-9	C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]	{1: 1, 19: 1, 14: 15}
Did not match all atoms present	2065-67-0	C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]	{19: 1, 14: 20}
Did not match all atoms present	2065-70-5	C1=CC2=C(C=CC(=C2)Cl)C=C1Cl	{17: 2, 14: 6}
Did not match all atoms present	2065-73-8	[2H]OC(=O)C(=O)O[2H]	{27: 2}
Did not match all atoms present	20651-65-4	CCCCC1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 3, 14: 4}
Did not match all atoms present	20651-66-5	CCCCC1=CC(=CC=C1)F	{16: 1, 1: 1, 2: 3, 14: 4}
Did not match all atoms present	20651-69-8	CCCCC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 3, 28: 1, 14: 4}
Did not match all atoms present	20651-71-2	CCCCC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 3, 27: 1, 14: 4}
Did not match all atoms present	20651-73-4	CCCCC1=CC=C(C=C1)C#N	{1: 1, 2: 3, 37: 1, 14: 4}
Did not match all atoms present	20651-74-5	CCCCC1=CC=CC(=C1)C#N	{1: 1, 2: 3, 37: 1, 14: 4}
Did not match all atoms present	20651-75-6	CCCCC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 4}
Did not match all atoms present	20651-76-7	CCCCC1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 4}
Did not match all atoms present	20651-88-1	CC1(C2=CC=CC=C2C(=O)C1=O)C	{1: 2, 13: 1, 14: 4, 25: 2}
Did not match all atoms present	20653-04-7	C1=CC=C(C=C1)C(=O)CC(=O)NC2=CC=CC3=CC=CC=C32	{24: 2, 2: 1, 14: 12, 31: 1}
Did not match all atoms present	20653-11-6	CC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-]	{1: 2, 38: 2, 4: 1, 22: 2, 14: 16}
Did not match all atoms present	20653-98-9	[Al-].[O].[O]	{}
Did not match all atoms present	20654-56-2	[O-][Re](=O)(=O)=O.[Ag+]	{29: 4}
Did not match all atoms present	2066-93-5	C1=CC=C2C(=C1)C(=CC(=O)C2=O)S(=O)(=O)O	{25: 2, 20: 1, 29: 2, 14: 5, 15: 1}
Did not match all atoms present	20662-14-0	O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Sc+3]	{17: 3}
Did not match all atoms present	20662-53-7	C1CNCCC1N2C3=CC=CC=C3NC2=O	{32: 2, 33: 1, 11: 4, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	20662-83-3	CC1=C(OC=N1)C	{1: 2, 35: 1, 14: 1, 23: 1}
Did not match all atoms present	20662-84-4	CC1=C(OC(=N1)C)C	{1: 3, 35: 1, 23: 1}
Did not match all atoms present	20662-87-7	CCCCCCC1=NC(=C(O1)C)C	{1: 3, 2: 5, 35: 1, 23: 1}
Did not match all atoms present	20662-90-2	CC1=NC(=CO1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 6, 23: 1}
Did not match all atoms present	206658-89-1	B(C1=CC(=CC=C1)N)(O)O.O	{20: 2, 30: 1, 14: 4}
Did not match all atoms present	20666-86-8	C1CCC(CC1)OC(=O)OOC(=O)C2=CC=CC=C2	{28: 1, 11: 5, 12: 1, 14: 5}
Did not match all atoms present	20667-13-4	CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1C.[Br-]	{1: 2, 2: 15, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	20668-28-4	CC1=CC2=NC=C(C=C2C=C1)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	20668-29-5	CC1=CC=CC2=CC(=CN=C12)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	20668-30-8	CC1=C(C2=C(C=C1)N=CC=C2)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	20668-33-1	CC1=C(C=C2C(=C1)C=CC=N2)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	2067-58-5	C1=CC(=CC=C1N)N(CCCl)CCCl	{17: 2, 2: 4, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	2067-84-7	C1=CC2=C(NC(=O)C(=O)N2)N=C1	{32: 2, 25: 2, 35: 1, 14: 3}
Did not match all atoms present	20672-23-5	CC1=CC2=CC=CC=C3C2=C(C=C3)C(=C1)C	{1: 2, 14: 8}
Did not match all atoms present	20675-51-8	CCCCCC1=CC2=C(C=CC(O2)(C)CCC=C(C)C)C(=C1)O	{1: 4, 2: 6, 6: 1, 7: 1, 13: 1, 14: 4, 21: 1, 23: 1}
Did not match all atoms present	2068-80-6	C([C@@H](C(=O)O)N)C(=O)[O-].C([C@@H](C(=O)O)N)C(=O)[O-].[Mg+2]	{24: 2, 27: 2, 2: 2, 3: 2, 30: 2}
Did not match all atoms present	20680-07-3	CNC(=O)NC1=CC=C(C=C1)Br	{24: 1, 1: 1, 18: 1, 14: 4, 31: 2}
Did not match all atoms present	20681-14-5	[Au+]	{}
Did not match all atoms present	20684-06-4	CCN(CCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CC3=CC=CC=C3)CCO.Cl	{1: 3, 2: 6, 35: 1, 33: 4, 14: 5, 17: 1, 20: 1, 25: 2}
Did not match all atoms present	20684-29-1	CCC(C(=O)OC1=C(C=CC=C1C)C)N2CCN(CC2)C.Cl	{1: 4, 2: 1, 3: 1, 33: 2, 11: 4, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	20685-78-3	C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)NCN5CCCC5)N(C)C)O.[N+](=O)(O)[O-]	{1: 3, 2: 1, 33: 2, 11: 5, 12: 3, 13: 2, 14: 3, 15: 4, 20: 5, 21: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	20686-45-7	CCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)C	{1: 2, 2: 4, 33: 3, 41: 1, 11: 4, 14: 7, 24: 1}
Did not match all atoms present	20686-65-1	CC1=NC2=C(O1)C3=CC=CC=C3C=C2	{1: 1, 35: 1, 14: 6, 23: 1}
Did not match all atoms present	20686-66-2	CC1=NC2=CC3=CC=CC=C3C=C2O1	{1: 1, 35: 1, 14: 6, 23: 1}
Did not match all atoms present	206860-48-2	C1=CC(=C(C=C1F)C(F)(F)F)CBr	{16: 4, 2: 1, 4: 1, 18: 1, 14: 3}
Did not match all atoms present	20689-96-7	CCN(CC1=CC=CC=C1)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 14: 5, 29: 1}
Did not match all atoms present	2069-14-9	C1=CC=C(C(=C1)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])Br	{4: 1, 38: 1, 14: 7, 16: 3, 18: 1, 22: 1}
Did not match all atoms present	2069-71-8	CN(C)C1=CC(=C(C=C1)[N+](=O)[O-])N	{1: 2, 38: 1, 30: 1, 14: 3, 33: 1}
Did not match all atoms present	20691-83-2	CN(C)C1=CC=C(C=C1)N=NC2=CC(=CC=C2)OC	{1: 3, 34: 2, 22: 1, 14: 8, 33: 1}
Did not match all atoms present	20691-84-3	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC(=C2)C(=O)O	{1: 2, 34: 2, 27: 1, 14: 8, 33: 1}
Did not match all atoms present	20694-39-7	O.O.O.O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Mn+2]	{}
Did not match all atoms present	20697-04-5	C1C(O1)C2=CC(=CC=C2)Cl	{17: 1, 11: 1, 12: 1, 14: 4, 23: 1}
Did not match all atoms present	20698-91-3	COC(=O)[C@@H](C1=CC=CC=C1)O	{1: 1, 3: 1, 20: 1, 14: 5, 28: 1}
Did not match all atoms present	206986-80-3	C1=CC(=CC=C1Cl)[Se](=O)O[Se](=O)C2=CC=C(C=C2)Cl	{17: 2, 22: 1, 14: 8, 29: 2}
Did not match all atoms present	207-08-9	C1=CC=C2C=C3C4=CC=CC5=C4C(=CC=C5)C3=CC2=C1	{14: 12}
Did not match all atoms present	207-11-4	C1=CC=C2C(=C1)N=C3C4=CC=CC5=C4C(=CC=C5)C3=N2	{35: 2, 14: 10}
Did not match all atoms present	207-83-0	C1C2=C(C3=C1C4=CC=CC=C4C=C3)C5=CC=CC=C5C=C2	{11: 1, 14: 12}
Did not match all atoms present	207-84-1	C1=CC=C2C(=C1)C=CC3=C2C4=C(N3)C5=CC=CC=C5C=C4	{32: 1, 14: 12}
Did not match all atoms present	207-85-2	C1=CC=C2C(=C1)C=CC3=C2C4=C(N3)C5=C(C=C4)N=CC=C5	{32: 1, 35: 1, 14: 11}
Did not match all atoms present	207-89-6	C1=CC=C2C(=C1)C=CC3=C2NC4=C3C5=C(C=C4)N=CC=C5	{32: 1, 35: 1, 14: 11}
Did not match all atoms present	20707-70-4	C1=CC=C(C=C1)C=CC=NO	{34: 1, 20: 1, 14: 5, 6: 3}
Did not match all atoms present	2071-20-7	C1=CC=C(C=C1)P(CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 1, 14: 20}
Did not match all atoms present	20712-42-9	C(=O)(C(=O)[O-])[O-].O.O.O.[Cd+2]	{24: 2}
Did not match all atoms present	20712-83-8	[NH3+]O	{20: 1}
Did not match all atoms present	207124-67-2	C1=CC=C(C(=C1)C=O)O.C1=CC=C(C(=C1)C=O)O.O.O.[Co]	{26: 2, 21: 2, 14: 8}
Did not match all atoms present	207124-69-4	C1=CC=C(C(=C1)N/C=C/2\C(=O)C=CC=C2)N/C=C/3\C(=O)C=CC=C3.O.[Co]	{25: 2, 31: 2, 14: 12, 6: 2, 15: 2}
Did not match all atoms present	20718-55-2	CC1=CC2=S(S1)SC=C2	{1: 1, 41: 2, 14: 3, 15: 2}
Did not match all atoms present	20719-22-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=CC=[N+](C=C5)C	{1: 4, 6: 2, 33: 2, 14: 28, 24: 2, 29: 6, 31: 4}
Did not match all atoms present	20719-23-7	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=CC=[N+](C=C5)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 6: 2, 33: 2, 14: 28, 24: 2, 29: 6, 31: 4}
Did not match all atoms present	2072-68-6	COC1=CC=C(C2=NC3=CC=CC(=C3N=C12)C(=O)O)COC(CO)O	{1: 1, 2: 2, 3: 1, 14: 5, 35: 2, 20: 2, 22: 2, 27: 1}
Did not match all atoms present	20722-48-9	[2H]C1=C(C2=CC=CC=C2C3=CC=CC=C13)[2H]	{14: 10}
Did not match all atoms present	207291-85-8	C1=CC(=C(C(=C1)O)F)C(F)(F)F	{16: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	20730-02-3	CCC(=O)NNC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5, 31: 2}
Did not match all atoms present	20730-67-0	CCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCC	{1: 2, 2: 4, 34: 2, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	207308-34-7	CS(=O)(=O)[O-].C(=[NH2+])(N)O	{1: 1, 20: 1, 29: 3, 30: 2, 7: 1}
Did not match all atoms present	20731-48-0	COC1=C(C(=CC(=C1)C(=O)O)Br)OC	{1: 2, 18: 1, 27: 1, 22: 2, 14: 2}
Did not match all atoms present	20731-62-8	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Tm+3].[Tm+3]	{29: 12}
Did not match all atoms present	20731-74-2	CSC1=CSC=C1	{40: 1, 1: 1, 14: 3, 41: 1}
Did not match all atoms present	20734-56-9	CNC1=CC=CC2=C1C(=CC=C2)NC	{1: 2, 14: 6, 31: 2}
Did not match all atoms present	20734-58-1	CN(C)C1=CC=CC2=C1C(=CC=C2)N(C)C	{1: 4, 14: 6, 33: 2}
Did not match all atoms present	20736-88-3	CC1=CC(=NC=C1)C.Cl	{1: 2, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	20738-78-7	C1=CC(=CN=C1)[Hg]C2=CN=CC=C2	{35: 2, 14: 8}
Did not match all atoms present	2074-03-5	CCCCC/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C	{1: 2, 2: 4, 38: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	2074-05-7	CCCCCCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 5, 38: 2, 6: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	2074-50-2	C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]	{1: 4, 33: 2, 22: 2, 14: 8, 29: 6}
Did not match all atoms present	20743-50-4	CN1C(=NN=N1)C2=CC=CC=C2	{1: 1, 35: 3, 14: 5, 33: 1}
Did not match all atoms present	20743-57-1	C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3	{24: 1, 14: 14, 31: 1}
Did not match all atoms present	20743-94-6	CCCOC1=CC=C(C=C1)OC	{1: 2, 2: 2, 22: 2, 14: 4}
Did not match all atoms present	20743-95-7	CCCCOC1=CC=C(C=C1)OC	{1: 2, 2: 3, 22: 2, 14: 4}
Did not match all atoms present	20743-97-9	CCCCCCCOC1=CC=C(C=C1)OC	{1: 2, 2: 6, 22: 2, 14: 4}
Did not match all atoms present	20743-99-1	CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)OC	{1: 2, 2: 15, 22: 2, 14: 4}
Did not match all atoms present	20744-02-9	CC(C)OC1=CC=C(C=C1)OC	{1: 3, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	20746-54-7	CN(C)C1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)N=C=S)C(=O)O3)C5=C(O2)C=C(C=C5)N(C)C	{1: 4, 34: 1, 33: 2, 8: 1, 13: 1, 14: 9, 23: 1, 28: 1}
Did not match all atoms present	2075-45-8	C1=C(C=NN1)Br	{32: 1, 18: 1, 35: 1, 14: 2}
Did not match all atoms present	2075-46-9	C1=C(C=NN1)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 2}
Did not match all atoms present	20753-31-5	CC(C)OC(=S)NC	{31: 1, 1: 3, 3: 1, 22: 1, 7: 1}
Did not match all atoms present	20753-53-1	C1=CC(=CC=C1Cl)[Se](=O)O	{17: 1, 20: 1, 29: 1, 14: 4}
Did not match all atoms present	207556-02-3	C(P(=O)(O)O)P(=O)(O)O.[Na+].[Na+].[Na+]	{2: 1, 20: 4, 29: 2}
Did not match all atoms present	207569-15-1	C1=CC=C(C=C1)OC2=CC3=C4NC(=C3C=C2)NC5=C6C=C(C=CC6=C([N-]5)NC7=C8C=C(C=CC8=C(N7)NC9=C1C=C(C=CC1=C(N4)[N-]9)OC1=CC=CC=C1)OC1=CC=CC=C1)OC1=CC=CC=C1.[Ni+2]	{32: 6, 35: 2, 22: 4, 14: 32}
Did not match all atoms present	20758-58-1	COCC(=O)[O-]	{24: 1, 1: 1, 2: 1, 22: 1}
Did not match all atoms present	20758-95-6	OP1(=O)OP(=O)(OP(=O)(O1)O)O.OP1(=O)OP(=O)(OP(=O)(O1)O)O.[Ca+2].[Ca+2].[Ca+2]	{20: 6, 29: 6, 23: 6}
Did not match all atoms present	20762-60-1	[N-]=[N+]=[N-].[K+]	{34: 1}
Did not match all atoms present	20762-71-4	CCCCCCCCCCCC[N+]1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 2, 2: 11, 29: 3, 14: 9, 33: 1}
Did not match all atoms present	20762-98-5	C1=COC(=C1)C(=O)N=[N+]=[N-]	{24: 1, 34: 2, 14: 3, 23: 1}
Did not match all atoms present	20766-36-3	CC(=O)/C=C/C1=CC(=CC=C1)Cl	{24: 1, 1: 1, 14: 4, 6: 2, 17: 1}
Did not match all atoms present	20766-37-4	CC(=O)/C=C/C1=CC=CC=C1Cl	{24: 1, 1: 1, 14: 4, 6: 2, 17: 1}
Did not match all atoms present	20766-40-9	CC(=O)C=CC1=CC=CC=C1[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4, 6: 2}
Did not match all atoms present	20768-67-6	O.[Al]	{}
Did not match all atoms present	207683-22-5	[B-](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.O.O.[Na+]	{16: 4, 14: 16}
Did not match all atoms present	207692-02-2	C1=CC=C2C(=C1)C(=C(N2)C3=C(C4=CC=CC=C4N3)[O-])O.C1=CC=C2C(=C1)C(=C(N2)C3=C(C4=CC=CC=C4N3)[O-])O.[Na+].[K+]	{32: 4, 21: 2, 14: 16}
Did not match all atoms present	2077-13-6	CC(C)C1=CC=CC=C1Cl	{1: 2, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	2077-33-0	CC=CC1=CC=CC=C1C	{1: 2, 14: 4, 6: 2}
Did not match all atoms present	2077-46-5	CC1=C(C=CC(=C1Cl)Cl)Cl	{1: 1, 14: 2, 17: 3}
Did not match all atoms present	20770-41-6	[PH2-].[K+].[K+].[K+]	{}
Did not match all atoms present	20773-98-2	COC1=CC=CC=[N+]1[O-]	{1: 1, 33: 1, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	20776-03-8	CC1=CC(=O)N(N1C)C2=CC=CC=C2.OCl(=O)(=O)=O	{1: 2, 33: 2, 14: 6, 17: 1, 20: 1, 25: 1, 29: 3}
Did not match all atoms present	20779-08-2	CCCCCC(=O)[O-].CCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 8}
Did not match all atoms present	20779-14-0	CCCCCCCCCCCCCCCCOS(=O)(=O)C	{1: 2, 2: 15, 29: 2, 22: 1}
Did not match all atoms present	2078-12-8	C[Si](C)(C)OC(=O)C1=CC=CC=C1	{1: 3, 28: 1, 14: 5}
Did not match all atoms present	2078-13-9	C[Si](C)(C)OC1=CC=C(C=C1)C(=O)O[Si](C)(C)C	{1: 6, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	2078-14-0	COC1=CC=C(C=C1)C(=O)O[Si](C)(C)C	{1: 4, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	2078-16-2	COC1=C(C=C(C=C1)C(=O)O[Si](C)(C)C)OC	{1: 5, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	2078-17-3	C[Si](C)(C)OC1=CC(=CC(=C1O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	{1: 12, 28: 1, 22: 3, 14: 2}
Did not match all atoms present	2078-18-4	C[Si](C)(C)OC(=O)CC1=CC=CC=C1	{1: 3, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	2078-20-8	C[Si](C)(C)OC(=O)C=CC1=CC=CC=C1	{1: 3, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	2078-54-8	CC(C)C1=C(C(=CC=C1)C(C)C)O	{1: 4, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	20780-53-4	C1[C@H](O1)C2=CC=CC=C2	{11: 1, 12: 1, 14: 5, 23: 1}
Did not match all atoms present	20780-54-5	C1[C@@H](O1)C2=CC=CC=C2	{11: 1, 12: 1, 14: 5, 23: 1}
Did not match all atoms present	20781-20-8	COC1=CC(=C(C=C1)CN)OC	{1: 2, 2: 1, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	20781-22-0	COC1=C(C(=CC=C1)OC)CN	{1: 2, 2: 1, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	2079-00-7	CN(CCC(CC(=O)NC1C=CC(OC1C(=O)O)N2C=CC(=NC2=O)N)N)C(=N)N	{1: 1, 2: 3, 3: 1, 36: 1, 33: 2, 7: 1, 12: 3, 14: 4, 35: 1, 23: 1, 24: 1, 25: 1, 27: 1, 30: 3, 31: 1}
Did not match all atoms present	20792-41-0	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[K+].[Ir+3]	{}
Did not match all atoms present	20794-96-1	CC(C)[NH2+]CC(C1=CC2=CC=CC=C2C=C1)Cl.[Cl-]	{1: 2, 2: 1, 3: 2, 14: 7, 17: 2}
Did not match all atoms present	20795-51-1	CCC(=O)CCC1=CC=CC=C1	{24: 1, 1: 1, 2: 3, 14: 5}
Did not match all atoms present	20797-48-2	C1=CC(=C(C=C1C=CC(=O)O)[N+](=O)[O-])Cl	{38: 1, 17: 1, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	207974-17-2	C1=CC(=C(C(=C1)F)N=C=S)F	{8: 1, 16: 2, 34: 1, 14: 3}
Did not match all atoms present	207981-46-2	C1=CC(=C(C=C1C(F)(F)F)C(=O)Cl)F	{16: 4, 17: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	207981-49-5	C1=C(C(=C(C(=C1F)F)N=C=S)F)F	{8: 1, 16: 4, 34: 1, 14: 1}
Did not match all atoms present	20799-66-0	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC=O	{26: 1, 4: 1, 14: 15, 31: 1}
Did not match all atoms present	208-07-1	C1=CC=C2C(=C1)C=CC3=C2C4=CC5=CC=CC=C5C4=N3	{35: 1, 14: 11, 15: 2}
Did not match all atoms present	208-96-8	C1=CC2=C3C(=C1)C=CC3=CC=C2	{14: 8}
Did not match all atoms present	2080-35-5	CC1=CC2=S(S1)SC(=C2)C	{1: 2, 41: 2, 14: 2, 15: 3}
Did not match all atoms present	2081-12-1	CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.CC(C)(C)O.[Zr]	{1: 12, 4: 4, 20: 4}
Did not match all atoms present	20815-29-6	CCC1=C(C=NC=C1)C	{1: 2, 2: 1, 35: 1, 14: 3}
Did not match all atoms present	20815-35-4	CN(C)C(=NC1=CC=C(C=C1)OC)N(C)C	{1: 5, 34: 1, 33: 2, 7: 1, 14: 4, 22: 1}
Did not match all atoms present	20816-12-0	O=[Os](=O)(=O)=O	{29: 4}
Did not match all atoms present	208173-19-7	C1=CC(=C(C(=C1)C(F)(F)F)F)C(=O)Cl	{16: 4, 17: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	208186-84-9	C1=CC(=C(C=C1F)Cl)CO	{16: 1, 17: 1, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	20819-54-9	CP(=[Se])(C)C	{1: 3}
Did not match all atoms present	2082-61-3	CC=C(C)C1=CC=CC=C1	{1: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	2082-80-6	CCCCCCCCCCCCCCCCCCOP(OCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCC	{1: 3, 2: 51, 22: 3}
Did not match all atoms present	2082-84-0	CCCCCCCCCC[N+](C)(C)C.[Br-]	{1: 4, 2: 9, 18: 1}
Did not match all atoms present	20820-80-8	CCOP(=O)(C)SCCN(C)C	{1: 4, 2: 3, 33: 1, 40: 1, 22: 1, 29: 1}
Did not match all atoms present	20820-82-0	CC1=CC(=NC(=C1C)C)C	{1: 4, 35: 1, 14: 1}
Did not match all atoms present	20821-66-3	CN(C)C(=S)SCC=C	{1: 2, 2: 1, 5: 1, 6: 1, 33: 1, 40: 1, 7: 1}
Did not match all atoms present	20826-04-4	C1=C(C=NC=C1Br)C(=O)O	{35: 1, 18: 1, 27: 1, 14: 3}
Did not match all atoms present	20828-66-4	COC(=O)CCCC1=CC=CS1	{1: 1, 2: 3, 28: 1, 14: 3, 41: 1}
Did not match all atoms present	20829-66-7	C(CN)N.[N+](=O)(O)[O-].[N+](=O)(O)[O-]	{2: 2, 20: 2, 30: 2}
Did not match all atoms present	2083-13-8	C[Si](C)C1=CC(=CC=C1)Cl	{1: 2, 14: 4, 17: 1}
Did not match all atoms present	2083-91-2	CN(C)[Si](C)(C)C	{1: 5, 33: 1}
Did not match all atoms present	20830-81-3	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)N)O	{1: 3, 11: 3, 12: 5, 13: 1, 14: 3, 20: 2, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	20834-61-1	CC(C)(C)C1=CC(=C(C(=C1)Br)O)C(C)(C)C	{1: 6, 18: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	20836-11-7	CC1(CC2=CC=CC=C2C1)C	{1: 2, 11: 2, 13: 1, 14: 4}
Did not match all atoms present	20836-42-4	C[Si](C)(C)OCCN(CCO[Si](C)(C)C)CCO[Si](C)(C)C	{1: 9, 2: 6, 22: 3, 33: 1}
Did not match all atoms present	2084-45-9	CC1=CC(=C(C=C1Cl)Cl)C	{1: 2, 14: 2, 17: 2}
Did not match all atoms present	20841-12-7	[Be+2].CC(C)[CH2-].CC(C)[CH2-]	{1: 4, 3: 2, 5: 2}
Did not match all atoms present	20843-07-6	CC1=COC=C1C	{1: 2, 14: 2, 23: 1}
Did not match all atoms present	20847-82-9	C1=CC=C2C3C=CC3C2=C1	{12: 2, 14: 6}
Did not match all atoms present	2085-83-8	CC[NH+](CC)C(C1=CC=CC=C1)C(=O)OC2=C(C=CC=C2C)C.[Cl-]	{1: 4, 2: 2, 3: 1, 14: 8, 17: 1, 28: 1}
Did not match all atoms present	2085-85-0	CC[NH+](CC)CC(=O)OC1=C(C=CC=C1OC)OC.[Cl-]	{1: 4, 2: 3, 14: 3, 17: 1, 22: 2, 28: 1}
Did not match all atoms present	2085-88-3	CC1(CO1)C2=CC=CC=C2	{1: 1, 11: 1, 13: 1, 14: 5, 23: 1}
Did not match all atoms present	20850-43-5	C1OC2=C(O1)C=C(C=C2)CCl	{17: 1, 2: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	20851-50-7	C1=CC=C(C(=C1)C=C(C(=O)O)C(=O)O)Cl	{17: 1, 27: 2, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	20854-76-6	C1=CC=C2C(=C1)C(=O)C(C2=O)N=O	{25: 2, 34: 1, 12: 1, 29: 1, 14: 4}
Did not match all atoms present	20856-57-9	C1=CC(=C(C=C1NC(C(Cl)(Cl)Cl)NC=O)Cl)Cl	{3: 1, 4: 1, 14: 3, 17: 5, 26: 1, 31: 2}
Did not match all atoms present	20859-73-8	[Al]#P	{}
Did not match all atoms present	2086-26-2	C1=CC(=CC=C1CON)[N+](=O)[O-].Cl	{2: 1, 38: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	2086-83-1	COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC	{1: 2, 33: 1, 11: 3, 14: 6, 22: 2, 23: 2}
Did not match all atoms present	20861-99-8	C1C(O1)C2=CC3=CC=CC=C3C=C2	{11: 1, 12: 1, 14: 7, 23: 1}
Did not match all atoms present	2088-24-6	COC1=CC(=CC=C1)OCC(=O)O	{1: 1, 2: 1, 27: 1, 22: 2, 14: 4}
Did not match all atoms present	2088-72-4	CCOC(=O)CSP(=O)(OC)OC	{1: 3, 2: 2, 40: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	20882-16-0	[F-].[Pu]	{16: 1}
Did not match all atoms present	20883-98-1	COC(=O)C=CC1=CC=CC=C1O	{1: 1, 28: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	2089-46-5	CC(C)(C1=CC=CC=C1)C2=CC(=C(C(=C2)CN3CCCCC3)O)CN4CCCCC4.Br.Br	{1: 2, 2: 2, 4: 1, 33: 2, 11: 10, 14: 7, 18: 2, 21: 1}
Did not match all atoms present	2089-87-4	C1=CC2=C(C=CC(=C2)C(=O)O)C(=C1)C(=O)O	{27: 2, 14: 6}
Did not match all atoms present	20890-10-2	C(#N)N.[Pb]	{37: 1, 30: 1}
Did not match all atoms present	20890-72-6	COC1=CC=CC=C1/C=C(\C2=CC=CC=C2)/C(=O)O	{1: 1, 6: 1, 7: 1, 14: 9, 22: 1, 27: 1}
Did not match all atoms present	20892-46-0	CN(C)CCCN1C=CC2=CC=CC=C21	{1: 2, 2: 3, 14: 6, 33: 2}
Did not match all atoms present	20893-30-5	C1=CSC(=C1)CC#N	{41: 1, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	20893-43-0	CCCCC1=CC(=CC=C1)OC	{1: 2, 2: 3, 22: 1, 14: 4}
Did not match all atoms present	20894-63-7	C1=CC=C2C=C(C=CC2=C1)C(=O)C=CC3=CC=CS3	{24: 1, 41: 1, 14: 10, 6: 2}
Did not match all atoms present	20898-44-6	CC(C)(C)OC(=O)NC(CC1=CN(C=N1)CC2=CC=CC=C2)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 33: 1, 14: 7, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	209-22-3	C1=CC2=C3C(=C1)SSC3=CC=C2	{41: 2, 14: 6}
Did not match all atoms present	209-42-7	C1=CC=C2C=CC3=C2C(=C1)C=CC=C3	{14: 10}
Did not match all atoms present	2090-82-6	C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)OP(=O)(O)O)C4=CC=C(C=C4)OP(=O)(O)O	{13: 1, 14: 12, 20: 4, 22: 2, 28: 1, 29: 2}
Did not match all atoms present	2090-89-3	CC(C)CNCCOC(=O)C1=CC=C(C=C1)N	{1: 2, 2: 3, 3: 1, 14: 4, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	20901-21-7	O=S=S	{40: 1, 29: 1}
Did not match all atoms present	20904-74-9	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCCCS(=O)(=O)[O-])C=C3N(C4=C(S3)C=CC(=C4)Cl)CCCCS(=O)(=O)O	{1: 1, 2: 9, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 17: 2, 20: 1, 29: 5}
Did not match all atoms present	20905-32-2	B(OCC)(OCC)Cl	{1: 2, 2: 2, 22: 2, 17: 1}
Did not match all atoms present	2091-46-5	C#CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{9: 1, 2: 1, 18: 1, 10: 1, 14: 15}
Did not match all atoms present	20910-28-5	O.O.O.[O-2].[O-2].[O-]S(=O)(=O)[O-].[U]	{29: 4}
Did not match all atoms present	20912-69-0	COC1=CC=C(C=C1)SC2=CC=C(C=C2)Cl	{40: 1, 1: 1, 22: 1, 14: 8, 17: 1}
Did not match all atoms present	209129-65-7	CCC(C)(C)OC(=O)N1C(=C2C(=C(N(C2=O)C(=O)OC(C)(C)CC)C3=CC=C(C=C3)Cl)C1=O)C4=CC=C(C=C4)Cl	{1: 6, 2: 2, 4: 2, 33: 2, 14: 8, 15: 4, 17: 2, 25: 2, 28: 2}
Did not match all atoms present	20914-59-4	CCN(CC)CCCC(C)NN1C=NC2=C1N=CN=C2SC.Cl	{1: 4, 2: 5, 3: 1, 33: 2, 40: 1, 14: 2, 17: 1, 35: 3, 31: 1}
Did not match all atoms present	2092-16-2	C(#N)[S-].C(#N)[S-].[Ca+2]	{37: 2}
Did not match all atoms present	2092-17-3	C(#N)[S-].C(#N)[S-].O.O.O.[Ba+2]	{37: 2}
Did not match all atoms present	2092-55-9	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=C(C=CC(=C3)S(=O)(=O)[O-])O	{34: 1, 14: 9, 15: 1, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	2092-56-0	CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])NN=C2C(=O)C=CC3=CC=CC=C32.[Na+]	{1: 1, 34: 1, 14: 8, 15: 1, 17: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	20921-41-9	CC(C#C)(C1=CC=CC=C1)OC(=O)NC2CCCCC2	{1: 1, 4: 1, 9: 1, 10: 1, 11: 5, 12: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	20921-50-0	CC1=C(C=C(C=C1)C(C#C)(C2=CC=CC=C2)OC(=O)NC3CCCCC3)C	{1: 2, 4: 1, 9: 1, 10: 1, 11: 5, 12: 1, 14: 8, 28: 1, 31: 1}
Did not match all atoms present	20928-02-3	CC1=CC2=C(C=C1)SC3=CC=CC=C32	{1: 1, 14: 7, 41: 1}
Did not match all atoms present	20928-63-6	COC1=CC=CNC1=O	{32: 1, 1: 1, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	20929-46-8	C1=CC=C(C=C1)C2C=CC(C3C2C(=O)OC3=O)C4=CC=CC=C4	{28: 2, 12: 4, 14: 12}
Did not match all atoms present	20929-99-1	C#CC(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)OC(=O)NC3CCCCCC3	{4: 1, 9: 1, 10: 1, 11: 6, 12: 1, 14: 8, 16: 2, 28: 1, 31: 1}
Did not match all atoms present	2093-04-1	C1=CC(=CC=C1C(C(F)(F)F)(C(F)(F)F)O)OC2=CC=C(C=C2)C(C(F)(F)F)(C(F)(F)F)O	{16: 12, 20: 2, 4: 6, 22: 1, 14: 8}
Did not match all atoms present	20930-10-3	CC#CC(C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)NC3CCCCC3	{1: 1, 4: 1, 10: 2, 11: 5, 12: 1, 14: 10, 28: 1, 31: 1}
Did not match all atoms present	20932-80-3	C[Si](C)(C)C(C#CC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C	{1: 18, 10: 2, 4: 2}
Did not match all atoms present	20934-81-0	C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)N	{35: 1, 30: 1, 14: 8, 23: 1}
Did not match all atoms present	20936-33-8	C1=CC(=C(C=C1O)[O-])C(=O)O.C1=CC(=C(C=C1O)[O-])C(=O)O.[Cu+2]	{27: 2, 21: 2, 14: 6}
Did not match all atoms present	2094-99-7	CC(=C)C1=CC(=CC=C1)C(C)(C)N=C=O	{1: 3, 34: 1, 4: 1, 5: 1, 7: 1, 8: 1, 14: 4, 29: 1}
Did not match all atoms present	2095-03-6	C1C(O1)COC2=CC=C(C=C2)CC3=CC=C(C=C3)OCC4CO4	{2: 3, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2}
Did not match all atoms present	2095-06-9	C1C(O1)CN(CC2CO2)C3=CC=CC=C3	{33: 1, 2: 2, 11: 2, 12: 2, 14: 5, 23: 2}
Did not match all atoms present	2095-17-2	C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)CCCN	{33: 1, 2: 3, 41: 1, 14: 7, 17: 1, 30: 1}
Did not match all atoms present	2095-57-0	CCC(C)C1(C(=O)NC(=S)NC1=O)CC	{32: 2, 1: 3, 2: 2, 3: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	2095-58-1	CCC(C)C1(C(=O)NC(=S)NC1=O)CC=C	{32: 2, 1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	20950-56-5	C1=CC(=CC(=C1)O)C2=CC(=CC(=C2)O)O	{21: 3, 14: 7}
Did not match all atoms present	20951-05-7	CS(=O)(=O)C1=CC(=C(C(=C1)Cl)O)Cl	{1: 1, 29: 2, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	20955-11-7	F[Fe-3](F)(F)(F)(F)F.[Na+].[Na+].[Na+]	{16: 6}
Did not match all atoms present	2096-86-8	CC1=CC=C(C=C1)CC(=O)C	{24: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	20967-96-8	C1=CC=C(C=C1)COC2=CC=CC(=C2)CC#N	{2: 2, 22: 1, 14: 9, 37: 1}
Did not match all atoms present	2097-16-7	CC[Si]12OCCN(CCO1)CCO2	{1: 1, 2: 1, 11: 6, 33: 1, 23: 3}
Did not match all atoms present	2097-18-9	C=C[Si]12OCCN(CCO1)CCO2	{33: 1, 11: 6, 5: 1, 6: 1, 23: 3}
Did not match all atoms present	2097-19-0	C1CO[Si]2(OCCN1CCO2)C3=CC=CC=C3	{33: 1, 11: 6, 14: 5, 23: 3}
Did not match all atoms present	2097-20-3	CC1CN2CCO[Si](O1)(OC(C2)C)C3=CC=CC=C3	{1: 2, 33: 1, 11: 4, 12: 2, 14: 5, 23: 3}
Did not match all atoms present	2097-60-1	CC[Sn](C)(CC)CC	{1: 4, 2: 3}
Did not match all atoms present	20970-75-6	CC1=C(N=CC=C1)C#N	{1: 1, 35: 1, 37: 1, 14: 3}
Did not match all atoms present	20977-05-3	CC(C(C)OC(=O)C)C(=O)OCC12[C@H]3C[C@@]4(C(=CCC5C4(CCC6C5(CCC([C@]6(C)CO)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O[C@@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O)O)C)C)C1CC([C@@H](C2O)O3)(C)C)C.[Na+]	{1: 9, 2: 3, 3: 2, 11: 8, 12: 21, 13: 6, 14: 1, 15: 1, 20: 10, 22: 3, 23: 4, 27: 1, 28: 2}
Did not match all atoms present	20977-50-8	CC(C)NC(=O)OC1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F	{1: 2, 2: 3, 3: 1, 33: 1, 11: 4, 12: 1, 14: 4, 16: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	20980-22-7	C1CN(CCN1)C2=NC=CC=N2	{32: 1, 33: 1, 11: 4, 14: 3, 35: 2}
Did not match all atoms present	20982-36-9	C1CNP(=O)(NC1)N(CCCl)CCCl	{32: 2, 33: 1, 2: 4, 11: 3, 17: 2, 29: 1}
Did not match all atoms present	20982-74-5	C=O.C=O.C=O.C=O.C=O.C=O.C=O.C=O.C=O.[Fe]	{5: 9}
Did not match all atoms present	20984-33-2	CC1=CC(=C2C(=C1)C=CC=N2)O	{1: 1, 35: 1, 21: 1, 14: 5}
Did not match all atoms present	20986-33-8	CC[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 14: 28, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	20986-40-7	CCOC(=O)C1=CC(=CN=C1)Br	{1: 1, 2: 1, 35: 1, 14: 3, 18: 1, 28: 1}
Did not match all atoms present	20989-17-7	C1=CC=C(C=C1)[C@@H](CO)N	{2: 1, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	2099-63-0	C1=CC=C(C(=C1)C(=O)O)N.Cl	{17: 1, 27: 1, 30: 1, 14: 4}
Did not match all atoms present	20995-67-9	COP1(=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)OC	{1: 2, 22: 2, 14: 17, 15: 3}
Did not match all atoms present	20995-81-7	C1=CC=C(C=C1)C2=C3C=CC=CC3=PC4=CC=CC=C42	{14: 13}
Did not match all atoms present	2099990000-00-0	[OH-].[OH-].[OH-].[OH-].[Na+].[Al+3]	{}
Did not match all atoms present	2099995000-00-0	[OH-].[OH-].[Y+3].[Y+3]	{}
Did not match all atoms present	2100-25-6	CC1=CC(=C(C(=C1C)I)C)C	{1: 4, 19: 1, 14: 1}
Did not match all atoms present	2100-42-7	COC1=CC(=C(C=C1)OC)Cl	{1: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	21001-46-7	CC[NH+](CC)CCOC(=O)C1=CC2=C(C=C1)NC3=C2CCCC3.[Cl-]	{32: 1, 1: 2, 2: 4, 11: 4, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	21006-73-5	[H+].C1=CC=C(C=C1)[As+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-].[Cl-]	{17: 2, 14: 20}
Did not match all atoms present	21009-92-7	CC1=CC(=C(C(=C1)OC)C(=O)C)C	{24: 1, 1: 4, 22: 1, 14: 2}
Did not match all atoms present	21009-99-4	C1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3C=C2)O	{24: 1, 21: 1, 14: 11}
Did not match all atoms present	2101-86-2	CC1=CC=C(C=C1)N=[N+]=[N-]	{1: 1, 34: 2, 14: 4}
Did not match all atoms present	2101-87-3	COC1=CC=C(C=C1)[N-][N+]#N	{1: 1, 34: 2, 22: 1, 14: 4}
Did not match all atoms present	2101-88-4	C1=CC(=CC=C1N=[N+]=[N-])Br	{18: 1, 34: 2, 14: 4}
Did not match all atoms present	21016-34-2	CC1CCC2=C(C1)C(=CC(=[O+]2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O	{1: 1, 11: 3, 12: 1, 14: 11, 17: 1, 23: 1, 29: 4}
Did not match all atoms present	21016-35-3	CCCCCOC1=CC=C(C=C1)C2=CC(=[O+]C3=C2CCCC3)C4=CC=C(C=C4)OCCCCC.[O-]Cl(=O)(=O)=O	{1: 2, 2: 8, 11: 4, 14: 9, 17: 1, 22: 2, 23: 1, 29: 4}
Did not match all atoms present	21016-37-5	CCN(CC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CC)CC)C3=C(C=C(C=C3)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 2: 4, 3: 1, 33: 2, 14: 11, 20: 2, 29: 4}
Did not match all atoms present	21017-50-5	C1=CC=C2C(=C1)C=CN2CCC(=O)N	{24: 1, 33: 1, 2: 2, 30: 1, 14: 6}
Did not match all atoms present	21018-13-3	CCOC1=CC=CC=C1C(=O)NN	{1: 1, 2: 1, 14: 4, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	21018-38-2	CC(=C)CNC(=S)NC	{1: 2, 2: 1, 31: 2, 5: 1, 7: 2}
Did not match all atoms present	21019-30-7	CCN1CC2(CC[C@@H](C34[C@@H]2[C@@H](C(C31)([C@]5(C[C@@H](C6C[C@@H]4[C@@H]5[C@H]6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7N8C(=O)C[C@@H](C8=O)C	{1: 6, 2: 2, 33: 2, 11: 6, 12: 10, 13: 4, 14: 4, 20: 2, 22: 4, 25: 2, 28: 1}
Did not match all atoms present	21023-20-1	C[Si](C)(C)N(O[Si](C)(C)C)[Si](C)(C)C	{1: 9, 22: 1, 33: 1}
Did not match all atoms present	21025-18-3	CCN1C(=O)C(=C(C)C=C2N(CCS2)C)SC1=S	{1: 3, 2: 1, 33: 2, 6: 1, 7: 1, 41: 2, 11: 2, 15: 3, 25: 1}
Did not match all atoms present	21029-33-4	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ru+2]	{}
Did not match all atoms present	2103-46-0	CN(C)C=NC1=CC=C(C=C1)Cl	{1: 2, 34: 1, 6: 1, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	2103-47-1	CN(C)C=NC1=CC(=CC=C1)[N+](=O)[O-]	{1: 2, 34: 1, 6: 1, 38: 1, 33: 1, 14: 4}
Did not match all atoms present	2103-50-6	CN(C)C=NC1=CC(=CC=C1)Cl	{1: 2, 34: 1, 6: 1, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	2103-57-3	COC1=C(C(=C(C=C1)C=O)OC)OC	{1: 3, 26: 1, 22: 3, 14: 2}
Did not match all atoms present	2103-64-2	C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)O)OC5=C3C=CC(=C5O)O	{23: 1, 28: 1, 13: 1, 14: 8, 21: 4}
Did not match all atoms present	2103-88-0	C1=CC=C(C=C1)C2=CSC(=S)N2	{32: 1, 41: 1, 14: 6}
Did not match all atoms present	21032-12-2	C1CC(=O)C2=CC=CC=C2C1O	{20: 1, 11: 2, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	21035-59-6	CNCC1=CC=CC=N1	{1: 1, 2: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	21035-65-4	CN1C(=O)C(=O)N(C1=S)C	{1: 2, 25: 2, 33: 2, 15: 1}
Did not match all atoms present	21038-67-5	C1=CN=CC2=C1C(=O)NC(=O)N2	{32: 2, 25: 2, 35: 1, 14: 3}
Did not match all atoms present	2104-04-3	COC1=CC=C(C=C1)C2=CSC(=N2)N	{1: 1, 35: 1, 41: 1, 14: 5, 22: 1, 30: 1}
Did not match all atoms present	2104-09-8	C1=CC(=CC=C1C2=CSC(=N2)N)[N+](=O)[O-]	{38: 1, 41: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	2104-64-5	CCOP(=S)(C1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 22: 2, 14: 9}
Did not match all atoms present	2104-86-1	CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)CCl	{1: 1, 2: 5, 3: 1, 14: 4, 17: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	2104-96-3	COP(=S)(OC)OC1=CC(=C(C=C1Cl)Br)Cl	{1: 2, 18: 1, 22: 3, 14: 2, 17: 2}
Did not match all atoms present	21041-85-0	C1=NNC(=N1)N=[N+]=[N-]	{32: 1, 34: 2, 35: 2, 14: 1}
Did not match all atoms present	21041-86-1	CC1=NC(=NN1)N=[N+]=[N-]	{32: 1, 1: 1, 34: 2, 35: 2}
Did not match all atoms present	21041-93-0	[OH-].[OH-].[Co+2]	{}
Did not match all atoms present	21041-95-2	[OH-].[OH-].[Cd+2]	{}
Did not match all atoms present	2105-61-5	C1=C(C(=CC(=C1F)F)F)[N+](=O)[O-]	{16: 3, 38: 1, 14: 2}
Did not match all atoms present	2105-94-4	C1=CC(=C(C=C1Br)F)O	{16: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	21050-13-5	C1=CC=C(C=C1)P(=N[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Cl-]	{17: 1, 34: 1, 14: 30}
Did not match all atoms present	21050-95-3	C1=CC=C2C(=C1)N=NN2Cl	{17: 1, 35: 2, 14: 4, 33: 1}
Did not match all atoms present	21054-72-8	CCCCCCCCCCCCN1C=C[N+](=C1C)CC2=CC=CC=C2.[Cl-]	{1: 2, 2: 12, 33: 2, 14: 7, 17: 1}
Did not match all atoms present	21055-37-8	COC(=O)CN=C=S	{8: 1, 1: 1, 2: 1, 28: 1, 34: 1}
Did not match all atoms present	21055-43-6	CC(C)C[C@@H](C(=O)OC)N=C=S	{1: 3, 2: 1, 3: 2, 8: 1, 34: 1, 28: 1}
Did not match all atoms present	21055-47-0	COC(=O)[C@H](CCSC)N=C=S	{1: 2, 2: 2, 3: 1, 8: 1, 34: 1, 40: 1, 28: 1}
Did not match all atoms present	210555-94-5	CCC(C)CC(C)CC(C)CCC1=CC=C(C=C1)O	{1: 4, 2: 5, 3: 3, 21: 1, 14: 4}
Did not match all atoms present	21057-99-8	[Np+].[O].[O]	{}
Did not match all atoms present	210578-56-6	CCCCC(CC)C(=O)[O-].[Tl+]	{24: 1, 1: 2, 2: 4, 3: 1}
Did not match all atoms present	21059-46-1	C([C@@H](C(=O)[O-])N)C(=O)[O-].[Ca+2]	{24: 2, 2: 1, 3: 1, 30: 1}
Did not match all atoms present	2106-02-7	C1=CC(=C(C=C1F)Cl)N	{16: 1, 17: 1, 30: 1, 14: 3}
Did not match all atoms present	2106-04-9	C1=CC(=C(C(=C1)Cl)F)N	{16: 1, 17: 1, 30: 1, 14: 3}
Did not match all atoms present	2106-05-0	C1=CC(=C(C=C1Cl)N)F	{16: 1, 17: 1, 30: 1, 14: 3}
Did not match all atoms present	2106-40-3	C1=C(C=C(C(=C1F)Cl)F)F	{16: 3, 17: 1, 14: 2}
Did not match all atoms present	21062-28-2	CCN1CCCC(C1)NC2=NC(=NC(=C2)C)N=C(N)NC3=CC(=C(C=C3)Cl)Cl	{1: 2, 2: 1, 35: 2, 33: 1, 7: 1, 11: 4, 12: 1, 34: 1, 14: 4, 17: 2, 30: 1, 31: 2}
Did not match all atoms present	21064-27-7	C=CCN=CC1=CC=CC=C1	{34: 1, 2: 1, 14: 5, 5: 1, 6: 2}
Did not match all atoms present	21064-50-6	CC1=CC2=C(C=C1)NC3=C2C4=CC=CC=C4C=C3	{32: 1, 1: 1, 14: 9}
Did not match all atoms present	2107-69-9	COC1=C(C=C2C(=C1)CCC2=O)OC	{1: 2, 11: 2, 22: 2, 14: 2, 25: 1}
Did not match all atoms present	2107-70-2	COC1=C(C=C(C=C1)CCC(=O)O)OC	{1: 2, 2: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	2107-76-8	CC1=CC(=O)OC2=CC(=CC(=C12)O)O	{1: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	21070-32-6	CCCCC1=CC2=C(C=C[N+](=C2C=C1)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 33: 1, 14: 5, 29: 1}
Did not match all atoms present	21070-33-7	CCCCC1=CC2=C(C=C1)N(C=CC2=NO)O	{1: 1, 2: 3, 33: 1, 34: 1, 14: 5, 20: 1, 21: 1}
Did not match all atoms present	21072-42-4	C1CC(CCC1C2=CC=CC=C2)C3=CC=CC=C3	{11: 4, 12: 2, 14: 10}
Did not match all atoms present	21075-41-2	CC1=C2C=CC3=CC=CC=C3C2=NC4=C1C=C(C=C4)C5=CC=CC=C5	{1: 1, 35: 1, 14: 14}
Did not match all atoms present	210758-43-3	CCCC1=[C-]C(C(=C1C)C)(C)C.CCCC1=[C-]C(C(=C1C)C)(C)C.[Ba+2]	{1: 10, 2: 4, 13: 2, 15: 6}
Did not match all atoms present	21080-92-2	C1=CSC=C1C(C(=O)O)C(=O)O	{27: 2, 41: 1, 3: 1, 14: 3}
Did not match all atoms present	21081-74-3	CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 1, 38: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	21082-50-8	CC[Hg+].C(C(C(=O)O)N)[S-]	{27: 1, 1: 1, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	21083-36-3	C1=CC=C2C(=C1)C(=O)S2	{25: 1, 14: 4, 41: 1}
Did not match all atoms present	21083-47-6	C1=CC=C(C=C1)C2(C(=O)NC(=S)N2)C3=CC=CC=C3	{32: 2, 25: 1, 13: 1, 14: 10, 15: 1}
Did not match all atoms present	21084-22-0	C1=CC(=CC(=C1)C(F)(F)F)C(=O)C2=CC=C(C=C2)C(F)(F)F	{16: 6, 24: 1, 4: 2, 14: 8}
Did not match all atoms present	21084-84-4	C1=CC=C(C=C1)C2=NC(=O)NO2	{32: 1, 25: 1, 35: 1, 14: 5, 23: 1}
Did not match all atoms present	21085-56-3	CC1=CC=CC=C1CCNN	{1: 1, 2: 2, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	21086-87-3	CC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)C	{1: 2, 2: 1, 28: 1, 14: 8}
Did not match all atoms present	21087-64-9	CC(C)(C)C1=NN=C(N(C1=O)N)SC	{1: 4, 35: 2, 4: 1, 33: 1, 40: 1, 25: 1, 30: 1}
Did not match all atoms present	21089-06-5	CC(O)(P(=O)(O)[O-])P(=O)(O)[O-].[K+].[K+]	{1: 1, 4: 1, 29: 4, 20: 3}
Did not match all atoms present	2109-99-1	CC(CC1=CC=CC=C1)(CO)CO	{1: 1, 2: 3, 4: 1, 14: 5, 20: 2}
Did not match all atoms present	21094-80-4	C[S-].C[S-].[Hg+2]	{1: 2}
Did not match all atoms present	211-91-6	C1=CC=C2C(=C1)C=CC3=C2C4=C5C(=CC=CC5=C3)C=C4	{14: 12}
Did not match all atoms present	2110-19-2	C1=CC=C2C(=C1)C(=O)N(C2=O)C(CCC(=O)N)C(=O)O	{33: 1, 2: 2, 3: 1, 14: 4, 24: 1, 25: 2, 27: 1, 30: 1}
Did not match all atoms present	21109-95-5	S=[Ba]	{}
Did not match all atoms present	21109-99-9	CCN(CC)C1=CC=C(C=C1)[Hg]OC(=O)C	{1: 3, 2: 2, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	21112-37-8	CC(C)(C)C1=C(C=CC(=C1)OC)OC	{1: 5, 4: 1, 22: 2, 14: 3}
Did not match all atoms present	21113-36-0	CC1=C(C=C(C=C1)C2=C(C(=C(C=C2)C)C)[N+](=O)[O-])C	{1: 4, 38: 1, 14: 5}
Did not match all atoms present	21113-55-3	C1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3	{11: 5, 13: 1, 14: 10}
Did not match all atoms present	21119-13-1	CC(=S)OC	{1: 2, 22: 1, 7: 1}
Did not match all atoms present	21121-62-0	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)C)Cl	{1: 3, 2: 2, 33: 1, 13: 1, 14: 9, 17: 1, 23: 1, 28: 1}
Did not match all atoms present	21124-09-4	CCN=NNC1=CC=CC=C1	{1: 1, 2: 1, 34: 2, 14: 5, 31: 1}
Did not match all atoms present	21124-13-0	CC1=CC=C(C=C1)NN=NC	{1: 2, 34: 2, 14: 4, 31: 1}
Did not match all atoms present	21124-33-4	CCN(CC)C(=S)S.N	{1: 2, 2: 2, 39: 1, 33: 1, 7: 1}
Did not match all atoms present	21124-40-3	C1=CSC(=C1)C(C(=O)O)N	{27: 1, 41: 1, 3: 1, 30: 1, 14: 3}
Did not match all atoms present	21129-18-0	CCC(=O)[O-].CCC(=O)[O-].[Mn+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	2113-47-5	CC(=O)NC1=CC=CC=C1C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	2113-51-1	C1=CC=C(C=C1)C2=CC=CC=C2I	{19: 1, 14: 9}
Did not match all atoms present	2113-54-4	CC(=O)NC1=CC=CC(=C1)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	2113-57-7	C1=CC=C(C=C1)C2=CC(=CC=C2)Br	{18: 1, 14: 9}
Did not match all atoms present	2113-58-8	C1=CC=C(C=C1)C2=CC(=CC=C2)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	2113-68-0	C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)O	{20: 1, 29: 2, 14: 9}
Did not match all atoms present	21134-90-7	CC1=C(N=NC=N1)C	{1: 2, 35: 3, 14: 1}
Did not match all atoms present	21134-95-2	CC1=CN=NC=N1	{1: 1, 35: 3, 14: 2}
Did not match all atoms present	21134-96-3	CC1=CN=CN=N1	{1: 1, 35: 3, 14: 2}
Did not match all atoms present	21138-22-7	[N-]=[N+]=N[GeH3]	{34: 2}
Did not match all atoms present	2114-00-3	CC(C(=O)C1=CC=CC=C1)Br	{24: 1, 1: 1, 18: 1, 3: 1, 14: 5}
Did not match all atoms present	2114-02-5	C(=NC(=S)N)(N)N	{34: 1, 30: 3, 7: 2}
Did not match all atoms present	2114-25-2	C[Si](C)(C)OCC(CO[Si](C)(C)C)(CO[Si](C)(C)C)CO[Si](C)(C)C	{1: 12, 2: 4, 4: 1, 22: 4}
Did not match all atoms present	2114-33-2	CC(CC1=CC=CC=C1)OC(=O)C	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	2114-39-8	CC(CC1=CC=CC=C1)Br	{1: 1, 2: 1, 3: 1, 18: 1, 14: 5}
Did not match all atoms present	21145-77-7	CC1CC(C2=C(C1(C)C)C=C(C(=C2)C(=O)C)C)(C)C	{1: 7, 11: 1, 12: 1, 13: 2, 14: 2, 24: 1}
Did not match all atoms present	21149-87-1	CCC1(C(=O)NC(=O)[N-]C1=O)CC=C(C)C.[Na+]	{32: 1, 1: 3, 2: 2, 35: 1, 6: 1, 7: 1, 13: 1, 25: 3}
Did not match all atoms present	21150-22-1	CCC(C)C1C(=O)NCC(=O)NC2CS(=O)C3=C(CC(C(=O)NCC(=O)N1)NC(=O)C(NC(=O)C4CC(CN4C(=O)C(NC2=O)CC(=O)O)O)C(C)C(CO)O)C5=C(N3)C=C(C=C5)O	{32: 8, 1: 3, 2: 3, 3: 3, 33: 1, 11: 6, 12: 7, 14: 3, 20: 3, 21: 1, 25: 8, 27: 1, 29: 1}
Did not match all atoms present	21150-23-2	CC[C@H](C)[C@H]1C(=O)NCC(=O)N[C@H]2CS(=O)C3=C(C[C@@H](C(=O)NCC(=O)N1)NC(=O)[C@@H](NC(=O)[C@@H]4C[C@H](CN4C(=O)[C@@H](NC2=O)CC(=O)N)O)[C@@H](C)[C@H](C)O)C5=C(N3)C=C(C=C5)O	{32: 8, 1: 4, 2: 2, 3: 3, 33: 1, 11: 6, 12: 7, 14: 3, 20: 2, 21: 1, 24: 1, 25: 8, 29: 1, 30: 1}
Did not match all atoms present	21151-56-4	C1=CC(=CC=C1OCCl)Cl	{17: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	21152-33-0	CC(C)(C)C1CC(CC(C1)O)C2=CC=CC=C2	{1: 3, 4: 1, 11: 3, 12: 3, 14: 5, 20: 1}
Did not match all atoms present	21155-21-5	CCN1CCSC1=CC=C2C(=O)N(C(=S)S2)CC(=O)O	{1: 1, 2: 2, 6: 2, 33: 2, 41: 2, 11: 2, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	2116-36-1	C1=CC=C(C=C1)CC2=CC=C(C=C2)Br	{2: 1, 18: 1, 14: 9}
Did not match all atoms present	2116-62-3	C1=CC=C(C=C1)CCC2=CC=CC=N2	{2: 2, 35: 1, 14: 9}
Did not match all atoms present	2116-65-6	C1=CC=C(C=C1)CC2=CC=NC=C2	{2: 1, 35: 1, 14: 9}
Did not match all atoms present	2116-84-9	C[Si](C)(C)O[Si](C1=CC=CC=C1)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 22: 3, 14: 5}
Did not match all atoms present	21160-95-2	CN.CNC(=S)S	{1: 2, 31: 1, 39: 1, 30: 1, 7: 1}
Did not match all atoms present	21169-71-1	C1=C(ON=C1)C(=O)O	{35: 1, 27: 1, 14: 2, 23: 1}
Did not match all atoms present	2117-24-0	C[Si](C)(C)OC1=CC=C(C=C1)O[Si](C)(C)C	{1: 6, 22: 2, 14: 4}
Did not match all atoms present	2117-28-4	C[Si](C)(C)C[Si](C)(C)C	{1: 6, 2: 1}
Did not match all atoms present	2117-34-2	CC[Si](CC)(CC)OC	{1: 4, 2: 3, 22: 1}
Did not match all atoms present	2117-36-4	CCCC[Ge](CCCC)(CCCC)Cl	{1: 3, 2: 9, 17: 1}
Did not match all atoms present	2117-39-7	C1=CC=C(C=C1)C[Hg]Cl	{17: 1, 2: 1, 14: 5}
Did not match all atoms present	2117-48-8	C=C[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{14: 15, 5: 1, 6: 1}
Did not match all atoms present	21172-28-1	C1=CC(=CC(=C1)C(F)(F)F)C(CN)O	{2: 1, 3: 1, 4: 1, 14: 4, 16: 3, 20: 1, 30: 1}
Did not match all atoms present	21172-59-8	[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Sn+4]	{}
Did not match all atoms present	21175-08-6	[Mo+4]	{}
Did not match all atoms present	21178-63-2	CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[Cr+3]	{24: 3, 1: 3, 2: 42, 6: 6}
Did not match all atoms present	21187-98-4	CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN2CC3CCCC3C2	{1: 1, 33: 1, 11: 5, 12: 2, 14: 4, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	21198-79-8	C(=N/N)(\N)/[Se]	{34: 1, 30: 2, 7: 1}
Did not match all atoms present	212-54-4	C1C2=CC=CC=C2C3=C1C4=C(C=CC5=CC=CC=C54)C=C3	{11: 1, 14: 12}
Did not match all atoms present	212-74-8	C1=CC2=C3C=CC=CC3=C4C=CC=CC4=C5C=CC=CC5=C2C=C1	{14: 16}
Did not match all atoms present	2120-70-9	C1=CC=C(C=C1)OCC=O	{2: 1, 26: 1, 22: 1, 14: 5}
Did not match all atoms present	21202-52-8	CCN1C=CN=C1C	{1: 2, 2: 1, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	21208-99-1	C1CCC(C1)CCCCCNCCSS(=O)(=O)O	{2: 7, 40: 1, 11: 4, 12: 1, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	21209-02-9	CC1CCC(CC1)CCCCNCCSS(=O)(=O)O	{1: 1, 2: 6, 40: 1, 11: 4, 12: 2, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	2121-12-2	C1C[N+]2=CC3=CC4=C(C=C3C5=CC(=CC1=C52)O)OCO4	{33: 1, 11: 3, 21: 1, 14: 5, 23: 2}
Did not match all atoms present	2121-90-6	CCCCCCCCC/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C	{1: 2, 2: 8, 38: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	21210-43-5	COC(=O)[C@H](C1=CC=CC=C1)O	{1: 1, 3: 1, 20: 1, 14: 5, 28: 1}
Did not match all atoms present	21211-22-3	C1=CC=C2C(=C1)C(=C(S2)C(=O)O)Cl	{17: 1, 27: 1, 14: 4, 41: 1}
Did not match all atoms present	21211-29-0	C1=CC=C2C(=C1)C(=CS2(=O)=O)Cl	{17: 1, 29: 2, 14: 5, 15: 1}
Did not match all atoms present	21211-65-4	C1=CNC(=C1)CC2=CC=CN2	{32: 2, 2: 1, 14: 6}
Did not match all atoms present	21213-89-8	CNCC(=O)C1=CC=C(C=C1)O	{1: 1, 2: 1, 14: 4, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	21214-39-1	CC(C)(C)C1=C(C=CC(=C1)OP(=O)(OC2=CC(=C(C=C2)O)C(C)(C)C)OC3=CC(=C(C=C3)O)C(C)(C)C)O	{1: 9, 4: 3, 14: 9, 21: 3, 22: 3, 29: 1}
Did not match all atoms present	21219-23-8	C(C(=O)OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)Br	{17: 5, 2: 1, 28: 1, 18: 1}
Did not match all atoms present	21219-30-7	C1CCS(=O)(=O)C1.C1N(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 3, 11: 7, 29: 2, 38: 3}
Did not match all atoms present	2122-19-2	CC1CNC(=S)N1	{32: 2, 1: 1, 11: 1, 12: 1, 15: 1}
Did not match all atoms present	2122-44-3	[2H][C]([2H])[2H]	{}
Did not match all atoms present	2122-46-5	C1=CC=C(C=C1)[O]	{14: 5}
Did not match all atoms present	2122-48-7	C#[C]	{9: 1}
Did not match all atoms present	2122-61-4	C1=C(C=C(C(=C1I)N)I)C(=O)O	{27: 1, 19: 2, 30: 1, 14: 2}
Did not match all atoms present	2122-70-5	CCOC(=O)CC1=CC=CC2=CC=CC=C21	{1: 1, 2: 2, 28: 1, 14: 7}
Did not match all atoms present	2122-77-2	C1=C(C(=CC(=C1Cl)Cl)Cl)OCCO	{17: 3, 2: 2, 20: 1, 22: 1, 14: 2}
Did not match all atoms present	2122-86-3	C1=C(OC(=C1)[N+](=O)[O-])C2=NNC(=O)O2	{32: 1, 35: 1, 38: 1, 14: 2, 23: 1, 28: 1}
Did not match all atoms present	21221-93-2	C1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F	{16: 6, 24: 1, 4: 2, 14: 8}
Did not match all atoms present	21224-57-7	CCC1=CC=C(C=C1)CCCCNCCSS(=O)(=O)O	{1: 1, 2: 7, 40: 1, 14: 4, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	21224-81-7	CC1=CC=C(C=C1)OCCCCNCCSS(=O)(=O)O	{1: 1, 2: 6, 40: 1, 14: 4, 20: 1, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	212268-44-5	C1CCC(C1)N2C=CC3=C2N=CN=C3Cl	{33: 1, 35: 2, 11: 4, 12: 1, 14: 3, 17: 1}
Did not match all atoms present	2123-24-2	C1CCC(=O)[N-]CC1.[Na+]	{25: 1, 11: 5, 35: 1}
Did not match all atoms present	2123-27-5	C=CC1=C(C=C(C=C1)Cl)Cl	{17: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	2123-28-6	C=CC1=C(C(=CC=C1)Cl)Cl	{17: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	21232-47-3	C1=CC(=C(C=C1N=[N+](C2=CC(=C(C=C2)Cl)Cl)[O-])Cl)Cl	{17: 4, 34: 1, 29: 1, 14: 6, 33: 1}
Did not match all atoms present	21233-74-9	CCC1=C(C2=CC=CC=C2N=C1)C(=O)OCC	{1: 2, 2: 2, 35: 1, 28: 1, 14: 5}
Did not match all atoms present	212335-63-2	CCCCCCCCCCCCCCCCCCN1CC(SC1C2=C(C=CC(=C2)S(=O)(=O)NCCCN(CCCNS(=O)(=O)C3=CC(=C(C=C3)O)C4N(CC(S4)(C)C)CCCCCCCCCCCCCCCCCC)S(=O)(=O)C5=CC(=NNC6=C(C=C(C=C6)OC)S(=O)(=O)N7CCOCC7)C8=C(C5=O)C=CC=C8NS(=O)(=O)C)O)(C)C	{1: 8, 2: 40, 34: 1, 33: 4, 41: 2, 11: 6, 12: 2, 13: 2, 14: 13, 15: 2, 21: 2, 22: 1, 23: 1, 25: 1, 29: 10, 31: 4}
Did not match all atoms present	21236-74-8	CC1=CC(=C(C=C1)O)CN2CCCCC2	{1: 1, 2: 1, 33: 1, 11: 5, 14: 3, 21: 1}
Did not match all atoms present	21239-29-2	CCOC(=O)C1=CC(=CC(=C1)C)C	{1: 3, 2: 1, 28: 1, 14: 3}
Did not match all atoms present	2124-31-4	CC(=O)C1=CC=C(C=C1)N(C)C	{24: 1, 1: 3, 14: 4, 33: 1}
Did not match all atoms present	21243-26-5	C1C2=C(C3=C(S1)C(=CC=C3)F)NC4=CC=CC=C24	{16: 1, 32: 1, 11: 1, 14: 7, 41: 1}
Did not match all atoms present	21245-01-2	CC(C)CCOC(=O)C1=CC=C(C=C1)N(C)C	{1: 4, 2: 2, 3: 1, 33: 1, 14: 4, 28: 1}
Did not match all atoms present	21245-02-3	CCCCC(CC)COC(=O)C1=CC=C(C=C1)N(C)C	{1: 4, 2: 5, 3: 1, 33: 1, 14: 4, 28: 1}
Did not match all atoms present	21247-98-3	C1=CC=C2C(=C1)C3=C4C(=C2CO)C=CC5=CC=CC(=C54)C=C3	{2: 1, 20: 1, 14: 11}
Did not match all atoms present	21248-00-0	C1=CC=C2C(=C1)C3=C4C(=C2Br)C=CC5=CC=CC(=C54)C=C3	{18: 1, 14: 11}
Did not match all atoms present	21248-01-1	C1=CC=C2C(=C1)C3=C4C(=C2Cl)C=CC5=CC=CC(=C54)C=C3	{17: 1, 14: 11}
Did not match all atoms present	21249-93-4	C1=CC=C(C=C1)CC(F)(F)F	{16: 3, 2: 1, 4: 1, 14: 5}
Did not match all atoms present	21250-21-5	C1=C(C=C(C=C1Cl)Cl)N=S=O	{40: 1, 17: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	21256-18-8	C1=CC=C(C=C1)C2=C(OC(=N2)CCC(=O)O)C3=CC=CC=C3	{35: 1, 2: 2, 27: 1, 14: 10, 23: 1}
Did not match all atoms present	2126-70-7	COC1=CC=C(C=C1)C(=O)/C(=C/C(=O)[O-])/Br.[Na+]	{1: 1, 6: 1, 7: 1, 14: 4, 18: 1, 22: 1, 24: 2}
Did not match all atoms present	2126-84-3	CC(C1=CC=CC=C1)NN.C(=O)(C(=O)O)O	{1: 1, 3: 1, 14: 5, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	21264-77-7	C(CN)N.C(CN)N.[O-]S(=O)(=O)[O-].[Ni+2]	{2: 4, 29: 4, 30: 4}
Did not match all atoms present	212652-59-0	C=CS(=O)(=O)CCOCCNC1=NC(=NC(=N1)NC2=CC(=C(C=C2)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=C(C3=N)S(=O)(=O)[O-])S(=O)(=O)[O-])F.[Na+].[Na+].[Na+]	{2: 4, 35: 3, 36: 1, 5: 1, 6: 1, 14: 6, 15: 6, 16: 1, 22: 1, 25: 1, 29: 11, 31: 4}
Did not match all atoms present	21266-62-6	CCCCN(CCCC)CCCNC1=NC=NC2=C1NC=N2.Cl	{32: 1, 1: 2, 2: 9, 35: 3, 33: 1, 14: 2, 17: 1, 31: 1}
Did not match all atoms present	21266-66-0	C1=CC(=CC=C1CNC2=NC=NC3=C2NC=N3)S(=O)(=O)N	{32: 1, 2: 1, 35: 3, 14: 6, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	21266-67-1	C1=CC(=CC=C1CCNC2=NC=NC3=C2NC=N3)S(=O)(=O)N	{32: 1, 2: 2, 35: 3, 14: 6, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	21267-72-1	CC(C#C)N(C1=CC=CC=C1)C(=O)CCl	{1: 1, 2: 1, 3: 1, 33: 1, 9: 1, 10: 1, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	21267-97-0	C1=CC(=CC=C1CN2C=NC3=C2NC=NC3=O)S(=O)(=O)N	{32: 1, 33: 1, 2: 1, 35: 2, 14: 6, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	21268-01-9	CSC1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)S(=O)(=O)N	{1: 1, 2: 1, 35: 3, 33: 1, 40: 1, 14: 6, 29: 2, 30: 1}
Did not match all atoms present	21268-97-3	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)N/N=C/3\C=CC(=O)C(=C3)C(=O)O	{34: 1, 38: 1, 14: 10, 15: 2, 20: 1, 25: 1, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	2127-03-9	C1=CC=NC(=C1)SSC2=CC=CC=N2	{40: 2, 35: 2, 14: 8}
Did not match all atoms present	2127-10-8	C1=CC(=NC=C1[N+](=O)[O-])SSC2=NC=C(C=C2)[N+](=O)[O-]	{40: 2, 35: 2, 38: 2, 14: 6}
Did not match all atoms present	2127-74-4	C(C(F)(F)F)(F)S(=O)(=O)F	{16: 5, 3: 1, 4: 1, 29: 2}
Did not match all atoms present	21271-15-8	C12=C(C(=C(C(=C1F)F)F)F)N=C(C(=N2)F)F	{16: 6, 35: 2}
Did not match all atoms present	212716-69-3	CC(=O)C(=NNC1=C(C=CC(=C1)S(=O)(=O)N)O)C(=O)NC2=CC=CC=C2.C1=CC(=C(C=C1[N+](=O)[O-])O)NN=C2C(=CC3=C(C=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cr]	{1: 1, 34: 2, 38: 1, 7: 1, 14: 14, 15: 2, 21: 2, 24: 2, 25: 1, 29: 8, 30: 2, 31: 3}
Did not match all atoms present	212716-70-6	C1=CC(=C(C=C1[N+](=O)[O-])O)NN=C2C(=CC3=C(C=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].C1=CC(=C(C=C1[N+](=O)[O-])O)NN=C2C(=CC3=C(C=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Cr]	{34: 2, 38: 2, 14: 12, 15: 4, 21: 2, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	21273-04-1	[2H]C1(CC(CC(C1)([2H])[2H])O)[2H]	{20: 1, 11: 5, 12: 1}
Did not match all atoms present	21273-15-4	C[Si](C)(C)OC(=O)CCC1=CC=CC=C1	{1: 3, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	212755-76-5	COC(=O)CC(=O)C1=CC=C(C=C1)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 24: 1, 28: 1}
Did not match all atoms present	212755-80-1	C1=CC(=NC(=C1)C(C=O)C=O)C(=O)O	{27: 1, 35: 1, 26: 2, 3: 1, 14: 3}
Did not match all atoms present	212755-81-2	C1=CC(=NC=C1C(=O)O)C(C=O)C=O	{27: 1, 35: 1, 26: 2, 3: 1, 14: 3}
Did not match all atoms present	212755-83-4	C1=CC=NC(=C1)C(C=O)C=O	{35: 1, 26: 2, 3: 1, 14: 4}
Did not match all atoms present	212757-09-0	C1CC[C@H]([C@@H](C1)C(=O)C2=CC=C(C=C2)Br)C(=O)O	{11: 4, 12: 2, 14: 4, 18: 1, 24: 1, 27: 1}
Did not match all atoms present	212757-10-3	C1CC[C@H]([C@H](C1)C(=O)C2=CC=CS2)C(=O)O	{41: 1, 11: 4, 12: 2, 14: 3, 24: 1, 27: 1}
Did not match all atoms present	212757-11-4	C1CC[C@H]([C@@H](C1)C(=O)C2=CC=CS2)C(=O)O	{41: 1, 11: 4, 12: 2, 14: 3, 24: 1, 27: 1}
Did not match all atoms present	212757-12-5	C1CC2CC1C(C2C(=O)O)C(=O)C3=CC=CC=C3	{24: 1, 27: 1, 11: 3, 12: 4, 14: 5}
Did not match all atoms present	2128-93-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3	{24: 1, 14: 14}
Did not match all atoms present	21286-54-4	CC1([C@@H]2CC[C@]1(C(=O)C2)CS(=O)(=O)Cl)C	{1: 2, 2: 1, 11: 3, 12: 1, 13: 2, 17: 1, 25: 1, 29: 2}
Did not match all atoms present	21288-28-8	C1=CC2=C(C(=C1)O)N=CC=C2.OP(=O)(O)O	{35: 1, 20: 3, 21: 1, 14: 6, 29: 1}
Did not match all atoms present	21288-85-7	N.N.N.N.[Cl-].[Cl-].[Cl-].[Rh+3]	{17: 3}
Did not match all atoms present	2129-89-7	CP(=O)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 29: 1, 14: 10}
Did not match all atoms present	21294-41-7	[O].[O].[U+]	{}
Did not match all atoms present	21295-86-3	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)N3CCOCC3	{1: 4, 3: 1, 33: 3, 11: 4, 14: 8, 23: 1}
Did not match all atoms present	21296-92-4	CC1=CC2=C(C=C1)NC(=C2C)C	{32: 1, 1: 3, 14: 3}
Did not match all atoms present	21297-72-3	CCO[Si]1(CCCN1[Si](C)(C)C)OCC	{1: 5, 2: 2, 11: 3, 22: 2, 33: 1}
Did not match all atoms present	21299-86-5	CC(C)NCC(COC1=CC=CC=C1OC2=CC=CC=C2)O.Cl	{1: 2, 2: 2, 3: 2, 14: 9, 17: 1, 20: 1, 22: 2, 31: 1}
Did not match all atoms present	213-44-5	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC5=C4C=CC6=CC7=CC=CC=C7C=C65	{14: 18}
Did not match all atoms present	213-46-7	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5=CC=CC=C54	{14: 14}
Did not match all atoms present	2130-56-5	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)C(=O)O)C(=O)O)N	{27: 2, 30: 2, 14: 6}
Did not match all atoms present	2130-76-9	CC1=CC=C(C=C1)S(=O)(=O)NCCCCC(C(=O)O)N	{1: 1, 2: 4, 3: 1, 14: 4, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	21302-09-0	CCCCCCCCCCCCO[P+](=O)OCCCCCCCCCCCC	{1: 2, 2: 22, 29: 1, 22: 2}
Did not match all atoms present	21303-03-7	[Li+].CCCC(=O)[O-]	{24: 1, 1: 1, 2: 2}
Did not match all atoms present	21308-96-3	C1=NC(=S)C2=C(N1)N=NC=N2	{32: 1, 35: 4, 14: 2}
Did not match all atoms present	2131-18-2	CCCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 14, 14: 5}
Did not match all atoms present	2131-38-6	CC1=CC2=C(C=C(C=C2C=C1)C)C	{1: 3, 14: 5}
Did not match all atoms present	2131-39-7	CC1=CC=CC2=C(C=C(C=C12)C)C	{1: 3, 14: 5}
Did not match all atoms present	2131-41-1	CC1=C2C=CC=C(C2=C(C=C1)C)C	{1: 3, 14: 5}
Did not match all atoms present	2131-42-2	CC1=CC2=C(C=CC(=C2C=C1)C)C	{1: 3, 14: 5}
Did not match all atoms present	2131-43-3	CC1=C(C2=C(C=C1)C(=C(C=C2)C)C)C	{1: 4, 14: 4}
Did not match all atoms present	2131-55-7	C1=CC(=CC=C1N=C=S)Cl	{8: 1, 17: 1, 34: 1, 14: 4}
Did not match all atoms present	2131-57-9	CC(=O)C1=CC=C(C=C1)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4, 24: 1}
Did not match all atoms present	2131-59-1	C1=CC(=CC(=C1)Br)N=C=S	{8: 1, 18: 1, 34: 1, 14: 4}
Did not match all atoms present	2131-60-4	C1=CC(=CC=C1N=C=S)O	{8: 1, 34: 1, 21: 1, 14: 4}
Did not match all atoms present	2131-61-5	C1=CC(=CC=C1N=C=S)[N+](=O)[O-]	{8: 1, 34: 1, 38: 1, 14: 4}
Did not match all atoms present	2131-62-6	C1=CC(=CC=C1C(=O)O)N=C=S	{8: 1, 34: 1, 27: 1, 14: 4}
Did not match all atoms present	2131-63-7	C1=CC(=CC(=C1)N=C=S)C(=O)O	{8: 1, 34: 1, 27: 1, 14: 4}
Did not match all atoms present	2131-64-8	CN(C)C1=CC=C(C=C1)N=C=S	{8: 1, 1: 2, 34: 1, 14: 4, 33: 1}
Did not match all atoms present	21314-17-0	C1=CC=C(C=C1)N2C3=NC=NC(=O)C3=CN2	{32: 1, 25: 1, 35: 2, 14: 7, 33: 1}
Did not match all atoms present	21316-51-8	C(C#N)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{17: 5, 2: 1, 37: 1}
Did not match all atoms present	2132-66-3	COC1=CC=C(C=C1)C(=CCl)C2=CC=C(C=C2)OC	{1: 2, 6: 1, 7: 1, 14: 8, 17: 1, 22: 2}
Did not match all atoms present	2132-80-1	COC1=CC=C(C=C1)C2=CC=C(C=C2)OC	{1: 2, 22: 2, 14: 8}
Did not match all atoms present	2132-84-5	CCCCCC(C)C1=CC=CC=C1	{1: 2, 2: 4, 3: 1, 14: 5}
Did not match all atoms present	2132-85-6	CCCCC(CC)C1=CC=CC=C1	{1: 2, 2: 4, 3: 1, 14: 5}
Did not match all atoms present	21321-30-2	CCP(=C=O)(C(=C=O)C=C=O)C(=C=O)C=C=O.[Cr]	{1: 1, 2: 1, 6: 2, 7: 2, 8: 5, 29: 5}
Did not match all atoms present	21321-31-3	CCP(=C=O)(C(=C=O)C=C=O)C(=C=O)C=C=O.[W]	{1: 1, 2: 1, 6: 2, 7: 2, 8: 5, 29: 5}
Did not match all atoms present	21322-38-3	C1=CC=C(C=C1)CNC(CCC(NCC2=CC=CC=C2)N3C(=O)C(NC3=O)(C4=CC=CC=C4)C5=CC=CC=C5)N6C(=O)C(NC6=O)(C7=CC=CC=C7)C8=CC=CC=C8	{32: 2, 33: 2, 2: 4, 3: 2, 13: 2, 14: 30, 25: 4, 31: 2}
Did not match all atoms present	21322-39-4	C1=CC=C(C=C1)C2(C(=O)N(C(=O)N2)CNCCNCN3C(=O)C(NC3=O)(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6	{32: 2, 33: 2, 2: 4, 13: 2, 14: 20, 25: 4, 31: 2}
Did not match all atoms present	21324-39-0	F[P-](F)(F)(F)(F)F.[Na+]	{16: 6}
Did not match all atoms present	21324-40-3	[Li+].F[P-](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	21327-74-2	CC1CCCCC1=C(C2=CC=C(C=C2)OC(=O)C)C3=CC=C(C=C3)OC(=O)C	{1: 3, 7: 1, 11: 4, 12: 1, 14: 8, 15: 1, 28: 2}
Did not match all atoms present	21328-74-5	C1=CC2=C3NC(=C2C=C1)NC4=C5C=CC=CC5=C([N-]4)NC6=C7C=CC=CC7=C(N6)NC8=C9C=CC=CC9=C(N3)[N-]8.[Cd+2]	{32: 6, 35: 2, 14: 16}
Did not match all atoms present	21331-80-6	CN(C)CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 2, 2: 2, 18: 1, 14: 15, 33: 1}
Did not match all atoms present	21340-02-3	F[Al-](F)(F)F	{16: 4}
Did not match all atoms present	21340-03-4	[Al+3].[F-].[F-].[F-].[F-].[F-].[F-]	{16: 6}
Did not match all atoms present	21340-68-1	CC(C)(C(=O)OC)OC1=CC=C(C=C1)C2=CC=C(C=C2)Cl	{1: 3, 4: 1, 14: 8, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	21342-26-7	CC(C)[Ge](I)(I)I	{19: 3, 1: 2, 3: 1}
Did not match all atoms present	21342-85-8	CC1=C(C=CC=C1Cl)CC(C#N)Cl	{1: 1, 2: 1, 3: 1, 37: 1, 14: 3, 17: 2}
Did not match all atoms present	21346-66-7	C1=CC(=C(C=C1S(=O)(=O)F)C(=O)O)Cl	{16: 1, 17: 1, 27: 1, 29: 2, 14: 3}
Did not match all atoms present	21348-59-4	C(=O)(C(=O)[O-])[O-].[Nb+2]	{24: 2}
Did not match all atoms present	21348-60-7	C(=O)(C(=O)[O-])[O-].[Ta+2]	{24: 2}
Did not match all atoms present	21351-39-3	C(=O)(N)N.OS(=O)(=O)O	{24: 1, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	21351-79-1	[OH-].[Cs+]	{}
Did not match all atoms present	21352-22-7	CC1=NC2=CC=CC=C2C=C1N	{1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	21354-01-8	CC(=O)NC1=CC=CC=C1N=O	{1: 1, 34: 1, 14: 4, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	2136-75-6	C1=CC=C(C=C1)P(=CC=O)(C2=CC=CC=C2)C3=CC=CC=C3	{26: 1, 14: 15, 6: 1}
Did not match all atoms present	2136-89-2	C1=CC=C(C(=C1)C(Cl)(Cl)Cl)Cl	{17: 4, 4: 1, 14: 4}
Did not match all atoms present	2136-95-0	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C(Cl)Cl	{17: 7, 3: 1}
Did not match all atoms present	2136-99-4	C1=C(C(=C(C(=C1Cl)Cl)C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 8, 14: 2}
Did not match all atoms present	21361-35-3	CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.CC(/C(=C/C(=O)C(C)(C)C)/[O-])(C)C.[Mg+2]	{24: 2, 1: 12, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	21363-18-8	CCC(C)N(CC(C1=CC=CN1CC2=CC=CC=C2Cl)O)C(C)CC	{1: 4, 2: 4, 3: 3, 33: 2, 14: 7, 17: 1, 20: 1}
Did not match all atoms present	21364-16-9	C[Ge](C)(C)C1=CC=C(C=C1)[Ge](C)(C)C	{1: 6, 14: 4}
Did not match all atoms present	21364-38-5	CC1=C(SC(=S)N1C)C	{1: 3, 41: 1, 33: 1}
Did not match all atoms present	21364-46-5	C1=CC=C2C=NC=CC2=C1.Cl	{17: 1, 35: 1, 14: 7}
Did not match all atoms present	21369-64-2	[Li+].CCCCC[CH2-]	{1: 1, 2: 4, 5: 1}
Did not match all atoms present	213697-53-1	CN(C)C1=CC=CC=C1C2=CC=CC=C2P(C3CCCCC3)C4CCCCC4	{1: 2, 11: 10, 12: 2, 14: 8, 33: 1}
Did not match all atoms present	21374-25-4	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ru+4]	{}
Did not match all atoms present	21377-65-1	[Np+3]	{}
Did not match all atoms present	2138-20-7	C1CCC(CC1)C2=C(C=C(C=C2)O)O	{11: 5, 12: 1, 21: 2, 14: 3}
Did not match all atoms present	2138-22-9	C1=CC(=C(C=C1Cl)O)O	{17: 1, 21: 2, 14: 3}
Did not match all atoms present	2138-24-1	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[I-]	{1: 4, 2: 20, 19: 1}
Did not match all atoms present	2138-43-4	CC(C)C1=CC(=C(C=C1)O)O	{1: 2, 3: 1, 21: 2, 14: 3}
Did not match all atoms present	2138-48-9	CC(C)C1=C(C(=CC=C1)O)O	{1: 2, 3: 1, 21: 2, 14: 3}
Did not match all atoms present	2138-49-0	CC(C)C1=CC(=C(C(=C1)O)O)C(C)C	{1: 4, 3: 2, 21: 2, 14: 2}
Did not match all atoms present	21382-98-9	CSC1=CC=C(C=C1)C#N	{40: 1, 1: 1, 37: 1, 14: 4}
Did not match all atoms present	21383-06-2	CCCCCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 4, 3: 1, 14: 10}
Did not match all atoms present	21386-21-0	C1(=C(C(=C(C(=C1F)F)S)F)F)C2=C(C(=C(C(=C2F)F)S)F)F	{16: 8, 39: 2}
Did not match all atoms present	21388-05-6	Br[Hg-](Br)Br	{18: 3}
Did not match all atoms present	2139-00-6	COC1=C(C=C2C(=C1)OC(=N2)N)Cl	{1: 1, 35: 1, 14: 2, 17: 1, 22: 1, 23: 1, 30: 1}
Did not match all atoms present	2139-25-5	C1CCN(CC1)CC(C2=NOC(=C2)C3=CC=CC=C3)O.C1CCN(CC1)CC(C2=NOC(=C2)C3=CC=CC=C3)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{33: 2, 2: 4, 3: 2, 4: 1, 11: 10, 14: 12, 35: 2, 20: 3, 23: 2, 27: 3}
Did not match all atoms present	21395-09-5	CCCCCCC(C)OC(=O)C1=CC=CC=C1C(=O)O	{1: 2, 2: 5, 3: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	21395-47-1	CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCNC2=CC(=NC3=C2N=C(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5)N.Cl	{1: 2, 2: 4, 35: 3, 33: 1, 14: 15, 17: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	213995-12-1	C1CCN(CC1)[C@H](C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O	{33: 1, 3: 1, 4: 1, 11: 5, 14: 15, 20: 1}
Did not match all atoms present	214-17-5	C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC5=CC=CC=C5C=C43	{14: 14}
Did not match all atoms present	214-63-1	C1=CC2=C3C(=C1)C=C4C5=CC=CC6=C5C(=CC=C6)C=C4C3=CC=C2	{14: 14}
Did not match all atoms present	214-87-9	C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C5=CC=CC=C5C6=CC7=CC8=CC=CC=C8C=C7C=C64	{14: 20}
Did not match all atoms present	214-91-5	C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4C5=CC6=CC=CC=C6C=C53	{14: 16}
Did not match all atoms present	21402-12-0	CC(CC1=NC(=NC(=N1)N)N)CC2=NC(=NC(=N2)N)N	{1: 1, 2: 2, 3: 1, 30: 4, 35: 6}
Did not match all atoms present	21402-19-7	CN1C(=CSC1=S)C2=CC=CC=C2	{1: 1, 41: 1, 14: 6, 33: 1}
Did not match all atoms present	21406-61-1	CCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 2: 4, 18: 1, 14: 15}
Did not match all atoms present	21407-67-0	CC1=CC=C(N1N(C)C)C	{1: 4, 14: 2, 33: 2}
Did not match all atoms present	21409-48-3	CC(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)C.CC(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)C.CC(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)C.[Cr]	{27: 3, 1: 12, 3: 6, 21: 3, 14: 6}
Did not match all atoms present	2141-42-6	C1CCC2=CC3=CC=CC=C3C=C2C1	{11: 4, 14: 6}
Did not match all atoms present	21411-33-6	CCC(CCC(CC)C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 4, 3: 2, 14: 10}
Did not match all atoms present	21411-35-8	CCC(C)(CCC(C)(CC)C1=CC=CC=C1)C2=CC=CC=C2	{1: 4, 2: 4, 4: 2, 14: 10}
Did not match all atoms present	21411-39-2	CC(C)(C)CC1=CC(=CC(=C1)CC(C)(C)C)CC(C)(C)C	{1: 9, 2: 3, 4: 3, 14: 3}
Did not match all atoms present	21411-42-7	CC1=CC(=C(C(=C1)C)CS)C	{1: 3, 2: 1, 14: 2, 39: 1}
Did not match all atoms present	21412-00-0	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Rh+3]	{17: 6}
Did not match all atoms present	21413-28-5	C1=CC=C(C=C1)C2(C(=O)NC(=O)N2S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4	{32: 1, 33: 1, 13: 1, 14: 15, 25: 2, 29: 2}
Did not match all atoms present	214139-26-1	CC(C)(C)OC(=O)NC1(CCC2=CC=CC=C21)C(=O)O	{1: 3, 4: 1, 11: 2, 13: 1, 14: 4, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	214139-28-3	C1CC(C2=CC=CC=C21)(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35	{2: 1, 11: 2, 12: 1, 13: 1, 14: 12, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	2142-01-0	C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O	{25: 2, 2: 1, 14: 9, 33: 1}
Did not match all atoms present	2142-06-5	C1CC(=O)N(C1=O)CC2=CC=CC=C2	{25: 2, 2: 1, 11: 2, 14: 5, 33: 1}
Did not match all atoms present	2142-29-2	C1=C(C(=CC(=C1Cl)C(Cl)(Cl)Cl)Cl)C(Cl)(Cl)Cl	{17: 8, 4: 2, 14: 2}
Did not match all atoms present	2142-31-6	C1(=C(C(=C(C(=C1Cl)Cl)C(Cl)Cl)Cl)Cl)C(Cl)Cl	{17: 8, 3: 2}
Did not match all atoms present	2142-63-4	CC(=O)C1=CC(=CC=C1)Br	{24: 1, 1: 1, 18: 1, 14: 4}
Did not match all atoms present	2142-64-5	CCC1=CC=CC=C1C(=O)C	{24: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	2142-68-9	CC(=O)C1=CC=CC=C1Cl	{24: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	2142-69-0	CC(=O)C1=CC=CC=C1Br	{24: 1, 1: 1, 18: 1, 14: 4}
Did not match all atoms present	2142-71-4	CC1=CC=CC(=C1C)C(=O)C	{24: 1, 1: 3, 14: 3}
Did not match all atoms present	2142-73-6	CC1=CC(=C(C=C1)C)C(=O)C	{24: 1, 1: 3, 14: 3}
Did not match all atoms present	2142-76-9	CC1=C(C(=CC=C1)C)C(=O)C	{24: 1, 1: 3, 14: 3}
Did not match all atoms present	2142-79-2	CC1=CC(=C(C(=C1C)C(=O)C)C)C	{24: 1, 1: 5, 14: 1}
Did not match all atoms present	2142-94-1	CC(=C)CCC/C(=C\COC=O)/C	{1: 2, 2: 4, 5: 1, 6: 1, 7: 2, 26: 1}
Did not match all atoms present	21423-81-4	CC1=C(C=C(C=C1)C#N)Cl	{1: 1, 37: 1, 14: 3, 17: 1}
Did not match all atoms present	21426-53-9	C1=CC=C2C(=C1)C3=CC=CC=C3[Si]O2	{14: 8, 23: 1}
Did not match all atoms present	214262-85-8	CCOC(=O)CC1=C(C=CC=C1Cl)F	{1: 1, 2: 2, 14: 3, 16: 1, 17: 1, 28: 1}
Did not match all atoms present	214262-86-9	C1=CC(=C(C(=C1)Cl)CCO)F	{16: 1, 17: 1, 2: 2, 20: 1, 14: 3}
Did not match all atoms present	214262-87-0	C1=CC(=C(C=C1F)Cl)CCO	{16: 1, 17: 1, 2: 2, 20: 1, 14: 3}
Did not match all atoms present	214262-88-1	COC(=O)CC1=C(C=C(C=C1)F)Cl	{1: 1, 2: 1, 14: 3, 16: 1, 17: 1, 28: 1}
Did not match all atoms present	214262-89-2	C1CCC(C1)(C#N)C2=CC=CC=C2F	{16: 1, 11: 4, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	214262-90-5	C1CCC(C1)(C#N)C2=CC(=CC=C2)F	{16: 1, 11: 4, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	214262-91-6	C1CCC(CC1)(C#N)C2=CC(=CC=C2)F	{16: 1, 11: 5, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	214262-92-7	C1CCC(C1)(C#N)C2=C(C=C(C=C2)F)Cl	{37: 1, 11: 4, 13: 1, 14: 3, 16: 1, 17: 1}
Did not match all atoms present	214262-93-8	C1CCC(CC1)(C#N)C2=C(C=C(C=C2)F)Cl	{37: 1, 11: 5, 13: 1, 14: 3, 16: 1, 17: 1}
Did not match all atoms present	214262-94-9	C1CCC(C1)(C#N)C2=C(C=CC=C2Cl)F	{37: 1, 11: 4, 13: 1, 14: 3, 16: 1, 17: 1}
Did not match all atoms present	214262-95-0	C1CCC(CC1)(C#N)C2=C(C=CC=C2Cl)F	{37: 1, 11: 5, 13: 1, 14: 3, 16: 1, 17: 1}
Did not match all atoms present	214262-96-1	C1CCC(C1)(C2=CC=CC=C2F)C(=O)O	{16: 1, 27: 1, 11: 4, 13: 1, 14: 4}
Did not match all atoms present	214262-97-2	C1CCC(C1)(C2=CC(=CC=C2)F)C(=O)O	{16: 1, 27: 1, 11: 4, 13: 1, 14: 4}
Did not match all atoms present	214262-98-3	C1CCC(CC1)(C2=CC(=CC=C2)F)C(=O)O	{16: 1, 27: 1, 11: 5, 13: 1, 14: 4}
Did not match all atoms present	214262-99-4	C1CCC(C1)(C2=CC=C(C=C2)F)C(=O)O	{16: 1, 27: 1, 11: 4, 13: 1, 14: 4}
Did not match all atoms present	214263-00-0	C1CCC(CC1)(C2=CC=C(C=C2)F)C(=O)O	{16: 1, 27: 1, 11: 5, 13: 1, 14: 4}
Did not match all atoms present	214263-01-1	C1CCC(C1)(C2=C(C=C(C=C2)F)Cl)C(=O)O	{11: 4, 13: 1, 14: 3, 16: 1, 17: 1, 27: 1}
Did not match all atoms present	214263-02-2	C1CCC(CC1)(C2=C(C=C(C=C2)F)Cl)C(=O)O	{11: 5, 13: 1, 14: 3, 16: 1, 17: 1, 27: 1}
Did not match all atoms present	214263-03-3	C1CCC(C1)(C2=C(C=CC=C2Cl)F)C(=O)O	{11: 4, 13: 1, 14: 3, 16: 1, 17: 1, 27: 1}
Did not match all atoms present	214263-04-4	C1CCC(CC1)(C2=C(C=CC=C2Cl)F)C(=O)O	{11: 5, 13: 1, 14: 3, 16: 1, 17: 1, 27: 1}
Did not match all atoms present	214279-40-0	COC1=CC(=C(C=C1)[N+](=O)[O-])I	{38: 1, 1: 1, 19: 1, 22: 1, 14: 3}
Did not match all atoms present	214279-41-1	C1=CC(=C(C=C1CBr)I)[N+](=O)[O-]	{38: 1, 2: 1, 19: 1, 18: 1, 14: 3}
Did not match all atoms present	2143-80-8	CC(=O)C=CC1=CC=CC=C1F	{16: 1, 1: 1, 14: 4, 6: 2, 24: 1}
Did not match all atoms present	2143-99-9	C1=CC(=CC=C1/C=N/N=C\C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{34: 2, 38: 2, 14: 8, 6: 2}
Did not match all atoms present	21430-69-3	[C-]#N.[C-]#N.[Na+].[Ag+]	{}
Did not match all atoms present	21433-91-0	CC1=CC(=CO1)C2=CC=CC=C2	{1: 1, 14: 7, 23: 1}
Did not match all atoms present	21436-44-2	CC1=CC=CC(=C1)C(=O)OC(=O)C2=CC(=CC=C2)C	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	21436-96-4	CC1=CC(=C(C=C1)N)C.Cl	{1: 2, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	21436-97-5	CC1=CC(=C(C=C1C)N)C.Cl	{1: 3, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	21438-99-3	[CH2-]C#N.[K+]	{5: 1, 37: 1}
Did not match all atoms present	2144-00-5	C1=CC=C2C(=C1)C=CC=C2C=NN=CC3=CC=CC4=CC=CC=C43	{34: 2, 14: 14, 6: 2}
Did not match all atoms present	2144-08-3	C1=CC(=C(C(=C1C=O)O)O)O	{26: 1, 21: 3, 14: 2}
Did not match all atoms present	2144-45-8	C1=CC=C(C=C1)COC(=O)OOC(=O)OCC2=CC=CC=C2	{2: 2, 14: 10}
Did not match all atoms present	21441-24-7	C1=CC(=CC=C1N2C=CN=C2)F	{16: 1, 33: 1, 35: 1, 14: 7}
Did not match all atoms present	21443-53-8	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C2=NO[N+](=C2C(=O)C3=CC(=CC=C3)[N+](=O)[O-])[O-]	{33: 1, 35: 1, 38: 2, 14: 8, 23: 1, 24: 2}
Did not match all atoms present	21447-86-9	CC1=C(C=C(C=C1)C(=O)N2CC2)N(CCCl)CCCl	{1: 1, 2: 4, 33: 2, 11: 2, 14: 3, 17: 2, 24: 1}
Did not match all atoms present	2145-21-3	C1=CC(=CC=C1[O])F	{16: 1, 14: 4}
Did not match all atoms present	2145-31-5	C1=CC(=CC(=C1)OCC#N)C(F)(F)F	{2: 1, 4: 1, 37: 1, 14: 4, 16: 3, 22: 1}
Did not match all atoms present	21450-81-7	CC1=CC(=C(C(=C1C)[Hg]OC(=O)C)C)C	{1: 5, 28: 1, 14: 1}
Did not match all atoms present	21452-14-2	CC1=C(SC(=N1)N)C(=O)NC2=CC=CC=C2	{1: 1, 35: 1, 41: 1, 14: 5, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	2146-61-4	COC1=CC=CC(=C1)CCBr	{1: 1, 2: 2, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	21465-51-0	C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)[O-].[Na+]	{41: 1, 35: 1, 29: 3, 14: 4}
Did not match all atoms present	21466-07-9	C1=C(C=C(C(=C1Br)O)C2=CC(=CC(=C2OP(=O)(O)O)Br)Br)Br	{14: 4, 18: 4, 20: 2, 21: 1, 22: 1, 29: 1}
Did not match all atoms present	2147-61-7	C1=CC(=C(C(=C1)O)N)C(=O)CC(C(=O)O)N	{2: 1, 3: 1, 14: 3, 21: 1, 24: 1, 27: 1, 30: 2}
Did not match all atoms present	2147-83-3	C1CNCC=C1N2C3=CC=CC=C3NC2=O	{32: 2, 33: 1, 11: 3, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	21472-86-6	CC1=CC(=C(C(=C1)Cl)Cl)Cl	{1: 1, 14: 2, 17: 3}
Did not match all atoms present	21472-93-5	CCN1C=C(C(=O)N(C1=O)CC)C	{1: 3, 2: 2, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	2148-56-3	C1=CC(=C(C(=C1)Cl)C(=O)O)N	{17: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	21482-59-7	B(B(C)C)(C)C	{1: 4}
Did not match all atoms present	2149-36-2	C1=CC2=C(C(=C1)OS(=O)(=O)O)N=CC=C2	{35: 1, 20: 1, 22: 1, 14: 6, 29: 2}
Did not match all atoms present	21494-31-5	COP(=[Fe]=C=O)(OC)OC.[N-]=O.[N-]=O	{8: 1, 1: 3, 29: 3, 22: 3}
Did not match all atoms present	21494-33-7	CCCCOP(=[Fe])(OCCCC)OCCCC.[CH-]=O.[N-]=O.[N-]=O	{1: 3, 2: 9, 29: 3, 22: 3}
Did not match all atoms present	21498-08-8	CC(C1=NCCN1)OC2=C(C=CC=C2Cl)Cl.Cl	{32: 1, 1: 1, 3: 1, 11: 2, 14: 3, 15: 1, 17: 3, 35: 1, 22: 1}
Did not match all atoms present	215-11-2	C1=CC=C2C(=C1)C3=CC=CC=C3C4=CC5=C(C=C24)C6=CC=CC=C6C7=CC=CC=C75	{14: 18}
Did not match all atoms present	215-26-9	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)C5=CC=CC=C5C6=CC=CC=C64	{14: 16}
Did not match all atoms present	215-29-2	C1=CC=C2C(=C1)C=CC3=C2N=C4C5=CC=CC=C5C6=CC=CC=C6C4=N3	{35: 2, 14: 14}
Did not match all atoms present	215-58-7	C1=CC=C2C=C3C4=CC=CC=C4C5=CC=CC=C5C3=CC2=C1	{14: 14}
Did not match all atoms present	215-64-5	C1=CC=C2C(=C1)C3=CC=CC=C3C4=NC5=CC=CC=C5N=C24	{35: 2, 14: 12}
Did not match all atoms present	215-66-7	C1=CC=C2C(=C1)C3=CC=CC=C3C4=NC5=C(C=CC=N5)N=C24	{35: 3, 14: 11}
Did not match all atoms present	215-96-3	C1=CC=C2C(=C1)C=CC3=CC4=CC5=C(C=C4C=C32)C6=CC=CC=C6C7=CC=CC=C75	{14: 18}
Did not match all atoms present	2150-18-7	CCC1=NC=CC(=C1)C	{1: 2, 2: 1, 35: 1, 14: 3}
Did not match all atoms present	2150-37-0	COC1=CC(=CC(=C1)C(=O)OC)OC	{1: 3, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	2150-38-1	COC1=C(C=C(C=C1)C(=O)OC)OC	{1: 3, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	2150-41-6	COC1=CC(=C(C=C1)C(=O)OC)OC	{1: 3, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	2150-44-9	COC(=O)C1=CC(=CC(=C1)O)O	{1: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	2150-45-0	COC(=O)C1=C(C=CC=C1O)O	{1: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	2150-46-1	COC(=O)C1=C(C=CC(=C1)O)O	{1: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	2150-47-2	COC(=O)C1=C(C=C(C=C1)O)O	{1: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	2150-48-3	CCN(CC)C1=CC2=C(C=C1)C=C3C=CC(=[N+](CC)CC)C=C3O2.[Cl-]	{1: 4, 2: 4, 33: 2, 14: 7, 17: 1, 23: 1}
Did not match all atoms present	2150-53-0	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N/N=C/5\C=CC6=C(C5=O)C(=C(C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 12, 15: 3, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	2150-58-5	CN(C)C1=CC=C(C=C1)N=C2C=CC(=O)C=C2	{1: 2, 34: 1, 33: 1, 14: 8, 15: 1, 25: 1}
Did not match all atoms present	2150-60-9	C1=CC(=C2C(=C1N)C(=O)C3=C(C2=O)C(=CC(=C3O)S(=O)(=O)[O-])N)O.[Na+]	{25: 2, 30: 2, 21: 2, 14: 3, 29: 3}
Did not match all atoms present	2150-89-2	CCOC(=O)NC1=CC(=CC=C1)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	2150-93-8	CC(=O)NC1=CC(=C(C=C1)Cl)Cl	{24: 1, 1: 1, 31: 1, 14: 3, 17: 2}
Did not match all atoms present	21510-43-0	C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)Br	{18: 1, 35: 2, 14: 9, 23: 1}
Did not match all atoms present	21511-46-6	C1S(=O)(=O)CS1(=O)=O	{11: 2, 29: 4}
Did not match all atoms present	215125-12-5	COC1=NNC(=O)[N-]1.[K+]	{32: 1, 1: 1, 35: 2, 22: 1, 25: 1}
Did not match all atoms present	215190-23-1	C1=CC=C(C=C1)/C=C/C[C@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 2, 3: 1, 6: 2, 12: 1, 14: 13, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	2152-34-3	C1=CC=C(C=C1)C2C(=O)N=C(O2)N	{35: 1, 12: 1, 14: 5, 15: 1, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	2152-64-9	C1=CC=C(C=C1)NC2=CC=C(C=C2)C(=C3C=CC(=NC4=CC=CC=C4)C=C3)C5=CC=C(C=C5)NC6=CC=CC=C6.Cl	{34: 1, 7: 1, 14: 27, 15: 2, 17: 1, 31: 2}
Did not match all atoms present	21521-51-7	C1=C(C=C(C(=C1Br)I)Br)Br	{18: 3, 19: 1, 14: 2}
Did not match all atoms present	21524-23-2	C1=CC=C(C=C1)C2=CC(=NNC3=CC=CC=C3)C(=O)C=C2	{25: 1, 34: 1, 31: 1, 14: 13, 15: 2}
Did not match all atoms present	21524-34-5	CC(C)C1=CC(=C(C(=C1)C(C)C)Br)C(C)C	{1: 6, 18: 1, 3: 3, 14: 2}
Did not match all atoms present	21524-39-0	C1=CC(=C(C(=C1)F)F)C#N	{16: 2, 37: 1, 14: 3}
Did not match all atoms present	215245-16-2	CCN(CCC#N)C1=C(C=C(C(=C1)NC(=O)C)N2N=C3C(=CC(=C(C3=N2)Cl)N)Br)OC	{1: 3, 2: 3, 35: 2, 37: 1, 33: 2, 14: 3, 17: 1, 18: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	21528-11-0	C1=CC=C2C=C(C(=CC2=C1)C(=O)NCC[NH3+])O.[Cl-]	{2: 2, 14: 6, 17: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	21528-24-5	CN(C)C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)N(C)C)C(=O)O	{24: 1, 1: 4, 27: 1, 14: 7, 33: 2}
Did not match all atoms present	21528-31-4	CN(C)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O	{24: 1, 1: 2, 27: 1, 14: 8, 33: 1}
Did not match all atoms present	21528-48-3	CCCCCCCCCCCCS(=O)(=O)C(=CC=C1N(CCS1)CCCS(=O)(=O)[O-])C#N.[K+]	{1: 1, 2: 14, 33: 1, 6: 2, 7: 1, 41: 1, 11: 2, 15: 1, 29: 5, 37: 1}
Did not match all atoms present	2153-08-4	CCOC1=CC=C(C=C1)NC(=O)CCl	{1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	2153-26-6	CC1=CCC(CC1)C(C)(C)OC=O	{1: 3, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
Did not match all atoms present	2153-98-2	C[C@@H]([C@H](C1=CC=CC=C1)O)N.Cl	{1: 1, 3: 2, 14: 5, 17: 1, 20: 1, 30: 1}
Did not match all atoms present	21533-76-6	CC1=CC2=CC=CC3=CC=C4C=CC1=C4N32	{1: 1, 14: 8, 33: 1}
Did not match all atoms present	21535-47-7	CN1CCN2C(C1)C3=CC=CC=C3CC4=CC=CC=C42.Cl	{1: 1, 33: 2, 11: 4, 12: 1, 14: 8, 17: 1}
Did not match all atoms present	21535-97-7	CC1=COC2=CC=CC=C12	{1: 1, 14: 5, 23: 1}
Did not match all atoms present	21538-06-7	C1=C(C=C(C=C1S(=O)(=O)Cl)S(=O)(=O)Cl)S(=O)(=O)Cl	{17: 3, 29: 6, 14: 3}
Did not match all atoms present	2154-02-1	CN1CCC2=CC(=C(C=C2C1CCC3=CC=C(C=C3)Cl)OC)OC	{1: 3, 2: 2, 33: 1, 11: 2, 12: 1, 14: 6, 17: 1, 22: 2}
Did not match all atoms present	2154-54-3	[CH2]C1=CC=CC=C1	{5: 1, 14: 5}
Did not match all atoms present	2154-55-4	[2H]C1=C(C(=C(C(=C1[2H])[2H])C([2H])[2H])[2H])[2H]	{1: 1, 14: 5}
Did not match all atoms present	21540-57-8	C1=CC=C(C(=C1)CC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]	{2: 1, 38: 2, 14: 8}
Did not match all atoms present	21545-54-0	C1CCC(CC1)NC(=S)NCCN2CCOCC2	{33: 1, 2: 2, 7: 1, 11: 9, 12: 1, 23: 1, 31: 2}
Did not match all atoms present	21548-32-3	CCOP(=O)(N=C1SCS1)OCC	{1: 2, 2: 2, 41: 2, 11: 1, 34: 1, 15: 1, 22: 2, 29: 1}
Did not match all atoms present	21548-73-2	[SH-].[Ag].[Ag+]	{}
Did not match all atoms present	21549-02-0	O=S(=O)([O])F	{16: 1, 29: 3}
Did not match all atoms present	2155-42-2	C=CC1=CC(=CC(=C1)Cl)Cl	{17: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	2155-70-6	CCCC[Sn](CCCC)(CCCC)OC(=O)C(=C)C	{1: 4, 2: 9, 28: 1, 5: 1, 7: 1}
Did not match all atoms present	2155-73-9	CCCC[Sb](CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	2155-78-4	C(P(Cl)Cl)Cl	{17: 3, 2: 1}
Did not match all atoms present	2155-96-6	C=CP(C1=CC=CC=C1)C2=CC=CC=C2	{14: 10, 5: 1, 6: 1}
Did not match all atoms present	21553-46-8	CC1=CC(=CC(=C1OC)C)C(=O)O	{1: 3, 27: 1, 22: 1, 14: 2}
Did not match all atoms present	21554-20-1	CC1=CC(=NNC2=CC=C(C=C2)N)C=C(C1=O)C	{1: 2, 34: 1, 14: 6, 15: 3, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	21556-79-6	CCCC(=O)NC1=CC(=CC=C1)O	{1: 1, 2: 2, 14: 4, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	21558-94-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[N-]=O.[Rh]	{29: 1, 14: 45}
Did not match all atoms present	21559-03-5	[F-].[F-].[Al+3]	{16: 2}
Did not match all atoms present	2156-04-9	B(C1=CC=C(C=C1)C=C)(O)O	{14: 4, 20: 2, 5: 1, 6: 1}
Did not match all atoms present	2156-27-6	CC(COC1=CC=CC=C1CC2=CC=CC=C2)N3CCCCC3	{1: 1, 2: 2, 3: 1, 33: 1, 11: 5, 14: 9, 22: 1}
Did not match all atoms present	2156-29-8	C[N+]1=CC=CC=C1C=CC2=CC=C(C=C2)N(C)C.[I-]	{1: 3, 19: 1, 14: 8, 6: 2, 33: 2}
Did not match all atoms present	2156-56-1	C(C(=O)[O-])(Cl)Cl.[Na+]	{24: 1, 17: 2, 3: 1}
Did not match all atoms present	21561-99-9	CN(C(=O)NC1=CC=CC=C1)N=O	{1: 1, 34: 1, 33: 1, 14: 5, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	215612-56-9	CC(=O)NC1=C(C=CC(=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)N=NC4=CC(=C5C=CC=C(C5=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 2: 2, 35: 3, 34: 2, 14: 12, 17: 1, 22: 1, 24: 1, 29: 11, 31: 3}
Did not match all atoms present	21563-29-1	C1=CC2=C(C=CC3=C2C(=C1)C(=O)OC3=O)Br	{18: 1, 28: 2, 14: 5}
Did not match all atoms present	21564-17-0	C1=CC=C2C(=C1)N=C(S2)SCSC#N	{2: 1, 35: 1, 37: 1, 40: 2, 41: 1, 14: 4}
Did not match all atoms present	21564-91-0	CC1CCCC2=C1C=CC=C2C	{1: 2, 11: 3, 12: 1, 14: 3}
Did not match all atoms present	21564-92-1	CC1CC2=CC=CC=C2CC1C	{1: 2, 11: 2, 12: 2, 14: 4}
Did not match all atoms present	21566-11-0	CN(C)C1=CC=C(C=C1)C(=O)N(C)C	{24: 1, 1: 4, 14: 4, 33: 2}
Did not match all atoms present	21567-21-5	C1(=C(C(=C(C(=C1Cl)Cl)OC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl)Cl)O	{17: 9, 21: 1, 22: 1}
Did not match all atoms present	2157-39-3	C1=C(C=C(C=C1C(=O)O)Cl)C(=O)O	{17: 1, 27: 2, 14: 3}
Did not match all atoms present	2157-50-8	CC/C(=N\O)/C1=CC=CC=C1	{1: 1, 2: 1, 7: 1, 34: 1, 14: 5, 20: 1}
Did not match all atoms present	2157-52-0	C1=CC=C2C(=C1)C3=CC=CC=C3C2=NO	{34: 1, 20: 1, 14: 8, 15: 1}
Did not match all atoms present	2157-98-4	CC(=CC(=O)NC)OP(=O)(OC)OC	{1: 4, 6: 1, 7: 1, 22: 3, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	21570-53-6	CCCC[N+](CCC(C)C)(CCC(C)C)CCC(C)C	{1: 7, 2: 9, 3: 3}
Did not match all atoms present	21572-61-2	C1(=C(C(=[N+]=[N-])C(=C1Cl)Cl)Cl)Cl	{17: 4, 34: 1, 15: 5}
Did not match all atoms present	21577-80-0	CCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)O	{1: 1, 2: 11, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	21578-97-2	CCOCCOC(=O)NC1=CC=CC2=C1C=C(C=C2)O	{1: 1, 2: 3, 14: 6, 21: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	21579-78-2	CN1CCN(CC1)CC(C2=CC=CC=C2)(C3=CC=CC=C3)O	{1: 1, 2: 1, 4: 1, 33: 2, 11: 4, 14: 10, 20: 1}
Did not match all atoms present	2158-04-5	C1=CC=C(C=C1)CCNC(=O)N	{24: 1, 2: 2, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	21581-45-3	C1=CC(=C(C=C1CCN)Cl)Cl	{17: 2, 2: 2, 30: 1, 14: 3}
Did not match all atoms present	21587-39-3	CC(=O)C1=CC2=C(O1)C=CC(=C2)OC	{24: 1, 1: 2, 22: 1, 14: 4, 23: 1}
Did not match all atoms present	21590-92-1	CCN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)OCCN4CCCCC4	{1: 1, 2: 3, 33: 2, 11: 5, 12: 1, 14: 8, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	21593-23-7	CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CSC3=CC=NC=C3)SC1)C(=O)O	{1: 1, 2: 2, 35: 1, 33: 1, 40: 1, 41: 1, 11: 1, 12: 2, 14: 4, 15: 2, 24: 1, 25: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	21595-62-0	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)/C=C/C(=O)NC4=CC=C(C=C4)NC5=CC=[N+](C=C5)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 6: 4, 33: 2, 14: 28, 24: 2, 29: 6, 31: 4}
Did not match all atoms present	21598-06-1	C1=CC2=C(C=C1O)C=C(N2)C(=O)O	{32: 1, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	216-00-2	C1=CC=C2C=C3C=C4C5=CC=CC=C5C6=CC=CC=C6C4=CC3=CC2=C1	{14: 16}
Did not match all atoms present	216-07-9	C1=CC=C2C(=C1)C3=CC=CC=C3C4=CC5=CC6=CC7=C(C=C6C=C5C=C24)C8=CC=CC=C8C9=CC=CC=C97	{14: 22}
Did not match all atoms present	216-08-0	C1=CC=C2C=C3C=C4C=C5C6=CC=CC=C6C7=CC=CC=C7C5=CC4=CC3=CC2=C1	{14: 18}
Did not match all atoms present	21600-42-0	CN(C)N=NC1=C[N+](=CC=C1)[O-]	{1: 2, 34: 2, 29: 1, 14: 4, 33: 2}
Did not match all atoms present	21600-43-1	CCN(CC)N=NC1=CN=CC=C1	{1: 2, 2: 2, 35: 1, 33: 1, 34: 2, 14: 4}
Did not match all atoms present	21600-45-3	CN(CCO)N=NC1=CC=CC=C1	{1: 1, 2: 2, 33: 1, 34: 2, 14: 5, 20: 1}
Did not match all atoms present	21601-78-5	C1=CC=C(C=C1)C(C(=O)O)C(=O)OC2=CC=CC=C2	{27: 1, 3: 1, 28: 1, 14: 10}
Did not match all atoms present	21602-32-4	CC(C)(C)C1CCC(CC1)(C2=CC=CC=C2)N3CCN(CC3)C.CI	{1: 5, 4: 1, 33: 2, 11: 8, 12: 1, 13: 1, 14: 5, 19: 1}
Did not match all atoms present	21608-06-0	CCN(CCC(=O)OC)C1=CC=CC=C1	{1: 2, 2: 3, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	21609-90-5	COP(=S)(C1=CC=CC=C1)OC2=CC(=C(C=C2Cl)Br)Cl	{1: 1, 18: 1, 22: 2, 14: 7, 17: 2}
Did not match all atoms present	2161-85-5	CC(=O)C1=CC(=C(C=C1O)O)C(=O)C	{24: 2, 1: 2, 21: 2, 14: 2}
Did not match all atoms present	216144-70-6	C1=CC(=C(C=C1F)C(=O)Cl)C(F)(F)F	{16: 4, 17: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	21615-29-2	CCOC1=C(C=C(C=C1)NC(=O)C)N(CCO)CCO	{1: 2, 2: 5, 33: 1, 14: 3, 20: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	21615-34-9	COC1=CC=CC=C1C(=O)Cl	{24: 1, 1: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	21617-18-5	C1=CC2=NC=CC(=C2C(=C1)Cl)Cl	{17: 2, 35: 1, 14: 5}
Did not match all atoms present	2162-63-2	CCCCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 1, 2: 9, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	2162-74-5	CC(C)C1=C(C(=CC=C1)C(C)C)N=C=NC2=C(C=CC=C2C(C)C)C(C)C	{8: 1, 1: 8, 34: 2, 3: 4, 14: 6}
Did not match all atoms present	2162-75-6	CCC1=C(C(=CC=C1)CC)N(C#N)C2=C(C=CC=C2CC)CC	{1: 4, 2: 4, 37: 1, 14: 6, 33: 1}
Did not match all atoms present	21621-73-8	CC1=C(C=NN1C2=NC3=CC=CC=C3N=C2)C(=O)C	{24: 1, 1: 2, 35: 3, 14: 6, 33: 1}
Did not match all atoms present	21626-24-4	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Na+].[Na+].[Fe]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	2163-12-4	CC(=O)C1=C(C(=C(C=C1)O)C(=O)C)O	{24: 2, 1: 2, 21: 2, 14: 2}
Did not match all atoms present	2163-77-1	C1=CC(=C(C=C1[As](=O)(O)O)N)O	{30: 1, 20: 2, 21: 1, 14: 3, 29: 1}
Did not match all atoms present	2163-80-6	C[As](=O)(O)[O-].[Na+]	{1: 1, 20: 1, 29: 2}
Did not match all atoms present	2163-97-5	CS(=O)(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	21635-69-8	CC1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)O)OC)N	{1: 2, 2: 2, 14: 2, 20: 1, 22: 2, 29: 4, 30: 1}
Did not match all atoms present	2164-07-0	C1CC2C(C(C1O2)C(=O)[O-])C(=O)[O-].[K+].[K+]	{24: 2, 11: 2, 12: 4, 23: 1}
Did not match all atoms present	2164-08-1	C1CCC(CC1)N2C(=O)C3=C(CCC3)NC2=O	{32: 1, 25: 2, 11: 8, 12: 1, 33: 1}
Did not match all atoms present	2164-09-2	CC(=C)C(=O)NC1=CC(=C(C=C1)Cl)Cl	{1: 1, 5: 1, 7: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	2164-17-2	CN(C)C(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 2, 4: 1, 33: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	2164-34-3	C1C(OC2=CC=CC=C2O1)CBr	{2: 1, 11: 1, 12: 1, 14: 4, 18: 1, 23: 2}
Did not match all atoms present	2164-83-2	C1=NC(=C(C(=O)N1)[N+](=O)[O-])O	{32: 1, 35: 1, 38: 1, 14: 1, 21: 1, 25: 1}
Did not match all atoms present	2164-87-6	C1CCC2C(C1)SC(=S)S2	{41: 2, 11: 4, 12: 2, 15: 1}
Did not match all atoms present	21640-48-2	C1=CC(=CC(=C1)Cl)CCC(=O)O	{17: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	21642-82-0	CCC[C@H](C)C1(C(=O)NC(=O)[N-]C1=O)CC.[Na+]	{32: 1, 1: 3, 2: 3, 3: 1, 13: 1, 35: 1, 25: 3}
Did not match all atoms present	21643-38-9	CCCCCCC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 5, 27: 1, 14: 4}
Did not match all atoms present	216439-38-2	CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]	{1: 2, 34: 2, 3: 1, 38: 1, 14: 7, 22: 1, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	21644-95-1	CC1=CC(=NNC2=C(C=C(C=C2)N)C)C=C(C1=O)C	{1: 3, 34: 1, 14: 5, 15: 3, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	21645-26-1	CCN(CC)C(=S)NCC=C	{1: 2, 2: 3, 5: 1, 6: 1, 7: 1, 33: 1, 31: 1}
Did not match all atoms present	21645-51-2	[Al+3].[OH-].[OH-].[OH-]	{}
Did not match all atoms present	21646-99-1	CCOP(OCC)OP(OCC)OCC	{1: 4, 2: 4, 22: 5}
Did not match all atoms present	21649-57-0	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)C(=O)OC4=CC=CC=C4)C(=O)[O-])C.[Na+]	{1: 2, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 10, 24: 2, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	21650-02-2	CN1C[C@H]2CCC[C@@H](C1)C2(C3=CC=CC=C3)OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 2, 4: 1, 33: 1, 11: 5, 12: 2, 13: 1, 14: 5, 20: 1, 22: 1, 27: 3}
Did not match all atoms present	21651-19-4	O=[Sn]	{29: 1}
Did not match all atoms present	21655-73-2	C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)Br)Br	{17: 2, 18: 2, 14: 8, 7: 2}
Did not match all atoms present	21658-26-4	C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])N=C(N)N	{34: 1, 38: 1, 7: 1, 14: 8, 28: 1, 30: 2}
Did not match all atoms present	21658-95-7	CC(C)OP(=O)(CC#N)OC(C)C	{1: 4, 2: 1, 3: 2, 37: 1, 22: 2, 29: 1}
Did not match all atoms present	21663-51-4	CCCCCC(C)N=C=S	{8: 1, 1: 2, 2: 4, 3: 1, 34: 1}
Did not match all atoms present	21663-61-6	C1=CC(=C(C=C1Cl)C#N)Cl	{17: 2, 37: 1, 14: 3}
Did not match all atoms present	21666-38-6	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]	{1: 2, 2: 4}
Did not match all atoms present	21667-62-9	C1=CC(=CC(=C1)Cl)C(=O)CC#N	{24: 1, 17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	216689-57-5	CCCCCCCC[Si]1(O[Si](O[Si](O1)(OCC)O[Si]2(O[Si](O[Si](O2)(OCC)O[Si](C)(C)C)(CCCCCCCC)OCC)OCC)(O)O[Si](C)(C)C)OCC	{1: 13, 2: 19, 20: 1, 22: 8, 23: 6}
Did not match all atoms present	2167-14-8	CCN1C=CC=C1C=O	{1: 1, 2: 1, 26: 1, 14: 3, 33: 1}
Did not match all atoms present	2167-87-5	CC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C.Cl	{1: 3, 2: 3, 33: 2, 41: 1, 14: 7, 17: 1}
Did not match all atoms present	21674-38-4	C1(=NC(=NC(=N1)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 45, 35: 3, 4: 21}
Did not match all atoms present	21674-96-4	CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)N	{1: 1, 35: 1, 41: 1, 14: 5, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	21678-63-7	CC(=O)NC1=CC(=CC=C1)NCCC#N	{1: 1, 2: 2, 37: 1, 14: 4, 24: 1, 31: 2}
Did not match all atoms present	21679-46-9	CC(=O)CC(=O)C.CC(=O)CC(=O)C.CC(=O)CC(=O)C.[Co]	{24: 6, 1: 6, 2: 3}
Did not match all atoms present	2168-13-0	CN(C)CC1=C(C=CC=N1)O	{1: 2, 2: 1, 35: 1, 33: 1, 14: 3, 21: 1}
Did not match all atoms present	2168-93-6	CCCCS(=O)CCCC	{1: 2, 2: 6, 29: 1}
Did not match all atoms present	21689-84-9	CCNC1=NC(=NC(=N1)SC)NC(C)(C)C#N	{1: 4, 2: 1, 35: 3, 4: 1, 37: 1, 40: 1, 31: 2}
Did not match all atoms present	2169-44-0	CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)OC)OC	{1: 4, 33: 1, 11: 3, 12: 1, 14: 3, 21: 1, 22: 3}
Did not match all atoms present	2169-75-7	CN1C2CCC1CC(C2)OC3C4=CC=CC=C4CCC5=CC=CC=C35.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 1, 2: 2, 4: 1, 33: 1, 11: 6, 12: 4, 14: 8, 20: 1, 22: 1, 27: 3}
Did not match all atoms present	2169-87-1	C1=CC=C2C=C(C(=CC2=C1)C(=O)O)C(=O)O	{27: 2, 14: 6}
Did not match all atoms present	21693-51-6	CC1CCCC2=C(C=CC(=C12)C)C	{1: 3, 11: 3, 12: 1, 14: 2}
Did not match all atoms present	21693-54-9	CC1=CC(=C2CCCCC2=C1)C	{1: 2, 11: 4, 14: 2}
Did not match all atoms present	21693-55-0	CC1CCCC2=C(C=C(C=C12)C)C	{1: 3, 11: 3, 12: 1, 14: 2}
Did not match all atoms present	217-37-8	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5=C4C=CC6=CC=CC=C65	{14: 16}
Did not match all atoms present	217-42-5	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5=CC6=CC=CC=C6C=C54	{14: 16}
Did not match all atoms present	217-54-9	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC5=CC6=CC=CC=C6C=C54	{14: 16}
Did not match all atoms present	217-59-4	C1=CC=C2C(=C1)C3=CC=CC=C3C4=CC=CC=C24	{14: 12}
Did not match all atoms present	2170-06-1	C[Si](C)(C)C#CC1=CC=CC=C1	{1: 3, 10: 2, 14: 5}
Did not match all atoms present	2170-09-4	CC1=CC=CC=C1C(=O)NC	{24: 1, 1: 2, 14: 4, 31: 1}
Did not match all atoms present	21702-79-4	COC(=O)C1=CC(=CC(=C1O)Br)Br	{1: 1, 18: 2, 28: 1, 21: 1, 14: 2}
Did not match all atoms present	21702-84-1	COC1=C(C=C(C=C1)Br)Br	{1: 1, 18: 2, 22: 1, 14: 3}
Did not match all atoms present	21704-44-9	CCSC(=N)N.OP(=O)=O	{1: 1, 2: 1, 36: 1, 7: 1, 40: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	21704-46-1	CCOP(=O)(O)OCC.CCSC(=N)N	{1: 3, 2: 3, 36: 1, 7: 1, 40: 1, 20: 1, 22: 2, 29: 1, 30: 1}
Did not match all atoms present	21705-02-2	CCC(C)C1C(=O)NCC(=O)NC2CS(=O)C3=C(CC(C(=O)NCC(=O)N1)NC(=O)C(NC(=O)C4CC(CN4C(=O)C(NC2=O)CC(=O)O)O)C(C)C(C)O)C5=C(N3)C=C(C=C5)O	{32: 8, 1: 4, 2: 2, 3: 3, 33: 1, 11: 6, 12: 7, 14: 3, 20: 2, 21: 1, 25: 8, 27: 1, 29: 1}
Did not match all atoms present	21708-94-1	CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)[N+](=O)[O-])C3=CC=CC=C3	{1: 2, 2: 4, 38: 1, 33: 1, 7: 2, 14: 14, 22: 1}
Did not match all atoms present	21709-44-4	CN(C)C(=O)OC1=CC=CC=C1C2SCCS2	{1: 2, 33: 1, 41: 2, 11: 2, 12: 1, 14: 4, 28: 1}
Did not match all atoms present	2171-74-6	C1=CC=C2C(=C1)OC(=O)O2	{28: 2, 14: 4}
Did not match all atoms present	2171-82-6	CP(=[Se])(Cl)Cl	{1: 1, 17: 2}
Did not match all atoms present	2171-96-2	CO[SiH3]	{1: 1, 22: 1}
Did not match all atoms present	2171-98-4	CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Zr+4]	{1: 8, 3: 4, 29: 4}
Did not match all atoms present	2171-99-5	CC(C)O.CC(C)O.CC(C)O.CC(C)O.[Hf]	{1: 8, 3: 4, 20: 4}
Did not match all atoms present	21711-65-9	C1=CC=C2C(=C1)C=CC=C2N=O	{34: 1, 29: 1, 14: 7}
Did not match all atoms present	21711-71-7	C1=CC=C(C=C1)C2=CC=CC=C2N=O	{34: 1, 29: 1, 14: 9}
Did not match all atoms present	21713-75-7	C1CCC(=C(C#N)C2=CC=CC=C2)C1	{15: 1, 11: 4, 37: 1, 14: 5, 7: 1}
Did not match all atoms present	21714-25-0	COC1=C(C=C(C=C1)CCN=C=S)OC	{1: 2, 2: 2, 8: 1, 34: 1, 14: 3, 22: 2}
Did not match all atoms present	21715-46-8	CCNC1=NC2=C(C=C(C=C2)Cl)C(O1)(C)C3=CC=CC=C3	{1: 2, 2: 1, 35: 1, 13: 1, 14: 8, 15: 1, 17: 1, 23: 1, 31: 1}
Did not match all atoms present	2172-02-3	CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].[Hf+4]	{1: 12, 4: 4, 29: 4}
Did not match all atoms present	2172-12-5	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Y+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	21721-78-8	C1=CC=C(C(=C1)C(=O)N)NC(=O)CCl	{2: 1, 14: 4, 17: 1, 24: 2, 30: 1, 31: 1}
Did not match all atoms present	21725-46-2	CCNC1=NC(=NC(=N1)Cl)NC(C)(C)C#N	{1: 3, 2: 1, 35: 3, 4: 1, 37: 1, 17: 1, 31: 2}
Did not match all atoms present	21727-09-3	C(#N)C(C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)O	{17: 5, 3: 1, 20: 1, 37: 1}
Did not match all atoms present	2173-44-6	CC1=C(C(=CC=C1)C)OC(=O)CN2CCN(CC2)C.Cl.Cl	{1: 3, 2: 1, 33: 2, 11: 4, 14: 3, 17: 2, 28: 1}
Did not match all atoms present	2173-47-9	CC[NH+](CC)C(C)C(=O)OC1=C(C=C(C=C1C)C)C.[Cl-]	{1: 6, 2: 2, 3: 1, 14: 2, 17: 1, 28: 1}
Did not match all atoms present	2173-57-1	CC(C)COC1=CC2=CC=CC=C2C=C1	{1: 2, 2: 1, 3: 1, 22: 1, 14: 7}
Did not match all atoms present	21731-56-6	CS(=O)(=O)C1=CC(=C(C=C1)N)[N+](=O)[O-]	{1: 1, 30: 1, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	21734-43-0	C1=C(C=C(C=C1O)O)C(=O)NCCO	{2: 2, 14: 3, 20: 1, 21: 2, 24: 1, 31: 1}
Did not match all atoms present	21736-60-7	CC1=NN(C(=O)C1N=NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C5=CC=CC=C5	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 12, 15: 1, 25: 3}
Did not match all atoms present	21738-25-0	CCN(CC)CCSP(=O)(CC)OCC	{1: 4, 2: 6, 33: 1, 40: 1, 22: 1, 29: 1}
Did not match all atoms present	21738-42-1	CC(C)NCC1CCC2=CC(=C(C=C2N1)[N+](=O)[O-])CO	{32: 1, 1: 2, 2: 2, 3: 1, 38: 1, 11: 2, 12: 1, 14: 2, 20: 1, 31: 1}
Did not match all atoms present	21739-91-3	COC1=CC=C(C=C1)C(=O)/C(=C\C(=O)O)/Br	{1: 1, 6: 1, 7: 1, 14: 4, 18: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	21739-92-4	C1=CC(=C(C=C1Br)C(=O)O)Cl	{17: 1, 18: 1, 27: 1, 14: 3}
Did not match all atoms present	21739-93-5	C1=CC(=C(C=C1Cl)C(=O)O)Br	{17: 1, 18: 1, 27: 1, 14: 3}
Did not match all atoms present	2174-16-5	C1=CC=C(C(=C1)C(=O)O)O.C(CO)N(CCO)CCO	{33: 1, 2: 6, 14: 4, 20: 3, 21: 1, 27: 1}
Did not match all atoms present	2174-64-3	COC1=CC(=CC(=C1)O)O	{1: 1, 22: 1, 21: 2, 14: 3}
Did not match all atoms present	21742-00-7	C1=CC=C(C(=C1)CCl)C(F)(F)F	{16: 3, 17: 1, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	2175-80-6	CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 11, 22: 1, 14: 4}
Did not match all atoms present	2175-90-8	C1=CC=C(C=C1)C(=C2C=CC=C2)C3=CC=CC=C3	{15: 1, 14: 14, 7: 1}
Did not match all atoms present	21752-78-3	C[Si](C)(C)CC#CC[Si](C)(C)C	{1: 6, 2: 2, 10: 2}
Did not match all atoms present	21752-80-7	C[Si](C)(C)CC#C[Si](C)(C)C	{1: 6, 2: 1, 10: 2}
Did not match all atoms present	21752-86-3	C[Si](C)(C)C#CC#CC#C[Si](C)(C)C	{1: 6, 10: 6}
Did not match all atoms present	21757-82-4	CC(=O)OC(C1=CC(=C(C=C1)Cl)Cl)C(Cl)(Cl)Cl	{1: 1, 3: 1, 4: 1, 14: 3, 17: 5, 28: 1}
Did not match all atoms present	2176-62-7	C1(=C(C(=NC(=C1Cl)Cl)Cl)Cl)Cl	{17: 5, 35: 1}
Did not match all atoms present	2176-98-9	CCC[Sn](CCC)(CCC)CCC	{1: 4, 2: 8}
Did not match all atoms present	2177-47-1	CC1=CC2=CC=CC=C2C1	{1: 1, 11: 1, 14: 5, 15: 1}
Did not match all atoms present	2177-70-0	CC(=C)C(=O)OC1=CC=CC=C1	{1: 1, 28: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	21770-86-5	CCN(CC)CCSP(=O)(C)OCC	{1: 4, 2: 5, 33: 1, 40: 1, 22: 1, 29: 1}
Did not match all atoms present	21776-17-0	CN(C)P(=O)(C=C)N(C)C	{1: 4, 33: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	21777-84-4	CC(C)C(C1=CC=CC=C1)C(C)C	{1: 4, 3: 3, 14: 5}
Did not match all atoms present	21787-81-5	CC1=C(C=CC(=C1)Cl)NC=O	{1: 1, 26: 1, 31: 1, 14: 3, 17: 1}
Did not match all atoms present	21789-36-6	CC1=CC(=C(C=C1)C#N)C	{1: 2, 37: 1, 14: 3}
Did not match all atoms present	2179-16-0	CC(C1=CN=C2C(=N1)C(=O)N=C(N2)N)NC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O	{32: 1, 1: 1, 2: 2, 3: 2, 14: 5, 35: 3, 24: 1, 25: 1, 27: 2, 30: 1, 31: 2}
Did not match all atoms present	2179-25-1	CC1=CC(=CC(=C1S(=O)(=O)C)C)OC(=O)NC	{1: 4, 28: 1, 29: 2, 14: 2, 31: 1}
Did not match all atoms present	2179-79-5	C1=CC=C(C=C1)[Se]C#N	{37: 1, 14: 5}
Did not match all atoms present	2179-80-8	C[Se]C#N	{1: 1, 37: 1}
Did not match all atoms present	2179-89-7	C1CN(C(=C2N(CCN2C3=CC=CC=C3)C4=CC=CC=C4)N1C5=CC=CC=C5)C6=CC=CC=C6	{33: 4, 11: 4, 14: 20, 15: 2}
Did not match all atoms present	2179-92-2	CCCC[Sn](CCCC)(CCCC)C#N	{1: 3, 2: 9, 37: 1}
Did not match all atoms present	21792-52-9	C#CC1=CC=CC=C1C#C	{9: 2, 10: 2, 14: 4}
Did not match all atoms present	21797-13-7	[B-](F)(F)(F)F.[B-](F)(F)(F)F.CC#N.CC#N.CC#N.CC#N.[Pd+2]	{16: 8, 1: 4, 37: 4}
Did not match all atoms present	218-01-9	C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC=CC=C43	{14: 12}
Did not match all atoms present	218-02-0	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CN=C4	{35: 1, 14: 11}
Did not match all atoms present	218-08-6	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC=N4	{35: 1, 14: 11}
Did not match all atoms present	218-19-9	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3N=CC=C4	{35: 1, 14: 11}
Did not match all atoms present	2180-01-0	C(#N)[Se]C#N	{37: 2}
Did not match all atoms present	2180-30-5	C1=CC(=CC=C1C2=CC=C(C=C2)C(C(F)(F)F)(C(F)(F)F)O)C(C(F)(F)F)(C(F)(F)F)O	{16: 12, 20: 2, 4: 6, 14: 8}
Did not match all atoms present	2180-43-0	CCCC(CCC1=CC=CC=C1)O	{1: 1, 2: 4, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	2180-65-6	CC(C)CCC[Al](CCCC(C)C)CCCC(C)C	{1: 6, 2: 9, 3: 3}
Did not match all atoms present	2180-92-9	CCCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C	{1: 3, 2: 3, 33: 1, 11: 4, 12: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	21800-49-7	CC1=CCC(C(C1COC2=CC3=C(C=C2)C=CC(=O)O3)(C)CCC(=O)O)C(=C)C	{1: 3, 2: 3, 5: 1, 7: 1, 11: 1, 12: 2, 13: 1, 14: 6, 15: 1, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	21803-75-8	C1=CC(=C(C=C1C#N)Cl)N	{17: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	2181-04-6	CC12CCC(=O)C=C1C=CC3C2CCC4(C3CCC4(CCC(=O)[O-])O)C.[K+]	{1: 2, 2: 2, 11: 6, 12: 3, 13: 3, 14: 3, 15: 1, 20: 1, 24: 1, 25: 1}
Did not match all atoms present	2181-40-0	C1=CC=C(C=C1)[Ge](C2=CC=CC=C2)(C3=CC=CC=C3)O[Ge](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{22: 1, 14: 30}
Did not match all atoms present	2181-42-2	C[S+](C)C.[I-]	{1: 3, 19: 1}
Did not match all atoms present	2181-97-7	COC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{1: 1, 2: 1, 28: 1, 14: 15, 17: 1}
Did not match all atoms present	21811-92-7	CC(=O)C(C(=O)NC1=CC=CC=C1)NN=C2C=C(C=CC2=O)S(=O)(=O)N	{1: 1, 34: 1, 3: 1, 14: 8, 15: 2, 24: 2, 25: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	21811-94-9	CC(=O)C(C(=O)NC1=CC=CC=C1)N/N=C\2/C=C(C=CC2=O)S(=O)(=O)NC	{1: 2, 34: 1, 3: 1, 14: 8, 15: 2, 24: 2, 25: 1, 29: 2, 31: 3}
Did not match all atoms present	21812-61-3	C1=CC=C(C=C1)C2=C(N3C=CC=CC3=C2)C4=CC=CC=C4	{33: 1, 14: 15}
Did not match all atoms present	21813-99-0	CCCCC1=CN=C(C=C1)C(=O)[O-].CCCCC1=CN=C(C=C1)C(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 6, 35: 2, 14: 6}
Did not match all atoms present	21815-91-8	C1=CC=C2C(=C1)C(=C(S2)C(=O)Cl)Cl	{24: 1, 17: 2, 14: 4, 41: 1}
Did not match all atoms present	21816-42-2	CC1=[N+](C=C(C(=C1)[N+](=O)[O-])C)[O-]	{1: 2, 38: 1, 29: 1, 14: 2, 33: 1}
Did not match all atoms present	2182-66-3	CC(=O)O[Si](C)(C)OC(=O)C	{1: 4, 28: 2}
Did not match all atoms present	21820-82-6	CN1CC(OC1=O)CCN2CCC(=CC2)C3=CC=CC=C3	{1: 1, 2: 2, 33: 2, 11: 4, 12: 1, 14: 6, 15: 1, 28: 1}
Did not match all atoms present	218276-54-1	C1=CC=C(C=C1)/C=C/C=C/C2=CC=C(C=C2)N(C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=C(C=C5)/C=C/C=C/C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8	{33: 2, 14: 36, 6: 8}
Did not match all atoms present	21829-25-4	CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC	{32: 1, 1: 4, 38: 1, 12: 1, 14: 4, 15: 4, 28: 2}
Did not match all atoms present	21834-92-4	CC(C)CC=C(C=O)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 6: 1, 7: 1, 14: 5, 26: 1}
Did not match all atoms present	21835-55-2	CC1=CC=C(C=C1)S(=O)(=O)O.C(=O)(N)N	{1: 1, 14: 4, 20: 1, 24: 1, 29: 2, 30: 2}
Did not match all atoms present	21847-06-3	[SH-].[GeH3]	{}
Did not match all atoms present	21848-62-4	COC1=C(C2=C3[C@H](CC4=CC(=C(C=C42)OC)OC)NCCC3=C1)OC	{32: 1, 1: 4, 11: 3, 12: 1, 14: 3, 22: 4}
Did not match all atoms present	2185-78-6	C[Sb+](C)(C)C.[I-]	{1: 4, 19: 1}
Did not match all atoms present	2185-86-6	CC[NH+]=C1C=CC(=C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C4=CC=CC=C14.[Cl-]	{1: 5, 2: 1, 33: 2, 7: 1, 14: 14, 15: 2, 17: 1, 31: 1}
Did not match all atoms present	2185-92-4	C1=CC=C(C=C1)C2=CC=CC=C2N.Cl	{17: 1, 30: 1, 14: 9}
Did not match all atoms present	2185-98-0	C1=CC=C(C(=C1)CC(C(=O)O)[NH3+])C[NH+](CCCl)CCCl.[Cl-].[Cl-]	{27: 1, 17: 4, 2: 6, 3: 1, 14: 4}
Did not match all atoms present	21850-44-2	CC(C)(C1=CC(=C(C(=C1)Br)OCC(CBr)Br)Br)C2=CC(=C(C(=C2)Br)OCC(CBr)Br)Br	{1: 2, 2: 4, 3: 2, 4: 1, 14: 4, 18: 8, 22: 2}
Did not match all atoms present	21854-95-5	C1=CC=C(C(=C1)C(=O)C(=O)C2=CC=CC=C2Cl)Cl	{24: 2, 17: 2, 14: 8}
Did not match all atoms present	2186-24-5	CC1=CC=C(C=C1)OCC2CO2	{1: 1, 2: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	2186-92-7	COC1=CC=C(C=C1)C(OC)OC	{1: 3, 3: 1, 22: 3, 14: 4}
Did not match all atoms present	21860-84-4	CC(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O	{1: 1, 3: 1, 33: 1, 14: 4, 25: 2, 27: 1}
Did not match all atoms present	21872-33-3	C[C@H](C1=CC=CC=C1)[N+]#[C-]	{1: 1, 34: 1, 3: 1, 14: 5}
Did not match all atoms present	2188-67-2	CCCCCNCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 6, 14: 4, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	21884-44-6	CC1=CC(=C2C(=C1O)C(=O)C34C5C6C(C3C(=O)C7=C(C8=C(C=C(C(=C8C(=O)C67C(C5O)C(=O)C4=C2O)O)C)O)O)O)O	{1: 2, 12: 6, 13: 2, 14: 2, 15: 4, 20: 4, 21: 4, 25: 4}
Did not match all atoms present	21888-96-0	C1C[NH+](CCC1[C@@]2(CCC(=O)NC2=O)C3=CC=CC=C3)CC4=CC=CC=C4.[Cl-]	{32: 1, 2: 1, 11: 6, 12: 1, 13: 1, 14: 10, 17: 1, 25: 2}
Did not match all atoms present	21889-25-8	CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC(=CC=C4)Cl)/C2=O	{1: 1, 34: 1, 14: 13, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	21889-27-0	COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC(=CC=C4)Cl)/C2=O	{1: 1, 34: 1, 14: 13, 15: 2, 17: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	21889-28-1	CC1=C(C=C(C=C1)Cl)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4OC	{1: 2, 34: 1, 14: 12, 15: 2, 17: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	2189-60-8	CCCCCCCCC1=CC=CC=C1	{1: 1, 2: 7, 14: 5}
Did not match all atoms present	21892-80-8	CN1C2=CC=CC=C2OC1=O	{1: 1, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	21892-95-5	C1C2CC3C1C3C2OC=O	{26: 1, 11: 2, 12: 5}
Did not match all atoms present	21894-02-0	CC1=CC(=CC(=C1O)C)S(=O)(=O)O	{1: 2, 20: 1, 21: 1, 14: 2, 29: 2}
Did not match all atoms present	21894-06-4	C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)O)OC3=CC=C(C=C3)[N+](=O)[O-]	{38: 1, 22: 1, 27: 1, 21: 1, 14: 9}
Did not match all atoms present	21895-13-6	CC1=CC(=CC=C1)CC2=CC=CC=C2C	{1: 2, 2: 1, 14: 8}
Did not match all atoms present	21895-16-9	CC1=CC=C(C=C1)CC2=CC=CC(=C2)C	{1: 2, 2: 1, 14: 8}
Did not match all atoms present	21898-19-1	CC(C)(C)NCC(C1=CC(=C(C(=C1)Cl)N)Cl)O.Cl	{1: 3, 2: 1, 3: 1, 4: 1, 14: 2, 17: 3, 20: 1, 30: 1, 31: 1}
Did not match all atoms present	21898-53-3	CCOC(=O)C1=C(C(=C(N1)C)C(=O)C(=O)OCC)C	{24: 1, 1: 4, 2: 2, 28: 2, 32: 1}
Did not match all atoms present	219-08-9	C1C=CC2=C1C=CC3=C2C=CC4=CC=CC=C43	{11: 1, 14: 10}
Did not match all atoms present	219-25-0	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CS4	{41: 1, 14: 10}
Did not match all atoms present	2190-04-7	CCCCCCCCCCCCCCCCCC[NH3+].CC(=O)[O-]	{24: 1, 1: 2, 2: 17}
Did not match all atoms present	2190-64-9	COC1=CC2=C(C=C1)NC3=CC4=C(C=C3C2=O)NC5=C(C4=O)C=C(C=C5)OC	{32: 2, 1: 2, 22: 2, 14: 8, 25: 2}
Did not match all atoms present	2190-96-7	CCCCCCCCCCCCCCP(=O)(C)C	{1: 3, 2: 13, 29: 1}
Did not match all atoms present	2190-97-8	CCCCCCCCCCCCCCCCP(=O)(C)C	{1: 3, 2: 15, 29: 1}
Did not match all atoms present	21900-42-5	CC1=CC(=C(C=C1)C(=O)Cl)C	{24: 1, 1: 2, 14: 3, 17: 1}
Did not match all atoms present	21901-18-8	CC1=C(C(=O)NC=C1)[N+](=O)[O-]	{32: 1, 1: 1, 38: 1, 14: 2, 25: 1}
Did not match all atoms present	21901-29-1	CC1=NC(=C(C=C1)[N+](=O)[O-])N	{38: 1, 1: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	21901-34-8	CC1=CC(=CNC1=O)[N+](=O)[O-]	{32: 1, 1: 1, 38: 1, 14: 2, 25: 1}
Did not match all atoms present	21901-40-6	CC1=CC(=NC=C1[N+](=O)[O-])N	{38: 1, 1: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	21901-41-7	CC1=CC(=O)NC=C1[N+](=O)[O-]	{32: 1, 1: 1, 38: 1, 14: 2, 25: 1}
Did not match all atoms present	21905-27-1	C=CC[As](=O)(C1=CC=CC=C1)O	{2: 1, 5: 1, 6: 1, 14: 5, 20: 1, 29: 1}
Did not match all atoms present	21905-32-8	C1=CC=C(C=C1)[As](=O)(CCCO)O	{2: 3, 20: 2, 29: 1, 14: 5}
Did not match all atoms present	21905-40-8	C1=CC=C(C=C1)C(C[As](=O)(C2=CC=CC(=C2)Cl)O)O	{2: 1, 3: 1, 14: 9, 17: 1, 20: 2, 29: 1}
Did not match all atoms present	21905-60-2	COC1=CC=CC=C1OC2=CC=CC=C2O	{1: 1, 22: 2, 21: 1, 14: 8}
Did not match all atoms present	21906-31-0	CC(=O)CC1=CC=CC=C1Br	{24: 1, 1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	21906-32-1	CC(=O)CC1=CC(=CC=C1)Br	{24: 1, 1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	21906-39-8	CC(=O)CC1=CC(=CC=C1)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	21907-50-6	C(=O)(C(F)(F)F)[O-].[Cs+]	{16: 3, 24: 1, 4: 1}
Did not match all atoms present	21907-59-5	C[Ge](C)(C)C(F)(F)F	{16: 3, 1: 3, 4: 1}
Did not match all atoms present	21908-53-2	O=[Hg]	{29: 1}
Did not match all atoms present	21915-53-7	C1=CC=C(C=C1)C2C(O2)CO	{20: 1, 2: 1, 12: 2, 14: 5, 23: 1}
Did not match all atoms present	2192-20-3	C1CN(CCN1CCOCCO)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl.Cl	{33: 2, 2: 4, 3: 1, 11: 4, 14: 9, 17: 3, 20: 1, 22: 1}
Did not match all atoms present	2192-21-4	CCN(CC)CCOC1=CC=CC=C1C(=O)CCC2=CC=CC=C2.Cl	{1: 2, 2: 6, 33: 1, 14: 9, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	2192-55-4	C(COC1=C(C(=C(C(=C1F)F)F)F)F)O	{16: 5, 2: 2, 20: 1, 22: 1}
Did not match all atoms present	21923-23-9	CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)SC)Cl	{1: 3, 2: 2, 40: 1, 14: 2, 17: 2, 22: 3}
Did not match all atoms present	21928-50-7	C1CNCCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O	{32: 1, 4: 1, 11: 4, 13: 1, 14: 3, 16: 3, 17: 1, 20: 1}
Did not match all atoms present	2193-38-6	CC(C)C1=CC(=CC=C1)F	{16: 1, 1: 2, 3: 1, 14: 4}
Did not match all atoms present	21934-68-9	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(C=C(C=C5O2)C)C	{1: 4, 2: 2, 33: 1, 13: 1, 14: 9, 23: 1, 28: 1}
Did not match all atoms present	21948-70-9	CSC1=NC=CN=C1	{40: 1, 1: 1, 35: 2, 14: 3}
Did not match all atoms present	21951-32-6	C1=CC2=C(C=C1S(=O)(=O)O)SC(=N2)N	{35: 1, 41: 1, 14: 3, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	21951-33-7	C1=CC(=CC=C1N2C(=O)C=C(N2)C(=O)O)S(=O)(=O)O	{32: 1, 33: 1, 14: 5, 20: 1, 25: 1, 27: 1, 29: 2}
Did not match all atoms present	21951-34-8	CC1=NN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)CCO	{1: 1, 2: 2, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	219539-04-5	CC(=O)C(=NNC1=CC(=CC(=C1O)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)NC2=CC=CC=C2.CC(=O)C(=NNC1=CC(=CC(=C1O)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)NC2=CC=CC=C2.[Na+].[Na+].[Na+].[Na+].[K+].[Cr]	{1: 2, 34: 2, 7: 2, 14: 14, 21: 2, 24: 4, 29: 12, 31: 4}
Did not match all atoms present	21956-56-9	COC1=CC(=CC(=C1)C=CC2=CC=CC=C2)OC	{1: 2, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	21959-01-3	C1CCOC1.C1CCOC1.Cl[Zr](Cl)(Cl)Cl	{17: 4, 11: 8, 23: 2}
Did not match all atoms present	21959-05-7	C1CCOC1.C1CCOC1.Cl[Hf](Cl)(Cl)Cl	{17: 4, 11: 8, 23: 2}
Did not match all atoms present	2196-13-6	C1=CN=CC=C1C(=S)N	{35: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	2196-99-8	COC1=CC=C(C=C1)C(=O)CCl	{1: 1, 2: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	21961-08-0	CCCCCCS(=O)(=O)C=C	{1: 1, 2: 5, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	21961-30-8	C1=C(C=C(C=C1N)Cl)C(=O)O	{17: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	21969-11-9	C1=CC(=CC=C1[N+](=O)[O-])SC2=CC=C(C=C2)Cl	{40: 1, 17: 1, 38: 1, 14: 8}
Did not match all atoms present	2197-01-5	CCN\1C2=CC=CC=C2S/C1=C/C3=[N+](C4=CC=CC=C4S3)CC.[I-]	{1: 2, 2: 2, 6: 1, 33: 2, 41: 2, 14: 8, 15: 1, 19: 1}
Did not match all atoms present	2197-57-1	CC1=C(C(=O)C2=CC=CC=C2C1=O)C	{1: 2, 25: 2, 14: 4, 15: 2}
Did not match all atoms present	2197-63-9	CCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCC	{1: 2, 2: 30, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	21970-53-6	CN(C)C1=CC=C(C=C1)C=CC2=CC=NC3=CC=CC=C23.Cl	{1: 2, 35: 1, 6: 2, 33: 1, 14: 10, 17: 1}
Did not match all atoms present	21978-61-0	C1=CC=C(C=C1)C=NN2N=C3C=CC=CC3=N2	{33: 1, 34: 1, 35: 2, 14: 9, 6: 1}
Did not match all atoms present	2198-51-8	C1=CC(=CC=C1N(CCO)CCO)O	{33: 1, 2: 4, 20: 2, 21: 1, 14: 4}
Did not match all atoms present	2198-53-0	CC1=C(C(=CC=C1)C)NC(=O)C	{24: 1, 1: 3, 14: 3, 31: 1}
Did not match all atoms present	2198-54-1	CC1=C(C=C(C=C1)NC(=O)C)C	{24: 1, 1: 3, 14: 3, 31: 1}
Did not match all atoms present	2198-58-5	CCN(CC)C1=CC=C(C=C1)N.Cl	{1: 2, 2: 2, 33: 1, 14: 4, 17: 1, 30: 1}
Did not match all atoms present	2198-66-5	CC(C)(C)C1=CC(=C(C=C1)O)Br	{1: 3, 18: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	2198-75-6	C1=CC=C2C(=C1)C=C(C=C2Cl)Cl	{17: 2, 14: 6}
Did not match all atoms present	2198-77-8	C1=CC(=CC2=C1C=CC(=C2)Cl)Cl	{17: 2, 14: 6}
Did not match all atoms present	21984-93-0	CC1=CC(=CO1)C(=O)O	{1: 1, 27: 1, 14: 2, 23: 1}
Did not match all atoms present	21985-87-5	C1(=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N	{38: 5, 30: 1}
Did not match all atoms present	21986-78-7	CCCCCCCCOC(=O)CCS[Sn](CCCC)(CCCC)SCCC(=O)O[Sn](CCCC)(CCCC)OCCCCCCCC	{40: 2, 1: 6, 2: 30, 28: 2, 22: 1}
Did not match all atoms present	21987-62-2	C1=C(C=C(C(=C1Br)O)C2=CC(=CC(=C2O)Br)Br)Br	{18: 4, 21: 2, 14: 4}
Did not match all atoms present	21988-58-9	CCOP(=O)(NCCSP(=O)(N1CCOCC1)OC)OCC	{1: 3, 2: 4, 33: 1, 40: 1, 11: 4, 22: 3, 23: 1, 29: 2, 31: 1}
Did not match all atoms present	2199-41-9	CC1=CC(=C(N1)C)C	{32: 1, 1: 3, 14: 1}
Did not match all atoms present	2199-44-2	CCOC(=O)C1=C(C=C(N1)C)C	{32: 1, 1: 3, 2: 1, 28: 1, 14: 1}
Did not match all atoms present	2199-45-3	CCOC(=O)C1=CC(=C(N1)C)C	{32: 1, 1: 3, 2: 1, 28: 1, 14: 1}
Did not match all atoms present	2199-46-4	CCOC(=O)C1=C(C(=C(N1)C)C)C	{32: 1, 1: 4, 2: 1, 28: 1}
Did not match all atoms present	2199-47-5	CCC1=C(NC(=C1C)C(=O)OCC)C	{32: 1, 1: 4, 2: 2, 28: 1}
Did not match all atoms present	2199-51-1	CCOC(=O)C1=C(NC=C1C)C	{32: 1, 1: 3, 2: 1, 28: 1, 14: 1}
Did not match all atoms present	2199-52-2	CCOC(=O)C1=C(NC(=C1)C)C	{32: 1, 1: 3, 2: 1, 28: 1, 14: 1}
Did not match all atoms present	2199-53-3	CCOC(=O)C1=CNC(=C1C)C	{32: 1, 1: 3, 2: 1, 28: 1, 14: 1}
Did not match all atoms present	2199-54-4	CCOC(=O)C1=C(NC(=C1C)C)C	{32: 1, 1: 4, 2: 1, 28: 1}
Did not match all atoms present	2199-59-9	CCOC(=O)C1=C(NC(=C1C)C=O)C	{32: 1, 1: 3, 2: 1, 28: 1, 26: 1}
Did not match all atoms present	2199-64-6	CCOC(=O)C1=C(C(=C(N1)C)C=O)C	{32: 1, 1: 3, 2: 1, 28: 1, 26: 1}
Did not match all atoms present	2199-69-1	[2H]C1=C(C(=C(C(=C1[2H])Cl)Cl)[2H])[2H]	{17: 2, 14: 4}
Did not match all atoms present	2199-93-1	CC(=O)C1=CC2=C(C=CC(=C2)Br)OC1=O	{24: 1, 1: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	219905-91-6	CCCCCCCCCC(=O)NC(CCC(=O)N(CCNC(=O)C1=C(OC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC=CC=C4)C(=O)O	{1: 1, 2: 13, 3: 1, 33: 1, 14: 15, 35: 1, 23: 1, 24: 3, 27: 1, 31: 2}
Did not match all atoms present	21992-92-7	CN(C)[P+](N(C)C)(N(C)C)[Se]C.[I-]	{1: 7, 19: 1, 33: 3}
Did not match all atoms present	219946-99-3	OO.[Al+3]	{20: 2}
Did not match all atoms present	219959-86-1	C1=CC=C2C(=C1)C3=C(N2C4=CC=C(C=C4)N)C=NC=C3	{33: 1, 35: 1, 30: 1, 14: 11}
Did not match all atoms present	220-42-8	C1=CC=C2C3C4=CC=CC=C4C(C2=C1)OO3	{12: 2, 14: 8, 23: 2}
Did not match all atoms present	220-77-9	C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC5=C(C=CC6=CC=CC=C65)C=C43	{14: 16}
Did not match all atoms present	220-82-6	C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC5=CC6=CC=CC=C6C=C5C=C43	{14: 16}
Did not match all atoms present	2200-44-4	CC1=C(ON=C1C)[N-]S(=O)(=O)C2=CC=C(C=C2)N.[Na+]	{1: 2, 34: 1, 35: 1, 14: 4, 23: 1, 29: 2, 30: 1}
Did not match all atoms present	2200-71-7	COC1=C(C(=C(C(=C1F)F)C2=C(C(=C(C(=C2F)F)OC)F)F)F)F	{16: 8, 1: 2, 22: 2}
Did not match all atoms present	22002-44-4	CC1=CC(=C(C=C1)OC)Cl	{1: 2, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	22002-45-5	CC1=CC(=C(C=C1)OC)Br	{1: 2, 18: 1, 22: 1, 14: 3}
Did not match all atoms present	22006-17-3	CC1=CC=CC=C1N.Cl.Cl	{1: 1, 30: 1, 14: 4, 17: 2}
Did not match all atoms present	2201-15-2	CCNC1(CCCCC1)C2=CC=CC=C2	{1: 1, 2: 1, 11: 5, 13: 1, 14: 5, 31: 1}
Did not match all atoms present	2201-17-4	CN(C)C1(CCCCC1)C2=CC=CC=C2	{1: 2, 11: 5, 13: 1, 14: 5, 33: 1}
Did not match all atoms present	2201-23-2	C1CCC(CC1)(C#N)C2=CC=CC=C2	{11: 5, 13: 1, 14: 5, 37: 1}
Did not match all atoms present	22013-33-8	C1COC2=C(O1)C=CC(=C2)N	{11: 2, 30: 1, 14: 3, 23: 2}
Did not match all atoms present	22016-03-1	CC(=O)CC(=O)NC1=CC(=CC=C1)O	{1: 1, 2: 1, 14: 4, 21: 1, 24: 2, 31: 1}
Did not match all atoms present	22019-64-3	CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 33: 1, 14: 13, 29: 2}
Did not match all atoms present	2202-98-4	C1=CC=C(C(=C1)C(=O)O)C(=O)OCCOCCO	{2: 4, 14: 4, 20: 1, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	22025-87-2	CC(C)(C)C1=CC=CC=C1N(C)C	{1: 5, 4: 1, 14: 4, 33: 1}
Did not match all atoms present	22026-39-7	C1OC2=C(O1)C=C(C=C2)C(=O)NN	{11: 1, 14: 3, 23: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	22027-50-5	COC1=CC=C(C=C1)C(=O)CC(=O)OC	{1: 2, 2: 1, 14: 4, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	22029-36-3	C(CN)N.OS(=O)(=O)O	{2: 2, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	2203-01-2	CCN(CCN1C(=O)C2=CC=CC=C2C1=O)C3=CC(=C(C=C3)N=NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C)C	{1: 3, 2: 3, 35: 1, 33: 2, 41: 1, 34: 2, 14: 10, 25: 2, 29: 2}
Did not match all atoms present	22031-12-5	CC(CP(C1=CC=CC=C1)C2=CC=CC=C2)(CP(C3=CC=CC=C3)C4=CC=CC=C4)CP(C5=CC=CC=C5)C6=CC=CC=C6	{1: 1, 2: 3, 4: 1, 14: 30}
Did not match all atoms present	22031-17-0	C(O)[P+](CO)(CO)CO.C(O)[P+](CO)(CO)CO.C(O)[P+](CO)(CO)CO.[O-]P(=O)([O-])[O-]	{2: 12, 20: 12, 29: 4}
Did not match all atoms present	22031-33-0	CC(=O)OCCN(CCC#N)C1=CC=CC=C1	{1: 1, 2: 4, 37: 1, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	22037-28-1	C1=COC=C1Br	{18: 1, 14: 3, 23: 1}
Did not match all atoms present	22040-99-9	CCOC(=O)CCC[N+](C)(C)C.[I-]	{1: 4, 2: 4, 19: 1, 28: 1}
Did not match all atoms present	22041-26-5	C[N+](C)(C)CC(=O)OC.[I-]	{1: 4, 2: 1, 19: 1, 28: 1}
Did not match all atoms present	22041-33-4	CC[N+](C)(C)CCC(=O)OCC.[I-]	{1: 4, 2: 4, 19: 1, 28: 1}
Did not match all atoms present	22041-34-5	CC[N+](C)(CC)CCC(=O)OCC.[I-]	{1: 4, 2: 5, 19: 1, 28: 1}
Did not match all atoms present	22042-71-3	C1=CC(=CC=C1C=O)OCC(=O)O	{27: 1, 2: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	22042-73-5	C1=CC(=CC=C1C=O)OCCO	{2: 2, 26: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	22042-79-1	CC1=C(C(=NN1C2=CC=CC=C2)C)C=O	{1: 2, 26: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	22042-96-2	C(CN(CP(=O)(O)O)CP(=O)(O)O)N(CCN(CP(=O)(O)O)CP(=O)(O)[O-])CP(=O)(O)O.[Na+]	{33: 3, 2: 9, 20: 9, 29: 6}
Did not match all atoms present	22047-25-2	CC(=O)C1=NC=CN=C1	{24: 1, 1: 1, 35: 2, 14: 3}
Did not match all atoms present	22047-26-3	CC1=NC(=CN=C1)C(=O)C	{24: 1, 1: 2, 35: 2, 14: 2}
Did not match all atoms present	22047-27-4	CC1=NC=C(N=C1)C(=O)C	{24: 1, 1: 2, 35: 2, 14: 2}
Did not match all atoms present	22047-88-7	C1=CC=C(C=C1)COC2=CC=CC=C2CC(=O)O	{2: 2, 27: 1, 22: 1, 14: 9}
Did not match all atoms present	220497-47-2	C1=CC=C(C(=C1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)Br	{2: 2, 3: 1, 12: 1, 14: 12, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-48-3	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC(=CC=C4)Br)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-50-7	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=C(S4)Br)C(=O)[O-]	{2: 2, 3: 1, 41: 1, 12: 1, 14: 10, 18: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-60-9	C=C(C[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)Br	{2: 2, 3: 1, 5: 1, 7: 1, 12: 1, 14: 8, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-64-3	C1[C@@H](C=C[C@@H]1NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O	{2: 1, 11: 1, 12: 3, 14: 10, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-65-4	C1[C@H](C=C[C@H]1NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O	{2: 1, 11: 1, 12: 3, 14: 10, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-66-5	C1C[C@H](C[C@H]1C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 1, 11: 3, 12: 3, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-67-6	C1C[C@@H](C[C@@H]1C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 1, 11: 3, 12: 3, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-68-7	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC(=O)O)C4=CC=C(C=C4)Br	{2: 2, 3: 1, 12: 1, 14: 12, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-75-6	COC(=O)[C@@H](CC1=CC2=CC=CC=C2C=C1)CC(=O)[O-]	{1: 1, 2: 2, 3: 1, 14: 7, 24: 1, 28: 1}
Did not match all atoms present	220497-79-0	C1=CC=C(C(=C1)C[C@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)Br	{2: 2, 3: 1, 12: 1, 14: 12, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-81-4	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC(=CC=C4)Br)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 12, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-83-6	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=C(S4)Br)C(=O)O	{2: 2, 3: 1, 41: 1, 12: 1, 14: 10, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-85-8	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=CO4)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 11, 23: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-88-1	C1[C@H]([C@@H]([C@@H]([C@H]1[NH3+])O)O)CO	{20: 3, 2: 1, 11: 1, 12: 4}
Did not match all atoms present	220497-90-5	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CSC=C4)C(=O)[O-]	{2: 2, 3: 1, 41: 1, 12: 1, 14: 11, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-92-7	C=C(C[C@H](C(=O)[O-])NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)Br	{2: 2, 3: 1, 5: 1, 7: 1, 12: 1, 14: 8, 18: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-94-9	CC1(O[C@H]2[C@@H](C[C@@H]([C@H]2O1)NC(=O)OC(C)(C)C)C(=O)[O-])C	{1: 5, 4: 1, 11: 1, 12: 4, 13: 1, 23: 2, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	220497-98-3	C#CC[C@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{2: 2, 3: 1, 9: 1, 10: 1, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220498-02-2	C1=CC=C(C=C1)[C@@H](CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 2, 3: 1, 12: 1, 14: 13, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	220498-04-4	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC(=O)[O-])C4=CC=C(C=C4)Br	{2: 2, 3: 1, 12: 1, 14: 12, 18: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	22052-01-3	CC(=O)ON1C2=C(C(=O)NC1=O)NC=N2	{32: 2, 1: 1, 35: 1, 33: 1, 14: 1, 25: 2, 28: 1}
Did not match all atoms present	22053-74-3	CC1=C(SC2=CC=CC=C12)C=O	{1: 1, 26: 1, 14: 4, 41: 1}
Did not match all atoms present	22056-53-7	CC1=C(C2=C(N1)CCC2)C(=O)C	{24: 1, 1: 2, 11: 3, 32: 1}
Did not match all atoms present	22059-60-5	CC(C)N(CCC(C1=CC=CC=C1)(C2=CC=CC=N2)C(=O)N)C(C)C.OP(=O)(O)O	{1: 4, 2: 2, 3: 2, 4: 1, 33: 1, 14: 9, 35: 1, 20: 3, 24: 1, 29: 1, 30: 1}
Did not match all atoms present	2206-26-0	[2H]C([2H])([2H])C#N	{1: 1, 37: 1}
Did not match all atoms present	2206-38-4	C1CCC(CC1)OC2=CC=CC=C2	{11: 5, 12: 1, 22: 1, 14: 5}
Did not match all atoms present	2206-48-6	COC1=CC=CC=C1C2CCCCC2	{1: 1, 11: 5, 12: 1, 22: 1, 14: 4}
Did not match all atoms present	2206-94-2	CC(=O)OC(=C)C1=CC=CC=C1	{1: 1, 28: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	2207-41-2	CCN1C2=CC=CC=C2C(=O)C3=CC=CC=C31	{1: 1, 2: 1, 33: 1, 14: 8, 25: 1}
Did not match all atoms present	2207-50-3	C1C(OC(=N1)N)C2=CC=CC=C2	{35: 1, 11: 1, 12: 1, 14: 5, 15: 1, 23: 1, 30: 1}
Did not match all atoms present	2207-68-3	C1=CC(=CC=C1C(C(CO)O)O)[N+](=O)[O-]	{2: 1, 3: 2, 20: 3, 38: 1, 14: 4}
Did not match all atoms present	2207-69-4	CC(C)[C@@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O.CS(=O)(=O)O	{32: 1, 1: 6, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	2207-75-2	C1(=NC(=O)NC(=O)N1)C(=O)[O-].[K+]	{24: 1, 25: 2, 35: 1, 32: 2}
Did not match all atoms present	22071-15-4	CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)O	{24: 1, 1: 1, 3: 1, 14: 9, 27: 1}
Did not match all atoms present	22072-35-1	CC1=CC2=C(C=C1)C(=C(N2)C)C	{32: 1, 1: 3, 14: 3}
Did not match all atoms present	2208-05-1	CN(C)CCOC(=O)C1=CC=CC=C1	{1: 2, 2: 2, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	2208-20-0	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])O	{24: 1, 38: 1, 21: 1, 14: 10, 31: 1}
Did not match all atoms present	2208-25-5	C1=C(C=C(C2=NNN=C21)F)F	{16: 2, 32: 1, 35: 2, 14: 2}
Did not match all atoms present	22082-71-9	CN1CCOP1Cl	{23: 1, 1: 1, 11: 2, 33: 1, 17: 1}
Did not match all atoms present	22083-74-5	CN1CCCC1C2=CN=CC=C2	{1: 1, 35: 1, 33: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	22084-89-5	CC1=CC=CC=C1CCC(=O)O	{1: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	22086-53-9	B(CCC)(CCC)Cl	{1: 2, 2: 4, 17: 1}
Did not match all atoms present	22089-22-1	C1CN(P(=O)(OC1)N(CCCl)CCCl)CCCl	{33: 2, 2: 6, 11: 3, 17: 3, 23: 1, 29: 1}
Did not match all atoms present	2209-36-1	C1CCC2=[N+](ON=C2C1)[O-]	{33: 1, 11: 4, 35: 1, 23: 1}
Did not match all atoms present	2209-72-5	CC1=NC(=O)C(=C(N1)N)N=O	{32: 1, 1: 1, 34: 1, 35: 1, 25: 1, 29: 1, 30: 1}
Did not match all atoms present	22091-92-5	CCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(N(C6=CC=CC=C65)CC)C)C	{1: 4, 2: 2, 33: 2, 13: 1, 14: 12, 28: 1}
Did not match all atoms present	22095-62-1	B(F)(F)I	{16: 2, 19: 1}
Did not match all atoms present	22095-63-2	B(F)(I)I	{16: 1, 19: 2}
Did not match all atoms present	22095-64-3	B(F)(Cl)I	{16: 1, 17: 1, 19: 1}
Did not match all atoms present	22095-96-1	[H+].[H+].[H+].CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N\NC3=CC(=C(C=C3O)S(=O)(=O)CCOS(=O)(=O)O)OC)/C2=O)S(=O)(=O)O.[Cu]	{1: 2, 2: 2, 34: 1, 14: 5, 15: 2, 20: 3, 21: 1, 22: 2, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	2210-34-6	[2H]C#C	{9: 2}
Did not match all atoms present	2210-63-1	CCCCC1C(=O)NN(C1=O)C2=CC=CC=C2	{32: 1, 1: 1, 2: 3, 33: 1, 12: 1, 14: 5, 25: 2}
Did not match all atoms present	2210-77-7	CC1=C(C(=CC=C1)C)NC(=O)CN2CCCC2	{1: 2, 2: 1, 33: 1, 11: 4, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	2210-79-9	CC1=CC=CC=C1OCC2CO2	{1: 1, 2: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	22103-05-5	C/C=C/SC1=CC=CC=C1	{40: 1, 1: 1, 14: 5, 6: 2}
Did not match all atoms present	221037-98-5	B(C1=CC(=CC=C1)I)(O)O	{19: 1, 20: 2, 14: 4}
Did not match all atoms present	22108-55-0	C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C=CS4	{41: 1, 14: 10}
Did not match all atoms present	2211-66-7	C1CCC(CC1)N=CC2=CC=CC=C2	{34: 1, 11: 5, 12: 1, 14: 5, 6: 1}
Did not match all atoms present	2211-89-4	CC(C)S(=O)C(C)C	{1: 4, 3: 2, 29: 1}
Did not match all atoms present	2211-92-9	CC(C)(C)S(=O)C(C)(C)C	{1: 6, 4: 2, 29: 1}
Did not match all atoms present	2211-94-1	COC1=CC=C(C=C1)OCC2CO2	{1: 1, 2: 1, 11: 1, 12: 1, 14: 4, 22: 2, 23: 1}
Did not match all atoms present	2211-99-6	CCCCCCCCCCC(C)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 9, 3: 1, 29: 3, 14: 4}
Did not match all atoms present	22110-53-8	[C-]#[N+]C12CC3CC(C1)CC(C3)C2	{34: 1, 11: 6, 12: 3, 13: 1}
Did not match all atoms present	22112-78-3	COC1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)OC)C8=CC=C(C=C8)OC)C9=CC=C(C=C9)OC)N3	{32: 2, 1: 4, 35: 2, 22: 4, 14: 24}
Did not match all atoms present	22113-86-6	CCN.[N+](=O)(O)[O-]	{1: 1, 2: 1, 20: 1, 30: 1}
Did not match all atoms present	22113-87-7	CN.[N+](=O)(O)[O-]	{1: 1, 20: 1, 30: 1}
Did not match all atoms present	22115-41-9	C1=CC=C(C(=C1)CBr)C#N	{2: 1, 18: 1, 14: 4, 37: 1}
Did not match all atoms present	22117-79-9	COC1=C(C=C(C=C1)S(=O)(=O)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 17: 1, 22: 1, 29: 2}
Did not match all atoms present	2212-05-7	C1C(O1)COC2=CC=C(C=C2)Cl	{2: 1, 11: 1, 12: 1, 14: 4, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	2212-06-8	C1C(O1)COC2=CC=C(C=C2)Br	{2: 1, 11: 1, 12: 1, 14: 4, 18: 1, 22: 1, 23: 1}
Did not match all atoms present	2212-07-9	C1C(O1)COC2=C(C=C(C=C2)Cl)Cl	{2: 1, 11: 1, 12: 1, 14: 3, 17: 2, 22: 1, 23: 1}
Did not match all atoms present	2212-10-4	CCO[Si](C)(CCl)OCC	{1: 3, 2: 3, 22: 2, 17: 1}
Did not match all atoms present	2212-17-1	CN(C)C(=S)NC1=CC=C(C=C1)Cl	{1: 2, 33: 1, 7: 1, 14: 4, 17: 1, 31: 1}
Did not match all atoms present	2212-75-1	C1=CC=C(C=C1)COC(=O)N[C@@H](CCCCN)C(=O)O	{2: 5, 3: 1, 14: 5, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	2212-81-9	CC(C)(C)OOC(C)(C)C1=CC(=CC=C1)C(C)(C)OOC(C)(C)C	{1: 10, 4: 4, 22: 4, 14: 4}
Did not match all atoms present	22120-39-4	CC1=CC2=C(C=C1)NC=C2CCN(C)C	{32: 1, 1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	22123-15-5	C1=CSC(=C1)C2=NC(=CC(=C2)C(F)(F)F)Cl	{35: 1, 4: 1, 41: 1, 14: 5, 16: 3, 17: 1}
Did not match all atoms present	22123-27-9	CCOC1=CC=C(C=C1)[NH2+]CCN(C)C.[Cl-]	{1: 3, 2: 3, 33: 1, 14: 4, 17: 1, 22: 1}
Did not match all atoms present	2213-63-0	C1=CC=C2C(=C1)N=C(C(=N2)Cl)Cl	{17: 2, 35: 2, 14: 4}
Did not match all atoms present	2213-68-5	CC1=CC(=C(C(=C1)O)O)C(C)(C)CC(C)(C)C	{1: 6, 2: 1, 4: 2, 21: 2, 14: 2}
Did not match all atoms present	2213-82-3	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl	{17: 2, 38: 2, 14: 2}
Did not match all atoms present	2213-84-5	CCNP(=O)(OC)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 1, 14: 2, 17: 3, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	22131-35-7	CCCCN(CCCC)CCNC1=NC(=NO1)C2=CC=CC=C2	{1: 2, 2: 8, 35: 2, 33: 1, 14: 5, 23: 1, 31: 1}
Did not match all atoms present	22131-79-9	C=CCOC1=C(C=C(C=C1)CC(=O)O)Cl	{2: 2, 5: 1, 6: 1, 14: 3, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	22131-80-2	C=CCOC1=C(C=C(C=C1)CC(=O)O)Cl.C(CO)N	{2: 4, 5: 1, 6: 1, 14: 3, 17: 1, 20: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	22132-71-4	N.N.OP(O)O	{20: 3}
Did not match all atoms present	22133-20-6	CC1=C(C=C(C=C1)NC(=O)OC)Cl	{1: 2, 31: 1, 28: 1, 14: 3, 17: 1}
Did not match all atoms present	22134-07-2	C1=C(C=C(C(=C1Cl)N=C=S)Cl)Cl	{8: 1, 17: 3, 34: 1, 14: 2}
Did not match all atoms present	22134-11-8	C1=C(C=C(C(=C1Br)N=C=S)Br)Br	{8: 1, 18: 3, 34: 1, 14: 2}
Did not match all atoms present	22134-75-4	C1=C(C=C(C(=C1Cl)N)Cl)S(=O)(=O)N	{17: 2, 30: 2, 29: 2, 14: 2}
Did not match all atoms present	22135-49-5	CCC[C@@H](C1=CC=CC=C1)O	{1: 1, 2: 2, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	22136-09-0	C1=CC=C(C(=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)O)S(=O)(=O)O	{34: 1, 14: 8, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	22137-01-5	COC1=CC2=C(C=C1)OC=C2CC[NH3+].[Cl-]	{1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	22139-77-1	C1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)O)O	{14: 8, 6: 2, 21: 2}
Did not match all atoms present	2214-14-4	CC1(CC1)C2=CC=CC=C2	{1: 1, 11: 2, 13: 1, 14: 5}
Did not match all atoms present	22144-76-9	CC1CC=CC2C(C(=C(C3C2(C(C=CC(C1=O)(C)O)OC(=O)C)C(=O)NC3CC4=CC=CC=C4)C)C)O	{32: 1, 1: 5, 2: 1, 11: 1, 12: 6, 13: 2, 14: 9, 15: 2, 20: 2, 25: 2, 28: 1}
Did not match all atoms present	22144-77-0	CC1CC=CC2C(C(=C)C(C3C2(C(C=CC(C1=O)(C)O)OC(=O)C)C(=O)NC3CC4=CC=CC=C4)C)O	{32: 1, 1: 4, 2: 1, 5: 1, 11: 1, 12: 7, 13: 2, 14: 9, 15: 1, 20: 2, 25: 2, 28: 1}
Did not match all atoms present	221452-67-1	CCN(C1=CC(=C(C=C1)N=NC2=C(C=C3C(=C2)C(=O)N(C3=O)C)Br)NC(=O)C)C(C)C(=O)OCC	{1: 5, 2: 2, 3: 1, 33: 2, 34: 2, 14: 5, 18: 1, 24: 1, 25: 2, 28: 1, 31: 1}
Did not match all atoms present	2215-21-6	CC(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)C	{27: 1, 1: 4, 3: 2, 21: 1, 14: 2}
Did not match all atoms present	2215-33-0	C1=CC=NC(=C1)C=NNC2=CC=CC=N2	{34: 1, 35: 2, 14: 8, 6: 1, 31: 1}
Did not match all atoms present	2215-77-2	C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)O	{27: 1, 22: 1, 14: 9}
Did not match all atoms present	22150-76-1	CC(C(C1=CN=C2C(=N1)C(=O)N=C(N2)N)O)O	{32: 1, 1: 1, 3: 2, 14: 1, 35: 3, 20: 2, 25: 1, 30: 1}
Did not match all atoms present	22151-75-3	C12=C(NC(=O)N1)N(C(=O)NC2=O)O	{32: 3, 25: 3, 21: 1, 33: 1}
Did not match all atoms present	22156-34-9	C1=CC=C2C(=C1)C(=O)N(C2=O)C(CCl)Cl	{33: 1, 2: 1, 3: 1, 14: 4, 17: 2, 25: 2}
Did not match all atoms present	22158-93-6	CC(C)COC(CBr)N1C(=O)C2=CC=CC=C2C1=O	{1: 2, 2: 2, 3: 2, 33: 1, 14: 4, 18: 1, 22: 1, 25: 2}
Did not match all atoms present	22159-33-7	CCN(CC)C1=CC=C(C=C1)C2=C(N=C(O2)C=C)C3=CC=CC=C3Cl	{1: 2, 2: 2, 35: 1, 5: 1, 6: 1, 33: 1, 14: 8, 17: 1, 23: 1}
Did not match all atoms present	2216-12-8	C1=CC=C(C=C1)OC2=CC=CC=C2[N+](=O)[O-]	{38: 1, 22: 1, 14: 9}
Did not match all atoms present	2216-15-1	CCN(CC)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	2216-16-2	CCN(CC)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	2216-45-7	CC1=CC=C(C=C1)COC(=O)C	{1: 2, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	2216-63-9	CC1=C2CCCC2=C(C=C1)Cl	{1: 1, 11: 3, 14: 2, 17: 1}
Did not match all atoms present	2216-67-3	CNC1=CC2=CC=CC=C2C=C1	{1: 1, 14: 7, 31: 1}
Did not match all atoms present	2216-68-4	CNC1=CC=CC2=CC=CC=C21	{1: 1, 14: 7, 31: 1}
Did not match all atoms present	2216-69-5	COC1=CC=CC2=CC=CC=C21	{1: 1, 22: 1, 14: 7}
Did not match all atoms present	2216-75-3	C1=CC=C(C=C1)NN=CC2=CC=CO2	{34: 1, 31: 1, 14: 8, 6: 1, 23: 1}
Did not match all atoms present	2216-92-4	CCOC(=O)CNC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	2216-94-6	CCOC(=O)C#CC1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 10: 2, 14: 5}
Did not match all atoms present	2217-06-3	C1=C(C=C(C(=C1[N+](=O)[O-])SC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{40: 1, 38: 6, 14: 4}
Did not match all atoms present	2217-07-4	CCCN(CCC)C1=CC=CC=C1	{1: 2, 2: 4, 14: 5, 33: 1}
Did not match all atoms present	2217-40-5	C1CC(C2=CC=CC=C2C1)N	{11: 3, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	2217-41-6	C1CCC2=C(C1)C=CC=C2N	{11: 4, 30: 1, 14: 3}
Did not match all atoms present	2217-44-9	C1=CC=C(C(=C1)C(=C2C=C(C(=O)C(=C2)I)I)C3=CC(=C(C(=C3)I)[O-])I)C(=O)[O-].[Na+].[Na+]	{7: 1, 14: 8, 15: 3, 19: 4, 24: 1, 25: 1}
Did not match all atoms present	2217-45-0	CC1=CC(=C(C(=C1C)C)C)N	{1: 4, 30: 1, 14: 1}
Did not match all atoms present	2217-55-2	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{40: 2, 38: 4, 14: 6}
Did not match all atoms present	2217-60-9	CC1=CC(=C(C=C1O)C(C)C)O	{1: 3, 3: 1, 21: 2, 14: 2}
Did not match all atoms present	2217-81-4	C1=CC=C(C=C1)[Se](C2=CC=CC=C2)(Cl)Cl	{17: 2, 14: 10}
Did not match all atoms present	2217-82-5	C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)[O-].[Na+]	{29: 3, 14: 9}
Did not match all atoms present	22176-45-0	C=CCCCC1=NC(=NC(=N1)N)N	{35: 3, 2: 3, 30: 2, 5: 1, 6: 1}
Did not match all atoms present	2218-52-2	C(C(=O)[O-])(F)F.[Na+]	{16: 2, 24: 1, 3: 1}
Did not match all atoms present	2218-54-4	C(=O)(C(C(C(F)(F)F)(F)F)(F)F)[O-].[Na+]	{16: 7, 24: 1, 4: 3}
Did not match all atoms present	2218-80-6	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Cu+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	2218-94-2	C1=CC=C(C=C1)[N-]C2=NN(C=[N+]2C3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 34: 1, 35: 1, 14: 16}
Did not match all atoms present	2218-96-4	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S	{38: 2, 14: 3, 39: 1}
Did not match all atoms present	22180-30-9	CCOC(=O)C(CC1=CC2=C(C=C1)OCO2)C(=O)OCC	{1: 2, 2: 3, 3: 1, 11: 1, 14: 3, 23: 2, 28: 2}
Did not match all atoms present	22180-53-6	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Br[Pd]Br	{18: 2, 14: 30}
Did not match all atoms present	22184-65-2	CC1(NN1CC2=CC=CC=C2)C	{32: 1, 1: 2, 2: 1, 33: 1, 13: 1, 14: 5}
Did not match all atoms present	22184-93-6	C1=CC(=CC(=C1)S(=O)(=O)NCCO)[N+](=O)[O-]	{2: 2, 38: 1, 14: 4, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	22185-75-7	CCC(=O)NC1=CC(=CC=C1)N(CC)CC	{1: 3, 2: 3, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	22188-15-4	C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4C(=C32)C=CC5=CC=C(C=C5)[N+](=O)[O-]	{38: 1, 35: 1, 14: 14, 6: 2}
Did not match all atoms present	2219-12-7	CN1C2=CC=CC=C2NC1=C3C=CC=CC3=O	{32: 1, 1: 1, 33: 1, 14: 8, 15: 2, 25: 1}
Did not match all atoms present	2219-18-3	CC(C)CN(CC(C)C)C(=S)[S-].[Na+]	{1: 4, 2: 2, 3: 2, 33: 1, 7: 1}
Did not match all atoms present	2219-31-0	C(CO[NH+]=C(N)N)C(C(=O)O)N.OS(=O)(=O)[O-]	{2: 2, 3: 1, 7: 1, 20: 1, 22: 1, 27: 1, 29: 3, 30: 3, 31: 1}
Did not match all atoms present	2219-52-5	[2H]OCCO[2H]	{2: 2, 20: 2}
Did not match all atoms present	2219-62-7	C(=C=O)=C=S	{8: 3, 29: 1}
Did not match all atoms present	2219-72-9	CC1=C(C=CC(=C1)O)C(C)(C)C	{1: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	2219-73-0	CCC1=CC(=C(C=C1)O)C	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	2219-78-5	CCC1=C(C=C(C(=C1)C)C)O	{1: 3, 2: 1, 21: 1, 14: 2}
Did not match all atoms present	2219-82-1	CC1=C(C(=CC=C1)C(C)(C)C)O	{1: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	2219-84-3	CC1=C(C=CC(=C1)C(C)(C)CC(C)(C)C)O	{1: 6, 2: 1, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	22190-12-1	C1=CC=C(C=C1)SC2=NC3=CC=CC=C3C=C2	{40: 1, 35: 1, 14: 11}
Did not match all atoms present	22193-20-0	C1=CC=C(C=C1)NC(=O)NCCC#N	{24: 1, 2: 2, 37: 1, 14: 5, 31: 2}
Did not match all atoms present	22198-72-7	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N.Cl	{1: 2, 33: 2, 14: 5, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	22199-08-2	C1=CN=C(N=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.[Ag+]	{35: 2, 30: 1, 34: 1, 29: 2, 14: 7}
Did not match all atoms present	222-51-5	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=CC6=C(C=CC7=CC=CC=C76)C=C5C4=C3	{14: 18}
Did not match all atoms present	222-54-8	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=CC6=CC=CC=C6C=C5C4=C3	{14: 16}
Did not match all atoms present	222-58-2	C1=CC=C2C=C3C(=CC2=C1)C=CC4=CC5=C(C=CC6=CC7=CC=CC=C7C=C65)C=C43	{14: 18}
Did not match all atoms present	222-75-3	C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C=CC5=CC6=CC7=CC=CC=C7C=C6C=C54	{14: 18}
Did not match all atoms present	222-78-6	C1=CC=C2C=C3C(=CC2=C1)C=CC4=CC5=CC6=CC=CC=C6C=C5C=C43	{14: 16}
Did not match all atoms present	222-81-1	C1=CC=C2C=C3C(=CC2=C1)C=CC4=CC5=CC6=CC7=CC=CC=C7C=C6C=C5C=C43	{14: 18}
Did not match all atoms present	222-93-5	C1=CC=C2C=C3C(=CC2=C1)C=CC4=CC5=CC=CC=C5C=C43	{14: 14}
Did not match all atoms present	22201-28-1	O=[U]=S	{29: 1}
Did not match all atoms present	22204-24-6	CN1CCCN=C1/C=C/C2=CC=CS2.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O	{1: 1, 2: 1, 35: 1, 6: 2, 33: 1, 41: 1, 11: 3, 14: 13, 15: 1, 21: 2, 27: 2}
Did not match all atoms present	22204-53-1	C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O	{27: 1, 1: 2, 3: 1, 22: 1, 14: 6}
Did not match all atoms present	22204-91-7	CN1CCC(CC1)OC(=O)C(OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl	{1: 1, 3: 1, 33: 1, 11: 4, 12: 1, 14: 8, 17: 2, 22: 2, 28: 1}
Did not match all atoms present	22205-05-6	CC1C2CC3=C(C1(CCN2CC=C(C)C)C)C=C(C=C3)O.Cl	{1: 4, 2: 1, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 13: 1, 14: 3, 17: 1, 21: 1}
Did not match all atoms present	22205-30-7	CCCCCCCCCCCCS[Sn](CCCCCCCC)(CCCCCCCC)SCCCCCCCCCCCC	{40: 2, 1: 4, 2: 36}
Did not match all atoms present	22205-45-4	[Cu].[Cu].[S]	{}
Did not match all atoms present	22208-73-7	O.O.[Ca+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	22212-55-1	CCOC(=O)C(C)N(C1=CC(=C(C=C1)Cl)Cl)C(=O)C2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 33: 1, 14: 8, 17: 2, 24: 1, 28: 1}
Did not match all atoms present	22214-28-4	CC(=O)C=CC1=CC=CC=C1O	{24: 1, 1: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	22219-02-9	C1=CC=C(C(=C1)C(=O)O)SC2=CC=CC=C2C(=O)O	{40: 1, 27: 2, 14: 8}
Did not match all atoms present	2222-33-5	C1=CC=C2C(=C1)C=CC3=CC=CC=C3C2=O	{25: 1, 14: 10}
Did not match all atoms present	22223-55-8	CC12CO[As](OC1)OC2	{1: 1, 11: 3, 13: 1, 23: 3}
Did not match all atoms present	22224-92-6	CCOP(=O)(NC(C)C)OC1=CC(=C(C=C1)SC)C	{1: 5, 2: 1, 3: 1, 40: 1, 14: 3, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	22225-32-7	CC(=O)N(C1=CC2=C(CC3=CC=CC=C32)C=C1)O	{1: 1, 33: 1, 11: 1, 14: 7, 20: 1, 24: 1}
Did not match all atoms present	22227-26-5	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)N	{16: 6, 24: 1, 4: 2, 30: 1, 14: 3}
Did not match all atoms present	22228-82-6	CC(C)C(=O)[O-].[NH4+]	{24: 1, 1: 2, 3: 1}
Did not match all atoms present	2223-89-4	CC1=CC(=CC=C1)N(CCC#N)CCN2C(=O)CCC2=O	{1: 1, 2: 4, 37: 1, 33: 2, 11: 2, 14: 4, 25: 2}
Did not match all atoms present	2223-93-0	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	2223-95-2	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Ni+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	22232-01-5	B(O)(OCCN)OCCN	{2: 4, 20: 1, 30: 2, 22: 2}
Did not match all atoms present	22232-25-3	C1=CC(=C(C=C1Cl)CC2=C(C=CC(=C2)Cl)[O-])[O-].[Na+].[Na+]	{17: 2, 2: 1, 14: 6}
Did not match all atoms present	22232-54-8	CCOC(=O)N1C=CN(C1=S)C	{1: 2, 2: 1, 28: 1, 14: 2, 33: 2}
Did not match all atoms present	22232-71-9	C1CN2C(=N1)C3=CC=CC=C3C2(C4=CC=C(C=C4)Cl)O	{33: 1, 35: 1, 11: 2, 13: 1, 14: 8, 15: 1, 17: 1, 20: 1}
Did not match all atoms present	22233-89-2	CC(C)[Se]C1=CC=CC=C1	{1: 2, 3: 1, 14: 5}
Did not match all atoms present	22235-85-4	C=CCN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3	{33: 1, 2: 2, 3: 1, 5: 1, 6: 1, 11: 4, 12: 3, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	22236-04-0	C1=CC=C(C(=C1)N)OC(F)F	{16: 2, 30: 1, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	22236-10-8	C1=CC(=CC=C1N)OC(F)F	{16: 2, 30: 1, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	22237-13-4	B(C1=CC=C(C=C1)OCC)(O)O	{1: 1, 2: 1, 20: 2, 22: 1, 14: 4}
Did not match all atoms present	22238-17-1	B(OC(C)CC)(OC(C)CC)OC(C)CC	{1: 6, 2: 3, 3: 3, 22: 3}
Did not match all atoms present	2224-00-2	CCOC1=C(C2=CC=CC=C2C=C1)C(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 6}
Did not match all atoms present	2224-32-0	C1=CC=C(C=C1)P(=C2C=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{14: 19, 15: 1}
Did not match all atoms present	22244-16-2	C1=CC=C(C=C1)NC2=CC=C(C=C2)C(=C3C=CC(=NC4=CC=CC=C4)C=C3)C5=CC=C(C=C5)NC6=CC=CC=C6	{31: 2, 34: 1, 15: 2, 14: 27, 7: 1}
Did not match all atoms present	22247-66-1	C1=CC(=CC=C1C(=O)O)OCCCCCOC2=CC=C(C=C2)C(=O)O	{2: 5, 27: 2, 22: 2, 14: 8}
Did not match all atoms present	22251-01-0	CC(=O)N(C1=CC=CC2=C1CC3=CC=CC=C32)O	{1: 1, 33: 1, 11: 1, 14: 7, 20: 1, 24: 1}
Did not match all atoms present	22253-11-8	C1C(CC2=CC=CC=C21)C3=CC=CC=C3	{11: 2, 12: 1, 14: 9}
Did not match all atoms present	22254-24-6	CC(C)[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[Br-]	{1: 3, 2: 1, 3: 2, 11: 4, 12: 3, 14: 5, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	22254-88-2	C1=CC(=CC=C1C2=CC(=CC(=C2CC#N)C3=CC=C(C=C3)N(CCO)CCO)N(CCO)CCO)N(CCO)CCO	{33: 3, 2: 13, 20: 6, 37: 1, 14: 10}
Did not match all atoms present	22257-44-9	C1=CC2=N[N-]N=C2C=C1.[Ag+]	{35: 3, 14: 4}
Did not match all atoms present	22259-30-9	CNC(=O)OC1=CC=CC(=C1)N=CN(C)C	{1: 3, 34: 1, 6: 1, 33: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	2226-88-2	C(CC(=O)[O-])C(=O)[O-].[NH4+].[NH4+]	{24: 2, 2: 2}
Did not match all atoms present	22260-51-1	CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O.CS(=O)(=O)O	{32: 1, 1: 6, 2: 1, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 4, 15: 1, 18: 1, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	22261-92-3	C[Te]C1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 14: 4}
Did not match all atoms present	22262-18-6	C[Se]C1=CC=CC=C1C(=O)[O-].[Na+]	{24: 1, 1: 1, 14: 4}
Did not match all atoms present	22262-19-7	C[Te]C1=CC=CC=C1C(=O)[O-].[Na+]	{24: 1, 1: 1, 14: 4}
Did not match all atoms present	22268-28-6	B(F)(Br)I	{16: 1, 18: 1, 19: 1}
Did not match all atoms present	22268-66-2	CCN\1C2=CC=CC=C2S/C1=C\C=C\C=C\C=C\C3=[N+](C4=CC=CC=C4S3)CC.[O-]Cl(=O)(=O)=O	{1: 2, 2: 2, 6: 7, 33: 2, 41: 2, 14: 8, 15: 1, 17: 1, 29: 4}
Did not match all atoms present	2227-13-6	C1=CC(=CC=C1SC2=CC(=C(C=C2Cl)Cl)Cl)Cl	{40: 1, 17: 4, 14: 6}
Did not match all atoms present	2227-64-7	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CBr	{24: 1, 2: 1, 38: 1, 18: 1, 14: 4}
Did not match all atoms present	2227-79-4	C1=CC=C(C=C1)C(=S)N	{30: 1, 14: 5, 7: 1}
Did not match all atoms present	22272-48-6	C1=CC=C(C=C1)CC2=CC(=CC=C2)O	{2: 1, 21: 1, 14: 9}
Did not match all atoms present	222739-15-3	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NN=C4C(=CC5=C(C4=O)C=CC(=C5)NC6=CC=CC=C6)S(=O)(=O)[O-].[K+].[K+].[K+]	{1: 2, 34: 3, 14: 16, 15: 2, 22: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	2228-27-5	CN1C=CC(=NC1=O)N(C)C	{1: 3, 35: 1, 33: 2, 14: 2, 25: 1}
Did not match all atoms present	22280-56-4	CC1=CC(=CN=C1Cl)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 2, 17: 1}
Did not match all atoms present	22280-60-0	CC1=C(C=CC(=N1)Cl)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 2, 17: 1}
Did not match all atoms present	22280-62-2	CC1=C(C=CC(=N1)N)[N+](=O)[O-]	{38: 1, 1: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	22286-82-4	CCOC(=O)C(=C)C1=CC=CC=C1	{1: 1, 2: 1, 5: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	22287-69-0	[C-]#[N+]C1=CC=C(C=C1)N=NC2=CC=CC=C2	{34: 3, 14: 9}
Did not match all atoms present	22288-78-4	COC(=O)C1=C(C=CS1)N	{1: 1, 28: 1, 30: 1, 14: 2, 41: 1}
Did not match all atoms present	22289-34-5	[CH3-].[CH3-].CC[PH+](CC)CC.CC[PH+](CC)CC.[Pt+2]	{1: 6, 2: 6}
Did not match all atoms present	2229-07-4	[CH3]	{}
Did not match all atoms present	22292-76-8	CC1=C(C=C(C=C1O)C(C)C)C(C)C	{1: 5, 3: 2, 21: 1, 14: 2}
Did not match all atoms present	22293-38-5	CC(=O)N(C1=CC=CC=C1)NC2=CC=CC=C2	{24: 1, 1: 1, 33: 1, 14: 10, 31: 1}
Did not match all atoms present	22297-70-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)S(=O)(=O)[O-])O.[Na+]	{25: 2, 21: 2, 14: 5, 29: 3}
Did not match all atoms present	22298-04-0	C1C2=C(C3=C(S1)C=CC(=C3)F)NC4=CC=CC=C24	{16: 1, 32: 1, 11: 1, 14: 7, 41: 1}
Did not match all atoms present	22298-29-9	C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)OC(=O)C5=CC=CC=C5)C)O)F)C	{1: 3, 2: 1, 11: 4, 12: 4, 13: 4, 14: 8, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1, 28: 1}
Did not match all atoms present	22300-56-7	CC1=NN(N=C1C(=O)O)C2=CC=CC=C2	{1: 1, 27: 1, 35: 2, 14: 5, 33: 1}
Did not match all atoms present	22300-89-6	[Be+2].C1=CC=[C-]C=C1.C1=CC=[C-]C=C1	{14: 10}
Did not match all atoms present	22302-65-4	CC(=O)NC1=CC=CC2=C1C=CC=C2O	{24: 1, 1: 1, 21: 1, 14: 6, 31: 1}
Did not match all atoms present	22303-30-6	C1=CC(=C(C=C1NC(=O)C(Cl)(Cl)Cl)Cl)Cl	{24: 1, 17: 5, 4: 1, 14: 3, 31: 1}
Did not match all atoms present	22304-30-9	CCCC1C(=O)N2C3=C(C=CC(=C3)C)N=C(N2C1=O)N(C)C.O.O	{1: 4, 2: 2, 35: 1, 33: 3, 12: 1, 14: 3, 15: 1, 25: 2}
Did not match all atoms present	22304-57-0	C1(=C(C(=C(C(=C1F)F)F)F)F)OC(C(=O)F)(C(F)(F)F)F	{16: 10, 24: 1, 4: 2, 22: 1}
Did not match all atoms present	22306-37-2	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Bi+3]	{24: 3, 1: 3}
Did not match all atoms present	22308-32-3	CCC(=O)C1=CC=CC=C1OCCN(CC)CC.Cl	{1: 3, 2: 5, 33: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	22308-77-6	C1=CC=C(C=C1)I.ClCl	{17: 2, 19: 1, 14: 5}
Did not match all atoms present	2231-57-4	C(=S)(NN)NN	{31: 2, 30: 2, 7: 1}
Did not match all atoms present	223106-41-0	C(C(=O)[O-])(O)S(=O)[O-].[Na+].[Na+]	{24: 1, 3: 1, 20: 1, 29: 2}
Did not match all atoms present	22313-62-8	CC1=CC=CC=C1C(=O)OOC(C)(C)C	{1: 4, 4: 1, 22: 1, 14: 4, 28: 1}
Did not match all atoms present	22316-47-8	CN1C(=O)CC(=O)N(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3	{1: 1, 33: 2, 11: 1, 14: 8, 17: 1, 25: 2}
Did not match all atoms present	22316-55-8	C1C(=O)NC2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3	{32: 1, 33: 1, 11: 1, 14: 8, 17: 1, 25: 2}
Did not match all atoms present	2232-08-8	CC1=CC=C(C=C1)S(=O)(=O)N2C=CN=C2	{1: 1, 35: 1, 29: 2, 14: 7, 33: 1}
Did not match all atoms present	22320-10-1	COC(=O)CCCC1=CC=C(C=C1)O	{1: 1, 2: 3, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	22322-71-0	O.[Cl-].[Cl-].[Ba+2]	{17: 2}
Did not match all atoms present	22325-27-5	CC1=CC(=NC(=S)N1)C	{32: 1, 1: 2, 35: 1, 14: 1}
Did not match all atoms present	22326-31-4	C1=C(C=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)O	{27: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	22326-55-2	O.[OH-].[OH-].[Ba+2]	{}
Did not match all atoms present	2233-18-3	CC1=CC(=CC(=C1O)C)C=O	{1: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	2233-29-6	CC1=C(C(=NC=C1)C)C	{1: 3, 35: 1, 14: 2}
Did not match all atoms present	22330-48-9	CCOC1=C2C(=CC=C3C2=C(C=C1)C(=O)N(C3=O)C)OCC	{1: 3, 2: 2, 33: 1, 14: 4, 22: 2, 25: 2}
Did not match all atoms present	2234-13-1	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=C(C(=C2Cl)Cl)Cl)Cl	{17: 8}
Did not match all atoms present	2234-14-2	CC(C)C1=CC(=C(C(=C1)C(C)C)C(=O)C)C(C)C	{24: 1, 1: 7, 3: 3, 14: 2}
Did not match all atoms present	2234-16-4	CC(=O)C1=C(C=C(C=C1)Cl)Cl	{24: 1, 1: 1, 14: 3, 17: 2}
Did not match all atoms present	2234-20-0	CC1=CC(=C(C=C1)C=C)C	{1: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	2234-97-1	CCCP(CCC)CCC	{1: 3, 2: 6}
Did not match all atoms present	22345-47-7	CCC1C(=NN=C(C2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3)OC)OC)C	{1: 6, 2: 1, 35: 2, 12: 1, 14: 5, 15: 2, 22: 4}
Did not match all atoms present	22346-43-6	CNC1=CC2=CC(=CC(=C2C=C1)O)S(=O)(=O)O	{1: 1, 14: 5, 20: 1, 21: 1, 29: 2, 31: 1}
Did not match all atoms present	22346-75-4	C1=C[N+](=CC=C1CO)[O-]	{33: 1, 2: 1, 20: 1, 29: 1, 14: 4}
Did not match all atoms present	22348-32-9	C1C[C@@H](NC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{32: 1, 4: 1, 11: 3, 12: 1, 14: 10, 20: 1}
Did not match all atoms present	22349-59-3	CC1=C2C=CC3=CC=CC=C3C2=C(C=C1)C	{1: 2, 14: 8}
Did not match all atoms present	2235-01-0	COC(C1=CC=CC=C1)(C2=CC=CC=C2)OC	{1: 2, 4: 1, 22: 2, 14: 10}
Did not match all atoms present	2235-15-6	C1C2=CC=CC3=C2C(=CC=C3)C1=O	{25: 1, 11: 1, 14: 6}
Did not match all atoms present	2235-25-8	[H+].[H+].CC[Hg]OP(=O)([O-])[O-]	{1: 1, 2: 1, 29: 3, 22: 1}
Did not match all atoms present	2235-43-0	C(N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])P(=O)(O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 1, 2: 3, 20: 1, 29: 8}
Did not match all atoms present	2235-54-3	CCCCCCCCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 11, 29: 3, 22: 1}
Did not match all atoms present	2235-83-8	CC(=O)CCCC1=CC=CC=C1	{24: 1, 1: 1, 2: 3, 14: 5}
Did not match all atoms present	2235-90-7	CCC(CC1=CNC2=CC=CC=C21)N	{32: 1, 1: 1, 2: 2, 3: 1, 14: 5, 30: 1}
Did not match all atoms present	22350-95-4	C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2.[Ag+]	{22: 2, 14: 10, 29: 2}
Did not match all atoms present	22351-56-0	CCC1CC2=CC=CC=C2C1=O	{1: 1, 2: 1, 11: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	223551-48-2	CC(=O)O.CC(=O)[O-].CN1C2=C(C=CC(=C2)S(=O)(=O)C)[N+](=C1C3=CC4=C(O3)C=C(C=C4)OC)C	{1: 6, 33: 2, 14: 7, 22: 1, 23: 1, 24: 1, 27: 1, 29: 2}
Did not match all atoms present	22359-67-7	COC1=CC=C(C=C1)C=CC(=O)C2=CC3=CC=CC=C3C=C2	{24: 1, 1: 1, 22: 1, 14: 11, 6: 2}
Did not match all atoms present	2236-52-4	C1=CC=C(C(=C1)C2=CC=CC=C2I)I	{19: 2, 14: 8}
Did not match all atoms present	2236-60-4	C1=CN=C2C(=N1)C(=O)N=C(N2)N	{32: 1, 25: 1, 35: 3, 30: 1, 14: 2}
Did not match all atoms present	22360-77-6	CC#CC1=C2C(=CC=C1)C=CC=C2C#CC	{1: 2, 10: 4, 14: 6}
Did not match all atoms present	22361-85-9	CCC1=C2C=C3C(=C(C(=CC4=NC(=CC5=NC(=CC(=C1C)N2)C(=C5C)CC)C(=C4CCC(=O)OC)C)N3)C(=O)OC)C	{32: 2, 1: 8, 2: 4, 35: 2, 14: 4, 28: 2}
Did not match all atoms present	22364-68-7	CC1=CC=CC=C1CC#N	{1: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	22365-40-8	CN1C(=O)CC(=O)N(C2=C1C=CC(=C2)C(F)(F)F)C3=CC=CC=C3	{1: 1, 4: 1, 33: 2, 11: 1, 14: 8, 16: 3, 25: 2}
Did not match all atoms present	2237-30-1	C1=CC(=CC(=C1)N)C#N	{30: 1, 14: 4, 37: 1}
Did not match all atoms present	2237-36-7	COC1=CC(=C(C=C1)C(=O)O)O	{1: 1, 22: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	22371-93-3	CCOP(=S)(OC1=CC(=C(C=C1)[N+](=O)[O-])C)OC(C)C	{1: 4, 2: 1, 3: 1, 38: 1, 14: 3, 22: 3}
Did not match all atoms present	22373-78-0	CCC1(CCC(O1)C2(CCC3(O2)CC(C(C(O3)C(C)C(C(C)C(=O)[O-])OC)C)O)C)C4C(CC(O4)C5C(CC(C(O5)(CO)O)C)C)C.[Na+]	{1: 9, 2: 2, 3: 3, 11: 7, 12: 10, 13: 4, 20: 3, 22: 1, 23: 5, 24: 1}
Did not match all atoms present	22374-89-6	CC(CCC1=CC=CC=C1)N	{1: 1, 2: 2, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	22381-54-0	CC1=CC=C(C=C1)S(=O)(=O)CCO	{1: 1, 2: 2, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	22382-13-4	COP(=O)(F)F	{16: 2, 1: 1, 29: 1, 22: 1}
Did not match all atoms present	22383-53-5	CCOCC(C1=CC=CC=C1)O	{1: 1, 2: 2, 3: 1, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	22387-03-7	[2H]OP(=O)([O-])[O-].[K+].[K+]	{20: 1, 29: 3}
Did not match all atoms present	2239-92-1	CC(C)OC(=O)NC1=CC=C(C=C1)Cl	{1: 2, 3: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	22393-63-1	CCC1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\Br)/C3=CC=CC=C3	{1: 1, 2: 1, 18: 1, 14: 14, 7: 2}
Did not match all atoms present	22394-38-3	C1=CC=C2C(=C1)/C(=C/NC3=NC=CS3)/C=N2	{35: 2, 6: 1, 41: 1, 14: 7, 15: 1, 31: 1}
Did not match all atoms present	22395-93-3	[B](F)Cl	{16: 1, 17: 1}
Did not match all atoms present	22396-72-1	CCN(CC)CC#CC1=CC=CC=C1	{1: 2, 2: 3, 10: 2, 14: 5, 33: 1}
Did not match all atoms present	22398-80-7	P#[In]	{}
Did not match all atoms present	224-10-2	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)SC=C4	{41: 1, 14: 10}
Did not match all atoms present	224-41-9	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)C5=CC=CC=C5C=C4	{14: 14}
Did not match all atoms present	224-42-0	C1=CC=C2C(=C1)C=CC3=NC4=C(C=C32)C5=CC=CC=C5C=C4	{35: 1, 14: 13}
Did not match all atoms present	224-53-3	C1=CC=C2C(=C1)C=CC3=C2N=C4C(=C3)C=CC5=CC=CC=C54	{35: 1, 14: 13}
Did not match all atoms present	224-98-6	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=N4	{35: 1, 14: 11}
Did not match all atoms present	2240-14-4	CCNC1C2CCC(C2)C1C3=CC=CC=C3.Cl	{1: 1, 2: 1, 11: 3, 12: 4, 14: 5, 17: 1, 31: 1}
Did not match all atoms present	2240-25-7	C1=NC(=O)NC(=C1Br)N	{32: 1, 35: 1, 14: 1, 18: 1, 25: 1, 30: 1}
Did not match all atoms present	2240-41-7	COP(=O)(C1=CC=CC=C1)OC	{1: 2, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	2240-47-3	C1=CC=C(C=C1)P(=N)(C2=CC=CC=C2)C3=CC=CC=C3	{36: 1, 14: 15}
Did not match all atoms present	2240-85-9	CN1C=CC=CC1=[Se]	{1: 1, 14: 4, 33: 1}
Did not match all atoms present	22400-26-6	C(=[N])=O	{8: 1, 29: 1}
Did not match all atoms present	22402-95-5	C(P(CCl)Cl)Cl	{17: 3, 2: 2}
Did not match all atoms present	224051-14-3	CCCCCCCCCCCCCCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 13, 14: 7}
Did not match all atoms present	224051-15-4	CCCCCCCCCCCCCCC1=CC2=C(C=C1)C=C(C=C2)CCCCCCCCCCCCCC	{1: 2, 2: 26, 14: 6}
Did not match all atoms present	224051-16-5	CCCCCCCCCCCCCCC1=CC2=C(C=C(C=C2C=C1)CCCCCCCCCCCCCC)CCCCCCCCCCCCCC	{1: 3, 2: 39, 14: 5}
Did not match all atoms present	22407-40-5	C1=CC=C(C=C1)S(=O)(=O)C2=CC=CS2	{41: 1, 29: 2, 14: 8}
Did not match all atoms present	22409-91-2	CCOC(=O)CCOC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	2241-68-1	C(C(C(F)F)(F)F)OP(OCC(C(F)F)(F)F)OCC(C(F)F)(F)F	{16: 12, 2: 3, 3: 3, 4: 3, 22: 3}
Did not match all atoms present	22413-78-1	CCN1C[C@@]2(CC[C@@H](C34[C@@H]2[C@@H](C(C31)([C@]5(C[C@@H]([C@H]6C[C@@H]4[C@@H]5[C@H]6OC)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7N	{1: 5, 2: 2, 33: 1, 11: 5, 12: 9, 13: 4, 14: 4, 20: 2, 22: 4, 28: 1, 30: 1}
Did not match all atoms present	2242-96-8	C1=CC=C2C(=C1)NC(=N2)CCS	{32: 1, 2: 2, 35: 1, 14: 4, 39: 1}
Did not match all atoms present	22421-59-6	CC1=CC(=C(C(=C1)Br)OCC2CO2)Br	{1: 1, 2: 1, 11: 1, 12: 1, 14: 2, 18: 2, 22: 1, 23: 1}
Did not match all atoms present	22424-58-4	CC1=C(C=CC(=C1)OCC2=CC=CC=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 22: 1, 14: 8}
Did not match all atoms present	22426-21-7	CCCC[N+](CCC)(CCCC)CCCC.[I-]	{1: 4, 2: 11, 19: 1}
Did not match all atoms present	22426-24-0	C[C@@H](C1=CC=CO1)OC(=O)C	{1: 2, 3: 1, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	22428-30-4	C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)O)O)N	{2: 1, 30: 2, 21: 2, 14: 6}
Did not match all atoms present	22428-48-4	C1CC(=COCC2=CC=CC=C2)CC=C1	{2: 1, 6: 1, 11: 3, 14: 7, 15: 1, 22: 1}
Did not match all atoms present	22429-12-5	CN1CCN(P1C2=CC=CC=C2)C	{1: 2, 11: 2, 14: 5, 33: 2}
Did not match all atoms present	2243-30-3	CC(C)(C)N(C)C1=CC=CC=C1	{1: 4, 4: 1, 14: 5, 33: 1}
Did not match all atoms present	2243-32-5	CC1=C(C(=C(C(=C1C)C)C(=O)O)C)C	{1: 5, 27: 1}
Did not match all atoms present	2243-35-8	CC(=O)OCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	2243-42-7	C1=CC=C(C=C1)OC2=CC=CC=C2C(=O)O	{27: 1, 22: 1, 14: 9}
Did not match all atoms present	2243-43-8	C1=CC=C(C=C1)OCCCC#N	{2: 3, 22: 1, 14: 5, 37: 1}
Did not match all atoms present	2243-47-2	C1=CC=C(C=C1)C2=CC(=CC=C2)N	{30: 1, 14: 9}
Did not match all atoms present	2243-54-1	C1=CC=C2C=C(C=CC2=C1)N=C=O	{8: 1, 34: 1, 29: 1, 14: 7}
Did not match all atoms present	2243-55-2	C1=CC=C2C(=C1)C=CC=C2NN	{30: 1, 14: 7, 31: 1}
Did not match all atoms present	2243-56-3	C1=CC=C2C(=C1)C=CC=C2NN.Cl	{17: 1, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	2243-58-5	C1=CC=C2C=C(C=CC2=C1)NN.Cl	{17: 1, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	2243-61-0	C1=CC=C2C(=C1)C(=CC=C2N)N	{30: 2, 14: 6}
Did not match all atoms present	2243-62-1	C1=CC2=C(C=CC=C2N)C(=C1)N	{30: 2, 14: 6}
Did not match all atoms present	2243-69-8	CC(=O)NC1=C(C=C(C=C1)OC(=O)C)[N+](=O)[O-]	{1: 2, 38: 1, 14: 3, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	2243-71-2	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3[N+](=O)[O-])O)O	{25: 2, 38: 1, 21: 2, 14: 5}
Did not match all atoms present	2243-74-5	C1=CC(=CC(=C1)[N+](=O)[O-])N/N=C\2/C=CC(=O)C=C2O	{34: 1, 38: 1, 14: 7, 15: 2, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	2243-76-7	C1=CC(=CC=C1N/N=C/2\C=CC(=O)C(=C2)C(=O)[O-])[N+](=O)[O-].[Na+]	{34: 1, 38: 1, 14: 7, 15: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	2243-79-0	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2[N+](=O)[O-]	{24: 1, 38: 1, 14: 9}
Did not match all atoms present	2243-80-3	C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9}
Did not match all atoms present	2243-81-4	C1=CC=C2C(=C1)C=CC=C2C(=O)N	{24: 1, 30: 1, 14: 7}
Did not match all atoms present	2243-83-6	C1=CC=C2C=C(C=CC2=C1)C(=O)Cl	{24: 1, 17: 1, 14: 7}
Did not match all atoms present	2243-89-2	CC1=CC2=C(C=C1)N=C(C=C2C)C	{1: 3, 35: 1, 14: 4}
Did not match all atoms present	2243-90-5	CC1=NC2=C(C=C(C=C2C=C1)C)C	{1: 3, 35: 1, 14: 4}
Did not match all atoms present	2243-94-9	C1=CC2=C(C=C(C=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 5}
Did not match all atoms present	2243-95-0	C1=CC2=C(C=CC(=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 5}
Did not match all atoms present	22430-47-3	C[Si](C)(C)C=CC=C[Si](C)(C)C	{1: 6, 6: 4}
Did not match all atoms present	224311-51-7	CC(C)(C)P(C1=CC=CC=C1C2=CC=CC=C2)C(C)(C)C	{1: 6, 4: 2, 14: 9}
Did not match all atoms present	22432-68-4	C1(=O)OC(C(O1)(Cl)Cl)(Cl)Cl	{17: 4, 13: 2}
Did not match all atoms present	22433-39-2	CC(=C=C)C1=CC=CC=C1	{8: 1, 1: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	22433-76-7	CC(=O)NC1=CC2=C(C=C1)N=CC=C2	{24: 1, 1: 1, 35: 1, 14: 6, 31: 1}
Did not match all atoms present	22437-79-2	C(C(C(=O)[O-])S)C(=O)[O-].[Na+].[Na+]	{24: 2, 2: 1, 3: 1, 39: 1}
Did not match all atoms present	2244-11-3	C1(=O)C(=O)NC(=O)NC1=O.O	{32: 2, 25: 4}
Did not match all atoms present	2244-21-5	C1(=O)[N-]C(=O)N(C(=O)N1Cl)Cl.[K+]	{17: 2, 35: 1, 33: 2, 25: 3}
Did not match all atoms present	22440-93-3	CN(C)C1=CC(=CC=C1)N(C)C	{1: 4, 14: 4, 33: 2}
Did not match all atoms present	22441-45-8	Cl[As](Cl)(Cl)(Cl)Cl	{17: 5}
Did not match all atoms present	22442-48-4	COC1=CC=C(C=C1)CCC#N	{1: 1, 2: 2, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	22445-41-6	CC1=CC(=CC(=C1)I)C	{1: 2, 19: 1, 14: 3}
Did not match all atoms present	22445-42-7	CC1=CC(=CC(=C1)C#N)C	{1: 2, 37: 1, 14: 3}
Did not match all atoms present	22446-37-3	COC(=O)CC1=CC=CC=C1O	{1: 1, 2: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	2245-38-7	CC1=CC=CC2=CC(=C(C=C12)C)C	{1: 3, 14: 5}
Did not match all atoms present	2245-52-5	C[NH+](C)CC1=CC=C(C=C1)C=C	{1: 2, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	2245-53-6	C1=CC(=CC=C1OCC(=O)O)OCC(=O)O	{2: 2, 27: 2, 22: 2, 14: 4}
Did not match all atoms present	22452-74-0	C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)O)C(=O)O	{27: 2, 29: 2, 14: 8}
Did not match all atoms present	22454-86-0	C1=C(NC(=O)NC1=O)C(=O)[O-].C1=C(NC(=O)NC1=O)C(=O)[O-].[Ca+2]	{24: 2, 25: 4, 14: 2, 32: 4}
Did not match all atoms present	22464-76-2	O.O.[O-]Cl.[O-]Cl.[Ca+2]	{17: 2, 29: 2}
Did not match all atoms present	22464-99-9	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Zr+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	22467-98-7	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)COC4=CC=C(C=C4)Cl)CCC5=C(C(=O)CC[C@H]35)Cl	{1: 1, 2: 1, 11: 8, 12: 5, 13: 1, 14: 4, 15: 2, 17: 2, 22: 1, 25: 1, 28: 1}
Did not match all atoms present	22468-64-0	[O-]I.[Na+]	{19: 1, 29: 1}
Did not match all atoms present	2247-71-4	CC(=O)NC(C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)C(F)(F)F	{1: 1, 4: 2, 14: 8, 16: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	2247-78-1	CC(=O)NC(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)C(F)(F)F	{1: 1, 4: 2, 14: 8, 16: 5, 24: 1, 31: 1}
Did not match all atoms present	22472-36-2	C[Si](C)(C)C(=C)C(=C)[Si](C)(C)C	{1: 6, 5: 2, 7: 2}
Did not match all atoms present	2248-34-2	[B-](F)(F)(F)F.C1COCCN1C2=CC=C(C=C2)[N+]#N	{33: 1, 34: 1, 11: 4, 14: 4, 16: 4, 23: 1}
Did not match all atoms present	22480-91-7	COC1=C(C(=C(C=C1)CC(=O)O)OC)OC	{1: 3, 2: 1, 27: 1, 22: 3, 14: 2}
Did not match all atoms present	22482-43-5	C1=CC(=C(C(=C1)Cl)/C=C/[N+](=O)[O-])Cl	{17: 2, 38: 1, 14: 3, 6: 2}
Did not match all atoms present	2249-28-7	C1CNCCC1(C2=CC(=CC=C2)C(F)(F)F)O	{32: 1, 4: 1, 11: 4, 13: 1, 14: 4, 16: 3, 20: 1}
Did not match all atoms present	22494-42-4	C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)O	{16: 2, 27: 1, 21: 1, 14: 6}
Did not match all atoms present	22499-11-2	CCCCOC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{1: 1, 2: 3, 3: 1, 14: 10, 22: 1, 24: 1}
Did not match all atoms present	22499-12-3	CC(C)COC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{1: 2, 2: 1, 3: 2, 14: 10, 22: 1, 24: 1}
Did not match all atoms present	225-11-6	C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4C=C32	{35: 1, 14: 11}
Did not match all atoms present	225-51-4	C1=CC=C2C(=C1)C=CC3=CC4=CC=CC=C4N=C32	{35: 1, 14: 11}
Did not match all atoms present	225-61-6	C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4N=C32	{35: 2, 14: 10}
Did not match all atoms present	225-83-2	C1=CC=C2C(=C1)C=CC3=C2NC4=CC=CC=C4S3	{32: 1, 41: 1, 14: 10}
Did not match all atoms present	22500-95-4	C[Si](C)(C)C=CC(=C)[Si](C)(C)C	{1: 6, 5: 1, 6: 2, 7: 1}
Did not match all atoms present	22504-72-9	CNS(=O)(=O)NC	{1: 2, 29: 2, 31: 2}
Did not match all atoms present	22506-53-2	C1=CC2=C(C=CC3=C2C(=C1)C4=C3C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	22509-74-6	CCOC(=O)N1C(=O)C2=CC=CC=C2C1=O	{1: 1, 2: 1, 33: 1, 14: 4, 25: 2, 28: 1}
Did not match all atoms present	2251-50-5	C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)Cl	{16: 5, 17: 1, 24: 1}
Did not match all atoms present	2251-65-2	C1=CC(=CC(=C1)C(F)(F)F)C(=O)Cl	{16: 3, 17: 1, 4: 1, 14: 4, 24: 1}
Did not match all atoms present	22510-13-0	CCCCCCOC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{1: 1, 2: 5, 3: 1, 14: 10, 22: 1, 24: 1}
Did not match all atoms present	22514-23-4	C1COCCN1CCSC2=NC(=CC=C2)Cl	{33: 1, 2: 2, 35: 1, 40: 1, 11: 4, 14: 3, 17: 1, 23: 1}
Did not match all atoms present	22515-25-9	C[Si](C)(C)C1=CC=C(C=C1)SC	{40: 1, 1: 4, 14: 4}
Did not match all atoms present	2252-44-0	C1=CC(=CC(=C1)Br)OC(F)(F)F	{16: 3, 18: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	2252-51-9	C1=CC(=C(C=C1F)Cl)C(=O)O	{16: 1, 17: 1, 27: 1, 14: 3}
Did not match all atoms present	2252-63-3	C1CN(CCN1)C2=CC=C(C=C2)F	{16: 1, 32: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	22524-51-2	CC1=CC(=C(C(=C1C)C(=O)OC)C)C	{1: 5, 28: 1, 14: 1}
Did not match all atoms present	22524-99-8	C1NC(=S)N=N1	{32: 1, 35: 2, 11: 1, 15: 1}
Did not match all atoms present	22525-43-5	CN(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N	{1: 2, 30: 1, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	22529-97-1	C[Si](C)(C)NC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 3, 31: 1}
Did not match all atoms present	2253-43-2	CCCOP(=S)(OCCC)S	{1: 2, 2: 4, 22: 2, 39: 1}
Did not match all atoms present	2253-44-3	CCCCOP(=S)(OCCCC)S	{1: 2, 2: 6, 22: 2, 39: 1}
Did not match all atoms present	2253-52-3	CC(C)COP(=S)(OCC(C)C)S	{1: 4, 2: 2, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	2253-73-8	CC(C)N=C=S	{8: 1, 1: 2, 34: 1, 3: 1}
Did not match all atoms present	22531-06-2	CCC1=CC2=C(CCCC2=O)C=C1	{1: 1, 2: 1, 11: 3, 14: 3, 25: 1}
Did not match all atoms present	22531-20-0	CCC1=CC2=C(CCCC2)C=C1	{1: 1, 2: 1, 11: 4, 14: 3}
Did not match all atoms present	22532-47-4	CC1=CC=C(C=C1)CCOC(=O)C	{1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	22532-51-0	CC(=O)OCCC1=CC=C(C=C1)OC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	22532-72-5	CC1=C(C=CC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 38: 1, 22: 1, 14: 7, 17: 1}
Did not match all atoms present	22535-42-8	CCCC[Sn](OC(=O)/C=C\C(=O)OC(C)C)(OC(=O)/C=C\C(=O)OC(C)C)CCCC	{1: 6, 2: 6, 3: 2, 28: 4, 6: 4}
Did not match all atoms present	22535-49-5	C=CC(=O)OC1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 14: 9, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	22537-19-5	[Lr]	{}
Did not match all atoms present	22537-20-8	[Be+2]	{}
Did not match all atoms present	22537-22-0	[Mg+2]	{}
Did not match all atoms present	22537-23-1	[Al+3]	{}
Did not match all atoms present	22537-29-7	[Sc+3]	{}
Did not match all atoms present	22537-33-3	[Ga+3]	{}
Did not match all atoms present	22537-38-8	[Rb+]	{}
Did not match all atoms present	22537-39-9	[Sr+2]	{}
Did not match all atoms present	22537-40-2	[Y+3]	{}
Did not match all atoms present	22537-48-0	[Cd+2]	{}
Did not match all atoms present	22537-49-1	[In+3]	{}
Did not match all atoms present	22537-50-4	[Sn+4]	{}
Did not match all atoms present	22537-56-0	[Tl+]	{}
Did not match all atoms present	22537-58-2	[Po+2]	{}
Did not match all atoms present	22537-59-3	[Pa+4]	{}
Did not match all atoms present	22539-11-3	[O-]S(=O)F	{16: 1, 29: 2}
Did not match all atoms present	22539-65-7	CC1=C(C(=CC=C1)C(C)C)C	{1: 4, 3: 1, 14: 3}
Did not match all atoms present	2254-88-8	C1(=NSC(=N1)Cl)Cl	{17: 2, 35: 2, 41: 1}
Did not match all atoms present	2254-94-6	CN1C2=CC=CC=C2SC1=S	{1: 1, 41: 1, 14: 4, 33: 1}
Did not match all atoms present	22541-12-4	[Ba+2]	{}
Did not match all atoms present	22541-14-6	[Pr+3]	{}
Did not match all atoms present	22541-16-8	[Pm+3]	{}
Did not match all atoms present	22541-17-9	[Sm+3]	{}
Did not match all atoms present	22541-18-0	[Eu+3]	{}
Did not match all atoms present	22541-19-1	[Gd+3]	{}
Did not match all atoms present	22541-20-4	[Tb+3]	{}
Did not match all atoms present	22541-21-5	[Dy+3]	{}
Did not match all atoms present	22541-22-6	[Ho+3]	{}
Did not match all atoms present	22541-23-7	[Tm+3]	{}
Did not match all atoms present	22541-24-8	[Lu+3]	{}
Did not match all atoms present	22541-25-9	[Hf+4]	{}
Did not match all atoms present	22541-28-2	[Re+7]	{}
Did not match all atoms present	22541-34-0	[Po+4]	{}
Did not match all atoms present	22541-36-2	[Ra+2]	{}
Did not match all atoms present	22541-37-3	[Ac+3]	{}
Did not match all atoms present	22541-42-0	[Cm+3]	{}
Did not match all atoms present	22541-43-1	[Cf+3]	{}
Did not match all atoms present	22541-44-2	[Pu+4]	{}
Did not match all atoms present	22541-46-4	[Am+3]	{}
Did not match all atoms present	22541-47-5	[Bk+3]	{}
Did not match all atoms present	22541-48-6	[Se-2]	{}
Did not match all atoms present	22541-49-7	[Te-2]	{}
Did not match all atoms present	22541-53-3	[Co+2]	{}
Did not match all atoms present	22541-54-4	[As+3]	{}
Did not match all atoms present	22541-63-5	[Co+3]	{}
Did not match all atoms present	22541-70-4	[Pu+3]	{}
Did not match all atoms present	22541-75-9	[Ti+3]	{}
Did not match all atoms present	22541-77-1	[V+3]	{}
Did not match all atoms present	22541-79-3	[Cr+2]	{}
Did not match all atoms present	22541-87-3	[Mo+2]	{}
Did not match all atoms present	22541-90-8	[Sn+2]	{}
Did not match all atoms present	22541-96-4	[Yb+2]	{}
Did not match all atoms present	22542-02-5	[Re+4]	{}
Did not match all atoms present	22542-03-6	[Re+2]	{}
Did not match all atoms present	22542-10-5	[Pt+2]	{}
Did not match all atoms present	22542-11-6	[Hg+]	{}
Did not match all atoms present	22545-13-7	CCC1=CC=C(C=C1)CCO	{1: 1, 2: 3, 20: 1, 14: 4}
Did not match all atoms present	22545-15-9	CCOC1=CC=C(C=C1)CCO	{1: 1, 2: 3, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	2255-17-6	CC1=C(C=CC(=C1)OP(=O)(OC)OC)[N+](=O)[O-]	{1: 3, 38: 1, 22: 3, 14: 3, 29: 1}
Did not match all atoms present	22550-74-9	CN1CCOP1OC	{1: 2, 11: 2, 33: 1, 22: 1, 23: 1}
Did not match all atoms present	2256-01-1	CC(C)CC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 2, 6: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	22560-16-3	[Li+].[BH-](CC)(CC)CC	{1: 3, 2: 3}
Did not match all atoms present	22560-50-5	C(P(=O)(O)[O-])(P(=O)(O)[O-])(Cl)Cl.[Na+].[Na+]	{17: 2, 4: 1, 29: 4, 20: 2}
Did not match all atoms present	22564-43-8	CCN(CCCl)C1=CC=CC(=C1)C	{1: 2, 2: 3, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	22569-48-8	[OH-].[Zn+2]	{}
Did not match all atoms present	2257-09-2	C1=CC=C(C=C1)CCN=C=S	{8: 1, 2: 2, 34: 1, 14: 5}
Did not match all atoms present	22572-40-3	CCN=C=NCCC[N+](C)(C)C.[I-]	{8: 1, 1: 4, 2: 4, 19: 1, 34: 2}
Did not match all atoms present	22578-81-0	[U+3]	{}
Did not match all atoms present	22578-82-1	[Np+4]	{}
Did not match all atoms present	22581-63-1	[2H]C([2H])(C([2H])([2H])Br)Br	{2: 2, 18: 2}
Did not match all atoms present	22581-72-2	CSC1=CC=NC=C1	{40: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	22582-68-9	CCC(=O)C1=CNC2=CC=CC=C21	{24: 1, 1: 1, 2: 1, 14: 5, 32: 1}
Did not match all atoms present	22583-66-0	CC(C)(C)C1=CC=C(C=C1)C(=O)C(C)(C)C	{24: 1, 1: 6, 4: 2, 14: 4}
Did not match all atoms present	22588-78-9	CC(=O)NC1=CC(=C(C=C1)OC)N(CCC#N)CCO	{1: 2, 2: 4, 37: 1, 33: 1, 14: 3, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	2259-96-3	C1C2CC(C1C=C2)C3NC4=CC(=C(C=C4S(=O)(=O)N3)S(=O)(=O)N)Cl	{32: 2, 11: 2, 12: 4, 14: 4, 17: 1, 29: 4, 30: 1}
Did not match all atoms present	22594-69-0	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].Cl[Ru]Cl.Cl[Ru]Cl	{17: 4, 29: 6}
Did not match all atoms present	226-36-8	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=CC=CC=C5C4=N3	{35: 1, 14: 13}
Did not match all atoms present	226-47-1	C1=CC=C2C(=C1)C=CC3=C2N=C4C=CC5=CC=CC=C5C4=N3	{35: 2, 14: 12}
Did not match all atoms present	226-65-3	C1=CC=C2C(=C1)C=CN3C2=NN4C=CC5=CC=CC=C5C4=N3	{33: 2, 35: 2, 14: 12, 15: 2}
Did not match all atoms present	226-88-0	C1=CC=C2C(=C1)C=CC3=CC4=CC5=CC=CC=C5C=C4C=C32	{14: 14}
Did not match all atoms present	2260-08-4	CC(=O)OC1=C(C=C(C=C1)OC2=C(C=C(C=C2I)C(=O)O)I)I	{1: 1, 14: 5, 19: 3, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	2260-50-6	CC(=O)OCC[N+](C)(C)C.[I-]	{1: 4, 2: 2, 19: 1, 28: 1}
Did not match all atoms present	22603-53-8	C1=C(C=C(C(=C1[N+](=O)[O-])N)C#N)[N+](=O)[O-]	{38: 2, 30: 1, 14: 2, 37: 1}
Did not match all atoms present	22604-10-0	C(=C(C#N)C#N)[C-](C#N)C#N.[Na+]	{37: 4, 6: 1, 7: 2}
Did not match all atoms present	22605-15-8	C1=CC=C(C=C1)C2=CC(=P(C(=C2)C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6	{14: 27, 15: 3}
Did not match all atoms present	22608-53-3	COP(=O)(SC)SC	{40: 2, 1: 3, 29: 1, 22: 1}
Did not match all atoms present	2261-83-8	CCP(=O)(OCC(C)C)F	{1: 3, 2: 2, 3: 1, 16: 1, 22: 1, 29: 1}
Did not match all atoms present	2261-94-1	CN1C2=C(C=CC1=O)C=C(C=C2)C(F)(F)F	{1: 1, 4: 1, 33: 1, 14: 5, 16: 3, 25: 1}
Did not match all atoms present	22612-62-0	C1CCC(C(=O)C1)(C2=CC=CC=C2)C3=CC=CC=C3	{25: 1, 11: 4, 13: 1, 14: 10}
Did not match all atoms present	22614-60-4	CCOP(=[Fe]=P(OCC)(OCC)OCC)(OCC)OCC.[N-]=O.[N-]=O	{1: 6, 2: 6, 29: 2, 22: 6}
Did not match all atoms present	22616-31-5	CC(C)C[N+](CCOCCOC1=CC=CC=C1)(CC2=CC=CC=C2)CC(C)C.[Cl-]	{1: 4, 2: 7, 3: 2, 14: 10, 17: 1, 22: 2}
Did not match all atoms present	22617-04-5	CC1=CC(=NNC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C(=C1)C(C)(C)C	{1: 4, 34: 1, 4: 1, 38: 1, 14: 5, 15: 3, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	22618-23-1	CC1=C(C=C(C=C1)OC(=O)C)C	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	22618-51-5	CC1=CC=CC=C1C2=CCCCC2	{1: 1, 11: 4, 14: 5, 15: 1}
Did not match all atoms present	22620-93-5	CCCCCCCCCC(=O)[O-].[Al]	{24: 1, 1: 1, 2: 8}
Did not match all atoms present	2263-09-4	CCCCN(CCO)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 5, 4: 8, 33: 1, 16: 17, 20: 1, 29: 2}
Did not match all atoms present	22632-10-6	CNC1=NC=NC=C1	{1: 1, 35: 2, 14: 3, 31: 1}
Did not match all atoms present	22633-33-6	COC(=O)C1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 28: 1, 21: 1, 14: 2}
Did not match all atoms present	22636-29-9	CCOC1=C(C=C(C=C1)NC(=O)C)N(CCC#N)CCO	{1: 2, 2: 5, 37: 1, 33: 1, 14: 3, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	22643-20-5	CCCCCCCCN(CCCCCCCC)CC1=CC=CC=C1	{1: 2, 2: 15, 14: 5, 33: 1}
Did not match all atoms present	2265-64-7	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COC(=O)C5=CC=NC=C5)O)C)O)F)C	{1: 3, 2: 1, 35: 1, 11: 4, 12: 4, 13: 4, 14: 7, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1, 28: 1}
Did not match all atoms present	2265-93-2	C1=CC(=C(C=C1F)F)I	{16: 2, 19: 1, 14: 3}
Did not match all atoms present	2265-94-3	C1=C(C=C(C=C1F)F)[N+](=O)[O-]	{16: 2, 38: 1, 14: 3}
Did not match all atoms present	22652-14-8	C1=C(C=C(N=C1Cl)Cl)C(Cl)(Cl)Cl	{17: 5, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	2266-22-0	CC1=CC=CC(=C1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N4CCCC4	{1: 1, 2: 3, 33: 2, 11: 8, 13: 1, 14: 8, 16: 1, 24: 2}
Did not match all atoms present	22664-55-7	CC1=CC(=C(C(=C1OC(=O)C)C)C)OCC(CNC(C)C)O	{1: 6, 2: 2, 3: 2, 14: 1, 20: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	22666-53-1	CC(C)(C)C(=C)C1=CC=C(C=C1)OC	{1: 4, 4: 1, 5: 1, 7: 1, 14: 4, 22: 1}
Did not match all atoms present	22666-67-7	CC(C)(C)C(=C)C1=CC=C(C=C1)C(F)(F)F	{1: 3, 4: 2, 5: 1, 7: 1, 14: 4, 16: 3}
Did not match all atoms present	22668-01-5	C1=CN(C(=N1)[N+](=O)[O-])CC(=O)NCCO	{33: 1, 2: 3, 35: 1, 38: 1, 14: 2, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	22673-19-4	CCCC[CH2-].CCCC[CH2-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Sn+4]	{1: 6, 2: 6, 5: 2, 6: 2, 7: 2, 24: 2}
Did not match all atoms present	22679-54-5	CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 3, 4: 1, 14: 9}
Did not match all atoms present	2268-05-5	C1=CC(=C(C(=C1)Cl)F)Cl	{16: 1, 17: 2, 14: 3}
Did not match all atoms present	2268-15-7	C1=C(C=C(C(=C1F)F)O)F	{16: 3, 21: 1, 14: 2}
Did not match all atoms present	2268-16-8	C1=C(C(=CC(=C1F)F)F)O	{16: 3, 21: 1, 14: 2}
Did not match all atoms present	2268-17-9	C1=C(C=C(C(=C1F)O)F)F	{16: 3, 21: 1, 14: 2}
Did not match all atoms present	22681-77-2	C1=CC=NC(=C1)NC2=CC=C(C=C2)Cl	{17: 1, 35: 1, 14: 8, 31: 1}
Did not match all atoms present	2269-06-9	C[NH+]1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)OC)OC)OC.[Cl-]	{1: 5, 11: 3, 12: 1, 14: 3, 17: 1, 22: 4}
Did not match all atoms present	2269-22-9	CCC(C)[O-].CCC(C)[O-].CCC(C)[O-].[Al+3]	{1: 6, 2: 3, 3: 3, 29: 3}
Did not match all atoms present	22692-70-2	CCC(=CC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	22695-80-3	O.O.O.O.[Mg+2].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	22698-95-9	C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=CC=C3Cl	{17: 1, 33: 1, 14: 8, 25: 2}
Did not match all atoms present	22699-97-4	COC1=C(C=C(C=C1)C(=O)C2=CC(=C(C(=C2)OC)OC)OC)OC	{24: 1, 1: 5, 22: 5, 14: 5}
Did not match all atoms present	227-04-3	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C5C=CC6=CC=CC=C6C5=C4)C=C32	{14: 16}
Did not match all atoms present	227-09-8	C1=CC=C2C(=C1)C=CC3=CC4=CC5=C(C=C6C=CC7=CC=CC=C7C6=C5)C=C4C=C32	{14: 18}
Did not match all atoms present	227-56-5	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CS4	{41: 1, 14: 10}
Did not match all atoms present	227-86-1	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3SC=C4	{41: 1, 14: 10}
Did not match all atoms present	2270-20-4	C1=CC=C(C=C1)CCCCC(=O)O	{2: 4, 27: 1, 14: 5}
Did not match all atoms present	22705-32-4	CN(C)[Si](C)C	{1: 4, 33: 1}
Did not match all atoms present	22705-33-5	CN(C)[Si](C)N(C)C	{1: 5, 33: 2}
Did not match all atoms present	22706-20-3	CC1=NN(N=N1)C2=CC=CC=C2	{1: 1, 35: 3, 14: 5, 33: 1}
Did not match all atoms present	22708-14-1	CCCCCOC(=O)C1=CC=CC=C1OC	{1: 2, 2: 4, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	22711-21-3	COC1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2	{24: 2, 1: 1, 22: 1, 14: 9}
Did not match all atoms present	22711-23-5	C1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)Cl	{24: 2, 17: 1, 14: 9}
Did not match all atoms present	22711-24-6	C1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{24: 2, 38: 1, 14: 9}
Did not match all atoms present	22713-35-5	CN1C2=CC=CC=C2[N+](=N1)C.[I-]	{1: 2, 19: 1, 35: 1, 14: 4, 33: 2}
Did not match all atoms present	22715-27-1	C1=C(C=NC(=N1)N)N	{35: 2, 30: 2, 14: 2}
Did not match all atoms present	22717-57-3	CC1=CC(=C(C=C1)O)C(=O)OC	{1: 2, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	22719-28-4	C1=CC(=CC=C1NNC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8, 31: 2}
Did not match all atoms present	2272-45-9	CC1=CC=C(C=C1)N=CC2=CC=CC=C2	{1: 1, 34: 1, 14: 9, 6: 1}
Did not match all atoms present	22726-00-7	C1=CC(=CC(=C1)Br)C(=O)N	{24: 1, 18: 1, 30: 1, 14: 4}
Did not match all atoms present	22729-75-5	CS(=O)(=O)N(C1=CC=CC=C1)SC(C(F)(Cl)Cl)(Cl)Cl	{1: 1, 4: 2, 33: 1, 40: 1, 14: 5, 16: 1, 17: 4, 29: 2}
Did not match all atoms present	2273-43-0	CCCC[Sn](=O)O	{1: 1, 2: 3, 20: 1, 29: 1}
Did not match all atoms present	2273-45-2	C[Sn](=O)C	{1: 2, 29: 1}
Did not match all atoms present	2273-46-3	CCCCC[Sn](=O)CCCCC	{1: 2, 2: 8, 29: 1}
Did not match all atoms present	2273-51-0	C1=CC=C(C=C1)[Sn](=O)C2=CC=CC=C2	{29: 1, 14: 10}
Did not match all atoms present	22737-36-6	C[Si](C)(C)ON	{1: 3, 30: 1, 22: 1}
Did not match all atoms present	22737-37-7	C[Si](C)(C)NO[Si](C)(C)C	{1: 6, 22: 1, 31: 1}
Did not match all atoms present	2274-42-2	CS(=O)(=O)CC#N	{1: 1, 2: 1, 29: 2, 37: 1}
Did not match all atoms present	2274-66-0	C1=CC(=C(C=C1Cl)Cl)C(=O)C(Cl)Cl	{24: 1, 17: 4, 3: 1, 14: 3}
Did not match all atoms present	2274-74-0	C1=CC(=CC=C1SN=NC2=CC(=C(C=C2Cl)Cl)Cl)Cl	{40: 1, 17: 4, 34: 2, 14: 6}
Did not match all atoms present	22749-43-5	C1=CC=C2C(=C1)C3=CC=CC=C3P(O2)Cl	{17: 1, 14: 8, 23: 1}
Did not match all atoms present	2275-14-1	CCOP(=S)(OCC)SCSC1=C(C=CC(=C1)Cl)Cl	{1: 2, 2: 3, 40: 2, 14: 3, 17: 2, 22: 2}
Did not match all atoms present	2275-18-5	CCOP(=S)(OCC)SCC(=O)NC(C)C	{1: 4, 2: 3, 3: 1, 40: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	2275-23-2	CC(C(=O)NC)SCCSP(=O)(OC)OC	{1: 4, 2: 2, 3: 1, 40: 2, 22: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	2275-61-8	CNP(=O)(N1CC1)N2CC2	{1: 1, 33: 2, 11: 4, 29: 1, 31: 1}
Did not match all atoms present	2275-81-2	CCCNP(=O)(N1CC1)N2CC2	{33: 2, 2: 2, 1: 1, 11: 4, 29: 1, 31: 1}
Did not match all atoms present	22750-65-8	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=CC=C3NC(=O)C	{24: 2, 1: 2, 11: 1, 14: 6, 31: 2}
Did not match all atoms present	22750-69-2	C(C=CN=[N+]=[N-])N=[N+]=[N-]	{2: 1, 34: 4, 6: 2}
Did not match all atoms present	22751-23-1	C1=CC=C(C(=C1)CC(=O)Cl)[N+](=O)[O-]	{24: 1, 17: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	22753-24-8	C1=CC2=C(C(=C1)S(=O)(=O)O)C(=O)C3=C(C2=O)C=CC=C3S(=O)(=O)[O-].[K+]	{25: 2, 20: 1, 29: 5, 14: 6}
Did not match all atoms present	22755-01-7	O=[SiH2]	{29: 1}
Did not match all atoms present	22755-15-3	CC(=O)NC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	22755-36-8	C[N+](C)(C)[O-].OCl(=O)(=O)=O	{1: 3, 20: 1, 29: 4, 17: 1}
Did not match all atoms present	22756-14-5	O.[Mg+2].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	22758-34-5	CCOC(CNC1=CC=CC=C1)OCC	{1: 2, 2: 3, 3: 1, 14: 5, 22: 2, 31: 1}
Did not match all atoms present	2276-40-6	C1=CC=C(C=C1)/C(=C/C(=O)C2=CC=CC=C2)/S	{24: 1, 39: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	2276-90-6	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)NC)I	{24: 2, 1: 2, 19: 3, 27: 1, 31: 2}
Did not match all atoms present	22760-18-5	CC1=CC2=C(C=C1)C(=NC(=O)N2C(C)C)C3=CC=CC=C3	{1: 3, 3: 1, 33: 1, 14: 8, 35: 1, 25: 1}
Did not match all atoms present	22764-81-4	CCN(CC)C(=S)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 2, 33: 1, 7: 1, 14: 2, 17: 3, 22: 1}
Did not match all atoms present	22767-50-6	CCCCCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 6, 29: 3}
Did not match all atoms present	22767-77-7	C/C=C/C1=CC=CC2=CC=CC=C21	{1: 1, 14: 7, 6: 2}
Did not match all atoms present	22767-82-4	CCOP(=O)(NC1=C(C=C(C=C1)C)C)OCC	{1: 4, 2: 2, 14: 3, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	22767-95-9	CC(C)OC(=O)CCC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	2277-92-1	C1=C(C=C(C(=C1Cl)O)NC(=O)C2=C(C(=CC(=C2Cl)Cl)Cl)O)Cl	{24: 1, 17: 5, 21: 2, 14: 3, 31: 1}
Did not match all atoms present	22771-17-1	C1CCC(CC1)[Sn](=O)C2CCCCC2	{11: 10, 12: 2, 29: 1}
Did not match all atoms present	22771-18-2	C1CCC(CC1)[Sn](=O)O	{20: 1, 11: 5, 12: 1, 29: 1}
Did not match all atoms present	22771-99-9	C1COCCN1S(=O)(=O)C2=CC=C(C=C2)Cl	{33: 1, 11: 4, 14: 4, 17: 1, 23: 1, 29: 2}
Did not match all atoms present	22774-81-8	CC(=C)CNC1=CC=CC=C1	{1: 1, 2: 1, 5: 1, 7: 1, 14: 5, 31: 1}
Did not match all atoms present	227750-12-1	COC1=CC=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC4=NC(=NC(=N4)N5CCN(CC5)CCN)N6CCN(CC6)CCN)S(=O)(=O)O	{1: 1, 2: 4, 35: 3, 33: 4, 11: 8, 34: 1, 14: 8, 15: 2, 20: 1, 22: 1, 25: 1, 29: 2, 30: 2, 31: 2}
Did not match all atoms present	227754-04-3	CCO[Si](C)(CC[Si](C)(C)O[Si](C)(C)CC[Si](C)(OCC)OCC)OCC	{1: 10, 2: 8, 22: 5}
Did not match all atoms present	227783-28-0	CC1=CC(=CC=C1)C.C1CCCC1.[Al-](Cl)(Cl)(Cl)Cl.[Fe]	{1: 2, 11: 5, 14: 4, 17: 4}
Did not match all atoms present	2278-22-0	CC(=O)OO[N+](=O)[O-]	{1: 1, 28: 1, 22: 1}
Did not match all atoms present	2278-50-4	C1=CC=C2C(=C1)C3=NN4C5=CC=C6C7=C(C8=C(C=C7)NC9=C8C=CC1=C9C(=O)C7=CC=CC=C7C1=O)C(=O)C1=C6C5=C(C=C1)C1=C4C3=C(C2=O)C=C1	{32: 1, 25: 4, 35: 1, 14: 18, 33: 1}
Did not match all atoms present	22781-23-3	CC1(OC2=C(O1)C(=CC=C2)OC(=O)NC)C	{1: 3, 13: 1, 14: 3, 23: 2, 28: 1, 31: 1}
Did not match all atoms present	22788-18-7	C(COP(=O)(N)N(CCCl)CCCl)C(=O)O	{33: 1, 2: 6, 17: 2, 22: 1, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	2279-64-3	C1=CC=C(C=C1)[Hg]NC(=O)N	{24: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	2279-76-7	CCC[Sn](CCC)(CCC)Cl	{1: 3, 2: 6, 17: 1}
Did not match all atoms present	22791-18-0	CNC(=O)OC1=CC=CC2=C1OC3(O2)CCCCC3	{1: 1, 11: 5, 13: 1, 14: 3, 23: 2, 28: 1, 31: 1}
Did not match all atoms present	22791-23-7	CNC(=O)OC1=CC=CC2=C1OCO2	{1: 1, 11: 1, 14: 3, 23: 2, 28: 1, 31: 1}
Did not match all atoms present	22791-33-9	CC(=O)N(C)C(=O)OC1=CC=CC2=C1OC(O2)(C)C	{1: 4, 33: 1, 13: 1, 14: 3, 23: 2, 24: 1, 28: 1}
Did not match all atoms present	22791-64-6	C1C2=C(C=CC(=C2)N)OCO1	{11: 2, 30: 1, 14: 3, 23: 2}
Did not match all atoms present	22791-95-3	CC(C)C1=C(C(=CC=C1)C(C)(C)C)O	{1: 5, 3: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	22797-20-2	CCS(=O)(=O)C1=CC2=C(C=C1)N(C3=CC=CC=C3C(=O)N2CCN(C)C)C	{1: 4, 2: 3, 33: 3, 14: 7, 25: 1, 29: 2}
Did not match all atoms present	22802-39-7	CC1=CC(=C(C=C1C)Br)O	{1: 2, 18: 1, 21: 1, 14: 2}
Did not match all atoms present	22803-29-8	CCCC[Si]1(O[Si](O[Si](O[Si](O1)(C)ON(CC)CC)(C)ON(CC)CC)(C)ON(CC)CC)C	{1: 11, 2: 9, 33: 3, 22: 3, 23: 4}
Did not match all atoms present	22806-79-7	[Au+3].[C-]#N.[C-]#N.[C-]#N.[C-]#N	{}
Did not match all atoms present	22807-99-4	COC1=CC(=C(C(=C1)OC)CC2=CC=CC=C2)OC	{1: 3, 2: 1, 22: 3, 14: 7}
Did not match all atoms present	2281-78-9	CC(C)NC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl	{1: 2, 3: 1, 14: 4, 17: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	22810-27-1	C1=CC=C2C(=C1)C(=O)C=CS2(=O)=O	{25: 1, 29: 2, 14: 6}
Did not match all atoms present	22817-48-7	C1CCN(CC1)C2=C3C=CC=NC3=C4C(=C2)C(=O)C5=CC=CC=C5C4=O	{25: 2, 11: 5, 35: 1, 14: 8, 33: 1}
Did not match all atoms present	22817-49-8	C1COCCN1C2=C3C=CC=NC3=C4C(=C2)C(=O)C5=CC=CC=C5C4=O	{33: 1, 35: 1, 11: 4, 14: 8, 23: 1, 25: 2}
Did not match all atoms present	22818-40-2	C1=CC(=CC=C1[C@H](C(=O)O)N)O	{27: 1, 30: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	2282-34-0	CCCC(C)C1=CC(=CC=C1)OC(=O)NC	{1: 3, 2: 2, 3: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	2282-84-0	CC1=CC(=C(C(=C1)C)C(=O)OC)C	{1: 4, 28: 1, 14: 2}
Did not match all atoms present	2282-89-5	CCC1=C(C(=CC=C1)CC)OC(=O)C(C)[NH+](CC)CC.[Cl-]	{1: 5, 2: 4, 3: 1, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	22820-24-2	CCCN(CCN1CCOCC1)CC(COC2=CC=C(C=C2)Cl)O.Cl.Cl	{1: 1, 2: 6, 3: 1, 33: 2, 11: 4, 14: 4, 17: 3, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	22821-69-8	COC(=O)C1=CC(=CC=C1)S(=O)(=O)C	{1: 2, 28: 1, 29: 2, 14: 4}
Did not match all atoms present	22821-70-1	COC(=O)C1=CC=C(C=C1)S(=O)(=O)C	{1: 2, 28: 1, 29: 2, 14: 4}
Did not match all atoms present	22821-75-6	CS(=O)(=O)C1=CC=CC(=C1)C#N	{1: 1, 29: 2, 14: 4, 37: 1}
Did not match all atoms present	22821-76-7	CS(=O)(=O)C1=CC=C(C=C1)C#N	{1: 1, 29: 2, 14: 4, 37: 1}
Did not match all atoms present	22821-80-3	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)C	{24: 1, 1: 2, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	22824-31-3	CC1(CCC(C2=C1C=CC(=C2)O)(C)C)C	{1: 4, 11: 2, 13: 2, 14: 3, 21: 1}
Did not match all atoms present	2283-08-1	C1=CC=C2C(=C1)C=CC(=C2C(=O)O)O	{27: 1, 21: 1, 14: 6}
Did not match all atoms present	2283-11-6	CCN(CC)P(N(CC)CC)N(CC)CC	{1: 6, 2: 6, 33: 3}
Did not match all atoms present	22830-45-1	C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.O.O.[Fe+2]	{24: 2, 2: 2, 3: 8, 20: 10}
Did not match all atoms present	22831-39-6	[Mg]=[Si]=[Mg]	{}
Did not match all atoms present	22831-42-1	[Al]#[As]	{}
Did not match all atoms present	22832-87-7	C1=CC(=C(C=C1Cl)Cl)COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl.[N+](=O)(O)[O-]	{33: 1, 2: 2, 3: 1, 14: 9, 17: 4, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	22839-47-0	COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(=O)O)N	{1: 1, 2: 2, 3: 2, 14: 5, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	2284-20-0	COC1=CC=C(C=C1)N=C=S	{8: 1, 1: 1, 34: 1, 22: 1, 14: 4}
Did not match all atoms present	2284-30-2	C1=CC=C(C=C1)CC2=C(C=C(C=C2)O)O	{2: 1, 21: 2, 14: 8}
Did not match all atoms present	22843-73-8	C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=C(C=C8)[N+](=O)[O-])C9=CC=C(C=C9)[N+](=O)[O-])N3)[N+](=O)[O-]	{32: 2, 35: 2, 38: 4, 14: 24}
Did not match all atoms present	2285-12-3	C1=CC=C(C(=C1)C(F)(F)F)N=C=O	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 29: 1}
Did not match all atoms present	22853-00-5	[O].[O].[Pu+2]	{}
Did not match all atoms present	22853-17-4	[Al+].[O-].[O-].[O]	{}
Did not match all atoms present	22855-70-5	C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].[Ag+].[Ag+]	{17: 2, 25: 2, 15: 4}
Did not match all atoms present	22856-27-5	N([GeH3])([GeH3])[GeH3]	{33: 1}
Did not match all atoms present	22856-30-0	C1=CC=C2C=C(C(=CC2=C1)C#N)C#N	{37: 2, 14: 6}
Did not match all atoms present	22859-36-5	COC[Si](OC)(OC)OC	{1: 4, 2: 1, 22: 4}
Did not match all atoms present	22862-76-6	CC(=O)OC1C(CNC1CC2=CC=C(C=C2)OC)O	{32: 1, 1: 2, 2: 1, 11: 1, 12: 3, 14: 4, 20: 1, 22: 1, 28: 1}
Did not match all atoms present	22867-74-9	CCC1=CC=CC2=C1NC=C2	{32: 1, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	22868-13-9	[Na+].[Na+].[S-][S-]	{}
Did not match all atoms present	22868-76-4	CC1=CN=C(N=C1)C	{1: 2, 35: 2, 14: 2}
Did not match all atoms present	22871-55-2	CCOC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 27: 1, 28: 1}
Did not match all atoms present	22873-89-8	CC(=O)NC1=CC=CC2=C1/C(=N/NC3=C(C=CC(=C3)[N+](=O)[O-])O)/C(=O)C=C2	{1: 1, 34: 1, 38: 1, 14: 8, 15: 1, 21: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	22876-20-6	C1=CC2=C(C=C1Cl)OC(=S)N2	{32: 1, 17: 1, 14: 3, 23: 1}
Did not match all atoms present	22876-29-5	CCOC(=O)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 1, 14: 2, 17: 3}
Did not match all atoms present	22877-95-8	[O].[Sb+]	{}
Did not match all atoms present	22878-02-0	[Am+].[O].[O]	{}
Did not match all atoms present	2288-13-3	C[Si]12OCCN(CCO1)CCO2	{1: 1, 11: 6, 33: 1, 23: 3}
Did not match all atoms present	2288-18-8	C=CC(=C)C1=CC=CC=C1	{14: 5, 5: 2, 6: 1, 7: 1}
Did not match all atoms present	22881-35-2	CC(C)C1=C(N(N(C1=O)C2=CC=CC=C2)C)CN(C)C(C)CC3=CC=CC=C3	{1: 5, 2: 2, 3: 2, 33: 3, 14: 10, 25: 1}
Did not match all atoms present	22884-29-3	CC(C)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 2, 2: 1, 3: 1, 18: 1, 14: 15}
Did not match all atoms present	22884-95-3	CC1=C(C=C(C=C1)C#N)C	{1: 2, 37: 1, 14: 3}
Did not match all atoms present	22886-66-4	O.O.O.[F-].[F-].[F-].[Ga+3]	{16: 3}
Did not match all atoms present	22898-01-7	C(C(C(=O)[O-])(F)F)(F)F.[Na+]	{16: 4, 24: 1, 3: 1, 4: 1}
Did not match all atoms present	229-67-4	C1=CC=C2C(=C1)C=CC3=C2C=CN=C3	{35: 1, 14: 9}
Did not match all atoms present	229-87-8	C1=CC=C2C(=C1)C=NC3=CC=CC=C23	{35: 1, 14: 9}
Did not match all atoms present	229-95-8	C1C2=CC=CC=C2C3=CC=CC=C3O1	{11: 1, 14: 8, 23: 1}
Did not match all atoms present	2290-58-6	C[Ge](C)(C)C#C	{1: 3, 10: 1, 9: 1}
Did not match all atoms present	2290-65-5	C[Si](C)(C)N=C=S	{8: 1, 1: 3, 34: 1}
Did not match all atoms present	2290-89-3	C1=CC=C(C=C1)CNC2=CC=CC=C2.Cl	{17: 1, 2: 1, 14: 10, 31: 1}
Did not match all atoms present	22900-44-3	CC1(C2=CC=C(O2)C(C3=CC=C(O3)C(C4=CC=C(O4)C(C5=CC=C1O5)(C)C)(C)C)(C)C)C	{1: 8, 13: 4, 14: 8, 23: 4}
Did not match all atoms present	22900-79-4	CC1=CC(=CC(=C1O)C)NC(=O)C	{24: 1, 1: 3, 21: 1, 14: 2, 31: 1}
Did not match all atoms present	22904-40-1	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Pb+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	2291-80-7	CC(C)COC(=O)NC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	22913-11-7	CC(C)OC(=O)C1=CC=C(C=C1)Cl	{1: 2, 3: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	22913-24-2	COC(=O)C1=CC2=CC=CC=C2S1	{1: 1, 28: 1, 14: 5, 41: 1}
Did not match all atoms present	22916-47-8	C1=CC(=C(C=C1Cl)Cl)COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl	{33: 1, 2: 2, 3: 1, 14: 9, 17: 4, 35: 1, 22: 1}
Did not match all atoms present	22921-10-4	CC1=CC=C(C=C1)OC(C)C	{1: 3, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	22921-72-8	C1=CC=C(C=C1)OCCCCCBr	{2: 5, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	22924-15-8	CCOC1=CC=CC(=C1)C=O	{1: 1, 2: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	22927-13-5	CCC1=CC=CC=C1C=O	{1: 1, 2: 1, 26: 1, 14: 4}
Did not match all atoms present	22935-72-4	CCOP(=S)(OCC)OC1=CC=C(C=C1)/C=N/OC(=O)N2CCOCC2	{1: 2, 2: 2, 6: 1, 33: 1, 11: 4, 34: 1, 14: 4, 22: 3, 23: 1, 28: 1}
Did not match all atoms present	22936-03-4	CCOP(=S)(OCC)OC1=C(C=C(C=C1)/C=N/OC(=O)NC)OC	{1: 4, 2: 2, 6: 1, 34: 1, 14: 3, 22: 4, 28: 1, 31: 1}
Did not match all atoms present	22936-17-0	CCOP(=S)(OCC)OC1=CC=C(C=C1)/C(=N\OC(=O)NC(C)C)/C	{1: 5, 2: 2, 3: 1, 7: 1, 34: 1, 14: 4, 22: 3, 28: 1, 31: 1}
Did not match all atoms present	22936-20-5	CCCCNC(=O)ON=C(C)C1=CC=C(C=C1)OP(=S)(OCC)OCC	{1: 4, 2: 5, 7: 1, 34: 1, 14: 4, 22: 3, 28: 1, 31: 1}
Did not match all atoms present	22936-34-1	CCOC(=O)O/N=C(\C)/C1=CC=C(C=C1)OP(=S)(OCC)OCC	{1: 4, 2: 3, 7: 1, 34: 1, 14: 4, 22: 3}
Did not match all atoms present	22936-44-3	CCOP(=S)(OCC)OC1=CC(=C(C=C1)/C(=N\OC(=O)C)/C)C	{1: 5, 2: 2, 7: 1, 34: 1, 14: 3, 22: 3, 28: 1}
Did not match all atoms present	22936-69-2	CCNC1=NC(=NC(=N1)Cl)NC(C)C(C)C	{1: 4, 2: 1, 3: 2, 17: 1, 35: 3, 31: 2}
Did not match all atoms present	22936-75-0	CCNC1=NC(=NC(=N1)SC)NC(C)C(C)C	{1: 5, 2: 1, 3: 2, 40: 1, 35: 3, 31: 2}
Did not match all atoms present	22936-86-3	CC(C)NC1=NC(=NC(=N1)NC2CC2)Cl	{1: 2, 3: 1, 11: 2, 12: 1, 17: 1, 35: 3, 31: 2}
Did not match all atoms present	2294-43-1	C=CCC1=CC=C(C=C1)Br	{18: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	2294-47-5	C1=CC(=N[N+]#N)C=CC1=NN=[N-]	{34: 4, 14: 4, 15: 2}
Did not match all atoms present	2294-71-5	CCC(C1=CC=CC=C1)C(=O)OC	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	2294-76-0	CCCCCC1=CC=CC=N1	{1: 1, 2: 4, 35: 1, 14: 4}
Did not match all atoms present	2294-82-8	CCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 1, 2: 1, 12: 1, 14: 8}
Did not match all atoms present	2294-94-2	C1=CC=C(C=C1)CC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{2: 1, 4: 1, 14: 20}
Did not match all atoms present	22941-83-9	CCOP(=S)(OCC)OC1=CC=C(C=C1)C(=NOC(=O)NC)C	{1: 4, 2: 2, 7: 1, 34: 1, 14: 4, 22: 3, 28: 1, 31: 1}
Did not match all atoms present	22941-96-4	CCOP(=S)(OCC)OC1=CC=C(C=C1)/C=N/OC(=O)NC	{1: 3, 2: 2, 6: 1, 34: 1, 14: 4, 22: 3, 28: 1, 31: 1}
Did not match all atoms present	22942-02-5	CCCCNC(=O)O/N=C/C1=CC=C(C=C1)OP(=S)(OCC)OCC	{1: 3, 2: 5, 6: 1, 34: 1, 14: 4, 22: 3, 28: 1, 31: 1}
Did not match all atoms present	22942-43-4	CCOP(=S)(OCC)OC1=CC=C(C=C1)/C(=N\OC(=O)N(C)C)/C	{1: 5, 2: 2, 33: 1, 7: 1, 34: 1, 14: 4, 22: 3, 28: 1}
Did not match all atoms present	22942-83-2	C1CC(=C2C1=C3C=CC=CC3=N2)NO	{35: 1, 11: 2, 14: 4, 15: 3, 20: 1, 31: 1}
Did not match all atoms present	22946-41-4	CC1C=CN(C(=O)N1C)C.OS(=O)(=O)O	{1: 3, 33: 2, 12: 1, 14: 2, 20: 2, 25: 1, 29: 2}
Did not match all atoms present	22948-02-3	C1=CC(=CC(=C1)S)N	{30: 1, 14: 4, 39: 1}
Did not match all atoms present	22948-06-7	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)N	{4: 1, 30: 1, 14: 19}
Did not match all atoms present	22949-08-2	CC(=O)N1CCC2=C1C=C(C=C2)[N+](=O)[O-]	{1: 1, 38: 1, 33: 1, 11: 2, 14: 3, 24: 1}
Did not match all atoms present	2295-05-8	C[Si](C)(C)CCC[Si](C)(C)C	{1: 6, 2: 3}
Did not match all atoms present	2295-12-7	C[Si]1(CCC1)C	{1: 2, 11: 3}
Did not match all atoms present	2295-13-8	CC1C[Si](C1)(C)C	{1: 3, 11: 2, 12: 1}
Did not match all atoms present	2295-24-1	CCC[Si](CCC)(Cl)Cl	{1: 2, 2: 4, 17: 2}
Did not match all atoms present	2295-35-4	C1CC(=S)NC1	{32: 1, 11: 3, 15: 1}
Did not match all atoms present	2295-58-1	CCC(=O)C1=C(C=C(C=C1O)O)O	{24: 1, 1: 1, 2: 1, 21: 3, 14: 2}
Did not match all atoms present	22952-87-0	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@@H](CC4)N=[N+]=[N-]	{1: 1, 34: 2, 33: 1, 11: 5, 12: 4, 13: 1, 14: 2, 21: 1, 23: 1}
Did not match all atoms present	22955-73-3	COC1=C(C=C(C=C1)C(=O)OC)C(=O)OC	{1: 3, 28: 2, 22: 1, 14: 3}
Did not match all atoms present	22958-08-3	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@@H](CC4)N=[N+]=[N-]	{1: 2, 34: 2, 33: 1, 11: 5, 12: 4, 13: 1, 14: 2, 22: 1, 23: 1}
Did not match all atoms present	22963-62-8	CSC1=C(C(=NC(=C1Cl)Cl)Cl)Cl	{40: 1, 1: 1, 35: 1, 17: 4}
Did not match all atoms present	22966-23-0	C1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)Br	{24: 1, 18: 1, 14: 9, 6: 2}
Did not match all atoms present	22966-79-6	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)CC4=CC=C(C=C4)N(CCCl)CCCl)CCC5=C3C=CC(=C5)OC(=O)CC6=CC=C(C=C6)N(CCCl)CCCl	{1: 1, 2: 10, 33: 2, 11: 6, 12: 4, 13: 1, 14: 11, 17: 4, 28: 2}
Did not match all atoms present	22966-83-2	C1=CC(=CC=C1NC(=O)N(CCCl)CCCl)[N+](=O)[O-]	{33: 1, 2: 4, 38: 1, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	22967-56-2	[O].[O].[Pu+]	{}
Did not match all atoms present	22967-92-6	C[Hg+]	{1: 1}
Did not match all atoms present	22968-45-2	C1=C[Se]C(=C1)C(=O)O	{27: 1, 14: 3}
Did not match all atoms present	2297-64-5	C1=CC(=CC=C1S(=O)(=O)NN)Br	{18: 1, 30: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	22971-62-6	C1=CSC(=C1)C(=O)CCCC(=O)O	{24: 1, 41: 1, 2: 3, 27: 1, 14: 3}
Did not match all atoms present	22975-58-2	CCC(CC)C1=CC=C(C=C1)C	{1: 3, 2: 2, 3: 1, 14: 4}
Did not match all atoms present	22975-76-4	CC1=CC(=O)OC2=C1C=CC3=C2C(=CO3)C	{1: 2, 28: 1, 14: 4, 23: 1}
Did not match all atoms present	2298-13-7	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N)C.Cl	{1: 2, 34: 2, 30: 1, 14: 7, 17: 1}
Did not match all atoms present	22981-32-4	C(#N)O.N	{20: 1, 37: 1}
Did not match all atoms present	22987-10-6	CCC(=O)NC1=CC=CC(=C1)N	{1: 1, 2: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	22989-67-9	CC1=CC=C(C(=S)N1)O	{32: 1, 1: 1, 21: 1, 14: 2}
Did not match all atoms present	2299-73-2	COC1=CC=C(C=C1)C=NN=CC2=CC=C(C=C2)OC	{1: 2, 22: 2, 34: 2, 14: 8, 6: 2}
Did not match all atoms present	230-07-9	C1=CC2=C(C=CC3=C2C=CC=N3)N=C1	{35: 2, 14: 8}
Did not match all atoms present	230-17-1	C1=CC=C2C(=C1)C3=CC=CC=C3N=N2	{35: 2, 14: 8}
Did not match all atoms present	230-27-3	C1=CC=C2C(=C1)C=CC3=C2N=CC=C3	{35: 1, 14: 9}
Did not match all atoms present	230-46-6	C1=CC2=C(C3=C(C=C2)N=CC=C3)N=C1	{35: 2, 14: 8}
Did not match all atoms present	2300-15-4	CC(C)(C1=CC=C(C=C1)O)C2=CC(=C(C=C2)O)C(C)(C)C3=CC=C(C=C3)O	{1: 4, 4: 2, 21: 3, 14: 11}
Did not match all atoms present	2300-87-0	CCCC(C)(C)C(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 3, 2: 2, 4: 2, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	2300-88-1	CCC(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	23001-29-8	CC1(C2=CC=CC=C2N(C13C=CC4=C(O3)C=CC(=C4)O)C)C	{1: 3, 33: 1, 13: 2, 14: 9, 21: 1, 23: 1}
Did not match all atoms present	23003-25-0	CC1=NC(=C(C=C1)O)SC	{40: 1, 1: 2, 35: 1, 21: 1, 14: 2}
Did not match all atoms present	23003-30-7	CC1=NC(=C(C=C1)O)I	{1: 1, 19: 1, 21: 1, 14: 2, 35: 1}
Did not match all atoms present	23003-43-2	CC1=[N+]2CCSC2=C(C=C1)[O-]	{1: 1, 11: 2, 41: 1, 14: 2, 33: 1}
Did not match all atoms present	23003-45-4	C1CSC2=C(C=CC=[N+]21)[O-]	{33: 1, 11: 2, 14: 3, 41: 1}
Did not match all atoms present	23007-85-4	CN1CCC(=CC1)C2=CC=CC=C2.Cl	{1: 1, 33: 1, 11: 3, 14: 6, 15: 1, 17: 1}
Did not match all atoms present	2301-25-9	C1=CC(=CC=C1N2C=CN=C2)[N+](=O)[O-]	{33: 1, 35: 1, 38: 1, 14: 7}
Did not match all atoms present	2301-52-2	C1=CC=C2C(=C1)C(=O)N(C2=O)C(CCC(=O)O)C(=O)O	{33: 1, 2: 2, 3: 1, 14: 4, 25: 2, 27: 2}
Did not match all atoms present	23012-11-5	CC1=CN=C(O1)C	{1: 2, 35: 1, 14: 1, 23: 1}
Did not match all atoms present	2302-80-9	CCCCP(=O)(Cl)Cl	{1: 1, 2: 3, 29: 1, 17: 2}
Did not match all atoms present	2302-84-3	C(=O)NNC(=S)N	{26: 1, 31: 2, 30: 1, 7: 1}
Did not match all atoms present	2302-88-7	CC(=O)NNC(=S)N	{24: 1, 1: 1, 31: 2, 30: 1, 7: 1}
Did not match all atoms present	2302-93-4	C/C(=N\NC(=S)N)/C1=CC=CC=C1	{1: 1, 34: 1, 7: 2, 14: 5, 30: 1, 31: 1}
Did not match all atoms present	2302-95-6	CC=NC(=S)NN	{1: 1, 34: 1, 6: 1, 7: 1, 30: 1, 31: 1}
Did not match all atoms present	2302-96-7	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C\3/C4=C(C=CC3=O)C=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 11, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	2302-97-8	C1=CC2=C(/C(=N/NC3=CC=C(C=C3)C4=CC=C(C=C4)N/N=C\5/C6=C(C=CC5=O)C=CC=C6S(=O)(=O)[O-])/C(=O)C=C2)C(=C1)S(=O)(=O)[O-].[Na+].[Na+]	{34: 2, 14: 18, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	23022-40-4	C[Sn](C)(C)C1C=CC2=CC=CC=C12	{1: 3, 12: 1, 14: 6}
Did not match all atoms present	23022-83-5	CC(=O)C(C1=CC=CC=C1)Br	{24: 1, 1: 1, 18: 1, 3: 1, 14: 5}
Did not match all atoms present	23026-73-5	CC1=CC2=CSC=C2C=C(C1=O)C	{1: 2, 41: 1, 14: 4, 25: 1}
Did not match all atoms present	23031-15-4	CC(=CC1C(C1(C)C)C(=O)OCC2=CC=C(O2)CC#C)C	{1: 4, 2: 2, 6: 1, 7: 1, 9: 1, 10: 1, 12: 2, 13: 1, 14: 2, 23: 1, 28: 1}
Did not match all atoms present	23031-25-6	CC(C)(C)NCC(C1=CC(=CC(=C1)O)O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 3, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	23031-32-5	CC(C)(C)NCC(C1=CC(=CC(=C1)O)O)O.CC(C)(C)NCC(C1=CC(=CC(=C1)O)O)O.OS(=O)(=O)O	{1: 6, 2: 2, 3: 2, 4: 2, 14: 6, 20: 4, 21: 4, 29: 2, 31: 2}
Did not match all atoms present	23032-93-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.O=[Re]=O.I	{19: 1, 29: 2, 14: 30}
Did not match all atoms present	23034-56-2	CCN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)C5=CC=CC=C51	{1: 1, 2: 1, 33: 1, 34: 1, 14: 12, 29: 2, 31: 1}
Did not match all atoms present	23038-61-1	CC1=C(C=C(C=C1)C(=O)OC)C(=O)OC	{1: 3, 28: 2, 14: 3}
Did not match all atoms present	23039-94-3	C1=CC(=CC(=C1)P(C2=CC=CC(=C2)F)C3=CC=CC(=C3)F)F	{16: 3, 14: 12}
Did not match all atoms present	2304-30-5	CCCC[P+](CCCC)(CCCC)CCCC.[Cl-]	{1: 4, 2: 12, 17: 1}
Did not match all atoms present	2304-85-0	C1=CC2=C3C(=CC=C4C3=C1C=CC4=O)C(=O)C=C2	{25: 2, 14: 8}
Did not match all atoms present	2304-96-3	C1=CC=C(C=C1)COC(=O)N[C@@H](CC(=O)N)C(=O)O	{2: 2, 3: 1, 14: 5, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	23042-75-3	CC(=O)NC1=C(C=C(C=C1)OC)OC	{24: 1, 1: 3, 22: 2, 14: 3, 31: 1}
Did not match all atoms present	23043-52-9	CC(=O)NC1=C2C=CC=CC2=NC3=CC=CC=C31	{24: 1, 1: 1, 35: 1, 14: 8, 31: 1}
Did not match all atoms present	2305-13-7	COC1=C(C=CC(=C1)CCCO)O	{1: 1, 2: 3, 14: 3, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	2305-36-4	CC1=CC(=C(C=C1)C(=O)O)N	{1: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	2305-75-1	CC1=CC(=CC=C1)N=CN(C)C	{1: 3, 34: 1, 14: 4, 6: 1, 33: 1}
Did not match all atoms present	23056-29-3	C1CNCCC1NC2=CC=CC=C2	{32: 1, 11: 4, 12: 1, 14: 5, 31: 1}
Did not match all atoms present	23056-33-9	CC1=CC(=NC=C1[N+](=O)[O-])Cl	{1: 1, 35: 1, 38: 1, 14: 2, 17: 1}
Did not match all atoms present	23058-19-7	[Se+6]	{}
Did not match all atoms present	2306-33-4	CCOC(=O)C1=CC=CC=C1C(=O)O	{1: 1, 2: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	23060-42-6	COC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O	{1: 1, 14: 10, 22: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	23062-34-2	C1C2=CSC=C2C3=CSC=C3CO1	{41: 2, 11: 2, 14: 4, 23: 1}
Did not match all atoms present	23063-31-2	CC1=C(C1C2=CC=CC=C2)C	{1: 2, 12: 1, 14: 5, 15: 2}
Did not match all atoms present	23063-36-7	CC1=CC=C(C=C1)C(Cl)Cl	{1: 1, 3: 1, 14: 4, 17: 2}
Did not match all atoms present	23065-80-7	[O-]S(=O)(=O)[O-].[Pt+2]	{29: 4}
Did not match all atoms present	23068-34-0	C1=CC(=C(C(=C1)Cl)Cl)N.Cl	{17: 3, 30: 1, 14: 3}
Did not match all atoms present	23069-99-0	C1=CC=C(C=C1)CCNC=O	{2: 2, 26: 1, 14: 5, 31: 1}
Did not match all atoms present	2307-49-5	COC1=C(C(=C(C=C1Cl)Cl)Cl)C(=O)O	{1: 1, 27: 1, 22: 1, 14: 1, 17: 3}
Did not match all atoms present	2307-68-8	CCCC(C)C(=O)NC1=CC(=C(C=C1)C)Cl	{1: 3, 2: 2, 3: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	2307-97-3	CCC(=O)O[C@@]1(CCN2CCCC[C@H]2C1)C3=CC=CC=C3.Cl	{1: 1, 2: 1, 33: 1, 11: 7, 12: 1, 13: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	23074-10-4	CCC1=CC=C(O1)C=O	{1: 1, 2: 1, 26: 1, 14: 2, 23: 1}
Did not match all atoms present	23079-28-9	CC(C)CCP(=O)(CCC(C)C)CCC(C)C	{1: 6, 2: 6, 3: 3, 29: 1}
Did not match all atoms present	23079-65-4	CCCCOC1=CC=CC(=C1)C	{1: 2, 2: 3, 22: 1, 14: 4}
Did not match all atoms present	2308-61-4	C1=CC=C(C=C1)CC2C(=O)NC(C(=O)N2)CC3=CC=CC=C3	{32: 2, 25: 2, 2: 2, 12: 2, 14: 10}
Did not match all atoms present	23086-43-3	C/C=C/CCCC1=CC=CC=C1	{1: 1, 2: 3, 14: 5, 6: 2}
Did not match all atoms present	23087-46-9	CC(=O)O.N.[Cu]	{1: 1, 27: 1}
Did not match all atoms present	2309-47-9	CC(C1=CC=CS1)O	{1: 1, 3: 1, 20: 1, 14: 3, 41: 1}
Did not match all atoms present	2309-48-0	C1=CSC(=C1)C=CC(=O)C2=CC=CS2	{24: 1, 41: 2, 14: 6, 6: 2}
Did not match all atoms present	2309-49-1	CN1C2=C(N(C1=O)C)N(C(=O)N(C2=O)C)C	{1: 4, 33: 4, 25: 3}
Did not match all atoms present	23092-17-3	C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(F)(F)F	{33: 1, 2: 1, 35: 1, 4: 1, 11: 1, 14: 8, 15: 1, 16: 3, 17: 1, 25: 1}
Did not match all atoms present	23093-74-5	CC(C)(C)[NH2+]CC(COC1=CC=CC=C1C#N)O.[Cl-]	{1: 3, 2: 2, 3: 1, 4: 1, 37: 1, 14: 4, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	23095-05-8	COC1=C(C=C(C=C1)Br)S(=O)(=O)Cl	{1: 1, 14: 3, 17: 1, 18: 1, 22: 1, 29: 2}
Did not match all atoms present	231-23-2	C1=CC2=NC=CN=C2C3=NC=CN=C31	{35: 4, 14: 6}
Did not match all atoms present	2310-17-0	CCOP(=S)(OCC)SCN1C2=C(C=C(C=C2)Cl)OC1=O	{1: 2, 2: 3, 33: 1, 40: 1, 14: 3, 17: 1, 22: 2, 28: 1}
Did not match all atoms present	2310-83-0	C(CN(CC(=O)O)CP(=O)(O)O)N(CC(=O)O)CP(=O)(O)O	{33: 2, 2: 6, 27: 2, 20: 4, 29: 2}
Did not match all atoms present	23101-87-3	CC(C=O)N1C(=O)C2=CC=CC=C2C1=O	{1: 1, 3: 1, 33: 1, 14: 4, 25: 2, 26: 1}
Did not match all atoms present	23102-86-5	[13CH](=O)[O-].[Na+]	{26: 1}
Did not match all atoms present	23103-98-2	CC1=C(N=C(N=C1OC(=O)N(C)C)N(C)C)C	{1: 6, 35: 2, 28: 1, 33: 2}
Did not match all atoms present	23107-11-1	CC(C)C(C(C)OC)(C(=O)OCC1=C2[C@H](CCN2C=C1)O)O	{1: 4, 2: 1, 3: 2, 4: 1, 33: 1, 11: 2, 12: 1, 14: 2, 20: 2, 22: 1, 28: 1}
Did not match all atoms present	23107-96-2	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2CC(=O)O	{24: 1, 2: 1, 27: 1, 14: 9}
Did not match all atoms present	23109-05-9	CCC(C)C1C(=O)NCC(=O)NC2CS(=O)C3=C(CC(C(=O)NCC(=O)N1)NC(=O)C(NC(=O)C4CC(CN4C(=O)C(NC2=O)CC(=O)N)O)C(C)C(CO)O)C5=C(N3)C=C(C=C5)O	{32: 8, 1: 3, 2: 3, 3: 3, 33: 1, 11: 6, 12: 7, 14: 3, 20: 3, 21: 1, 24: 1, 25: 8, 29: 1, 30: 1}
Did not match all atoms present	23111-70-8	CC(CC1=CC=CC=C1)N2CC[N+](CC2)(CC3=CC=CC=C3)C(C)CC4=CC=CC=C4.[Br-]	{1: 2, 2: 3, 3: 2, 33: 1, 11: 4, 14: 15, 18: 1}
Did not match all atoms present	23112-96-1	B(C1=C(C=CC=C1OC)OC)(O)O	{1: 2, 20: 2, 22: 2, 14: 3}
Did not match all atoms present	23115-33-5	C[Si](C)(C)OOS(=O)(=O)O[Si](C)(C)C	{1: 6, 29: 2, 22: 3}
Did not match all atoms present	23119-35-9	CCOCCOC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)N)N	{1: 1, 2: 3, 14: 7, 21: 2, 22: 2, 25: 2, 30: 2}
Did not match all atoms present	2312-12-1	CCCCCCCCCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCCCCCCCCC)[O-]	{1: 2, 2: 18, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	2312-14-3	CCCCCCCCCCCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCCCCCCCCCCC)[O-]	{1: 2, 2: 22, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	2312-15-4	CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 11, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	2312-35-8	CC(C)(C)C1=CC=C(C=C1)OC2CCCCC2OS(=O)OCC#C	{1: 3, 2: 1, 4: 1, 9: 1, 10: 1, 11: 4, 12: 2, 14: 4, 22: 3, 29: 1}
Did not match all atoms present	2312-73-4	C1CCOC(C1)N2C=NC3=C2N=CN=C3NCC4=CC=CC=C4	{33: 1, 2: 1, 35: 3, 11: 4, 12: 1, 14: 7, 23: 1, 31: 1}
Did not match all atoms present	2312-76-7	CC1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].[Na+]	{1: 1, 38: 2, 14: 2}
Did not match all atoms present	23120-99-2	C[Sn]C	{1: 2}
Did not match all atoms present	23125-28-2	CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=N2)C(=O)OCC)C)C	{32: 1, 1: 4, 2: 2, 35: 1, 12: 1, 14: 4, 15: 4, 28: 2}
Did not match all atoms present	2313-87-3	CCOC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N.Cl	{1: 1, 2: 1, 34: 2, 14: 7, 17: 1, 22: 1, 30: 2}
Did not match all atoms present	23132-52-7	CC(C)(C)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 3, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	23134-05-6	O=S([O-])S(=O)(=O)[O-]	{29: 5}
Did not match all atoms present	23136-39-2	CC(=O)C1=CC2=C(O1)C=CC(=C2)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4, 23: 1}
Did not match all atoms present	23138-50-3	CCC1=CC=C(C=C1)N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	23138-55-8	C1=CC(=CC(=C1)Br)N=C=O	{8: 1, 18: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	23138-56-9	C1=CC(=CC(=C1)I)N=C=O	{8: 1, 34: 1, 19: 1, 29: 1, 14: 4}
Did not match all atoms present	23138-58-1	CCC1=CC(=CC=C1)N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	23138-64-9	CC(=O)C1=CC(=CC=C1)N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 24: 1, 29: 1}
Did not match all atoms present	23138-94-5	CN(C)CC[Si](C)(C)C	{1: 5, 2: 2, 33: 1}
Did not match all atoms present	23139-00-6	CC1=CC=C(C=C1)NC(=O)N(C)N=O	{1: 2, 34: 1, 33: 1, 14: 4, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	23139-02-8	CN(C(=O)NC1=CC=C(C=C1)Br)N=O	{1: 1, 34: 1, 33: 1, 14: 4, 18: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	2314-09-2	CCCCOC(=O)C1(C2=CC=CC=C2C3=CC=CC=C31)O	{1: 1, 2: 3, 13: 1, 14: 8, 20: 1, 28: 1}
Did not match all atoms present	2314-17-2	CCCCSC1=NC2=CC=CC=C2S1	{1: 1, 2: 3, 35: 1, 40: 1, 41: 1, 14: 4}
Did not match all atoms present	2314-36-5	C1=C(C=C(C(=C1Cl)O)Cl)C=O	{17: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	2314-48-9	CSC(=S)SC	{40: 2, 1: 2, 7: 1}
Did not match all atoms present	23141-61-9	CC1=C(C2=C(C=C1)N=CC=C2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	2315-02-8	CC1=CC(=C(C(=C1CC2=NCCN2)C)O)C(C)(C)C.Cl	{32: 1, 1: 5, 2: 1, 35: 1, 4: 1, 11: 2, 14: 1, 15: 1, 17: 1, 21: 1}
Did not match all atoms present	2315-20-0	C1=C(OC(=C1)[N+](=O)[O-])/C=C/C(=NN=C(N)N)/C=C/C2=CC=C(O2)[N+](=O)[O-].Cl	{34: 2, 38: 2, 6: 4, 7: 2, 14: 4, 17: 1, 23: 2, 30: 2}
Did not match all atoms present	2315-39-1	CCCCCCCCCCCCCCCC[N+]1=CC=CC(=C1)C.[Br-]	{1: 2, 2: 15, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	2315-40-4	CCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)C.[Br-]	{1: 2, 2: 15, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	2315-61-9	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCCO	{1: 5, 2: 5, 4: 2, 14: 4, 20: 1, 22: 2}
Did not match all atoms present	2315-68-6	CCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	23155-02-4	C[C@H]1[C@H](O1)P(=O)(O)O	{1: 1, 12: 2, 29: 1, 20: 2, 23: 1}
Did not match all atoms present	2316-26-9	COC1=C(C=C(C=C1)/C=C/C(=O)O)OC	{1: 2, 22: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	2316-64-5	C1=CC(=C(C=C1Br)CO)O	{2: 1, 20: 1, 18: 1, 14: 3, 21: 1}
Did not match all atoms present	23162-15-4	B(OCCCCCCCCCCCCCC)(OCCCCCCCCCCCCCC)OCCCCCCCCCCCCCC	{1: 3, 2: 39, 22: 3}
Did not match all atoms present	23162-99-4	C1=CC=C(C=C1)CN(F)F	{16: 2, 33: 1, 2: 1, 14: 5}
Did not match all atoms present	23163-84-0	CCOC1=CC=CC=C1N=C=S	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 22: 1}
Did not match all atoms present	23163-86-2	C1=CC(=C(C=C1N=C=S)C(F)(F)F)Cl	{34: 1, 4: 1, 8: 1, 14: 3, 16: 3, 17: 1}
Did not match all atoms present	23164-36-5	CCC(C(CC(C)[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2)O.[Cl-]	{1: 4, 2: 2, 3: 2, 4: 1, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	23164-74-1	C1CC(=NC1)[Se]	{35: 1, 11: 3, 15: 1}
Did not match all atoms present	23165-19-7	C[N+]1(CCOCC1)C.[Cl-]	{23: 1, 1: 2, 11: 4, 17: 1}
Did not match all atoms present	23165-29-9	C1=C(C=C(C=C1C(F)(F)F)N=C=S)C(F)(F)F	{8: 1, 16: 6, 34: 1, 4: 2, 14: 3}
Did not match all atoms present	23165-44-8	CCCCC1=CC=C(C=C1)N=C=S	{8: 1, 1: 1, 2: 3, 34: 1, 14: 4}
Did not match all atoms present	23165-46-0	C1=C(C(=CC(=C1Cl)Cl)Cl)N=C=S	{8: 1, 17: 3, 34: 1, 14: 2}
Did not match all atoms present	23165-49-3	C1=CC(=C(C=C1C(F)(F)F)N=C=S)Cl	{34: 1, 4: 1, 8: 1, 14: 3, 16: 3, 17: 1}
Did not match all atoms present	23165-53-9	CC1=C(C=CC(=C1)Cl)N=C=S	{8: 1, 1: 1, 34: 1, 14: 3, 17: 1}
Did not match all atoms present	23165-60-8	COC1=CC(=C(C=C1)N=C=S)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 8: 1, 14: 3, 22: 1}
Did not match all atoms present	2317-22-8	CC1=C(C=CC=C1C#N)C#N	{1: 1, 37: 2, 14: 3}
Did not match all atoms present	23172-39-6	O.O.[Ce]	{}
Did not match all atoms present	23172-40-9	O.[V+2]	{}
Did not match all atoms present	23176-01-4	CCOC(=O)CN1C(=O)CSC1=S	{1: 1, 2: 2, 33: 1, 41: 1, 11: 1, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	23180-57-6	C[C@@]12C[C@]3([C@@H]4C[C@]1([C@@]4([C@H](O2)O3)COC(=O)C5=CC=CC=C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O	{1: 1, 2: 2, 11: 2, 12: 7, 13: 4, 14: 5, 20: 5, 22: 1, 23: 3, 28: 1}
Did not match all atoms present	23182-46-9	CC[N+]1(CCCCC1)CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.[Br-]	{1: 1, 2: 3, 4: 1, 11: 5, 14: 10, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	23184-66-9	CCCCOCN(C1=C(C=CC=C1CC)CC)C(=O)CCl	{1: 3, 2: 7, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	23184-71-6	C1=CC=C(C=C1)[O-].C(CO)[NH+](CCO)CCO	{2: 6, 20: 3, 14: 5}
Did not match all atoms present	23188-89-8	CCCC[Pb](CCCC)(CCCC)N1C=NC2=CC=CC=C21	{1: 3, 2: 9, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	23189-63-1	CC1=CC=CC2=C1C3=CC=CC=C3C=C2C	{1: 2, 14: 8}
Did not match all atoms present	2319-96-2	CC1=CC2=CC3=CC=CC=C3C=C2C4=CC=CC=C14	{1: 1, 14: 11}
Did not match all atoms present	2319-97-3	C1CC2=CC(=CC=C2)CCC3=CC=CC1=C3	{11: 4, 14: 8}
Did not match all atoms present	23191-75-5	CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2C(F)(F)F)C(=O)OCC)C)C	{32: 1, 1: 4, 2: 2, 4: 1, 12: 1, 14: 4, 15: 4, 16: 3, 28: 2}
Did not match all atoms present	23197-71-9	CCOC(=O)C(C1=CC=C(C=C1)CC(C)C)(C(=O)OCC)F	{1: 4, 2: 3, 3: 1, 4: 1, 14: 4, 16: 1, 28: 2}
Did not match all atoms present	232-54-2	C1C=CC2=C1C3=CC=CC=C3C=C2	{11: 1, 14: 8}
Did not match all atoms present	232-95-1	C1=CC=C2C(=C1)C=CC3=C2C=CO3	{14: 8, 23: 1}
Did not match all atoms present	2320-96-9	C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)Cl)OC5=C3C=CC(=C5Cl)O	{13: 1, 14: 8, 17: 2, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	23209-26-9	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Co+2]	{}
Did not match all atoms present	23209-59-8	OP(O)O.[Na].[Ca]	{20: 3}
Did not match all atoms present	2321-07-5	C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O	{23: 1, 28: 1, 13: 1, 14: 10, 21: 2}
Did not match all atoms present	2321-53-1	C[As](=O)(O)[O-].[NH4+]	{1: 1, 20: 1, 29: 2}
Did not match all atoms present	23210-56-2	CC(C(C1=CC=C(C=C1)O)O)N2CCC(CC2)CC3=CC=CC=C3	{1: 1, 2: 1, 3: 2, 33: 1, 11: 4, 12: 1, 14: 9, 20: 1, 21: 1}
Did not match all atoms present	23213-34-5	CC1=C(C(=O)NC(=O)N1)CN2CCCCC2	{32: 2, 1: 1, 2: 1, 33: 1, 11: 5, 25: 2}
Did not match all atoms present	23214-92-8	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N)O	{1: 2, 2: 1, 11: 3, 12: 5, 13: 1, 14: 3, 20: 3, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	23216-67-3	CCC(=CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)CCCS(=O)(=O)O)C=C4N(C5=C(S4)C=CC6=CC=CC=C65)CCCS(=O)(=O)[O-].CCN(CC)CC	{1: 4, 2: 10, 33: 3, 6: 2, 7: 1, 41: 2, 14: 12, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	23217-81-4	CC(C1=C(C(=C(C=C1I)I)NC(=O)C)I)C(=O)O	{1: 2, 3: 1, 14: 1, 19: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	23217-86-9	CCCC(C1=C(C(=C(C=C1I)I)N)I)C(=O)O	{1: 1, 2: 2, 3: 1, 14: 1, 19: 3, 27: 1, 30: 1}
Did not match all atoms present	23217-87-0	CCCC(C1=C(C(=C(C=C1I)I)NC(=O)C)I)C(=O)O	{1: 2, 2: 2, 3: 1, 14: 1, 19: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	23218-62-4	COC1=CC=C(C=C1)COC(=O)OC2=CC(=C(C=C2Cl)Cl)Cl	{1: 1, 2: 1, 22: 1, 14: 6, 17: 3}
Did not match all atoms present	23221-99-0	NS(=O)(=O)[O-].NS(=O)(=O)[O-].[Mg+2]	{29: 6, 30: 2}
Did not match all atoms present	23233-88-7	CC(=O)OC1=C(C=C(C=C1C(=S)NC2=CC=C(C=C2)Br)Cl)Br	{1: 1, 7: 1, 14: 6, 17: 1, 18: 2, 28: 1, 31: 1}
Did not match all atoms present	23236-18-2	CCN1C2=CC=CC=C2OC1=CC=C3C(=O)N(C(=S)S3)CC(=O)O	{1: 1, 2: 2, 6: 2, 33: 2, 41: 1, 14: 4, 15: 3, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	23239-51-2	C[C@@H]([C@@H](C1=CC=C(C=C1)O)O)NCCC2=CC=C(C=C2)O.Cl	{1: 1, 2: 2, 3: 2, 14: 8, 17: 1, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	2324-98-3	COC1=C(C(=CC(=C1F)F)F)F	{16: 4, 1: 1, 22: 1, 14: 1}
Did not match all atoms present	23242-92-4	C1=C(C=C(C(=C1[N+](=O)[O-])C2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C3=C(C=C(C(=C3[N+](=O)[O-])C4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 12, 14: 6}
Did not match all atoms present	23245-64-9	C1=CC(=C2C=CC=C(C2=C1)[N+](=O)[O-])C#N	{38: 1, 37: 1, 14: 6}
Did not match all atoms present	23248-23-9	[Li+].C(C[O-])O	{2: 2, 20: 1, 29: 1}
Did not match all atoms present	2325-10-2	C1=CC=C(C=C1)[C@@H]([C@H](C2=CC=CC=C2)O)O	{3: 2, 20: 2, 14: 10}
Did not match all atoms present	2325-27-1	C1=CC=C(C=C1)N=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{34: 1, 14: 20}
Did not match all atoms present	2325-41-9	CCO[Si](N)(OCC)OCC	{1: 3, 2: 3, 30: 1, 22: 3}
Did not match all atoms present	23250-03-5	C1=CC=C(C=C1)[P+](CCO)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{17: 1, 2: 2, 20: 1, 14: 15}
Did not match all atoms present	23250-44-4	CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)[O-])C.[K+]	{1: 4, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 24: 1}
Did not match all atoms present	23250-73-9	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Mn+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	23255-03-0	C.C(C(=O)O)N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+]	{24: 2, 33: 1, 2: 3, 27: 1}
Did not match all atoms present	23256-30-6	CC1CS(=O)(=O)CCN1/N=C/C2=CC=C(O2)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 6: 1, 33: 1, 11: 3, 12: 1, 14: 2, 23: 1, 29: 2}
Did not match all atoms present	23256-50-0	CC(=O)O.C1=CC(=C(C(=C1)Cl)/C=N/N=C(N)N)Cl	{1: 1, 34: 2, 6: 1, 7: 1, 14: 3, 17: 2, 27: 1, 30: 2}
Did not match all atoms present	23257-56-9	CC(=O)OC(C1CCNCC1)C2=CC=CC=C2.Cl	{32: 1, 1: 1, 3: 1, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	23257-62-7	CCCCN(CC(COC1=CC=CC=C1)O)CC(COC2=CC=CC=C2)O	{1: 1, 2: 7, 3: 2, 33: 1, 14: 10, 20: 2, 22: 2}
Did not match all atoms present	23258-43-7	CCN(CC[N+]1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])C#N.[Cl-]	{1: 1, 2: 3, 37: 1, 38: 1, 33: 2, 34: 2, 14: 12, 17: 1}
Did not match all atoms present	23262-34-2	CC(=CCC/C(=C/CCC1=COC=C1)/C)C	{1: 3, 2: 4, 6: 2, 7: 2, 14: 3, 23: 1}
Did not match all atoms present	2327-69-7	CCOC(=O)CCCP(=O)(OCC)OCC	{1: 3, 2: 6, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	2327-98-2	CC=C=CC1=CC=CC=C1	{8: 1, 1: 1, 14: 5, 6: 2}
Did not match all atoms present	2327-99-3	C=C=CC1=CC=CC=C1	{8: 1, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	23275-26-5	CCCCCC[O-].CCCCCC[O-].CCCCCC[O-].[Al+3]	{1: 3, 2: 15, 29: 3}
Did not match all atoms present	23279-53-0	CCC(C1=C(C(=C(C=C1I)I)NC(=O)C)I)C(=O)O	{1: 2, 2: 1, 3: 1, 14: 1, 19: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	23279-54-1	CCC(C1=C(C(=C(C=C1I)I)N(CC)C(=O)C)I)C(=O)O	{1: 3, 2: 2, 3: 1, 33: 1, 14: 1, 19: 3, 24: 1, 27: 1}
Did not match all atoms present	2328-31-6	CNC(=O)OCC1=C(C(=CC=C1)Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	23287-26-5	CC1=CC=CC(=C1O)C(=O)OC	{1: 2, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	23287-50-5	CCC(=O)[O-].CCC(=O)[O-].[Sr+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	23288-49-5	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C	{40: 2, 1: 14, 4: 5, 21: 2, 14: 4}
Did not match all atoms present	23291-96-5	C[C@H]1C(=O)O[C@@H]2CCN3C2=C(COC(=O)[C@]([C@]1(C)O)(C)O)C=C3	{1: 3, 33: 1, 11: 3, 12: 2, 13: 2, 14: 2, 20: 2, 28: 2}
Did not match all atoms present	23292-85-5	CC(=O)CCC(=O)O[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{24: 1, 1: 1, 2: 2, 28: 1, 14: 15}
Did not match all atoms present	23292-93-5	CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].[Zn+2]	{24: 2, 1: 2, 14: 8}
Did not match all atoms present	23293-23-4	CC(C)[N-]C(C)C.CC(C)[N-]C(C)C.[Mg+2]	{1: 8, 34: 2, 3: 4}
Did not match all atoms present	232949-65-4	CCCCCOC(=O)CCC1=CC=CC=C1	{1: 1, 2: 6, 28: 1, 14: 5}
Did not match all atoms present	23295-00-3	C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N	{34: 1, 22: 1, 14: 10, 29: 2}
Did not match all atoms present	23295-32-1	C/C(=C(/N=O)\C)/NO.C/C(=C(/N=O)\C)/NO.C1CC[N-]CC1.Cl[Co+]	{1: 4, 34: 2, 35: 1, 7: 4, 11: 5, 17: 1, 20: 2, 29: 2, 31: 2}
Did not match all atoms present	233-02-3	C1=CC=C2C(=C1)C=CC3=C2C=CS3	{41: 1, 14: 8}
Did not match all atoms present	233-59-0	C1=CC=C2C(=C1)C=CC3=NNN=C32	{32: 1, 35: 2, 14: 6}
Did not match all atoms present	23301-82-8	CC(=O)/C=C(/C(F)(F)F)\[O-].[Sm+3]	{1: 1, 4: 1, 6: 1, 7: 1, 16: 3, 24: 1}
Did not match all atoms present	23306-60-7	CCS(=O)(=O)C1=CC(=C(C=C1)N)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 29: 2, 30: 1}
Did not match all atoms present	23308-53-4	CCN(CC)C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)N(CC)CC	{1: 4, 2: 4, 4: 1, 14: 18, 33: 2}
Did not match all atoms present	23308-82-9	CC(C1=CC(=CC=C1)OC)O	{1: 2, 3: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	23311-75-3	CCC1=CC=CC=C1NS(=O)(=O)C2=CC(=[N+]=[N-])C=CC2=NS(=O)(=O)C3=CC=C(C=C3)C	{1: 2, 2: 1, 34: 2, 14: 11, 15: 3, 29: 4, 31: 1}
Did not match all atoms present	23314-05-8	CCOC(=O)C1=C(NC(=C1C)[N+](=O)[O-])C	{32: 1, 1: 3, 2: 1, 28: 1, 38: 1}
Did not match all atoms present	23315-55-1	CCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCC)[O-]	{1: 2, 2: 4, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	23319-66-6	CC(C(=O)[O-])O.C1=CC=C(C=C1)[Hg+].C(CO)N(CCO)CCO	{1: 1, 2: 6, 3: 1, 33: 1, 14: 5, 20: 4, 24: 1}
Did not match all atoms present	23327-57-3	CN1CCOC(C2=CC=CC=C2C1)C3=CC=CC=C3.Cl	{1: 1, 33: 1, 11: 3, 12: 1, 14: 9, 17: 1, 23: 1}
Did not match all atoms present	23328-87-2	CCCCCCCCCCCCCCCCCC1=NC=CN1	{32: 1, 1: 1, 2: 16, 35: 1, 14: 2}
Did not match all atoms present	23330-86-1	[AlH2].[TeH]	{}
Did not match all atoms present	23330-87-2	[AlH2].[SeH]	{}
Did not match all atoms present	23332-31-2	CC(=O)O[Hg]C1=CC=C(C=C1)N(C)C	{1: 3, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	23335-61-7	[OH-].[OH-].[Ti+4]	{}
Did not match all atoms present	23335-74-2	CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[Fe+3]	{24: 3, 1: 3, 2: 42, 6: 6}
Did not match all atoms present	23339-04-0	CC1=C(C2=C3C(=CC=C2)C4=CC=CC=C4C3=C1)C	{1: 2, 14: 8}
Did not match all atoms present	23341-13-1	C1=C(C=C(C=C1C(=O)O)C(=O)O)C#N	{27: 2, 37: 1, 14: 3}
Did not match all atoms present	23341-91-5	COC1=CC=CC(=C1OCC2=CC=CC=C2)C=C(C3=CC=CS3)C(=O)O	{1: 1, 2: 1, 6: 1, 7: 1, 41: 1, 14: 11, 22: 2, 27: 1}
Did not match all atoms present	23342-25-8	CC1=CC(=C2CCC(CC2=C1)(C)C)C	{1: 4, 11: 3, 13: 1, 14: 2}
Did not match all atoms present	23344-17-4	C[C@@H]1/C=C\C=C(\C(=O)NC2=C(C(=C3C(=C(C(=C4C3=C(/C(=C/[C@@]([C@@H]([C@@H]([C@H]([C@@H]([C@@H]([C@@H](C1O)C)O)C(=O)OC)O)C)O)(C)O)/C)OCO4)C)O)C2=O)OC(=O)C)C)/C	{32: 1, 1: 10, 11: 1, 12: 8, 13: 1, 14: 4, 15: 6, 20: 5, 21: 1, 23: 2, 25: 2, 28: 2}
Did not match all atoms present	23350-56-3	CCN1C(=CC=C2C(=O)N(C(=S)S2)CC)C=CC3=CC=CC=C31	{1: 2, 2: 2, 6: 2, 33: 2, 41: 1, 14: 6, 15: 3, 25: 1}
Did not match all atoms present	23351-07-7	C1=CN(C=C1)C2=CC=C(C=C2)C#N	{33: 1, 37: 1, 14: 8}
Did not match all atoms present	23351-91-9	C1=C(C=C(C=C1C(=O)O)Br)C(=O)O	{18: 1, 27: 2, 14: 3}
Did not match all atoms present	23354-43-0	CN1C(=[N+](C=N1)C)N=NC2=CC=C(C=C2)N(C)C.COS(=O)(=O)[O-]	{1: 5, 34: 2, 35: 1, 33: 3, 14: 5, 22: 1, 29: 3}
Did not match all atoms present	23357-45-1	C1C[C@H](C2=CC=CC=C2C1)O	{20: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	233587-34-3	CCCCCCCCCCCCCCCCCCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 17, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	233587-35-4	CCCCCCCCCCCCCCCCCCCCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 19, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	233587-36-5	CCCCCCCCCCCCCCCCCCCCCCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 21, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	23359-08-2	C1=CC(=CC=C1/C=C/C(=O)O)C=O	{26: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	23361-55-9	B(=O)Cl	{17: 1, 29: 1}
Did not match all atoms present	23361-56-0	B(=O)F	{16: 1, 29: 1}
Did not match all atoms present	23361-67-3	CC(C)(C)COC=O	{1: 3, 2: 1, 4: 1, 26: 1}
Did not match all atoms present	23363-14-6	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Y+3]	{24: 3, 1: 3}
Did not match all atoms present	23368-55-0	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)C)CCCS(=O)(=O)O)C=C3N(C4=C(S3)C=CC(=C4)C)CCCS(=O)(=O)[O-]	{1: 3, 2: 7, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	23368-58-3	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCCS(=O)(=O)[O-])C=C4N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCCCS(=O)(=O)O	{1: 1, 2: 9, 33: 2, 6: 2, 7: 1, 14: 16, 15: 1, 20: 1, 23: 2, 29: 5}
Did not match all atoms present	23373-04-8	CC(=O)NC1=C(C=C(C=C1)Br)Br	{24: 1, 1: 1, 18: 2, 14: 3, 31: 1}
Did not match all atoms present	23374-15-4	C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC(=CC=C3)OC4=CC(=CC=C4)OC5=CC=CC(=C5)OC6=CC=CC(=C6)OC7=CC=CC=C7	{22: 6, 14: 30}
Did not match all atoms present	23374-70-1	C1(=NC(=NC(=N1)NO)NO)NO	{35: 3, 20: 3, 31: 3}
Did not match all atoms present	23375-56-6	CC1=C/C(=N/NC2=CC(=CC=C2)OC)/C(=O)C=C1	{1: 2, 34: 1, 14: 7, 15: 2, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	23378-88-3	C1=C(C=C(C(=C1Cl)O)S(=O)(=O)Cl)Cl	{17: 3, 21: 1, 14: 2, 29: 2}
Did not match all atoms present	2338-12-7	C1=CC2=NNN=C2C=C1[N+](=O)[O-]	{32: 1, 35: 2, 38: 1, 14: 3}
Did not match all atoms present	2338-18-3	C1C(CC2=CC=CC=C21)N.Cl	{17: 1, 11: 2, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	2338-20-7	C1=C(C=C(C(=C1I)I)I)C(=O)O	{27: 1, 19: 3, 14: 2}
Did not match all atoms present	2338-24-1	C1=C2C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 38: 2, 14: 2, 16: 3}
Did not match all atoms present	2338-25-2	C1=C2C(=CC(=C1Cl)Cl)N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 14: 2, 16: 3, 17: 2}
Did not match all atoms present	2338-27-4	C1=C2C(=C(C(=C1Cl)Cl)Cl)N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 14: 1, 16: 3, 17: 3}
Did not match all atoms present	2338-29-6	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)N=C(N2)C(F)(F)F	{16: 3, 17: 4, 35: 1, 4: 1, 32: 1}
Did not match all atoms present	2338-31-0	C1=CC2=C(C(=C1)Cl)N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 14: 3, 16: 3, 17: 1}
Did not match all atoms present	2338-37-6	CCC(=O)O[C@@](CC1=CC=CC=C1)(C2=CC=CC=C2)[C@@H](C)CN(C)C	{1: 4, 2: 3, 3: 1, 4: 1, 33: 1, 14: 10, 28: 1}
Did not match all atoms present	2338-54-7	CC1=C(C=CC(=C1)OC)F	{16: 1, 1: 2, 22: 1, 14: 3}
Did not match all atoms present	2338-75-2	C1=CC(=CC=C1CC#N)C(F)(F)F	{16: 3, 2: 1, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	2338-76-3	C1=CC(=CC(=C1)C(F)(F)F)CC#N	{16: 3, 2: 1, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	23383-11-1	C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Fe+2]	{20: 1, 2: 2, 27: 3, 4: 1}
Did not match all atoms present	23383-59-7	CC(C)(C)C(=O)OOC(C)(C)C1=CC=CC=C1	{1: 5, 4: 2, 22: 1, 14: 5, 28: 1}
Did not match all atoms present	23384-72-7	CCC(=O)C1=CC(=C(C=C1)F)F	{16: 2, 1: 1, 2: 1, 14: 3, 24: 1}
Did not match all atoms present	23389-74-4	CCCCCC(=O)C1=CC=NC=C1	{24: 1, 1: 1, 2: 4, 35: 1, 14: 4}
Did not match all atoms present	2339-78-8	C1=C(C(=CC(=C1Cl)Cl)F)[N+](=O)[O-]	{16: 1, 17: 2, 38: 1, 14: 2}
Did not match all atoms present	23395-20-2	CC(=C)C(=O)OC[Si]12OCCN(CCO1)CCO2	{1: 1, 2: 1, 5: 1, 7: 1, 11: 6, 23: 3, 33: 1, 28: 1}
Did not match all atoms present	23399-70-4	CC1=C(C=CC(=C1)Cl)I	{1: 1, 19: 1, 14: 3, 17: 1}
Did not match all atoms present	23399-77-1	C1=CC(=C(C=C1Cl)C(F)(F)F)I	{16: 3, 17: 1, 19: 1, 4: 1, 14: 3}
Did not match all atoms present	23399-81-7	C1=CC(=C(C=C1Cl)Cl)OC(=O)C(Cl)(Cl)Cl	{17: 5, 4: 1, 14: 3, 28: 1}
Did not match all atoms present	23399-88-4	CCOC1=C(C=C(C=C1Cl)Cl)Cl	{1: 1, 2: 1, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	23399-90-8	CC(=O)OC1=C(C=C(C=C1Cl)Cl)Cl	{1: 1, 28: 1, 14: 2, 17: 3}
Did not match all atoms present	234-17-3	C1OC2=C(O1)C3=C(C=C2)C=CN=C3	{35: 1, 11: 1, 14: 5, 23: 2}
Did not match all atoms present	234-41-3	C1=CC=C2C(=C1)C=CC3=C2SC=C3	{41: 1, 14: 8}
Did not match all atoms present	234-80-0	C1=CC=C2C(=C1)C=NN3C2=NN=C3	{33: 1, 35: 3, 14: 6}
Did not match all atoms present	2340-87-6	CCC(C#N)(C1=C(C(=C(C(=C1F)F)F)F)F)C(=O)[O-]	{1: 1, 2: 1, 4: 1, 37: 1, 16: 5, 24: 1}
Did not match all atoms present	2340-93-4	C1(=C(C(=C(C(=C1C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 18, 4: 6}
Did not match all atoms present	23402-66-6	[OH-].[OH-].[OH-].[Ti+4]	{}
Did not match all atoms present	23411-85-0	[Al+3].[OH-].[OH-]	{}
Did not match all atoms present	23412-26-2	CC1C(C=COC2(C(=O)C3=C4C(=CC(=NC(=O)C(=CC(=O)C5CC5C(C(C(C(C1OC(=O)C)C)O)C)O)C)C(=O)C4=C(C(=C3O2)C)O)NC6CCC(OC6C)O)C)OC	{1: 9, 35: 1, 11: 3, 12: 12, 13: 1, 14: 4, 15: 3, 20: 3, 21: 1, 22: 1, 23: 3, 25: 4, 28: 1, 31: 1}
Did not match all atoms present	23413-80-1	CC(=O)OC1=CC=CC=C1C(=O)[O-].CC(=O)OC1=CC=CC=C1C(=O)[O-].[OH-].[Al+3]	{24: 2, 1: 2, 28: 2, 14: 8}
Did not match all atoms present	23414-72-4	[O-][Mn](=O)(=O)=O.[O-][Mn](=O)(=O)=O.[Zn+2]	{29: 8}
Did not match all atoms present	23418-85-1	CC1=CC=C(C=C1)S(=O)(=O)OCCC#C	{1: 1, 2: 2, 9: 1, 10: 1, 14: 4, 22: 1, 29: 2}
Did not match all atoms present	23418-91-9	B1(C2CCCC1CCC2)C3=CC=CC=C3	{11: 6, 12: 2, 14: 5}
Did not match all atoms present	23420-61-3	CC1=C(C=C(C=C1)NC2=NCCO2)C	{1: 2, 35: 1, 11: 2, 14: 3, 15: 1, 23: 1, 31: 1}
Did not match all atoms present	23421-22-9	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCOCCOC3=CC(=C(C=C3)C(=O)C4=CC=CC=C4)O)O	{24: 2, 2: 4, 22: 3, 21: 2, 14: 16}
Did not match all atoms present	23422-53-9	CNC(=O)OC1=CC=CC(=C1)N=CN(C)C.Cl	{1: 3, 34: 1, 6: 1, 33: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	23424-47-7	COC(=O)[NH+]=C1NC2=CC=CC=C2N1.[Cl-]	{32: 2, 1: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	23427-51-2	CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC3=[N+](C4=NC5=CC=CC=C5N=C4N3CC=C)CC=C.[I-]	{1: 2, 2: 2, 35: 3, 5: 2, 6: 4, 33: 3, 14: 9, 19: 1}
Did not match all atoms present	2343-23-9	C1CNC2=C1C=CC(=C2)F	{16: 1, 32: 1, 11: 2, 14: 3}
Did not match all atoms present	2343-36-4	C1=CC=C(C=C1)NNC(=O)CF	{16: 1, 24: 1, 2: 1, 14: 5, 31: 2}
Did not match all atoms present	23432-62-4	COC(=O)NCCC[Si](OC)(OC)OC	{1: 4, 2: 3, 28: 1, 22: 3, 31: 1}
Did not match all atoms present	2344-70-9	CC(CCC1=CC=CC=C1)O	{1: 1, 2: 2, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	2344-71-0	CC(CCCC1=CC=CC=C1)O	{1: 1, 2: 3, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	2344-80-1	C[Si](C)(C)CCl	{1: 3, 2: 1, 17: 1}
Did not match all atoms present	2344-83-4	C[Si](C)(C)CCCCl	{1: 3, 2: 3, 17: 1}
Did not match all atoms present	234446-37-8	CCCCCCCCCCCCCCCCCCCCCCCCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 23, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	234446-38-9	CCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 25, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	234446-39-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 27, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	2345-34-8	CC(=O)OC1=CC=C(C=C1)C(=O)O	{1: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	2345-38-2	C[Si](C)(C)CC(=O)O	{1: 3, 2: 1, 27: 1}
Did not match all atoms present	23450-31-9	C1=CC=C(C=C1)CC2=CC=C(C=C2)C#N	{2: 1, 37: 1, 14: 9}
Did not match all atoms present	23453-39-6	B(F)(F)F.C1=CC(=CC(=C1)Cl)N	{16: 3, 17: 1, 30: 1, 14: 4}
Did not match all atoms present	23464-17-7	C1=CC=C(C=C1)CC(=O)C(=O)C2=CC=CC=C2	{24: 2, 2: 1, 14: 10}
Did not match all atoms present	23468-31-7	C1OC2=C(O1)C=C(C(=C2)CCl)Cl	{17: 2, 2: 1, 11: 1, 14: 2, 23: 2}
Did not match all atoms present	2347-47-9	CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(C(=N2)Cl)Cl	{1: 2, 35: 2, 33: 1, 14: 3, 17: 2, 29: 2}
Did not match all atoms present	23471-13-8	C(C[Hg]Br)O	{2: 2, 20: 1, 18: 1}
Did not match all atoms present	23471-23-0	COC(=O)[Hg]Br	{1: 1, 18: 1, 28: 1}
Did not match all atoms present	23476-83-7	C1C[N+]2(CCN1CC(CCl)O)CC[N+]3(CCN(CC3)CC(CCl)O)CC2.[Cl-].[Cl-]	{33: 2, 2: 4, 3: 2, 11: 12, 17: 4, 20: 2}
Did not match all atoms present	2348-17-6	CCCCC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C	{1: 2, 2: 3, 38: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	2348-47-2	CC1=CC=CC(=C1)[CH2]	{1: 1, 5: 1, 14: 4}
Did not match all atoms present	2348-48-3	CC1=CC=CC=C1[CH2]	{1: 1, 5: 1, 14: 4}
Did not match all atoms present	2348-49-4	C1=CC=C(C=C1)[NH]	{36: 1, 14: 5}
Did not match all atoms present	2348-51-8	C[CH]C1=CC=CC=C1	{1: 1, 14: 5, 6: 1}
Did not match all atoms present	2348-52-9	CC1=CC=C(C=C1)[CH2]	{1: 1, 5: 1, 14: 4}
Did not match all atoms present	2348-79-0	CN(C)C1=CC(=O)C2=CC=CC=C2C1=O	{1: 2, 25: 2, 33: 1, 14: 5, 15: 1}
Did not match all atoms present	2348-81-4	C1=CC=C2C(=C1)C(=O)C=C(C2=O)N	{25: 2, 30: 1, 14: 5, 15: 1}
Did not match all atoms present	2348-82-5	COC1=CC(=O)C2=CC=CC=C2C1=O	{1: 1, 25: 2, 22: 1, 14: 5, 15: 1}
Did not match all atoms present	23481-28-9	C1=CC=C2C(=O)C=CC(=NNC3=CC=C(C4=CC=CC=C43)S(=O)(=O)O)C2=C1	{34: 1, 14: 12, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	23483-22-9	CC(C)(C=C)O[Si](C)C	{1: 4, 22: 1, 4: 1, 5: 1, 6: 1}
Did not match all atoms present	23488-38-2	CC1=C(C(=C(C(=C1Br)Br)C)Br)Br	{1: 2, 18: 4}
Did not match all atoms present	23489-00-1	CCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 7, 11: 5, 18: 1}
Did not match all atoms present	23489-01-2	CCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 8, 11: 5, 18: 1}
Did not match all atoms present	23489-02-3	CCCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 9, 11: 5, 18: 1}
Did not match all atoms present	23489-03-4	CCCCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 10, 11: 5, 18: 1}
Did not match all atoms present	2349-58-8	C1=CC=C(C=C1)C2=C(NC(=S)N2)C3=CC=CC=C3	{32: 2, 14: 10}
Did not match all atoms present	2349-67-9	C1(=NNC(=S)S1)N	{32: 1, 41: 1, 35: 1, 30: 1}
Did not match all atoms present	23491-45-4	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)NC(=C6C=CC(=O)C=C6)N5	{32: 3, 1: 1, 35: 1, 33: 2, 11: 4, 14: 10, 15: 2, 25: 1}
Did not match all atoms present	23491-52-3	CCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N6CCN(CC6)C	{32: 2, 1: 2, 2: 1, 35: 2, 33: 2, 11: 4, 14: 10, 22: 1}
Did not match all atoms present	23495-12-7	CCC(=O)OCCOC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	23495-13-8	CCCCC(=O)OCCOC1=CC=CC=C1	{1: 1, 2: 5, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	235-06-3	C1=CC=C2C(=C1)C=CC3=NN=CN32	{33: 1, 35: 2, 14: 7}
Did not match all atoms present	235-92-7	C1C=CC2=C1C3=CC=CC=C3C4=CC=CC=C24	{11: 1, 14: 10}
Did not match all atoms present	2350-01-8	C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)N	{33: 1, 30: 1, 14: 14}
Did not match all atoms present	2350-89-2	C=CC1=CC=C(C=C1)C2=CC=CC=C2	{14: 9, 5: 1, 6: 1}
Did not match all atoms present	23500-79-0	CC1=CC(=C(C(=C1CCl)C)O)C(C)(C)C	{1: 5, 2: 1, 4: 1, 14: 1, 17: 1, 21: 1}
Did not match all atoms present	23505-41-1	CCN(CC)C1=NC(=CC(=N1)OP(=S)(OCC)OCC)C	{1: 5, 2: 4, 35: 2, 33: 1, 14: 1, 22: 3}
Did not match all atoms present	235083-88-2	C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)[O-])[O-])C(=O)O.[Zn+2]	{2: 1, 27: 2, 14: 10}
Did not match all atoms present	235083-90-6	C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)[O-])[O-])C(=O)O.[Sr+2]	{2: 1, 27: 2, 14: 10}
Did not match all atoms present	23509-16-2	CC1=CNC(=C1C(=O)OC(C)C2=CC[C@@]34C2(C[C@H](C56C3=CC[C@H]7[C@@]5(CC[C@@](C7)(O6)O)C)O)CN(CCO4)C)C	{32: 1, 1: 5, 3: 1, 33: 1, 11: 9, 12: 2, 13: 5, 14: 3, 15: 2, 20: 2, 23: 2, 28: 1}
Did not match all atoms present	2351-13-5	C[Si](C)(CBr)O[Si](C)(C)CBr	{1: 4, 2: 2, 18: 2, 22: 1}
Did not match all atoms present	2351-33-9	C1C[Si](C1)(Cl)Cl	{17: 2, 11: 3}
Did not match all atoms present	2351-34-0	C[Si]1(CCC1)Cl	{1: 1, 11: 3, 17: 1}
Did not match all atoms present	2351-37-3	C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 14: 8}
Did not match all atoms present	23511-70-8	CCCC(=O)OCCOC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	23515-59-5	CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC.Cl	{1: 4, 2: 2, 33: 2, 41: 1, 12: 2, 14: 8, 17: 1, 22: 1, 25: 1, 28: 1}
Did not match all atoms present	23516-74-7	CC1=CC=C(C=C1)S(=O)(=O)NCCSSCCNS(=O)(=O)C2=CC=C(C=C2)C	{1: 2, 2: 4, 40: 2, 14: 8, 29: 4, 31: 2}
Did not match all atoms present	23518-13-0	CN1C=C(C2=CC=CC=C21)C(=O)CO	{1: 1, 2: 1, 33: 1, 14: 5, 20: 1, 24: 1}
Did not match all atoms present	23519-77-9	CCC[O-].CCC[O-].CCC[O-].CCC[O-].[Zr+4]	{1: 4, 2: 8, 29: 4}
Did not match all atoms present	23521-13-3	C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)N(CCBr)CCBr)[N+](=O)[O-]	{33: 1, 2: 4, 38: 1, 14: 8, 18: 2, 28: 1}
Did not match all atoms present	23521-14-4	CN(C)C1=CC=C(C=C1)N=NC2=CC3=NC=CN=C3C=C2	{1: 2, 34: 2, 35: 2, 14: 9, 33: 1}
Did not match all atoms present	23524-75-6	CC(C)OC(=O)CC(C(=O)OC(C)C)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 1, 3: 3, 28: 2, 29: 3}
Did not match all atoms present	23525-20-4	CCCCCCCCCCCCCCCCCC(=O)OCCN(CCN(CCOC(=O)CCCCCCCCCCCCCCCCC)CCOC(=O)CCCCCCCCCCCCCCCCC)CCO.COS(=O)(=O)OC	{1: 5, 2: 58, 33: 2, 20: 1, 22: 2, 28: 3, 29: 2}
Did not match all atoms present	23526-02-5	C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COC4C(OC(C(C4O)O)OC(C(C(C(C(=O)O)O)OP(=O)(O)O)O)C(=O)O)CO)O)O	{33: 1, 2: 2, 3: 4, 12: 9, 14: 2, 35: 3, 20: 9, 22: 3, 23: 2, 27: 2, 29: 1, 30: 1}
Did not match all atoms present	2353-33-5	C1[C@@H]([C@H](O[C@H]1N2C=NC(=NC2=O)N)CO)O	{33: 1, 2: 1, 35: 2, 11: 1, 12: 3, 14: 1, 20: 2, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	2353-45-9	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=C(C=C(C=C5)O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 19, 15: 2, 21: 1, 29: 9}
Did not match all atoms present	2353-98-2	CN(C)P(F)(F)(F)F	{16: 4, 1: 2, 33: 1}
Did not match all atoms present	23535-89-9	CCCC[Sn]1(OC(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)O1)CCCC	{1: 2, 2: 6, 28: 2, 17: 4}
Did not match all atoms present	23537-16-8	CC1=CC(=C2C(=C1)C(=O)C34C5C6C(C3C(=O)C7=C(C8=C(C=C(C=C8C(=O)C67C(C5O)C(=O)C4=C2O)C)O)O)O)O	{1: 2, 12: 6, 13: 2, 14: 4, 15: 4, 20: 4, 21: 2, 25: 4}
Did not match all atoms present	2354-61-2	C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3	{33: 2, 2: 3, 11: 4, 14: 9, 16: 1, 24: 1}
Did not match all atoms present	2354-93-0	CCOC(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 28: 1, 31: 1}
Did not match all atoms present	23541-50-6	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)N)O.Cl	{1: 3, 11: 3, 12: 5, 13: 1, 14: 3, 17: 1, 20: 2, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	23543-66-0	CC1=CN(C2=CC=CC=C12)C(=O)C	{24: 1, 1: 2, 14: 5, 33: 1}
Did not match all atoms present	23545-77-9	CC1=CC(=CC=C1)NC=CC=NC2=CC=CC(=C2)C	{1: 2, 34: 1, 14: 8, 6: 3, 31: 1}
Did not match all atoms present	23550-45-0	S=S	{}
Did not match all atoms present	2356-16-3	CCOC(=O)C(F)P(=O)(OCC)OCC	{1: 3, 2: 3, 3: 1, 16: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	23560-59-0	COP(=O)(OC)OC1=C(C2C1CC=C2)Cl	{1: 2, 11: 1, 12: 2, 14: 2, 15: 2, 17: 1, 22: 3, 29: 1}
Did not match all atoms present	23561-36-6	C1=CC(=C(C=C1[N+](=O)[O-])CCl)OP(=O)(Cl)Cl	{2: 1, 38: 1, 14: 3, 17: 3, 22: 1, 29: 1}
Did not match all atoms present	23564-05-8	COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC	{1: 2, 31: 4, 28: 2, 14: 4, 7: 2}
Did not match all atoms present	23564-06-9	CCOC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OCC	{1: 2, 2: 2, 7: 2, 14: 4, 28: 2, 31: 4}
Did not match all atoms present	23566-47-4	CC(C)CC(=O)C#CC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 10: 2, 14: 5, 24: 1}
Did not match all atoms present	2357-25-7	C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3N)F	{33: 1, 2: 1, 35: 3, 14: 6, 16: 1, 30: 1}
Did not match all atoms present	2357-47-3	C1=CC(=C(C=C1N)C(F)(F)F)F	{16: 4, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	2357-52-0	COC1=C(C=C(C=C1)Br)F	{16: 1, 1: 1, 18: 1, 22: 1, 14: 3}
Did not match all atoms present	2357-55-3	C1=CC(=CC=C1C[Hg]Cl)F	{16: 1, 17: 1, 2: 1, 14: 4}
Did not match all atoms present	23574-01-8	COC(=O)CCNCC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	23579-92-2	COCC1=CC=CC=N1	{1: 1, 2: 1, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	2358-29-4	C1=CC(=C(C(=C1F)C(=O)O)F)F	{16: 3, 27: 1, 14: 2}
Did not match all atoms present	23580-52-1	CCC1=C(N=C(C=C1)C)C	{1: 3, 2: 1, 35: 1, 14: 2}
Did not match all atoms present	23581-62-6	CC1=C(C(=CC=C1)C)NC(=O)C2CN3CCC2CC3.Cl	{1: 2, 33: 1, 11: 5, 12: 2, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	23582-02-7	C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)CCP(C4=CC=CC=C4)C5=CC=CC=C5	{2: 4, 14: 25}
Did not match all atoms present	23582-03-8	C1=CC=C(C=C1)P(CCP(CCP(C2=CC=CC=C2)C3=CC=CC=C3)CCP(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6	{2: 6, 14: 30}
Did not match all atoms present	23586-53-0	C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Tl+3]	{16: 9, 24: 3, 4: 3}
Did not match all atoms present	23587-90-8	CC(C)(C)[Hg]C(C)(C)C	{1: 6, 4: 2}
Did not match all atoms present	23588-66-1	CN1C(C2=CC=CC=C2SC1=O)C=N	{1: 1, 36: 1, 6: 1, 33: 1, 41: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	23589-43-7	C1=CC=C(C=C1)C=NN2C3=CC=CC=C3N=N2	{33: 1, 34: 1, 35: 2, 14: 9, 6: 1}
Did not match all atoms present	2359-09-3	CC(C)(C)C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 3, 27: 2, 4: 1, 14: 3}
Did not match all atoms present	2359-60-6	C1CCN(CC1)C2=CC=C(C=C2)N	{33: 1, 11: 5, 30: 1, 14: 4}
Did not match all atoms present	23590-99-0	C1=NC(=O)C2=C(N1)N(C=N2)[C@H](C=O)O[C@@H](CO)C=O	{32: 1, 33: 1, 2: 1, 3: 2, 14: 2, 35: 2, 20: 1, 22: 1, 25: 1, 26: 2}
Did not match all atoms present	23593-75-1	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3Cl)N4C=CN=C4	{17: 1, 35: 1, 4: 1, 14: 17, 33: 1}
Did not match all atoms present	23595-00-8	C1=CC=C(C(=C1)C(=O)O)N(C2=CC=CC(=C2)C(F)(F)F)N=O	{33: 1, 34: 1, 4: 1, 14: 8, 16: 3, 27: 1, 29: 1}
Did not match all atoms present	23595-42-8	C1=C(C(=CC(=C1Cl)Cl)Cl)NC(=O)CCl	{24: 1, 17: 4, 2: 1, 14: 2, 31: 1}
Did not match all atoms present	23595-49-5	CCCCCC1=C(C=C(C=C1)O)C	{1: 2, 2: 4, 21: 1, 14: 3}
Did not match all atoms present	23597-82-2	CCCCCCOC(=O)C1=CN=CC=C1	{1: 1, 2: 5, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	23597-98-0	C1CN2C(NC3=CC=CC=C3C2=N1)C4=CC=C(C=C4)Cl	{32: 1, 33: 1, 35: 1, 11: 2, 12: 1, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	23598-72-3	CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)O	{1: 1, 35: 1, 14: 4, 17: 1, 23: 1, 27: 1}
Did not match all atoms present	23599-75-9	CC(CCNC1=NC=NC2=C1NC=N2)CO	{32: 1, 1: 1, 2: 3, 3: 1, 14: 2, 35: 3, 20: 1, 31: 1}
Did not match all atoms present	236-02-2	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2NC=N4	{32: 1, 35: 1, 14: 9}
Did not match all atoms present	236-63-5	C1=CSC2=C1C3=C(S2)SC=C3	{41: 3, 14: 4}
Did not match all atoms present	2360-45-4	CCC(=O)C1=CC=CC=C1C(=O)O	{24: 1, 1: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	23602-78-0	CC(CC1=CC(=CC=C1)C(F)(F)F)NCCOC(=O)C2=CC=CC=C2	{1: 1, 2: 3, 3: 1, 4: 1, 14: 9, 16: 3, 28: 1, 31: 1}
Did not match all atoms present	23605-74-5	C(CCCN(CP(=O)(O)O)CP(=O)(O)O)CCN(CP(=O)(O)O)CP(=O)(O)O	{33: 2, 2: 10, 20: 8, 29: 4}
Did not match all atoms present	23606-32-8	N.N.[N+](=O)([O-])[O-].[Ag+]	{}
Did not match all atoms present	23606-37-3	CC1=C2C=CC=NC2=C3C(=C1)C=CC=N3.CC1=C2C=CC=NC2=C3C(=C1)C=CC=N3.CC1=C2C=CC=NC2=C3C(=C1)C=CC=N3.[O-]S(=O)(=O)[O-].[Fe+2]	{1: 3, 35: 6, 29: 4, 14: 21}
Did not match all atoms present	23609-20-3	CCOC1=CC=C(C=C1)NCCC#N	{1: 1, 2: 3, 37: 1, 14: 4, 22: 1, 31: 1}
Did not match all atoms present	2361-27-5	C1=CSC(=C1)C(=O)NN	{24: 1, 41: 1, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	23611-64-5	CC1=CC2=C(C=C1)OC(=S)NC2=O	{32: 1, 1: 1, 25: 1, 14: 3, 23: 1}
Did not match all atoms present	23611-66-7	C1=CC2=C(C=C1Br)C(=O)NC(=S)O2	{32: 1, 25: 1, 18: 1, 14: 3, 23: 1}
Did not match all atoms present	23611-67-8	C1=C(C=C2C(=C1Cl)OC(=S)NC2=O)Cl	{32: 1, 17: 2, 25: 1, 14: 2, 23: 1}
Did not match all atoms present	23611-68-9	C1=C(C=C2C(=C1Br)OC(=S)NC2=O)Br	{32: 1, 25: 1, 18: 2, 14: 2, 23: 1}
Did not match all atoms present	23611-69-0	C1=CC2=C(C(=C1)[N+](=O)[O-])OC(=S)NC2=O	{32: 1, 25: 1, 38: 1, 14: 3, 23: 1}
Did not match all atoms present	23613-02-7	CCNC1=NC(=S)N=C(N1)N(CC)CC	{32: 1, 1: 3, 2: 3, 35: 2, 33: 1, 31: 1}
Did not match all atoms present	23616-79-7	CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 10, 14: 5, 17: 1}
Did not match all atoms present	23617-71-2	CC1=CC(=C(C=C1)C(=O)OC)C	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	2362-10-9	C[Si](C)(CCl)O[Si](C)(C)CCl	{1: 4, 2: 2, 22: 1, 17: 2}
Did not match all atoms present	2362-12-1	CC1=C(C=CC(=C1)Br)O	{1: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	2362-16-5	CC1=CC(=C(C=C1C)CCl)CCl	{1: 2, 2: 2, 14: 2, 17: 2}
Did not match all atoms present	2362-18-7	C1=CC(=CC=C1CCl)OC2=CC=C(C=C2)CCl	{17: 2, 2: 2, 22: 1, 14: 8}
Did not match all atoms present	2362-50-7	C1=CC=C2C(=C1)SC3=CC=CC=C3S2=O	{41: 1, 29: 1, 14: 8}
Did not match all atoms present	23621-79-6	CC(CC(=O)[O-])CC(C)(C)C.CC(CC(=O)[O-])CC(C)(C)C.[Pb+2]	{24: 2, 1: 8, 2: 4, 3: 2, 4: 2}
Did not match all atoms present	23627-24-9	CC(=O)NC1=CC(=C(C=C1Cl)Cl)Cl	{24: 1, 1: 1, 31: 1, 14: 2, 17: 3}
Did not match all atoms present	23627-80-7	C12C(O1)C(C(C(C2O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{12: 6, 22: 4, 23: 1}
Did not match all atoms present	2363-26-0	CC1=CC=CC=C1OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 22: 1, 14: 7}
Did not match all atoms present	23635-30-5	C1[C@@H]2C3[C@H]([C@H]([C@@H](O2)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C6=C5[C@H]([C@@H](C(=O)O3)CC(=O)O)[C@@H](C(=O)O6)O)O)O)OC(=O)C7=CC(=C(C(=C7C8=C(C(=C(C=C8C(=O)O1)O)O)O)O)O)O	{2: 1, 11: 1, 12: 8, 14: 5, 20: 1, 21: 11, 23: 1, 27: 1, 28: 6}
Did not match all atoms present	2364-46-7	C1=CC2=CC(=CC(=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 5}
Did not match all atoms present	2364-54-7	CC1=C(C=C(C(=C1)O)C(C)C)N=O	{1: 3, 34: 1, 3: 1, 14: 2, 21: 1, 29: 1}
Did not match all atoms present	2364-59-2	CCOC(=O)CCCOC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	23642-01-5	CC(=O)OC1=CC=CC=C1C(=O)[O-].CC(=O)OC1=CC=CC=C1C(=O)[O-].CC(=O)OC1=CC=CC=C1C(=O)[O-].CC(=O)OC1=CC=CC=C1C(=O)[O-].[Cu+2].[Cu+2]	{24: 4, 1: 4, 28: 4, 14: 16}
Did not match all atoms present	2365-26-6	C1=CC=C2C(=C1)C=CN=C2C=NNC(=S)N	{34: 1, 35: 1, 6: 1, 7: 1, 14: 6, 30: 1, 31: 1}
Did not match all atoms present	23654-78-6	C(C(CO)(CO)[NH3+])O.OS(=O)(=O)[O-]	{20: 4, 2: 3, 4: 1, 29: 3}
Did not match all atoms present	23659-80-5	CCOC(C1=CC=C(C=C1)OC)C(=O)C2=CC=C(C=C2)OC	{1: 3, 2: 1, 3: 1, 14: 8, 22: 3, 24: 1}
Did not match all atoms present	23666-93-5	CC1=C(C(=CC=C1)C)OP(=O)(OC2=CC=CC=C2)OC3=C(C=CC=C3C)C	{1: 4, 22: 3, 14: 11, 29: 1}
Did not match all atoms present	23666-94-6	CC1=C(C(=CC=C1)C)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 2, 22: 3, 14: 13, 29: 1}
Did not match all atoms present	23668-76-0	CC(C)[Sn](=O)C(C)C	{1: 4, 3: 2, 29: 1}
Did not match all atoms present	2367-19-3	[B-](F)(F)(F)F.C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N	{16: 4, 34: 1, 14: 9, 31: 1}
Did not match all atoms present	2367-76-2	C1=C(C=C(C(=C1F)Br)F)F	{16: 3, 18: 1, 14: 2}
Did not match all atoms present	2367-78-4	C1=C(C(=CC(=C1F)Cl)F)F	{16: 3, 17: 1, 14: 2}
Did not match all atoms present	2367-80-8	C1=C(C=C(C(=C1Cl)F)Cl)F	{16: 2, 17: 2, 14: 2}
Did not match all atoms present	2367-82-0	C1=C(C=C(C(=C1F)F)F)F	{16: 4, 14: 2}
Did not match all atoms present	2367-91-1	C1=CC(=C(C=C1F)Cl)F	{16: 2, 17: 1, 14: 3}
Did not match all atoms present	236733-89-4	C1=CC=C2C=C(C(=CC2=C1)C(=O)O)[O-].C1=CC=C2C=C(C(=CC2=C1)C(=O)O)[O-].[Sr+2]	{27: 2, 14: 12}
Did not match all atoms present	23676-08-6	CCOC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	23676-09-7	CCOC1=CC=C(C=C1)C(=O)OCC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	23678-44-6	N.N.N.Cl.[Pt]	{17: 1}
Did not match all atoms present	23679-20-1	C=CCOP(O)OCC=C	{2: 2, 22: 2, 20: 1, 5: 2, 6: 2}
Did not match all atoms present	2368-49-2	C1(=C(C(=C(C(=C1Br)F)Br)F)Br)F	{16: 3, 18: 3}
Did not match all atoms present	2368-53-8	C1=C(C(=C(C(=C1F)Cl)F)Cl)F	{16: 3, 17: 2, 14: 1}
Did not match all atoms present	23680-31-1	CC(C)(C)OC(=O)N[C@@H](COCC1=CC=CC=C1)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 14: 5, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	23680-84-4	COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N)OC	{1: 2, 35: 2, 14: 2, 17: 1, 22: 2, 30: 1}
Did not match all atoms present	23681-60-9	C1=CC=C(C=C1)NC2=CC=C(C=C2)C(C3=CC=C(C=C3)NC4=CC=CC=C4)(C5=CC=C(C=C5)NC6=CC=CC=C6)O	{20: 1, 4: 1, 14: 27, 31: 3}
Did not match all atoms present	23684-52-8	C([C@@H]([C@@H]([C@H](C(=O)COP(=O)([O-])[O-])O)O)O)OP(=O)([O-])[O-].[Ca+2].[Ca+2]	{2: 2, 3: 3, 20: 3, 22: 2, 24: 1, 29: 6}
Did not match all atoms present	23690-13-3	CC(CC1=C(C=C(C=C1)OC)OC)N	{1: 3, 2: 1, 3: 1, 14: 3, 22: 2, 30: 1}
Did not match all atoms present	23690-14-4	CC(CC1=C(C=CC=C1OC)OC)N	{1: 3, 2: 1, 3: 1, 14: 3, 22: 2, 30: 1}
Did not match all atoms present	23691-27-2	C1=CC=C(C=C1)C(CC(Cl)(Cl)Cl)Cl	{17: 4, 2: 1, 3: 1, 4: 1, 14: 5}
Did not match all atoms present	23693-18-7	CC(CC1=CC2=C(C=C1OC)OCO2)N	{1: 2, 2: 1, 3: 1, 11: 1, 14: 2, 22: 1, 23: 2, 30: 1}
Did not match all atoms present	23693-19-8	CC(CC1=C(C2=C(C=C1)OCO2)OC)N	{1: 2, 2: 1, 3: 1, 11: 1, 14: 2, 22: 1, 23: 2, 30: 1}
Did not match all atoms present	23695-15-0	CC1=C(C=CC=C1[N+](=O)[O-])N=C=O	{1: 1, 34: 1, 38: 1, 8: 1, 14: 3, 29: 1}
Did not match all atoms present	23695-63-8	C1C23C=CC=CC2(CS1(=O)=O)C=CC=C3	{11: 2, 13: 2, 14: 8, 29: 2}
Did not match all atoms present	23696-28-8	CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)NCCO	{1: 1, 2: 2, 33: 2, 14: 4, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	2370-88-9	C[Si]1O[Si](O[Si](O[Si](O1)C)C)C	{1: 4, 23: 4}
Did not match all atoms present	23700-19-8	C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].[O-]S(=O)(=O)[O-].[Fe+2]	{38: 3, 35: 6, 29: 4, 14: 21}
Did not match all atoms present	23703-22-2	CCCCCCC1=CC=C(C=C1)Br	{1: 1, 2: 5, 18: 1, 14: 4}
Did not match all atoms present	23708-66-9	C[Sn]1(C2=CC=CC=C2CC3=CC=CC=C31)C	{1: 2, 11: 1, 14: 8}
Did not match all atoms present	23710-76-1	CC(C)CC(=O)C1=C(C2=CC=CC=C2C1=O)[O-].CC(C)CC(=O)C1=C(C2=CC=CC=C2C1=O)[O-].[Ca+2]	{1: 4, 2: 2, 3: 2, 14: 8, 15: 4, 24: 2, 25: 2}
Did not match all atoms present	23712-05-2	C1CN=C(N1)COC2=CC(=C(C=C2)Cl)Cl.Cl	{32: 1, 2: 1, 35: 1, 11: 2, 14: 3, 15: 1, 17: 3, 22: 1}
Did not match all atoms present	23713-46-4	[Bi+3]	{}
Did not match all atoms present	23713-48-6	[Sb+3]	{}
Did not match all atoms present	23713-49-7	[Zn+2]	{}
Did not match all atoms present	2372-21-6	CC(C)OC(=O)OOC(C)(C)C	{1: 5, 3: 1, 4: 1, 22: 1}
Did not match all atoms present	2372-45-4	CCCC[O-].[Na+]	{1: 1, 2: 3, 29: 1}
Did not match all atoms present	23724-93-8	COC1=NC=CC2=CC=CC=C21	{1: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	2373-76-4	CC1=CC=CC=C1/C=C/C(=O)O	{1: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	2373-79-7	CCOC1=CC=C(C=C1)/C=C/C(=O)O	{1: 1, 2: 1, 6: 2, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	2373-80-0	C1OC2=C(O1)C=C(C=C2)C=CC(=O)O	{27: 1, 11: 1, 14: 3, 6: 2, 23: 2}
Did not match all atoms present	2373-98-0	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)O)O)N	{30: 2, 21: 2, 14: 6}
Did not match all atoms present	23730-10-1	CCN(CC)C(=O)NS(=O)(=O)C1=CC=C(C=C1)C	{1: 3, 2: 2, 33: 1, 14: 4, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	23731-06-8	C1=CC(=C(C=C1CCl)C=O)O	{17: 1, 2: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	23735-43-5	CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2COC(O2)(C)C	{1: 3, 2: 1, 11: 1, 12: 1, 13: 1, 14: 4, 22: 1, 23: 2, 29: 2}
Did not match all atoms present	23739-66-4	CC(=O)C(C(=O)NC1=CC=C(C=C1)OC)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]	{1: 2, 34: 2, 3: 1, 38: 1, 14: 7, 17: 1, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	2374-03-0	C1=CC(=C(C=C1C(=O)O)O)N	{30: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	2374-05-2	CC1=CC(=CC(=C1O)C)Br	{1: 2, 18: 1, 21: 1, 14: 2}
Did not match all atoms present	2374-14-3	C[Si]1(O[Si](O[Si](O1)(C)CCC(F)(F)F)(C)CCC(F)(F)F)CCC(F)(F)F	{16: 9, 1: 3, 2: 6, 4: 3, 23: 3}
Did not match all atoms present	2374-61-0	CCN(CC)S(=O)(=O)C	{1: 3, 2: 2, 29: 2, 33: 1}
Did not match all atoms present	23743-26-2	C1CCC(CC1)P(CCP(C2CCCCC2)C3CCCCC3)C4CCCCC4	{2: 2, 11: 20, 12: 4}
Did not match all atoms present	23743-30-8	COC(=O)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C4=CC=CC=C43)C5=NC6=C(O5)C=CC(=C6)C(=O)OC	{1: 2, 35: 2, 28: 2, 14: 12, 23: 2}
Did not match all atoms present	23745-86-0	C(C(=O)[O-])F.[K+]	{16: 1, 24: 1, 2: 1}
Did not match all atoms present	23746-34-1	C(CO)N(CCO)C(=S)[S-].[K+]	{33: 1, 2: 4, 20: 2, 7: 1}
Did not match all atoms present	23747-48-0	CC1CCC2=NC=CN=C12	{1: 1, 11: 2, 12: 1, 14: 2, 35: 2}
Did not match all atoms present	2375-03-3	C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)COC(=O)CCC(=O)[O-])O.[Na+]	{1: 3, 2: 3, 11: 4, 12: 5, 13: 3, 14: 3, 15: 1, 20: 2, 24: 2, 25: 1, 28: 1}
Did not match all atoms present	2375-86-2	C1(=C(P(P1C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 12, 4: 4}
Did not match all atoms present	23761-74-2	CO[Si](C)(C)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 3, 22: 1}
Did not match all atoms present	2377-80-2	C1(=C(C(=C(C(=C1F)S(=O)(=O)Cl)C(F)(F)F)F)F)C(F)(F)F	{16: 9, 17: 1, 4: 2, 29: 2}
Did not match all atoms present	2377-81-3	C(#N)C1=C(C(=C(C(=C1F)F)F)C#N)F	{16: 4, 37: 2}
Did not match all atoms present	23771-52-0	C1=C2C(=NC(=S)N=C2NN1)N	{32: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	23772-26-1	C1C2=CC=CC=C2CS(=O)(=O)C3=CC=CC=C31	{11: 2, 29: 2, 14: 8}
Did not match all atoms present	23777-55-1	[B][B]C	{1: 1}
Did not match all atoms present	23779-33-1	CO[Si](CCCNCCNC(=O)N)(OC)OC	{1: 3, 2: 5, 22: 3, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	23779-99-9	C1=CC=C(C(=C1)C(=O)OCC(CO)O)NC2=C3C=CC=C(C3=NC=C2)C(F)(F)F	{2: 2, 3: 1, 4: 1, 14: 9, 16: 3, 35: 1, 20: 2, 28: 1, 31: 1}
Did not match all atoms present	2378-95-2	CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)NC	{1: 3, 2: 4, 3: 1, 14: 4, 24: 1, 28: 2, 31: 2}
Did not match all atoms present	23781-82-0	C1=CC=C(C=C1)C2=CC=C3C=CC=C3C=C2	{14: 12}
Did not match all atoms present	23784-96-5	C1=C(SC(=C1)Cl)CCl	{17: 2, 2: 1, 14: 2, 41: 1}
Did not match all atoms present	23786-14-3	COC1=CC=C(C=C1)CC(=O)OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	23786-20-1	C1CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)N4CCN(CC4)CCO	{33: 3, 2: 2, 35: 1, 11: 6, 14: 8, 15: 1, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	23787-80-6	CC1=NC=CN=C1C(=O)C	{24: 1, 1: 2, 35: 2, 14: 2}
Did not match all atoms present	23788-74-1	CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2COC(O2)(C)C	{1: 3, 2: 1, 11: 1, 12: 1, 13: 1, 14: 4, 22: 1, 23: 2, 29: 2}
Did not match all atoms present	23789-34-6	C1=COC(=C1)C(=C(C2=CC=CO2)N=O)NO	{34: 1, 7: 2, 14: 6, 20: 1, 23: 2, 29: 1, 31: 1}
Did not match all atoms present	2379-18-2	C1=C(C(=C(C(=C1F)F)N=[N+](C2=C(C(=CC(=C2F)F)F)F)[O-])F)F	{16: 8, 33: 1, 34: 1, 29: 1, 14: 2}
Did not match all atoms present	2379-20-6	C1=C(C(=C(C(=C1F)F)N=NC2=C(C(=CC(=C2F)F)F)F)F)F	{16: 8, 34: 2, 14: 2}
Did not match all atoms present	2379-55-7	CC1=NC2=CC=CC=C2N=C1C	{1: 2, 35: 2, 14: 4}
Did not match all atoms present	2379-57-9	C1=C2C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])NC(=O)C(=O)N2	{32: 2, 25: 2, 38: 2, 14: 2}
Did not match all atoms present	2379-74-0	CC1=CC(=CC2=C1C(=O)C(=C3C(=O)C4=C(S3)C=C(C=C4C)Cl)S2)Cl	{1: 2, 41: 2, 14: 4, 15: 2, 17: 2, 25: 2}
Did not match all atoms present	2379-76-2	C1=CC=C(C=C1)C2=C(C=C(C=C2)N=NC3=CC=C(C=C3)C4=CC(=CC=C4)C(=O)NC5=CC=CC6=C5C(=O)C7=C(C6=O)C(=CC=C7)NC(=O)C8=CC=CC=C8)C(=O)NC9=CC=CC1=C9C(=O)C2=C(C1=O)C(=CC=C2)NC(=O)C1=CC=CC=C1	{24: 4, 25: 4, 34: 2, 14: 38, 31: 4}
Did not match all atoms present	2379-81-9	C1=CC=C(C=C1)C(=O)NC2=C3C(=C4C(=C2)C5=CC(=C6C(=C5N4)C(=O)C7=CC=CC=C7C6=O)NC(=O)C8=CC=CC=C8)C(=O)C9=CC=CC=C9C3=O	{24: 2, 25: 4, 32: 1, 14: 20, 31: 2}
Did not match all atoms present	2379-90-0	COC1=C(C2=C(C(=C1)O)C(=O)C3=CC=CC=C3C2=O)N	{1: 1, 14: 5, 21: 1, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	2379-92-2	C1=CC=C2C(=C1)C=CC(=C2CC3=C(C=CC4=CC=CC=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 1, 29: 6, 14: 12}
Did not match all atoms present	23795-03-1	CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)[O-].[Na+]	{1: 2, 2: 4, 33: 1, 14: 4, 24: 1, 29: 2}
Did not match all atoms present	23799-60-2	C1=CC2=C(C=C1Cl)C(=CS2)CC#N	{17: 1, 2: 1, 37: 1, 14: 4, 41: 1}
Did not match all atoms present	238-04-0	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)C5=CC=CC6=C5C4=CC=C6	{14: 14}
Did not match all atoms present	238-06-2	C1=CC=C2C(=C1)C=CC3=C2N=C4C5=CC=CC6=C5C(=CC=C6)C4=N3	{35: 2, 14: 12}
Did not match all atoms present	238-84-6	C1C2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3	{11: 1, 14: 10}
Did not match all atoms present	2380-63-4	C1=NNC2=C1C(=NC=N2)N	{32: 1, 35: 3, 30: 1, 14: 2}
Did not match all atoms present	2380-78-1	COC1=C(C=CC(=C1)CCO)O	{1: 1, 2: 2, 14: 3, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	2380-91-8	CC(C1=CC=C(C=C1)O)O	{1: 1, 3: 1, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	2380-94-1	C1=CC2=C(C=CN2)C(=C1)O	{32: 1, 21: 1, 14: 5}
Did not match all atoms present	23800-57-9	C1=CC=C(C=C1)C(=CC(=O)C2=CC=CC=C2)CC(=O)C3=CC=CC=C3	{24: 2, 2: 1, 14: 15, 6: 1, 7: 1}
Did not match all atoms present	23806-24-8	CC1=C(SC=C1)C(=O)O	{1: 1, 27: 1, 14: 2, 41: 1}
Did not match all atoms present	238088-70-5	C1CCC(C1)OCCC2=CC=CC=C2	{2: 2, 11: 4, 12: 1, 22: 1, 14: 5}
Did not match all atoms present	2381-15-9	CC1=CC2=C(C=C1)C=C3C=CC4=CC=CC=C4C3=C2	{1: 1, 14: 11}
Did not match all atoms present	2381-16-0	CC1=CC2=C(C=C1)C=C3C(=C2)C=CC4=CC=CC=C43	{1: 1, 14: 11}
Did not match all atoms present	2381-18-2	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)N	{30: 1, 14: 11}
Did not match all atoms present	2381-19-3	CC1=CC2=C(C=C1)C3=C(C=CC4=CC=CC=C43)C=C2	{1: 1, 14: 11}
Did not match all atoms present	2381-21-7	CC1=C2C=CC3=CC=CC4=C3C2=C(C=C1)C=C4	{1: 1, 14: 9}
Did not match all atoms present	2381-31-9	CC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C12	{1: 1, 14: 11}
Did not match all atoms present	2381-34-2	CC1=CC2=CC=CC=C2C3=C1C=CC4=CC=CC=C43	{1: 1, 14: 11}
Did not match all atoms present	2381-39-7	CC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C5=CC=CC=C15	{1: 1, 14: 11}
Did not match all atoms present	2381-40-0	CC1=CC2=C(C=C1)C(=C3C=CC4=CC=CC=C4C3=N2)C	{1: 2, 35: 1, 14: 9}
Did not match all atoms present	2381-85-3	CCN(CC)C1=CC2=C(C=C1)N=C3C4=CC=CC=C4C(=[NH2+])C=C3O2.[Cl-]	{1: 2, 2: 2, 35: 1, 33: 1, 14: 8, 17: 1, 23: 1, 30: 1}
Did not match all atoms present	2382-08-3	CN1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O	{1: 1, 33: 1, 14: 6, 25: 2}
Did not match all atoms present	2382-43-6	CC(C[N+](C)(C)C)O.[Cl-]	{1: 4, 2: 1, 3: 1, 20: 1, 17: 1}
Did not match all atoms present	2382-76-5	CCCCCOP(=O)(O)O	{1: 1, 2: 4, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	2382-80-1	CCOC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)C	{32: 1, 1: 2, 2: 2, 3: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	2382-96-9	C1=CC=C2C(=C1)NC(=S)O2	{32: 1, 14: 4, 23: 1}
Did not match all atoms present	23822-43-7	C1=CC(=CC=C1NC(=O)N)OC2=CC=C(C=C2)Cl	{14: 8, 17: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	23822-50-6	CCCOC(=O)N=C=S	{8: 1, 1: 1, 2: 2, 28: 1, 34: 1}
Did not match all atoms present	23826-71-3	COC1=CC=C(C=C1)C(=O)C2=CN=CC=C2	{24: 1, 1: 1, 35: 1, 22: 1, 14: 8}
Did not match all atoms present	23826-72-4	CN(C)CCNC1=CC=CC=N1	{1: 2, 2: 2, 35: 1, 33: 1, 14: 4, 31: 1}
Did not match all atoms present	23828-92-4	C1CC(CCC1NCC2=CC(=CC(=C2N)Br)Br)O.Cl	{2: 1, 11: 4, 12: 2, 14: 2, 17: 1, 18: 2, 20: 1, 30: 1, 31: 1}
Did not match all atoms present	23838-12-2	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C5=CC=C(C=C5)[N+](=O)[O-])C)C	{1: 5, 2: 3, 3: 2, 38: 1, 11: 8, 12: 5, 13: 2, 14: 5, 15: 1, 28: 1}
Did not match all atoms present	23838-73-5	CCNC1=CC=CC=C1N	{1: 1, 2: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	23840-43-9	C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC(=CC=C3)Br	{18: 1, 22: 2, 14: 13}
Did not match all atoms present	23843-64-3	CO[Si](CCCNC(=O)N)(OC)OC	{1: 3, 2: 3, 22: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	23843-86-9	COC(=O)C1=C(C=C(C=C1)C(C2=CC(=CC=C2)N)O)C(=O)O	{1: 1, 3: 1, 14: 7, 20: 1, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	23843-87-0	COC(=O)C1=C(C=CC(=C1)C(C2=CC(=CC=C2)N)O)C(=O)O	{1: 1, 3: 1, 14: 7, 20: 1, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	23844-57-7	CC(C(=O)OC)OC1=C(C=C(C=C1)Cl)Cl	{1: 2, 3: 1, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	23847-25-8	COC(=O)C1=CC(=CC=C1)S(=O)(=O)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC	{1: 2, 28: 2, 29: 4, 14: 8, 31: 1}
Did not match all atoms present	2385-81-1	CCOC(=O)C1(CCN(CC1)CCOCC2CCCO2)C3=CC=CC=C3	{1: 1, 2: 4, 33: 1, 11: 7, 12: 1, 13: 1, 14: 5, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	2385-87-7	CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)N5CCCC5	{32: 1, 1: 1, 33: 2, 11: 6, 12: 2, 14: 5, 15: 1, 24: 1}
Did not match all atoms present	23850-94-4	CCCCC(CC)C(=O)O[Sn](CCCC)(OC(=O)C(CC)CCCC)OC(=O)C(CC)CCCC	{1: 7, 2: 15, 3: 3, 28: 3}
Did not match all atoms present	23852-97-3	CCOC(=O)C1=CC=C(C=C1)NCC(=NO)CN	{1: 1, 2: 3, 7: 1, 34: 1, 14: 4, 20: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	23857-69-4	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OCC.[O-]Cl(=O)(=O)=O	{1: 5, 2: 5, 33: 2, 14: 10, 17: 1, 23: 1, 28: 1, 29: 4}
Did not match all atoms present	2386-25-6	CC1=CNC(=C1C(=O)C)C	{24: 1, 1: 3, 14: 1, 32: 1}
Did not match all atoms present	2386-26-7	CCOC(=O)C1=C(C(=C(N1)C)C(=O)C)C	{24: 1, 1: 4, 2: 1, 28: 1, 32: 1}
Did not match all atoms present	2386-47-2	CCCCS(=O)(=O)O	{1: 1, 2: 3, 20: 1, 29: 2}
Did not match all atoms present	2386-52-9	CS(=O)(=O)[O-].[Ag+]	{1: 1, 29: 3}
Did not match all atoms present	2386-53-0	CCCCCCCCCCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 11, 29: 3}
Did not match all atoms present	2386-54-1	CCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 3, 29: 3}
Did not match all atoms present	2386-56-3	CS(=O)(=O)[O-].[K+]	{1: 1, 29: 3}
Did not match all atoms present	2386-57-4	CS(=O)(=O)[O-].[Na+]	{1: 1, 29: 3}
Did not match all atoms present	2386-58-5	C=CS(=O)(=O)N	{30: 1, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	2386-60-9	CCCCS(=O)(=O)Cl	{1: 1, 2: 3, 29: 2, 17: 1}
Did not match all atoms present	2386-64-3	C[CH2-].[Mg+2].[Cl-]	{1: 1, 5: 1, 17: 1}
Did not match all atoms present	2386-98-3	B(N(C)C)N(C)C	{1: 4, 33: 2}
Did not match all atoms present	2387-16-8	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(Cl)Cl	{17: 2, 3: 2, 14: 10}
Did not match all atoms present	2387-18-0	CC1=C(C=CC(=C1)CCl)CCl	{1: 1, 2: 2, 14: 3, 17: 2}
Did not match all atoms present	23873-81-6	C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)N=O)NO	{34: 1, 7: 2, 14: 10, 20: 1, 29: 1, 31: 1}
Did not match all atoms present	23875-59-4	CC1=CC=CC=C1OCC(CN2C(CCC2(C)C)(C)C)O.Cl	{1: 5, 2: 2, 3: 1, 33: 1, 11: 2, 13: 2, 14: 4, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	2388-00-3	CC[Pb](CC)CC.CC[Pb](CC)CC	{1: 6, 2: 6}
Did not match all atoms present	2388-07-0	[Li+].CC[O-]	{1: 1, 2: 1, 29: 1}
Did not match all atoms present	2388-10-5	[Li+].CC(C)[O-]	{1: 2, 3: 1, 29: 1}
Did not match all atoms present	2388-14-9	CC(C)C1=CC=C(C=C1)C(=C)C	{1: 3, 3: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	2388-51-4	CN(C)C1=CC=C(C=C1)SC	{40: 1, 1: 3, 14: 4, 33: 1}
Did not match all atoms present	2388-69-4	CSC1=CC(=CC=C1)SC	{40: 2, 1: 2, 14: 4}
Did not match all atoms present	2388-73-0	COC1=CC=CC=C1SC	{40: 1, 1: 2, 22: 1, 14: 4}
Did not match all atoms present	23885-72-5	C1=CC(=CC=C1C(C(CO)NC(=O)CO)O)[N+](=O)[O-]	{2: 2, 3: 2, 38: 1, 14: 4, 20: 3, 24: 1, 31: 1}
Did not match all atoms present	23888-15-5	C1=CC=C(C=C1)C2OC(OO2)C3=CC=CC=C3	{12: 2, 14: 10, 23: 3}
Did not match all atoms present	2389-45-9	CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)OCC1=CC=CC=C1)C(=O)O	{1: 3, 2: 5, 3: 1, 4: 1, 14: 5, 27: 1, 28: 2, 31: 2}
Did not match all atoms present	2389-75-5	C1=CC2=C(C(=C1)Cl)NC3=C(C2=O)C(=O)C4=C(C3=O)C(=O)C5=C(N4)C(=CC=C5)Cl	{32: 2, 17: 2, 14: 6, 25: 4}
Did not match all atoms present	23890-27-9	C1=CC2=C(C=CC(=C2O)[N+]#N)C(=C1)S(=O)(=O)O	{34: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	23894-07-7	C1=C2C=C(C(=CC2=CC(=C1O)S(=O)(=O)O)S(=O)(=O)O)O	{20: 2, 21: 2, 14: 4, 29: 4}
Did not match all atoms present	23897-15-6	CC1=CC(=C(C(=C1)C)P(C2=C(C=C(C=C2C)C)C)C3=C(C=C(C=C3C)C)C)C	{1: 9, 14: 6}
Did not match all atoms present	239-01-0	C1=CC=C2C(=C1)C=CC3=C2NC4=CC=CC=C34	{32: 1, 14: 10}
Did not match all atoms present	239-30-5	C1=CC=C2C(=C1)C=CC3=C2OC4=CC=CC=C34	{14: 10, 23: 1}
Did not match all atoms present	239-35-0	C1=CC=C2C(=C1)C=CC3=C2SC4=CC=CC=C34	{41: 1, 14: 10}
Did not match all atoms present	239-60-1	C1C2=C(C3=CC=CC=C3C=C2)C4=CC5=CC=CC=C5C=C41	{11: 1, 14: 12}
Did not match all atoms present	239-64-5	C1=CC=C2C(=C1)C=CC3=C2NC4=C3C=CC5=CC=CC=C54	{32: 1, 14: 12}
Did not match all atoms present	239-67-8	C1=CC=C2C(=C1)C=CC3=C2NC4=C3C=CC5=C4N=CC=C5	{32: 1, 35: 1, 14: 11}
Did not match all atoms present	239-72-5	C1=CC=C2C(=C1)C=CC3=C2SC4=C3C=CC5=CC=CC=C54	{41: 1, 14: 12}
Did not match all atoms present	239-98-5	C1=CC=C2C(=C1)C=CC3=CC4=CC5=CC6=CC=CC=C6C=C5C=C4C=C32	{14: 16}
Did not match all atoms present	2390-54-7	CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C.[Cl-]	{1: 4, 41: 1, 33: 2, 14: 7, 17: 1}
Did not match all atoms present	2390-56-9	CN(C)C1=CC2=[N+](C3=C(C=CC(=C3)N)N=C2C=C1)C4=CC=CC=C4.[Cl-]	{1: 2, 35: 1, 33: 2, 14: 11, 17: 1, 30: 1}
Did not match all atoms present	2390-59-2	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=C(C=C3)N(CC)CC.[Cl-]	{1: 6, 2: 6, 33: 3, 7: 1, 14: 12, 15: 2, 17: 1}
Did not match all atoms present	2390-63-8	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OCC.[Cl-]	{1: 5, 2: 5, 33: 2, 14: 10, 17: 1, 23: 1, 28: 1}
Did not match all atoms present	2390-74-1	C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)NC(=O)CN	{32: 1, 2: 2, 3: 1, 14: 5, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	23902-87-6	CC(CN1CCN(CC1)C(=O)CC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)O	{1: 1, 2: 2, 3: 2, 33: 2, 11: 4, 14: 9, 17: 1, 20: 1, 24: 1}
Did not match all atoms present	23902-88-7	CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 3, 2: 2, 3: 1, 4: 1, 33: 2, 11: 4, 14: 13, 17: 1, 24: 1}
Did not match all atoms present	23902-89-8	C1CN(CCN1CCC2=CC=CC=C2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{33: 2, 2: 3, 3: 1, 11: 4, 14: 14, 17: 1, 24: 1}
Did not match all atoms present	23902-91-2	COC1=CC=CC=C1N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 1, 2: 1, 3: 1, 33: 2, 11: 4, 14: 13, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	23903-11-9	CN(CCCO)CCC(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 1, 2: 5, 3: 1, 33: 1, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	23904-72-5	CC1=CC=C(C=C1)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 1, 2: 1, 3: 1, 33: 2, 11: 4, 14: 13, 17: 1, 24: 1}
Did not match all atoms present	23904-74-7	C1CN(CCN1C2=CC=CC=N2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{33: 2, 2: 1, 3: 1, 11: 4, 14: 13, 17: 1, 35: 1, 24: 1}
Did not match all atoms present	23904-87-2	CC1=CC=CC=C1N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 1, 2: 1, 3: 1, 33: 2, 11: 4, 14: 13, 17: 1, 24: 1}
Did not match all atoms present	23904-88-3	CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 1, 2: 1, 3: 1, 33: 2, 11: 4, 14: 13, 17: 1, 24: 1}
Did not match all atoms present	2391-03-9	CN(C)CC[C@@H](C1=CC=C(C=C1)Br)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O	{1: 2, 2: 2, 3: 1, 6: 2, 33: 1, 14: 8, 18: 1, 35: 1, 27: 2}
Did not match all atoms present	2391-30-2	CC1=CC=C(C=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N)S(=O)(=O)O)C2=O	{1: 1, 33: 1, 14: 8, 20: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	23911-56-0	CC1=C(OC2=CC=CC=C12)C(=O)C	{24: 1, 1: 2, 14: 4, 23: 1}
Did not match all atoms present	23912-79-0	C1=CC=C2C(=C1)C(=O)C3=CC4=C(C=C3C2=O)C(=O)C5=CC=CC=C5C4=O	{25: 4, 14: 10}
Did not match all atoms present	23915-07-3	C1=CC(=C(C=C1F)F)CBr	{16: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	23917-55-7	CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 1, 2: 2, 3: 1, 33: 2, 11: 4, 14: 13, 17: 1, 24: 1}
Did not match all atoms present	23918-98-1	C1=NC2=C(C(=N1)N)N=CN2C[C@H]([C@H](C(=O)O)O)O	{33: 1, 2: 1, 3: 2, 14: 2, 35: 3, 20: 2, 27: 1, 30: 1}
Did not match all atoms present	2392-39-4	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COP(=O)([O-])[O-])O)C)O)F)C.[Na+].[Na+]	{1: 3, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 22: 1, 24: 1, 25: 1, 29: 3}
Did not match all atoms present	2392-43-0	CC1=C(C(=C(C(=C1F)F)N=NC2=C(C(=C(C(=C2F)F)C)F)F)F)F	{16: 8, 1: 2, 34: 2}
Did not match all atoms present	2392-68-9	C1=CC(=CC(=C1)Cl)N=C=S	{8: 1, 17: 1, 34: 1, 14: 4}
Did not match all atoms present	2392-84-9	C1=CC=C(C=C1)SC2=CC(=CC=C2)SC3=CC=CC(=C3)SC4=CC=CC=C4	{40: 3, 14: 18}
Did not match all atoms present	23920-57-2	C1CN(CCN1C2=NC=CS2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{33: 2, 2: 1, 3: 1, 41: 1, 11: 4, 14: 11, 17: 1, 35: 1, 24: 1}
Did not match all atoms present	23927-47-1	CC1=C2CCC3=CC(=C(CCC(=C1)C=C2)C=C3)C	{1: 2, 11: 4, 14: 6}
Did not match all atoms present	2393-17-1	C1=CC(=CC=C1CCC(=O)O)N	{2: 2, 27: 1, 30: 1, 14: 4}
Did not match all atoms present	2393-23-9	COC1=CC=C(C=C1)CN	{1: 1, 2: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	2393-53-5	CC12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5	{1: 1, 11: 6, 12: 3, 13: 1, 14: 8, 25: 1, 28: 1}
Did not match all atoms present	2393-97-7	C1=CC(=CC=C1SCSC2=CC=C(C=C2)Cl)Cl	{40: 2, 17: 2, 2: 1, 14: 8}
Did not match all atoms present	23936-60-9	CP(C)CCP(C)C	{1: 4, 2: 2}
Did not match all atoms present	2394-02-7	C1=CC(=CC=C1S(=O)(=O)CS(=O)(=O)C2=CC=C(C=C2)Cl)Cl	{17: 2, 2: 1, 29: 4, 14: 8}
Did not match all atoms present	2394-03-8	C1=CC(=CC(=C1)Cl)S(=O)(=O)CS(=O)(=O)C2=CC(=CC=C2)Cl	{17: 2, 2: 1, 29: 4, 14: 8}
Did not match all atoms present	23941-48-2	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=C(C=C4)C)C(=O)C5=C(C=CC(=C5C3=O)O)O	{1: 2, 31: 2, 21: 2, 14: 12, 25: 2}
Did not match all atoms present	23945-44-0	C1=C(C(=O)NC(=O)N1)C(=O)O	{32: 2, 25: 2, 27: 1, 14: 1}
Did not match all atoms present	23945-50-8	C1=C(C(=O)NC(=S)N1)C(=O)O	{32: 2, 25: 1, 27: 1, 14: 1}
Did not match all atoms present	23947-60-6	CCCCC1=C(NC(=NC1=O)NCC)C	{32: 1, 1: 3, 2: 4, 35: 1, 25: 1, 31: 1}
Did not match all atoms present	2395-96-2	COC1=C2C=CC=CC2=CC3=CC=CC=C31	{1: 1, 22: 1, 14: 9}
Did not match all atoms present	23950-58-5	CC(C)(C#C)NC(=O)C1=CC(=CC(=C1)Cl)Cl	{1: 2, 4: 1, 9: 1, 10: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	2396-03-4	COC1=CC=[C]C=C1	{1: 1, 22: 1, 14: 4}
Did not match all atoms present	2396-26-1	CC1=CC=C(C=C1)C(C(F)(F)F)(C(F)(F)F)F	{16: 7, 1: 1, 4: 3, 14: 4}
Did not match all atoms present	2396-60-3	COC1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 1, 34: 2, 22: 1, 14: 9}
Did not match all atoms present	2396-68-1	CC(C)(C)C1=CC=C(C=C1)S	{1: 3, 4: 1, 14: 4, 39: 1}
Did not match all atoms present	23973-67-3	CC1=C(C(=CC=C1)C)NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)O	{1: 2, 14: 8, 20: 1, 21: 1, 29: 2, 31: 1}
Did not match all atoms present	23976-66-1	C1=C(C=C(C(=C1Br)OCCO)Br)Br	{2: 2, 22: 1, 20: 1, 18: 3, 14: 2}
Did not match all atoms present	2398-37-0	COC1=CC(=CC=C1)Br	{1: 1, 18: 1, 22: 1, 14: 4}
Did not match all atoms present	2398-64-3	CCCCCCCCCCCCCC(CCCCCC)C1=CC=CC=C1	{1: 2, 2: 17, 3: 1, 14: 5}
Did not match all atoms present	2398-65-4	CCCCCCCCCCCC(CCCCCCCC)C1=CC=CC=C1	{1: 2, 2: 17, 3: 1, 14: 5}
Did not match all atoms present	2398-66-5	CCCCCCCCCCCCCCCCCCC(C)C1=CC=CC=C1	{1: 2, 2: 17, 3: 1, 14: 5}
Did not match all atoms present	2398-68-7	CCCCCCCCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 19, 14: 5}
Did not match all atoms present	2398-81-4	C1=CC(=C[N+](=C1)[O-])C(=O)O	{33: 1, 27: 1, 29: 1, 14: 4}
Did not match all atoms present	2398-95-0	CC(C(=O)O)(O)P(=O)(C(C)(C(=O)O)O)O	{1: 2, 27: 2, 4: 2, 29: 1, 20: 3}
Did not match all atoms present	2398-96-1	CC1=CC(=CC=C1)N(C)C(=S)OC2=CC3=CC=CC=C3C=C2	{1: 2, 33: 1, 22: 1, 14: 11, 7: 1}
Did not match all atoms present	23981-80-8	CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O	{27: 1, 1: 2, 3: 1, 22: 1, 14: 6}
Did not match all atoms present	23985-59-3	CC(C)(C(C1=CC=CC=C1)O)C(=O)O	{1: 2, 3: 1, 4: 1, 14: 5, 20: 1, 27: 1}
Did not match all atoms present	23987-32-8	C1=C(C=C(C(=C1[N+](=O)[O-])C2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])N=NC3=C(C=C(C(=C3[N+](=O)[O-])C4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{34: 2, 38: 12, 14: 6}
Did not match all atoms present	2399-85-1	C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[K+].[K+].[K+]	{24: 3, 33: 1, 2: 3}
Did not match all atoms present	23996-12-5	C1=CC=C(C=C1)C2=NC=CN2CCC#N	{33: 1, 2: 2, 35: 1, 37: 1, 14: 7}
Did not match all atoms present	23996-16-9	CCCCCCCCCCCC1=NC=CN1CCC#N	{1: 1, 2: 12, 35: 1, 37: 1, 33: 1, 14: 2}
Did not match all atoms present	23996-25-0	CCC1=NC(=CN1CCC#N)C	{1: 2, 2: 3, 35: 1, 37: 1, 33: 1, 14: 1}
Did not match all atoms present	23996-55-6	CC1=NC=CN1CCC#N	{1: 1, 2: 2, 35: 1, 37: 1, 33: 1, 14: 2}
Did not match all atoms present	240-39-1	C1=CC2=C(C3=C(C=C2)C4=C(N3)C5=C(C=C4)SC=C5)N=C1	{32: 1, 41: 1, 35: 1, 14: 9}
Did not match all atoms present	240-44-8	C1C=CC2=C1C3=CC4=C(C=C3C=C2)C5=CC=CC=C5C=C4	{11: 1, 14: 12}
Did not match all atoms present	2400-00-2	CCCCCCCCCC(CC)C1=CC=CC=C1	{1: 2, 2: 9, 3: 1, 14: 5}
Did not match all atoms present	2400-01-3	CCCCCCC(CCCCCC)C1=CC=CC=C1	{1: 2, 2: 10, 3: 1, 14: 5}
Did not match all atoms present	2400-02-4	CCCCCCCCCCCCCCCCCC(CC)C1=CC=CC=C1	{1: 2, 2: 17, 3: 1, 14: 5}
Did not match all atoms present	2400-03-5	CCCCCCCCCCCCCCCCC(CCC)C1=CC=CC=C1	{1: 2, 2: 17, 3: 1, 14: 5}
Did not match all atoms present	2400-04-6	CCCCCCCCCCCCCCCC(CCCC)C1=CC=CC=C1	{1: 2, 2: 17, 3: 1, 14: 5}
Did not match all atoms present	2400-17-1	CNC1=C2C=CC=CC2=NS1	{1: 1, 35: 1, 41: 1, 14: 4, 31: 1}
Did not match all atoms present	24000-79-1	COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=C(C=C2)C(=O)OC	{24: 2, 1: 2, 28: 2, 14: 8, 31: 2}
Did not match all atoms present	2401-21-0	C1=CC(=C(C(=C1)I)Cl)Cl	{17: 2, 19: 1, 14: 3}
Did not match all atoms present	2401-22-1	CC1=CC(=C(C=C1)Cl)I	{1: 1, 19: 1, 14: 3, 17: 1}
Did not match all atoms present	2401-24-3	COC1=CC(=C(C=C1)Cl)N	{1: 1, 30: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	2401-73-2	C[Si](C)(O[Si](C)(C)Cl)Cl	{1: 4, 22: 1, 17: 2}
Did not match all atoms present	2401-85-6	C1=CC=C2C(=C1)C(=CC(=C2Cl)[N+](=O)[O-])[N+](=O)[O-]	{17: 1, 38: 2, 14: 5}
Did not match all atoms present	24016-03-3	C1=CC=C(C=C1)COC2=C(N=CC=C2)N	{35: 1, 2: 1, 30: 1, 22: 1, 14: 8}
Did not match all atoms present	24017-47-8	CCOP(=S)(OCC)OC1=NN(C=N1)C2=CC=CC=C2	{1: 2, 2: 2, 35: 2, 33: 1, 14: 6, 22: 3}
Did not match all atoms present	24019-46-3	C1=C(C=C(C=C1C(=O)OCCO)S(=O)(=O)[O-])C(=O)OCCO.[Na+]	{28: 2, 2: 4, 20: 2, 29: 3, 14: 3}
Did not match all atoms present	24019-66-7	C=CCC1=CC=CC(=C1O)C=O	{2: 1, 5: 1, 6: 1, 14: 3, 21: 1, 26: 1}
Did not match all atoms present	2402-42-8	CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41.[Cl-]	{1: 2, 2: 2, 6: 1, 33: 2, 14: 12, 15: 1, 17: 1}
Did not match all atoms present	2402-77-9	C1=CC(=C(N=C1)Cl)Cl	{17: 2, 35: 1, 14: 3}
Did not match all atoms present	2402-78-0	C1=CC(=NC(=C1)Cl)Cl	{17: 2, 35: 1, 14: 3}
Did not match all atoms present	2402-79-1	C1=C(C(=NC(=C1Cl)Cl)Cl)Cl	{17: 4, 35: 1, 14: 1}
Did not match all atoms present	2402-95-1	C1=CC=[N+](C(=C1)Cl)[O-]	{17: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	2402-97-3	C1=CC(=C[N+](=C1)[O-])Br	{33: 1, 18: 1, 29: 1, 14: 4}
Did not match all atoms present	2402-98-4	C1=CC=[N+](C(=C1)C#N)[O-]	{33: 1, 29: 1, 14: 4, 37: 1}
Did not match all atoms present	24023-71-0	COC1=CC=C(C=C1)C2=NN=C(O2)CCl	{1: 1, 2: 1, 35: 2, 14: 4, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	24027-84-7	C1=CC=C2C3=C4C(=CC2=C1)C(=CC5=CC=CC(=C54)C=C3)O	{21: 1, 14: 11}
Did not match all atoms present	2403-22-7	CCCCNCC1=CC=CC=C1	{1: 1, 2: 4, 14: 5, 31: 1}
Did not match all atoms present	24032-84-6	C1=CC(=CC=C1N=C=O)SC(F)(F)F	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 40: 1, 29: 1}
Did not match all atoms present	2404-03-7	CCOP(=O)(N(C)C)OCC	{1: 4, 2: 2, 29: 1, 22: 2, 33: 1}
Did not match all atoms present	2404-05-9	CCOP(=O)(OCC)SC	{40: 1, 1: 3, 2: 2, 29: 1, 22: 2}
Did not match all atoms present	2404-52-6	FP(=S)(F)F	{16: 3}
Did not match all atoms present	2404-55-9	CP(=S)(C)C	{1: 3}
Did not match all atoms present	2404-65-1	CCOP(=O)(N(C)C)N(C)C	{1: 5, 2: 1, 29: 1, 22: 1, 33: 2}
Did not match all atoms present	2404-73-1	CCCCOP(=O)(C)OCCCC	{1: 3, 2: 6, 29: 1, 22: 2}
Did not match all atoms present	2404-78-6	CCOP(=O)(SCC)SCC	{40: 2, 1: 3, 2: 3, 29: 1, 22: 1}
Did not match all atoms present	2404-87-7	C1=CC=C(C=C1)C2=CSC=C2	{41: 1, 14: 8}
Did not match all atoms present	2404-89-9	C1=CSC(=C1)C2=CSC=C2	{41: 2, 14: 6}
Did not match all atoms present	24040-34-4	C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CCl	{24: 1, 17: 1, 2: 1, 11: 1, 14: 7}
Did not match all atoms present	24044-52-8	C1=CC(=CC(=C1)[N+](=O)[O-])C=C2C(=O)NC(=O)S2	{32: 1, 6: 1, 38: 1, 41: 1, 14: 4, 15: 1, 25: 2}
Did not match all atoms present	24045-79-2	CC1=C(C(=S)SS1)C#N	{1: 1, 37: 1, 41: 2}
Did not match all atoms present	24046-14-8	CC1=CC=C(N1N2C=CC=C2)C	{1: 2, 14: 6, 33: 2}
Did not match all atoms present	24049-18-1	C=CCOC1=C(C=C(C=C1)CC(=O)[O-])Cl.[Na+]	{2: 2, 5: 1, 6: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	24050-58-6	COC1=CC(=CC(=C1OC)OC)C(=O)OCCC[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{1: 3, 2: 5, 3: 1, 14: 12, 17: 1, 22: 3, 28: 1}
Did not match all atoms present	24057-28-1	CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=[NH+]C=C1	{32: 1, 1: 1, 29: 3, 14: 9}
Did not match all atoms present	24059-71-0	CC1=CC=CC=C1N2CCCC2=O	{1: 1, 11: 3, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	2406-33-9	C1CC[Si](C1)(Cl)Cl	{17: 2, 11: 4}
Did not match all atoms present	2406-34-0	C1CC[Si](CC1)(Cl)Cl	{17: 2, 11: 5}
Did not match all atoms present	24065-33-6	C1=C(SC(=C1)Cl)C(=O)O	{17: 1, 27: 1, 14: 2, 41: 1}
Did not match all atoms present	24066-82-8	CCOC(=O)CN=C=S	{8: 1, 1: 1, 2: 2, 28: 1, 34: 1}
Did not match all atoms present	24068-15-3	C1=CC(=CC=C1C2=NN=C(O2)CCl)Cl	{17: 2, 2: 1, 35: 2, 14: 4, 23: 1}
Did not match all atoms present	2407-83-2	CCC1=C(/C(=C/C2=C(C(=C(N2)C)CC)C)/N=C1C)C	{32: 1, 1: 6, 2: 2, 35: 1, 6: 1, 15: 4}
Did not match all atoms present	2407-87-6	CCOC(=O)C1=C(/C(=C\C2=C(C(=C(N2)C)C(=O)OCC)C)/N=C1C)C	{32: 1, 1: 6, 2: 2, 35: 1, 6: 1, 15: 4, 28: 2}
Did not match all atoms present	24070-84-6	C(C[Si](Cl)Cl)CCl	{17: 3, 2: 3}
Did not match all atoms present	24072-75-1	C1=C2C(=CC(=C1Cl)Cl)SC(=N2)N	{17: 2, 35: 1, 30: 1, 14: 2, 41: 1}
Did not match all atoms present	24074-26-8	CCOC(=O)CP(=O)(OC(C)C)OC(C)C	{1: 5, 2: 2, 3: 2, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	24078-21-5	CC1=C(C=CC(=C1)C(=O)OC)[N+](=O)[O-]	{1: 2, 28: 1, 38: 1, 14: 3}
Did not match all atoms present	2408-36-8	[Li+].[C-]#N	{}
Did not match all atoms present	2408-38-0	CC1=CC(=C(C(=C1C(=O)O)C)C)C	{1: 4, 27: 1, 14: 1}
Did not match all atoms present	24082-11-9	C[Si](C)(C)CC(=O)O[Si](C)(C)C	{1: 6, 2: 1, 28: 1}
Did not match all atoms present	24083-13-4	CCCCCCCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 7, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	24083-16-7	CCCCCCCCCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 9, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	24083-19-0	CCCCCCCCCCCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 11, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	2409-35-0	CC[NH+](CC)C(C)C(=O)OC1=C(C=CC=C1OC)OC.[Cl-]	{1: 5, 2: 2, 3: 1, 14: 3, 17: 1, 22: 2, 28: 1}
Did not match all atoms present	2409-36-1	C1=CC=C2C(=C1)C3=CC=CC=C3N2CO	{33: 1, 2: 1, 20: 1, 14: 8}
Did not match all atoms present	2409-55-4	CC1=CC(=C(C=C1)O)C(C)(C)C	{1: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	24092-48-6	C1=CC2=C(C=CC3=C2C(=C1)C4=C(C3=O)C=C(C=C4)Cl)Cl	{17: 2, 14: 8, 25: 1}
Did not match all atoms present	24094-93-7	N#[Cr]	{}
Did not match all atoms present	24095-80-5	CNC(=S)NNC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{1: 1, 4: 2, 7: 1, 14: 3, 16: 6, 31: 3}
Did not match all atoms present	24096-53-5	C1CC(=O)N(C1=O)C2=CC(=CC(=C2)Cl)Cl	{17: 2, 11: 2, 33: 1, 14: 3, 25: 2}
Did not match all atoms present	24106-05-6	CC1=C(C=CC(=C1)Br)NC(=O)C	{24: 1, 1: 2, 18: 1, 14: 3, 31: 1}
Did not match all atoms present	24108-33-6	CC1=NC=CN=N1	{1: 1, 35: 3, 14: 2}
Did not match all atoms present	24108-34-7	CC1=CN=NC(=N1)C	{1: 2, 35: 3, 14: 1}
Did not match all atoms present	24108-36-9	CC1=C(N=NC(=N1)C)C	{1: 3, 35: 3}
Did not match all atoms present	24109-06-6	CC(C)(C)C(=O)NC1=CC=C(C=C1)Br	{1: 3, 4: 1, 14: 4, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	2412-73-9	C1CCC(CC1)OC(=O)C2=CC=CC=C2	{28: 1, 11: 5, 12: 1, 14: 5}
Did not match all atoms present	24123-89-5	C1CN2CCC1C(=O)C2=CC3=CC=CC=C3	{33: 1, 6: 1, 11: 4, 12: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	24124-25-2	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O[Sn](CCCC)(CCCC)CCCC	{1: 4, 2: 21, 28: 1, 6: 4}
Did not match all atoms present	2413-38-9	C1CN(CCN1CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO.Cl.Cl	{33: 2, 2: 4, 4: 1, 6: 1, 41: 1, 11: 4, 14: 7, 15: 1, 16: 3, 17: 2, 20: 1}
Did not match all atoms present	24131-31-5	C1=CC=C(C=C1)COC2=CC(=CC(=C2)CO)OCC3=CC=CC=C3	{2: 3, 20: 1, 22: 2, 14: 13}
Did not match all atoms present	24133-73-1	CC(=O)OC1=CC=C(C=C1)C(C)(C)C2=CC=CC=C2	{1: 3, 4: 1, 14: 9, 28: 1}
Did not match all atoms present	24136-83-2	CC[N+]1=C(OC2=CC=CC=C21)C=CC=CC=CN(C3=CC=CC=C3)C(=O)C.[I-]	{1: 2, 2: 1, 6: 6, 33: 2, 14: 9, 19: 1, 23: 1, 24: 1}
Did not match all atoms present	24138-34-9	C1=C(C=C(C(=C1Br)OC(=O)C=CC(=O)OC2=C(C=C(C=C2Br)Br)Br)Br)Br	{18: 6, 28: 2, 14: 4, 6: 2}
Did not match all atoms present	24138-83-8	C1=CC(=CC=C1C=C2C(=O)NC(=O)S2)Cl	{32: 1, 6: 1, 41: 1, 14: 4, 15: 1, 17: 1, 25: 2}
Did not match all atoms present	2414-98-4	CC[O-].CC[O-].[Mg+2]	{1: 2, 2: 2, 29: 2}
Did not match all atoms present	24140-30-5	CCC(C)COC(=O)C=CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC	{1: 3, 2: 2, 3: 1, 6: 3, 34: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	24140-33-8	CC[C@H](C)COC(=O)C=CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)C#N	{1: 2, 2: 2, 3: 1, 37: 1, 6: 3, 34: 1, 14: 8, 28: 1}
Did not match all atoms present	24142-77-6	CCCOC(C)(C)C1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 22: 1, 14: 5}
Did not match all atoms present	24143-08-6	CC(=O)NC1C=NC(=NO1)C2=CC=C(O2)[N+](=O)[O-]	{1: 1, 35: 2, 38: 1, 12: 1, 14: 3, 15: 1, 23: 2, 24: 1, 31: 1}
Did not match all atoms present	24143-17-7	CC1CN2CC(=O)NC3=C(C2(O1)C4=CC=CC=C4)C=C(C=C3)Cl	{32: 1, 1: 1, 33: 1, 11: 2, 12: 1, 13: 1, 14: 8, 17: 1, 23: 1, 25: 1}
Did not match all atoms present	24147-49-7	C1C(=O)N=C(S1)N(C2=CC=CC=C2)C3=CC=CC=C3	{33: 1, 35: 1, 41: 1, 11: 1, 14: 10, 15: 1, 25: 1}
Did not match all atoms present	24147-50-0	CCCCCCCN1C(=O)CN(C1=S)C2=CC=CC=C2	{1: 1, 2: 6, 33: 2, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	2415-80-7	C1C(C1(Cl)Cl)C2=CC=CC=C2	{17: 2, 11: 1, 12: 1, 13: 1, 14: 5}
Did not match all atoms present	2415-85-2	CC1=CC=C(C=C1)NC(=O)CC(=O)C	{24: 2, 1: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	2415-87-4	CC(=O)CC(=O)NC1=CC(=CC=C1)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	24151-93-7	CCCOP(=S)(OCCC)SCC(=O)N1CCCCC1C	{1: 3, 2: 5, 33: 1, 40: 1, 11: 4, 12: 1, 22: 2, 24: 1}
Did not match all atoms present	24153-37-5	C1C2=CC=CC3=C2C4=C(C=CC=C41)C(=C3[N+]#N)[O-]	{34: 1, 11: 1, 14: 6}
Did not match all atoms present	24155-42-8	C1=CC(=C(C=C1Cl)Cl)C(CN2C=CN=C2)O	{33: 1, 2: 1, 3: 1, 14: 6, 17: 2, 35: 1, 20: 1}
Did not match all atoms present	24157-79-7	CC(C)C1=CC=C(C2=CC=CC=C21)C(C)C	{1: 4, 3: 2, 14: 6}
Did not match all atoms present	24157-81-1	CC(C)C1=CC2=C(C=C1)C=C(C=C2)C(C)C	{1: 4, 3: 2, 14: 6}
Did not match all atoms present	2416-94-6	CC1=C(C(=C(C=C1)C)O)C	{1: 3, 21: 1, 14: 2}
Did not match all atoms present	2416-98-0	CC(C)(C)C1=CC=CC(=C1O)C2=CC=CC=C2	{1: 3, 4: 1, 21: 1, 14: 8}
Did not match all atoms present	24160-53-0	COC1=CC(=C(C=C1C=CC(=O)O)OC)OC	{1: 3, 22: 3, 27: 1, 14: 2, 6: 2}
Did not match all atoms present	24166-13-0	C1COC2(N1CC(=O)NC3=C2C=C(C=C3)Cl)C4=CC=CC=C4Cl	{32: 1, 33: 1, 11: 3, 13: 1, 14: 7, 17: 2, 23: 1, 25: 1}
Did not match all atoms present	24167-38-2	CCN(CC)CCN1C2=C3C(=C(C=C2)CO)SC4=CC=CC=C4C3=N1	{1: 2, 2: 5, 35: 1, 33: 2, 41: 1, 14: 6, 20: 1}
Did not match all atoms present	24167-52-0	CN(C)C(=O)C1=CC(=CC=C1)Cl	{24: 1, 1: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	24167-56-4	CN(C)C(=O)C1=CC=C(C=C1)F	{16: 1, 1: 2, 33: 1, 14: 4, 24: 1}
Did not match all atoms present	24167-76-8	[Na+].[PH2-]	{}
Did not match all atoms present	24168-52-3	C1C(=C1C2=CC=CC=C2)C3=CC=CC=C3	{11: 1, 14: 10, 15: 2}
Did not match all atoms present	24168-56-7	CC(C)(C1=CC=CC2=C1C=CC=C2C(C)(C)O)O	{1: 4, 4: 2, 14: 6, 20: 2}
Did not match all atoms present	24168-70-5	CCC(C)C1=NC=CN=C1OC	{1: 3, 2: 1, 3: 1, 14: 2, 35: 2, 22: 1}
Did not match all atoms present	24168-96-5	C1=CC(=C(C(=C1)Cl)COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-]	{33: 1, 2: 2, 3: 1, 14: 9, 17: 4, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	2417-04-1	CC1=CC(=CC(=C1O)C)C2=CC(=C(C(=C2)C)O)C	{1: 4, 21: 2, 14: 4}
Did not match all atoms present	2417-72-3	COC(=O)C1=CC=C(C=C1)CBr	{1: 1, 2: 1, 28: 1, 18: 1, 14: 4}
Did not match all atoms present	2417-77-8	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CBr	{2: 1, 18: 1, 14: 9}
Did not match all atoms present	24171-89-9	C1=CSC(=C1)P(C2=CC=CS2)C3=CC=CS3	{41: 3, 14: 9}
Did not match all atoms present	24173-36-2	C1=CC(=CC=C1C=O)N=[N+]=[N-]	{26: 1, 34: 2, 14: 4}
Did not match all atoms present	24178-85-6	C1CC2=CC=C(O2)CCC3=CC=C1C4=CC=CC=C34	{11: 4, 14: 8, 23: 1}
Did not match all atoms present	24192-58-3	CC(C)C1=CC=CC2=C1C(=CC=C2)C(C)C	{1: 4, 3: 2, 14: 6}
Did not match all atoms present	24197-62-4	CC(=O)SC1=CC=C(C=C1)C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4, 40: 1}
Did not match all atoms present	2420-16-8	C1=CC(=C(C=C1C=O)Cl)O	{17: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	2420-26-0	C1=CC(=C(C=C1Cl)O)C=O	{17: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	2420-87-3	C1=CC2=C(C=C1C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{28: 4, 14: 6}
Did not match all atoms present	2420-97-5	CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].[Cd+2]	{24: 2, 1: 2, 14: 8}
Did not match all atoms present	2420-98-6	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Cd+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	24203-21-2	[Re-]	{}
Did not match all atoms present	24203-36-9	[K+]	{}
Did not match all atoms present	24207-15-6	CCN1C(=CC=C(C1=S)O)C	{1: 2, 2: 1, 21: 1, 14: 2, 33: 1}
Did not match all atoms present	24207-38-3	C1=CC=C(C(=C1)C(=O)NCCO)O	{2: 2, 14: 4, 20: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	24207-41-8	C1=CC(=C(C=C1O)O)C(=O)NCCO	{2: 2, 14: 3, 20: 1, 21: 2, 24: 1, 31: 1}
Did not match all atoms present	2421-11-6	C1CN1C(CO)C2=CC=CC=C2	{33: 1, 2: 1, 3: 1, 11: 2, 14: 5, 20: 1}
Did not match all atoms present	2421-28-5	C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{24: 1, 28: 4, 14: 6}
Did not match all atoms present	24219-23-6	CCN(CC[N+]1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NC(=NS3)C4=CC=CC=C4.[Cl-]	{1: 1, 2: 3, 35: 2, 33: 2, 41: 1, 34: 2, 14: 14, 17: 1}
Did not match all atoms present	24219-37-2	CCCCCCC[CH2-].CCCCCCC[CH2-].[Mg+2]	{1: 2, 2: 12, 5: 2}
Did not match all atoms present	24219-97-4	CN1CCN2C(C1)C3=CC=CC=C3CC4=CC=CC=C42	{1: 1, 11: 4, 12: 1, 14: 8, 33: 2}
Did not match all atoms present	2422-79-9	CC1=C2C(=CC3=CC=CC=C13)C=CC4=CC=CC=C42	{1: 1, 14: 11}
Did not match all atoms present	2422-88-0	CCCCNC(=S)N(CCCC)CCCC	{1: 3, 2: 9, 31: 1, 33: 1, 7: 1}
Did not match all atoms present	24220-18-6	CC1=CC2=C(C=C1)[N+](=C(C=C2)C3=CC=C(C=C3)N(C)C)C.[Cl-]	{1: 4, 33: 2, 14: 9, 17: 1}
Did not match all atoms present	24221-86-1	C[C@H]([C@H](C1=CC=CC=C1)O)NC.Cl	{1: 2, 3: 2, 14: 5, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	24228-44-2	[Mn+3].[OH-]	{}
Did not match all atoms present	2423-66-7	C1=CC=C2C(=C1)N(C=C[N+]2=O)[O-]	{33: 2, 29: 2, 14: 6}
Did not match all atoms present	2423-71-4	CC1=CC(=CC(=C1O)C)[N+](=O)[O-]	{1: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	24231-46-7	C1COCCN1C2=NC(=NC(=N2)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)N7CCOCC7)S(=O)(=O)O)S(=O)(=O)O)NC8=CC=CC=C8	{33: 2, 35: 6, 6: 2, 11: 8, 14: 16, 20: 2, 23: 2, 29: 4, 31: 4}
Did not match all atoms present	24234-06-8	CCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 6, 11: 5, 18: 1}
Did not match all atoms present	24237-55-6	CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)N.Cl	{1: 1, 2: 2, 33: 1, 41: 1, 11: 3, 14: 5, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	24239-35-8	C1=CC(=CC=C1C2=NN(N=C2)C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N5N=CC(=N5)C6=CC=C(C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 35: 4, 14: 16, 6: 2, 29: 12}
Did not match all atoms present	2424-75-1	CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCC[NH+](C)C.[Cl-]	{1: 3, 2: 3, 4: 1, 14: 10, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	24242-19-1	C1=C(C=NC=C1N)C(=O)O	{35: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	24245-27-0	C1=CC=C(C=C1)NC(=[NH+]C2=CC=CC=C2)N.[Cl-]	{17: 1, 31: 2, 30: 1, 14: 10, 7: 1}
Did not match all atoms present	24248-21-3	CCOC(=O)C1=C(ON=C1C2=C(C=CC=C2Cl)Cl)C	{1: 2, 2: 1, 35: 1, 14: 3, 17: 2, 23: 1, 28: 1}
Did not match all atoms present	2425-01-6	C1C(O1)COC2=CC=C(C=C2)OCC3CO3	{2: 2, 11: 2, 12: 2, 14: 4, 22: 2, 23: 2}
Did not match all atoms present	2425-10-7	CC1=C(C=C(C=C1)OC(=O)NC)C	{1: 3, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	2425-15-2	CCOP(=S)(OCC)OC1=CC(=C(C=C1)[N+](=O)[O-])C	{1: 3, 2: 2, 38: 1, 22: 3, 14: 3}
Did not match all atoms present	2425-25-4	CCOC(=O)CSP(=O)(OCC)OCC	{1: 3, 2: 4, 40: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	2425-41-4	C1C(COC(O1)C2=CC=CC=C2)(CO)CO	{2: 2, 11: 2, 12: 1, 13: 1, 14: 5, 20: 2, 23: 2}
Did not match all atoms present	2425-85-6	CC1=CC(=C(C=C1)NN=C2C(=O)C=CC3=CC=CC=C32)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 14: 9, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	24254-18-0	[GeH3].[GeH3].[Se]	{}
Did not match all atoms present	24254-59-9	COC(=O)CCCC1=CC=C(C=C1)OC2=CC=CC=C2	{1: 1, 2: 3, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	24254-61-3	CC(CC(=O)OC)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1, 14: 4, 28: 1}
Did not match all atoms present	24254-66-8	CC1=CC=C(C=C1)C(C)CC(=O)OC	{1: 3, 2: 1, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	24254-67-9	CC(CC(=O)OC)C1=CC=C(C=C1)C2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 28: 1, 14: 9}
Did not match all atoms present	24256-56-2	CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC(=CC=C4)S(=O)(=O)[O-].O.O.O.[Na+].[Cr+3]	{1: 1, 34: 2, 35: 1, 33: 1, 14: 9, 29: 6}
Did not match all atoms present	2426-65-5	COC1=CC2=C(C=C1)NC=C2CCN3CCCC3	{32: 1, 1: 1, 2: 2, 33: 1, 11: 4, 14: 4, 22: 1}
Did not match all atoms present	2426-87-1	COC1=C(C=CC(=C1)C=O)OCC2=CC=CC=C2	{1: 1, 2: 1, 26: 1, 22: 2, 14: 8}
Did not match all atoms present	2426-94-0	C1=CN=CN=C1C2=NC=NC=C2	{35: 4, 14: 6}
Did not match all atoms present	24260-42-2	COC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 26: 1, 14: 4}
Did not match all atoms present	24262-07-5	CC1=C2CCC3=CC=C(CCC(=C1)C=C2)C=C3	{1: 1, 11: 4, 14: 7}
Did not match all atoms present	24263-92-1	CCCCCCCCCCCCCC(=O)OC1=CN(C2=CC=CC=C21)C	{1: 2, 2: 12, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	24268-87-9	C[NH+](C)CCN1C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C31.[Cl-]	{1: 2, 2: 2, 38: 1, 33: 1, 14: 7, 17: 1, 25: 1}
Did not match all atoms present	24268-89-1	C[NH+](C)CCCN1C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C31.[Cl-]	{1: 2, 2: 3, 38: 1, 33: 1, 14: 7, 17: 1, 25: 1}
Did not match all atoms present	2427-06-7	CN1CCN(C2=CC=CC=C21)C	{1: 2, 11: 2, 14: 4, 33: 2}
Did not match all atoms present	2427-71-6	C1=CC2=C(C=C1Cl)N=CC(=O)N2	{32: 1, 17: 1, 35: 1, 14: 4, 25: 1}
Did not match all atoms present	24273-19-6	CCCC(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	24277-43-8	C[C@@H](C1=CC=CC=C1)N=C=S	{8: 1, 1: 1, 34: 1, 3: 1, 14: 5}
Did not match all atoms present	24277-44-9	C[C@H](C1=CC=CC=C1)N=C=S	{8: 1, 1: 1, 34: 1, 3: 1, 14: 5}
Did not match all atoms present	24279-39-8	C1=C(C=C(C(=C1Cl)N)Cl)C(F)(F)F	{16: 3, 17: 2, 4: 1, 30: 1, 14: 2}
Did not match all atoms present	2428-04-8	C1(=NC(=NC(=N1)N(Cl)Cl)N(Cl)Cl)N(Cl)Cl	{17: 6, 35: 3, 33: 3}
Did not match all atoms present	2428-06-0	CC1(COP(OC1)Cl)C	{23: 2, 1: 2, 11: 2, 13: 1, 17: 1}
Did not match all atoms present	24280-93-1	CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CCC(=O)O)OC	{1: 3, 2: 3, 6: 1, 7: 1, 11: 1, 21: 1, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	24283-57-6	CC1=C(C=CC(=C1)F)NC(=O)C2=C(C(=CC(=C2)Cl)C3=CC=C(C=C3)Cl)O	{1: 1, 14: 9, 16: 1, 17: 2, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	24286-05-3	[2H]C=O	{5: 1}
Did not match all atoms present	2429-73-4	C1=CC(=CC=C1C2=CC=C(C=C2)N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/5\C(=CC6=C(C5=O)C=C(C=C6)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 14: 15, 15: 4, 25: 2, 29: 9, 30: 2, 31: 2}
Did not match all atoms present	2429-74-5	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=O)C4=C(C=C(C=C4C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])N)OC)N/N=C/5\C(=O)C6=C(C=C(C=C6C=C5S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 12, 15: 4, 22: 2, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	2429-79-0	C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)N/N=C/5\C=CC(=O)C(=C5)C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 16, 15: 2, 24: 1, 25: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	2429-80-3	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)N=NC5=C6C=CC(=CC6=CC(=C5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 4, 14: 20, 22: 1, 29: 8, 30: 1}
Did not match all atoms present	2429-81-4	CC1=CC(=C(C(=C1N)N=NC2=CC=C(C=C2)C3=CC=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-])N)N=NC5=C(C=C6C=C(/C(=N\NC7=CC=C(C8=CC=CC=C87)S(=O)(=O)[O-])/C(=O)C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 6, 14: 21, 15: 4, 24: 1, 25: 2, 29: 9, 30: 2, 31: 2}
Did not match all atoms present	2429-82-5	C1=CC(=CC=C1C2=CC=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-])N/N=C/5\C=CC(=O)C(=C5)C(=O)[O-].[Na+].[Na+]	{34: 2, 14: 15, 15: 4, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	2429-83-6	CC1=CC(=C(C=C1N)N)N=NC2=CC=C(C=C2)C3=CC=C(C=C3)N=NC4=C(C=C5C=C(C(=NNC6=CC=CC=C6)C(=O)C5=C4N)S(=O)(=O)O)S(=O)(=O)O.[Na+]	{1: 1, 34: 5, 14: 17, 15: 2, 20: 2, 25: 1, 29: 4, 30: 3, 31: 1}
Did not match all atoms present	2429-84-7	C1=CC(=CC=C1C2=CC=C(C=C2)N/N=C\3/C=CC(=O)C(=C3)C(=O)[O-])NNC4=C5C(=CC(=CC5=O)S(=O)(=O)[O-])C=CC4=N.[Na+].[Na+]	{34: 1, 36: 1, 14: 15, 15: 7, 24: 1, 25: 2, 29: 3, 31: 3}
Did not match all atoms present	24291-69-8	CC(=C)C(=O)OC1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl	{1: 1, 5: 1, 38: 2, 7: 1, 14: 1, 17: 2, 28: 1}
Did not match all atoms present	24291-70-1	C/C=C/C(=O)OC1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl	{1: 1, 6: 2, 38: 2, 14: 1, 17: 2, 28: 1}
Did not match all atoms present	24292-52-2	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC(=C(C(=C3)OC)C(=O)/C=C/C4=CC(=C(C=C4)OC)O)O)O)O)O)O)O)O	{1: 3, 2: 1, 6: 2, 12: 10, 14: 5, 20: 6, 21: 2, 22: 4, 23: 2, 24: 1}
Did not match all atoms present	24293-73-0	C[N+](C)(C)CC(=O)C1=CC=C(C=C1)N.[Cl-]	{1: 3, 2: 1, 14: 4, 17: 1, 24: 1, 30: 1}
Did not match all atoms present	24295-03-2	CC(=O)C1=NC=CS1	{24: 1, 1: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	24297-29-8	[Br-].[Br-].[Br-].[Cf]	{18: 3}
Did not match all atoms present	24298-17-7	CCCCCCCC[N+](CCC)(CCCCCCCC)CCCCCCCC.[Br-]	{1: 4, 2: 23, 18: 1}
Did not match all atoms present	243-17-4	C1C2=CC=CC=C2C3=CC4=CC=CC=C4C=C31	{11: 1, 14: 10}
Did not match all atoms present	243-24-3	C1=CC=C2C(=C1)C=C3C2=CC4=CC=CC=C4O3	{14: 10, 23: 1}
Did not match all atoms present	243-28-7	C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4N3	{32: 1, 14: 10}
Did not match all atoms present	243-42-5	C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4O3	{14: 10, 23: 1}
Did not match all atoms present	243-46-9	C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4S3	{41: 1, 14: 10}
Did not match all atoms present	243-59-4	C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N=C3N2	{32: 1, 35: 2, 14: 8}
Did not match all atoms present	2430-16-2	C1=CC=C(C=C1)CCCCCCO	{2: 6, 20: 1, 14: 5}
Did not match all atoms present	24301-86-8	CCC(C1=CC=CC=C1)[NH3+].[Cl-]	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	24301-89-1	C1=CC=C(C=C1)CC(C2=CC=CC=C2)N.Cl	{17: 1, 2: 1, 3: 1, 30: 1, 14: 10}
Did not match all atoms present	24303-76-2	CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=O)N2C	{1: 2, 35: 1, 33: 1, 14: 8, 25: 1}
Did not match all atoms present	24304-00-5	N#[Al]	{}
Did not match all atoms present	24305-27-9	C1CC(N(C1)C(=O)C(CC2=CN=CN2)NC(=O)C3CCC(=O)N3)C(=O)N	{32: 2, 33: 1, 2: 1, 3: 1, 11: 5, 12: 2, 14: 2, 35: 1, 24: 3, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	24305-56-4	CCCCCCCCCCCCC1=C(C=C(C=C1)O)O	{1: 1, 2: 11, 21: 2, 14: 3}
Did not match all atoms present	24306-23-8	CC1=CC=C(C=C1)CCCC(=O)OC	{1: 2, 2: 3, 28: 1, 14: 4}
Did not match all atoms present	24307-26-4	C[N+]1(CCCCC1)C.[Cl-]	{1: 2, 11: 5, 17: 1}
Did not match all atoms present	24308-84-7	C1=CC=C(C=C1)S(=O)[O-].C1=CC=C(C=C1)S(=O)[O-].[Zn+2]	{29: 4, 14: 10}
Did not match all atoms present	24309-43-1	C1C=CC2CC1C3=CC=CC=C23	{11: 2, 12: 2, 14: 6}
Did not match all atoms present	24309-48-6	C#CCN=C=S	{8: 1, 9: 1, 2: 1, 34: 1, 10: 1}
Did not match all atoms present	2431-00-7	CC1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2	{24: 2, 1: 1, 14: 9}
Did not match all atoms present	2431-96-1	CCN(CC)C(=O)CC1=CC=CC=C1	{24: 1, 1: 2, 2: 3, 14: 5, 33: 1}
Did not match all atoms present	24310-40-5	C1=CC=C2C(=C1)C(=O)N(N=N2)CO	{33: 1, 2: 1, 35: 2, 14: 4, 20: 1, 25: 1}
Did not match all atoms present	24310-41-6	C1=CC=C2C(=C1)C(=O)N(N=N2)CCl	{33: 1, 2: 1, 35: 2, 14: 4, 17: 1, 25: 1}
Did not match all atoms present	24312-07-0	[GeH3].[GeH3].[Te]	{}
Did not match all atoms present	243120-33-4	CCCOC1=NC(=O)[N-]N1.[K+]	{32: 1, 1: 1, 2: 2, 35: 2, 22: 1, 25: 1}
Did not match all atoms present	24313-88-0	COC1=CC(=CC(=C1OC)OC)N	{1: 3, 30: 1, 22: 3, 14: 2}
Did not match all atoms present	24318-00-1	C1=CC=C(C=C1)COC2=CC=CC(=C2)[N+](=O)[O-]	{2: 1, 38: 1, 22: 1, 14: 9}
Did not match all atoms present	24318-02-3	C1=CC=C(C=C1)COC2=CC(=CC=C2)Cl	{17: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	2432-11-3	C1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=CC=C3)O	{21: 1, 14: 13}
Did not match all atoms present	2432-12-4	CC1=CC(=C(C(=C1)Cl)O)Cl	{1: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	2432-14-6	CC1=CC(=C(C(=C1)Br)O)Br	{1: 1, 18: 2, 21: 1, 14: 2}
Did not match all atoms present	2432-90-8	CCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCCC	{1: 2, 2: 22, 28: 2, 14: 4}
Did not match all atoms present	24324-17-2	C1=CC=C2C(=C1)C(C3=CC=CC=C32)CO	{20: 1, 2: 1, 12: 1, 14: 8}
Did not match all atoms present	24325-70-0	CC1=CC=C(C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 38: 1, 14: 8, 6: 2}
Did not match all atoms present	2433-56-9	C1=CC=C2C(=C1)C=CC3=C2C=CC=C3O	{21: 1, 14: 9}
Did not match all atoms present	24342-55-0	C[NH+]1CCCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.[Cl-]	{1: 1, 3: 1, 33: 1, 11: 5, 14: 9, 17: 2}
Did not match all atoms present	24345-16-2	CC1C(=O)NC(C(=O)NC(C(=O)NC(CSSCC2C(=O)NC(C(=O)NC(C(=O)N3CCCC3C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)N2)CC(=O)N)N)C(=O)N1)CC(C)C)C)C(C)O)CCC(=O)O)C)CCCCN)C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)N)C(=O)NC(CC4=CN=CN4)C(=O)N)CCCNC(=N)N)CCCNC(=N)N	{32: 14, 1: 6, 2: 19, 3: 5, 36: 2, 33: 1, 7: 2, 41: 4, 11: 7, 12: 15, 14: 2, 35: 1, 20: 1, 24: 7, 25: 14, 27: 1, 30: 8, 31: 5}
Did not match all atoms present	24346-56-3	CCC(C(=O)C1=CC=CC=C1)C(=O)OCC	{1: 2, 2: 2, 3: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	2435-64-5	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)N	{1: 2, 34: 2, 33: 1, 14: 8, 29: 2, 30: 1}
Did not match all atoms present	2435-76-9	C1=C(C(=O)NC(=N1)[O-])[N+]#N	{32: 1, 25: 1, 34: 1, 35: 1, 14: 1}
Did not match all atoms present	24351-11-9	CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCCS(=O)(=O)[O-])C	{1: 2, 2: 4, 33: 2, 14: 2, 17: 2, 29: 3}
Did not match all atoms present	24351-12-0	CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CC)C.[I-]	{1: 3, 2: 2, 33: 2, 14: 2, 17: 2, 19: 1}
Did not match all atoms present	24353-58-0	CC1=C(C(=CC=C1)C)N(COCC(C)C)C(=O)CCl	{1: 4, 2: 3, 3: 1, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	24356-01-2	[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr+4]	{5: 4, 14: 20}
Did not match all atoms present	24356-60-3	CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CSC3=CC=NC=C3)SC1)C(=O)[O-].[Na+]	{1: 1, 2: 2, 35: 1, 33: 1, 40: 1, 41: 1, 11: 1, 12: 2, 14: 4, 15: 2, 24: 2, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	24356-94-3	CC(=O)[C@@]12[C@@H](C[C@@H]3C1(CC[C@H]4C3CCC5=CC(=O)CCC45C)C)OC(O2)(C)C6=CC=CC=C6	{1: 4, 11: 7, 12: 4, 13: 4, 14: 6, 15: 1, 23: 2, 24: 1, 25: 1}
Did not match all atoms present	24358-29-0	CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O)C	{1: 2, 33: 1, 11: 3, 12: 2, 14: 3, 17: 1, 27: 1, 29: 2}
Did not match all atoms present	24358-62-1	CC(C1=CC=C(C=C1)Br)N	{1: 1, 18: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	2436-66-0	CN1C=NC2=CC=CC=C2C1=O	{1: 1, 35: 1, 33: 1, 14: 5, 25: 1}
Did not match all atoms present	2436-73-9	CC1=C(C=CC(=C1)Cl)OCC(=O)OC	{1: 2, 2: 1, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	2436-79-5	CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)C	{32: 1, 1: 4, 2: 2, 28: 2}
Did not match all atoms present	2436-85-3	CN(C)C1=CC2=CC=CC=C2C=C1	{1: 2, 14: 7, 33: 1}
Did not match all atoms present	2436-92-2	CC1=C(C2=CC=CC=C2N=C1)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	2436-96-6	C1=CC=C(C(=C1)C2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	24360-63-2	CC1=C2C(=CC3=CC=CC=C13)C4=CC=CC=C4S2	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	24363-37-9	CC(C)[O-].CC(C)[O-].[Ba+2]	{1: 4, 3: 2, 29: 2}
Did not match all atoms present	24365-61-5	C1CCN(C1)CCOC2=CC=C(C=C2)C3=C(OC4=C3C5=CC=CC=C5C=C4)C6=CC=CC=C6	{33: 1, 2: 2, 11: 4, 14: 15, 22: 1, 23: 1}
Did not match all atoms present	2437-03-8	CCNC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 1, 14: 7, 31: 1}
Did not match all atoms present	2437-23-2	CCCCCCCCCCCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 10}
Did not match all atoms present	2437-29-8	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O	{1: 8, 33: 4, 7: 2, 14: 26, 15: 4, 24: 2, 27: 4}
Did not match all atoms present	2437-33-4	C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)Cl	{17: 1, 22: 1, 14: 9, 29: 2}
Did not match all atoms present	2437-66-3	CC1=CC(=C(C(=C1)C(=O)O)C)C	{1: 3, 27: 1, 14: 2}
Did not match all atoms present	2437-72-1	CC1=C(C2=CC=CC=C2N=C1C)C	{1: 3, 35: 1, 14: 4}
Did not match all atoms present	2437-76-5	CC1=C(C=C(C=C1)C(C)C)Br	{1: 3, 18: 1, 3: 1, 14: 3}
Did not match all atoms present	2437-79-8	C1=CC(=C(C=C1Cl)Cl)C2=C(C=C(C=C2)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	2437-88-9	CCOC1=CC(=CC(=C1)OCC)OCC	{1: 3, 2: 3, 22: 3, 14: 3}
Did not match all atoms present	2437-98-1	CCCN(C1=CC=CC=C1)C(=O)C	{24: 1, 1: 2, 2: 2, 14: 5, 33: 1}
Did not match all atoms present	24370-25-0	C1=CC=C2C(=C1)NC(=N2)NC(=O)N	{32: 1, 35: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	24371-94-6	C1CCC(CC1)[Hg]Cl	{17: 1, 11: 5, 12: 1}
Did not match all atoms present	24378-32-3	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[N-]=O.[Fe+4].[Ba+2]	{29: 1}
Did not match all atoms present	2438-03-1	CCCC1=CC=CC=C1C(=O)O	{1: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	2438-05-3	CCCC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	2438-32-6	CN(C)CC[C@@H](C1=CC=C(C=C1)Cl)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O	{1: 2, 2: 2, 3: 1, 6: 2, 33: 1, 14: 8, 17: 1, 35: 1, 27: 2}
Did not match all atoms present	2438-49-5	CN(C)C1=C(C=C(C=C1)N=NC2=CC=CC=C2)OC	{1: 3, 34: 2, 22: 1, 14: 8, 33: 1}
Did not match all atoms present	2438-51-9	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C=C2)O	{24: 1, 1: 1, 20: 1, 14: 9, 33: 1}
Did not match all atoms present	2438-72-4	CCCCOC1=CC=C(C=C1)CC(=O)NO	{1: 1, 2: 4, 14: 4, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	2438-88-2	COC1=C(C(=C(C(=C1Cl)Cl)[N+](=O)[O-])Cl)Cl	{1: 1, 38: 1, 22: 1, 17: 4}
Did not match all atoms present	24382-04-5	[CH-](C=O)C=O.[Na+]	{26: 2, 6: 1}
Did not match all atoms present	24385-10-2	COC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=C4C[C@](C[C@@H](C4=C3O)O)(C(=O)CO)O)O	{1: 1, 2: 1, 11: 2, 12: 1, 13: 1, 14: 3, 20: 3, 21: 2, 22: 1, 24: 1, 25: 2}
Did not match all atoms present	24386-06-9	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=C5)C=CC7=C6C8=C(C=CC9=C8C1=C(C=CC2=C1C1=C(C=C2)C=CC2=CC=CC=C21)C=C9)C=C7)C=C3	{14: 30}
Did not match all atoms present	24387-68-6	C1=CN=CC(=O)N1.[Na+]	{32: 1, 25: 1, 35: 1, 14: 3}
Did not match all atoms present	2439-00-1	C1=CC(=C(C(=C1Cl)CC(=O)[O-])Cl)Cl.[Na+]	{24: 1, 17: 3, 2: 1, 14: 2}
Did not match all atoms present	2439-01-2	CC1=CC2=C(C=C1)N=C3C(=N2)SC(=O)S3	{1: 1, 35: 2, 41: 2, 14: 3, 25: 1}
Did not match all atoms present	2439-04-5	C1=CC2=C(C=CN=C2)C(=C1)O	{35: 1, 21: 1, 14: 6}
Did not match all atoms present	2439-77-2	COC1=CC=CC=C1C(=O)N	{24: 1, 1: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	2439-99-8	C(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O	{33: 1, 2: 3, 27: 1, 20: 4, 29: 2}
Did not match all atoms present	24390-65-6	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=CC=CC=C3Cl	{34: 1, 14: 10, 15: 1, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	24391-36-4	CN(C)C1=NC(=O)NC2=C1NC=N2	{32: 2, 1: 2, 35: 2, 33: 1, 14: 1, 25: 1}
Did not match all atoms present	24393-53-1	CCOC(=O)/C=C/C1=CC=C(C=C1)Br	{1: 1, 2: 1, 6: 2, 14: 4, 18: 1, 28: 1}
Did not match all atoms present	243968-60-7	CC(C[NH2+]CC(C)O)O.[F-]	{16: 1, 1: 2, 2: 2, 3: 2, 20: 2}
Did not match all atoms present	24398-88-7	CCOC(=O)C1=CC(=CC=C1)Br	{1: 1, 2: 1, 28: 1, 18: 1, 14: 4}
Did not match all atoms present	244-63-3	C1=CC=C2C(=C1)C3=C(N2)C=NC=C3	{32: 1, 35: 1, 14: 7}
Did not match all atoms present	244-95-1	C1=CC=C2C(=C1)C3=CC=CC=C3[Se]2	{14: 8}
Did not match all atoms present	244-98-4	C1=CC=C2C(=C1)C3=CC=CC=C3[Te]2	{14: 8}
Did not match all atoms present	244-99-5	C1C2=C(C3=CC=CC=C31)N=CC=C2	{35: 1, 11: 1, 14: 7}
Did not match all atoms present	2440-22-4	CC1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2	{1: 1, 35: 2, 21: 1, 14: 7, 33: 1}
Did not match all atoms present	2440-29-1	CCCC(=O)O[Hg]C1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	2440-40-6	CCC[Hg]Cl	{1: 1, 2: 2, 17: 1}
Did not match all atoms present	2440-42-8	CC[Hg]I	{1: 1, 2: 1, 19: 1}
Did not match all atoms present	2440-45-1	CC[Hg]OP(=O)(O)O[Hg]CC	{1: 2, 2: 2, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	24400-84-8	CC(C)[Si](CC=C)(C(C)C)C(C)C	{1: 6, 2: 1, 3: 3, 5: 1, 6: 1}
Did not match all atoms present	24402-98-0	C1CC2CC1C3C2C(=O)C4=CC=CC=C4C3=O	{25: 2, 11: 3, 12: 4, 14: 4}
Did not match all atoms present	24406-93-7	O[Si](O)(O)O[Si](O)(O)O.[Pr+3].[Pr+3]	{20: 6, 22: 1}
Did not match all atoms present	24407-32-7	C12=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)NC2=O	{32: 1, 25: 2, 18: 4}
Did not match all atoms present	24407-55-4	CC(CC1=CC=CC=C1OC)[NH2+]C(C)CC2=CC=CC=C2OC.CC(C(=O)[O-])O	{1: 5, 2: 2, 3: 3, 14: 8, 20: 1, 22: 2, 24: 1}
Did not match all atoms present	2441-27-2	C=C([Si](Cl)(Cl)Cl)Cl	{17: 4, 5: 1, 7: 1}
Did not match all atoms present	2441-46-5	COC1=CC(=C(C=C1OC)OC)OC	{1: 4, 22: 4, 14: 2}
Did not match all atoms present	2441-88-5	C1=CC=C(C=C1)C(CNC2=NC=CC=N2)O.Cl	{2: 1, 3: 1, 14: 8, 17: 1, 35: 2, 20: 1, 31: 1}
Did not match all atoms present	24410-52-4	CC1=C(C=C2C(=C1)C=CO2)C	{1: 2, 14: 4, 23: 1}
Did not match all atoms present	24411-61-8	CC(C)(C)NP(C(C)(C)C)Cl	{1: 6, 31: 1, 4: 2, 17: 1}
Did not match all atoms present	24413-04-5	CO[Si](C1=CC=C(C=C1)CCl)(OC)OC	{1: 3, 2: 1, 22: 3, 14: 4, 17: 1}
Did not match all atoms present	24415-66-5	CC1=NC2=NC=NN2C(=C1)Cl	{1: 1, 35: 3, 33: 1, 14: 2, 17: 1}
Did not match all atoms present	24416-28-2	C1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=CC=C3	{24: 2, 34: 1, 14: 15, 7: 1}
Did not match all atoms present	244205-60-5	CC(C)(C)OC(=O)N[C@@]1(C[C@H]1C2=CC=CC=C2)C(=O)O	{1: 3, 4: 1, 11: 1, 12: 1, 13: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	24421-05-4	CN1CCCNC1=S	{32: 1, 1: 1, 11: 3, 33: 1, 15: 1}
Did not match all atoms present	24423-68-5	CC(C)CC[Hg]CCC(C)C	{1: 4, 2: 4, 3: 2}
Did not match all atoms present	24423-87-8	C1C[N+](=CC2=CC=CC=C21)[O-]	{33: 1, 11: 2, 29: 1, 14: 5}
Did not match all atoms present	24424-99-5	CC(C)(C)OC(=O)OC(=O)OC(C)(C)C	{1: 6, 4: 2}
Did not match all atoms present	24425-13-6	CC(C)(C)C1=NC2=CC=CC=C2N1	{32: 1, 1: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	24425-40-9	C1CC2=C(C1)C=C(C=C2)N	{11: 3, 30: 1, 14: 3}
Did not match all atoms present	24426-36-6	CC(C)[NH+](CCCl)CCCl.[Cl-]	{1: 2, 2: 4, 3: 1, 17: 3}
Did not match all atoms present	2443-58-5	C1C2=CC=CC=C2C3=C1C=C(C=C3)O	{11: 1, 21: 1, 14: 7}
Did not match all atoms present	24431-27-4	CCC1=CC=C(C=C1)OCC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	24433-71-4	CCN1C(=NN=N1)C2=CC=CC=C2	{1: 1, 2: 1, 35: 3, 14: 5, 33: 1}
Did not match all atoms present	24437-41-0	CN1C=CC=C1CC#N	{1: 1, 2: 1, 37: 1, 14: 3, 33: 1}
Did not match all atoms present	24438-17-3	CC1C2=CC=CC=C2N(C1=O)C	{1: 2, 12: 1, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	2444-19-1	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)O	{28: 1, 21: 1, 14: 9}
Did not match all atoms present	2444-28-2	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)O	{1: 6, 4: 2, 21: 2, 14: 2}
Did not match all atoms present	2444-36-2	C1=CC=C(C(=C1)CC(=O)O)Cl	{17: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	2444-68-0	C=CC1=C2C=CC=CC2=CC3=CC=CC=C31	{14: 9, 5: 1, 6: 1}
Did not match all atoms present	2444-89-5	C1=CC(=CC=C1OC2=CC=C(C=C2)Cl)Cl	{17: 2, 22: 1, 14: 8}
Did not match all atoms present	2444-90-8	CC(C)(C1=CC=C(C=C1)[O-])C2=CC=C(C=C2)[O-].[Na+].[Na+]	{1: 2, 4: 1, 14: 8}
Did not match all atoms present	24442-68-0	CC1CC(CC(C1)(C)C)OC=O	{1: 3, 26: 1, 11: 3, 12: 2, 13: 1}
Did not match all atoms present	24446-63-7	CCOC(=O)C(=CC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 6: 1, 7: 1, 14: 10, 28: 1}
Did not match all atoms present	2445-07-0	CN(C)C(=S)S[As](C)SC(=S)N(C)C	{40: 2, 1: 5, 33: 2, 7: 2}
Did not match all atoms present	2445-81-0	COC1=CC=CC2=C1OC(=O)C=C2	{1: 1, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	2445-82-1	CC1=CC2=CC=CC=C2OC1=O	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	2445-83-2	CC1=CC2=C(C=C1)C=CC(=O)O2	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	24455-25-2	C1=CC(=CC=C1SC(=O)C(=O)SC2=CC=C(C=C2)Cl)Cl	{24: 2, 17: 2, 14: 8, 40: 2}
Did not match all atoms present	24456-59-5	COC1=C(C=C2C(=C1)CCNC2=S)OC	{32: 1, 1: 2, 11: 2, 14: 2, 15: 1, 22: 2}
Did not match all atoms present	24458-48-8	CC(C)(CNC1=CC=C(C=C1)N=O)[N+](=O)[O-]	{1: 2, 2: 1, 4: 1, 38: 1, 34: 1, 14: 4, 29: 1, 31: 1}
Did not match all atoms present	2446-69-7	CCCCCCC1=CC=C(C=C1)O	{1: 1, 2: 5, 21: 1, 14: 4}
Did not match all atoms present	24460-06-8	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)N	{1: 2, 2: 2, 33: 1, 13: 1, 14: 10, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	24463-15-8	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CO	{2: 1, 20: 1, 14: 9}
Did not match all atoms present	24463-19-2	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CCl	{17: 1, 2: 1, 14: 9}
Did not match all atoms present	2447-54-3	C[N+]1=C2C(=C3C=CC4=C(C3=C1)OCO4)C=CC5=CC6=C(C=C52)OCO6	{1: 1, 11: 2, 33: 1, 14: 7, 23: 4}
Did not match all atoms present	2447-57-6	COC1=C(N=CN=C1OC)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 2, 35: 2, 14: 5, 22: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	2447-79-2	C1=CC(=C(C=C1Cl)Cl)C(=O)N	{24: 1, 17: 2, 30: 1, 14: 3}
Did not match all atoms present	24470-76-6	CC(C)C[Hg]CC(C)C	{1: 4, 2: 2, 3: 2}
Did not match all atoms present	24470-78-8	CC(C)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]	{19: 1, 1: 2, 3: 1, 14: 15}
Did not match all atoms present	24471-48-5	C1=CC2=C3C(=C1)C=CC4=C3C(=CC(=C4)CO)C=C2	{2: 1, 20: 1, 14: 9}
Did not match all atoms present	24473-06-1	CC(C)(C)C(=O)COC1=CC=C(C=C1)Cl	{1: 3, 2: 1, 4: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	24477-37-0	CC1=CC(=NO1)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3	{1: 1, 2: 2, 35: 1, 11: 5, 12: 1, 14: 5, 23: 1, 24: 2, 29: 2, 31: 3}
Did not match all atoms present	2448-39-7	C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)O.C1=CC2=C(C=CC(=O)O2)C=C1N	{27: 1, 28: 2, 30: 1, 14: 10}
Did not match all atoms present	24484-21-7	C1CCC(=O)C2=C(C1)C=CC(=C2)F	{16: 1, 25: 1, 11: 4, 14: 3}
Did not match all atoms present	2449-05-0	C1=CC=C(C=C1)COC(=O)N=NC(=O)OCC2=CC=CC=C2	{2: 2, 28: 2, 34: 2, 14: 10}
Did not match all atoms present	2449-14-1	C1=CC=C(C=C1)OC(=O)N=NC(=O)OC2=CC=CC=C2	{34: 2, 28: 2, 14: 10}
Did not match all atoms present	2449-35-6	C1=CC(=CC=C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)C(=O)O	{27: 2, 29: 2, 14: 8}
Did not match all atoms present	2449-49-2	CC(C1=CC=CC=C1)N(C)C	{1: 3, 3: 1, 14: 5, 33: 1}
Did not match all atoms present	24490-39-9	CP(C)[Se]C	{1: 3}
Did not match all atoms present	24496-65-9	C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C=NC5=CC=C4	{35: 1, 14: 11}
Did not match all atoms present	2450-55-7	C1=CC=C(C=C1)/C(=C(\C#N)/C2=CC=CC=C2)/C#N	{37: 2, 14: 10, 7: 2}
Did not match all atoms present	2451-79-8	CCCCOC(=O)C1=CC(=C(C=C1C(=O)OCCCC)C(=O)OCCCC)C(=O)OCCCC	{1: 4, 2: 12, 28: 4, 14: 2}
Did not match all atoms present	2451-84-5	C1=CC=C(C=C1)COC(=O)CCCCC(=O)OCC2=CC=CC=C2	{2: 6, 28: 2, 14: 10}
Did not match all atoms present	24518-45-4	CCOC(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC=C(C=C2)C(=O)C(Cl)Cl	{1: 1, 2: 1, 3: 2, 38: 1, 14: 8, 17: 2, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	2452-01-9	CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 20}
Did not match all atoms present	2452-70-2	CC(C)CCOP(=O)(C)OCCC(C)C	{1: 5, 2: 4, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	2452-84-8	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(CCO)CCO	{33: 1, 2: 4, 20: 2, 34: 2, 14: 9}
Did not match all atoms present	24520-19-2	C1(=C(C(=C(C(=C1F)F)F)F)F)OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F	{16: 14, 4: 3, 22: 2, 7: 2}
Did not match all atoms present	24521-72-0	C1=CC(=CC(=C1)[Sn](C2=CC=CC(=C2)F)(C3=CC=CC(=C3)F)C4=CC=CC(=C4)F)F	{16: 4, 14: 16}
Did not match all atoms present	24523-60-2	CC(C)(C)C1=CC=CC=C1C(C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 3: 1, 4: 1, 14: 14}
Did not match all atoms present	24526-64-5	CN1CC(C2=C(C1)C(=CC=C2)N)C3=CC=CC=C3	{1: 1, 33: 1, 11: 2, 12: 1, 14: 8, 30: 1}
Did not match all atoms present	24530-53-8	C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-])[O-].[Ba+2]	{34: 2, 29: 3, 14: 12}
Did not match all atoms present	24530-67-4	CC(=O)NC1=CC(=C(C=C1)OC)N(CCO)CCO	{1: 2, 2: 4, 33: 1, 14: 3, 20: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	24536-75-2	CCOC(=O)CN1CCN(CC1)C(=O)/C=C\C2=CC(=C(C(=C2)OC)OC)OC.C(=C/C(=O)O)\C(=O)O	{1: 4, 2: 2, 6: 4, 33: 2, 11: 4, 14: 2, 22: 3, 24: 1, 27: 2, 28: 1}
Did not match all atoms present	24539-60-4	CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)O	{1: 1, 2: 9, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	2454-37-7	CC(C1=CC(=CC=C1)N)O	{1: 1, 3: 1, 20: 1, 30: 1, 14: 4}
Did not match all atoms present	24540-94-1	CCCCCCCCCCN=C=S	{8: 1, 1: 1, 2: 9, 34: 1}
Did not match all atoms present	24544-04-5	CC(C)C1=C(C(=CC=C1)C(C)C)N	{1: 4, 3: 2, 30: 1, 14: 3}
Did not match all atoms present	24544-08-9	CCC1=CC(=CC(=C1N)CC)C	{1: 3, 2: 2, 30: 1, 14: 2}
Did not match all atoms present	24549-06-2	CCC1=CC=CC(=C1N)C	{1: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	24552-27-0	C1=CC=C(C=C1)OC(=O)CCCl	{17: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	24554-26-5	C1=C(OC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC=O	{35: 1, 38: 1, 41: 1, 14: 3, 23: 1, 26: 1, 31: 1}
Did not match all atoms present	24556-64-7	C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2O)Br)Br	{24: 1, 18: 2, 21: 1, 14: 7, 31: 1}
Did not match all atoms present	24557-04-8	CCCCC(=O)[O-].CCCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 6}
Did not match all atoms present	24558-36-9	CC1=CC(=CC(=C1N(C)C)C)[N+](=O)[O-]	{1: 4, 38: 1, 14: 2, 33: 1}
Did not match all atoms present	2456-45-3	CC(C1=CC=CC=C1)C2=CC(=C(C=C2)OC)C(C)C3=CC=CC=C3	{1: 3, 3: 2, 22: 1, 14: 13}
Did not match all atoms present	2456-81-7	C1CCN(C1)C2=CC=NC=C2	{33: 1, 11: 4, 14: 4, 35: 1}
Did not match all atoms present	24565-13-7	CCNC1=NC(=NC(=N1)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)NCC)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC=CC=C6.[Na+].[Na+]	{1: 2, 2: 2, 35: 6, 6: 2, 14: 16, 29: 6, 31: 6}
Did not match all atoms present	24566-79-8	C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCCBr	{25: 2, 2: 6, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	24567-53-1	PCl	{17: 1}
Did not match all atoms present	2457-01-4	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ba+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	2457-02-5	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Sr+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	2457-47-8	C1=C(C=NC=C1Cl)Cl	{17: 2, 35: 1, 14: 3}
Did not match all atoms present	2457-76-3	C1=CC(=C(C=C1N)Cl)C(=O)O	{17: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	2457-80-9	CSC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)O	{1: 1, 2: 1, 35: 3, 33: 1, 40: 1, 12: 4, 14: 2, 20: 2, 23: 1, 30: 1}
Did not match all atoms present	24570-12-5	C1=CC=C(C=C1)[C@@H](C(=O)NN)O	{3: 1, 14: 5, 20: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	24572-01-8	[2H][O-].[K+]	{}
Did not match all atoms present	24579-90-6	C1=CC(=C(C=C1[N+](=O)[O-])[Hg]Cl)O	{17: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	24579-91-7	C1=C(C=C(C(=C1[N+](=O)[O-])O)[Hg]Cl)[N+](=O)[O-]	{17: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	2458-12-0	CC1=C(C=C(C=C1)C(=O)O)N	{1: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	2458-23-3	C1=CC2=C(C=C1Cl)NC=C(C2=O)C#N	{32: 1, 17: 1, 37: 1, 14: 4, 25: 1}
Did not match all atoms present	2458-26-6	C1=CC=C(C=C1)C2=CC=NN2	{32: 1, 35: 1, 14: 7}
Did not match all atoms present	24587-37-9	CC(C)[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)N	{32: 1, 1: 2, 2: 1, 3: 3, 14: 5, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	24589-77-3	C1=CC(=CC=C1C(=O)O)NN.Cl	{17: 1, 27: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	24589-78-4	CN(C(=O)C(F)(F)F)[Si](C)(C)C	{16: 3, 1: 4, 4: 1, 24: 1, 33: 1}
Did not match all atoms present	2459-07-6	COC(=O)C1=CC=CC=N1	{1: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	2459-09-8	COC(=O)C1=CC=NC=C1	{1: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	2459-10-1	COC(=O)C1=CC(=C(C=C1)C(=O)OC)C(=O)OC	{1: 3, 28: 3, 14: 3}
Did not match all atoms present	2459-24-7	COC(=O)C1=CC=CC2=CC=CC=C21	{1: 1, 28: 1, 14: 7}
Did not match all atoms present	2459-25-8	COC(=O)C1=CC2=CC=CC=C2C=C1	{1: 1, 28: 1, 14: 7}
Did not match all atoms present	24594-56-7	[Na+].[Br-].[Br-].[Au+]	{18: 2}
Did not match all atoms present	24595-14-0	C(CC(=O)O)[C@@H](C(=O)[O-])N.[K+]	{24: 1, 27: 1, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	24596-19-8	CC1=CC(=CC(=C1N)C)Br	{1: 2, 18: 1, 30: 1, 14: 2}
Did not match all atoms present	24596-38-1	CC(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 4, 34: 2, 3: 1, 14: 8, 33: 1}
Did not match all atoms present	24596-39-2	CCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 2: 3, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	24596-41-6	CC(C)(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 5, 34: 2, 4: 1, 14: 8, 33: 1}
Did not match all atoms present	24597-12-4	Cl[Ga]Cl.Cl[Ga]Cl	{17: 4}
Did not match all atoms present	24598-73-0	C1=C(NC(=O)NC1=O)C(=O)[O-].[K+]	{24: 1, 25: 2, 14: 1, 32: 2}
Did not match all atoms present	24599-58-4	CC1=C(C=CC(=C1)OC)OC	{1: 3, 22: 2, 14: 3}
Did not match all atoms present	246-42-4	C1=CC=C2C(=C1)C3=NC4=CC(=CC=C4)N=C5C6=CC=CC=C6C(=NC7=CC=CC(=C7)N=C2N3)N5	{32: 2, 35: 4, 14: 16}
Did not match all atoms present	2460-49-3	COC1=CC(=C(C=C1O)Cl)Cl	{1: 1, 22: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	2460-59-5	C1=C(C=C(C(=C1[N+](=O)[O-])O)C=O)[N+](=O)[O-]	{26: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	24600-36-0	CN(CC1=C(C=CC=C1Cl)NC(=O)C2=CC=CC=C2)CC(=O)[NH+]3CCOCC3.[Cl-]	{1: 1, 2: 2, 33: 1, 11: 4, 14: 8, 17: 2, 23: 1, 24: 2, 31: 1}
Did not match all atoms present	24600-77-9	N#[Yb]	{}
Did not match all atoms present	24605-36-5	C1=CC(=C(C=C1S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 29: 6, 14: 3}
Did not match all atoms present	24606-08-4	C[Sb](C)(C)(Br)Br	{1: 3, 18: 2}
Did not match all atoms present	24613-61-4	CCCCCCCCC=CCCCCCCCCOP(=O)(O)O	{1: 1, 2: 15, 6: 2, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	24613-89-6	[O-][Cr](=O)(=O)[O-].[O-][Cr](=O)(=O)[O-].[O-][Cr](=O)(=O)[O-].[Cr+3].[Cr+3]	{29: 12}
Did not match all atoms present	24614-07-1	CC1=NC=C(C2=[N+]1CCS2)[O-]	{1: 1, 35: 1, 33: 1, 41: 1, 11: 2, 14: 1}
Did not match all atoms present	24614-40-2	CCCCCCCCCCOC(=O)CC(C(=O)O)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 10, 3: 1, 27: 1, 28: 1, 29: 3}
Did not match all atoms present	24621-21-4	N#[Nb]	{}
Did not match all atoms present	24622-72-8	CC(C)CCOC(CN1CCCC1)C2=CC=CC=C2	{1: 2, 2: 3, 3: 2, 33: 1, 11: 4, 14: 5, 22: 1}
Did not match all atoms present	24623-20-9	CC1=CC2=C(CCC2=O)C=C1	{1: 1, 11: 2, 14: 3, 25: 1}
Did not match all atoms present	24623-65-2	CC(C)(C)C1=CC=CC(=C1O)C=O	{1: 3, 26: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	24623-77-6	O[Al]=O	{20: 1, 29: 1}
Did not match all atoms present	24628-33-9	F[SiH](F)[Si](F)(F)F	{16: 5}
Did not match all atoms present	24628-35-1	F[SiH](F)[Si](F)(F)S	{16: 4, 39: 1}
Did not match all atoms present	2463-45-8	C1C(OC(=O)O1)CCl	{17: 1, 2: 1, 11: 1, 12: 1}
Did not match all atoms present	2463-84-5	COP(=S)(OC)OC1=C(C=C(C=C1)[N+](=O)[O-])Cl	{1: 2, 38: 1, 22: 3, 14: 3, 17: 1}
Did not match all atoms present	24632-47-1	CN1CCN(CC1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 6: 1, 33: 2, 11: 4, 34: 1, 14: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	24632-48-2	CN1CCN(CC1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-].Cl.Cl	{1: 1, 2: 1, 38: 1, 6: 1, 33: 2, 11: 4, 34: 1, 14: 2, 17: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	24634-61-5	CC=CC=CC(=O)[O-].[K+]	{24: 1, 1: 1, 6: 4}
Did not match all atoms present	24634-93-3	C1=C(C(=CC#C1)Cl)Cl	{17: 2, 14: 2}
Did not match all atoms present	24634-94-4	C1=C(C=C(C#C1)Cl)Cl	{17: 2, 14: 2}
Did not match all atoms present	2464-33-7	CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C2=O	{1: 1, 33: 1, 14: 8, 25: 2}
Did not match all atoms present	2464-37-1	C1=CC=C2C(=C1)C3=C(C2(C(=O)O)O)C=C(C=C3)Cl	{17: 1, 27: 1, 20: 1, 13: 1, 14: 7}
Did not match all atoms present	24644-78-8	CC1=CC=CC2=C1CCC2=O	{1: 1, 11: 2, 14: 3, 25: 1}
Did not match all atoms present	24646-67-1	CC(C)CCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O	{1: 2, 2: 2, 3: 1, 14: 7, 25: 2}
Did not match all atoms present	24646-85-3	N#[V]	{}
Did not match all atoms present	24648-13-3	C1=CC=C2C(=C1)SC(=C3SC4=CC=CC=C4S3)S2	{41: 4, 14: 8, 15: 2}
Did not match all atoms present	2465-27-2	CN(C)C1=CC=C(C=C1)C(=N)C2=CC=C(C=C2)N(C)C.Cl	{1: 4, 36: 1, 33: 2, 7: 1, 14: 8, 17: 1}
Did not match all atoms present	2465-29-4	CNC1=CC2=C(C=C1)C=C3C=CC(=[NH+]C)C=C3O2.[Cl-]	{31: 2, 1: 2, 23: 1, 14: 7, 17: 1}
Did not match all atoms present	2465-56-7	[CH2]	{}
Did not match all atoms present	2465-59-0	C1=C2C(=NC(=O)NC2=O)NN1	{32: 3, 25: 2, 35: 1, 14: 1}
Did not match all atoms present	24650-42-8	COC(C1=CC=CC=C1)(C(=O)C2=CC=CC=C2)OC	{24: 1, 1: 2, 4: 1, 22: 2, 14: 10}
Did not match all atoms present	24656-22-2	CCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCC(=O)O.C1CCN(CC1)CCN(CC2=CC=CC=N2)C3=CC=CC=C3	{1: 3, 2: 45, 35: 1, 33: 2, 11: 5, 14: 9, 27: 3}
Did not match all atoms present	2466-09-3	OP(=O)(O)OP(=O)(O)O	{20: 4, 29: 2, 22: 1}
Did not match all atoms present	24666-55-5	C1CC(=O)NC(=O)C1NC(=O)OCC2=CC=CC=C2	{32: 1, 2: 1, 11: 2, 12: 1, 14: 5, 25: 2, 28: 1, 31: 1}
Did not match all atoms present	2467-02-9	C1=CC=C(C(=C1)CC2=CC=CC=C2O)O	{2: 1, 21: 2, 14: 8}
Did not match all atoms present	2467-03-0	C1=CC=C(C(=C1)CC2=CC=C(C=C2)O)O	{2: 1, 21: 2, 14: 8}
Did not match all atoms present	2467-12-1	B(OCCCCCCCC)(OCCCCCCCC)OCCCCCCCC	{1: 3, 2: 21, 22: 3}
Did not match all atoms present	2467-13-2	B(OCC(CC)CCCC)(OCC(CC)CCCC)OCC(CC)CCCC	{1: 6, 2: 15, 3: 3, 22: 3}
Did not match all atoms present	2467-15-4	B(OCCCCCCCCCCCC)(OCCCCCCCCCCCC)OCCCCCCCCCCCC	{1: 3, 2: 33, 22: 3}
Did not match all atoms present	24670-07-3	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].O.O.O.O.O.O.O.O.O.O.[Dy+3].[Dy+3]	{24: 6}
Did not match all atoms present	24671-21-4	CN(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O	{1: 2, 2: 3, 33: 2, 11: 4, 13: 1, 14: 8, 17: 1, 20: 1, 24: 1}
Did not match all atoms present	24677-78-9	C1=CC(=C(C(=C1)O)O)C=O	{26: 1, 21: 2, 14: 3}
Did not match all atoms present	24679-02-5	CCCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)N=CC3=CC=C(C=C3)OCCCCCCCC	{1: 2, 34: 2, 6: 2, 2: 14, 14: 12, 22: 2}
Did not match all atoms present	2468-21-5	CCC1=C[C@@H]2C[C@]3([C@@H]1N(C2)CCC4=C3NC5=CC=CC=C45)C(=O)OC	{32: 1, 1: 2, 2: 1, 33: 1, 11: 4, 12: 2, 13: 1, 14: 5, 15: 1, 28: 1}
Did not match all atoms present	24681-18-3	CC(=O)C(C(=O)C)N=NC1=CC(=C(C=C1)C=CC2=C(C=C(C=C2)N3N=C4C=C(C5=CC=CC=C5C4=N3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{1: 2, 34: 2, 3: 1, 6: 2, 33: 1, 14: 11, 35: 2, 20: 3, 24: 2, 29: 6}
Did not match all atoms present	24683-00-9	CC(C)CC1=NC=CN=C1OC	{1: 3, 2: 1, 3: 1, 14: 2, 35: 2, 22: 1}
Did not match all atoms present	24683-32-7	CC(=C[Al])C=C	{1: 1, 5: 1, 6: 2, 7: 1}
Did not match all atoms present	24684-41-1	CC1=C2C(=C3CCCC3=C1)C=CC4=CC=CC=C42	{1: 1, 11: 3, 14: 7}
Did not match all atoms present	24684-42-2	CC1=C2C(=C3C(=C1)CCC3=O)C=CC4=CC=CC=C42	{1: 1, 11: 2, 14: 7, 25: 1}
Did not match all atoms present	24684-49-9	CC1=C2C3=CC=CC=C3C(=CC2=C4CCC(=O)C4=C1)OC	{1: 2, 11: 2, 22: 1, 14: 6, 25: 1}
Did not match all atoms present	24684-56-8	CC1=C2C(=C3CC(C(=O)C3=C1)O)C=CC4=CC=CC=C42	{1: 1, 11: 1, 12: 1, 14: 7, 20: 1, 25: 1}
Did not match all atoms present	24684-58-0	CC(=O)OC1=C2C(=C3CCC(=O)C3=C1)C=CC4=CC=CC=C42	{1: 1, 11: 2, 28: 1, 14: 7, 25: 1}
Did not match all atoms present	24686-78-0	C1CN(CCC1=O)C(=O)C2=CC=CC=C2	{24: 1, 25: 1, 11: 4, 14: 5, 33: 1}
Did not match all atoms present	24687-31-8	CCN1C2=CC=CC=C2[Se]C1=CC(=CC3=[N+](C4=CC=CC=C4[Se]3)CC)C.[Br-]	{1: 3, 2: 2, 33: 2, 6: 2, 7: 1, 14: 8, 15: 1, 18: 1}
Did not match all atoms present	2469-55-8	C[Si](C)(CCCN)O[Si](C)(C)CCCN	{1: 4, 2: 6, 30: 2, 22: 1}
Did not match all atoms present	2469-84-3	CC1=CC(=C(C=C1C[N+](C)(C)N)NC2=C3C(=C(C=C2)NC)C(=O)C4=CC=CC=C4C3=O)C.[Cl-]	{1: 5, 2: 1, 14: 8, 17: 1, 25: 2, 30: 1, 31: 2}
Did not match all atoms present	24690-46-8	CCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 2: 2, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	24691-76-7	CC1=C(CCCO1)C(=O)NC2=CC=CC=C2	{1: 1, 11: 3, 14: 5, 15: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	24694-40-4	C1=CC2=NNN=C2C=C1.OS(=O)(=O)O	{32: 1, 35: 2, 20: 2, 29: 2, 14: 4}
Did not match all atoms present	24697-35-6	C[Si](C)(C)OC(=C)O[Si](C)(C)C	{1: 6, 5: 1, 22: 2, 7: 1}
Did not match all atoms present	24699-40-9	C1CCN(CC1)CCN(CC2=CC=CC=N2)C3=CC=CC=C3.Cl	{33: 2, 2: 3, 35: 1, 11: 5, 14: 9, 17: 1}
Did not match all atoms present	2470-73-7	CC(CN1CCN(CC1)CCOCCO)CN2C3=CC=CC=C3SC4=CC=CC=C42	{1: 1, 2: 6, 3: 1, 33: 3, 41: 1, 11: 4, 14: 8, 20: 1, 22: 1}
Did not match all atoms present	2470-85-1	CC(=O)CC1C2=CC=CC=C2C3=CC=CC=C13	{24: 1, 1: 1, 2: 1, 12: 1, 14: 8}
Did not match all atoms present	24704-54-9	CC1=C(C(=O)N(N1)C2=CC=C(C=C2)S(=O)(=O)O)C=CC=C3C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)O)C	{32: 1, 1: 2, 35: 1, 6: 3, 33: 2, 14: 8, 15: 2, 20: 2, 25: 2, 29: 4}
Did not match all atoms present	24704-64-1	[O-]P([O-])[O-].[Al]	{29: 3}
Did not match all atoms present	2471-08-1	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 26, 22: 11}
Did not match all atoms present	2471-92-3	C1C2=CC=CC=C2CS1	{41: 1, 11: 2, 14: 4}
Did not match all atoms present	24716-09-4	CCCCC(C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 2: 3, 3: 1, 14: 5}
Did not match all atoms present	24719-19-5	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Co+2].[Co+2].[Co+2]	{29: 8}
Did not match all atoms present	2472-22-2	COC1=CC2=C(CC(=O)CC2)C=C1	{1: 1, 11: 3, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	24723-77-1	COC1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O	{1: 1, 2: 1, 35: 3, 33: 1, 12: 4, 14: 1, 20: 3, 22: 1, 23: 1, 30: 1}
Did not match all atoms present	24729-96-2	CCCC1CC(N(C1)C)C(=O)NC(C2C(C(C(C(O2)SC)OP(=O)(O)O)O)O)C(C)Cl	{1: 4, 2: 2, 3: 2, 33: 1, 40: 1, 11: 2, 12: 7, 17: 1, 20: 4, 22: 1, 23: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	24731-73-5	CC(=O)CC(=O)NC1=CC=C(C=C1)NC(=O)CC(=O)C	{24: 4, 1: 2, 2: 2, 14: 4, 31: 2}
Did not match all atoms present	24734-68-7	C1=CC=C(C=C1)CCCS	{2: 3, 14: 5, 39: 1}
Did not match all atoms present	2474-02-4	C[Si](C)(O[Si](C)(C)O[Si](C)(C)Cl)O[Si](C)(C)Cl	{1: 8, 22: 3, 17: 2}
Did not match all atoms present	24742-30-1	CCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N	{1: 1, 34: 1, 37: 1, 6: 1, 2: 1, 14: 8, 22: 1}
Did not match all atoms present	24744-57-8	CCCCCCCCCCCCCCCCCC[N+](CCO)(CCO)CC(=O)[O-]	{24: 1, 1: 1, 2: 22, 20: 2}
Did not match all atoms present	2475-31-2	C1=C(C=C2C(=C1Br)N/C(=C/3\C(=O)C4=CC(=CC(=C4N3)Br)Br)/C2=O)Br	{32: 2, 25: 2, 18: 4, 14: 4, 15: 2}
Did not match all atoms present	2475-33-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)C5=C6C7=C(C8=C(C=C7)C(=O)C9=CC=CC=C9C8=O)NC6=C1C(=C5N4)C(=O)C2=CC=CC=C2C1=O	{32: 2, 25: 6, 14: 16}
Did not match all atoms present	2475-42-5	CC1=CC(=CC=C1)N=NC2=C(C=C(C=C2)N/N=C/3\C=C(C=CC3=O)C)C	{1: 3, 34: 3, 14: 10, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	2475-43-6	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])OC)N	{1: 2, 34: 2, 38: 1, 14: 6, 22: 1, 30: 1}
Did not match all atoms present	2475-44-7	CNC1=C2C(=C(C=C1)NC)C(=O)C3=CC=CC=C3C2=O	{1: 2, 31: 2, 14: 6, 25: 2}
Did not match all atoms present	2475-45-8	C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)N)N)N	{25: 2, 30: 4, 14: 4}
Did not match all atoms present	2475-46-9	CNC1=C2C(=C(C=C1)NCCO)C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 2, 14: 6, 20: 1, 25: 2, 31: 2}
Did not match all atoms present	24758-49-4	C1COCCN1C2=CC=C(C=C2)C(=O)C3=CC=CC=C3	{24: 1, 33: 1, 11: 4, 14: 9, 23: 1}
Did not match all atoms present	2476-37-1	CC(=O)C1=C(C=CC(=C1)Cl)Cl	{24: 1, 1: 1, 14: 3, 17: 2}
Did not match all atoms present	24764-91-8	COC1=CC=C(C=C1)N=CC=NC2=CC=C(C=C2)OC	{1: 2, 22: 2, 34: 2, 14: 8, 6: 2}
Did not match all atoms present	24765-31-9	CCN1C(=O)C(C(=O)N(C1=S)CC)C=CC=CC=C2C(=O)N(C(=S)N(C2=O)CC)CC	{1: 4, 2: 4, 6: 5, 33: 4, 12: 1, 15: 3, 25: 4}
Did not match all atoms present	24776-44-1	C1=CC=C(C=C1)C(=O)C2=CC=C(C3=CC=CC=C32)O	{24: 1, 21: 1, 14: 11}
Did not match all atoms present	2478-29-7	CCCCCCCCCCCCCCCC[N+](C)(C)C.C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-]	{1: 4, 2: 15, 35: 1, 14: 4, 15: 1, 29: 2}
Did not match all atoms present	2478-38-8	CC(=O)C1=CC(=C(C(=C1)OC)O)OC	{24: 1, 1: 3, 22: 2, 21: 1, 14: 2}
Did not match all atoms present	2478-67-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)Cl)N	{17: 1, 30: 1, 21: 1, 14: 5, 25: 2}
Did not match all atoms present	24781-13-3	C1=CC=C(C=C1)CCCOC(=O)C2=CC=CC=C2O	{2: 3, 28: 1, 21: 1, 14: 9}
Did not match all atoms present	24789-99-9	CCN(CC)C1=CC=C(C=C1)C(=C(C#N)C#N)C#N	{1: 2, 2: 2, 37: 3, 33: 1, 7: 2, 14: 4}
Did not match all atoms present	2479-46-1	C1=CC(=CC(=C1)OC2=CC=C(C=C2)N)OC3=CC=C(C=C3)N	{30: 2, 22: 2, 14: 12}
Did not match all atoms present	2479-47-2	CC(C)(C1=CC=C(C=C1)N)C2=CC=C(C=C2)N	{1: 2, 4: 1, 30: 2, 14: 8}
Did not match all atoms present	2479-49-4	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O	{24: 1, 27: 4, 14: 6}
Did not match all atoms present	2479-64-3	B1(NC2=CC=CC=C2N1)C3=CC=CC=C3	{32: 2, 14: 9}
Did not match all atoms present	247940-06-3	C1CCC(CC1)P(C2CCCCC2)C3=CC=CC=C3C4=CC=CC=C4	{11: 10, 12: 2, 14: 9}
Did not match all atoms present	24796-94-9	CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3O2.[O-]Cl(=O)(=O)=O	{1: 4, 2: 4, 35: 1, 33: 2, 14: 6, 17: 1, 23: 1, 29: 4}
Did not match all atoms present	248-70-4	C1=CC=C2C(=C1)C3=C(S2)C4=CC=CC=C4S3	{41: 2, 14: 8}
Did not match all atoms present	248-96-4	C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C5=CC=CC=C5N4	{32: 1, 14: 12}
Did not match all atoms present	24801-88-5	CCO[Si](CCCN=C=O)(OCC)OCC	{1: 3, 2: 6, 8: 1, 34: 1, 22: 3, 29: 1}
Did not match all atoms present	24807-40-7	COC(=O)CCC1=CC=C(C=C1)OCC2=CC=CC=C2	{1: 1, 2: 3, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	24807-55-4	C1=NNC(=N1)[N+](=O)[O-]	{32: 1, 35: 2, 38: 1, 14: 1}
Did not match all atoms present	2481-86-9	C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)O)O	{34: 1, 14: 12, 21: 2, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	2481-94-9	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 2, 2: 2, 34: 2, 14: 9, 33: 1}
Did not match all atoms present	24812-82-6	C1=CC(=CC(=C1)[N+](=O)[O-])N(CCO)CCO	{33: 1, 2: 4, 20: 2, 38: 1, 14: 4}
Did not match all atoms present	24813-03-4	C1CCN(CC1)C(=O)C2=CC(=CC=C2)N(CCCl)CCCl	{33: 2, 2: 4, 11: 5, 14: 4, 17: 2, 24: 1}
Did not match all atoms present	24813-27-2	C1C2CC3CC1CC(C2)(C3)COC(=O)C4=CN=CC=C4	{2: 1, 35: 1, 11: 6, 12: 3, 13: 1, 14: 4, 28: 1}
Did not match all atoms present	24815-24-5	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)/C=C/C6=CC(=C(C(=C6)OC)OC)OC	{32: 1, 1: 6, 6: 2, 33: 1, 11: 5, 12: 6, 14: 5, 22: 5, 28: 2}
Did not match all atoms present	24815-93-8	CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OS(=O)(=O)O)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	24817-51-4	CCC(C)C(=O)OCCC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	24818-79-9	CC(C)(C(=O)O[Al]OC(=O)C(C)(C)OC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)Cl.O	{1: 4, 4: 2, 14: 8, 17: 2, 22: 2, 28: 2}
Did not match all atoms present	2482-80-6	C1CN1C2=CC(=NC(=N2)N3CC3)Cl	{17: 1, 11: 4, 35: 2, 14: 1, 33: 2}
Did not match all atoms present	24821-22-5	C1=CC(=C(C(=C1)C(F)(F)F)C(=O)O)C(F)(F)F	{16: 6, 27: 1, 4: 2, 14: 3}
Did not match all atoms present	24829-12-7	C1=C/C(=C\NC2=NC=NN2)/C(=O)C=C1	{32: 1, 35: 2, 6: 1, 14: 5, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	24831-41-2	CCNC1=NC(=NC(=N1)SSC2=NC(=NC(=N2)N(CC)CC)NCC)N(CC)CC	{1: 6, 2: 6, 35: 6, 33: 2, 40: 2, 31: 2}
Did not match all atoms present	24833-58-7	[CH3-].C[PH+](C)C1=CC=CC=C1.C[PH+](C)C1=CC=CC=C1.Cl[Pt+]	{1: 4, 14: 10, 17: 1}
Did not match all atoms present	24833-62-3	[CH3-].C[PH+](C)C1=CC=CC=C1.C[PH+](C)C1=CC=CC=C1.Br[Pt+]	{1: 4, 18: 1, 14: 10}
Did not match all atoms present	24837-70-5	C1=CC=[N+](C=C1)CC2=CC=C(C=C2)[N+](=O)[O-]	{33: 1, 2: 1, 38: 1, 14: 9}
Did not match all atoms present	2484-16-4	CC1=CC2=CC=CC=C2C=C(C1=O)C	{1: 2, 14: 6, 25: 1}
Did not match all atoms present	2484-88-0	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O	{34: 2, 20: 1, 29: 2, 14: 9}
Did not match all atoms present	24846-92-2	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[NH4+].[Zn+2]	{24: 3, 1: 3}
Did not match all atoms present	24848-81-5	B(OC(C)CCCCCC)(OC(C)CCCCCC)OC(C)CCCCCC	{1: 6, 2: 15, 3: 3, 22: 3}
Did not match all atoms present	2485-10-1	C1C2=CC=CC=C2C3=C1C=C(C=C3)NC(=O)C4=CC=CC=C4C(=O)O	{24: 1, 27: 1, 11: 1, 14: 11, 31: 1}
Did not match all atoms present	24850-33-7	CCCC[Sn](CCCC)(CCCC)CC=C	{1: 3, 2: 10, 5: 1, 6: 1}
Did not match all atoms present	24853-80-3	CN1CCN(CC1)C2=NN=C3C(=C2)N(C4=CC=CC=C4O3)C.Cl.Cl	{1: 2, 35: 2, 33: 3, 11: 4, 14: 5, 17: 2, 23: 1}
Did not match all atoms present	24854-43-1	CN1C=NNC1=S	{32: 1, 1: 1, 35: 1, 14: 1, 33: 1}
Did not match all atoms present	24855-58-1	C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])O	{30: 1, 38: 1, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	24856-58-4	COC(C1=CC=C(C=C1)Br)OC	{1: 2, 18: 1, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	24856-79-9	CCOP(=O)([O-])[O-].[NH4+].[NH4+]	{1: 1, 2: 1, 29: 3, 22: 1}
Did not match all atoms present	24856-99-3	P(P(Br)Br)(Br)Br	{18: 4}
Did not match all atoms present	2486-07-9	C1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 22: 1, 14: 8}
Did not match all atoms present	2486-13-7	C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8, 6: 2}
Did not match all atoms present	2486-70-6	CC1=C(C=CC(=C1)C(=O)O)N	{1: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	24864-19-5	CC1=NC(=CS1)C2=CC=C(C=C2)C3=CC=CC=C3	{1: 1, 35: 1, 14: 10, 41: 1}
Did not match all atoms present	2487-01-6	CC1=C(C=C(C(=C1[N+](=O)[O-])OC(=O)C)C(C)(C)C)[N+](=O)[O-]	{1: 5, 4: 1, 38: 2, 14: 1, 28: 1}
Did not match all atoms present	2487-26-5	CCCC(=O)OC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 2, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	2487-40-3	C1=NC2=C(N1)C(=O)NC(=S)N2	{32: 3, 25: 1, 35: 1, 14: 1}
Did not match all atoms present	2487-90-3	CO[Si](OC)OC	{1: 3, 22: 3}
Did not match all atoms present	24871-38-3	CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 24, 6: 8}
Did not match all atoms present	2488-01-9	C[Si](=C1C=CC(=[Si](C)C)C=C1)C	{1: 4, 14: 4}
Did not match all atoms present	24885-45-8	CC1=C(C(=CC=C1)I)O	{1: 1, 19: 1, 21: 1, 14: 3}
Did not match all atoms present	2489-05-6	CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Ag+]	{24: 1, 1: 1, 2: 20}
Did not match all atoms present	2489-13-6	C1=C(NC=N1)CC(C(=O)O)NC(=O)CN	{32: 1, 2: 2, 3: 1, 14: 2, 35: 1, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	2489-52-3	C1=CC(=CC(=C1)S(=O)(=O)Cl)S(=O)(=O)F	{16: 1, 17: 1, 29: 4, 14: 4}
Did not match all atoms present	2489-77-2	CNC(=S)N(C)C	{1: 3, 31: 1, 33: 1, 7: 1}
Did not match all atoms present	2489-86-3	C=CCC1=CC=CC2=CC=CC=C21	{2: 1, 14: 7, 5: 1, 6: 1}
Did not match all atoms present	24891-23-4	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C(=O)C3=CC=C(C=C3)N	{1: 3, 33: 3, 14: 9, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	24891-41-6	CC1=CC2=C(C3=C(C(=C2C=C1)C)C4=CC=CC=C4C=C3)C	{1: 3, 14: 9}
Did not match all atoms present	2490-89-3	C1=CC(=CC=C1NC(=O)N)[As]=O	{24: 1, 30: 1, 29: 1, 14: 4, 31: 1}
Did not match all atoms present	24902-02-1	CCCOC(=O)C1COC2=CC=CC=C2O1	{1: 1, 2: 2, 11: 1, 12: 1, 14: 4, 23: 2, 28: 1}
Did not match all atoms present	24909-09-9	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C(C(C=C5)O)O)C=C2	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	2491-17-0	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1(CCOCC1)CCN=C=NC2CCCCC2	{1: 2, 2: 2, 8: 1, 11: 9, 12: 1, 34: 2, 14: 4, 23: 1, 29: 3}
Did not match all atoms present	2491-31-8	C1=CC=C(C=C1)CC(=O)C2=CC=CC=C2O	{24: 1, 2: 1, 21: 1, 14: 9}
Did not match all atoms present	2491-32-9	C1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)O	{24: 1, 2: 1, 21: 1, 14: 9}
Did not match all atoms present	2491-52-3	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{34: 2, 38: 1, 14: 9}
Did not match all atoms present	2491-56-7	CC1=C/C(=N/NC2=CC=C(C=C2)Cl)/C(=O)C=C1	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	2491-71-6	C1=CC(=CC=C1N)N=NC2=CC=C(C=C2)S(=O)(=O)[O-].[Na+]	{30: 1, 34: 2, 29: 3, 14: 8}
Did not match all atoms present	2491-74-9	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 2, 34: 2, 38: 1, 14: 8, 33: 1}
Did not match all atoms present	2491-76-1	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)Cl	{1: 2, 34: 2, 33: 1, 14: 8, 17: 1}
Did not match all atoms present	24913-14-2	C1=CN=C2C=CN=C3N2C1=NC=C3	{33: 1, 35: 3, 14: 6}
Did not match all atoms present	24917-48-4	[CH3-].[CH3-].C[PH+](C)C1=CC=CC=C1.C[PH+](C)C1=CC=CC=C1.[Pt+2]	{1: 4, 14: 10}
Did not match all atoms present	24917-50-8	[CH3-].[CH3-].C[PH+](C1=CC=CC=C1)C2=CC=CC=C2.C[PH+](C1=CC=CC=C1)C2=CC=CC=C2.[Pt+2]	{1: 2, 14: 20}
Did not match all atoms present	2492-26-4	C1=CC=C2C(=C1)N=C(S2)[S-].[Na+]	{41: 1, 35: 1, 14: 4}
Did not match all atoms present	24920-35-2	CC1=CC(=C(C=C1)[N+]#N)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	24922-77-8	CCCCCCCCCCCCCC[N+](C)(C)CC1=CC(=C(C=C1)Cl)Cl.[Cl-]	{1: 3, 2: 14, 14: 3, 17: 3}
Did not match all atoms present	24924-36-5	CCN(CC=C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 8, 5: 1, 6: 1, 33: 1, 16: 17, 29: 2}
Did not match all atoms present	24928-72-1	CCCCCCCC(=O)OCCNC(=S)C(=S)NCCOC(=O)CCCCCCC	{1: 2, 2: 16, 31: 2, 28: 2, 7: 2}
Did not match all atoms present	2493-02-9	C1=CC(=CC=C1N=C=O)Br	{8: 1, 18: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	2493-04-1	C1=C(OC(=C1)[N+](=O)[O-])CO	{2: 1, 20: 1, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	2493-57-4	C1=CC=C(C=C1)OS(=O)(=O)C2=CC(=CC(=C2)Cl)Cl	{17: 2, 22: 1, 14: 8, 29: 2}
Did not match all atoms present	2493-84-7	CCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 7, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	24931-66-6	C/C=C/CS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	24932-48-7	CC1=CC(=C(C=C1C)Br)Br	{1: 2, 18: 2, 14: 2}
Did not match all atoms present	24932-49-8	CC1=C(C(=C(C=C1)Br)Br)C	{1: 2, 18: 2, 14: 2}
Did not match all atoms present	24934-91-6	CCOP(=S)(OCC)SCCl	{40: 1, 1: 2, 2: 3, 22: 2, 17: 1}
Did not match all atoms present	24936-38-7	C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O.C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O	{32: 1, 33: 2, 2: 2, 35: 3, 12: 8, 14: 4, 20: 8, 22: 2, 23: 2, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	24939-03-5	C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O.C1=NC(=O)C2=C(N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O	{32: 1, 33: 2, 2: 2, 35: 3, 12: 8, 14: 4, 20: 8, 22: 2, 23: 2, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	24939-64-8	CCCCCCCCCCCCCCCCCCN1C2=C(C=C(C=C2)S(=O)(=O)[O-])N=C1C3=CC=C(C=C3)NC(=O)CC(=O)C4=CC=CC=C4	{1: 1, 2: 18, 35: 1, 33: 1, 14: 12, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	2494-55-5	CCC(=O)OCC[N+](C)(C)C.[I-]	{1: 4, 2: 3, 19: 1, 28: 1}
Did not match all atoms present	2494-56-6	CCCC(=O)OCC[N+](C)(C)C.[I-]	{1: 4, 2: 4, 19: 1, 28: 1}
Did not match all atoms present	2494-93-1	CC1=C(C=CC(=C1)N)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 34: 2, 14: 8, 20: 2, 29: 4, 30: 1}
Did not match all atoms present	24940-63-4	C(C(=O)[C@H]([C@@H](C(=O)C(=O)[O-])O)O)O.C(C(=O)[C@H]([C@@H](C(=O)C(=O)[O-])O)O)O.[Ca+2]	{24: 6, 2: 2, 3: 4, 20: 6}
Did not match all atoms present	24942-77-6	C1=CC=C(C=C1)C=CC2=CC(=CC=C2)Cl	{17: 1, 14: 9, 6: 2}
Did not match all atoms present	2495-35-4	C=CC(=O)OCC1=CC=CC=C1	{2: 1, 14: 5, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	2495-37-6	CC(=C)C(=O)OCC1=CC=CC=C1	{1: 1, 2: 1, 5: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	2495-54-7	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O	{1: 1, 33: 1, 11: 1, 12: 5, 14: 7, 20: 3, 22: 1, 23: 1, 24: 1, 27: 1}
Did not match all atoms present	24951-05-1	C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=C5C(=N4)N(C=N5)CCO.Cl.Cl	{33: 3, 2: 3, 35: 3, 11: 5, 14: 5, 17: 2, 20: 1, 23: 2}
Did not match all atoms present	24955-83-7	CN(C)CCC(=O)C1=CNC2=CC=CC=C21	{32: 1, 1: 2, 2: 2, 33: 1, 14: 5, 24: 1}
Did not match all atoms present	2496-21-1	CCCCC1=CC=C(C=C1)NN=C2C=CC(=O)C=C2	{1: 1, 2: 3, 34: 1, 14: 8, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	2496-26-6	CCOC1=CC=C(C=C1)NN=C2C=CC(=O)C=C2	{1: 1, 2: 1, 34: 1, 14: 8, 15: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	2496-92-6	CCOP(=O)(OCC)SCCS(=O)CC	{40: 1, 1: 3, 2: 5, 29: 2, 22: 2}
Did not match all atoms present	24961-39-5	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)CBr	{2: 1, 18: 1, 14: 11}
Did not match all atoms present	24961-49-7	C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C(C=C4)C(C(C=C25)O)O	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	24962-75-2	CN(C)S(=O)(=O)C1=CC(=C(C=C1)O)N	{1: 2, 33: 1, 14: 3, 21: 1, 29: 2, 30: 1}
Did not match all atoms present	24964-07-6	CC1=CC2=CC3=C(C=C2C=C1)C4=CC=CC=C4S3	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	24964-09-8	CC1=CC=CC2=CC3=C(C=C12)SC4=CC=CC=C43	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	24964-64-5	C1=CC(=CC(=C1)C=O)C#N	{26: 1, 37: 1, 14: 4}
Did not match all atoms present	24966-39-0	C1=CC(=C(C(=C1)Cl)S)Cl	{17: 2, 14: 3, 39: 1}
Did not match all atoms present	2497-06-5	CCOP(=S)(OCC)SCCS(=O)(=O)CC	{40: 1, 1: 3, 2: 5, 29: 2, 22: 2}
Did not match all atoms present	2497-07-6	CCOP(=S)(OCC)SCCS(=O)CC	{40: 1, 1: 3, 2: 5, 29: 1, 22: 2}
Did not match all atoms present	2497-38-3	C1=CC(=O)C=CC1=NNC2=CC=C(C=C2)C(=O)O	{34: 1, 14: 8, 15: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	2497-91-8	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)C(=O)O)[N+](=O)[O-]	{17: 1, 27: 1, 38: 2, 14: 2}
Did not match all atoms present	24973-49-7	C1=CC=C(C=C1)C2=CC=CC=C2C#N	{37: 1, 14: 9}
Did not match all atoms present	24973-59-9	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)N=O)C(C)(C)C	{1: 9, 34: 1, 4: 3, 29: 1, 14: 2}
Did not match all atoms present	24974-78-5	C[Si]1(C[Si](N2N1[Si](C[Si]2(C)C)(C)C)(C)C)C	{1: 8, 11: 2, 33: 2}
Did not match all atoms present	2498-02-4	CCN(CCN1C(=O)C2=CC=CC=C2C1=O)C3=CC=CC(=C3)C	{1: 2, 2: 3, 33: 2, 14: 8, 25: 2}
Did not match all atoms present	2498-03-5	CCN(CCN1C(=O)CCC1=O)C2=CC=CC(=C2)C	{1: 2, 2: 3, 33: 2, 11: 2, 14: 4, 25: 2}
Did not match all atoms present	2498-12-6	CC1=CC(=CC=C1)NCCN2C(=O)CCC2=O	{1: 1, 2: 2, 33: 1, 11: 2, 14: 4, 25: 2, 31: 1}
Did not match all atoms present	2498-20-6	CCCCC[N+](CCCCC)(CCCCC)CCCCC.[I-]	{1: 4, 2: 16, 19: 1}
Did not match all atoms present	2498-27-3	C[N+](C)(C)C1=CC(=CC=C1)O.[I-]	{1: 3, 19: 1, 21: 1, 14: 4}
Did not match all atoms present	2498-66-0	C1=CC=C2C(=C1)C=CC3=C2C(=O)C4=CC=CC=C4C3=O	{25: 2, 14: 10}
Did not match all atoms present	2498-75-1	CC1=CC2=C(C=C1)C3=CC4=CC=CC=C4C=C3C=C2	{1: 1, 14: 11}
Did not match all atoms present	2498-76-2	CC1=CC2=C(C=C1)C=CC3=CC4=CC=CC=C4C=C32	{1: 1, 14: 11}
Did not match all atoms present	2498-77-3	CC1=CC=CC2=C1C3=CC4=CC=CC=C4C=C3C=C2	{1: 1, 14: 11}
Did not match all atoms present	2498-95-5	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C(=CC4=CC=C(C=C4)N(C)CCS(=O)(=O)[O-])C#N)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 2, 35: 1, 33: 1, 6: 1, 7: 1, 41: 1, 14: 10, 37: 1, 24: 1, 29: 6, 31: 1}
Did not match all atoms present	24985-85-1	CCOC(=O)C1=CC2=C(N1)C=CC(=C2)O	{32: 1, 1: 1, 2: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	24992-60-7	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].O.[Pr+3].[Pr+3]	{24: 6}
Did not match all atoms present	24998-17-2	C1=CC(=NN=C1/C=C/C2=CC=C(O2)[N+](=O)[O-])N.Cl	{35: 2, 38: 1, 6: 2, 14: 4, 17: 1, 23: 1, 30: 1}
Did not match all atoms present	250-65-7	C1=CSC2=CSC=C21	{41: 2, 14: 4}
Did not match all atoms present	250-71-5	C1=C[Se]C2=C[Se]C=C21	{14: 4}
Did not match all atoms present	250-84-0	C1=CSC2=C1C=CS2	{41: 2, 14: 4}
Did not match all atoms present	25005-95-2	C1CN=C(C(=N1)C2=CC=CC=N2)C3=CC=CC=N3	{35: 4, 11: 2, 14: 8, 15: 2}
Did not match all atoms present	25005-97-4	C1=CC=NC(=C1)C2=C(N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4)C5=CC=CC=N5	{35: 6, 14: 16}
Did not match all atoms present	25007-79-8	C1=CC=NC(=C1)C2=NC(=NC(=N2)N)N	{35: 4, 30: 2, 14: 4}
Did not match all atoms present	2501-02-2	C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8, 6: 2}
Did not match all atoms present	2501-03-3	COC1=CC=C(C=C1)N=CC2=CC=CC=C2[N+](=O)[O-]	{1: 1, 34: 1, 6: 1, 38: 1, 14: 8, 22: 1}
Did not match all atoms present	2501-94-2	CC(C)(C)P	{1: 3, 4: 1}
Did not match all atoms present	25015-63-8	[B]1OC(C(O1)(C)C)(C)C	{1: 4, 13: 2, 23: 2}
Did not match all atoms present	25016-01-7	COC1=C(C=C(C=C1)Br)C=O	{1: 1, 18: 1, 26: 1, 22: 1, 14: 3}
Did not match all atoms present	25016-02-8	COC1=C(C=C(C=C1)[N+](=O)[O-])C=O	{1: 1, 26: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	25017-08-7	CCCCC(=O)C1=CC=C(C=C1)Cl	{24: 1, 1: 1, 2: 3, 14: 4, 17: 1}
Did not match all atoms present	25017-68-9	CC(=O)OC1C2=CC=CC=C2C3=CC=CC=C13	{1: 1, 12: 1, 14: 8, 28: 1}
Did not match all atoms present	25022-55-3	CC(C)N(C(C)C)C(=S)S	{1: 4, 3: 2, 33: 1, 39: 1, 7: 1}
Did not match all atoms present	25024-53-7	CC(C)(C)OC(=O)N[C@@H](CC1=CN(C=N1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 38: 2, 33: 1, 14: 5, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	25025-06-3	CC(=O)NC1=CC=C(C=C1)CC#N	{1: 1, 2: 1, 37: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	25025-59-6	CC(=O)SCC[N+](C)(C)C.[Br-]	{24: 1, 1: 4, 2: 2, 18: 1, 40: 1}
Did not match all atoms present	25026-34-0	C1=CC(=CC=C1CC(=O)Cl)Cl	{24: 1, 17: 2, 2: 1, 14: 4}
Did not match all atoms present	25026-97-5	C1=CC(=C(C=C1[N+](=O)[O-])C(=S)N)N	{38: 1, 30: 2, 14: 3, 7: 1}
Did not match all atoms present	2503-46-0	CC(=O)CC1=CC(=C(C=C1)O)OC	{1: 2, 2: 1, 14: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	2503-56-2	CC1=CC(=O)N2C(=N1)N=CN2	{32: 1, 1: 1, 35: 2, 33: 1, 14: 2, 25: 1}
Did not match all atoms present	25035-37-4	C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC(=CC=C1N)N	{27: 2, 30: 2, 14: 8}
Did not match all atoms present	25036-33-3	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CO)O	{2: 3, 8: 2, 34: 2, 14: 8, 20: 2, 29: 2}
Did not match all atoms present	2504-55-4	C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)N)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 2, 23: 1, 30: 2}
Did not match all atoms present	2504-64-5	C(C[Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl	{17: 6, 2: 2}
Did not match all atoms present	25045-36-7	CC1=CC(=C(C=C1)OC)C(=O)O	{1: 2, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	25046-79-1	CC1=CC(=NO1)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NN3CCCCCC3	{1: 1, 2: 2, 35: 1, 33: 1, 11: 6, 14: 5, 23: 1, 24: 2, 29: 2, 31: 3}
Did not match all atoms present	25047-48-7	CO[C@@H]1COC([C@@H]([C@H]1OC)O)OC2=C3COC(=O)C3=C(C4=CC(=C(C=C42)OC)OC)C5=CC6=C(C=C5)OCO6	{1: 4, 11: 3, 12: 4, 14: 5, 20: 1, 22: 5, 23: 3, 28: 1}
Did not match all atoms present	25047-71-6	CC1=C(C=CC(=C1)OC)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)S(=O)(=O)[O-])OC)/C2=O.[Na+]	{1: 3, 34: 1, 14: 11, 15: 2, 22: 2, 24: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	25054-53-9	C1OC2=C(O1)C=C(C=C2)C(=O)Cl	{24: 1, 17: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	25054-74-4	CCCCCCCCCCCC[N+](C)(CCCCCCCCCCCC)CC(=O)[O-]	{24: 1, 1: 3, 2: 23}
Did not match all atoms present	25057-89-0	CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O	{32: 1, 1: 2, 3: 1, 33: 1, 14: 4, 25: 1, 29: 2}
Did not match all atoms present	2506-41-4	C1=CC=C2C=C(C=CC2=C1)CCl	{17: 1, 2: 1, 14: 7}
Did not match all atoms present	25061-50-1	C1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OCCO	{2: 2, 11: 5, 12: 1, 14: 5, 20: 1, 22: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	25061-59-0	C1=CC=[N+](C=C1)CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.C(F)(F)(F)S(=O)(=O)[O-]	{33: 1, 2: 1, 4: 8, 14: 5, 16: 18, 29: 3}
Did not match all atoms present	25063-27-8	[CH2]CCC[O-].[CH2]CCC[O-].[CH2]CCC[O-].[CH2]CCC[O-].[Ge]	{2: 12, 5: 4, 29: 4}
Did not match all atoms present	25065-00-3	C[N+]1=CC=CC(=C1)[O-]	{1: 1, 14: 4, 33: 1}
Did not match all atoms present	25066-36-8	C1CCC(CC1)COC(=O)O	{27: 1, 2: 1, 11: 5, 12: 1}
Did not match all atoms present	25068-38-6	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl	{1: 2, 2: 1, 4: 1, 11: 1, 12: 1, 14: 8, 17: 1, 21: 2, 23: 1}
Did not match all atoms present	25069-29-8	C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C=CC(=O)O	{33: 1, 27: 1, 14: 14, 6: 2}
Did not match all atoms present	25069-81-2	COC(=O)C=CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 28: 1, 14: 14, 6: 2, 33: 1}
Did not match all atoms present	2507-91-7	CCOC(C)/C(=N/NC(=S)N)/C=N/NC(=S)N	{1: 2, 2: 1, 3: 1, 6: 1, 7: 3, 34: 2, 22: 1, 30: 2, 31: 2}
Did not match all atoms present	25070-22-8	C1=CC=C(C=C1)[P+](=O)[O-].C1=CC=C(C=C1)[P+](=O)[O-].[Zn+2]	{29: 4, 14: 10}
Did not match all atoms present	25070-46-6	P12SP3(=S)SP(=S)(S1)SP(=S)(S2)S3	{41: 6}
Did not match all atoms present	25078-74-4	CCN1C(=[N+](C2=NC3=CC=CC=C3N=C21)CC)C=CC4=C(N(C5=CC=CC=C54)C)C6=CC=CC=C6.[I-]	{1: 3, 2: 2, 35: 2, 6: 2, 33: 3, 14: 13, 19: 1}
Did not match all atoms present	2508-18-1	CC(=O)N(C1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)F)O	{1: 1, 33: 1, 11: 1, 14: 6, 16: 1, 20: 1, 24: 1}
Did not match all atoms present	2508-19-2	C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	2508-20-5	C1C2=CC=CC=C2C3=C1C=C(C=C3)N=O	{34: 1, 11: 1, 29: 1, 14: 7}
Did not match all atoms present	2508-23-8	CC(=O)N(C1=CC2=CC=CC=C2C=C1)O	{24: 1, 1: 1, 20: 1, 14: 7, 33: 1}
Did not match all atoms present	2508-86-3	C1=CC=C2C(=C1)C(=N)C=CN2O	{33: 1, 36: 1, 21: 1, 14: 6}
Did not match all atoms present	25080-14-2	CC(=O)NC1=CC(=C(C=C1)OC)N(CC2=CC=CC=C2)CC3=CC=CC=C3	{1: 2, 2: 2, 33: 1, 14: 13, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	25080-15-3	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CC3=CC=CC=C3)CC4=CC=CC=C4	{1: 2, 2: 2, 38: 2, 33: 1, 34: 2, 14: 14, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	25081-39-4	CC1=CC(=CC(=C1)C(=O)OC)C	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	25084-14-4	C1=C(OC(=C1)[N+](=O)[O-])C(=O)Cl	{24: 1, 17: 1, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	25088-69-1	C1=CC(=CC=C1C(C2=CC=C(C=C2)[O-])(C(F)(F)F)C(F)(F)F)[O-].[K+].[K+]	{16: 6, 4: 3, 14: 8}
Did not match all atoms present	25094-02-4	O.O.O.O.[Cl-].[Cl-].[Ca+2]	{17: 2}
Did not match all atoms present	251-41-2	C1=CSC2=C1SC=C2	{41: 2, 14: 4}
Did not match all atoms present	2510-22-7	C#CC1=CC=NC=C1	{9: 1, 10: 1, 35: 1, 14: 4}
Did not match all atoms present	2510-36-3	CC1=C(C(=NO1)C)C(=O)O	{1: 2, 27: 1, 35: 1, 23: 1}
Did not match all atoms present	2510-55-6	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C#N	{37: 1, 14: 9}
Did not match all atoms present	2510-76-1	CC1=CC=C(C=C1)/C=C\C2=CC=C(C=C2)C	{1: 2, 14: 8, 6: 2}
Did not match all atoms present	2510-86-3	CCOP(=O)(OCC)OC1=CC=CC=C1	{1: 2, 2: 2, 22: 3, 14: 5, 29: 1}
Did not match all atoms present	2510-89-6	CCCOP(=O)(OCCC)Cl	{1: 2, 2: 4, 29: 1, 22: 2, 17: 1}
Did not match all atoms present	2510-95-4	C1=CC=C(C=C1)C=C(C#N)C2=CC=CC=C2	{37: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	2510-98-7	CC(=C(C)C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 14: 10, 7: 2}
Did not match all atoms present	2510-99-8	CCOC(=O)C(C)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	25103-12-2	CC(C)CCCCCOP(OCCCCCC(C)C)OCCCCCC(C)C	{1: 6, 2: 15, 3: 3, 22: 3}
Did not match all atoms present	25108-36-5	C1=CC=NC(=C1)C(=O)[O-].[K+]	{24: 1, 35: 1, 14: 4}
Did not match all atoms present	25108-63-8	C=C1CCCC2=CC=CC=C12	{11: 3, 5: 1, 14: 4, 15: 1}
Did not match all atoms present	25109-26-6	C1=C[Se]C(=C1)C=O	{26: 1, 14: 3}
Did not match all atoms present	25109-28-8	C1CCC(CC1)C2=CC=C(C=C2)Br	{18: 1, 11: 5, 12: 1, 14: 4}
Did not match all atoms present	2511-09-3	CCO[P+](=O)C1=CC=CC=C1	{1: 1, 2: 1, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	2511-10-6	CCOP(=O)(C)SCC	{40: 1, 1: 3, 2: 2, 29: 1, 22: 1}
Did not match all atoms present	2511-17-3	CN(C)P(=O)(C)N(C)C	{1: 5, 29: 1, 33: 2}
Did not match all atoms present	25114-58-3	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[In+3]	{24: 3, 1: 3}
Did not match all atoms present	25115-74-6	C1CC(CCC1=O)(C#N)C2=CC=CC=C2	{25: 1, 11: 4, 13: 1, 14: 5, 37: 1}
Did not match all atoms present	25117-74-2	CCOC1=CC=C(C=C1)C#N	{1: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	25117-75-3	CCOC1=CC=CC(=C1)C#N	{1: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	25118-60-9	C1CCC(C1)(C#CC2=CC=CC=C2)O	{10: 2, 11: 4, 20: 1, 13: 1, 14: 5}
Did not match all atoms present	2512-56-3	CCCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O	{1: 1, 2: 7, 28: 1, 21: 1, 14: 8}
Did not match all atoms present	2512-58-5	C1CCC(CC1)P(=S)(C2CCCCC2)S	{11: 10, 12: 2, 39: 1}
Did not match all atoms present	25121-81-7	C1=CSC2=C1C=C(S2)Br	{41: 2, 18: 1, 14: 3}
Did not match all atoms present	25121-84-0	C1=CSC2=C1C(=CS2)Br	{41: 2, 18: 1, 14: 3}
Did not match all atoms present	25121-86-2	C1=C(SC2=C1C=C(S2)Br)Br	{41: 2, 18: 2, 14: 2}
Did not match all atoms present	25125-46-6	N.N.N.N.N.N.N.N.N.N.N.N.N.N.[O-2].[O-2].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Ru].[Ru].[Ru]	{17: 6}
Did not match all atoms present	2513-25-9	CC1(C=CC2=CC=CC=C2O1)C	{1: 2, 13: 1, 14: 6, 23: 1}
Did not match all atoms present	25140-86-7	CC(C(=O)O)OC1=CC=CC=C1Cl	{1: 1, 3: 1, 14: 4, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	25141-05-3	CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CC)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 20, 35: 1, 11: 2, 15: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	25144-78-9	CC1[C@@H]2CC3=C([C@]1(CCN2)C)C=C(C=C3)O.Cl	{32: 1, 1: 2, 11: 3, 12: 2, 13: 1, 14: 3, 17: 1, 21: 1}
Did not match all atoms present	25147-91-5	CO[Si](CCCNCCCN)(OC)OC	{1: 3, 2: 6, 30: 1, 22: 3, 31: 1}
Did not match all atoms present	25148-26-9	CC1=C2C=CC=CC2=C(C3=CC=CC=C13)CCl	{1: 1, 2: 1, 14: 8, 17: 1}
Did not match all atoms present	25151-00-2	CCCCCCCCCCCC(=O)O[Sn](CCCC)(OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC	{1: 4, 2: 33, 28: 3}
Did not match all atoms present	25152-85-6	CCC=CCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	25154-52-3	CC(C)CC(C)CC(C)c1ccc(O)cc1	{1: 4, 2: 2, 3: 3, 21: 1, 14: 4}
Did not match all atoms present	25155-18-4	CC1=C(C=CC(=C1)C(C)(C)CC(C)(C)C)OCCOCC[N+](C)(C)CC2=CC=CC=C2.[Cl-]	{1: 8, 2: 6, 4: 2, 14: 8, 17: 1, 22: 2}
Did not match all atoms present	25159-40-4	CCCCCCCCC=CCCCCCCCC(=O)NCCC[N+](C)(C)[O-]	{1: 3, 2: 17, 6: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	2516-05-4	CN(C)C1=CC2=C(C=C1)N=C3C=CC(=O)C=C3S2	{1: 2, 35: 1, 33: 1, 41: 1, 14: 6, 25: 1}
Did not match all atoms present	2516-95-2	C1=CC(=C(C=C1Cl)C(=O)O)[N+](=O)[O-]	{17: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	2516-96-3	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Cl	{17: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	25165-45-1	F[Al-2](F)(F)(F)F.[Ba+2]	{16: 5}
Did not match all atoms present	25167-89-9	CC1=C2C=CC3=C4C2=C(C=C1)C=CC4=CC5=CC=CC=C35	{1: 1, 14: 11}
Did not match all atoms present	25168-26-7	CC(C)CCCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 6, 3: 1, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	2517-98-8	CC1=C2C(=C(C3=CC=CC=C13)COC(=O)C)C=CC4=CC=CC=C42	{1: 2, 2: 1, 28: 1, 14: 10}
Did not match all atoms present	25171-21-5	C1=CC=C(C=C1)C2=N/C(=C/3\C=CC=CC3=O)/NC4=CC=CC=C42	{32: 1, 25: 1, 35: 1, 14: 13, 15: 3}
Did not match all atoms present	25173-35-7	CC1=CC=CC=C1OCCC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	25173-37-9	CC1=CC=C(C=C1)OCCC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	25173-68-6	C1=CC(=C(C=C1CCC(=O)O)Cl)Cl	{17: 2, 2: 2, 27: 1, 14: 3}
Did not match all atoms present	25173-72-2	COC1=CC(=CC(=C1OC)OC)CCC(=O)O	{1: 3, 2: 2, 27: 1, 22: 3, 14: 2}
Did not match all atoms present	25174-65-6	C1CN(CCN1CC2=CC=CC=C2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{33: 2, 2: 2, 3: 1, 11: 4, 14: 14, 17: 1, 24: 1}
Did not match all atoms present	25174-66-7	C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{33: 2, 2: 1, 3: 1, 11: 4, 14: 13, 17: 2, 24: 1}
Did not match all atoms present	25179-23-1	[Li+].CC(C)C(=O)[O-]	{24: 1, 1: 2, 3: 1}
Did not match all atoms present	25179-61-7	CCCN(CCC)C(=S)S	{1: 2, 2: 4, 39: 1, 33: 1, 7: 1}
Did not match all atoms present	2518-24-3	C1=CC2=C(C(=C1)N)C(=O)NC2=O	{32: 1, 25: 2, 30: 1, 14: 3}
Did not match all atoms present	2518-42-5	CC1=NO[N+](=C1C)[O-]	{1: 2, 35: 1, 33: 1, 23: 1}
Did not match all atoms present	25185-95-9	C1=CC(=C(C(=C1)Cl)C=NO)Cl	{17: 2, 34: 1, 20: 1, 14: 3, 6: 1}
Did not match all atoms present	25186-43-0	CC(C)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 3: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	25186-47-4	CC1=CC(=CC(=C1)Cl)Cl	{1: 1, 14: 3, 17: 2}
Did not match all atoms present	2519-10-0	C1=CC=C(C=C1)C2C(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6	{12: 1, 14: 25, 15: 4}
Did not match all atoms present	2519-30-4	CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)[O-])C=C(/C(=N\NC3=C4C=C(C=CC4=C(C=C3)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 3, 14: 12, 15: 2, 24: 1, 25: 1, 29: 12, 31: 2}
Did not match all atoms present	2519-37-1	CCC(C)CCCCC(=O)[O-]	{24: 1, 1: 2, 2: 5, 3: 1}
Did not match all atoms present	25191-20-2	C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=O)(O)O)O	{33: 1, 2: 1, 35: 3, 11: 1, 12: 3, 14: 2, 20: 3, 22: 1, 23: 1, 29: 1, 30: 1}
Did not match all atoms present	25201-30-3	CC(=O)O[Hg]C([Hg]OC(=O)C)([Hg]OC(=O)C)[Hg]OC(=O)C	{1: 4, 4: 1, 28: 4}
Did not match all atoms present	2521-01-9	CCOC(=O)N(CC1=CC=CC=C1)C2CC2	{1: 1, 2: 2, 33: 1, 11: 2, 12: 1, 14: 5, 28: 1}
Did not match all atoms present	2521-24-6	C1=CC(=CC=C1C(=S)N)Cl	{17: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	25212-15-1	CC[C@]1(C[C@@H](C2=C(C1O)C(=C3C(=C2)C(=O)C4=C(C3=O)C=CC=C4OC)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O)NC)O	{1: 4, 2: 1, 11: 2, 12: 6, 13: 1, 14: 4, 20: 3, 21: 1, 22: 2, 23: 1, 25: 2, 31: 1}
Did not match all atoms present	25214-70-4	C=O.C1=CC=C(C=C1)N	{30: 1, 5: 1, 14: 5}
Did not match all atoms present	2522-81-8	CC(C)(C)C(=O)OCC(=O)C1=CC=CC=C1	{1: 3, 2: 1, 4: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	25224-14-0	CCC(C)C1=CN=CC=C1	{1: 2, 2: 1, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	25226-98-6	CCOC(C=CC1=CC=CC=C1)OCC	{1: 2, 2: 2, 3: 1, 6: 2, 14: 5, 22: 2}
Did not match all atoms present	2523-37-7	CC1C2=CC=CC=C2C3=CC=CC=C13	{1: 1, 12: 1, 14: 8}
Did not match all atoms present	2523-39-9	CC1=CC2=C(CC3=CC=CC=C32)C=C1	{1: 1, 11: 1, 14: 7}
Did not match all atoms present	2523-44-6	C1C2=CC=CC=C2C3=C1C=C(C=C3)Cl	{17: 1, 11: 1, 14: 7}
Did not match all atoms present	2523-94-6	COP(=S)(Cl)Cl	{1: 1, 22: 1, 17: 2}
Did not match all atoms present	25235-85-2	C1=CC2=C(C=CN2)C(=C1)Cl	{32: 1, 17: 1, 14: 5}
Did not match all atoms present	25238-98-6	CCCCOP(=O)([O-])OCCCC.[K+]	{1: 2, 2: 6, 29: 2, 22: 2}
Did not match all atoms present	25238-99-7	CCCCOP(=O)(O)[O-].[K+]	{1: 1, 2: 3, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	2524-02-9	FP(=S)(F)Cl	{16: 2, 17: 1}
Did not match all atoms present	2524-03-0	COP(=S)(OC)Cl	{1: 2, 22: 2, 17: 1}
Did not match all atoms present	2524-04-1	CCOP(=S)(OCC)Cl	{1: 2, 2: 2, 22: 2, 17: 1}
Did not match all atoms present	2524-05-2	CCCOP(=S)(OCCC)Cl	{1: 2, 2: 4, 22: 2, 17: 1}
Did not match all atoms present	2524-09-6	CCOP(=S)(OCC)SCC	{40: 1, 1: 3, 2: 3, 22: 2}
Did not match all atoms present	2524-37-0	CCOC(=O)C1=C(C=C(C=C1C)O)O	{1: 2, 2: 1, 28: 1, 21: 2, 14: 2}
Did not match all atoms present	2524-52-9	CCOC(=O)C1=CC=CC=N1	{1: 1, 2: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	2524-64-3	C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)Cl	{17: 1, 22: 2, 14: 10, 29: 1}
Did not match all atoms present	2524-67-6	C1COCCN1C2=CC=C(C=C2)N	{33: 1, 11: 4, 30: 1, 14: 4, 23: 1}
Did not match all atoms present	25242-76-6	C1=C(C=C([N+](=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 38: 3, 29: 1, 14: 2}
Did not match all atoms present	25243-36-1	C1=C(C=C2C(=C1[N+](=O)[O-])[N-][N+]3=C4C=C(C=C(C4=NN23)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 2, 35: 2, 38: 4, 14: 4}
Did not match all atoms present	25245-33-4	COC1=C(C(=CC=C1)I)OC	{1: 2, 19: 1, 22: 2, 14: 3}
Did not match all atoms present	25245-34-5	COC1=CC(=C(C=C1)OC)Br	{1: 2, 18: 1, 22: 2, 14: 3}
Did not match all atoms present	2525-02-2	CCCC1=CC(=C(C=C1)O)O	{1: 1, 2: 2, 21: 2, 14: 3}
Did not match all atoms present	2525-21-5	C[N+]1=CC=CC2=CC=CC=C21.[Cl-]	{1: 1, 33: 1, 14: 7, 17: 1}
Did not match all atoms present	2525-40-8	C#CCS(=O)(=O)C1=CC=CC=C1	{9: 1, 2: 1, 10: 1, 14: 5, 29: 2}
Did not match all atoms present	2525-41-9	CC#CS(=O)(=O)C1=CC=CC=C1	{1: 1, 10: 2, 29: 2, 14: 5}
Did not match all atoms present	2525-42-0	C=C=CS(=O)(=O)C1=CC=CC=C1	{8: 1, 14: 5, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	25251-04-1	N1=P(N=P(N=P1(F)Cl)(Cl)Cl)(F)Cl	{16: 2, 17: 4, 35: 3}
Did not match all atoms present	25251-05-2	N1=P(N=P(N=P1(F)Cl)(F)Cl)(F)Cl	{16: 3, 17: 3, 35: 3}
Did not match all atoms present	25252-92-0	COC1=CC2=CC(=C(C=C2C=C1)O)C(=O)NC3=CC(=C(C=C3OC)Cl)OC	{1: 3, 14: 7, 17: 1, 21: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	25252-96-4	CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C=C	{1: 2, 2: 4, 5: 1, 6: 1, 33: 1, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	25255-02-1	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)O)S(=O)(=O)O)N=NC5=C6C=CC(=CC6=C(C=C5)N/N=C/7\C(=CC8=C(C7=O)C=CC(=C8)N)S(=O)(=O)O)S(=O)(=O)O	{34: 5, 14: 20, 15: 2, 20: 4, 25: 1, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	25264-32-8	C1=CC=C(C=C1)S(=O)(=O)NCCCS(=O)(=O)[O-].[Na+]	{2: 3, 29: 5, 14: 5, 31: 1}
Did not match all atoms present	25267-55-4	C1=C(C=C(C(=C1Cl)Cl)Cl)[O-].C1=C(C(=CC(=C1Cl)Cl)Cl)[O-].[Cu+2]	{17: 6, 14: 4}
Did not match all atoms present	25268-77-3	CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 8, 5: 1, 6: 1, 33: 1, 16: 17, 28: 1, 29: 2}
Did not match all atoms present	2527-76-6	CC1=C(C=CS1)S	{1: 1, 41: 1, 14: 2, 39: 1}
Did not match all atoms present	2527-96-0	CC1=CC=C(O1)C(=O)OC	{1: 2, 28: 1, 14: 2, 23: 1}
Did not match all atoms present	25277-93-4	O[O-].[Na+]	{20: 1, 29: 1}
Did not match all atoms present	25279-63-4	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C5=CC(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-])C)C	{1: 5, 2: 3, 3: 2, 38: 2, 11: 8, 12: 5, 13: 2, 14: 4, 15: 1, 28: 1}
Did not match all atoms present	2528-00-9	CCOC(=O)C1=CC=C(O1)CCl	{1: 1, 2: 2, 14: 2, 17: 1, 23: 1, 28: 1}
Did not match all atoms present	2528-16-7	C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2C(=O)O	{2: 1, 27: 1, 28: 1, 14: 9}
Did not match all atoms present	2528-36-1	CCCCOP(=O)(OCCCC)OC1=CC=CC=C1	{1: 2, 2: 6, 22: 3, 14: 5, 29: 1}
Did not match all atoms present	2528-38-3	CCCCCOP(=O)(OCCCCC)OCCCCC	{1: 3, 2: 12, 29: 1, 22: 3}
Did not match all atoms present	2528-39-4	CCCCCCOP(=O)(OCCCCCC)OCCCCCC	{1: 3, 2: 15, 29: 1, 22: 3}
Did not match all atoms present	25282-76-2	C1=CC=C(C=C1)CNC2=C3C(=C(C=C2)O)C(=O)C4=C(C3=O)C(=CC(=C4N)Br)O	{2: 1, 14: 8, 18: 1, 21: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	25284-83-7	C[TeH]	{1: 1}
Did not match all atoms present	25287-52-9	CCCCCCCOC(=O)C(C1=CC=CC=C1)[NH3+].[Cl-]	{1: 1, 2: 6, 3: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	25289-00-3	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)C	{1: 3, 2: 2, 33: 1, 13: 1, 14: 10, 23: 1, 28: 1}
Did not match all atoms present	2529-36-4	CC1=C(C(=C(C=C1)C)C(=O)O)C	{1: 3, 27: 1, 14: 2}
Did not match all atoms present	2529-39-7	CC1=C(C(=C(C(=C1)C(=O)O)C)C)C	{1: 4, 27: 1, 14: 1}
Did not match all atoms present	25294-38-6	[2H]C(=C=C=C([2H])[2H])[2H]	{8: 2, 5: 2}
Did not match all atoms present	25295-51-6	C1=CC(=C(C=C1NC2=NC(=NC(=N2)N)NCCO)S(=O)(=O)[O-])C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)N)NCCO)S(=O)(=O)[O-].[Na+].[Na+]	{2: 4, 35: 6, 6: 2, 14: 6, 20: 2, 29: 6, 30: 2, 31: 4}
Did not match all atoms present	253-37-2	C1=CC=C2C=PC=CC2=C1	{14: 7}
Did not match all atoms present	253-45-2	C1=CN=CC2=C1C=CN=C2	{35: 2, 14: 6}
Did not match all atoms present	253-50-9	C1=CN=CC2=C1C=NC=C2	{35: 2, 14: 6}
Did not match all atoms present	253-52-1	C1=CC=C2C=NN=CC2=C1	{35: 2, 14: 6}
Did not match all atoms present	253-66-7	C1=CC=C2C(=C1)C=CN=N2	{35: 2, 14: 6}
Did not match all atoms present	253-69-0	C1=CC2=C(C=NC=C2)N=C1	{35: 2, 14: 6}
Did not match all atoms present	253-72-5	C1=CC2=C(C=CN=C2)N=C1	{35: 2, 14: 6}
Did not match all atoms present	253-73-6	C1=CC2=CN=NC=C2N=C1	{35: 3, 14: 5}
Did not match all atoms present	253-82-7	C1=CC=C2C(=C1)C=NC=N2	{35: 2, 14: 6}
Did not match all atoms present	2530-10-1	CC1=CC(=C(S1)C)C(=O)C	{24: 1, 1: 3, 14: 1, 41: 1}
Did not match all atoms present	2530-26-9	C1=CC(=CN=C1)[N+](=O)[O-]	{35: 1, 38: 1, 14: 4}
Did not match all atoms present	2530-46-3	CCCCCCCCCCCC[N+]1(CCOCC1)[O-]	{1: 1, 2: 11, 11: 4, 29: 1, 23: 1}
Did not match all atoms present	2530-83-8	CO[Si](CCCOCC1CO1)(OC)OC	{1: 3, 2: 4, 11: 1, 12: 1, 22: 4, 23: 1}
Did not match all atoms present	2530-85-0	CC(=C)C(=O)OCCC[Si](OC)(OC)OC	{1: 4, 2: 3, 5: 1, 7: 1, 22: 3, 28: 1}
Did not match all atoms present	2530-86-1	CN(C)CCC[Si](OC)(OC)OC	{1: 5, 2: 3, 22: 3, 33: 1}
Did not match all atoms present	2530-87-2	CO[Si](CCCCl)(OC)OC	{1: 3, 2: 3, 22: 3, 17: 1}
Did not match all atoms present	2530-99-6	CN1C=NC2=C1C(=O)N(C(=O)N2C)CC=C	{1: 2, 2: 1, 35: 1, 5: 1, 6: 1, 33: 3, 14: 1, 25: 2}
Did not match all atoms present	25301-02-4	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.C1CO1	{1: 5, 2: 1, 4: 2, 5: 1, 11: 2, 14: 4, 21: 1, 23: 1}
Did not match all atoms present	25305-87-7	CCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC(=C(C=C2)C(=C3C=CC(=[N+](CC)CC)C=C3)C4=C(C=C(C=C4)N(CC)CC5=CC(=CC=C5)S(=O)(=O)[O-])C)C	{1: 6, 2: 6, 33: 3, 7: 1, 14: 18, 15: 2, 20: 1, 29: 5}
Did not match all atoms present	25309-23-3	C1CCC(C(C1)OC(=O)C(=O)C2=CC=CC=C2)Cl	{11: 4, 12: 2, 14: 5, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	25309-64-2	CCC1=CC=C(C=C1)I	{1: 1, 2: 1, 19: 1, 14: 4}
Did not match all atoms present	25309-65-3	CCC1=CC=C(C=C1)C#N	{1: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	2531-84-2	CC1=CC2=C(C=C1)C3=CC=CC=C3C=C2	{1: 1, 14: 9}
Did not match all atoms present	25310-97-8	C1=CC=C2C(=C1)C=C(C(=O)C2=NNC3=CC(=C(C=C3)Cl)S(=O)(=O)O)C(=O)O	{34: 1, 14: 8, 15: 2, 17: 1, 20: 1, 25: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	25311-20-0	CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2OC)S(=O)(=O)CCOS(=O)(=O)O)OC)C3=CC=C(C=C3)S(=O)(=O)O	{1: 3, 2: 2, 35: 1, 33: 1, 12: 1, 34: 2, 14: 6, 15: 1, 20: 2, 22: 3, 25: 1, 29: 6}
Did not match all atoms present	25311-71-1	CCOP(=S)(NC(C)C)OC1=CC=CC=C1C(=O)OC(C)C	{1: 5, 2: 1, 3: 2, 14: 4, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	25316-27-2	C1=CC=C2C(=C1)C(=NN=C2NN)NN.Cl	{17: 1, 35: 2, 30: 2, 14: 4, 31: 2}
Did not match all atoms present	25316-40-9	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N)O.Cl	{1: 2, 2: 1, 11: 3, 12: 5, 13: 1, 14: 3, 17: 1, 20: 3, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	25316-59-0	CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.[Br-]	{1: 3, 2: 10, 18: 1, 14: 5}
Did not match all atoms present	25317-34-4	CC(=O)NC1=CC(=C(C=C1)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)O)C=CC2=N)S(=O)(=O)O	{1: 1, 36: 1, 14: 7, 15: 5, 20: 2, 24: 1, 25: 1, 29: 4, 31: 3}
Did not match all atoms present	25318-28-9	CC(CN(C)C)C(C)OC(=O)C1=CC=C(C=C1)N	{1: 4, 2: 1, 3: 2, 33: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	25319-73-7	C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)S)OC5=C3C=CC(=C5)S	{39: 2, 28: 1, 13: 1, 14: 10, 23: 1}
Did not match all atoms present	25319-90-8	CCSC(=O)COC1=C(C=C(C=C1)Cl)C	{1: 2, 2: 2, 40: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	2532-17-4	C1=CC=C(C(=C1)C(=O)[O-])I.[Na+]	{24: 1, 19: 1, 14: 4}
Did not match all atoms present	2532-49-2	CCCC1=NC(=CC(=N1)OC(=O)N(C)C)C	{1: 4, 2: 2, 35: 2, 33: 1, 14: 1, 28: 1}
Did not match all atoms present	25321-09-9	CC(C)C1=CC=CC=C1C(C)C	{1: 4, 3: 2, 14: 4}
Did not match all atoms present	25321-43-1	CCCCCCCCC1=CC=CC=C1S(=O)(=O)O	{1: 1, 2: 7, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	25322-01-4	COC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=CC=C2O)O	{1: 1, 6: 2, 14: 7, 21: 2, 22: 1, 24: 1}
Did not match all atoms present	25322-93-4	C=CC=O.OS(=O)[O-].[Na+]	{26: 1, 20: 1, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	25324-56-5	P#[Sn]	{}
Did not match all atoms present	25327-03-1	C(#N)[S-].C(#N)[S-].[Mn+2]	{37: 2}
Did not match all atoms present	25328-90-9	C1CCCC(=CCC1)C2=CC=CC=C2	{11: 6, 14: 6, 15: 1}
Did not match all atoms present	2533-20-2	CCCCCCCCCCCCCCCCCC1=NC(=NC(=N1)N)N	{1: 1, 2: 16, 35: 3, 30: 2}
Did not match all atoms present	2533-82-6	C[As]=S	{1: 1}
Did not match all atoms present	25331-92-4	CCC1=C(NC2=C1C(=O)C(CC2)CN3CCC4(CC3)OCCO4)C	{32: 1, 1: 2, 2: 2, 33: 1, 11: 8, 12: 1, 13: 1, 23: 2, 25: 1}
Did not match all atoms present	25332-20-1	CC1=NC=C(N1C)[N+](=O)[O-].Cl	{1: 2, 35: 1, 38: 1, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	25332-39-2	C1CN(CCN1CCCN2C(=O)N3C=CC=CC3=N2)C4=CC(=CC=C4)Cl.Cl	{33: 4, 2: 3, 35: 1, 11: 4, 14: 8, 17: 2, 25: 1}
Did not match all atoms present	25333-21-5	COC(=O)CCCOC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 3, 14: 2, 17: 3, 22: 1, 28: 1}
Did not match all atoms present	25333-24-8	COC(=O)CCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	25333-83-9	CCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C.C(=CC(=O)O)C(=O)O	{1: 3, 2: 4, 6: 2, 33: 2, 41: 1, 14: 7, 24: 1, 27: 2}
Did not match all atoms present	25338-54-9	CN(C)CC1=CC=CC=C1O.Cl	{1: 2, 2: 1, 33: 1, 14: 4, 17: 1, 21: 1}
Did not match all atoms present	25338-58-3	CCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOCCOCCOCCOCCOCC(=O)O	{1: 1, 2: 24, 27: 1, 22: 9, 14: 4}
Did not match all atoms present	25343-69-5	CCC1=C(C(=CC=C1)CC)N=C=S	{8: 1, 1: 2, 2: 2, 34: 1, 14: 3}
Did not match all atoms present	25343-70-8	CC(C)C1=C(C(=CC=C1)C(C)C)N=C=S	{8: 1, 1: 4, 34: 1, 3: 2, 14: 3}
Did not match all atoms present	25343-91-3	CN1CCS(=O)(=O)CC1	{1: 1, 11: 4, 29: 2, 33: 1}
Did not match all atoms present	253446-15-0	C1CNC[C@@H](C2=CC(=C(C(=C21)Cl)O)O)C3=CC=CC=C3.Br	{32: 1, 11: 3, 12: 1, 14: 6, 17: 1, 18: 1, 21: 2}
Did not match all atoms present	25351-18-2	CC(=O)CCC[N+](C)(C)C.[I-]	{24: 1, 1: 4, 2: 3, 19: 1}
Did not match all atoms present	25351-57-9	C1=CC=C(C=C1)C=CC=NCCCN=CC=CC2=CC=CC=C2	{2: 3, 34: 2, 14: 10, 6: 6}
Did not match all atoms present	25355-59-3	CN(C(=O)NC1=CC=C(C=C1)OC)N=O	{1: 2, 34: 1, 33: 1, 14: 4, 22: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	25355-61-7	CN(C(=O)NC1=CC=C(C=C1)Cl)N=O	{1: 1, 34: 1, 33: 1, 14: 4, 17: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	25357-81-7	C[Si](C)(C)O[Si](CCCN)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 2: 3, 30: 1, 22: 3}
Did not match all atoms present	2536-31-4	COC(=O)C1(C2=CC=CC=C2C3=C1C=C(C=C3)Cl)O	{1: 1, 13: 1, 14: 7, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	2536-91-6	CC1=CC2=C(C=C1)N=C(S2)N	{1: 1, 35: 1, 30: 1, 14: 3, 41: 1}
Did not match all atoms present	25360-32-1	[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Ru]	{29: 1, 14: 45}
Did not match all atoms present	25361-50-6	C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC(=CC=C3)Cl	{17: 1, 22: 2, 14: 13}
Did not match all atoms present	25364-43-6	CC1=CC(=CC=C1)N2C=CN=C2	{1: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	25364-86-7	C[N+](C)(C)CC(CO)Cl.[Cl-]	{1: 3, 2: 2, 3: 1, 20: 1, 17: 2}
Did not match all atoms present	25369-78-2	C1=CC2=C(C=C1Cl)NC(=S)N2	{32: 2, 17: 1, 14: 3}
Did not match all atoms present	2537-36-2	C[N+](C)(C)C.[O-]Cl(=O)(=O)=O	{1: 4, 29: 4, 17: 1}
Did not match all atoms present	2537-48-6	CCOP(=O)(CC#N)OCC	{1: 2, 2: 3, 29: 1, 22: 2, 37: 1}
Did not match all atoms present	25371-96-4	C1=CC=C(C(=C1)C(F)(F)F)N2C=CN=C2	{16: 3, 33: 1, 35: 1, 4: 1, 14: 7}
Did not match all atoms present	25371-97-5	C1=CC(=CC(=C1)N2C=CN=C2)C(F)(F)F	{16: 3, 33: 1, 35: 1, 4: 1, 14: 7}
Did not match all atoms present	25371-98-6	C1=CC(=CC=C1C(F)(F)F)N2C=CN=C2	{16: 3, 33: 1, 35: 1, 4: 1, 14: 7}
Did not match all atoms present	25374-10-1	CN(C)[Si](C1=CC=CC=C1)(N(C)C)Cl	{1: 4, 33: 2, 14: 5, 17: 1}
Did not match all atoms present	25374-11-2	CN(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)Cl	{1: 2, 33: 1, 14: 10, 17: 1}
Did not match all atoms present	25377-91-7	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)CC3=CC=C(C4=CC=CC=C34)S(=O)(=O)O	{2: 1, 20: 2, 29: 4, 14: 12}
Did not match all atoms present	25379-20-8	C1=CC=C(C=C1)C2=CN3C=CC=CC3=C2	{33: 1, 14: 11}
Did not match all atoms present	2538-70-7	CC[Ge](CC)(CC)O[Ge](CC)(CC)CC	{1: 6, 2: 6, 22: 1}
Did not match all atoms present	2538-85-4	C1=CC=C2C(=C1)C=CC(=C2N/N=C\3/C4=CC=CC=C4C(=CC3=O)S(=O)(=O)[O-])O.[Na+]	{34: 1, 14: 11, 15: 2, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	25383-99-7	CCCCCCCCCCCCCCCCCC(=O)OC(C)C(=O)OC(C)C(=O)[O-].[Na+]	{24: 1, 1: 3, 2: 16, 3: 2, 28: 2}
Did not match all atoms present	25384-14-9	CC(=O)C1=CC=CC=C1N.Cl	{24: 1, 1: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	25384-17-2	CCC(=O)OC1(CCN(CC1CC=C)C)C2=CC=CC=C2	{1: 2, 2: 2, 5: 1, 6: 1, 33: 1, 11: 3, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	25385-63-1	CC(CCCO)O.[N+](=O)(O)[O-].[N+](=O)(O)[O-]	{1: 1, 2: 3, 3: 1, 20: 4}
Did not match all atoms present	25389-94-0	C1C(C(C(C(C1N)OC2C(C(C(C(O2)CN)O)O)O)O)OC3C(C(C(C(O3)CO)O)N)O)N.OS(=O)(=O)O	{2: 2, 11: 1, 12: 15, 20: 9, 22: 2, 23: 2, 29: 2, 30: 4}
Did not match all atoms present	2539-17-5	COC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)O	{1: 1, 21: 1, 22: 1, 17: 4}
Did not match all atoms present	2539-21-1	CC(C)OC1=CC=CC=C1OC	{1: 3, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	2539-53-9	CCOC1=C(C=C(C=C1)C=O)O	{1: 1, 2: 1, 14: 3, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	25394-13-2	C1=CC(=C(C=C1N)S(=O)(=O)[O-])C=CC2=C(C=C(C=C2)N)S(=O)(=O)[O-].[Na+].[Na+]	{30: 2, 14: 6, 6: 2, 29: 6}
Did not match all atoms present	25394-75-6	C[C@H]1[C@@H]([C@@H](C(=CO1)C(=O)OC)CC2=NC=CC3=C2N(C4=CC=CC=C34)C)CO	{1: 3, 2: 2, 35: 1, 33: 1, 12: 3, 14: 7, 15: 1, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	25395-22-6	C1=CC=C(C(=C1)C(=O)N)OCC(=O)O	{2: 1, 14: 4, 22: 1, 24: 1, 27: 1, 30: 1}
Did not match all atoms present	25395-41-9	COC1=CC=CC=C1OCC(COC(=O)C2=CN=CC=C2)O	{1: 1, 2: 2, 3: 1, 14: 8, 35: 1, 20: 1, 22: 2, 28: 1}
Did not match all atoms present	25395-78-2	[Li+].[Li+].[Li+].[Li+].C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C	{1: 12, 7: 4}
Did not match all atoms present	254-03-5	C1C=COC2=CC=CC=C21	{11: 1, 14: 6, 23: 1}
Did not match all atoms present	254-04-6	C1C=CC2=CC=CC=C2O1	{11: 1, 14: 6, 23: 1}
Did not match all atoms present	254-27-3	C1C2=CC=CC=C2OCO1	{11: 2, 14: 4, 23: 2}
Did not match all atoms present	254-60-4	C1=CC2=C(N=C1)N=CC=C2	{35: 2, 14: 6}
Did not match all atoms present	254-79-5	C1=CC2=C(C=CC=N2)N=C1	{35: 2, 14: 6}
Did not match all atoms present	254-87-5	C1=CC=C2C(=C1)N=CN=N2	{35: 3, 14: 5}
Did not match all atoms present	2540-09-2	CC1=CC(=O)NC2=C1C=CC(=C2)Cl	{32: 1, 1: 1, 25: 1, 14: 4, 17: 1}
Did not match all atoms present	2540-31-0	CC(=O)CC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2	{24: 2, 1: 1, 2: 1, 14: 10, 33: 1}
Did not match all atoms present	2540-82-1	CN(C=O)C(=O)CSP(=S)(OC)OC	{1: 3, 2: 1, 33: 1, 40: 1, 22: 2, 24: 1, 26: 1}
Did not match all atoms present	2540-99-0	C1=CC2=C(C=C1S(=O)(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{28: 4, 29: 2, 14: 6}
Did not match all atoms present	25400-21-9	O[AsH2]	{20: 1}
Did not match all atoms present	25400-23-1	C[As](O)O	{1: 1, 20: 2}
Did not match all atoms present	25401-39-2	CCCCC1C2=CC3=CC=CC=C3C=C1C2=O	{1: 1, 2: 3, 12: 1, 14: 6, 25: 1}
Did not match all atoms present	25401-40-5	C1CCCC2=CC3=CC=CC=C3C=C(C2=O)CCC1	{25: 1, 11: 7, 14: 6}
Did not match all atoms present	25401-41-6	C1CCCCC2=CC3=CC=CC=C3C=C(C2=O)CCCC1	{25: 1, 11: 9, 14: 6}
Did not match all atoms present	25401-43-8	CCCCCCCCCCCC1C2=CC3=CC=CC=C3C=C1C2=O	{1: 1, 2: 10, 12: 1, 14: 6, 25: 1}
Did not match all atoms present	25405-85-0	C[C@@H]1[C@H]([C@@]2([C@@H](C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)CO)O)C)O)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6	{1: 4, 2: 1, 11: 1, 12: 5, 13: 4, 14: 12, 15: 2, 20: 3, 25: 1, 28: 2}
Did not match all atoms present	2541-68-6	CC1=C2C(=CC3=CC=CC=C13)C4=CC=CC=C4C=C2F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	2541-69-7	CC1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC=C14	{1: 1, 14: 11}
Did not match all atoms present	25410-61-1	CC(CON=C1C2=CC=CC=C2C=CC3=CC=CC=C31)[NH+](C)C.[Cl-]	{1: 3, 2: 1, 3: 1, 34: 1, 14: 10, 17: 1, 22: 1}
Did not match all atoms present	25410-64-4	CC[NH+](CC)CCON=C1C2=CC=CC=C2C=CC3=CC=CC=C31.[Cl-]	{1: 2, 2: 4, 34: 1, 14: 10, 17: 1, 22: 1}
Did not match all atoms present	25414-22-6	COC1=CC=CO1	{1: 1, 22: 1, 14: 3, 23: 1}
Did not match all atoms present	25417-20-3	CCCCC1=CC2=CC(=CC(=C2C=C1)S(=O)(=O)[O-])CCCC.[Na+]	{1: 2, 2: 6, 29: 3, 14: 5}
Did not match all atoms present	25419-33-4	CC1CCCC2=C1C(=CC=C2)C	{1: 2, 11: 3, 12: 1, 14: 3}
Did not match all atoms present	25425-12-1	C[C@@H]1[C@]([C@H]([C@](O1)(C)/C=C(\C)/C=C/C=C/C=C/C2=C(C(=CC(=O)O2)OC)C)O)(C)O	{1: 6, 6: 7, 7: 1, 12: 2, 13: 2, 14: 1, 20: 2, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	25425-97-2	[NH4+].O[Se](=O)O.O[Se](=O)O	{20: 4, 29: 2}
Did not match all atoms present	25429-29-2	C1=CC=C(C=C1)C2(C=C(C(=C(C2Cl)Cl)Cl)Cl)Cl	{17: 5, 12: 1, 13: 1, 14: 6, 15: 3}
Did not match all atoms present	25430-97-1	CCCCC(CC)C[Sn](CC(CC)CCCC)(Cl)Cl	{1: 4, 2: 10, 3: 2, 17: 2}
Did not match all atoms present	25432-19-3	CCS(=O)C(C)C	{1: 3, 2: 1, 3: 1, 29: 1}
Did not match all atoms present	25432-20-6	CCS(=O)C(C)(C)C	{1: 4, 2: 1, 4: 1, 29: 1}
Did not match all atoms present	25436-23-1	COC1=CC=C(C=C1)C=CC(=O)O[Si](C)(C)C	{1: 4, 22: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	25436-25-3	CC(=CC(=O)O[Si](C)(C)C)C	{1: 5, 28: 1, 6: 1, 7: 1}
Did not match all atoms present	25436-27-5	C[Si](C)(C)OC(=O)C1=CC=C(C=C1)Cl	{1: 3, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	25436-32-2	COC1=CC=CC=C1C(=O)O[Si](C)(C)C	{1: 4, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	25436-37-7	C[Si](C)(C)OC(=O)C1=CN=CC=C1	{1: 3, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	25438-23-7	C1=C(C(=CC(=C1Cl)Cl)Cl)OC(=O)C(Cl)(Cl)Cl	{17: 6, 4: 1, 14: 2, 28: 1}
Did not match all atoms present	25439-20-7	CN(C)C(=O)CNC(=O)CC1=CC=CC=C1	{1: 2, 2: 2, 33: 1, 14: 5, 24: 2, 31: 1}
Did not match all atoms present	25440-14-6	C1=CC2=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=N5)C(=C1N2)C6=C(C(=C(C(=C6F)F)F)F)F)C7=C(C(=C(C(=C7F)F)F)F)F)C8=C(C(=C(C(=C8F)F)F)F)F)C9=C(C(=C(C(=C9F)F)F)F)F	{16: 20, 32: 2, 35: 2, 14: 8}
Did not match all atoms present	25441-52-5	CCC(=O)C1=C(C=C(C=C1)C(C)(C)C)O	{1: 4, 2: 1, 4: 1, 14: 3, 21: 1, 24: 1}
Did not match all atoms present	25443-63-4	Cl[Ru](Cl)(Cl)(Cl)(Cl)Cl	{17: 6}
Did not match all atoms present	25444-93-3	CC1=C(OC(=S)N1C)C	{1: 3, 33: 1, 23: 1}
Did not match all atoms present	25446-32-6	CCCCCCC1=CC2=C(CC(C2)CCCC)C=C1	{1: 2, 2: 8, 11: 2, 12: 1, 14: 3}
Did not match all atoms present	25446-91-7	CCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCOS(=O)(=O)[O-].[Mg+2]	{1: 2, 2: 26, 29: 6, 22: 2}
Did not match all atoms present	25446-93-9	CCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCOS(=O)(=O)[O-].[Mg+2]	{1: 2, 2: 18, 29: 6, 22: 2}
Did not match all atoms present	25448-25-3	CC(C)CCCCCCCOP(OCCCCCCCC(C)C)OCCCCCCCC(C)C	{1: 6, 2: 21, 3: 3, 22: 3}
Did not match all atoms present	2545-26-8	C1=NC2=C(N1)C(=NC=N2)I	{32: 1, 35: 3, 19: 1, 14: 2}
Did not match all atoms present	2545-59-7	CCCCOCCOC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 6, 14: 2, 17: 3, 22: 2, 28: 1}
Did not match all atoms present	2545-60-0	C1(=C(C(=NC(=C1Cl)Cl)C(=O)[O-])Cl)N.[K+]	{24: 1, 17: 3, 35: 1, 30: 1}
Did not match all atoms present	25450-02-6	C[N+](C)(C)CCO/N=C\1/C2=CC=CC=C2C=CC3=C1C=C(C=C3)Cl.[I-]	{1: 3, 2: 2, 34: 1, 14: 9, 17: 1, 19: 1, 22: 1}
Did not match all atoms present	25451-15-4	C1=CC=C(C=C1)C(COC(=O)N)COC(=O)N	{2: 2, 3: 1, 28: 2, 30: 2, 14: 5}
Did not match all atoms present	25455-73-6	OO.[Ag].[Ag]	{20: 2}
Did not match all atoms present	25459-05-6	C1=CC=C(C=C1)C=CC(=O)[O-].[NH4+]	{24: 1, 14: 5, 6: 2}
Did not match all atoms present	25462-85-5	CC1=NC(=CC(=C1)C(=O)O)Cl	{1: 1, 27: 1, 35: 1, 14: 2, 17: 1}
Did not match all atoms present	25464-95-3	C1=C(C=C(C(=C1Cl)N)Cl)CC2=CC(=C(C(=C2)Cl)N)Cl	{17: 4, 2: 1, 30: 2, 14: 4}
Did not match all atoms present	25469-93-6	[Cl-].[Cl-].[Nd]	{17: 2}
Did not match all atoms present	25469-96-9	[Cl-].[Cl-].[Tb]	{17: 2}
Did not match all atoms present	2547-61-7	C(S(=O)(=O)Cl)(Cl)(Cl)Cl	{17: 4, 4: 1, 29: 2}
Did not match all atoms present	2547-66-2	C1N(CN(CN1CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4	{33: 3, 2: 3, 11: 3, 14: 15}
Did not match all atoms present	25470-23-9	[Cl-].[Cl-].[Pr]	{17: 2}
Did not match all atoms present	25470-94-4	CC1(C2=CC=CC=C2[N+](=C1C=CC=C3C(C4=CC=CC=C4N3C)(C)C)C)C.[I-]	{1: 6, 6: 3, 33: 2, 13: 2, 14: 8, 15: 2, 19: 1}
Did not match all atoms present	25470-96-6	C/C(=C/C(=O)C)/[O-].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Rh]	{1: 2, 6: 1, 7: 1, 14: 15, 24: 1, 29: 1}
Did not match all atoms present	25476-27-1	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Na+].[Na+]	{35: 8, 14: 16}
Did not match all atoms present	25483-56-1	[CH3-].CC[N-]CC.CC[N-]CC.CC[N-]CC.[Ti+4]	{1: 6, 2: 6, 34: 3}
Did not match all atoms present	25485-34-1	CC(C)CCCC(C)C1CCC2C1(CCC3C2C=CC4=CC(CCC34C)OC(=O)C5=CC=CC=C5)C	{1: 5, 2: 3, 3: 2, 11: 6, 12: 5, 13: 2, 14: 8, 15: 1, 28: 1}
Did not match all atoms present	25486-91-3	CC1=C2CCCCC2=C(C3=C1C=CC4=CC=CC=C43)C	{1: 2, 11: 4, 14: 6}
Did not match all atoms present	25486-92-4	CC1=C2CCC3=C2C(=CC4=C3CCC5=CC=CC=C54)C=C1	{1: 1, 11: 4, 14: 7}
Did not match all atoms present	25487-66-5	B(C1=CC(=CC=C1)C(=O)O)(O)O	{27: 1, 20: 2, 14: 4}
Did not match all atoms present	2549-47-5	COC(=O)C1=CC2=C(C=C1)C=CC(=C2)C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	2549-87-3	C=CCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{2: 1, 5: 1, 6: 1, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	2549-90-8	CCCCC(CC)COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 2, 2: 5, 3: 1, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	2549-99-7	CCO[Si](CC1=CC=CC=C1)(OCC)OCC	{1: 3, 2: 4, 22: 3, 14: 5}
Did not match all atoms present	25492-69-7	CC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+]	{1: 1, 14: 9, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	255-37-8	C1=CC=C2C(=C1)OC=CO2	{14: 6, 23: 2}
Did not match all atoms present	255-50-5	C1=CC=C2C(=C1)SC=CS2	{41: 2, 14: 6}
Did not match all atoms present	255-53-8	C1=CN=C2C(=N1)N=CC=N2	{35: 4, 14: 4}
Did not match all atoms present	2550-02-9	CCC[Si](OCC)(OCC)OCC	{1: 4, 2: 5, 22: 3}
Did not match all atoms present	2550-04-1	CCO[Si](CC=C)(OCC)OCC	{1: 3, 2: 4, 22: 3, 5: 1, 6: 1}
Did not match all atoms present	2550-06-3	C(C[Si](Cl)(Cl)Cl)CCl	{17: 4, 2: 3}
Did not match all atoms present	2550-26-7	CC(=O)CCC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 14: 5}
Did not match all atoms present	2550-27-8	CC(CC1=CC=CC=C1)C(=O)C	{24: 1, 1: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	2550-61-0	CS(=O)(=O)[O-].[Cs+]	{1: 1, 29: 3}
Did not match all atoms present	2550-73-4	C1=C2C(=CC3=C1C(=O)NC3=O)C(=O)NC2=O	{32: 2, 25: 4, 14: 2}
Did not match all atoms present	25505-87-7	CC1=C(C(=C(C(=C1NC2=NC(=NC(=N2)Cl)NCCNC3=NC(=NC(=N3)NC4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])Cl)C)S(=O)(=O)[O-])C)NC5=CC(=C(C6=C5C(=O)C7=CC=CC=C7C6=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 3, 2: 2, 35: 6, 14: 8, 17: 2, 25: 2, 29: 12, 30: 1, 31: 5}
Did not match all atoms present	2551-53-3	CCCCCCCCP(=S)(CCCCCCCC)CCCCCCCC	{1: 3, 2: 21}
Did not match all atoms present	2551-62-4	FS(F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	2551-83-9	CO[Si](CC=C)(OC)OC	{1: 3, 2: 1, 22: 3, 5: 1, 6: 1}
Did not match all atoms present	25510-41-2	[Li+].[Li+].C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3	{35: 8, 14: 16}
Did not match all atoms present	25519-07-7	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Tb+3]	{24: 3, 1: 3}
Did not match all atoms present	2552-89-8	CC[C@@H]1[C@H](N2[C@H]3CC1C4[C@@H]2CC5([C@H]3N(C6=CC=CC=C65)C)[C@@H]4OC(=O)CCl)OC(=O)CCl.Cl	{1: 2, 2: 3, 33: 2, 11: 2, 12: 8, 13: 1, 14: 4, 17: 3, 28: 2}
Did not match all atoms present	25526-93-6	CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)F	{32: 1, 1: 1, 2: 1, 33: 1, 11: 1, 12: 3, 14: 1, 16: 1, 20: 1, 23: 1, 25: 2}
Did not match all atoms present	2553-04-0	COC1=CC=CC=C1C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9}
Did not match all atoms present	2553-08-4	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O	{1: 5, 2: 1, 4: 2, 14: 8, 21: 1, 28: 1}
Did not match all atoms present	2553-19-7	CCO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCC	{1: 2, 2: 2, 22: 2, 14: 10}
Did not match all atoms present	25535-16-4	CC[N+](C)(CC)CCC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[I-].[I-]	{1: 3, 2: 5, 33: 1, 14: 11, 19: 2, 30: 2}
Did not match all atoms present	25539-14-4	CC1=CC(=CC(=C1)OC2=CC=CC=C2)C	{1: 2, 22: 1, 14: 8}
Did not match all atoms present	25539-16-6	COC(=O)C1=CC(=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)[O-])C(=O)OC.[Na+]	{1: 2, 28: 2, 22: 1, 14: 7, 29: 3}
Did not match all atoms present	2554-06-5	C[Si]1(O[Si](O[Si](O[Si](O1)(C)C=C)(C)C=C)(C)C=C)C=C	{1: 4, 5: 4, 6: 4, 23: 4}
Did not match all atoms present	2554-75-8	CN(C)C1=NC=C(C=C1)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 14: 3, 33: 1}
Did not match all atoms present	25543-63-9	COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C3=CC=CC=C3	{1: 1, 22: 1, 34: 1, 14: 13, 6: 1}
Did not match all atoms present	2555-25-1	C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CC=C(C=C3)[N+](=O)[O-]	{28: 1, 38: 1, 14: 9}
Did not match all atoms present	2555-28-4	CC1=CC(=O)OC2=C1C=CC(=C2)OC	{1: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	2555-29-5	CC1=CC(=O)OC2=C1C=CC(=C2C(=O)C)O	{24: 1, 1: 2, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	2555-49-9	CCOC(=O)COC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	25554-63-6	CN(C)NC(=S)SC	{40: 1, 1: 3, 31: 1, 33: 1, 7: 1}
Did not match all atoms present	2556-10-7	CCOC(C)OCCC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 22: 2, 14: 5}
Did not match all atoms present	2556-43-6	CN(C)C(=NC1=CC=CC=C1)N(C)C	{1: 4, 34: 1, 33: 2, 14: 5, 7: 1}
Did not match all atoms present	2556-53-8	C[O-].C[O-].[Ca+2]	{1: 2, 29: 2}
Did not match all atoms present	25561-30-2	C[Si](C)(C)N=C(C(F)(F)F)O[Si](C)(C)C	{1: 6, 34: 1, 4: 1, 7: 1, 16: 3, 22: 1}
Did not match all atoms present	25562-98-5	C1=CC=C(C=C1)OC2=CC=CC=C2CC#N	{2: 1, 22: 1, 14: 9, 37: 1}
Did not match all atoms present	25563-02-4	C1=CC=C(C=C1)OC2=CC=CC=C2CC(=O)O	{2: 1, 27: 1, 22: 1, 14: 9}
Did not match all atoms present	25567-67-3	C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])[N+](=O)[O-]	{17: 1, 38: 2, 14: 3}
Did not match all atoms present	25569-80-6	C1=CC=C(C(=C1)C2=CC(=CC=C2)Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	2557-13-3	COC(=O)C1=CC(=CC=C1)C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4, 28: 1}
Did not match all atoms present	2557-70-2	C1=CNC(=C1)C(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 3, 32: 1}
Did not match all atoms present	2557-77-9	C1=CC(=CC(=C1)S)F	{16: 1, 14: 4, 39: 1}
Did not match all atoms present	2557-78-0	C1=CC=C(C(=C1)F)S	{16: 1, 14: 4, 39: 1}
Did not match all atoms present	25570-02-9	CC1=CC(=CC(=C1)C2=CC(=CC(=C2)C)C)C	{1: 4, 14: 6}
Did not match all atoms present	25573-43-7	C[C@@]12CCN(O[C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C	{1: 4, 33: 2, 11: 2, 12: 1, 13: 1, 14: 3, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	25578-79-4	O=[Yb]	{29: 1}
Did not match all atoms present	2558-30-7	C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3F	{32: 1, 35: 1, 38: 1, 11: 1, 14: 7, 15: 1, 16: 1, 25: 1}
Did not match all atoms present	25583-20-4	N#[Ti]	{}
Did not match all atoms present	25583-37-3	CCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCC	{1: 2, 2: 6, 34: 2, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	25592-09-0	B1(SB(SS1)C)C	{1: 2, 41: 3}
Did not match all atoms present	25594-14-3	CC1(CC2=C(O1)C3=CC=CC=C3C=C2)C	{1: 2, 11: 1, 13: 1, 14: 6, 23: 1}
Did not match all atoms present	25595-59-9	C1=CC=C2C(=C1)C(OS2(=O)=O)Cl	{17: 1, 12: 1, 29: 2, 14: 4, 23: 1}
Did not match all atoms present	25596-24-1	C[S+](=O)(C)C.[Br-]	{1: 3, 18: 1, 29: 1}
Did not match all atoms present	256-81-5	C1C2=CC=CC=C2C=CC3=CC=CC=C31	{11: 1, 14: 10}
Did not match all atoms present	256-96-2	C1=CC=C2C(=C1)C=CC3=CC=CC=C3N2	{32: 1, 14: 10}
Did not match all atoms present	25601-84-7	CC(=CC(=O)N(C)OC)OP(=O)(OC)OC	{1: 5, 33: 1, 6: 1, 7: 1, 22: 4, 24: 1, 29: 1}
Did not match all atoms present	25603-67-2	C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)O	{20: 1, 13: 1, 14: 13}
Did not match all atoms present	25606-41-1	CCCOC(=O)NCCC[NH+](C)C.[Cl-]	{1: 3, 2: 5, 31: 1, 28: 1, 17: 1}
Did not match all atoms present	25607-16-3	CCC1=C(C2=CC=CC=C2C=C1)C	{1: 2, 2: 1, 14: 6}
Did not match all atoms present	2561-17-3	C#CC1=CC(=CC=C1)F	{16: 1, 9: 1, 10: 1, 14: 4}
Did not match all atoms present	25611-78-3	C1=CC=C(C=C1)CC(C2=CC=CC=C2)N	{2: 1, 3: 1, 30: 1, 14: 10}
Did not match all atoms present	25614-03-3	CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O	{32: 1, 1: 5, 2: 1, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 4, 15: 1, 18: 1, 20: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	25617-97-4	N#[Ga]	{}
Did not match all atoms present	25617-98-5	N#[In]	{}
Did not match all atoms present	25619-56-1	CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].[Ba+2]	{1: 4, 2: 32, 29: 6, 14: 10}
Did not match all atoms present	2562-52-9	C12=C(N=C(N1)Cl)N=C(N=C2Cl)Cl	{32: 1, 17: 3, 35: 3}
Did not match all atoms present	25621-88-9	C1=CC=C\2C(=C1)C(=C3C(=O)NC(=O)NC3=O)N/C2=C(\C#N)/C(=O)N	{32: 3, 37: 1, 7: 1, 14: 4, 15: 1, 24: 1, 25: 3, 30: 1}
Did not match all atoms present	256235-78-6	CCCCCCCCCCO[Si](CC)(CC)CC	{1: 4, 2: 12, 22: 1}
Did not match all atoms present	25624-76-4	C1=NC(=O)C(=C(N1)N)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	25627-41-2	C[NH+](C)CC/C=C\1/C2=CC=CC=C2CS(=O)C3=CC=CC=C31.C(=C\C(=O)[O-])\C(=O)O	{1: 2, 2: 2, 6: 3, 11: 1, 14: 8, 15: 1, 24: 1, 27: 1, 29: 1}
Did not match all atoms present	25629-50-9	CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)Cl	{1: 1, 35: 1, 14: 4, 17: 2, 23: 1, 24: 1}
Did not match all atoms present	2563-07-7	CCOC1=C(C=CC(=C1)C)O	{1: 2, 2: 1, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	2563-97-5	C1=CC=C(C=C1)NC(=O)C(Cl)(Cl)Cl	{24: 1, 17: 3, 4: 1, 14: 5, 31: 1}
Did not match all atoms present	25632-24-0	COC1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NC5=CC=C(C=C5)OC	{1: 2, 14: 12, 21: 2, 22: 2, 25: 2, 31: 2}
Did not match all atoms present	25633-57-2	CC1=CC2=C(C=C1)OC(=C2C3=C(C=CC(=C3)C)OC)C	{1: 4, 22: 1, 14: 6, 23: 1}
Did not match all atoms present	2564-02-5	C1=CC(=CC=C1NC(=O)CCl)Br	{2: 1, 14: 4, 17: 1, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	2564-05-8	C1=CC(=CC(=C1)Cl)NC(=O)CCl	{24: 1, 17: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	2564-35-4	C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O	{32: 1, 33: 1, 2: 1, 35: 2, 11: 1, 12: 3, 14: 1, 20: 5, 22: 3, 23: 1, 25: 1, 29: 3, 30: 1}
Did not match all atoms present	2564-65-0	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C(=C32)CO)CO	{2: 2, 20: 2, 14: 10}
Did not match all atoms present	2564-86-5	C(=O)[O]	{26: 1}
Did not match all atoms present	25640-28-2	[O-]P(=O)([O-])[O-].[Na+].[Mg+2]	{29: 4}
Did not match all atoms present	25640-78-2	CC(C)C1=CC=CC=C1C2=CC=CC=C2	{1: 2, 3: 1, 14: 9}
Did not match all atoms present	25641-53-6	C1=CC=C(C(=C1)C([N+](=O)[O-])[N+](=O)[O-])[O-].[Na+]	{3: 1, 38: 2, 14: 4}
Did not match all atoms present	25641-65-0	CCCCC1=C2C(=C(C=C1)CCCC)C(=O)C3=C(C=CC(=C3C2=O)CCCC)CCCC	{1: 4, 2: 12, 14: 4, 25: 2}
Did not match all atoms present	25641-98-9	C1=C(C=C(C(=C1Cl)C(=O)O)C(=O)O)Cl	{17: 2, 27: 2, 14: 2}
Did not match all atoms present	25641-99-0	C1=CC=C(C(=C1)C(Cl)Cl)C(Cl)Cl	{17: 4, 3: 2, 14: 4}
Did not match all atoms present	25646-71-3	CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)N)C.CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)N)C.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O	{1: 6, 2: 6, 33: 2, 14: 6, 20: 6, 29: 10, 30: 2, 31: 2}
Did not match all atoms present	25646-77-9	CCN(CCO)C1=CC(=C(C=C1)N)C.OS(=O)(=O)O	{1: 2, 2: 3, 33: 1, 14: 3, 20: 3, 29: 2, 30: 1}
Did not match all atoms present	2565-07-3	CC(=O)O[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)C	{1: 2, 28: 2, 14: 10}
Did not match all atoms present	25650-13-9	C1=CC(=CC=C1C(=O)C=CC(=O)C2=CC=C(C=C2)F)F	{16: 2, 24: 2, 14: 8, 6: 2}
Did not match all atoms present	25650-97-9	C[NH+]1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=CC=C4)OC)O)OC.[Cl-]	{1: 3, 11: 3, 12: 1, 14: 4, 17: 1, 21: 1, 22: 2}
Did not match all atoms present	25651-76-7	CC(=C1C(=O)N(C(=S)S1)CC(=O)O)C=C2N(CCS2)C	{1: 2, 2: 1, 33: 2, 6: 1, 7: 1, 41: 2, 11: 2, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	25658-42-8	N#[Zr]	{}
Did not match all atoms present	25658-43-9	N#[U]	{}
Did not match all atoms present	25659-31-8	[O-]I(=O)=O.[O-]I(=O)=O.[Pb+2]	{19: 2, 29: 6}
Did not match all atoms present	2566-22-5	C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)C2=CC=CC=C2	{2: 1, 3: 1, 14: 10, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	25660-64-4	C1=CC=C(C=C1)C2=C[Se]N=N2	{35: 2, 14: 6}
Did not match all atoms present	25660-70-2	CCSC1=NN=C(S1)N	{1: 1, 2: 1, 35: 2, 40: 1, 41: 1, 30: 1}
Did not match all atoms present	2567-29-5	C1=CC=C(C=C1)C2=CC=C(C=C2)CBr	{2: 1, 18: 1, 14: 9}
Did not match all atoms present	2567-83-1	CC[N+](CC)(CC)CC.[O-]Cl(=O)(=O)=O	{1: 4, 2: 4, 29: 4, 17: 1}
Did not match all atoms present	2567-85-3	CC(CC(C1=CC(=C(C=C1)O)C(C)(C)C)C2=CC(=C(C=C2)O)C(C)(C)C)C3=CC(=C(C=C3)O)C(C)(C)C	{1: 10, 2: 1, 3: 2, 4: 3, 14: 9, 21: 3}
Did not match all atoms present	25675-28-9	CC1=CC(=CC=C1)C(C)O	{1: 2, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	2568-24-3	C1C=CCOC(O1)C2=CC=CC=C2	{11: 2, 12: 1, 14: 7, 23: 2}
Did not match all atoms present	2568-25-4	CC1COC(O1)C2=CC=CC=C2	{1: 1, 11: 1, 12: 2, 14: 5, 23: 2}
Did not match all atoms present	2568-34-5	CN(CC(=O)O)C(=O)C1=CC=CC=C1	{1: 1, 2: 1, 33: 1, 14: 5, 24: 1, 27: 1}
Did not match all atoms present	25680-58-4	CCC1=NC=CN=C1OC	{1: 2, 2: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	25681-79-2	[Na][Na]	{}
Did not match all atoms present	25683-07-2	C1=CC(=C(C(=C1)O)C(=O)C2=CC(=C(N2)Cl)Cl)O	{24: 1, 17: 2, 21: 2, 14: 4, 32: 1}
Did not match all atoms present	25687-72-3	C[C@H]1CO[C@](O1)(C)C2=CC=CC=C2	{1: 2, 11: 1, 12: 1, 13: 1, 14: 5, 23: 2}
Did not match all atoms present	25687-77-8	CC1COC(O1)(C)C2=CC=CC=C2	{1: 2, 11: 1, 12: 1, 13: 1, 14: 5, 23: 2}
Did not match all atoms present	25687-87-0	C/C(=N\NC(=S)N)/CCC1=CC=CC=C1	{1: 1, 2: 2, 7: 2, 34: 1, 14: 5, 30: 1, 31: 1}
Did not match all atoms present	25688-42-0	C1=CC=C(C(=C1)C(F)(F)F)P(C2=CC=CC=C2C(F)(F)F)C3=CC=CC=C3C(F)(F)F	{16: 9, 4: 3, 14: 12}
Did not match all atoms present	25688-76-0	C[Si](C)(C)N(CCCCCC(=O)O[Si](C)(C)C)[Si](C)(C)C	{1: 9, 2: 5, 28: 1, 33: 1}
Did not match all atoms present	2569-58-6	C1=CC=C(C=C1)N=NC2=CC=NC=C2	{34: 2, 35: 1, 14: 9}
Did not match all atoms present	25697-55-6	C1=CC(=CC(=C1)C(F)(F)F)CS	{16: 3, 2: 1, 4: 1, 14: 4, 39: 1}
Did not match all atoms present	257-05-6	C1=CC=C2C(=C1)C=CC3=CC=CC=C3O2	{14: 10, 23: 1}
Did not match all atoms present	257-07-8	C1=CC=C2C(=C1)C=NC3=CC=CC=C3O2	{35: 1, 14: 9, 23: 1}
Did not match all atoms present	257-13-6	C1=CC=C2C(=C1)C=CC3=CC=CC=C3S2	{41: 1, 14: 10}
Did not match all atoms present	257-55-6	C1=CC=CC2=C(C=C1)C=CC=CC=C2	{14: 12}
Did not match all atoms present	2570-01-6	C1=CC=C(C=C1)C2=C(C2=S)C3=CC=CC=C3	{14: 10}
Did not match all atoms present	2570-63-0	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Tl+3]	{24: 3, 1: 3}
Did not match all atoms present	25704-81-8	COC1=C2C3=C4C(=C1)C5=CC=CC=C5C(=O)C4=CC(=C3C6=C7C2=C(C(=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)Br)OC)Br	{1: 2, 18: 2, 22: 2, 14: 12, 25: 2}
Did not match all atoms present	25708-11-6	CC/C(=C\C#CCC(C[NH+](C)C)O)/C.[Cl-]	{1: 4, 2: 3, 3: 1, 6: 1, 7: 1, 10: 2, 17: 1, 20: 1}
Did not match all atoms present	25709-80-2	C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5Br)O	{13: 1, 14: 9, 18: 1, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	2571-00-8	CC1=CC=C(C=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 1, 6: 1, 38: 2, 14: 7, 31: 1}
Did not match all atoms present	2571-06-4	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Ga+3]	{24: 3, 1: 3}
Did not match all atoms present	2571-39-3	CC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)C	{24: 1, 1: 2, 14: 8}
Did not match all atoms present	2571-52-0	CC1=CC(=C(C(=C1)C)C#N)C	{1: 3, 37: 1, 14: 2}
Did not match all atoms present	2571-54-2	COC1=CC(=C(C(=C1)OC)C#N)OC	{1: 3, 22: 3, 14: 2, 37: 1}
Did not match all atoms present	2571-90-6	C=CC1=CC=CC=[N+]1[O-]	{33: 1, 14: 4, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	25710-20-7	C1=C(C(=NC=C1Cl)N)N	{17: 1, 35: 1, 30: 2, 14: 2}
Did not match all atoms present	25711-26-6	CCCC[Sn](CCCC)(CCCC)OC(=O)CC(=C)C(=O)O[Sn](CCCC)(CCCC)CCCC	{1: 6, 2: 19, 28: 2, 5: 1, 7: 1}
Did not match all atoms present	25711-72-2	C1=CC(=CC(=C1)NC(=O)N)N	{24: 1, 30: 2, 14: 4, 31: 1}
Did not match all atoms present	25711-77-7	C1(=C(C(=C(C(=C1F)F)F)F)F)OC(C(OC(C(=O)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F	{16: 16, 24: 1, 4: 5, 22: 2}
Did not match all atoms present	25717-11-7	CC1=C/C(=N/NC2=CC=C(C=C2)N)/C(=O)C=C1	{1: 1, 34: 1, 14: 7, 15: 2, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	25717-80-0	CCO/C(=N/C1=C[N+](=NO1)N2CCOCC2)/[O-]	{1: 1, 2: 1, 35: 1, 33: 2, 7: 1, 11: 4, 34: 1, 14: 1, 22: 1, 23: 2}
Did not match all atoms present	25718-61-0	C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].[Cr+3]	{27: 3, 14: 12}
Did not match all atoms present	25722-07-0	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCN)CCN	{2: 6, 27: 2, 30: 2, 14: 4}
Did not match all atoms present	25724-50-9	CC1=CC(=NN1SC(Cl)(Cl)Cl)C	{1: 2, 35: 1, 4: 1, 33: 1, 40: 1, 14: 1, 17: 3}
Did not match all atoms present	25724-54-3	CCC(CCCCOC(=O)C1=CC=CC=C1)COC(=O)C2=CC=CC=C2	{1: 1, 2: 6, 3: 1, 28: 2, 14: 10}
Did not match all atoms present	25724-58-7	CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC	{1: 2, 2: 14, 28: 2, 14: 4}
Did not match all atoms present	25727-08-6	CC(COC(C)CP(CC(C)OCC(C)O)CC(C)OCC(C)O)O	{1: 6, 2: 6, 3: 6, 20: 3, 22: 3}
Did not match all atoms present	25729-12-8	CCCCCCCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCCCCCCC)[O-]	{1: 2, 2: 14, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	25729-13-9	CCCCCCCCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCCCCCCCC)[O-]	{1: 2, 2: 16, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	2573-69-5	C1CCC(CC1)P(=S)(C2CCCCC2)[S-].C1CCC(CC1)P(=S)(C2CCCCC2)[S-].[Zn+2]	{11: 20, 12: 4}
Did not match all atoms present	2573-70-8	CCCCP(=S)(CCCC)[S-].[NH4+]	{1: 2, 2: 6}
Did not match all atoms present	25730-47-6	C1=CC=C(C=C1)C2=CSS3=C2C(=CS3)C4=CC=CC=C4	{41: 2, 14: 12, 15: 3}
Did not match all atoms present	25732-31-4	C1=NC2=C(N1)C(=NC=N2)NNC(=S)N	{32: 1, 35: 3, 7: 1, 14: 2, 30: 1, 31: 2}
Did not match all atoms present	25732-35-8	C12=C(C(=C(C(=C1F)F)F)F)C(=NN=C2F)F	{16: 6, 35: 2}
Did not match all atoms present	25732-74-5	C1CC2=CC3=CC=CC4=C3C5=C(C=CC1=C25)C=C4	{11: 2, 14: 8}
Did not match all atoms present	25738-35-6	C1=CC=C(C=C1)NC(=O)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC(=O)NC4=CC=CC=C4)S(=O)(=O)O)S(=O)(=O)O	{6: 2, 14: 16, 20: 2, 24: 2, 29: 4, 31: 4}
Did not match all atoms present	25739-65-5	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)S(=O)(=O)O)C3=CC(=C(C=C3Cl)S(=O)(=O)O)Cl	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 6, 15: 1, 17: 2, 20: 2, 25: 1, 29: 4}
Did not match all atoms present	2574-03-0	C1=CC(=CC=C1C#[N+][O-])[N+](=O)[O-]	{34: 1, 38: 1, 29: 1, 14: 4}
Did not match all atoms present	25743-94-6	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NCCCN(C)C)C(=O)C4=CC=CC=C4C3=O	{1: 3, 2: 3, 33: 1, 14: 10, 25: 2, 31: 2}
Did not match all atoms present	25744-09-6	C1=CC=C(C=C1)C2=NC(=CC3=CC=C(C=C3)C=C4C(=O)OC(=N4)C5=CC=CC=C5)C(=O)O2	{35: 2, 28: 2, 14: 14, 6: 2, 15: 4}
Did not match all atoms present	25746-37-6	CC/C(=C/C1=[N+](C2=C(S1)C=CC(=C2)C)CCCS(=O)(=O)O)/C=C\3/N(C4=C(S3)C=CC(=C4)C)CCCS(=O)(=O)[O-].CCN(CC)CC	{1: 6, 2: 10, 33: 3, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	25747-05-1	C1=CC=C2C(=C1)C=CC(=C2O)NN=C3C4=CC=CC=C4C(=CC3=O)S(=O)(=O)O	{34: 1, 14: 11, 15: 2, 20: 1, 21: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	25747-08-4	C1=CC=C2C(=C1)C=CC(=C2O)NN=C3C4=C(C=C(C=C4)[N+](=O)[O-])C(=CC3=O)S(=O)(=O)O	{34: 1, 38: 1, 14: 10, 15: 2, 20: 1, 21: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	25749-08-0	N.N.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.[Ni].[Ni]	{20: 6, 29: 6}
Did not match all atoms present	25756-83-6	FP=S	{16: 1}
Did not match all atoms present	25756-87-0	OP	{20: 1}
Did not match all atoms present	25757-74-8	NP(F)F	{16: 2, 30: 1}
Did not match all atoms present	25764-08-3	N#[Ce]	{}
Did not match all atoms present	25764-09-4	N#[Pr]	{}
Did not match all atoms present	25764-10-7	N#[La]	{}
Did not match all atoms present	25764-11-8	N#[Nd]	{}
Did not match all atoms present	25764-14-1	N#[Sm]	{}
Did not match all atoms present	25764-15-2	N#[Gd]	{}
Did not match all atoms present	25767-20-8	CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CCC(=O)OC)C)C(=C4C)CCC(=O)OC)C(=C3C)CCC(=O)OC)CCC(=O)OC	{32: 2, 1: 8, 2: 8, 35: 2, 14: 4, 28: 4}
Did not match all atoms present	25769-03-3	C1CCN(C1)C(=S)S	{33: 1, 11: 4, 39: 1, 7: 1}
Did not match all atoms present	25770-53-0	CC1=CC=C(C=C1)S(=O)(=O)N=CN(C)C	{1: 3, 34: 1, 6: 1, 33: 1, 14: 4, 29: 2}
Did not match all atoms present	25771-21-5	CN(C)C(=O)C1=CC=C(C=C1)C(F)(F)F	{1: 2, 4: 1, 33: 1, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	25771-65-7	C1=CC=C(C=C1)C2=C3C=CC=C(C3=NC=C2)[N+](=O)[O-]	{35: 1, 38: 1, 14: 10}
Did not match all atoms present	25773-40-4	CC(C)C1=NC=CN=C1OC	{1: 3, 3: 1, 22: 1, 14: 2, 35: 2}
Did not match all atoms present	25774-02-1	C1=CC=C(C=C1)COC(=O)C(C2=CC=CC=C2)C(=O)O	{27: 1, 2: 1, 3: 1, 28: 1, 14: 10}
Did not match all atoms present	25778-91-0	CCNC1=NC(=NC(=N1)NC2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NCC)NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 2: 2, 35: 6, 6: 2, 14: 12, 29: 18, 31: 6}
Did not match all atoms present	25779-13-9	C1=CC=C(C=C1)[C@@H](CO)O	{2: 1, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	2578-28-1	C[Se]CCC(C(=O)O)N	{27: 1, 1: 1, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	2578-45-2	C1=C(C=NC(=C1[N+](=O)[O-])Cl)[N+](=O)[O-]	{17: 1, 35: 1, 38: 2, 14: 2}
Did not match all atoms present	2578-58-7	C1=C(NC=N1)C[C@@H](C(=O)NCC(=O)O)N	{32: 1, 2: 2, 3: 1, 14: 2, 35: 1, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	2578-75-8	CC(=O)NC1=NN=C(S1)C2=CC=C(O2)[N+](=O)[O-]	{1: 1, 35: 2, 38: 1, 41: 1, 14: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	25781-92-4	C1=CC=C(C=C1)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-]	{17: 1, 38: 1, 14: 8, 31: 1}
Did not match all atoms present	25782-30-3	CC(=O)OC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC(=O)C)OC(=O)C)OC(=O)C	{1: 5, 14: 5, 22: 1, 23: 1, 25: 1, 28: 4}
Did not match all atoms present	25782-57-4	C1=CC=C(C=C1)C(C2=CC=C(C=C2)N)O	{3: 1, 20: 1, 30: 1, 14: 9}
Did not match all atoms present	25783-45-3	CCOC1=CC=CC(=C1)OC	{1: 2, 2: 1, 22: 2, 14: 4}
Did not match all atoms present	25783-56-6	C1CS(=O)(=O)CC1NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O	{11: 3, 12: 1, 14: 6, 21: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	25784-16-1	CC\1=NC2=CC=CC=C2/C1=N/NC3=CC=C(C=C3)C(=O)C[N+](C)(C)C.[Cl-]	{1: 4, 2: 1, 35: 1, 34: 1, 14: 8, 15: 2, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	25784-91-2	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)Cl)Cl	{24: 1, 17: 2, 38: 1, 14: 3}
Did not match all atoms present	2579-22-8	C1=CC=C(C=C1)C#CC=O	{10: 2, 26: 1, 14: 5}
Did not match all atoms present	25790-28-7	CC1=CC(=CC=C1)N(CCOC(=O)OC)CCOC(=O)OC	{1: 3, 2: 4, 14: 4, 33: 1}
Did not match all atoms present	25790-35-6	CC(=O)CC(=O)C1=CC=CO1	{24: 2, 1: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	25790-73-2	CN(CCO)C1=NC(=NC(=N1)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)Cl)N(C)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 2, 2: 4, 35: 6, 6: 2, 33: 2, 14: 6, 17: 2, 20: 2, 29: 6, 31: 2}
Did not match all atoms present	25796-01-4	C1=CC=C2C(=C1)C=CC=C2/C=C/C3=CC=NC=C3.Cl	{17: 1, 35: 1, 14: 11, 6: 2}
Did not match all atoms present	258-31-1	C1=CC=C2C=C3C=C4C=C5C=C6C=CC=CC6=CC5=CC4=CC3=CC2=C1	{14: 16}
Did not match all atoms present	258-76-4	C1=CC=C2C=C3C(=CC2=C1)N=C4C=C5C=CC=CC5=CC4=N3	{35: 2, 14: 12}
Did not match all atoms present	2580-77-0	C(CS(=O)(=O)CCO)O	{2: 4, 20: 2, 29: 2}
Did not match all atoms present	2580-78-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{2: 2, 14: 9, 22: 1, 25: 2, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	2580-80-5	CC1=CC(=C(C=C1N)NC(=O)C2=CC=CC=C2)C	{24: 1, 1: 2, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	25800-30-0	CCCOC(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 2, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	25804-89-1	CN(C)C1C2=C(C=C(C=C2)Cl)OC=N1	{1: 2, 35: 1, 33: 1, 12: 1, 14: 4, 17: 1, 23: 1}
Did not match all atoms present	25805-16-7	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCO)CO	{2: 5, 8: 2, 34: 2, 14: 8, 20: 2, 29: 2}
Did not match all atoms present	2581-34-2	CC1=C(C=CC(=C1)O)[N+](=O)[O-]	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	2581-69-3	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)[N+](=O)[O-]	{34: 2, 38: 1, 14: 13, 31: 1}
Did not match all atoms present	25811-66-9	CC(C)(C)N=N[Si](C)(C)C	{1: 6, 34: 2, 4: 1}
Did not match all atoms present	25812-30-0	CC1=CC(=C(C=C1)C)OCCCC(C)(C)C(=O)O	{1: 4, 2: 3, 4: 1, 14: 3, 22: 1, 27: 1}
Did not match all atoms present	2582-07-2	C1=CC=C2C(=C1)N=C(S2)N=C(N)N	{34: 1, 35: 1, 7: 1, 41: 1, 14: 4, 30: 2}
Did not match all atoms present	2582-42-5	C1=CC(=O)C(=CC1=NC2=CC(=C(C(=C2)Cl)O)Cl)Cl	{34: 1, 14: 5, 15: 2, 17: 3, 21: 1, 25: 1}
Did not match all atoms present	2582-79-8	C[Si](C)(C)OC1C(C(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 18, 12: 6, 22: 6}
Did not match all atoms present	25829-64-5	C1=CC=C(C(=C1)C2=NC3=C(N2)C=C(C=C3)OC4=CC5=C(C=C4)N=C(N5)C6=CC=CC=C6N)N	{32: 2, 30: 2, 35: 2, 22: 1, 14: 14}
Did not match all atoms present	2583-80-4	C1=CC=C(C=C1)/C=C/C2=C(C=C(C=C2)S(=O)(=O)[O-])N3N=C4C=CC5=C(C4=N3)C=CC(=C5)S(=O)(=O)[O-].[Na+].[Na+]	{33: 1, 35: 2, 14: 13, 6: 2, 29: 6}
Did not match all atoms present	25834-80-4	C1=CC(=CC=C1CC2=CC(=C(C=C2)N)CC3=CC=C(C=C3)N)N	{2: 2, 30: 3, 14: 11}
Did not match all atoms present	25837-05-2	[2H]C1=C(C(=C(C(=C1[2H])[2H])C([2H])([2H])C([2H])([2H])[2H])[2H])[2H]	{1: 1, 2: 1, 14: 5}
Did not match all atoms present	25843-64-5	C[N+]1=C(C=CC2=CC=CC=C21)C=NC3=CC=C(C=C3)N(CCCl)CCCl.[Cl-]	{1: 1, 2: 4, 6: 1, 33: 2, 34: 1, 14: 10, 17: 3}
Did not match all atoms present	25844-12-6	CC1=CC(=C(C(=C1)C(C)(C)C)O)CO	{1: 4, 2: 1, 4: 1, 14: 2, 20: 1, 21: 1}
Did not match all atoms present	25849-26-7	C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)N/N=C/3\C=C(C(=O)C=C3)C(=O)O)N/N=C/4\C=C(C(=O)C=C4)C(=O)O	{34: 2, 14: 14, 15: 4, 24: 1, 25: 2, 27: 2, 31: 4}
Did not match all atoms present	25852-70-4	CCCCCCC(C)OC(=O)CS[Sn](CCCC)(SCC(=O)OC(C)CCCCCC)SCC(=O)OC(C)CCCCCC	{40: 3, 1: 7, 2: 21, 3: 3, 28: 3}
Did not match all atoms present	25853-45-6	C1[C@H](O[C@H]([C@@H]1O)N2C=CC(=NC2=O)N)COP(=O)(O)O.C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC=NC3=O)COP(=O)(O)O)O	{32: 1, 33: 2, 2: 2, 35: 3, 11: 2, 12: 6, 14: 4, 20: 6, 22: 2, 23: 2, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	25854-16-4	C1=CC=C(C(=C1)CN=C=O)CN=C=O	{8: 2, 2: 2, 34: 2, 29: 2, 14: 4}
Did not match all atoms present	25855-92-9	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2Cl)CBr	{17: 1, 2: 1, 18: 1, 14: 8}
Did not match all atoms present	25857-20-9	C(CO)N(CCO)CS(=O)(=O)[O-].[Na+]	{33: 1, 2: 5, 20: 2, 29: 3}
Did not match all atoms present	2586-57-4	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=O)C=CC4=CC=CC=C43)OC)N/N=C/5\C=CC6=C(C5=O)C(=C(C=C6S(=O)(=O)O)S(=O)(=O)O)N	{1: 2, 34: 2, 14: 15, 15: 2, 20: 2, 22: 2, 25: 2, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	2586-62-1	CC1=C(C2=CC=CC=C2C=C1)Br	{1: 1, 18: 1, 14: 6}
Did not match all atoms present	2587-02-2	C1=C(C=C(N=C1Cl)Cl)N	{17: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	2587-42-0	CCCCCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCCCCC)[O-]	{1: 2, 2: 10, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	2587-75-9	CCCCC[Sn](CCCCC)(CCCCC)OC(=O)C	{1: 4, 2: 12, 28: 1}
Did not match all atoms present	2587-76-0	CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)Cl	{1: 3, 2: 21, 17: 1}
Did not match all atoms present	2587-81-7	CC[Pb](CC)(CC)OC(=O)C	{1: 4, 2: 3, 28: 1}
Did not match all atoms present	2587-82-8	CCCC[Pb](CCCC)(CCCC)OC(=O)C	{1: 4, 2: 9, 28: 1}
Did not match all atoms present	2587-84-0	CCCC[Pb](CCCC)(OC(=O)C)OC(=O)C	{1: 4, 2: 6, 28: 2}
Did not match all atoms present	2587-90-8	COP(=O)(OC)SCCSC	{40: 2, 1: 3, 2: 2, 29: 1, 22: 2}
Did not match all atoms present	25870-62-6	CCCCC(=O)CC1=CC=CC=C1	{24: 1, 1: 1, 2: 4, 14: 5}
Did not match all atoms present	25871-69-6	C1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2)C(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4	{24: 3, 14: 18}
Did not match all atoms present	25875-51-8	C1=CC(=CC=C1/C=N/N/C(=N/N=C/C2=CC=C(C=C2)Cl)/N)Cl	{34: 3, 6: 2, 7: 1, 14: 8, 17: 2, 30: 1, 31: 1}
Did not match all atoms present	25877-27-4	CN(C)CCC1=CC=CC=N1.Cl	{1: 2, 2: 2, 35: 1, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	2588-03-6	CCOP(=S)(OCC)SCS(=O)CC	{40: 1, 1: 3, 2: 4, 29: 1, 22: 2}
Did not match all atoms present	2588-04-7	CCOP(=S)(OCC)SCS(=O)(=O)CC	{40: 1, 1: 3, 2: 4, 29: 2, 22: 2}
Did not match all atoms present	2588-05-8	CCOP(=O)(OCC)SCS(=O)CC	{40: 1, 1: 3, 2: 4, 29: 2, 22: 2}
Did not match all atoms present	25889-63-8	CC1=C(C=C2C3=CC=CC4=C3C(=CC=C4)C2=C1)C	{1: 2, 14: 8}
Did not match all atoms present	2589-01-7	C1C(O1)COC2=NC(=NC(=N2)OCC3CO3)OCC4CO4	{2: 3, 35: 3, 11: 3, 12: 3, 22: 3, 23: 3}
Did not match all atoms present	2589-02-8	CC(C)(C1=CC(=C(C(=C1)Cl)OCC2CO2)Cl)C3=CC(=C(C(=C3)Cl)OCC4CO4)Cl	{1: 2, 2: 2, 4: 1, 11: 2, 12: 2, 14: 4, 17: 4, 22: 2, 23: 2}
Did not match all atoms present	2589-21-1	CCCCN(CCCC)C(=O)NC1=CC=CC=C1	{1: 2, 2: 6, 33: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	2589-47-1	CCC[N+]12[C@H]3CC([C@@H]([C@H]1O)CC)C4[C@@H]2C[C@@]5([C@H]3N(C6=CC=CC=C65)C)[C@@H]4O.C[C@H]([C@@H](C)C(=O)[O-])C(=O)[O-]	{1: 5, 2: 3, 3: 2, 33: 1, 11: 2, 12: 8, 13: 1, 14: 4, 20: 2, 24: 2}
Did not match all atoms present	2589-71-1	CCCCC(=O)C1=CC=C(C=C1)O	{24: 1, 1: 1, 2: 3, 21: 1, 14: 4}
Did not match all atoms present	2589-73-3	CCCCCCCC(=O)C1=CC=C(C=C1)O	{24: 1, 1: 1, 2: 6, 21: 1, 14: 4}
Did not match all atoms present	2589-78-8	CCCCCCCCCCCCCCCCC1=CC=C(C=C1)O	{1: 1, 2: 15, 21: 1, 14: 4}
Did not match all atoms present	25894-11-5	CCOC(=O)C1=C(C(=C(N1)C)C=C)C	{32: 1, 1: 3, 2: 1, 5: 1, 6: 1, 28: 1}
Did not match all atoms present	25895-60-7	[B-]C#N.[Na+]	{37: 1}
Did not match all atoms present	25895-62-9	[2H][B-]([2H])([2H])C#N.[Na+]	{37: 1}
Did not match all atoms present	25895-63-0	[2H][B-]([2H])([2H])C#N.[K+]	{37: 1}
Did not match all atoms present	25898-71-9	CCCC(C#C[Si](C)(C)C(Cl)Cl)O	{1: 3, 2: 2, 3: 2, 10: 2, 17: 2, 20: 1}
Did not match all atoms present	259-79-0	C1=CC=C2C(=C1)C3=CC=CC=C23	{14: 8}
Did not match all atoms present	259-84-7	C1=CC2=C(C3=C2C=CC=N3)N=C1	{35: 2, 14: 6}
Did not match all atoms present	25909-39-1	[Cl-].[Cl-].[Cl-].[Pt+4]	{17: 3}
Did not match all atoms present	2591-17-5	C1C(N/C(=C/2\N=C3C=CC(=O)C=C3S2)/S1)C(=O)O	{32: 1, 35: 1, 41: 2, 11: 1, 12: 1, 14: 3, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	2591-57-3	CCOP(=S)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 1, 38: 1, 22: 3, 14: 4}
Did not match all atoms present	2591-66-4	COP(=S)(N)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 30: 1, 22: 2, 14: 2, 17: 3}
Did not match all atoms present	2591-74-4	CCNP(=S)(OC)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 1, 14: 2, 17: 3, 22: 2, 31: 1}
Did not match all atoms present	25910-37-6	C1=CC=C(C(=C1)[N+]#N)[N+](=O)[O-]	{34: 1, 38: 1, 14: 4}
Did not match all atoms present	25910-85-4	CCOC1=CC2=C(C=C1)[N+](=C(C=C2)C=CC3=CC(=CC=C3)[N+](=O)[O-])C.COS(=O)(=O)[O-]	{1: 3, 2: 1, 38: 1, 6: 2, 33: 1, 14: 9, 22: 2, 29: 3}
Did not match all atoms present	25912-22-5	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C(NC3=CC(=C4C=CC=NC4=C3O)Cl)O	{3: 1, 14: 13, 17: 1, 35: 1, 20: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	259139-51-0	CC(C)CC(C)OC(=O)C1=CC=CC=C1C(=O)OC(C)CC(C)C	{1: 6, 2: 2, 3: 4, 28: 2, 14: 4}
Did not match all atoms present	25916-47-6	C=CC(=O)[O-].[Zn+2]	{24: 1, 5: 1, 6: 1}
Did not match all atoms present	25917-89-9	CC1=CC(=C(C=C1N)[N+](=O)[O-])N	{1: 1, 38: 1, 30: 2, 14: 2}
Did not match all atoms present	25917-90-2	COC1=CC(=C(C=C1N)[N+](=O)[O-])N	{1: 1, 30: 2, 38: 1, 22: 1, 14: 2}
Did not match all atoms present	2592-28-1	COC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N	{1: 1, 30: 1, 34: 2, 22: 1, 14: 8}
Did not match all atoms present	2592-95-2	C1=CC=C2C(=C1)N=NN2O	{33: 1, 35: 2, 21: 1, 14: 4}
Did not match all atoms present	2593-15-9	CCOC1=NC(=NS1)C(Cl)(Cl)Cl	{1: 1, 2: 1, 35: 2, 4: 1, 41: 1, 17: 3, 22: 1}
Did not match all atoms present	2593-81-9	CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]	{1: 1, 38: 1, 33: 1, 14: 3, 25: 2}
Did not match all atoms present	25930-79-4	C[Se+](C)C	{1: 3}
Did not match all atoms present	25931-01-5	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O	{2: 7, 8: 2, 34: 2, 14: 8, 20: 2, 27: 2, 29: 2}
Did not match all atoms present	25932-11-0	C1=CC=C(C=C1)S(=O)[O-].O.O.[Na+]	{29: 2, 14: 5}
Did not match all atoms present	25934-47-8	CCCCCCCCCCOC1=CC=CC=C1OCCCCCCCCCC	{1: 2, 2: 18, 22: 2, 14: 4}
Did not match all atoms present	25937-78-4	CC(=O)[CH-]C(=O)C.[Cs+]	{24: 2, 1: 2, 6: 1}
Did not match all atoms present	25938-97-0	C1=CC=C(C=C1)NNC(=O)C2=CC=C(C=C2)Br	{24: 1, 18: 1, 14: 9, 31: 2}
Did not match all atoms present	25939-05-3	C1=CC=C(C=C1)C(=NNC2=C(C=C(C=C2Cl)Cl)Cl)Cl	{17: 4, 34: 1, 31: 1, 14: 7, 7: 1}
Did not match all atoms present	25948-11-2	CCCNC1=NC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 2, 35: 1, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	25948-13-4	COCCCNC1=NC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 3, 35: 1, 38: 1, 14: 3, 22: 1, 31: 1}
Did not match all atoms present	25948-14-5	C1CCC(CC1)NC2=NC=C(C=C2)[N+](=O)[O-]	{35: 1, 38: 1, 11: 5, 12: 1, 14: 3, 31: 1}
Did not match all atoms present	2595-54-2	CCOC(=O)N(C)C(=O)CSP(=S)(OCC)OCC	{1: 4, 2: 4, 33: 1, 40: 1, 22: 2, 24: 1, 28: 1}
Did not match all atoms present	25952-35-6	CN1COCN(C1=S)C	{23: 1, 1: 2, 11: 2, 33: 2, 15: 1}
Did not match all atoms present	25952-36-7	CCN1COCN(C1=S)CC	{1: 2, 2: 2, 33: 2, 11: 2, 15: 1, 23: 1}
Did not match all atoms present	25953-06-4	CCN(CC)C1=CC(=C(C=C1)N=O)O.Cl	{1: 2, 2: 2, 33: 1, 34: 1, 14: 3, 17: 1, 21: 1, 29: 1}
Did not match all atoms present	25954-13-6	CCOP(=O)(C(=O)N)[O-].[NH4+]	{1: 1, 2: 1, 22: 1, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	25955-51-5	C/C(=C\C(=O)C)/O[Tl]	{24: 1, 1: 2, 22: 1, 6: 1, 7: 1}
Did not match all atoms present	25956-17-6	CC1=CC(=C(C=C1S(=O)(=O)[O-])OC)N/N=C\2/C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 1, 14: 7, 15: 1, 22: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	25959-36-8	CP1(=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C	{1: 2, 14: 17, 15: 3}
Did not match all atoms present	25959-50-6	COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C=CC(=O)O	{1: 1, 34: 1, 6: 3, 14: 8, 22: 1, 27: 1}
Did not match all atoms present	25959-51-7	CCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C	{1: 2, 34: 1, 6: 1, 2: 5, 14: 8, 22: 1}
Did not match all atoms present	2596-47-6	CC(=O)OC1=C(C=C(C=C1)C=CC(=O)O)OC	{1: 2, 6: 2, 14: 3, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	2596-93-2	C1=CC=C(C(=C1)NC=O)Cl	{17: 1, 26: 1, 14: 4, 31: 1}
Did not match all atoms present	25962-03-2	CCN1C2=CC=CC=C2SC1=CC=C3C(=O)N(C(=S)S3)CC(=O)O	{1: 1, 2: 2, 6: 2, 33: 2, 41: 2, 14: 4, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	25962-05-4	CCN1C2=CC=CC=C2OC1=CC=C3C(=O)N(C(=S)S3)CC	{1: 2, 2: 2, 6: 2, 33: 2, 41: 1, 14: 4, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	25962-16-7	CCN1C2=CC=CC=C2OC1=C3C(=O)N(C(=S)S3)C4=CC=CC=C4	{1: 1, 2: 1, 33: 2, 41: 1, 14: 9, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	25963-47-7	C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)O	{30: 1, 21: 1, 14: 8, 29: 2}
Did not match all atoms present	25967-29-7	C1CC1CN2C(=O)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4F	{33: 1, 2: 1, 35: 1, 11: 3, 12: 1, 14: 7, 15: 1, 16: 1, 17: 1, 25: 1}
Did not match all atoms present	2597-03-7	CCOC(=O)C(C1=CC=CC=C1)SP(=S)(OC)OC	{1: 3, 2: 1, 3: 1, 40: 1, 14: 5, 22: 2, 28: 1}
Did not match all atoms present	2597-09-3	CCN(CC)CCOC(=O)C(CC=C)(CC=C)C1=CC=CC=C1	{1: 2, 2: 6, 4: 1, 5: 2, 6: 2, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	2597-93-5	CC[Hg]N1C(=O)C2C(C1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{1: 1, 2: 1, 33: 1, 12: 2, 13: 3, 15: 2, 17: 6, 25: 2}
Did not match all atoms present	2597-95-7	C[Hg]SCC(CO)O	{40: 1, 1: 1, 2: 2, 3: 1, 20: 2}
Did not match all atoms present	25979-07-1	CC(C)(C)P(Cl)Cl	{1: 3, 4: 1, 17: 2}
Did not match all atoms present	2598-25-6	C1=CC(=CC=C1CCNN)Cl.OS(=O)(=O)O	{2: 2, 14: 4, 17: 1, 20: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	2598-29-0	CC(=O)OC1=CC=CC2=C1N=CC=C2	{1: 1, 35: 1, 28: 1, 14: 6}
Did not match all atoms present	2598-31-4	CC(=O)C1=C2C=CC=NC2=C(C=C1)O	{24: 1, 1: 1, 35: 1, 21: 1, 14: 5}
Did not match all atoms present	2598-70-1	CC1=CC=CC=C1CCN[NH3+].OS(=O)(=O)[O-]	{1: 1, 2: 2, 14: 4, 20: 1, 29: 3, 31: 1}
Did not match all atoms present	2598-71-2	COC1=CC=CC=C1CCN[NH3+].OS(=O)(=O)[O-]	{1: 1, 2: 2, 14: 4, 20: 1, 22: 1, 29: 3, 31: 1}
Did not match all atoms present	2598-72-3	CC1=CC=CC=C1OCCN[NH3+].OS(=O)(=O)[O-]	{1: 1, 2: 2, 14: 4, 20: 1, 22: 1, 29: 3, 31: 1}
Did not match all atoms present	2598-73-4	C1=CC=C(C(=C1)OCCNN)Cl.[O-]S(=O)(=O)[O-]	{2: 2, 14: 4, 17: 1, 22: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	2598-74-5	CC1=CC=C(C=C1)CCN(C(=S)N)N	{1: 1, 2: 2, 33: 1, 7: 1, 14: 4, 30: 2}
Did not match all atoms present	2598-75-6	C1=CC=C(C(=C1)CCN(C(=S)N)N)Cl	{33: 1, 2: 2, 7: 1, 14: 4, 17: 1, 30: 2}
Did not match all atoms present	2598-76-7	CC(CC1=CC=CC=C1)NNCCC2=CC=CC=C2	{1: 1, 2: 3, 3: 1, 14: 10, 31: 2}
Did not match all atoms present	25981-82-2	CC1=CC2=C(C=C1)N=C(C2(C)C)C	{1: 4, 35: 1, 13: 1, 14: 3, 15: 1}
Did not match all atoms present	25981-83-3	CC1=NC2=C(C1(C)C)C=C(C=C2)Cl	{1: 3, 35: 1, 13: 1, 14: 3, 15: 1, 17: 1}
Did not match all atoms present	259818-28-5	CCC1=CC(=CC=C1)CC[Si](Cl)(Cl)Cl	{1: 1, 2: 3, 14: 4, 17: 3}
Did not match all atoms present	25982-89-2	CC1=CC=C(C=C1)S(=O)(=O)[O-].C=CCN1C(N(C2=NC3=C(C=CC(=C3)Cl)[NH+]=C21)CC=C)/C=C/C=C\4/N(C5=NC6=C(C=C(C=C6)Cl)N=C5N4CC=C)CC=C	{32: 1, 1: 1, 2: 4, 35: 3, 5: 4, 6: 7, 33: 4, 12: 1, 14: 10, 15: 1, 17: 2, 29: 3}
Did not match all atoms present	25983-11-3	CC1N(C2=NC3=C(C=C(C=C3)Cl)N=C2N1C4=CC=CC=C4)C5=CC=CC=C5.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 2, 35: 2, 33: 2, 12: 1, 14: 17, 17: 1, 29: 3}
Did not match all atoms present	25983-12-4	CC1[NH+](C2=NC3=C(C=C(C=C3)Cl)N=C2N1C(=C)C)C(=C)C.CC1=CC=C(C=C1)S(=O)(=O)O	{1: 4, 35: 2, 5: 2, 7: 2, 12: 1, 14: 7, 17: 1, 20: 1, 33: 1, 29: 2}
Did not match all atoms present	25985-57-3	C(CS(=O)(=O)O)SC(=N)N	{2: 2, 36: 1, 7: 1, 40: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	25985-63-1	CC(=CC1=[N+](C2=CC=CC=C2S1)CCCCS(=O)(=O)[O-])C=C3N(C4=CC=CC=C4S3)CCCCS(=O)(=O)O	{1: 1, 2: 8, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	25986-44-1	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])S(=O)(=O)C)NC(=O)C	{1: 4, 2: 2, 38: 1, 33: 1, 34: 2, 14: 5, 18: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	2599-11-3	CCNC1=NC(=O)N=C(N1)NCC	{32: 1, 1: 2, 2: 2, 35: 2, 25: 1, 31: 2}
Did not match all atoms present	25991-27-9	COC(=O)C1=CC=COC1=O	{1: 1, 28: 2, 14: 3}
Did not match all atoms present	25991-93-9	COC(=S)SSC(Cl)(Cl)Cl	{1: 1, 4: 1, 7: 1, 40: 2, 17: 3, 22: 1}
Did not match all atoms present	25999-04-6	C1COCCN1S(=O)(=O)N	{33: 1, 11: 4, 29: 2, 30: 1, 23: 1}
Did not match all atoms present	260-94-6	C1=CC=C2C(=C1)C=C3C=CC=CC3=N2	{35: 1, 14: 9}
Did not match all atoms present	26002-80-2	CC(=CC1C(C1(C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C	{1: 4, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 22: 1, 28: 1}
Did not match all atoms present	2601-98-1	CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 28}
Did not match all atoms present	26011-40-5	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=C(C=C34)O)OC	{1: 2, 9: 1, 10: 1, 11: 6, 12: 3, 13: 2, 14: 2, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	26011-50-7	CC1=CC(=C(C=C1OC)CC(C)N)OC	{1: 4, 2: 1, 3: 1, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	26011-83-6	CC(=CC(=O)[O-])C1=C(C=C(C=C1)OC)OC.CC(=CC(=O)[O-])C1=C(C=C(C=C1)OC)OC.[Mg+2]	{1: 6, 6: 2, 7: 2, 14: 6, 22: 4, 24: 2}
Did not match all atoms present	26016-98-8	C[C@H]1[C@H](O1)P(=O)([O-])[O-].[Ca+2]	{1: 1, 12: 2, 29: 3, 23: 1}
Did not match all atoms present	26016-99-9	C[C@H]1[C@H](O1)P(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 12: 2, 29: 3, 23: 1}
Did not match all atoms present	26019-17-0	CN(C)CC1=CC=CS1	{1: 2, 2: 1, 41: 1, 14: 3, 33: 1}
Did not match all atoms present	2602-42-8	[C](=O)Cl	{17: 1, 29: 1}
Did not match all atoms present	2602-46-2	C1=CC(=CC=C1C2=CC=C(C=C2)N/N=C\3/C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/5\C(=CC6=CC(=CC(=C6C5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 14, 15: 4, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	26021-21-6	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)NCCO	{1: 2, 2: 2, 38: 2, 34: 2, 14: 4, 18: 1, 20: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	26021-56-7	C1COCCN1.C1=CC=C(C=C1)C(=O)O	{27: 1, 32: 1, 11: 4, 14: 5, 23: 1}
Did not match all atoms present	2603-10-3	COC(=O)NC1=CC=CC=C1	{1: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	26033-20-5	C1=CC=C(C=C1)C2=C(C=NN2)C=O	{32: 1, 26: 1, 35: 1, 14: 6}
Did not match all atoms present	26037-39-8	OS(=O)OS(=O)[O-]	{20: 1, 29: 3, 22: 1}
Did not match all atoms present	26037-72-9	CC1=CC=C(C=C1)[Hg]I	{1: 1, 19: 1, 14: 4}
Did not match all atoms present	26039-39-4	O1[GeH2]O[GeH2]1	{23: 2}
Did not match all atoms present	26039-40-7	O1[GeH2]O[GeH2]O[GeH2]1	{23: 3}
Did not match all atoms present	2604-45-7	CC1=CC(=C(C(=C1C)C(=O)O)C)C	{1: 4, 27: 1, 14: 1}
Did not match all atoms present	26040-51-7	CCCCC(CC)COC(=O)C1=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 28: 2, 18: 4}
Did not match all atoms present	26042-63-7	F[P-](F)(F)(F)(F)F.[Ag+]	{16: 6}
Did not match all atoms present	26045-95-4	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[N-]=O.[Fe+4].[Co+2]	{29: 1}
Did not match all atoms present	26049-68-3	C1=C(OC(=C1)[N+](=O)[O-])C2=CSC(=N2)NN	{35: 1, 38: 1, 41: 1, 14: 3, 23: 1, 30: 1, 31: 1}
Did not match all atoms present	26049-69-4	CN(C)NC1=NC(=CS1)C2=CC=C(O2)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 33: 1, 41: 1, 14: 3, 23: 1, 31: 1}
Did not match all atoms present	26049-70-7	C1=CC(=CC=C1C2=CSC(=N2)NN)[N+](=O)[O-]	{35: 1, 38: 1, 41: 1, 14: 5, 30: 1, 31: 1}
Did not match all atoms present	26049-71-8	C1=CC(=CC=C1C2=CSC(=N2)NN)N	{41: 1, 35: 1, 30: 2, 14: 5, 31: 1}
Did not match all atoms present	26049-94-5	C1=CC=C(C=C1)C[C@@H](C(=O)CCl)NC(=O)OCC2=CC=CC=C2	{2: 3, 3: 1, 14: 10, 17: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	2605-18-7	CC(C1=CC=CC=C1)C2=CC=C(C=C2)OC	{1: 2, 3: 1, 22: 1, 14: 9}
Did not match all atoms present	2605-44-9	CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 20}
Did not match all atoms present	2605-67-6	COC(=O)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 28: 1, 14: 15, 6: 1}
Did not match all atoms present	2606-85-1	CC1=CC2=C(C=C1)C=CC3=C2C4=CC=CC=C4C=C3	{1: 1, 14: 11}
Did not match all atoms present	2606-87-3	CC1=C2C=CC3=C(C2=CC4=CC=CC=C14)C=CC(=C3)F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	26061-35-8	CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C4[N-]3)C5=NC(=CC6=NC(=C2)C(=C6C)C=C)C(C5CCC(=O)[O-])C)C(=O)[O-])[O-])C)C.[Na+].[Na+].[Cu+2]	{1: 5, 2: 3, 35: 4, 5: 1, 6: 1, 12: 3, 14: 3, 15: 12, 24: 2}
Did not match all atoms present	26062-78-2	C=CC1=CC=CC=C1.C1=CC=C(C=C1)O	{14: 10, 5: 1, 6: 1, 21: 1}
Did not match all atoms present	26076-87-9	CC(CC1=CC=C(C=C1)CC(C)N)N.Cl.Cl	{1: 2, 2: 2, 3: 2, 14: 4, 17: 2, 30: 2}
Did not match all atoms present	26077-31-6	CCCCC(CC)C(=O)[O-].[Ag+]	{24: 1, 1: 2, 2: 4, 3: 1}
Did not match all atoms present	26078-23-9	CC1=CC(=O)NC2=C1C=CC(=C2)N(C)C	{32: 1, 1: 3, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	26078-24-0	CC1=CC(=O)OC2=CC(=C(C=C12)C)NC	{1: 3, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	26078-25-1	CCNC1=C(C=C2C(=CC(=O)OC2=C1)C)C	{1: 3, 2: 1, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	26079-06-1	CN(C)[Si](C)Cl	{1: 3, 33: 1, 17: 1}
Did not match all atoms present	2608-11-9	C1CCCNCC1.C1CCCN(CC1)C(=S)S	{32: 1, 33: 1, 11: 12, 39: 1, 7: 1}
Did not match all atoms present	26087-47-8	CC(C)OP(=O)(OC(C)C)SCC1=CC=CC=C1	{1: 4, 2: 1, 3: 2, 40: 1, 14: 5, 22: 2, 29: 1}
Did not match all atoms present	26087-98-9	CN1CCCN(CC1)C(=S)SSC(=S)N2CCCN(CC2)C	{40: 2, 1: 2, 11: 10, 33: 4, 7: 2}
Did not match all atoms present	2609-88-3	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=C(C=C(C=C4)S(=O)(=O)O)S(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 14: 9, 20: 1, 23: 1, 29: 5}
Did not match all atoms present	2609-99-6	C1=CC2=C(C(=NNC3=C(C=CC(=C3)S(=O)(=O)[O-])O)C(=O)C=C2C=C1NC(=O)NC4=CC5=C(C=C4)C(=O)C(=NNC6=C(C=CC(=C6)S(=O)(=O)[O-])O)C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 14, 15: 4, 21: 2, 24: 1, 25: 2, 29: 12, 31: 4}
Did not match all atoms present	26093-31-2	CC1=CC(=O)OC2=C1C=CC(=C2)N	{1: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	26095-59-0	CCCCCCCCOC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)OCC[N+](C)(CC)CC.[Br-]	{1: 4, 2: 11, 14: 8, 18: 1, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	26097-80-3	CC(C)OC(=O)NC1=CC2=C(C=C1)N=C(N2)C3=CSC=N3	{32: 1, 1: 2, 3: 1, 41: 1, 14: 5, 35: 2, 28: 1, 31: 1}
Did not match all atoms present	261-31-4	C1C2=CC=CC=C2SC3=CC=CC=C31	{41: 1, 11: 1, 14: 8}
Did not match all atoms present	261-42-7	C1C2=CC=CC=C2[Te]C3=CC=CC=C31	{11: 1, 14: 8}
Did not match all atoms present	2610-05-1	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C=CC4=C(C3=O)C(=C(C=C4S(=O)(=O)[O-])S(=O)(=O)[O-])N)OC)N/N=C/5\C=CC6=C(C5=O)C(=C(C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 12, 15: 2, 22: 2, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	2610-11-9	C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 17, 15: 2, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	2610-86-8	CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[K+]	{1: 1, 2: 1, 3: 1, 14: 9, 24: 1, 28: 1}
Did not match all atoms present	26103-32-2	C1=CC=C2C(=C1)NC3=C(C=C(C=C3O2)[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 38: 2, 14: 6, 23: 1}
Did not match all atoms present	26105-63-5	CC[Te][Te]CC	{1: 2, 2: 2}
Did not match all atoms present	26107-80-2	COC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{16: 6, 1: 1, 4: 2, 14: 3, 28: 1}
Did not match all atoms present	26107-82-4	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)NN	{4: 2, 14: 3, 16: 6, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	2611-61-2	CS(=O)(=O)C1=CC=C(C=C1)[C@H]([C@@H](COC(=O)CN)NC(=O)C(Cl)Cl)O.Cl	{1: 1, 2: 2, 3: 3, 14: 4, 17: 3, 20: 1, 24: 1, 28: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	2611-82-7	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C\3/C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 14: 10, 15: 1, 25: 1, 29: 9, 31: 1}
Did not match all atoms present	26110-32-7	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)CC(=O)C(C)(C)C)C(C)(C)CC	{1: 9, 2: 6, 4: 3, 14: 6, 17: 1, 22: 1, 24: 3, 31: 2}
Did not match all atoms present	26115-70-8	CO[Si](CCCN1C(=O)N(C(=O)N(C1=O)CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC)(OC)OC	{1: 9, 2: 9, 33: 3, 22: 9, 25: 3}
Did not match all atoms present	261165-02-0	CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1Br)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	261165-03-1	C[C@@H](C(=O)O)N(C1=C(C=CC(=C1)Br)OC)C(=O)OC(C)(C)C	{1: 5, 3: 1, 4: 1, 33: 1, 14: 3, 18: 1, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	261165-04-2	CC(C)(C)OC(=O)N[C@@H](C/C=C/C1=CC=CC=C1)C(=O)O.C1CCC(CC1)NC2CCCCC2	{1: 3, 2: 1, 3: 1, 4: 1, 6: 2, 11: 10, 12: 2, 14: 5, 27: 1, 28: 1, 31: 2}
Did not match all atoms present	261165-06-4	CC(C)(C)OC(=O)N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	26117-61-3	F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.F[PH+](F)F.[Cr]	{16: 18}
Did not match all atoms present	26118-67-2	CC(C)NS(=O)(=O)Cl	{31: 1, 1: 2, 3: 1, 29: 2, 17: 1}
Did not match all atoms present	2612-02-4	COC1=CC(=C(C=C1)O)C(=O)O	{1: 1, 22: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	2612-33-1	C(C(CCl)O[N+](=O)[O-])O[N+](=O)[O-]	{17: 1, 2: 2, 3: 1, 22: 2}
Did not match all atoms present	2612-57-9	C1=CC(=C(C=C1Cl)Cl)N=C=O	{8: 1, 17: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	26123-91-1	CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCOCC2.Cl[Zn-](Cl)Cl	{1: 2, 2: 2, 33: 1, 11: 4, 34: 1, 14: 2, 17: 3, 22: 2, 23: 1}
Did not match all atoms present	26124-86-7	B(=O)[O-].B(=O)[O-].O.[Ba+2]	{29: 4}
Did not match all atoms present	26129-32-8	CC(C(=O)O)OC1=CC=C(C=C1)OC2=CC=C(C=C2)Cl	{1: 1, 3: 1, 14: 8, 17: 1, 22: 2, 27: 1}
Did not match all atoms present	2613-23-2	C1=CC(=C(C=C1O)Cl)F	{16: 1, 17: 1, 21: 1, 14: 3}
Did not match all atoms present	2613-76-5	CC1CC(C2=CC=CC=C12)(C)C	{1: 3, 11: 1, 12: 1, 13: 1, 14: 4}
Did not match all atoms present	2613-89-0	C1=CC=C(C=C1)C(C(=O)O)C(=O)O	{27: 2, 3: 1, 14: 5}
Did not match all atoms present	26134-62-3	[Li+].[Li+].[Li+].[NH2-]	{}
Did not match all atoms present	261360-76-3	CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1Br)C(=O)[O-]	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 18: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	261360-77-4	CC(C)(C)OC(=O)N[C@H](CC1=CC(=CC=C1)Br)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	261380-16-9	CC(C)(C)OC(=O)N[C@H](CC1=CC=C(S1)Br)C(=O)[O-]	{1: 3, 2: 1, 3: 1, 4: 1, 41: 1, 14: 2, 18: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	261380-18-1	CC(C)(C)OC(=O)N[C@H](CC1=CC=CO1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 3, 23: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	261380-20-5	CC(C)(C)OC(=O)N[C@H](CC(=O)O)C1=CC=C(C=C1)Br	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	26148-68-5	C1=CC=C2C(=C1)C3=C(N2)N=C(C=C3)N	{32: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	26149-08-6	C1=C[Se]C(=C1)C(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 3}
Did not match all atoms present	2615-05-6	COC1=CC=CC=C1N=NC2=CC(=C(C=C2)N)OC	{1: 2, 30: 1, 34: 2, 22: 2, 14: 7}
Did not match all atoms present	2615-09-0	CC(=O)C1=CC=C(C=C1)SC2=CC=C(C=C2)C(=O)C	{24: 2, 1: 2, 14: 8, 40: 1}
Did not match all atoms present	26154-63-2	CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC=CC=C3C2=CC=C3	{1: 1, 2: 2, 22: 1, 14: 11, 29: 2}
Did not match all atoms present	26155-31-7	CC1=C(SC=C1)/C=C/C2=NCCCN2C.C(C(C(=O)O)O)(C(=O)O)O	{1: 2, 3: 2, 6: 2, 33: 1, 41: 1, 11: 3, 14: 2, 15: 1, 35: 1, 20: 2, 27: 2}
Did not match all atoms present	26157-96-0	C1(=C(C(=O)C(=C(C1=O)Cl)N=[N+]=[N-])Cl)N=[N+]=[N-]	{17: 2, 34: 4, 25: 2, 15: 4}
Did not match all atoms present	26159-34-2	C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)[O-].[Na+]	{24: 1, 1: 2, 3: 1, 22: 1, 14: 6}
Did not match all atoms present	26159-35-3	C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OC	{1: 3, 3: 1, 28: 1, 22: 1, 14: 6}
Did not match all atoms present	26160-82-7	C1=CC=C(C=C1)C2=CC3=C(C=C2)C4=NC5=C6C=C(C=CC6=C(N5)N=C7C8=C(C=CC(=C8)C9=CC=CC=C9)C(=N7)N=C1C2=C(C=CC(=C2)C2=CC=CC=C2)C(=N1)N=C3N4)C1=CC=CC=C1	{32: 2, 35: 6, 14: 32}
Did not match all atoms present	26162-66-3	CC1=CC(=C(C=C1OC(=O)C)C(C)C)OCC[NH+](C)C.C(C(=O)O)C(CO)(C(=O)O)C(=O)[O-]	{1: 6, 2: 4, 3: 1, 4: 1, 14: 2, 20: 1, 22: 1, 24: 1, 27: 2, 28: 1}
Did not match all atoms present	26164-26-1	CO[C@@H](C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	2617-47-2	C(O)P(=O)(O)O	{2: 1, 20: 3, 29: 1}
Did not match all atoms present	26171-23-3	CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)O	{1: 2, 2: 1, 33: 1, 14: 6, 24: 1, 27: 1}
Did not match all atoms present	26172-55-4	CN1C(=O)C=C(S1)Cl	{1: 1, 33: 1, 41: 1, 14: 1, 17: 1, 25: 1}
Did not match all atoms present	261734-99-0	C1=COC(=C1)/C(=N\O)/N	{34: 1, 7: 1, 14: 3, 20: 1, 23: 1, 30: 1}
Did not match all atoms present	26175-68-8	CN(C)S(=O)(=O)C1=C(C=C(C(=C1)Cl)N)Cl	{1: 2, 33: 1, 14: 2, 17: 2, 29: 2, 30: 1}
Did not match all atoms present	261763-02-4	C1=C(C=C(C(=C1Cl)F)C=O)C(F)(F)F	{16: 4, 17: 1, 26: 1, 4: 1, 14: 2}
Did not match all atoms present	26177-81-1	C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC(=C(C=C3)C(=O)O)C(=O)O)OC4=CC(=C(C=C4)C(=O)O)C(=O)O	{27: 4, 22: 2, 14: 14}
Did not match all atoms present	26177-82-2	C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC4=C(C=C3)C(=O)OC4=O)OC5=CC6=C(C=C5)C(=O)OC6=O	{28: 4, 22: 2, 14: 14}
Did not match all atoms present	2618-77-1	CC(C)(CCC(C)(C)OOC(=O)C1=CC=CC=C1)OOC(=O)C2=CC=CC=C2	{1: 4, 2: 2, 4: 2, 14: 10, 22: 2, 28: 2}
Did not match all atoms present	2618-96-4	C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=CC=C2	{29: 4, 14: 10, 31: 1}
Did not match all atoms present	26183-44-8	CCCCCCCCCCCCOCCOS(=O)(=O)O	{1: 1, 2: 13, 20: 1, 29: 2, 22: 2}
Did not match all atoms present	26189-88-8	CC(=O)OCCN(CCOC(=O)C)C1=CC=CC(=C1)N	{1: 2, 2: 4, 33: 1, 14: 4, 28: 2, 30: 1}
Did not match all atoms present	2619-97-8	C(CCl)[NH+](CCCl)CC(=O)O.[Cl-]	{17: 3, 2: 5, 27: 1}
Did not match all atoms present	26190-82-9	CC1=C2C=CC(=NC2=CC=C1)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	26196-45-2	C1=C(C(=CC(=C1[N+](=O)[O-])N)Cl)N	{17: 1, 38: 1, 30: 2, 14: 2}
Did not match all atoms present	262-12-4	C1=CC=C2C(=C1)OC3=CC=CC=C3O2	{14: 8, 23: 2}
Did not match all atoms present	262-20-4	C1=CC=C2C(=C1)OC3=CC=CC=C3S2	{41: 1, 14: 8, 23: 1}
Did not match all atoms present	262-22-6	C1=CC=C2C(=C1)OC3=CC=CC=C3[Se]2	{14: 8, 23: 1}
Did not match all atoms present	262-24-8	C1=CC=C2C(=C1)OC3=CC=CC=C3[Te]2	{14: 8, 23: 1}
Did not match all atoms present	262-30-6	C1=CC=C2C(=C1)[Se]C3=CC=CC=C3[Se]2	{14: 8}
Did not match all atoms present	262-89-5	C1=CC=C2C=CC3=CC=CC=C3C=CC2=C1	{14: 12}
Did not match all atoms present	2620-44-2	C1OC2=C(O1)C=C(C=C2)[N+](=O)[O-]	{11: 1, 38: 1, 14: 3, 23: 2}
Did not match all atoms present	2620-50-0	C1OC2=C(O1)C=C(C=C2)CN	{2: 1, 11: 1, 30: 1, 14: 3, 23: 2}
Did not match all atoms present	2620-62-4	CN(C)C1=NC=NC2=C1N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{1: 2, 2: 1, 35: 3, 33: 2, 12: 4, 14: 2, 20: 3, 23: 1}
Did not match all atoms present	26205-36-7	C[Si](C)(C)C1C2=CC=CC=C2C=C1[Si](C)(C)C	{1: 6, 12: 1, 14: 5, 15: 1}
Did not match all atoms present	26206-78-0	C1CCC(CC1)NC2=CC3=C(C=C2)C4(C5=C(O3)C=C(C=C5)Cl)C6=CC=CC=C6C(=O)O4	{11: 5, 12: 1, 13: 1, 14: 10, 17: 1, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	2621-01-4	CC(C#N)[Si](Cl)(Cl)Cl	{1: 1, 3: 1, 37: 1, 17: 3}
Did not match all atoms present	2621-46-7	CC(C)C1=CC=C(C=C1)Cl	{1: 2, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	2621-62-7	CC(=O)NC1=C(C=CC(=C1)Cl)Cl	{24: 1, 1: 1, 31: 1, 14: 3, 17: 2}
Did not match all atoms present	2621-78-5	CCOC(=O)NCC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	2621-79-6	CCOC(=O)N(C)C1=CC=CC=C1	{1: 2, 2: 1, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	2621-80-9	CCOC(=O)NC1=CC=C(C=C1)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	26212-81-7	C[N+]1(CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)C.[I-]	{1: 2, 2: 3, 4: 1, 33: 2, 41: 1, 11: 4, 14: 7, 16: 3, 19: 1}
Did not match all atoms present	26214-93-7	[Cd+2].[O-].[O-].[O-].[O-]	{}
Did not match all atoms present	26215-07-6	CCN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C	{1: 2, 2: 3, 37: 1, 38: 1, 33: 1, 34: 2, 14: 7, 29: 2}
Did not match all atoms present	26218-12-2	C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)NN	{14: 3, 20: 1, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	26219-22-7	CCOC(=O)CN1CCN(CC1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC.Cl	{1: 4, 2: 2, 6: 2, 33: 2, 11: 4, 14: 2, 17: 1, 22: 3, 24: 1, 28: 1}
Did not match all atoms present	2622-07-3	CCN(CC)P(=O)(N(CC)CC)N(CC)CC	{1: 6, 2: 6, 29: 1, 33: 3}
Did not match all atoms present	2622-08-4	CC1=CC=CC=C1OP(OC2=CC=CC=C2C)OC3=CC=CC=C3C	{1: 3, 22: 3, 14: 12}
Did not match all atoms present	2622-14-2	C1CCC(CC1)P(C2CCCCC2)C3CCCCC3	{11: 15, 12: 3}
Did not match all atoms present	2622-26-6	C1CN(CCC1O)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C#N	{33: 2, 2: 3, 37: 1, 41: 1, 11: 4, 12: 1, 14: 7, 20: 1}
Did not match all atoms present	2622-30-2	CCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)CCO	{1: 1, 2: 6, 33: 3, 41: 1, 11: 4, 14: 7, 20: 1, 24: 1}
Did not match all atoms present	2622-37-9	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F)CN(C)C	{1: 3, 2: 2, 3: 1, 4: 1, 33: 2, 41: 1, 14: 7, 16: 3}
Did not match all atoms present	2622-60-8	C1=CC=C(C=C1)N2C=NC3=CC=CC=C32	{33: 1, 35: 1, 14: 10}
Did not match all atoms present	2622-67-5	C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2C4=CC=CC=C4	{33: 1, 35: 1, 14: 14}
Did not match all atoms present	2622-83-5	CCC(C)C1=CC(=C(C=C1)O)C(C)C2=CC=CC=C2	{1: 3, 2: 1, 3: 2, 21: 1, 14: 8}
Did not match all atoms present	2622-89-1	B(C1=CC=CC=C1)(C2=CC=CC=C2)O	{20: 1, 14: 10}
Did not match all atoms present	26223-16-5	C1=C[Se]N=N1	{35: 2, 14: 2}
Did not match all atoms present	26225-59-2	CN(C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=C(C=C3)OC)OC)OC	{1: 5, 2: 2, 6: 2, 33: 1, 14: 6, 22: 4, 23: 1, 24: 1}
Did not match all atoms present	26225-79-6	CCOC1C(C2=C(O1)C=CC(=C2)OS(=O)(=O)C)(C)C	{1: 4, 2: 1, 12: 1, 13: 1, 14: 3, 22: 2, 23: 1, 29: 2}
Did not match all atoms present	26226-72-2	CCOC(=O)C1=CC=C(C=C1)NC(=O)CCl	{1: 1, 2: 2, 14: 4, 17: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	26227-73-6	CCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC	{1: 2, 34: 1, 6: 1, 2: 3, 14: 8, 22: 1}
Did not match all atoms present	2623-33-8	CC(=O)NC1=CC=C(C=C1)OC(=O)C	{24: 1, 1: 2, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	2623-45-2	CC1=CC(=C(C=C1)C(=O)CCl)C	{24: 1, 1: 2, 2: 1, 14: 3, 17: 1}
Did not match all atoms present	2623-50-9	CC1=C2C=CC=NC2=C(C=C1)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	26239-45-2	CC(=O)OCCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=CC(=C(C=C2OC)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)OC)NS(=O)(=O)C	{1: 5, 2: 4, 38: 1, 33: 1, 34: 4, 14: 8, 17: 1, 22: 2, 28: 2, 29: 2, 31: 1}
Did not match all atoms present	2624-17-1	C1(=O)NC(=O)[N-]C(=O)N1.[Na+]	{32: 2, 25: 3, 35: 1}
Did not match all atoms present	2624-31-9	CCCCCCCCCCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 14}
Did not match all atoms present	2624-43-3	CC(=O)OC1=CC=C(C=C1)C(=C2CCCCC2)C3=CC=C(C=C3)OC(=O)C	{1: 2, 7: 1, 11: 5, 14: 8, 15: 1, 28: 2}
Did not match all atoms present	2624-44-4	CCNCC.C1=CC(=C(C=C1O)S(=O)(=O)O)O	{1: 2, 2: 2, 14: 3, 20: 1, 21: 2, 29: 2, 31: 1}
Did not match all atoms present	26241-10-1	N(=O)N(O)S(=O)(=O)O.[K+]	{33: 1, 34: 1, 20: 2, 29: 3}
Did not match all atoms present	26257-13-6	C(C(=O)[O-])O.C(C(=O)[O-])O.[Ca+2]	{24: 2, 2: 2, 20: 2}
Did not match all atoms present	26259-45-0	CCC(C)NC1=NC(=NC(=N1)NCC)OC	{1: 4, 2: 2, 3: 1, 35: 3, 22: 1, 31: 2}
Did not match all atoms present	2626-34-8	CC1=CC2=N[Se]N=C2C=C1C	{1: 2, 35: 2, 14: 2}
Did not match all atoms present	2626-52-0	CCN(CC)CCCN=C=S	{8: 1, 1: 2, 2: 5, 34: 1, 33: 1}
Did not match all atoms present	26260-02-6	C1=CC=C(C(=C1)C=O)I	{26: 1, 19: 1, 14: 4}
Did not match all atoms present	26261-57-4	CC1=C/C(=C(/C2=CC=C(C=C2)N)\C3=CC(=C(C=C3)N)C)/C=CC1=N.Cl	{1: 2, 36: 1, 7: 1, 14: 10, 15: 3, 17: 1, 30: 2}
Did not match all atoms present	2627-06-7	CCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 9, 29: 3, 14: 4}
Did not match all atoms present	2627-27-2	C1=CC=C(C=C1)CCCN=C=S	{8: 1, 2: 3, 34: 1, 14: 5}
Did not match all atoms present	2627-69-2	C1=NC(=C(N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)N)C(=O)N	{33: 1, 2: 1, 35: 1, 12: 4, 14: 1, 20: 3, 23: 1, 24: 1, 30: 2}
Did not match all atoms present	2627-86-3	C[C@@H](C1=CC=CC=C1)N	{1: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	2627-95-4	C[Si](C)(C=C)O[Si](C)(C)C=C	{1: 4, 22: 1, 5: 2, 6: 2}
Did not match all atoms present	2627-97-6	C[Si](C=C)(C1=CC=CC=C1)O[Si](C)(C=C)C2=CC=CC=C2	{1: 2, 14: 10, 22: 1, 5: 2, 6: 2}
Did not match all atoms present	26270-58-6	C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC(=C(C=C3)Cl)Cl)OC)OC.C(=C\C(=O)[O-])\C(=O)O	{1: 4, 2: 2, 6: 4, 14: 5, 17: 2, 22: 3, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	26270-59-7	C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)C=CC3=CC=C(C=C3)OC)OC)OC.C(=CC(=O)[O-])C(=O)O	{1: 5, 2: 2, 6: 4, 14: 6, 22: 4, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	26270-60-0	C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=C(C=C3)F)OC)OC.C(=C\C(=O)[O-])\C(=O)O	{1: 4, 2: 2, 6: 4, 14: 6, 16: 1, 22: 3, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	26270-61-1	COC1=C(C(=C(C2=C1C=CO2)OC)OCC[NH+]3CCCC3)C(=O)/C=C/C4=CC=CC=C4.C(=C\C(=O)[O-])\C(=O)O	{1: 2, 2: 2, 6: 4, 11: 4, 14: 7, 22: 3, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	26270-62-2	CC[NH+](CC)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=CC=C3)OC)OC.C(=C\C(=O)[O-])\C(=O)O	{1: 4, 2: 4, 6: 4, 14: 7, 22: 3, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	26271-85-2	O[Se](=O)O.O[Se](=O)O.[Rb+]	{20: 4, 29: 2}
Did not match all atoms present	26271-97-6	CCCCCCCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]	{1: 1, 2: 22, 20: 2, 14: 5, 17: 1}
Did not match all atoms present	2628-16-2	CC(=O)OC1=CC=C(C=C1)C=C	{1: 1, 14: 4, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	2628-17-3	C=CC1=CC=C(C=C1)O	{14: 4, 5: 1, 6: 1, 21: 1}
Did not match all atoms present	2629-54-1	C1=CC(=CC(=C1)F)CC(C(=O)O)N	{2: 1, 3: 1, 14: 4, 16: 1, 27: 1, 30: 1}
Did not match all atoms present	2629-55-2	C1=CC=C(C(=C1)CC(C(=O)O)N)F	{2: 1, 3: 1, 14: 4, 16: 1, 27: 1, 30: 1}
Did not match all atoms present	2629-72-3	C1=CN=CC=C1CCCO	{2: 3, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	26290-70-0	CCCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 3, 29: 3, 22: 1}
Did not match all atoms present	26303-54-8	CCCCCCCCCC[O-].CCCCCCCCCC[O-].CCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 27, 29: 3}
Did not match all atoms present	26305-13-5	CC1=C(NC(=O)NC1=O)C	{32: 2, 1: 2, 25: 2}
Did not match all atoms present	26305-75-9	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Co]	{17: 1, 14: 45}
Did not match all atoms present	26307-30-2	CC1=C(C1=O)C2=CC=CC=C2	{1: 1, 14: 5, 25: 1}
Did not match all atoms present	26308-28-1	CCN1C2=C(C(=N1)C)NC(=O)CN=C2C3=CC=CC=C3	{32: 1, 1: 2, 2: 1, 35: 2, 33: 1, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	26309-95-5	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)OCOC(=O)C(C)(C)C)C.Cl	{1: 5, 2: 1, 3: 1, 4: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 17: 1, 24: 1, 25: 1, 28: 2, 30: 1, 31: 1}
Did not match all atoms present	2631-37-0	CC1=CC(=CC(=C1)OC(=O)NC)C(C)C	{1: 4, 3: 1, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	2631-40-5	CC(C)C1=CC=CC=C1OC(=O)NC	{1: 3, 3: 1, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	2631-68-7	C1(=C(C(=C(C(=C1Cl)[N+](=O)[O-])Cl)[N+](=O)[O-])Cl)[N+](=O)[O-]	{17: 3, 38: 3}
Did not match all atoms present	2631-77-8	C1=C(C=C(C(=C1I)O)C=O)I	{26: 1, 19: 2, 21: 1, 14: 2}
Did not match all atoms present	26311-09-1	CC(=O)NC1=C(C=CC(=C1)N)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 34: 2, 38: 1, 14: 7, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	26311-44-4	CCCCCC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 4, 28: 1, 14: 4}
Did not match all atoms present	26311-45-5	CCCCCC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 4, 27: 1, 14: 4}
Did not match all atoms present	26316-43-8	C=CC1=CC=CC=C1.C1=CC=C(C=C1)N2C(=O)C=CC2=O	{25: 2, 14: 12, 5: 1, 6: 1, 33: 1}
Did not match all atoms present	2632-13-5	COC1=CC=C(C=C1)C(=O)CBr	{1: 1, 2: 1, 14: 4, 18: 1, 22: 1, 24: 1}
Did not match all atoms present	26322-14-5	CCCCCCCCCCCCCCCCOC(=O)OOC(=O)OCCCCCCCCCCCCCCCC	{1: 2, 2: 30}
Did not match all atoms present	26328-04-1	COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCN(CC2)CC(=O)N3CCCC3.C(=C\C(=O)O)\C(=O)O	{1: 3, 2: 1, 6: 4, 33: 3, 11: 8, 14: 2, 22: 3, 24: 2, 27: 2}
Did not match all atoms present	26328-53-0	C1=CC(=CC=C1NC2=CC=C(C=C2)[N+](=O)[O-])N=C=S	{8: 1, 34: 1, 38: 1, 14: 8, 31: 1}
Did not match all atoms present	2633-03-6	C1=CC=NC(=C1)N=NC2=CC=CC=N2	{34: 2, 35: 2, 14: 8}
Did not match all atoms present	2633-06-9	C1=CC=C(C=C1)C=CC2=CN=CC=C2	{35: 1, 14: 9, 6: 2}
Did not match all atoms present	2633-54-7	CCOP(=S)(OC)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 1, 22: 3, 14: 2, 17: 3}
Did not match all atoms present	2633-57-0	C=CC[Si](CC=C)(CC=C)C1=CC=CC=C1	{2: 3, 14: 5, 5: 3, 6: 3}
Did not match all atoms present	2633-66-1	CC1=CC(=[C-]C(=C1)C)C.[Mg+2].[Br-]	{1: 3, 18: 1, 14: 2}
Did not match all atoms present	26330-06-3	CCCCCN=[N+]=[N-]	{1: 1, 2: 4, 34: 2}
Did not match all atoms present	26339-42-4	C1=CC=C(C=C1)CN2C3C(C(=O)OC3=O)N(C2=O)CC4=CC=CC=C4	{33: 2, 2: 2, 12: 2, 14: 10, 25: 1, 28: 2}
Did not match all atoms present	2634-33-5	C1=CC=C2C(=C1)C(=O)NS2	{32: 1, 25: 1, 14: 4, 41: 1}
Did not match all atoms present	26342-61-0	P#[Cr]	{}
Did not match all atoms present	26348-47-0	C1=CC=C(C=C1)C=C(C(=O)O)NC(=O)C2=CC=CC=C2	{6: 1, 7: 1, 14: 10, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	2635-13-4	C1OC2=C(O1)C=C(C=C2)Br	{18: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	2635-26-9	CCCCCCCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCCCCCCC)[O-]	{1: 2, 2: 12, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	26350-26-5	CP(=O)(CCl)Cl	{1: 1, 2: 1, 29: 1, 17: 2}
Did not match all atoms present	2636-16-0	CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 40}
Did not match all atoms present	2636-26-2	COP(=S)(OC)OC1=CC=C(C=C1)C#N	{1: 2, 22: 3, 14: 4, 37: 1}
Did not match all atoms present	2636-88-6	C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C(=S)=S	{8: 1, 11: 15, 12: 3}
Did not match all atoms present	26367-75-9	C1=CC(=CC=C1C(=O)C(CO)NC(=O)C(Cl)Cl)[N+](=O)[O-]	{2: 1, 3: 2, 38: 1, 14: 4, 17: 2, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	2637-34-5	C1=CC(=S)NC=C1	{32: 1, 14: 4}
Did not match all atoms present	2637-37-8	C1=CC=C2C(=C1)C=CC(=S)N2	{32: 1, 14: 6}
Did not match all atoms present	26372-59-8	CCC(C)CCC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5}
Did not match all atoms present	26375-43-9	C1=COC(=C1)C=CC(=O)C=CC2=CC=CO2	{24: 1, 14: 6, 6: 4, 23: 2}
Did not match all atoms present	26377-29-7	COP(=S)(OC)[S-].[Na+]	{1: 2, 22: 2}
Did not match all atoms present	26377-33-3	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCOC)CCOC	{1: 4, 2: 4, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	26381-41-9	C[N+](C)(C)C1=CC\2=C(C=C1)C=CC(=O)/C2=N/NC3=CC=C(C=C3)N.[Cl-]	{1: 3, 34: 1, 14: 9, 15: 1, 17: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	26385-07-9	C1=CC=C(C=C1)C(=O)NCCCl	{24: 1, 17: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	26386-88-9	C1=CC=C(C=C1)OP(=O)(N=[N+]=[N-])OC2=CC=CC=C2	{34: 2, 22: 2, 14: 10, 29: 1}
Did not match all atoms present	26387-47-3	C1CNP(=S)(NC1)OC2=CC=CC=C2	{32: 2, 11: 3, 22: 1, 14: 5}
Did not match all atoms present	26387-48-4	C1CCN(P(NC1)OC2=CC=CC=C2)S	{32: 1, 33: 1, 39: 1, 11: 4, 14: 5, 22: 1}
Did not match all atoms present	26387-49-5	C1CNP(=S)(N1)OC2=CC=CC=C2	{32: 2, 11: 2, 22: 1, 14: 5}
Did not match all atoms present	26388-47-6	CC1=C(C=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@H]([C@@H](CO5)O)O)O)O)O)O	{1: 1, 2: 1, 11: 1, 12: 9, 14: 5, 20: 6, 21: 1, 22: 2, 23: 2, 25: 2}
Did not match all atoms present	26393-20-4	C[Si]12C[Si]3(C[Si](C1)(C4[Si]5(C[Si]6(C[Si](C5)(C3[Si]4(C2)C6)C)C)C)C)C	{1: 6, 11: 8, 12: 2}
Did not match all atoms present	26399-36-0	CCCN(CC1CC1)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]	{1: 1, 2: 3, 4: 1, 38: 2, 33: 1, 11: 2, 12: 1, 14: 2, 16: 3}
Did not match all atoms present	264-09-5	C1C=CC=CC2=CC=CC=C21	{11: 1, 14: 8}
Did not match all atoms present	26400-24-8	C1CN2C=CC(=C2[C@H]1O)CO	{33: 1, 2: 1, 11: 2, 12: 1, 14: 2, 20: 2}
Did not match all atoms present	26401-97-8	CCCCCCCC[Sn](CCCCCCCC)(SCC(=O)OC(C)CCCCCC)SCC(=O)OC(C)CCCCCC	{40: 2, 1: 6, 2: 26, 3: 2, 28: 2}
Did not match all atoms present	26408-28-6	CC(=O)NC1=CC(=C(C=C1)OC)NCCC#N	{1: 2, 2: 2, 37: 1, 14: 3, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	26408-93-5	C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)N	{30: 1, 22: 1, 14: 9, 29: 2}
Did not match all atoms present	2641-01-2	CCCN(CCC)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)O	{1: 2, 2: 4, 33: 1, 34: 2, 14: 8, 27: 1}
Did not match all atoms present	2641-56-7	CCCCCCCC(=O)O[Sn](CC)(CC)OC(=O)CCCCCCC	{1: 4, 2: 14, 28: 2}
Did not match all atoms present	26412-87-3	C1=CC=NC=C1.O=S(=O)=O	{35: 1, 29: 3, 14: 5}
Did not match all atoms present	26413-18-3	C1CS(=O)(=O)CS(=O)(=O)C1	{11: 4, 29: 4}
Did not match all atoms present	26413-19-4	C1CS(=O)(=O)CS1(=O)=O	{11: 3, 29: 4}
Did not match all atoms present	2642-37-7	C1=CC=C2C(=C1)C(=CN2)OS(=O)(=O)[O-].[K+]	{32: 1, 22: 1, 14: 5, 29: 3}
Did not match all atoms present	2642-50-4	COC1=CC2=C(C=C1)N=C3C4=CC=CC=C4N=C5N3C2=NC6=CC=CC=C65	{1: 1, 35: 3, 22: 1, 14: 11, 33: 1}
Did not match all atoms present	2642-63-9	CC(=O)C1=CC(=C(C=C1)Cl)Cl	{24: 1, 1: 1, 14: 3, 17: 2}
Did not match all atoms present	2642-71-9	CCOP(=S)(OCC)SCN1C(=O)C2=CC=CC=C2N=N1	{1: 2, 2: 3, 35: 2, 33: 1, 40: 1, 14: 4, 22: 2, 25: 1}
Did not match all atoms present	2642-80-0	C1=CC(=CC=C1C(CCl)C2=CC=C(C=C2)Cl)Cl	{17: 3, 2: 1, 3: 1, 14: 8}
Did not match all atoms present	2642-81-1	C=C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl	{17: 2, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	2642-82-2	C1=CC(=CC=C1C(CO)C2=CC=C(C=C2)Cl)Cl	{17: 2, 2: 1, 3: 1, 20: 1, 14: 8}
Did not match all atoms present	2642-98-0	C1=CC=C2C(=C1)C=CC3=C2C=C(C4=CC=CC=C34)N	{30: 1, 14: 11}
Did not match all atoms present	26422-71-9	C1=CC=C(C=C1)S(=O)(=O)C2=C3C(=CC(=C2)O)[N+](=O)C4=C([N+]3=O)C=C(C=C4)Cl	{17: 1, 33: 2, 21: 1, 14: 10, 29: 4}
Did not match all atoms present	26429-16-3	CCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 3, 28: 1}
Did not match all atoms present	2643-07-4	CCN(CCCl)C1=CC=C(C=C1)C=O	{1: 1, 2: 3, 33: 1, 14: 4, 17: 1, 26: 1}
Did not match all atoms present	26438-26-6	CCCCCCCCCc1cccc2ccccc12	{1: 1, 2: 8, 14: 7}
Did not match all atoms present	26438-27-7	CCCCCCCCCCc1cccc2ccccc12	{1: 1, 2: 9, 14: 7}
Did not match all atoms present	2644-45-3	CCCCCCCCCC[N+](C)(C)CC(=O)[O-]	{24: 1, 1: 3, 2: 10}
Did not match all atoms present	2644-64-6	CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC	{1: 5, 2: 32, 3: 1, 22: 2, 28: 2, 29: 2}
Did not match all atoms present	26444-18-8	CC1=CC=CC=C1C(=C)C	{1: 2, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	26444-49-5	CC1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 1, 22: 3, 14: 14, 29: 1}
Did not match all atoms present	26447-24-5	C1CC(C2=CC=CC=C2C1)OO	{20: 1, 11: 3, 12: 1, 22: 1, 14: 4}
Did not match all atoms present	26447-67-6	CCCCCC(=O)C1=CC=CS1	{24: 1, 1: 1, 2: 4, 14: 3, 41: 1}
Did not match all atoms present	2645-07-0	C1=CC(=CC=C1C(=O)NCC(=O)O)[N+](=O)[O-]	{2: 1, 38: 1, 14: 4, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	2645-08-1	CCOC(=O)[C@H](CCCN=C(N)N)NC(=O)C1=CC=CC=C1.Cl	{1: 1, 2: 4, 3: 1, 7: 1, 34: 1, 14: 5, 17: 1, 24: 1, 28: 1, 30: 2, 31: 1}
Did not match all atoms present	2645-22-9	C1=CN=CC=C1SSC2=CC=NC=C2	{40: 2, 35: 2, 14: 8}
Did not match all atoms present	2645-36-5	C1CCN(CC1)C(=O)NC2=CC=CC=C2	{24: 1, 33: 1, 11: 5, 14: 5, 31: 1}
Did not match all atoms present	26450-38-4	[O-].[O-].[OH-].[O].[V+]	{}
Did not match all atoms present	26459-95-0	CC1=C(C=CC(=C1)N(CCCl)CCCl)C=O	{1: 1, 2: 4, 33: 1, 14: 3, 17: 2, 26: 1}
Did not match all atoms present	2646-15-3	CCCCCNC1=C2C(=C(C=C1)NCCCCC)C(=O)C3=CC=CC=C3C2=O	{1: 2, 2: 8, 31: 2, 14: 6, 25: 2}
Did not match all atoms present	2646-17-5	CC1=CC=CC=C1NN=C2C(=O)C=CC3=CC=CC=C32	{1: 1, 34: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	2646-38-0	C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.[Na]	{1: 3, 2: 2, 3: 1, 11: 8, 12: 7, 13: 2, 20: 2, 27: 1}
Did not match all atoms present	2646-90-4	C1=CC(=C(C=C1F)C=O)F	{16: 2, 26: 1, 14: 3}
Did not match all atoms present	2646-91-5	C1=CC(=C(C(=C1)F)F)C=O	{16: 2, 26: 1, 14: 3}
Did not match all atoms present	26465-81-6	CC1(CC(=O)C2=CC=CC=C21)C	{1: 2, 11: 1, 13: 1, 14: 4, 25: 1}
Did not match all atoms present	26473-60-9	COC(=C)CC1=CC=CC=C1	{1: 1, 2: 1, 5: 1, 7: 1, 14: 5, 22: 1}
Did not match all atoms present	26475-18-3	CC1=C(C(=C(C(=C1F)F)C2=C(C(=C(C(=C2F)F)C)F)F)F)F	{16: 8, 1: 2}
Did not match all atoms present	26479-97-0	CCN(CCOC(=O)CCCCC(=O)OCCN(CC)C1=CC=CC(=C1)C)C2=CC=CC(=C2)C	{1: 4, 2: 10, 28: 2, 14: 8, 33: 2}
Did not match all atoms present	2648-61-5	C1=CC=C(C=C1)C(=O)C(Cl)Cl	{24: 1, 17: 2, 3: 1, 14: 5}
Did not match all atoms present	26482-54-2	C1=CC=NC(=C1)N[N+](=O)[O-]	{35: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	26482-65-5	CC(C)(CO[N+](=O)[O-])CO[N+](=O)[O-]	{1: 2, 2: 2, 4: 1, 22: 2}
Did not match all atoms present	26486-93-1	C1=CC=C2C(=C1)C(NC2=O)O	{32: 1, 20: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	26488-34-6	CC(=O)N(C1=CC=C(C=C1)/C=C/C2=CC=CC=C2)OC(=O)C	{1: 2, 6: 2, 33: 1, 14: 9, 24: 1, 28: 1}
Did not match all atoms present	26488-89-1	C1=CC=C2C(=C1)C=CC=C2COS(=O)(=O)[O-].[Na+]	{2: 1, 22: 1, 14: 7, 29: 3}
Did not match all atoms present	26488-93-7	CC(=O)NC1=C(C=CC(=C1)Cl)O	{1: 1, 14: 3, 17: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	2649-11-8	CCCCCCCCCCCCOS(=O)(=O)OCCCCCCCCCCCC	{1: 2, 2: 22, 29: 2, 22: 2}
Did not match all atoms present	26490-07-3	CC(C)CC1=CC2=CC=CC=C2C=C1	{1: 2, 2: 1, 3: 1, 14: 7}
Did not match all atoms present	26493-63-0	C(C[N-]CC[NH-])[NH-].N=[N+]=[N-].N=[N+]=[N-].N=[N+]=[N-].[Co]	{2: 4, 36: 5, 34: 4}
Did not match all atoms present	2650-18-2	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5S(=O)(=O)[O-].[NH4+].[NH4+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 20, 15: 2, 29: 9}
Did not match all atoms present	2650-50-2	CCC[N+](C)(C)C.[Br-]	{1: 4, 2: 2, 18: 1}
Did not match all atoms present	2650-51-3	CCCC[N+](C)(C)C.[Br-]	{1: 4, 2: 3, 18: 1}
Did not match all atoms present	2650-64-8	C1=CC=C(C=C1)COC(=O)N[C@@H](CCC(=O)N)C(=O)O	{2: 3, 3: 1, 14: 5, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	2650-77-3	CC[N+](C)(C)C.[Br-]	{1: 4, 2: 1, 18: 1}
Did not match all atoms present	26505-12-4	C1=CC(=CC=C1NN)S(=O)(=O)CCO	{2: 2, 14: 4, 20: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	26509-45-5	COC1=C(C=C(C=C1)CC(CO)O)OC	{1: 2, 2: 2, 3: 1, 14: 3, 20: 2, 22: 2}
Did not match all atoms present	2651-46-9	C1=CC=C(C=C1)OCCCCCl	{17: 1, 2: 4, 22: 1, 14: 5}
Did not match all atoms present	2651-85-6	CCOP(CC)OCC	{1: 3, 2: 3, 22: 2}
Did not match all atoms present	2651-89-0	CCOP(=[Se])(OCC)OCC	{1: 3, 2: 3, 22: 3}
Did not match all atoms present	26513-20-2	CCN(CC)C1=CC=CC(=C1)N	{1: 2, 2: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	26516-62-1	C1=CC(=CC=C1N=S=O)Br	{40: 1, 18: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	2652-13-3	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 20, 22: 8}
Did not match all atoms present	2652-77-9	C1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3	{25: 2, 11: 1, 14: 10, 33: 2}
Did not match all atoms present	26529-13-5	C1CCC(=[N+](C2=CC=CC=C2)C3=CC=CC=C3)C1.[O-]Cl(=O)(=O)=O	{33: 1, 11: 4, 14: 10, 15: 1, 17: 1, 29: 4}
Did not match all atoms present	26529-14-6	C1CC(=CNC2=CC=CC=C2)C(=[N+](C3=CC=CC=C3)C4=CC=CC=C4)C1=CNC5=CC=CC=C5.[O-]Cl(=O)(=O)=O	{33: 1, 6: 2, 11: 2, 14: 20, 15: 3, 17: 1, 29: 4, 31: 2}
Did not match all atoms present	26535-46-6	CCCCCCCCCCCC(=O)NCC(C)OS(=O)(=O)[O-].[Na+]	{1: 2, 2: 11, 3: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	26536-60-7	CCCNC(=S)NCCC	{1: 2, 2: 4, 31: 2, 7: 1}
Did not match all atoms present	26537-19-9	CC(C)(C)C1=CC=C(C=C1)C(=O)OC	{1: 4, 4: 1, 14: 4, 28: 1}
Did not match all atoms present	26538-44-3	CC1CCCC(CCCCCC2=CC(=CC(=C2C(=O)O1)O)O)O	{1: 1, 11: 8, 12: 2, 14: 2, 20: 1, 21: 2, 28: 1}
Did not match all atoms present	2654-52-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=[N+](C2=CC=CC=C2S1)C	{1: 3, 41: 1, 29: 3, 14: 8, 33: 1}
Did not match all atoms present	2654-57-1	CC1CN(NC1=O)C2=CC=CC=C2	{32: 1, 1: 1, 33: 1, 11: 1, 12: 1, 14: 5, 25: 1}
Did not match all atoms present	2654-58-2	CC1(CN(NC1=O)C2=CC=CC=C2)C	{32: 1, 1: 2, 33: 1, 11: 1, 13: 1, 14: 5, 25: 1}
Did not match all atoms present	2654-66-2	CC1=CC=CC=[N+]1CC2=CC=CC=C2.[Br-]	{1: 1, 2: 1, 18: 1, 14: 9, 33: 1}
Did not match all atoms present	26541-56-0	CC(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2)OC(=O)C	{24: 1, 1: 2, 28: 1, 14: 9, 33: 1}
Did not match all atoms present	26541-57-1	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C=C2)OC(=O)C	{24: 1, 1: 2, 28: 1, 14: 9, 33: 1}
Did not match all atoms present	26544-22-9	CC(C)CCCCCOP(OCCCCCC(C)C)OC1=CC=CC=C1	{1: 4, 2: 10, 3: 2, 22: 3, 14: 5}
Did not match all atoms present	26544-23-0	CC(C)CCCCCCCOP(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 2, 2: 7, 3: 1, 22: 3, 14: 10}
Did not match all atoms present	26544-27-4	CCCCCCCCC(C)OP1COC2(CO1)COP(OC2)OC(C)CCCCCCCC	{1: 4, 2: 14, 3: 2, 11: 4, 13: 1, 22: 2, 23: 4}
Did not match all atoms present	26545-62-0	C1=CC=C2C(=C1)C3=C4C(=C2O)C=CC5=C6C=CC7=C(C8=CC=CC=C8C9=C7C6=C(C(=C54)C=C3)C(=O)C9=O)O	{25: 2, 21: 2, 14: 14}
Did not match all atoms present	26546-68-9	CCN(CC)P(CC)N(CC)CC	{1: 5, 2: 5, 33: 2}
Did not match all atoms present	26547-31-9	C1=CN=C(N=C1)SC2=CC=C(C=C2)Cl	{40: 1, 17: 1, 35: 2, 14: 7}
Did not match all atoms present	26547-51-3	C1=CC=C(C=C1)CCCCCCCC(=O)O	{2: 7, 27: 1, 14: 5}
Did not match all atoms present	26547-93-3	CC(C)CS(=O)C	{1: 3, 2: 1, 3: 1, 29: 1}
Did not match all atoms present	2655-14-3	CC1=CC(=CC(=C1)OC(=O)NC)C	{1: 3, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	2655-19-8	CC(C)(C)C1=CC(=CC(=C1)OC(=O)NC)C(C)(C)C	{1: 7, 31: 1, 4: 2, 14: 3, 28: 1}
Did not match all atoms present	2655-27-8	CCCCCNC1=CC=CC=C1	{1: 1, 2: 4, 14: 5, 31: 1}
Did not match all atoms present	2655-46-1	CC(=O)N1C(=O)CCN1C2=CC=CC=C2	{1: 1, 33: 2, 11: 2, 14: 5, 24: 1, 25: 1}
Did not match all atoms present	2655-48-3	CC1CN(N(C1=O)C(=O)C)C2=CC=CC=C2	{1: 2, 33: 2, 11: 1, 12: 1, 14: 5, 24: 1, 25: 1}
Did not match all atoms present	2655-83-6	CCOC1=CC(=CC=C1)Cl	{1: 1, 2: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	2655-84-7	CCOC1=CC(=CC=C1)Br	{1: 1, 2: 1, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	2655-95-0	CCCCCCCCCCC1=CC=C(C=C1)CCCCCCCCCC	{1: 2, 2: 18, 14: 4}
Did not match all atoms present	2655-96-1	CCCCCCCCCCCCCCCCC1=CC2=C(CCCC2)C=C1	{1: 1, 2: 15, 11: 4, 14: 3}
Did not match all atoms present	26552-50-1	COC1=CC=CC=C1C(=O)N(CC(C[Hg+])O)C(=O)O.[OH-]	{1: 1, 2: 2, 3: 1, 33: 1, 14: 4, 20: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	26557-90-4	CC1=NC(=NN1)Br	{32: 1, 1: 1, 18: 1, 35: 2}
Did not match all atoms present	2656-02-2	CCCCCC(CCCCC)CCCCCC1=CC2=C(CCCC2)C=C1	{11: 4, 1: 2, 2: 13, 3: 1, 14: 3}
Did not match all atoms present	26562-01-6	CC(C)CC[Sn](CCC(C)C)(CCC(C)C)CCC(C)C	{1: 8, 2: 8, 3: 4}
Did not match all atoms present	26562-65-2	CC1C=CC(=O)[Se]1	{1: 1, 12: 1, 14: 2, 25: 1}
Did not match all atoms present	265646-48-8	C(C[O-])N(CC[O-])CC(=O)[O-].[OH-].[Zr+4]	{24: 1, 33: 1, 2: 5, 29: 2}
Did not match all atoms present	26567-23-7	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)Cl	{1: 2, 2: 2, 33: 1, 13: 1, 14: 10, 17: 1, 23: 1, 28: 1}
Did not match all atoms present	2657-43-4	CCCCCCCCCCCCCCCCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 15, 14: 7}
Did not match all atoms present	2657-50-3	CCCCCCCCCCC(CCCCC)C1=CC2=C(CCCC2)C=C1	{11: 4, 1: 2, 2: 13, 3: 1, 14: 3}
Did not match all atoms present	2657-85-4	C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N)N	{24: 1, 30: 2, 14: 8, 31: 1}
Did not match all atoms present	2657-87-6	C1=CC(=CC(=C1)OC2=CC=C(C=C2)N)N	{30: 2, 22: 1, 14: 8}
Did not match all atoms present	26570-10-5	CCC(=O)O[C@](CC1=CC=CC=C1)(C2=CC=CC=C2)[C@H](C)CN(C)C.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O.O	{1: 4, 2: 3, 3: 1, 4: 1, 33: 1, 14: 17, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	26571-11-9	CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOCCOCCOCCOCCOCCO	{1: 1, 2: 26, 20: 1, 22: 9, 14: 4}
Did not match all atoms present	26574-59-4	C1=CC(=CC=C1S(=O)(=O)C(C(F)Cl)(F)F)Cl	{3: 1, 4: 1, 14: 4, 16: 3, 17: 2, 29: 2}
Did not match all atoms present	26576-46-5	CC(=O)CC(=O)NC1=CC2=C(C=C1)NC(=O)N2	{32: 2, 1: 1, 2: 1, 14: 3, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	26581-81-7	C1CC(=O)NC(=O)C1N2CC3=CC=CC=C3C2=O	{32: 1, 33: 1, 11: 3, 12: 1, 14: 4, 25: 3}
Did not match all atoms present	26583-60-8	CC1=CC=CC=C1OCCN	{1: 1, 2: 2, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	26585-57-9	CC1=CC(=C(C=C1S(=O)(=O)O)N)S(=O)(=O)O	{1: 1, 30: 1, 20: 2, 29: 4, 14: 2}
Did not match all atoms present	26586-55-0	CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C	{24: 1, 1: 2, 11: 4, 14: 4, 33: 2}
Did not match all atoms present	26586-83-4	[Na].Br[Sn](Br)Br	{18: 3}
Did not match all atoms present	26594-44-5	CC(=O)N(C1=CC=C(C=C1)C=CC2=CC=CC=C2)OC(=O)C	{1: 2, 6: 2, 33: 1, 14: 9, 24: 1, 28: 1}
Did not match all atoms present	26595-27-7	CC(C)(C(=O)OC1=CC=CC=C1)C(=O)OC2=CC=CC=C2	{1: 2, 4: 1, 14: 10, 28: 2}
Did not match all atoms present	26603-20-3	C1=CC2=CC3=C4NC(=C3C=C2C=C1)NC5=C6C=C7C=CC=CC7=CC6=C([N-]5)NC8=C9C=C1C=CC=CC1=CC9=C(N8)NC1=C2C=C3C=CC=CC3=CC2=C(N4)[N-]1.[Co+2]	{32: 6, 35: 2, 14: 24}
Did not match all atoms present	26608-06-0	C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)Br	{18: 1, 14: 7, 23: 1}
Did not match all atoms present	26608-34-4	CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)C)C(=C4C)CC)C(=C3C)CC)C	{32: 2, 1: 8, 2: 4, 35: 2, 14: 4}
Did not match all atoms present	26608-69-5	CC(C)(C)C=C([Si](C)(C)C)[Si](C)(C)C	{1: 9, 4: 1, 6: 1, 7: 1}
Did not match all atoms present	26615-21-4	CN(C)CCOC1=CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl	{1: 2, 2: 2, 33: 1, 41: 1, 14: 8, 15: 1, 17: 1, 22: 1}
Did not match all atoms present	26620-08-6	CCOC1=C(C=CC=C1C)C	{1: 3, 2: 1, 22: 1, 14: 3}
Did not match all atoms present	26621-44-3	C1=C(NN=C1)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 2}
Did not match all atoms present	26628-22-8	[N-]=[N+]=[N-].[Na+]	{34: 1}
Did not match all atoms present	26628-47-7	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC6=CC=CC=C65	{1: 2, 2: 2, 33: 1, 13: 1, 14: 13, 23: 1, 28: 1}
Did not match all atoms present	26629-87-8	CC(C)N1CCOC(C1)C2=CC(=CC=C2)C(F)(F)F	{1: 2, 3: 1, 4: 1, 33: 1, 11: 3, 12: 1, 14: 4, 16: 3, 23: 1}
Did not match all atoms present	26636-01-1	CC(C)CCCCCOC(=O)CS[Sn](C)(C)SCC(=O)OCCCCCC(C)C	{40: 2, 1: 6, 2: 12, 3: 2, 28: 2}
Did not match all atoms present	26638-43-7	COC(=O)C1=CC=CC=C1S(=O)(=O)Cl	{1: 1, 28: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	2664-32-6	CC(C)C1=CC=C(C=C1)OC(=O)C	{1: 3, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	2664-60-0	CCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)O	{1: 1, 2: 11, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	2664-63-3	C1=CC(=CC=C1O)SC2=CC=C(C=C2)O	{40: 1, 21: 2, 14: 8}
Did not match all atoms present	26640-60-8	CC(C)NC(C)CC1=CC=CC=C1.Cl	{1: 3, 2: 1, 3: 2, 14: 5, 17: 1, 31: 1}
Did not match all atoms present	26644-96-2	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)NN=C3C=CC(=O)C4=C3C=CC=N4	{34: 1, 35: 1, 14: 11, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	26645-10-3	C[CH2-].C[CH2-].Br[Au]	{1: 2, 18: 1, 5: 2}
Did not match all atoms present	2665-12-5	B(OC1=CC=CC=C1C)(OC2=CC=CC=C2C)OC3=CC=CC=C3C	{1: 3, 22: 3, 14: 12}
Did not match all atoms present	2665-30-7	CP(=S)(OC1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 38: 1, 22: 2, 14: 9}
Did not match all atoms present	26651-23-0	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)S(=O)(=O)O	{20: 1, 29: 2, 14: 9}
Did not match all atoms present	26651-25-2	CCCCNS(=O)(=O)C1=CC(=C(C=C1)OC)[N+]#N	{1: 2, 2: 3, 34: 1, 14: 3, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	26654-97-7	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(F)(F)S(=O)(=O)F)(F)F)F)(F)F)F.C(=C(F)F)(F)F	{16: 18, 4: 5, 29: 2, 22: 2, 7: 4}
Did not match all atoms present	2666-14-0	CC(O)(P(=O)(O)[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+]	{1: 1, 4: 1, 29: 5, 20: 2}
Did not match all atoms present	2666-17-3	CC(=O)N(C)C1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{1: 2, 33: 1, 14: 9, 20: 1, 24: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	2666-53-7	C1=C(C=C(C(=C1Br)[O-])Br)Br.[Na+]	{18: 3, 14: 2}
Did not match all atoms present	26660-76-4	C[N+](C)(CCCCCCCCCC[N+](C)(C)C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5.[I-].[I-]	{1: 4, 2: 10, 11: 12, 12: 6, 13: 2, 19: 2}
Did not match all atoms present	26670-16-6	C(CC1=NNN=N1)C2=NNN=N2	{32: 2, 2: 2, 35: 6}
Did not match all atoms present	26672-24-2	COC1=CC(=C(C=C1N)OC)S(=O)(=O)CCOS(=O)(=O)O	{1: 2, 2: 2, 14: 2, 20: 1, 22: 3, 29: 4, 30: 1}
Did not match all atoms present	26677-12-3	CCC1=C2C=C3C(=C(C(=N3)C(=C4[C@H]([C@@H](C(=N4)C=C5C(=C(C(=CC(=C1C=O)N2)N5)C=C)C)C)CCC(=O)O)CC(=O)O)C(=O)O)C	{32: 2, 1: 4, 2: 4, 35: 2, 5: 1, 6: 1, 12: 2, 14: 3, 26: 1, 27: 3}
Did not match all atoms present	2668-24-8	COC1=CC(=C(C(=C1O)Cl)Cl)Cl	{1: 1, 22: 1, 21: 1, 14: 1, 17: 3}
Did not match all atoms present	2668-47-5	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CC=CC=C2	{1: 6, 4: 2, 21: 1, 14: 7}
Did not match all atoms present	2668-92-0	CCOP(=S)(OCC)ON1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O	{1: 2, 2: 2, 33: 1, 14: 6, 22: 3, 25: 2}
Did not match all atoms present	26684-57-1	C1=CN=CC=C1C(CCO)CCO	{35: 1, 2: 4, 3: 1, 20: 2, 14: 4}
Did not match all atoms present	26685-82-5	C1CC[C@H]([C@H](C1)C(=O)O)NC(=O)C2=CC=CC=C2	{11: 4, 12: 2, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	2669-15-0	C1CCC(=O)N(CC1)C(=O)C2=CC=C(C=C2)C(=O)N3CCCCCC3=O	{24: 2, 25: 2, 11: 10, 14: 4, 33: 2}
Did not match all atoms present	2669-32-1	CCOC1=NN(C(=O)S1)CSP(=S)(OC)OC	{1: 3, 2: 2, 35: 1, 33: 1, 40: 1, 41: 1, 22: 3, 25: 1}
Did not match all atoms present	2669-94-5	C1CC(=O)OC2=C1C=C(C=C2)O	{11: 2, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	2669-95-6	CCCCN1CNC(=S)NC1	{32: 2, 1: 1, 2: 3, 33: 1, 11: 2, 15: 1}
Did not match all atoms present	26690-77-7	C1=CC=C(C=C1)C2=CC=CC=C2C3=CC=C(C=C3)C(=O)NO	{24: 1, 20: 1, 14: 13, 31: 1}
Did not match all atoms present	26691-08-7	CC1=C2C(=C(C3=C1C=CN=C3)C)C4=C(N2)C=CC(=C4)OC.CC(C(=O)O)O	{32: 1, 1: 4, 3: 1, 14: 6, 35: 1, 20: 1, 22: 1, 27: 1}
Did not match all atoms present	26692-47-7	CC(=O)OCCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C)Cl	{1: 3, 2: 4, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 28: 2, 29: 2}
Did not match all atoms present	26693-74-3	S[S-]	{39: 1}
Did not match all atoms present	26694-70-2	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OC)C)C.C(=O)(O)[O-]	{1: 5, 2: 2, 14: 8, 23: 1, 27: 1, 28: 1, 31: 2}
Did not match all atoms present	26699-73-0	C1=CC=C(C=C1)C(=O)OC(CO)CO	{28: 1, 2: 2, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	2670-38-4	C1=CC(=C(C=C1C(=O)N)Cl)Cl	{24: 1, 17: 2, 30: 1, 14: 3}
Did not match all atoms present	26705-20-4	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC=C(C=C3)CC4=CC=C(C=C4)NC(=O)C5=CC6=CC=CC=C6C=C5O)O	{24: 2, 2: 1, 21: 2, 14: 20, 31: 2}
Did not match all atoms present	26717-47-5	CC(C)(C(=O)OCCCC(=O)N(C)C)OC1=CC=C(C=C1)Cl	{1: 4, 2: 3, 4: 1, 33: 1, 14: 4, 17: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	2672-57-3	COC(=O)C1=C(C(=CC=C1)C(=O)OC)C(=O)OC	{1: 3, 28: 3, 14: 3}
Did not match all atoms present	2672-58-4	COC(=O)C1=CC(=CC(=C1)C(=O)OC)C(=O)OC	{1: 3, 28: 3, 14: 3}
Did not match all atoms present	2672-77-7	COC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O)OC	{1: 2, 14: 9, 21: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	2672-81-3	COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C4=CC5=CC=CC=C5C=C4O	{1: 1, 14: 12, 21: 1, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	2672-85-7	CCC1(C(=S)NC(=O)N1)C	{32: 2, 1: 2, 2: 1, 13: 1, 15: 1, 25: 1}
Did not match all atoms present	2673-40-7	C/C=C\1/CN[C@H]2CC3=C(C(=O)C[C@@H]1[C@@H]2C(=O)OC)NC4=CC=CC=C34	{32: 2, 1: 2, 6: 1, 11: 3, 12: 3, 14: 4, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	26733-18-6	C1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)Br)N)Br	{24: 1, 18: 2, 30: 1, 14: 7}
Did not match all atoms present	26739-54-8	C1=CC=C(C=C1)C(=O)O.C(=N)(N)N	{27: 1, 36: 1, 30: 2, 14: 5, 7: 1}
Did not match all atoms present	2674-34-2	COC1=CC(=C(C=C1Br)OC)Br	{1: 2, 18: 2, 22: 2, 14: 2}
Did not match all atoms present	2674-91-1	CCS(=O)CC(C)SP(=O)(OC)OC	{1: 4, 2: 2, 3: 1, 40: 1, 22: 2, 29: 2}
Did not match all atoms present	26741-53-7	CC(C)(C)C1=CC(=C(C=C1)OP2OCC3(CO2)COP(OC3)OC4=C(C=C(C=C4)C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 4: 4, 11: 4, 13: 1, 14: 6, 22: 2, 23: 4}
Did not match all atoms present	26747-87-5	[B][B][B][B][B][B][B][B][B][B]CC	{1: 1, 2: 1}
Did not match all atoms present	2675-35-6	C1=CC(=O)C=CC1=C(C2=CC=C(C=C2)O)NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 7: 1, 14: 11, 15: 1, 21: 1, 25: 1, 31: 2}
Did not match all atoms present	2675-77-6	COC1=CC(=C(C=C1Cl)OC)Cl	{1: 2, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	2675-79-8	COC1=CC(=CC(=C1OC)OC)Br	{1: 3, 18: 1, 22: 3, 14: 2}
Did not match all atoms present	26750-66-3	C(=S)([O-])[O-].[K+].[K+]	{7: 1}
Did not match all atoms present	2676-59-7	C1=CC(=C(C=C1OC2=CC(=C(C=C2)N)N)N)N	{30: 4, 22: 1, 14: 6}
Did not match all atoms present	26761-12-6	C1CC2CCC3=CC=CC(=C23)C1	{11: 5, 12: 1, 14: 3}
Did not match all atoms present	26761-40-0	CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C	{1: 4, 2: 14, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	26762-90-3	CCCCCCCCC1=CC=C(C=C1)OP(=O)(O)O	{1: 1, 2: 7, 14: 4, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	26762-93-6	CC(C)(OO)c1cccc(C(C)(C)OO)c1	{1: 4, 4: 2, 22: 2, 14: 4, 20: 2}
Did not match all atoms present	26763-69-9	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C9=C(C8=O)C=CC(=C9)N)C2=O	{25: 2, 30: 1, 14: 15}
Did not match all atoms present	26764-44-3	CC1=CC(=CC(=C1)N)N	{1: 1, 30: 2, 14: 3}
Did not match all atoms present	26766-27-8	C1=CC=C(C=C1)C(C2=C(C=C(C=C2)Cl)Cl)(C3=CN=CN=C3)O	{17: 2, 35: 2, 4: 1, 14: 11, 20: 1}
Did not match all atoms present	26767-00-0	CC(=CC(=O)OC)O[Si](C)(C)C	{1: 5, 28: 1, 22: 1, 6: 1, 7: 1}
Did not match all atoms present	2678-21-9	C1=C(C(=C(C(=C1Cl)Cl)[N+](=O)[O-])Cl)[N+](=O)[O-]	{17: 3, 38: 2, 14: 1}
Did not match all atoms present	2678-41-3	C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ba+2]	{14: 10}
Did not match all atoms present	26781-23-7	C=CC=O.C=O	{26: 1, 5: 2, 6: 1}
Did not match all atoms present	26782-43-4	C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CC[N+]3([C@]2([C@@H](CC3)OC1=O)O)C)(CO)O)C	{1: 3, 2: 1, 6: 1, 11: 5, 12: 2, 13: 2, 14: 1, 15: 2, 20: 3, 28: 2}
Did not match all atoms present	26786-32-3	CN(CCCN1C2=CC=CC=C2CCC3=CC=CC=C31)CC(=O)C4=CC=C(C=C4)Cl.Cl	{1: 1, 2: 4, 33: 2, 11: 2, 14: 12, 17: 2, 24: 1}
Did not match all atoms present	26789-26-4	C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC4=CC=CC=C4C(=NNC5=C(C=CC(=C5)C(=O)NC6=CC(=C(C=C6Cl)Cl)Cl)Cl)C3=O	{34: 1, 14: 17, 15: 2, 17: 4, 24: 2, 25: 1, 31: 3}
Did not match all atoms present	2679-01-8	CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C(=C3S2)[N+](=O)[O-].[Cl-]	{1: 4, 35: 1, 38: 1, 33: 2, 41: 1, 14: 5, 17: 1}
Did not match all atoms present	26791-93-5	COC1=C(C=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC	{1: 3, 38: 1, 28: 1, 22: 2, 14: 2}
Did not match all atoms present	26798-98-1	CN(C)[Si](C)(C)[Si](C)(C)C	{1: 7, 33: 1}
Did not match all atoms present	268-40-6	C1C=CC2=CC3=CC=CC=C3C=C21	{11: 1, 14: 8}
Did not match all atoms present	268-77-9	C1=CC=C2C=C3C(=CC2=C1)C=CS3	{41: 1, 14: 8}
Did not match all atoms present	2680-00-4	[2H]C=C	{5: 2}
Did not match all atoms present	2680-01-5	[2H]C=C([2H])[2H]	{5: 2}
Did not match all atoms present	26807-65-8	CC1CC2=CC=CC=C2N1NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N	{1: 1, 33: 1, 11: 1, 12: 1, 14: 7, 17: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	26818-53-1	CCC(C)NC(=S)C(=S)NC(C)CC	{31: 2, 1: 4, 2: 2, 3: 2, 7: 2}
Did not match all atoms present	2682-45-3	CC1=NC2=C(S1)C=CC3=CC=CC=C32	{1: 1, 35: 1, 14: 6, 41: 1}
Did not match all atoms present	2682-93-1	C1=CC(=CN=C1)/C=C/C2=CC=NC=C2	{35: 2, 14: 8, 6: 2}
Did not match all atoms present	26820-62-2	C1COCCN1C2=NC=C(C=C2)[N+](=O)[O-]	{33: 1, 35: 1, 38: 1, 11: 4, 14: 3, 23: 1}
Did not match all atoms present	2683-43-4	C1=C(C=C(C(=C1Cl)N)[N+](=O)[O-])Cl	{17: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	2683-82-1	CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)CC)C(=C4CC)CC)C(=C3CC)CC)CC	{32: 2, 1: 8, 2: 8, 35: 2, 14: 4}
Did not match all atoms present	2683-90-1	C1=NC(=O)C2=NNNC2=N1	{32: 2, 25: 1, 35: 3, 14: 1}
Did not match all atoms present	26830-95-5	CC1=CC(=C(C=C1)C#N)[N+](=O)[O-]	{1: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	26833-86-3	CC(C)CC[C@@]([C@@H](C(=O)OC)O)(C(=O)O[C@H]1[C@H]2C3=CC4=C(C=C3CCN5[C@@]2(CCC5)C=C1OC)OCO4)O	{1: 4, 2: 2, 3: 2, 4: 1, 33: 1, 11: 6, 12: 2, 13: 1, 14: 3, 15: 1, 20: 2, 22: 1, 23: 2, 28: 2}
Did not match all atoms present	26833-87-4	CC(C)(CCCC(CC(=O)OC)(C(=O)O[C@H]1[C@@H]2C3=CC4=C(C=C3CCN5[C@@]2(CCC5)C=C1OC)OCO4)O)O	{1: 4, 2: 4, 4: 2, 33: 1, 11: 6, 12: 2, 13: 1, 14: 3, 15: 1, 20: 2, 22: 1, 23: 2, 28: 2}
Did not match all atoms present	26834-28-6	CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 16, 29: 3, 14: 5}
Did not match all atoms present	26834-32-2	CC1(C2CCC1(C(C2)C3=CC(=C(C=C3)O)OC)C)C	{1: 4, 11: 3, 12: 2, 13: 2, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	26836-28-2	CCCCC(CC)COP(=O)(OCC(CC)CCCC)OP(=O)(O)O	{1: 4, 2: 10, 3: 2, 20: 2, 22: 3, 29: 2}
Did not match all atoms present	26837-33-2	CCCCCCCCCCCC1=NCC[N+]1(CCO)CC(=O)[O-].[OH-].[Na+]	{1: 1, 2: 13, 35: 1, 11: 2, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	26837-42-3	C=COS(=O)(=O)[O-].[K+]	{22: 1, 5: 1, 6: 1, 29: 3}
Did not match all atoms present	26839-75-8	CC(C)(C)NC[C@@H](COC1=NSN=C1N2CCOCC2)O	{1: 3, 2: 2, 3: 1, 4: 1, 33: 1, 41: 1, 11: 4, 35: 2, 20: 1, 22: 1, 23: 1, 31: 1}
Did not match all atoms present	2684-60-8	CC(=[N+]=[N-])C	{1: 2, 34: 1, 7: 1}
Did not match all atoms present	2684-62-0	CC(=C[N+]#N)[O-]	{1: 1, 34: 1, 6: 1, 7: 1}
Did not match all atoms present	26841-47-4	C1=CC=C(C=C1)C(=O)OCCN(CCOC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)N=NC5=CC=CC=C5	{33: 1, 2: 4, 28: 2, 34: 4, 14: 23}
Did not match all atoms present	26844-49-5	C1CN(CCC1N)CC(=O)C2=CNC3=CC=CC=C32	{32: 1, 33: 1, 2: 1, 11: 4, 12: 1, 14: 5, 24: 1, 30: 1}
Did not match all atoms present	26848-40-8	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC4=C(C=C3)NC(=O)N4)O	{32: 2, 14: 9, 21: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	26858-84-4	CC1=NN(C(=O)C1N=NC2=CC=CC=C2[N+](=O)[O-])C3=C(C=CC(=C3)Cl)Cl	{1: 1, 34: 2, 35: 1, 38: 1, 33: 1, 12: 1, 14: 7, 15: 1, 17: 2, 25: 1}
Did not match all atoms present	2686-70-6	C(CS(=O)O)[C@@H](C(=O)O)N	{2: 2, 3: 1, 20: 1, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	2686-72-8	C1=C(C2=C(C(=C1F)F)NC=N2)F	{16: 3, 32: 1, 35: 1, 14: 2}
Did not match all atoms present	26861-87-0	C1=NN=C(S1)N.Cl	{17: 1, 35: 2, 30: 1, 14: 1, 41: 1}
Did not match all atoms present	26863-15-0	C1=CC=C(C=C1)C2=CC=[N+](C=C2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-].[Cl-]	{17: 1, 38: 2, 14: 12, 33: 1}
Did not match all atoms present	26864-44-8	[H+].C1=CC(=C(C=C1S(=O)(=O)[O-])N/N=C\2/C=CC(=O)C=C2[O-])[O-].[Cu+2]	{34: 1, 14: 6, 15: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	26864-56-2	C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)CCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F	{33: 1, 2: 3, 3: 1, 4: 1, 11: 4, 13: 1, 14: 11, 16: 5, 17: 1, 20: 1}
Did not match all atoms present	26868-19-9	CCO[Si](CN(CC=C)C[Si](OCC)(OCC)OCC)(OCC)OCC	{1: 6, 2: 9, 5: 1, 6: 1, 33: 1, 22: 6}
Did not match all atoms present	26868-32-6	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)Br	{1: 1, 14: 9, 18: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	26869-99-8	C1=CC(=CC=C1C2=CC(=C3C(=C2N)C(=O)C4=C(C3=O)C(=CC(=C4O)S(=O)(=O)O)N)O)O	{14: 6, 20: 1, 21: 3, 25: 2, 29: 2, 30: 2}
Did not match all atoms present	2687-12-9	C1=CC=C(C=C1)/C=C/CCl	{17: 1, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	2687-25-4	CC1=C(C(=CC=C1)N)N	{1: 1, 30: 2, 14: 3}
Did not match all atoms present	2687-45-8	CC[N+](CC)(CC)[O-]	{1: 3, 2: 3, 29: 1}
Did not match all atoms present	26876-25-5	C=CO.C=O	{20: 1, 5: 2, 6: 1}
Did not match all atoms present	2688-48-4	C1C2=C(C=CC(=C2)O)OC1=O	{11: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	2688-77-9	CN1CCC2=CC(=C(C=C2[C@@H]1CC3=CC(=C(C=C3)OC)OC)OC)OC	{1: 5, 2: 1, 33: 1, 11: 2, 12: 1, 14: 5, 22: 4}
Did not match all atoms present	2688-84-8	C1=CC=C(C=C1)OC2=CC=CC=C2N	{30: 1, 22: 1, 14: 9}
Did not match all atoms present	2688-96-2	C1=CC=C(C=C1)C2=CC=CC=C2S	{14: 9, 39: 1}
Did not match all atoms present	26886-05-5	CC(C)C1=CC(=CC(=C1)O)C(C)C	{1: 4, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	26889-86-1	C1=CC=C2C=C(C(=CC2=C1)C(=O)NCCN)O	{2: 2, 14: 6, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	2689-59-0	C1=CC=C(C=C1)C(=O)C2=CC=CO2	{24: 1, 14: 8, 23: 1}
Did not match all atoms present	26893-93-6	C1=CC=C2C(=C1)C3=NC4=NC(=NC5=NC(=NC6=NC(=NC2=N3)C7=CC=CC=C76)C8=CC=CC=C85)C9=CC=CC=C94.[Cu]	{35: 8, 14: 16}
Did not match all atoms present	26894-49-5	CC1=CC(=CC2=C1C3=CC(=CC(=C3C(=O)O2)O)OC)O	{1: 2, 22: 1, 28: 1, 21: 2, 14: 4}
Did not match all atoms present	26896-31-1	CCCC[Sn](CCCC)(CCCC)SCC(=O)OCCCCCC(C)C	{40: 1, 1: 5, 2: 15, 3: 1, 28: 1}
Did not match all atoms present	26898-12-4	CC1=CC=CC=C1SC2=CC=CC=C2C	{40: 1, 1: 2, 14: 8}
Did not match all atoms present	269-12-5	C1=CC2=CC3=NNN=C3C=C2C=C1	{32: 1, 35: 2, 14: 6}
Did not match all atoms present	269-43-2	C1OC2=CC3=CC=CC=C3C=C2O1	{11: 1, 14: 6, 23: 2}
Did not match all atoms present	26903-94-6	CCN(CC)C1=CC=C(C=C1)NN=C2N=CN=N2	{1: 2, 2: 2, 35: 3, 33: 1, 34: 1, 14: 5, 15: 1, 31: 1}
Did not match all atoms present	26907-37-9	C1=NN=C(S1)NCNC2=NN=CS2	{41: 2, 2: 1, 35: 4, 14: 2, 31: 2}
Did not match all atoms present	2691-93-2	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)F	{16: 1, 17: 4, 14: 1}
Did not match all atoms present	26921-17-5	CC(C)(C)NC[C@@H](COC1=NSN=C1N2CCOCC2)O.C(=CC(=O)O)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 6: 2, 33: 1, 41: 1, 11: 4, 35: 2, 20: 1, 22: 1, 23: 1, 27: 2, 31: 1}
Did not match all atoms present	2693-46-1	C1=CC=C2C(=C1)C3=C4C2=CC=CC4=C(C=C3)N	{30: 1, 14: 9}
Did not match all atoms present	2693-66-5	C1(=C(NC(=C(C1=O)F)F)F)F	{16: 4, 25: 1, 32: 1}
Did not match all atoms present	26931-40-8	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)NCC(COC3=CC=CC=C3)O	{1: 2, 2: 2, 3: 1, 38: 2, 34: 2, 14: 9, 18: 1, 20: 1, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	26932-45-6	C([C@H](C(=O)O)N)[Se][Se]C[C@H](C(=O)O)N	{27: 2, 2: 2, 3: 2, 30: 2}
Did not match all atoms present	26939-22-0	CC1CC(N=C(O1)CC2=CC=CC=C2)(C)C	{1: 3, 2: 1, 35: 1, 11: 1, 12: 1, 13: 1, 14: 5, 15: 1, 23: 1}
Did not match all atoms present	2694-54-4	C=CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC=C)C(=O)OCC=C	{2: 3, 14: 3, 28: 3, 5: 3, 6: 3}
Did not match all atoms present	2694-78-2	[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)C2=CC=CC=C2)[2H])[2H]	{24: 1, 14: 10}
Did not match all atoms present	26941-42-4	COC1=CC=C(C=C1)C2=CC(=C3C(=C2N)C(=O)C4=C(C3=O)C(=CC(=C4O)S(=O)(=O)O)N)O	{1: 1, 14: 6, 20: 1, 21: 2, 22: 1, 25: 2, 29: 2, 30: 2}
Did not match all atoms present	26944-48-9	CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2C3CCC(C2O)(C3(C)C)C	{1: 4, 11: 2, 12: 3, 13: 2, 14: 4, 20: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	2695-37-6	C=CC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{14: 4, 5: 1, 6: 1, 29: 3}
Did not match all atoms present	2696-84-6	CCCC1=CC=C(C=C1)N	{1: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	2696-85-7	CCCCC1=CC=CC=C1N	{1: 1, 2: 3, 30: 1, 14: 4}
Did not match all atoms present	26963-33-7	CC(C)CCC1=CC=CS1	{1: 2, 2: 2, 3: 1, 14: 3, 41: 1}
Did not match all atoms present	2697-60-1	C(C[Se]S(=O)(=O)O)N	{2: 2, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	2697-65-6	C(C[Se])N.Cl	{17: 1, 2: 2, 30: 1}
Did not match all atoms present	26970-82-1	O.O.O.O.O.[O-][Se](=O)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	26978-64-3	C(CCS(=O)(=O)O)CO	{2: 4, 20: 2, 29: 2}
Did not match all atoms present	26979-27-1	C1=CC=C2C(=C1)C=CC=C2C3=C4C=CC=CC4=C(C5=CC=CC=C53)C6=CC=CC7=CC=CC=C76	{14: 22}
Did not match all atoms present	2698-11-5	[Li+].CCCC[O-]	{1: 1, 2: 3, 29: 1}
Did not match all atoms present	2698-38-6	CCOC(=O)COC1=C(C=C(C=C1)Cl)C	{1: 2, 2: 2, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	2698-41-1	C1=CC=C(C(=C1)C=C(C#N)C#N)Cl	{17: 1, 37: 2, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	2699-79-8	O=S(=O)(F)F	{16: 2, 29: 2}
Did not match all atoms present	26998-80-1	CC1=C(C(=C(C=C1)O)C)C	{1: 3, 21: 1, 14: 2}
Did not match all atoms present	270-82-6	C1=CC2=CSC=C2C=C1	{41: 1, 14: 6}
Did not match all atoms present	2700-22-3	C1=CC=C(C=C1)C=C(C#N)C#N	{37: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	2700-47-2	CCC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC	{24: 1, 1: 2, 2: 1, 22: 1, 14: 6}
Did not match all atoms present	2700-89-2	CS(=O)(=O)/C(=C\Cl)/Cl	{1: 1, 17: 2, 29: 2, 6: 1, 7: 1}
Did not match all atoms present	27007-85-8	C1CN(CCC12NC(=O)CS2)CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl.Cl	{32: 1, 33: 2, 2: 3, 41: 2, 11: 5, 13: 1, 14: 7, 17: 2, 25: 1}
Did not match all atoms present	27014-49-9	CCCCCCCCCC(CCCCCCCC(=O)O)C1=CC=C(C=C1)C	{27: 1, 1: 2, 2: 15, 3: 1, 14: 4}
Did not match all atoms present	27016-73-5	[Co]#[As]	{}
Did not match all atoms present	27016-75-7	[Ni]#[As]	{}
Did not match all atoms present	27016-91-7	CNC(=O)N1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3	{1: 1, 35: 1, 38: 1, 33: 1, 11: 1, 14: 8, 15: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	27018-50-4	CC1=C2C(=C(C3=CC=CC=C13)CI)C=CC4=CC=CC=C42	{1: 1, 2: 1, 19: 1, 14: 10}
Did not match all atoms present	2702-44-5	CC1=CC2=C(C=C1C)OC(=N2)C=CC3=CC=C(C=C3)C(=O)OC	{1: 3, 35: 1, 6: 2, 14: 6, 23: 1, 28: 1}
Did not match all atoms present	2702-58-1	COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	27025-49-6	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)C(=O)OC4=CC=CC=C4)C(=O)O)C	{1: 2, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 10, 24: 1, 25: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	27028-82-6	CCCCCCCCCCCCOCCN(CCO)CCO.OS(=O)(=O)O	{1: 1, 2: 17, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	27028-83-7	CCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 30, 29: 4, 22: 1}
Did not match all atoms present	2703-13-1	CCOP(=S)(C)OC1=CC=C(C=C1)SC	{40: 1, 1: 3, 2: 1, 22: 2, 14: 4}
Did not match all atoms present	27030-97-3	C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N4C(=O)C=CC4=O	{32: 1, 25: 2, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	27032-01-5	C1=CC=[N+](C=C1)C(=C=[N-])C#N	{8: 1, 33: 1, 37: 1, 14: 5, 7: 1}
Did not match all atoms present	27035-30-9	CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NO	{1: 2, 2: 1, 33: 1, 14: 7, 17: 1, 20: 1, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	27041-04-9	C1=CC=C(C=C1)CCC(CBr)C2=CC=CC=C2	{2: 3, 3: 1, 18: 1, 14: 10}
Did not match all atoms present	27046-19-1	C1COP(=O)(NC1=O)N(CCCl)CCCl	{32: 1, 33: 1, 2: 4, 11: 2, 17: 2, 23: 1, 25: 1, 29: 1}
Did not match all atoms present	27047-62-7	C1CSC2=CC=CC=C2C1NC(=O)NCCCl	{2: 2, 41: 1, 11: 2, 12: 1, 14: 4, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	27050-53-9	C1=C(C=C2C(=C1[N+](=O)[O-])NC3=C(C=C(C=C3S2=O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 38: 4, 29: 1, 14: 4}
Did not match all atoms present	27053-34-5	C1C2=C(C3=C1C(=C(C(=C3F)F)F)F)C(=C(C(=C2F)F)F)F	{16: 8, 11: 1}
Did not match all atoms present	27059-08-1	CC(=O)NC1=CC(=CC=C1)N(CCOC(=O)C)CCOC(=O)C	{1: 3, 2: 4, 33: 1, 14: 4, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	2706-28-7	C1=CC(=CC=C1N=NC2=CC(=C(C=C2)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 34: 2, 29: 6, 14: 7}
Did not match all atoms present	2706-50-5	CC(CC1=CC=CC=C1)N.Cl	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1, 30: 1}
Did not match all atoms present	2706-56-1	C1=CC=NC(=C1)CCN	{2: 2, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	2706-66-3	CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O.CS(=O)(=O)O	{32: 1, 1: 6, 2: 1, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	2706-89-0	C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)[O-].[Na+]	{16: 9, 24: 1, 4: 4}
Did not match all atoms present	2706-91-4	C(C(C(F)(F)F)(F)F)(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F	{16: 11, 20: 1, 4: 5, 29: 2}
Did not match all atoms present	27060-75-9	CC1=C(C=CC(=C1)OC)Br	{1: 2, 18: 1, 22: 1, 14: 3}
Did not match all atoms present	27060-91-9	C1COC2(N1CC(=O)N(C3=C2C=C(C=C3)Cl)CCO)C4=CC=CC=C4F	{33: 2, 2: 2, 11: 3, 13: 1, 14: 7, 16: 1, 17: 1, 20: 1, 23: 1, 25: 1}
Did not match all atoms present	27063-27-0	CC1=CC(=NC2=CC=CC=C12)N	{1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	27064-94-4	C1=CC(=CC=C1C(C2=CC=C(C=C2)F)Cl)F	{16: 2, 17: 1, 3: 1, 14: 8}
Did not match all atoms present	27069-17-6	COC1=CC=C(C=C1)C2=CC=NN2	{32: 1, 1: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	27070-22-0	C1=CC=C(C=C1)C(=O)OCCC(CCCl)Cl	{17: 2, 2: 4, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	27074-03-9	CC1=CC(=O)N(C(=C1C#N)O)C	{1: 2, 37: 1, 33: 1, 14: 1, 21: 1, 25: 1}
Did not match all atoms present	27074-70-0	CCCCCN(CCCCC)CC(C1=CC2=C(CCCC2)C3=CC=CC=C31)O	{1: 2, 2: 9, 3: 1, 33: 1, 11: 4, 14: 5, 20: 1}
Did not match all atoms present	2708-97-6	C1(=C(C(=C(C(=C1F)I)I)F)F)F	{16: 4, 19: 2}
Did not match all atoms present	27081-10-3	[B-](F)(F)(F)F.C1=CC=C[CH+]C=C1	{16: 4, 14: 7}
Did not match all atoms present	27083-55-2	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CCO)CO.C(CO)O	{2: 11, 8: 2, 34: 2, 14: 8, 20: 4, 27: 2, 29: 2}
Did not match all atoms present	2709-56-0	C1CN(CCN1CC/C=C\2/C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO	{33: 2, 2: 4, 4: 1, 6: 1, 41: 1, 11: 4, 14: 7, 15: 1, 16: 3, 20: 1}
Did not match all atoms present	27093-62-5	CN1C2=C(C3=CC=CC=C3C=C2)C4=C1C=CC5=CC=CC=C54	{1: 1, 14: 12, 33: 1}
Did not match all atoms present	27096-31-7	CCN(CC)CC.[N+](=O)(O)[O-]	{1: 3, 2: 3, 20: 1, 33: 1}
Did not match all atoms present	271-44-3	C1=CC=C2C(=C1)C=NN2	{32: 1, 35: 1, 14: 5}
Did not match all atoms present	271-58-9	C1=CC2=CON=C2C=C1	{35: 1, 14: 5, 23: 1}
Did not match all atoms present	271-61-4	C1=CC=C2C(=C1)C=NS2	{41: 1, 35: 1, 14: 5}
Did not match all atoms present	271-63-6	C1=CC2=C(NC=C2)N=C1	{32: 1, 35: 1, 14: 5}
Did not match all atoms present	271-89-6	C1=CC=C2C(=C1)C=CO2	{14: 6, 23: 1}
Did not match all atoms present	271-95-4	C1=CC=C2C(=C1)C=NO2	{35: 1, 14: 5, 23: 1}
Did not match all atoms present	27104-73-0	COC(=O)C1=CC2=CC=CC=C2C=N1	{1: 1, 35: 1, 28: 1, 14: 6}
Did not match all atoms present	27107-79-5	CCOC(=O)[C@@]1(CCC=C[C@H]1N(C)C)C2=CC=CC=C2.Cl	{1: 3, 2: 1, 33: 1, 11: 2, 12: 1, 13: 1, 14: 7, 17: 1, 28: 1}
Did not match all atoms present	27107-88-6	CCCCCCCC[Sn](CCCCCCCC)(SCC(=O)OCCCC)SCC(=O)OCCCC	{40: 2, 1: 4, 2: 22, 28: 2}
Did not match all atoms present	27107-89-7	CCCCCCCC[Sn](SCC(=O)OCC(CC)CCCC)(SCC(=O)OCC(CC)CCCC)SCC(=O)OCC(CC)CCCC	{40: 3, 1: 7, 2: 25, 3: 3, 28: 3}
Did not match all atoms present	27113-22-0	CCCCCCCC(=O)CCC1=CC(=C(C=C1)O)OC	{1: 2, 2: 8, 14: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	27115-36-2	C(=O)[O-].C(=O)[O-].C(=O)[O-].[Cr+3]	{26: 3}
Did not match all atoms present	27115-49-7	CC1=CC=CC(=C1)C(=O)NCC(=O)O	{1: 1, 2: 1, 14: 4, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	27115-50-0	CC1=CC=C(C=C1)C(=O)NCC(=O)O	{1: 1, 2: 1, 14: 4, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	27116-62-7	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)N(N=C5C)C6=CC=CC=C6	{1: 3, 2: 2, 35: 1, 33: 2, 13: 1, 14: 12, 23: 1, 28: 1}
Did not match all atoms present	2712-83-6	C1=CC(=C(C=C1[N+](=O)[O-])O)NC(=O)C(C(C(F)(F)F)(F)F)(F)F	{4: 3, 38: 1, 14: 3, 16: 7, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	27124-11-4	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)NC(=O)C(F)(F)F)O	{1: 2, 2: 1, 4: 1, 11: 3, 12: 5, 13: 1, 14: 3, 16: 3, 20: 3, 21: 2, 22: 2, 23: 1, 24: 2, 25: 2, 31: 1}
Did not match all atoms present	27126-93-8	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C#N	{16: 6, 4: 2, 37: 1, 14: 3}
Did not match all atoms present	27128-50-3	C1=C(C=C(C(=C1Cl)I)I)Cl	{17: 2, 19: 2, 14: 2}
Did not match all atoms present	27129-86-8	CC1=CC(=CC(=C1)CBr)C	{1: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	27129-87-9	CC1=CC(=CC(=C1)CO)C	{1: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	2713-31-7	C1=CC(=C(C=C1F)O)F	{16: 2, 21: 1, 14: 3}
Did not match all atoms present	2713-33-9	C1=CC(=C(C=C1O)F)F	{16: 2, 21: 1, 14: 3}
Did not match all atoms present	2713-34-0	C1=C(C=C(C=C1F)F)O	{16: 2, 21: 1, 14: 3}
Did not match all atoms present	2713-48-6	C1=CC=C(C=C1)P2(=NP(=NP(=N2)(F)F)(F)F)F	{16: 5, 35: 3, 14: 5}
Did not match all atoms present	2714-60-5	C(F)(F)(F)P(C(F)(F)F)P(C(F)(F)F)C(F)(F)F	{16: 12, 4: 4}
Did not match all atoms present	27141-23-7	CC[Ge]1(O[Ge](O[Ge](O[Ge](O1)(CC)CC)(CC)CC)(CC)CC)CC	{1: 8, 2: 8, 23: 4}
Did not match all atoms present	27143-81-3	CC(C)(C)C#[N+][O-]	{1: 3, 34: 1, 4: 1, 29: 1}
Did not match all atoms present	27146-15-2	COC(=O)NC1=CC2=C(C=C1)N=C(N2)C3=CSC=N3	{32: 1, 1: 1, 35: 2, 41: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	2715-68-6	CCN1C=NC2=C1N=CN=C2N	{1: 1, 2: 1, 35: 3, 33: 1, 14: 2, 30: 1}
Did not match all atoms present	2715-70-0	CCCCN1C=NC2=C1N=CN=C2N	{1: 1, 2: 3, 35: 3, 33: 1, 14: 2, 30: 1}
Did not match all atoms present	27151-54-8	COC1=CC=C(C=C1)NC2=CC=C(C=C2)O	{1: 1, 22: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	27151-57-1	CN(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC	{1: 3, 22: 2, 14: 8, 33: 1}
Did not match all atoms present	27151-74-2	CC(C)C[Hg]Cl	{1: 2, 2: 1, 3: 1, 17: 1}
Did not match all atoms present	27152-57-4	[O-][As]([O-])[O-].[O-][As]([O-])[O-].[Ca+2].[Ca+2].[Ca+2]	{29: 6}
Did not match all atoms present	27152-80-3	C1=CC(=CC=C1NCS(=O)(=O)[O-])N=NC2=CC=C(C=C2)[N+](=O)[O-].[Na+]	{2: 1, 38: 1, 34: 2, 14: 8, 29: 3, 31: 1}
Did not match all atoms present	27157-66-0	CCCCCCCCCCC1=CC=CC=C1O	{1: 1, 2: 9, 21: 1, 14: 4}
Did not match all atoms present	27159-75-7	CN(C)C=NCC1=CC=CC=C1	{1: 2, 2: 1, 6: 1, 33: 1, 34: 1, 14: 5}
Did not match all atoms present	27159-90-6	CCN(CCNS(=O)(=O)C)C1=CC=CC(=C1)C.[Na+]	{1: 3, 2: 3, 33: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	2716-62-3	CCCC(C)NC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	27164-09-6	C1=CC(=C(C(=C1Cl)C=O)O)Cl	{17: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	27164-46-1	CC1=NN=C(S1)SCC2=C(N3C(C(C3=O)NC(=O)CN4C=NN=N4)SC2)C(=O)[O-].[Na+]	{1: 1, 2: 2, 35: 5, 33: 2, 40: 1, 41: 2, 11: 1, 12: 2, 14: 1, 15: 2, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	27165-08-8	CC1=C(C=CC(=C1)Cl)[N+]#N	{1: 1, 34: 1, 14: 3, 17: 1}
Did not match all atoms present	27165-25-9	COC1=CC(=C(C=C1)[N+]#N)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	27165-88-4	C1CC2=CC3=CC(=C2)CCC4=CC1=CC(=C4)CC3	{11: 6, 14: 6}
Did not match all atoms present	27167-34-6	C1CCC(C(C1)O)(C2=CC=CC=C2)O	{20: 2, 11: 4, 12: 1, 13: 1, 14: 5}
Did not match all atoms present	2717-42-2	CC1=CC(=C(C2=CC=CC=C12)C)C	{1: 3, 14: 5}
Did not match all atoms present	2717-44-4	CC1=CC2=CC=CC=C2CC1	{1: 1, 11: 2, 14: 5, 15: 1}
Did not match all atoms present	27175-81-1	C1=CC=C(C=C1)CCCCCCCCCCl	{17: 1, 2: 9, 14: 5}
Did not match all atoms present	27176-87-0	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O	{1: 1, 2: 11, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	27177-37-3	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)NC2=CC=CC=C2	{1: 5, 2: 1, 4: 2, 14: 9, 31: 1}
Did not match all atoms present	2718-25-4	CN1CCC2=CC3=C(C=C2[C@@H]4[C@H]1C5=C([C@H](O4)OC)C6=C(C=C5)OCO6)OCO3	{1: 2, 33: 1, 11: 4, 12: 3, 14: 4, 22: 1, 23: 5}
Did not match all atoms present	2718-78-7	CCN1C2=CC=CC=C2SC1=CC=C3C(=O)N=C(S3)N(C4=CC=CC=C4)C5=CC=CC=C5	{1: 1, 2: 1, 35: 1, 6: 2, 33: 2, 41: 2, 14: 14, 15: 3, 25: 1}
Did not match all atoms present	2718-90-3	C1=CC(=C(C=C1N=[N+]=[N-])S(=O)(=O)[O-])C=CC2=C(C=C(C=C2)N=[N+]=[N-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 4, 14: 6, 6: 2, 29: 6}
Did not match all atoms present	27183-43-3	C1=CC(=CC(=C1)[N+](=O)[O-])COCC2=CC(=CC=C2)[N+](=O)[O-]	{2: 2, 38: 2, 22: 1, 14: 8}
Did not match all atoms present	2719-07-5	CC(=O)NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 1: 1, 38: 2, 14: 3, 31: 2}
Did not match all atoms present	2719-08-6	CC(=O)NC1=CC=CC=C1C(=O)OC	{24: 1, 1: 2, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	2719-13-3	CC(=O)NNC1=CC=C(C=C1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4, 31: 2}
Did not match all atoms present	2719-15-5	CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C	{24: 1, 1: 2, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	2719-21-3	CC(=O)C1=CC=C(C=C1)NC(=O)C	{24: 2, 1: 2, 14: 4, 31: 1}
Did not match all atoms present	2719-23-5	CC(=O)NC1=NC=CS1	{1: 1, 35: 1, 41: 1, 14: 2, 24: 1, 31: 1}
Did not match all atoms present	2719-30-4	C1=CC=C(C(=C1)N=C=S)[N+](=O)[O-]	{8: 1, 34: 1, 38: 1, 14: 4}
Did not match all atoms present	2719-32-6	C1=CC(=CC=C1C#N)N=C=S	{8: 1, 34: 1, 37: 1, 14: 4}
Did not match all atoms present	2719-40-6	CC1=C(C=C(C=C1)CCl)Cl	{1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	2719-52-0	CCCC(C)C1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	2719-61-1	CCCCCCCCCCC(C)C1=CC=CC=C1	{1: 2, 2: 9, 3: 1, 14: 5}
Did not match all atoms present	2719-62-2	CCCCCCC(CCCCC)C1=CC=CC=C1	{1: 2, 2: 9, 3: 1, 14: 5}
Did not match all atoms present	2719-63-3	CCCCCCCC(CCCC)C1=CC=CC=C1	{1: 2, 2: 9, 3: 1, 14: 5}
Did not match all atoms present	2719-64-4	CCCCCCCCC(CCC)C1=CC=CC=C1	{1: 2, 2: 9, 3: 1, 14: 5}
Did not match all atoms present	27193-93-7	CCCCCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 8, 14: 7}
Did not match all atoms present	272-30-0	C1=CC=C2C(=C1)C=C[Se]2	{14: 6}
Did not match all atoms present	272-35-5	C1=CC=C2C(=C1)C=C[Te]2	{14: 6}
Did not match all atoms present	272-97-9	C1=CN=CC2=C1N=CN2	{32: 1, 35: 2, 14: 4}
Did not match all atoms present	2720-41-4	C1CCC(=S)CC1	{11: 5, 15: 1}
Did not match all atoms present	2720-73-2	CCCCCOC(=S)[S-].[K+]	{1: 1, 2: 4, 22: 1, 7: 1}
Did not match all atoms present	2720-93-6	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C4=CC=CC=C42	{35: 1, 14: 13}
Did not match all atoms present	27200-12-0	C1=C(C=C(C(=C1O)O)O)[C@@H]2[C@H](C(=O)C3=C(C=C(C=C3O2)O)O)O	{12: 2, 14: 4, 20: 1, 21: 5, 23: 1, 25: 1}
Did not match all atoms present	27203-92-5	CN(C)C[C@H]1CCCC[C@@]1(C2=CC(=CC=C2)OC)O	{1: 3, 2: 1, 33: 1, 11: 4, 12: 1, 13: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	27208-37-3	C1=CC2=C3C(=C1)C=C4C=CC5=C4C3=C(C=C2)C=C5	{14: 10}
Did not match all atoms present	27215-10-7	CC(C)CCCCCOP(=O)(O)OCCCCCC(C)C	{1: 4, 2: 10, 3: 2, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	27216-79-1	[OH-].[Sn+2]	{}
Did not match all atoms present	2722-36-3	CC(CCO)C1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	27220-59-3	CCCCC1C(C(OC(=O)C(C(OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)OC(=O)CCC	{1: 4, 2: 5, 12: 5, 14: 3, 21: 1, 24: 1, 26: 1, 28: 3, 31: 2}
Did not match all atoms present	27223-35-4	CC1=CC(=O)N2CC(=O)N(C3=C(C2(O1)C4=CC=CC=C4)C=C(C=C3)Cl)C	{1: 2, 33: 2, 11: 1, 13: 1, 14: 9, 15: 1, 17: 1, 23: 1, 25: 2}
Did not match all atoms present	27223-49-0	CC1=C(C=C(O1)CC#C)COC(=O)C2C(C2(C)C)C=C(C)C	{1: 5, 2: 2, 6: 1, 7: 1, 9: 1, 10: 1, 12: 2, 13: 1, 14: 1, 23: 1, 28: 1}
Did not match all atoms present	27231-33-0	CC1=C2C(=CC=C1)NC(=S)N2	{32: 2, 1: 1, 14: 3}
Did not match all atoms present	27231-36-3	CC1=CC2=C(C=C1)NC(=S)N2	{32: 2, 1: 1, 14: 3}
Did not match all atoms present	27233-34-7	CCCCCCCCC=CCCCCCCCCOCCCCCCCCC=CCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 30, 22: 1, 6: 4, 29: 4}
Did not match all atoms present	2724-69-8	CNC(=S)NC1=CC=CC=C1	{1: 1, 31: 2, 14: 5, 7: 1}
Did not match all atoms present	27241-93-6	C1=CC=C(C(=C1)/C=N/NC2=CC=C(C=C2)Cl)Cl	{17: 2, 34: 1, 14: 8, 6: 1, 31: 1}
Did not match all atoms present	27245-05-2	FSS(F)(F)F	{16: 4, 40: 1}
Did not match all atoms present	27247-96-7	CCCCC(CC)CO[N+](=O)[O-]	{1: 2, 2: 5, 3: 1, 22: 1}
Did not match all atoms present	2725-53-3	CC(C)(C)C1=CC(=C(C=C1)O)C=O	{1: 3, 26: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	2725-68-0	CP(Cl)(Cl)(Cl)Cl	{1: 1, 17: 4}
Did not match all atoms present	2725-81-7	C1=CC2=C(C=CC(=O)O2)C=C1[N+](=O)[O-]	{28: 1, 38: 1, 14: 5}
Did not match all atoms present	2725-82-8	CCC1=CC(=CC=C1)Br	{1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	27253-22-1	CC(C)CCCCCSCC(=O)O[Sb](OC(=O)CSCCCCCC(C)C)OC(=O)CSCCCCCC(C)C	{40: 3, 1: 6, 2: 18, 3: 3, 28: 3}
Did not match all atoms present	27253-41-4	CC(C)CCCCCC(=O)[O-].CC(C)CCCCCC(=O)[O-].[Pb+2]	{24: 2, 1: 4, 2: 10, 3: 2}
Did not match all atoms present	27258-01-1	CCCCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)OC	{1: 2, 2: 3, 33: 2, 14: 10, 22: 1, 25: 1}
Did not match all atoms present	2726-03-6	C[NH+](C)CCN1C2=C(C=C(C=C2)Cl)NC3=CC=CC=C3C1=O.[Cl-]	{32: 1, 1: 2, 2: 2, 33: 1, 14: 7, 17: 2, 25: 1}
Did not match all atoms present	2726-42-3	COC1=CC(=CC=C1)[Se]C	{1: 2, 22: 1, 14: 4}
Did not match all atoms present	27260-19-1	CCNCCNC(=O)C1=CC(=C(C=C1OC)N)Cl	{1: 2, 2: 3, 14: 2, 17: 1, 22: 1, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	27262-47-1	CCCCN1CCCC[C@H]1C(=O)NC2=C(C=CC=C2C)C	{1: 3, 2: 3, 33: 1, 11: 4, 12: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	27267-69-2	COC1=CC(=C(C2=C1C(=O)C3=C(C2=O)OC(=C3)CCC4=C(C(=C5C(=C4)C=C(OC5=O)C(=O)OC)O)O)O)OC	{1: 3, 2: 2, 14: 4, 21: 3, 22: 2, 23: 1, 25: 2, 28: 2}
Did not match all atoms present	27269-04-1	C1=CC=NC(=C1)C2=NC(=CC=C2)C3=CC=CC=N3.OCl(=O)(=O)=O.OCl(=O)(=O)=O	{17: 2, 35: 3, 20: 2, 29: 6, 14: 11}
Did not match all atoms present	2727-68-6	CC1=CC=CC=C1NC(=O)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	2727-69-7	CC1=CC(=CC=C1)NC(=O)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	27276-25-1	COC1=CC(=CC(=C1OC)OC)C(=O)NCCCCCC(=O)[O-].[Na+]	{1: 3, 2: 5, 14: 2, 22: 3, 24: 2, 31: 1}
Did not match all atoms present	27277-00-5	CCCN1C(=O)C(=CN2C1=NC(=N2)N)C	{1: 2, 2: 2, 35: 2, 33: 2, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	27277-03-8	C(C1=NC(=NN1)N)O	{32: 1, 2: 1, 35: 2, 20: 1, 30: 1}
Did not match all atoms present	2728-04-3	CCN(CC)C(=O)C1=CC=CC=C1C	{24: 1, 1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	2728-05-4	CCN(CC)C(=O)C1=CC=C(C=C1)C	{24: 1, 1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	27280-72-4	COC1=C(C=CC(=C1)N)C=C(C#N)C2=CC=CC=C2	{1: 1, 37: 1, 6: 1, 7: 1, 14: 8, 22: 1, 30: 1}
Did not match all atoms present	27287-91-8	COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)N=NC3=CC=CC=C3	{1: 1, 22: 1, 34: 3, 14: 13, 6: 1}
Did not match all atoms present	27292-46-2	CC1=CC=C(C=C1)SCC(CS)S	{1: 1, 2: 2, 3: 1, 39: 2, 40: 1, 14: 4}
Did not match all atoms present	27292-49-5	C1COCCN1C2=CC(=CC=C2)O	{33: 1, 11: 4, 21: 1, 14: 4, 23: 1}
Did not match all atoms present	27298-97-1	C[C@@H](C1=CC=C(C=C1)Br)N	{1: 1, 18: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	27298-98-2	CC1=CC=C(C=C1)[C@H](C)N	{1: 2, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	273-05-2	C1=CN=CC2=NNN=C21	{32: 1, 35: 3, 14: 3}
Did not match all atoms present	273-09-6	C1=CC2=NON=C2C=C1	{35: 2, 14: 4, 23: 1}
Did not match all atoms present	273-13-2	C1=CC2=NSN=C2C=C1	{41: 1, 35: 2, 14: 4}
Did not match all atoms present	273-15-4	C1=CC2=N[Se]N=C2C=C1	{35: 2, 14: 4}
Did not match all atoms present	273-21-2	C1=CC2=C(N=C1)N=CN2	{32: 1, 35: 2, 14: 4}
Did not match all atoms present	273-34-7	C1=CC2=NNN=C2N=C1	{32: 1, 35: 3, 14: 3}
Did not match all atoms present	273-53-0	C1=CC=C2C(=C1)N=CO2	{35: 1, 14: 5, 23: 1}
Did not match all atoms present	273-59-6	C1=CC=C2C(=C1)N=NO2	{35: 2, 14: 4, 23: 1}
Did not match all atoms present	273-77-8	C1=CC=C2C(=C1)N=NS2	{41: 1, 35: 2, 14: 4}
Did not match all atoms present	273-91-6	C1=CC=C2C(=C1)N=C[Se]2	{35: 1, 14: 5}
Did not match all atoms present	273-92-7	C1=CC=C2C(=C1)N=N[Se]2	{35: 2, 14: 4}
Did not match all atoms present	27302-90-5	CS(=O)CC(=O)C1=CC=CC=N1	{1: 1, 2: 1, 35: 1, 14: 4, 24: 1, 29: 1}
Did not match all atoms present	27304-02-5	CC1=COC2=C1C(=O)C3=C(C2=O)OC(=C(C)C)C3	{1: 3, 7: 1, 11: 1, 14: 1, 15: 3, 23: 2, 25: 2}
Did not match all atoms present	2731-16-0	COC1=C(C(=C2C(=C1)CC[C@@H](C3=CC(=O)C(=CC=C32)SC)N)OC)OC	{1: 4, 40: 1, 11: 2, 12: 1, 14: 4, 22: 3, 25: 1, 30: 1}
Did not match all atoms present	27310-25-4	C1=C(C=C2C(=CC(=CC2=C1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)N	{30: 1, 20: 3, 29: 6, 14: 4}
Did not match all atoms present	27313-56-0	C1=CC2=CC3=CC(=C2)C=CC4=CC1=CC(=C4)C=C3	{14: 12}
Did not match all atoms present	27314-13-2	CNC1=C(C(=O)N(N=C1)C2=CC=CC(=C2)C(F)(F)F)Cl	{1: 1, 35: 1, 4: 1, 33: 1, 14: 5, 16: 3, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	27315-02-2	CC(=O)N=C1N=[N+](C2=CC=CC=C2N1O)[O-]	{1: 1, 34: 1, 35: 1, 33: 2, 14: 4, 21: 1, 24: 1, 29: 1}
Did not match all atoms present	27318-87-2	COC1=CC(=CC(=C1)OCC(CO)O)OC	{1: 2, 2: 2, 3: 1, 14: 3, 20: 2, 22: 3}
Did not match all atoms present	2732-09-4	CC1=CC2=C(C=C1)N=C3C(=C2C=O)C=CC4=CC=CC=C43	{1: 1, 26: 1, 35: 1, 14: 9}
Did not match all atoms present	2732-18-5	C1=CC(=O)OC2=CC(=CC(=C21)O)O	{28: 1, 21: 2, 14: 4}
Did not match all atoms present	2732-25-4	C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)Cl	{32: 1, 17: 1, 14: 7}
Did not match all atoms present	2732-58-3	CCC1=CC2=C(C=CC3=CC=CC=C32)C4=CC=CC=C41	{1: 1, 2: 1, 14: 11}
Did not match all atoms present	27323-37-1	C1=CC(=C(C=C1N)N)CC2=C(C=C(C=C2)N)N	{2: 1, 30: 4, 14: 6}
Did not match all atoms present	27323-64-4	CN1C(CC(C1=O)O)C2=CN=CC=C2	{1: 1, 35: 1, 33: 1, 11: 1, 12: 2, 14: 4, 20: 1, 25: 1}
Did not match all atoms present	27325-18-4	CC(C)NCC(COC1=CC=CC=C1C2CC2)O.Cl	{1: 2, 2: 2, 3: 2, 11: 2, 12: 1, 14: 4, 17: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	27326-27-8	CCCCCCCCCCCCOC(=O)CCS(=O)(=O)CCC(=O)OCCCCCCCCCCCC	{1: 2, 2: 26, 28: 2, 29: 2}
Did not match all atoms present	27328-86-5	C1=CC(=CC(=C1)C(F)(F)F)C(=O)CC#N	{2: 1, 4: 1, 37: 1, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	2733-41-7	C1=CC(=CC=C1C(=O)N=[N+]=[N-])[N+](=O)[O-]	{24: 1, 34: 2, 38: 1, 14: 4}
Did not match all atoms present	27330-47-8	CC1=C(SN=C1)C	{1: 2, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	2734-13-6	C1=CC=C2C3C=CC(C2=C1)C4=CC=CC=C34	{12: 2, 14: 10}
Did not match all atoms present	2734-52-3	C1=CC(=CC=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])N(CCO)CCO	{33: 1, 2: 4, 38: 1, 34: 2, 14: 8, 20: 2}
Did not match all atoms present	2734-70-5	COC1=C(C(=CC=C1)OC)N	{1: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	27343-29-9	CC1=C2C(=C3CCCC(=O)C3=C1)C=CC4=CC=CC=C42	{1: 1, 11: 3, 14: 7, 25: 1}
Did not match all atoms present	27344-41-8	C1=CC=C(C(=C1)C=CC2=CC=C(C=C2)C3=CC=C(C=C3)C=CC4=CC=CC=C4S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{14: 16, 6: 4, 29: 6}
Did not match all atoms present	27347-09-7	COC1=CC=C(C=C1)N2CC2	{1: 1, 11: 2, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	2735-04-8	COC1=CC(=C(C=C1)N)OC	{1: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	2735-05-9	CC1=C(C=C(C=C1)CCl)CCl	{1: 1, 2: 2, 14: 3, 17: 2}
Did not match all atoms present	2735-62-8	CN1C2=CC=CC=C2N=C1CC#N	{1: 1, 2: 1, 35: 1, 37: 1, 33: 1, 14: 4}
Did not match all atoms present	27351-96-8	CC(C)C1=CC=CC2=C1C=CC=C2C(C)C	{1: 4, 3: 2, 14: 6}
Did not match all atoms present	27353-29-3	CCOP(=O)(CN1CCOCC1)OCC	{1: 2, 2: 3, 33: 1, 11: 4, 22: 2, 23: 1, 29: 1}
Did not match all atoms present	27355-22-2	C1C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)O1	{17: 4, 11: 1, 28: 1}
Did not match all atoms present	27356-52-1	CCC1=NC2=CC=CC=C2C=C1C	{1: 2, 2: 1, 35: 1, 14: 5}
Did not match all atoms present	2736-21-2	COC1=CC2=C(C=C1)C(=CN2)CCN.Cl	{32: 1, 1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	2736-23-4	C1=C(C(=CC(=C1S(=O)(=O)N)Cl)Cl)C(=O)O	{17: 2, 30: 1, 27: 1, 29: 2, 14: 2}
Did not match all atoms present	27360-85-6	C1=CC2=C(C=C1S(=O)(=O)[O-])C3=NC4=NC(=NC5=C6C=CC(=CC6=C([N-]5)N=C7C8=C(C=C(C=C8)S(=O)(=O)[O-])C(=N7)N=C2[N-]3)S(=O)(=O)[O-])C9=C4C=CC(=C9)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{35: 8, 29: 12, 14: 12}
Did not match all atoms present	27361-16-6	CCCCOC1=CC=CC=N1	{1: 1, 2: 3, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	27371-95-5	CCCC[Sn]1(OCCS1)CCCC	{1: 2, 2: 6, 11: 2, 41: 1, 23: 1}
Did not match all atoms present	27374-25-0	CCOC1(CC1)O[Si](C)(C)C	{1: 4, 2: 1, 11: 2, 13: 1, 22: 2}
Did not match all atoms present	27375-52-6	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCO	{1: 1, 2: 2, 14: 4, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	27375-53-7	CC(=O)NC1=C(C=CC=C1S(=O)(=O)CCO)OC	{1: 2, 2: 2, 14: 3, 20: 1, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	27386-01-2	CNC1=NNC(=S)S1	{32: 1, 1: 1, 35: 1, 41: 1, 31: 1}
Did not match all atoms present	2739-04-0	CC1=CC=C(C=C1)N(C)C=O	{1: 2, 26: 1, 14: 4, 33: 1}
Did not match all atoms present	2739-12-0	CNC1=CC=CC=C1.Cl	{1: 1, 31: 1, 14: 5, 17: 1}
Did not match all atoms present	2739-17-5	C1CC2=CC=CC=C2NC1.Cl	{32: 1, 17: 1, 11: 3, 14: 4}
Did not match all atoms present	2739-97-1	C1=CC=NC(=C1)CC#N	{2: 1, 35: 1, 37: 1, 14: 4}
Did not match all atoms present	2739-98-2	CCOC(=O)CC1=CC=CC=N1	{1: 1, 2: 2, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	27391-26-0	CC(=O)C(C(=O)NC1=CC=C(C=C1)OC)N=NC2=CC=C(C=C2)SS(=O)(=O)[O-].[Na+]	{1: 2, 34: 2, 3: 1, 40: 1, 14: 8, 22: 1, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	274-07-7	[B]1OC2=CC=CC=C2O1	{14: 4, 23: 2}
Did not match all atoms present	274-09-9	C1OC2=CC=CC=C2O1	{11: 1, 14: 4, 23: 2}
Did not match all atoms present	274-40-8	C1=CC2=CC=CN2C=C1	{33: 1, 14: 7}
Did not match all atoms present	274-76-0	C1=CC2=NC=CN2C=C1	{33: 1, 35: 1, 14: 6}
Did not match all atoms present	274-87-3	C1=CC2=NN=NN2C=C1	{33: 1, 35: 3, 14: 4}
Did not match all atoms present	274-98-6	C1=CN2C=NN=C2N=C1	{33: 1, 35: 3, 14: 4}
Did not match all atoms present	2740-81-0	C1=CC=C(C(=C1)N=C=S)Cl	{8: 1, 17: 1, 34: 1, 14: 4}
Did not match all atoms present	2740-83-2	C1=CC(=CC(=C1)C(F)(F)F)CN	{16: 3, 2: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	2740-88-7	C1=CC(=CC=C1CN=C=S)F	{8: 1, 16: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	27406-36-6	C1=COC(=C1)C=C2C(=O)NC(=O)NC2=O	{32: 2, 6: 1, 14: 3, 15: 1, 23: 1, 25: 3}
Did not match all atoms present	2741-06-2	CCNC(=S)NC1=CC=CC=C1	{1: 1, 2: 1, 31: 2, 14: 5, 7: 1}
Did not match all atoms present	2741-16-4	CC(C)OC1=CC=CC=C1	{1: 2, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	2741-38-0	C=CCP(C1=CC=CC=C1)C2=CC=CC=C2	{2: 1, 14: 10, 5: 1, 6: 1}
Did not match all atoms present	2741-57-3	C1=CC=C(C(=C1)C(Cl)Cl)C(Cl)(Cl)Cl	{17: 5, 3: 1, 4: 1, 14: 4}
Did not match all atoms present	27419-90-5	C1=CC=C(C=C1)N(CCC#N)CCOCCC#N	{33: 1, 2: 6, 22: 1, 14: 5, 37: 2}
Did not match all atoms present	27421-70-1	CN(C)CCCN=C=S	{8: 1, 1: 2, 2: 3, 34: 1, 33: 1}
Did not match all atoms present	27425-55-4	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4N3	{32: 1, 1: 2, 2: 2, 35: 1, 33: 1, 14: 8, 28: 1}
Did not match all atoms present	27426-98-8	C1CC(C2=CC=CC=C2C1)C3CCC4=CC=CC=C4C3	{11: 6, 12: 2, 14: 8}
Did not match all atoms present	2743-38-6	C1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=CC=C2)C(=O)O	{27: 2, 3: 2, 28: 2, 14: 10}
Did not match all atoms present	27441-86-7	[NH4+].N(S(=O)(=O)[O-])S(=O)(=O)[O-]	{29: 6, 31: 1}
Did not match all atoms present	2745-22-4	C1=COC(=C1)C(CN)O	{2: 1, 3: 1, 14: 3, 20: 1, 23: 1, 30: 1}
Did not match all atoms present	2745-25-7	C1=COC(=C1)CC#N	{2: 1, 37: 1, 14: 3, 23: 1}
Did not match all atoms present	2745-26-8	C1=COC(=C1)CC(=O)O	{2: 1, 27: 1, 14: 3, 23: 1}
Did not match all atoms present	2745-54-2	CC1=CC(=CC(=C1)CCl)C	{1: 2, 2: 1, 14: 3, 17: 1}
Did not match all atoms present	27452-68-2	CCN(CCC#N)C1=CC(=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)N=NC4=CC(=CC=C4)S(=O)(=O)O)C	{1: 2, 2: 3, 37: 1, 33: 1, 34: 4, 14: 13, 20: 1, 29: 2}
Did not match all atoms present	2746-81-8	CCCCCCC(=O)OCCN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F	{1: 1, 2: 10, 4: 1, 33: 3, 41: 1, 11: 4, 14: 7, 16: 3, 28: 1}
Did not match all atoms present	27460-02-2	CCCCCCCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 11, 22: 3, 14: 10, 29: 1}
Did not match all atoms present	27460-73-7	CN1CC[C@H]2[C@H](C1)CCCC2NC(=O)C3=CC(=C(C(=C3)OC)OC)OC	{1: 4, 33: 1, 11: 6, 12: 3, 14: 2, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	27463-04-3	CC1=C(C2=CC=CC=C2N1)C(=O)CO	{32: 1, 1: 1, 2: 1, 14: 4, 20: 1, 24: 1}
Did not match all atoms present	27464-23-9	C1=CC(=NN=C1NN)N(CCO)CCO.Cl.Cl	{33: 1, 2: 4, 35: 2, 14: 2, 17: 2, 20: 2, 30: 1, 31: 1}
Did not match all atoms present	27464-38-6	CN(C)S(=O)C1=NC2=CC=CC=C2S1	{1: 2, 35: 1, 33: 1, 41: 1, 14: 4, 29: 1}
Did not match all atoms present	27464-82-0	CC1=NN=C(S1)C	{1: 2, 35: 2, 41: 1}
Did not match all atoms present	27468-64-0	CCCCOC1=CC=C(C=C1)OCC(=O)N(CCN(CC)CC)C2=C(C=C(C=C2)OC)OC.Cl	{1: 5, 2: 8, 33: 2, 14: 7, 17: 1, 22: 4, 24: 1}
Did not match all atoms present	27468-66-2	CCCCOC1=CC=C(C=C1)OCC(=O)N(CCN(CC)CC)C2=C(C=CC(=C2)OC)OC.Cl	{1: 5, 2: 8, 33: 2, 14: 7, 17: 1, 22: 4, 24: 1}
Did not match all atoms present	27469-53-0	C=CCNC1=NC(=NC(=N1)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)NCC=C	{33: 2, 2: 2, 3: 1, 5: 2, 6: 2, 11: 4, 14: 8, 16: 2, 35: 3, 31: 2}
Did not match all atoms present	27469-60-9	C1CN(CCN1)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F	{32: 1, 33: 1, 3: 1, 11: 4, 14: 8, 16: 2}
Did not match all atoms present	2747-05-9	CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C	{1: 2, 28: 2, 14: 4}
Did not match all atoms present	2747-31-1	C[N+](C)(C1=CC=C(C=C1)N=NC2=CC=CC=C2)[O-]	{1: 2, 34: 2, 29: 1, 14: 9}
Did not match all atoms present	27470-51-5	CCCCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)COC(=O)CCC(=O)O	{1: 1, 2: 6, 33: 2, 13: 1, 14: 10, 25: 2, 27: 1, 28: 1}
Did not match all atoms present	27471-60-9	CCCCOC1=CC=C(C=C1)OCC(=O)N(CCN(CC)CC)C2=C(C=CC(=C2)OCC)OCC.Cl	{1: 5, 2: 10, 33: 2, 14: 7, 17: 1, 22: 4, 24: 1}
Did not match all atoms present	27471-67-6	CCCCOC1=CC=C(C=C1)OCC(=O)N(CCN(CC)CC)C2=CC=CC=C2OC.Cl	{1: 4, 2: 8, 33: 2, 14: 8, 17: 1, 22: 3, 24: 1}
Did not match all atoms present	27472-21-5	CCOC1=C(C=C(C=C1)CC#N)OCC	{1: 2, 2: 3, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	27473-62-7	C1C2=CC=CC=C2CC1(C(=O)O)N	{27: 1, 30: 1, 11: 2, 13: 1, 14: 4}
Did not match all atoms present	27478-24-6	CCCCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)[O-].[NH4+]	{1: 1, 2: 3, 29: 3, 14: 6}
Did not match all atoms present	27479-29-4	CCCCCCCCCCCCCC[N+](C)(C)C(CC)C1=CC=CC=C1.[Cl-]	{1: 4, 2: 14, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	27479-45-4	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[Mg+2]	{1: 2, 2: 22, 29: 6, 14: 8}
Did not match all atoms present	2748-88-1	CCCCCCCCCCCCCC[N+]1=CC=C(C=C1)C.[Cl-]	{1: 2, 2: 13, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	2749-57-7	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=CC(=C(C=C3O)[N+](=O)[O-])Cl	{34: 1, 38: 1, 14: 8, 15: 1, 17: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	2749-93-1	CC#CC1=CC=C(C=C1)C	{1: 2, 10: 2, 14: 4}
Did not match all atoms present	27490-20-6	C[Si]1(CC2=CC=CC=C2C1)[Si](C)(C)C	{1: 4, 11: 2, 14: 4}
Did not match all atoms present	27490-21-7	C[Ge]1(CC2=CC=CC=C2C1)C	{1: 2, 11: 2, 14: 4}
Did not match all atoms present	27490-23-9	C[Si](C)(C)[Si](C)(C)C1CCC2=CC=CC=C12	{1: 5, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	27490-24-0	C[Ge](C)(C)C1CCC2=CC=CC=C12	{1: 3, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	27490-90-0	C[Si](C)(C1C=CC2=CC=CC=C12)C3=CC=CC=C3	{1: 2, 12: 1, 14: 11}
Did not match all atoms present	27496-76-0	CC1=CC=CC(=C1C)C=C	{1: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	27497-47-8	CC1=CC=C(C=C1)CC(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C	{1: 3, 2: 1, 3: 1, 14: 12}
Did not match all atoms present	275-02-5	C1=CN2C(=NC=N2)N=C1	{33: 1, 35: 3, 14: 4}
Did not match all atoms present	275-51-4	C1=CC=C2C=CC=C2C=C1	{14: 8}
Did not match all atoms present	2750-76-7	CCN(CC)C(=O)COC1=C2C3=C(C(=C1)NC(=O)/C(=C\C=C\[C@@H]([C@@H]([C@H]([C@H]([C@H]([C@@H]([C@@H]([C@H](/C=C/O[C@@]4(C(=O)C2=C(O4)C(=C3O)C)C)OC)C)OC(=O)C)C)O)C)O)C)/C)O	{32: 1, 1: 11, 2: 3, 33: 1, 12: 8, 13: 1, 14: 6, 15: 1, 20: 2, 21: 2, 22: 2, 23: 2, 24: 1, 25: 2, 28: 1}
Did not match all atoms present	27501-55-9	CCCCCCCCCOC(=O)CC(C(=O)OCCCCCCCCC)S(=O)(=O)O.N	{1: 2, 2: 17, 3: 1, 20: 1, 28: 2, 29: 2}
Did not match all atoms present	27503-81-7	C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O	{32: 1, 35: 1, 20: 1, 29: 2, 14: 8}
Did not match all atoms present	27505-78-8	CC1=CC=CC2=C1NC(=C2C)C	{32: 1, 1: 3, 14: 3}
Did not match all atoms present	27507-54-6	CN1C(=O)C2=C(C1=O)C=C(C=C2)OC3=CC4=C(C=C3)C(=O)N(C4=O)C	{1: 2, 33: 2, 22: 1, 14: 6, 25: 4}
Did not match all atoms present	2751-87-3	CCCCO[Si](CC)(CC)CC	{1: 4, 2: 6, 22: 1}
Did not match all atoms present	2751-90-8	C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{18: 1, 14: 20}
Did not match all atoms present	27512-72-7	CCOC(=O)CC1=C2C=C(C=CC2=NN1)Cl	{32: 1, 1: 1, 2: 2, 35: 1, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	2752-19-4	C1=CC=C(C=C1)C2=CC=CC=C2OP(OC3=CC=CC=C3C4=CC=CC=C4)OC5=CC=CC=C5C6=CC=CC=C6	{22: 3, 14: 27}
Did not match all atoms present	2752-65-0	CC(=CCC[C@@]1(C=CC2=C(O1)C(=C3C(=C2O)C(=O)C4=CC5CC6[C@@]4(O3)C(C5=O)(OC6(C)C)C/C=C(/C)\C(=O)O)CC=C(C)C)C)C	{1: 8, 2: 4, 6: 3, 7: 3, 11: 1, 12: 2, 13: 4, 14: 3, 15: 1, 21: 1, 23: 3, 25: 2, 27: 1}
Did not match all atoms present	27524-97-6	CC(C)NC(C)CN1C=NC2=C1C(=O)N(C(=O)N2C)C.Cl	{1: 5, 2: 1, 3: 2, 33: 3, 14: 1, 17: 1, 35: 1, 25: 2, 31: 1}
Did not match all atoms present	2754-27-0	CC(=O)O[Si](C)(C)C	{1: 4, 28: 1}
Did not match all atoms present	2754-32-7	C[Si](C)(C1=CC=C(C=C1)[Si](C)(C)O)O	{1: 4, 20: 2, 14: 4}
Did not match all atoms present	27544-18-9	C[C@@H](C1=CC2=CC=CC=C2C=C1)O	{1: 1, 3: 1, 20: 1, 14: 7}
Did not match all atoms present	27545-34-2	B(SC)(I)I	{40: 1, 1: 1, 19: 2}
Did not match all atoms present	27545-48-8	B(SC)(SC)I	{40: 2, 1: 2, 19: 1}
Did not match all atoms present	27546-46-9	CC1=CC=CC=C1C2CC2	{1: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	27548-93-2	CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)OC(=O)C	{1: 6, 11: 3, 12: 6, 13: 4, 14: 5, 15: 2, 20: 3, 23: 1, 25: 1, 28: 3}
Did not match all atoms present	27550-64-7	CCN(CCN1C(=O)CCC1=O)C2=CC=CC(=C2)NC(=O)C	{1: 2, 2: 3, 33: 2, 11: 2, 14: 4, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	27554-26-3	CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC(C)C	{1: 4, 2: 10, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	27555-34-6	COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O.C(=O)[C@@H]([C@H]([C@H]([C@@H](C(=O)O)O)O)O)O	{1: 1, 3: 5, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 5, 22: 1, 26: 1, 27: 1}
Did not match all atoms present	27568-90-7	C(CBr)OP(=O)(OCCBr)OCCBr	{2: 6, 18: 3, 22: 3, 29: 1}
Did not match all atoms present	2757-04-2	C1=CC=C(C=C1)C=CC(=O)OC2=CC=CC=C2	{28: 1, 14: 10, 6: 2}
Did not match all atoms present	2757-18-8	C(C(=O)[O-])C(=O)[O-].[Tl+].[Tl+]	{24: 2, 2: 1}
Did not match all atoms present	2757-90-6	C1=CC(=CC=C1CO)NNC(=O)CC[C@@H](C(=O)[O-])[NH3+]	{2: 3, 3: 1, 14: 4, 20: 1, 24: 2, 31: 2}
Did not match all atoms present	2757-92-8	CCSC1=NC2=CC=CC=C2S1	{1: 1, 2: 1, 35: 1, 40: 1, 41: 1, 14: 4}
Did not match all atoms present	2757-94-0	C1=CC=C(C=C1)NC2=CC(=O)C(=O)C3=CC=CC=C32	{25: 2, 31: 1, 14: 10, 15: 1}
Did not match all atoms present	27575-47-9	[F-].[F-].[Hg+2]	{16: 2}
Did not match all atoms present	27576-86-9	CC(C)(C1=CC=CC=C1)C2=CC(=CC=C2)O	{1: 2, 4: 1, 21: 1, 14: 9}
Did not match all atoms present	275795-16-9	CC(C)(C)C1=C(C=CC(=C1)C2=CC=CC=C2)N=O	{1: 3, 34: 1, 4: 1, 29: 1, 14: 8}
Did not match all atoms present	2758-06-7	C[N+](C)(C)CCBr.[Br-]	{1: 3, 2: 2, 18: 2}
Did not match all atoms present	2758-42-1	CNC.C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O	{1: 2, 2: 3, 14: 3, 17: 2, 22: 1, 27: 1, 31: 1}
Did not match all atoms present	27580-14-9	CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)[N+]#N	{1: 3, 2: 2, 33: 1, 34: 1, 14: 3, 22: 1, 29: 2}
Did not match all atoms present	27580-35-4	CC1=C(C=C(C=C1)Cl)[N+]#N	{1: 1, 34: 1, 14: 3, 17: 1}
Did not match all atoms present	27583-41-1	CCN1C2=CC=CC=C2OC1=CC=C3C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)O)C	{1: 2, 2: 1, 35: 1, 6: 2, 33: 2, 14: 8, 15: 3, 20: 1, 23: 1, 25: 1, 29: 2}
Did not match all atoms present	27589-33-9	C1=CSC(=C1)CNC2=CC(=C(C=C2C3=NNN=N3)S(=O)(=O)N)Cl	{32: 1, 2: 1, 35: 3, 41: 1, 14: 5, 17: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	2759-28-6	C1CN(CCN1)CC2=CC=CC=C2	{32: 1, 33: 1, 2: 1, 11: 4, 14: 5}
Did not match all atoms present	2759-71-9	C1CC1C(=O)NC2=CC(=C(C=C2)Cl)Cl	{11: 2, 12: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	27591-69-1	CCN(CC)CCOC1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)OCCN(CC)CC.Cl.Cl	{1: 4, 2: 8, 33: 2, 14: 6, 17: 2, 22: 2, 25: 1}
Did not match all atoms present	27593-14-2	CCCCCCCC[N+](C)(C)CC(=O)[O-]	{24: 1, 1: 3, 2: 8}
Did not match all atoms present	27593-23-3	CCCCCC1=CC=CC(=O)O1	{1: 1, 2: 4, 28: 1, 14: 3}
Did not match all atoms present	2760-31-8	CCC(=O)NC1=CC=C(C=C1)OC	{1: 2, 2: 1, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	2760-32-9	CCC(=O)NC1=CC=CC=C1Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	27603-25-4	CS(=O)(=O)C1=NN=C(S1)C(F)(F)F	{1: 1, 35: 2, 4: 1, 41: 1, 16: 3, 29: 2}
Did not match all atoms present	27607-61-0	C(CS(=O)(=O)Cl)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 15, 17: 1, 2: 2, 4: 7, 29: 2}
Did not match all atoms present	27607-77-8	C[Si](C)(C)OS(=O)(=O)C(F)(F)F	{16: 3, 1: 3, 4: 1, 29: 2, 22: 1}
Did not match all atoms present	2761-22-0	C1=CC(=CC=C1C2=CC=C(C=C2)N=C=O)N=C=O	{8: 2, 34: 2, 29: 2, 14: 8}
Did not match all atoms present	2761-24-2	CCCCC[Si](OCC)(OCC)OCC	{1: 4, 2: 7, 22: 3}
Did not match all atoms present	27610-20-4	C1=CC=C(C=C1)SO	{40: 1, 20: 1, 14: 5}
Did not match all atoms present	27618-25-3	CC1=CC(=CC=C1)NCCC#N	{1: 1, 2: 2, 37: 1, 14: 4, 31: 1}
Did not match all atoms present	27619-88-1	C(CS(=O)(=O)Cl)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 9, 17: 1, 2: 2, 4: 4, 29: 2}
Did not match all atoms present	27619-89-2	C(CS(=O)(=O)Cl)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 17: 1, 2: 2, 4: 6, 29: 2}
Did not match all atoms present	27619-90-5	C(CS(=O)(=O)Cl)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 17, 17: 1, 2: 2, 4: 8, 29: 2}
Did not match all atoms present	27619-91-6	C(CS(=O)(=O)Cl)C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 21, 17: 1, 2: 2, 4: 10, 29: 2}
Did not match all atoms present	27619-97-2	C(CS(=O)(=O)O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 20: 1, 2: 2, 4: 6, 29: 2}
Did not match all atoms present	2762-19-8	CNC1=CC=CC2=C1C(=O)N(C2=O)C	{1: 2, 31: 1, 33: 1, 14: 3, 25: 2}
Did not match all atoms present	2763-96-4	C1=C(ONC1=O)CN	{32: 1, 2: 1, 14: 1, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	27631-29-4	COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)Cl)OC	{1: 2, 35: 2, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	2764-72-9	C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31	{33: 2, 11: 2, 14: 8}
Did not match all atoms present	2764-87-6	C[Si]1(CC2=CC=CC=C2C1)C	{1: 2, 11: 2, 14: 4}
Did not match all atoms present	27642-27-9	CNC(=O)C1=CC=C(C=C1)O	{24: 1, 1: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	27644-00-4	C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)C3=CC=CC=C3	{24: 1, 2: 1, 14: 14}
Did not match all atoms present	2765-18-6	CCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 2, 14: 7}
Did not match all atoms present	27653-49-2	CCC1=C(C(=NC(=N1)N)N)C2=CC=CC=C2	{1: 1, 2: 1, 35: 2, 30: 2, 14: 5}
Did not match all atoms present	27653-50-5	CCCC1=C(C(=NC(=N1)N)N)C2=CC=CC=C2	{1: 1, 2: 2, 35: 2, 30: 2, 14: 5}
Did not match all atoms present	27655-40-9	C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)O	{35: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	27655-41-0	C1=CC(=C2C=CN=CC2=C1)C#N	{35: 1, 37: 1, 14: 6}
Did not match all atoms present	2766-51-0	C[S+](C)CC[C@@H](C(=O)O)N.[I-]	{1: 2, 2: 2, 3: 1, 19: 1, 27: 1, 30: 1}
Did not match all atoms present	2766-74-7	C1=C(SC(=C1)Cl)S(=O)(=O)Cl	{17: 2, 29: 2, 14: 2, 41: 1}
Did not match all atoms present	27668-52-6	CCCCCCCCCCCCCCCCCC[N+](C)(C)CCC[Si](OC)(OC)OC.[Cl-]	{1: 6, 2: 20, 22: 3, 17: 1}
Did not match all atoms present	2767-41-1	CCCCCC[Sn](CCCCCC)(Cl)Cl	{1: 2, 2: 10, 17: 2}
Did not match all atoms present	2767-47-7	C[Sn](C)(Br)Br	{1: 2, 18: 2}
Did not match all atoms present	2767-54-6	CC[Sn](CC)(CC)Br	{1: 3, 2: 3, 18: 1}
Did not match all atoms present	2767-55-7	CC[Sn](CC)(I)I	{1: 2, 2: 2, 19: 2}
Did not match all atoms present	2767-61-5	CCC[Sn](CCC)(CCC)Br	{1: 3, 2: 6, 18: 1}
Did not match all atoms present	2767-70-6	C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{2: 1, 38: 1, 18: 1, 14: 19}
Did not match all atoms present	2767-80-8	C(O)P(CO)CO	{2: 3, 20: 3}
Did not match all atoms present	2768-02-7	CO[Si](C=C)(OC)OC	{1: 3, 22: 3, 5: 1, 6: 1}
Did not match all atoms present	2768-42-5	C1=CC=C(C=C1)[C@@H](CC(=O)[O-])O	{24: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	2768-56-1	C1=CC=C(C=C1)COC(=O)NC(CO)C(=O)O	{2: 2, 3: 1, 14: 5, 20: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	2768-90-3	CCN1C(=CC=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41.[Cl-]	{1: 2, 2: 2, 6: 3, 33: 2, 14: 12, 15: 1, 17: 1}
Did not match all atoms present	27683-61-0	C1=CC(=CC(=C1)Cl)C(C(Cl)Cl)O	{17: 3, 3: 2, 20: 1, 14: 4}
Did not match all atoms present	27683-73-4	CNCC1=CC=CC=C1C(C2=CC=C(C=C2)Cl)O.Cl	{1: 1, 2: 1, 3: 1, 14: 8, 17: 2, 20: 1, 31: 1}
Did not match all atoms present	27685-90-1	C1=CC2=C(C=C1S(=O)(=O)Cl)OC(=O)N2	{32: 1, 17: 1, 28: 1, 29: 2, 14: 3}
Did not match all atoms present	27686-84-6	C[C@H](CC1=CC(=C(C=C1)O)O)[C@@H](C)CC2=CC(=C(C=C2)O)O	{1: 2, 2: 2, 3: 2, 21: 4, 14: 6}
Did not match all atoms present	2769-64-4	CCCC[N+]#[C-]	{1: 1, 2: 3, 34: 1}
Did not match all atoms present	2769-94-0	CC(C1=CC=CC=C1)C2=CC(=C(C=C2)O)C(C)C3=CC=CC=C3	{1: 2, 3: 2, 21: 1, 14: 13}
Did not match all atoms present	27690-02-4	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[K+].[K+]	{25: 2, 29: 6, 14: 6}
Did not match all atoms present	27691-62-9	CN(C)S(=O)(=O)C1=CC2=C(C=C1)NC3=CC=CC=C3S2	{32: 1, 1: 2, 33: 1, 41: 1, 14: 7, 29: 2}
Did not match all atoms present	27692-91-7	CCN(CCN(C)C)C1=CC=CC=C1	{1: 3, 2: 3, 14: 5, 33: 2}
Did not match all atoms present	27693-37-4	C1=CC=NC(=C1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]	{24: 1, 35: 1, 38: 1, 14: 8}
Did not match all atoms present	27694-82-2	C=CCN1C(=O)N(C(=O)N(C1=O)CC2=CC=CC=C2)CC=C	{33: 3, 2: 3, 5: 2, 6: 2, 14: 5, 25: 3}
Did not match all atoms present	27695-54-1	CCOC(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC=C(C=C2)C(=O)C(Br)Br	{1: 1, 2: 1, 3: 2, 38: 1, 14: 8, 18: 2, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	27695-55-2	C1=CC(=CC(=C1)Cl)C(=O)C(NC2=CC=C(C=C2)C(=O)C(Cl)Cl)O	{3: 2, 14: 8, 17: 3, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	27695-57-4	C1=CC=C(C=C1)C(=O)C(NC2=CC=C(C=C2)C(=O)C(Cl)Cl)O	{3: 2, 14: 9, 17: 2, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	27695-58-5	CC1=CC=C(C=C1)C(=O)C(NC2=CC=C(C=C2)C(=O)C(Cl)Cl)O	{1: 1, 3: 2, 14: 8, 17: 2, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	27695-59-6	COC1=CC=C(C=C1)C(=O)C(NC2=CC=C(C=C2)C(=O)C(Cl)Cl)O	{1: 1, 3: 2, 14: 8, 17: 2, 20: 1, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	27695-60-9	C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C(NC3=CC=C(C=C3)C(=O)C(Cl)Cl)O	{3: 2, 14: 13, 17: 2, 20: 1, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	27695-61-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C(NC3=CC=C(C=C3)C(=O)C(Cl)Cl)O	{3: 2, 14: 13, 17: 2, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	27697-51-4	CC[N+](C)(C)C.[Cl-]	{1: 4, 2: 1, 17: 1}
Did not match all atoms present	2770-75-4	C1(=NC(=S)NC(=S)N1)N	{32: 2, 35: 1, 30: 1}
Did not match all atoms present	27700-43-2	C1=CC=C(C=C1)SC2=CC=C(C=C2)C(=O)C(NC3=CC=C(C=C3)C(=O)C(Cl)Cl)O	{3: 2, 40: 1, 14: 13, 17: 2, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	27701-66-2	C1=CC=C(C=C1)C2=CC(=C(C=C2)Br)[N+](=O)[O-]	{18: 1, 38: 1, 14: 8}
Did not match all atoms present	27703-70-4	CCCCCCCCOC(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 7, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	27708-63-0	CC(C)CCCCCOP(=O)(O)O.[K+].[K+]	{1: 2, 2: 5, 3: 1, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	2771-13-3	COC1=CC=C(C=C1)CCN[NH3+].OS(=O)(=O)[O-]	{1: 1, 2: 2, 14: 4, 20: 1, 22: 1, 29: 3, 31: 1}
Did not match all atoms present	2771-67-7	C1=CC(=CC=C1N=C(Cl)Cl)Cl	{17: 3, 34: 1, 14: 4, 7: 1}
Did not match all atoms present	27713-85-5	CC1(C2=CC=CC=C2N(C1=CC=C3CCC(=CC=C4C(C5=CC=CC=C5N4C)(C)C)C3=O)C)C	{1: 6, 6: 4, 33: 2, 11: 2, 13: 2, 14: 8, 15: 4, 25: 1}
Did not match all atoms present	2772-45-4	CC(C)(C1=CC=CC=C1)C2=CC(=C(C=C2)O)C(C)(C)C3=CC=CC=C3	{1: 4, 4: 2, 21: 1, 14: 13}
Did not match all atoms present	2772-46-5	COC1=CC(=C(C=C1OC)Cl)Cl	{1: 2, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	27721-02-4	C1=CC=C(C=C1)P(CCCCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 5, 14: 20}
Did not match all atoms present	27724-96-5	C1CC(CCC1CN)C(=O)OC2=CC=C(C=C2)CCC(=O)O.Cl	{2: 3, 11: 4, 12: 2, 14: 4, 17: 1, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	27725-15-1	CC1=CC(=C(C=C1)O)S(=O)C2=C(C=CC(=C2)C)O	{1: 2, 21: 2, 14: 6, 29: 1}
Did not match all atoms present	27725-17-3	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)CC2=C(C=CC(=C2)C(C)(C)CC(C)(C)C)O	{1: 10, 2: 3, 4: 4, 21: 2, 14: 6}
Did not match all atoms present	27729-95-9	COC1=CC=C(C=C1)[C@H]2[C@@H](O2)C(=O)C3=CC=CC=C3	{1: 1, 12: 2, 14: 9, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	2773-92-4	CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)C.Cl	{1: 3, 2: 5, 35: 1, 33: 1, 14: 5, 17: 1, 22: 1}
Did not match all atoms present	27731-62-0	CCCCCCCCCCCCCCOCCCCCCCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 26, 29: 4, 22: 1}
Did not match all atoms present	27738-39-2	C1OC2=C(O1)C=C(C=C2)C=NC3=CC=CC=C3	{34: 1, 11: 1, 14: 8, 6: 1, 23: 2}
Did not match all atoms present	27742-38-7	C[As+](C)(C)C	{1: 4}
Did not match all atoms present	27749-40-2	CC(C)(C)C1=CC=CC=C1CC(=O)O	{1: 3, 2: 1, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	27750-80-7	COC1=CC(=CC(=C1O[Si](C)(C)C)OC)C=CC(=O)O[Si](C)(C)C	{1: 8, 22: 3, 28: 1, 14: 2, 6: 2}
Did not match all atoms present	27755-28-8	CC1=CC=C(C=C1)COC	{1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	27757-85-3	C1=CSC(=C1)CN	{41: 1, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	27757-95-5	CC1=CC(=C(C=C1Cl)S(=O)(=O)O)NN=C2C3=CC=CC=C3C=C(C2=O)C(=O)O	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 20: 1, 25: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	27758-60-7	CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)N	{1: 2, 30: 1, 14: 8, 33: 1}
Did not match all atoms present	27765-48-6	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[In+3]	{16: 12}
Did not match all atoms present	27765-80-6	CC(CC1=CC=CC=C1)N(C)C(=O)C	{1: 3, 2: 1, 3: 1, 33: 1, 14: 5, 24: 1}
Did not match all atoms present	27766-21-8	C1C(=NNC(=S)NN=C2CC3=CC=CC=C3C=C2)C=CC4=CC=CC=C41	{34: 2, 7: 1, 11: 2, 14: 12, 15: 2, 31: 2}
Did not match all atoms present	27766-45-6	COC1=CC(=C(C=C1[N+]#N)OC)NC(=O)C2=CC=CC=C2	{1: 2, 34: 1, 14: 7, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	27766-47-8	COC1=CC(=C(C=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])OC)[N+]#N	{1: 2, 34: 3, 38: 1, 22: 2, 14: 6}
Did not match all atoms present	27774-13-6	[O-]S(=O)(=O)[O-].O=[V+2]	{29: 5}
Did not match all atoms present	27774-18-1	CCCC[PH+](CCCC)CCCC.[N-]=O.[N-]=O.[Co]I	{1: 3, 2: 9, 19: 1, 29: 2}
Did not match all atoms present	27778-78-5	CCC(C)C(CN(C)C)C1=CC(=C(C=C1)OC)Cl	{1: 5, 2: 2, 3: 2, 33: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	2778-04-3	COC1=COC(=CC1=O)CSP(=O)(OC)OC	{1: 3, 2: 1, 40: 1, 14: 2, 22: 3, 23: 1, 25: 1, 29: 1}
Did not match all atoms present	2778-41-8	CC(C)(C1=CC=C(C=C1)C(C)(C)N=C=O)N=C=O	{1: 4, 34: 2, 4: 2, 8: 2, 14: 4, 29: 2}
Did not match all atoms present	2778-42-9	CC(C)(C1=CC(=CC=C1)C(C)(C)N=C=O)N=C=O	{1: 4, 34: 2, 4: 2, 8: 2, 14: 4, 29: 2}
Did not match all atoms present	27784-76-5	CCOP(=O)(CC(=O)OC(C)(C)C)OCC	{1: 5, 2: 3, 4: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	2779-69-3	C1=CC=C(C=C1)C(=C(Cl)Cl)C2=CC=CC=C2	{17: 2, 14: 10, 7: 2}
Did not match all atoms present	27790-37-0	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[K+].[K+].[Sn+2].[Sn+2]	{29: 12}
Did not match all atoms present	27794-93-0	C(N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])P(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+].[K+]	{33: 1, 2: 3, 29: 9}
Did not match all atoms present	27798-46-5	C1=CC=C2C(=C1)C=CC3=C4C(=C5C(=C32)C=CC6=CC=CC=C65)C=CC7=CC=CC=C74	{14: 18}
Did not match all atoms present	27798-73-8	COC1=C(C=C(C=C1)CCC(=O)OC)OC	{1: 3, 2: 2, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	27807-50-7	C1CN1P(=O)(NC(=O)C2=CC=C(C=C2)Br)N3CC3	{33: 2, 11: 4, 14: 4, 18: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	27807-51-8	C1CN1P(=O)(NC(=O)C2=CC=C(C=C2)I)N3CC3	{33: 2, 11: 4, 14: 4, 19: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	27807-69-8	C1CN1P(=O)(NC(=O)C2=CC=C(C=C2)Cl)N3CC3	{33: 2, 11: 4, 14: 4, 17: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	2781-00-2	CC(C)(C)OOC(C)(C)C1=CC=C(C=C1)C(C)(C)OOC(C)(C)C	{1: 10, 4: 4, 22: 4, 14: 4}
Did not match all atoms present	2781-10-4	CCCCC(CC)C(=O)O[Sn](CCCC)(CCCC)OC(=O)C(CC)CCCC	{1: 6, 2: 14, 3: 2, 28: 2}
Did not match all atoms present	2781-11-5	CCOP(=O)(CN(CCO)CCO)OCC	{1: 2, 2: 7, 33: 1, 20: 2, 22: 2, 29: 1}
Did not match all atoms present	27816-53-1	CC1=CC2=C(C=C1)N(C=C2)C	{1: 2, 14: 5, 33: 1}
Did not match all atoms present	27816-82-6	C1=CC=C(C=C1)CC(=O)NC2=CC(=C(C=C2)Cl)Cl	{24: 1, 17: 2, 2: 1, 14: 8, 31: 1}
Did not match all atoms present	2782-91-4	CN(C)C(=S)N(C)C	{1: 4, 33: 2, 7: 1}
Did not match all atoms present	27822-88-4	CC1(COC(=[N+]1C)C=CC2=CC=C(C=C2)N(C)C)CO.[I-]	{1: 4, 2: 1, 6: 2, 33: 2, 11: 1, 13: 1, 14: 4, 15: 1, 19: 1, 20: 1, 23: 1}
Did not match all atoms present	2783-48-4	CCC(C)OP(=O)(C1=CC=CC=C1)OC(C)CC	{1: 4, 2: 2, 3: 2, 14: 5, 22: 2, 29: 1}
Did not match all atoms present	2783-94-0	C1=CC(=CC=C1N/N=C\2/C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 9, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	2783-98-4	C1(=NNN=N1)C2=NNN=N2	{32: 2, 35: 6}
Did not match all atoms present	27830-16-6	CCOC1=CC=CC(=C1)C(=O)NN	{1: 1, 2: 1, 14: 4, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	27831-13-6	CC1=C(C=C(C=C1)C=C)C	{1: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	27831-63-6	C1=CC(=CC=C1NN=C2C=C(C(=O)C(=NNC3=CC=C(C=C3)[N+](=O)[O-])C2=O)S(=O)(=O)O)[N+](=O)[O-]	{34: 2, 38: 2, 14: 9, 20: 1, 25: 2, 29: 2, 31: 2}
Did not match all atoms present	2784-73-8	CC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3C	{1: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 21: 1, 23: 1, 28: 1}
Did not match all atoms present	2784-86-3	CC(=O)NC1=C(C2=C(C=C1)C3=CC=CC=C3C2)O	{1: 1, 11: 1, 14: 6, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	2784-89-6	C1=CC=C(C=C1)NC2=C(C=C(C=C2)N)[N+](=O)[O-]	{38: 1, 30: 1, 14: 8, 31: 1}
Did not match all atoms present	2784-94-3	CNC1=C(C=C(C=C1)N(CCO)CCO)[N+](=O)[O-]	{1: 1, 2: 4, 38: 1, 33: 1, 14: 3, 20: 2, 31: 1}
Did not match all atoms present	27848-81-3	[Li+].C[C@H](C(=O)[O-])O	{24: 1, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	27848-84-6	CN1CC(CC2(C1CC3=CN(C4=CC=CC2=C34)C)OC)COC(=O)C5=CC(=CN=C5)Br	{1: 3, 2: 1, 35: 1, 33: 2, 11: 3, 12: 2, 13: 1, 14: 7, 18: 1, 22: 1, 28: 1}
Did not match all atoms present	2785-74-2	CC1=CC(=C(C=C1C)O)O	{1: 2, 21: 2, 14: 2}
Did not match all atoms present	2785-87-7	CCCC1=CC(=C(C=C1)O)OC	{1: 2, 2: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	2785-88-8	CCC1=CC(=C(C=C1)OC)O	{1: 2, 2: 1, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	2785-89-9	CCC1=CC(=C(C=C1)O)OC	{1: 2, 2: 1, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	2785-98-0	COC1=CC(=C(C=C1)OC)C(=O)O	{1: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	27858-32-8	CCOC(=O)/C=C(\[O-])/C.CCOC(=O)/C=C(\[O-])/C.CC([O-])C.CC([O-])C.[Ti+4]	{1: 8, 2: 2, 3: 2, 6: 2, 7: 2, 28: 2, 29: 2}
Did not match all atoms present	2786-19-8	CC1=C(C=CC(=C1)Cl)OC(C)C(=O)OC	{1: 3, 3: 1, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	2786-43-8	CN1C2=CC=CC=C2SC1=[Se]	{1: 1, 41: 1, 14: 4, 33: 1}
Did not match all atoms present	2786-62-1	CN1C2=CC=CC=C2SC1=O	{1: 1, 41: 1, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	2786-70-1	CN1C2=CC=CC=C2SC1=C3N(C4=CC=CC=C4S3)C	{1: 2, 41: 2, 33: 2, 14: 8, 15: 2}
Did not match all atoms present	2786-85-8	CC1=C(C=C(C=C1)Cl)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4C	{1: 2, 34: 1, 14: 12, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	27860-55-5	CCC1=CC2=CC3=NC(=CC4=C(C(=C([N+]4(CC)[O-])C(=C5C(=C(C(=N5)C(=C1N2)CC)CC)CC)CC)CC)CC)C=C3.[V]	{32: 1, 1: 8, 2: 8, 35: 2, 14: 5, 15: 12, 29: 1}
Did not match all atoms present	27860-83-9	[B-](F)(F)(F)F.[B-](F)(F)(F)F.O.[Zn+2]	{16: 8}
Did not match all atoms present	27863-17-8	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Ru+2]	{35: 6, 14: 24}
Did not match all atoms present	2787-79-3	C1(=C(C(=C(C(=C1F)F)O)F)F)C(F)(F)F	{16: 7, 4: 1, 21: 1}
Did not match all atoms present	2787-85-1	COC1=C(C(=C(C(=C1F)F)N=NC2=C(C(=C(C(=C2F)F)OC)F)F)F)F	{16: 8, 1: 2, 34: 2, 22: 2}
Did not match all atoms present	2787-93-1	CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)O[Sn](CCCCCCCC)(CCCCCCCC)CCCCCCCC	{1: 6, 2: 42, 22: 1}
Did not match all atoms present	27876-55-7	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC4=CC=CC=C4C3=N2	{1: 5, 2: 1, 35: 2, 4: 2, 33: 1, 14: 9, 21: 1}
Did not match all atoms present	2788-23-0	C1=CC=C2C(=C1)C3=CC=CC=C3N2N=O	{33: 1, 34: 1, 29: 1, 14: 8}
Did not match all atoms present	27884-36-2	C1=CC2=CN=CC3=CC=C1N23	{33: 1, 35: 1, 14: 6}
Did not match all atoms present	27884-38-4	C1=CC2=CC3=CC=C4N3C(=CC2=C1)C=C4	{33: 1, 14: 9}
Did not match all atoms present	2789-88-0	CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C	{1: 2, 10: 2, 14: 8}
Did not match all atoms present	2789-92-6	C1=C(C=C(C(=C1Cl)N)C(=O)O)Cl	{17: 2, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	27892-99-5	C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C2=CC=C(C=C2)[N+](=O)[O-]	{38: 2, 14: 8, 6: 2}
Did not match all atoms present	27893-41-0	CCCCCCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 6, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	27895-67-6	COC1=C(C=C(C=C1)C=NC2=CC=CC=C2)OC	{1: 2, 22: 2, 34: 1, 14: 8, 6: 1}
Did not match all atoms present	27896-84-0	C1=CC2=C(C=C1[N+](=O)[O-])NC=N2.[N+](=O)(O)[O-]	{32: 1, 35: 1, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	27897-08-1	CC1=CC(=C(C=C1S(=O)(=O)O)C)N	{1: 2, 30: 1, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	279-53-8	C1C2COP(O1)O2	{11: 2, 12: 1, 23: 3}
Did not match all atoms present	2790-09-2	CC1=CC(=C(C=C1C(=O)O)C(=O)O)C	{1: 2, 27: 2, 14: 2}
Did not match all atoms present	27905-02-8	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ga+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	27905-38-0	CN(C)C1=CC=CC(=C1)NC(=O)C2=CC=CC=C2	{24: 1, 1: 2, 33: 1, 14: 9, 31: 1}
Did not match all atoms present	27905-65-3	C=C(CCCC(=C)C1=CC=CC=C1)C2=CC=CC=C2	{2: 3, 5: 2, 14: 10, 7: 2}
Did not match all atoms present	27919-85-3	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC(=CC=C3)N(CC4=CC=CC=C4)CC5=CC=CC=C5	{33: 2, 2: 4, 14: 24}
Did not match all atoms present	2792-70-3	[14CH](=O)[O-].[Na+]	{26: 1}
Did not match all atoms present	27920-25-8	C1=CC=C(C=C1)C2=CC=CC=C2OCO	{2: 1, 20: 1, 22: 1, 14: 9}
Did not match all atoms present	27936-43-2	CCCCCCCCCC1=CC=CC=C1[O-].[K+]	{1: 1, 2: 8, 14: 4}
Did not match all atoms present	2794-60-7	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ba+2]	{16: 6, 4: 2, 29: 6}
Did not match all atoms present	27942-64-9	CCCCOC(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 3, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	27945-43-3	CC1=CC(=CC(=C1O)C)N2C(=NC3=CC=CC=C3C2=O)C	{1: 3, 35: 1, 33: 1, 14: 6, 21: 1, 25: 1}
Did not match all atoms present	27948-61-4	C[C@H](C1=CC=CO1)O	{1: 1, 3: 1, 20: 1, 14: 3, 23: 1}
Did not match all atoms present	27949-30-0	C1=CC(=CC(=C1)O)C2=C(C=CC=C2O)O	{21: 3, 14: 7}
Did not match all atoms present	27951-99-1	CC1=CC=CC(=C1)/C=C/C2=CC=CC=N2	{1: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	27955-94-8	CC(C1=CC=C(C=C1)O)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O	{1: 1, 4: 1, 21: 3, 14: 12}
Did not match all atoms present	27958-77-6	CN(C)CC1=CC(=CC=C1)N	{1: 2, 2: 1, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	27959-26-8	C1CC(C(C(C1)(COC(=O)C2=CN=CC=C2)COC(=O)C3=CN=CC=C3)O)(COC(=O)C4=CN=CC=C4)COC(=O)C5=CN=CC=C5	{2: 4, 35: 4, 11: 3, 12: 1, 13: 2, 14: 16, 20: 1, 28: 4}
Did not match all atoms present	27960-69-6	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ti+4]	{29: 8}
Did not match all atoms present	27969-53-5	CCN1C(=CC(=C2C(=O)N(C(=O)N(C2=O)CCOC)CCOC)C)SC3=C1C4=CC=CC=C4C=C3	{1: 4, 2: 5, 33: 3, 6: 1, 7: 1, 41: 1, 14: 6, 15: 2, 22: 2, 25: 3}
Did not match all atoms present	2797-51-5	C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)N	{17: 1, 25: 2, 30: 1, 14: 4, 15: 2}
Did not match all atoms present	2797-80-0	CCC1=CC(=C(C=C1)CC)C(=O)C	{24: 1, 1: 3, 2: 2, 14: 3}
Did not match all atoms present	27974-49-8	C(C[Se]CCO)O	{2: 4, 20: 2}
Did not match all atoms present	27982-34-9	CCC(C(=O)NC1=CC=CC(=C1)C(=O)CC(=O)NC2=CC=CC=C2OC)OC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC	{1: 8, 2: 4, 3: 1, 4: 2, 14: 11, 22: 2, 24: 3, 31: 2}
Did not match all atoms present	27982-36-1	CCC(C(=O)NC1=CC(=C(C=C1)Cl)NC(=O)CC(=O)C(C)(C)C)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC	{1: 10, 2: 4, 3: 1, 4: 3, 14: 6, 17: 1, 22: 1, 24: 3, 31: 2}
Did not match all atoms present	2799-07-7	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SC[C@@H](C(=O)O)N	{2: 1, 3: 1, 4: 1, 40: 1, 14: 15, 27: 1, 30: 1}
Did not match all atoms present	2799-19-1	C(CO)[NH3+].C(CO)[NH3+].C(=O)(C(=O)[O-])[O-]	{24: 2, 2: 4, 20: 2}
Did not match all atoms present	2799-58-8	CP(=O)(OCCCl)OCCCl	{1: 1, 2: 4, 29: 1, 22: 2, 17: 2}
Did not match all atoms present	2799-72-6	C(CN=C=S)CCl	{8: 1, 17: 1, 2: 3, 34: 1}
Did not match all atoms present	2799-73-7	C(CN=C=S)CBr	{8: 1, 2: 3, 34: 1, 18: 1}
Did not match all atoms present	27990-92-7	C1=CC(=CC=C1NC2=CC=C(C=C2)[N+]#N)[N+]#N.[O-]S(=O)(=O)[O-]	{34: 2, 29: 4, 14: 8, 31: 1}
Did not match all atoms present	27992-32-1	C1=CC(=O)NC(=C1)Br	{32: 1, 25: 1, 18: 1, 14: 3}
Did not match all atoms present	27993-42-6	CCC(C)C(=O)CC1=CC=CC=C1	{24: 1, 1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	27998-60-3	C1=CC=C(C=C1)S(=O)CCCl	{17: 1, 2: 2, 29: 1, 14: 5}
Did not match all atoms present	280-45-5	C1C2COP(O1)OC2	{11: 3, 12: 1, 23: 3}
Did not match all atoms present	280-64-8	[B]1C2CCCC1CCC2	{11: 6, 12: 2}
Did not match all atoms present	2800-96-6	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Sn+4]	{24: 4, 1: 4}
Did not match all atoms present	28002-18-8	CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)S(=O)(=O)[O-])C(=O)[O-])C.[Na+].[Na+]	{1: 2, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 24: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	28002-70-2	C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N)O[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O[C@@H]4[C@@H]([C@H]([C@@H]([C@@H](O4)CN)O)O)N)O)O)N.OS(=O)(=O)O	{2: 3, 11: 1, 12: 19, 20: 9, 22: 3, 23: 3, 29: 2, 30: 6}
Did not match all atoms present	28005-74-5	CC1=CC=CC=C1N(CCO)CCO	{1: 1, 2: 4, 20: 2, 14: 4, 33: 1}
Did not match all atoms present	28008-55-1	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(C)O)O)N)O	{1: 3, 3: 1, 11: 3, 12: 5, 13: 1, 14: 3, 20: 3, 21: 2, 22: 2, 23: 1, 25: 2, 30: 1}
Did not match all atoms present	2801-29-8	CC1=C2C=CC=C(C2=NC=C1)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	2801-68-5	CC(CC1=C(C=CC(=C1)OC)OC)N	{1: 3, 2: 1, 3: 1, 14: 3, 22: 2, 30: 1}
Did not match all atoms present	28014-46-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O.OP(=O)(O)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 3, 20: 4, 21: 1, 29: 1}
Did not match all atoms present	2802-61-1	C1=CN=C(N=C1F)F	{16: 2, 35: 2, 14: 2}
Did not match all atoms present	2802-62-2	C1=C(N=CN=C1F)F	{16: 2, 35: 2, 14: 2}
Did not match all atoms present	28022-43-7	C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)N	{17: 1, 3: 1, 30: 1, 14: 9}
Did not match all atoms present	28023-55-4	C1=CC=C(C=C1)OC2=CC(=CC(=C2)C(=O)O)C(=O)O	{27: 2, 22: 1, 14: 8}
Did not match all atoms present	2804-00-4	CN1C(=O)CC2(C1=O)CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F	{1: 1, 2: 3, 33: 2, 11: 5, 13: 1, 14: 4, 16: 1, 24: 1, 25: 2}
Did not match all atoms present	28044-40-8	CC(C)NC(=O)CN1CCN(CC1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC.C(=C\C(=O)O)\C(=O)O	{1: 5, 2: 1, 3: 1, 6: 4, 33: 2, 11: 4, 14: 2, 22: 3, 24: 2, 27: 2, 31: 1}
Did not match all atoms present	28048-33-1	C1=CC=NC(=C1)C2=NC(=C(N=N2)C3=CC=C(C=C3)S(=O)(=O)[O-])C4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+]	{35: 4, 29: 6, 14: 12}
Did not match all atoms present	28052-84-8	COC1=CC2=C(C=C1)NC=C2CC(C(=O)O)N	{32: 1, 1: 1, 2: 1, 3: 1, 14: 4, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	28053-14-7	CCCN=NC1=CC=CC=C1	{1: 1, 2: 2, 34: 2, 14: 5}
Did not match all atoms present	28054-61-7	F[Si](Cl)(Br)Br	{16: 1, 17: 1, 18: 2}
Did not match all atoms present	28056-05-5	CCOC(=O)C1=CC(=NC(=C1)Cl)N	{1: 1, 2: 1, 35: 1, 14: 2, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	28056-06-6	C1=C(C=C(N=C1N)Cl)C(=O)NN	{35: 1, 14: 2, 17: 1, 24: 1, 30: 2, 31: 1}
Did not match all atoms present	28056-56-6	C[Ge](C#C)(C#C)C#C	{1: 1, 10: 3, 9: 3}
Did not match all atoms present	28056-58-8	C[Ge](C)(C#C)C#C	{1: 2, 10: 2, 9: 2}
Did not match all atoms present	28058-62-0	C1CC[NH+](CC1)C2(CC[NH+](CC2)CCCN3C4=CC=CC=C4CCC5=C3C=C(C=C5)Cl)C(=O)N.[Cl-].[Cl-]	{33: 1, 2: 3, 11: 11, 13: 1, 14: 7, 17: 3, 24: 1, 30: 1}
Did not match all atoms present	28059-64-5	C1=CC=C(C=C1)CC2=CC=CC=C2N	{2: 1, 30: 1, 14: 9}
Did not match all atoms present	28060-76-6	CC(C)CCOP(=O)(OCCC(C)C)OP(=O)(O)O	{1: 4, 2: 4, 3: 2, 20: 2, 22: 3, 29: 2}
Did not match all atoms present	28064-96-2	CCCCCCCCCCCCCCCCCCOC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 18, 3: 1, 24: 1, 28: 1, 29: 3}
Did not match all atoms present	28069-69-4	C[PH+](C)C.C[PH+](C)C.C[PH+](C)C.C[PH+](C)C.[Ni]	{1: 12}
Did not match all atoms present	2808-86-8	C1=C(C(=C(C(=N1)Cl)Cl)Cl)Cl	{17: 4, 35: 1, 14: 1}
Did not match all atoms present	28080-86-6	CCC(C)(C)CC1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 14: 5}
Did not match all atoms present	28081-11-0	C1=CC=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)F)Cl	{16: 1, 17: 1, 14: 8, 6: 2, 24: 1}
Did not match all atoms present	28081-12-1	C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)F)Cl	{16: 1, 17: 1, 14: 8, 6: 2, 24: 1}
Did not match all atoms present	28081-14-3	COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)F)OC	{1: 2, 6: 2, 14: 7, 16: 1, 22: 2, 24: 1}
Did not match all atoms present	28081-18-7	C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)C2=CC=C(C=C2)F	{16: 1, 24: 1, 38: 1, 14: 8, 6: 2}
Did not match all atoms present	28089-05-6	CC1=C(C2=C(O1)C=CC(=C2)OC)CC[NH3+].[Cl-]	{1: 2, 2: 2, 14: 3, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	28089-06-7	COC1=C(C=C2C(=C1)C=CO2)CC[NH3+].[Cl-]	{1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	2809-21-4	CC(O)(P(=O)(O)O)P(=O)(O)O	{1: 1, 4: 1, 29: 2, 20: 5}
Did not match all atoms present	2809-64-5	CC1=CC=CC2=C1CCCC2	{1: 1, 11: 4, 14: 3}
Did not match all atoms present	28094-15-7	C1=C(C(=CC(=C1O)O)O)CCN.Cl	{17: 1, 2: 2, 30: 1, 21: 3, 14: 2}
Did not match all atoms present	28099-67-4	COCC[O-].COCC[O-].[Ca+2]	{1: 2, 2: 4, 29: 2, 22: 2}
Did not match all atoms present	281-33-4	C1C2CC3CC1OP(O2)O3	{11: 3, 12: 3, 23: 3}
Did not match all atoms present	281-44-7	C1[SiH]2C[SiH]3C[SiH]1C[SiH](C2)C3	{11: 6}
Did not match all atoms present	2810-04-0	CCOC(=O)C1=CC=CS1	{1: 1, 2: 1, 28: 1, 14: 3, 41: 1}
Did not match all atoms present	28115-85-7	CC1=CC=CC=C1C(=O)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4, 24: 1}
Did not match all atoms present	28115-86-8	CC1=CC=CC(=C1)C(=O)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4, 24: 1}
Did not match all atoms present	28115-92-6	C1=CC(=CC=C1C(=O)N=C=S)[N+](=O)[O-]	{8: 1, 24: 1, 34: 1, 38: 1, 14: 4}
Did not match all atoms present	28118-15-2	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CC)C=C4N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CC.[Br-]	{1: 3, 2: 3, 33: 2, 6: 2, 7: 1, 14: 16, 15: 1, 18: 1, 23: 2}
Did not match all atoms present	28118-53-8	C1=CC=C(C=C1)SCCCSC2=CC=CC=C2	{40: 2, 2: 3, 14: 10}
Did not match all atoms present	2812-73-9	CCOC(=S)Cl	{1: 1, 2: 1, 17: 1, 22: 1, 7: 1}
Did not match all atoms present	28122-24-9	CCC1=CC=CC(=C1)CC2=CC=CC=C2	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	28122-25-0	CCC1=CC=CC=C1CC2=CC=CC=C2	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	28122-27-2	CC1=CC(=CC(=C1)CC2=CC=CC=C2)C	{1: 2, 2: 1, 14: 8}
Did not match all atoms present	28128-40-7	C12=C(NC(=NC1=O)N)NC(=S)N2	{32: 3, 25: 1, 35: 1, 30: 1}
Did not match all atoms present	2813-62-9	[2H]C=C[2H]	{5: 2}
Did not match all atoms present	2813-95-8	CCC(C)C1=CC(=CC(=C1OC(=O)C)[N+](=O)[O-])[N+](=O)[O-]	{1: 3, 2: 1, 3: 1, 38: 2, 14: 2, 28: 1}
Did not match all atoms present	28131-80-8	CC(=O)NC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)Cl	{1: 1, 14: 6, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	28132-03-8	COC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)OC	{1: 2, 27: 2, 28: 2, 14: 2}
Did not match all atoms present	28137-55-5	CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 2: 1, 3: 1, 33: 1, 41: 1, 14: 8, 22: 1, 29: 3}
Did not match all atoms present	2814-20-2	CC1=CC(=O)N=C(N1)C(C)C	{32: 1, 1: 3, 3: 1, 14: 1, 35: 1, 25: 1}
Did not match all atoms present	2814-77-9	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=C(C=C(C=C3)[N+](=O)[O-])Cl	{34: 1, 38: 1, 14: 9, 15: 1, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	28140-60-5	C1=CC=C(C=C1)NC=CC=NC2=CC=CC=C2.Cl	{17: 1, 34: 1, 14: 10, 6: 3, 31: 1}
Did not match all atoms present	28141-13-1	CCN1C(=O)C=C(C(=C1O)C#N)C	{1: 2, 2: 1, 37: 1, 33: 1, 14: 1, 21: 1, 25: 1}
Did not match all atoms present	28143-91-1	C1=CC=C(C=C1)[C@@H]([C@H](CO)N)O	{2: 1, 3: 2, 20: 2, 30: 1, 14: 5}
Did not match all atoms present	28149-15-7	C1=CC=C2C3=C(C=C(C=C3)[N+](=O)[O-])C(C2=C1)O	{20: 1, 12: 1, 38: 1, 14: 7}
Did not match all atoms present	28149-22-6	CC1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC	{1: 2, 34: 2, 14: 8, 31: 1}
Did not match all atoms present	2815-95-4	C1OC2=C(O1)C=C(C=C2)CCC(=O)O	{27: 1, 2: 2, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	2816-39-9	C1=CC=C(C=C1)[Ge](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[Ge](C2=CC=CC=C2)C3=CC=CC=C3	{14: 30}
Did not match all atoms present	28161-39-9	CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)C(=O)[O-])C.[Na+]	{1: 4, 3: 1, 11: 5, 12: 1, 13: 2, 14: 3, 24: 1}
Did not match all atoms present	28162-11-0	CCC(C)(C)C1=CC=C(C=C1)CCl	{1: 3, 2: 2, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	28163-00-0	C1=CC(=C(C=C1[N+](=O)[O-])Cl)C#N	{17: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	28163-64-6	C[C@@H](CN)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	28164-88-7	C[C@@H]1C[C@]2([C@H]3[C@H]4[C@]1([C@@H]5C=C(C(=O)[C@]5([C@@H]([C@@]6([C@H]4O6)CO)O)O)C)O[C@](O3)(O2)C7=CC=CC=C7)C(=C)C	{1: 3, 2: 1, 5: 1, 7: 1, 11: 1, 12: 6, 13: 5, 14: 6, 15: 1, 20: 3, 23: 4, 25: 1}
Did not match all atoms present	28165-72-2	CC(=O)OC1=C(C=CC=C1Br)Br	{1: 1, 18: 2, 28: 1, 14: 3}
Did not match all atoms present	28165-73-3	CC(=O)OC1=C(C=CC=C1I)I	{1: 1, 19: 2, 28: 1, 14: 3}
Did not match all atoms present	28166-41-8	C1=CC(=CC=C1C=C(C#N)C(=O)O)O	{37: 1, 6: 1, 7: 1, 14: 4, 21: 1, 27: 1}
Did not match all atoms present	28169-46-2	CC1=C(C=C(C=C1C(=O)O)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 27: 1, 38: 2, 14: 2}
Did not match all atoms present	28177-48-2	C1=CC(=C(C(=C1)F)O)F	{16: 2, 21: 1, 14: 3}
Did not match all atoms present	28178-42-9	CC(C)C1=C(C(=CC=C1)C(C)C)N=C=O	{1: 4, 34: 1, 3: 2, 8: 1, 14: 3, 29: 1}
Did not match all atoms present	2818-20-4	CNC1=CC=CC(=C1)N=NC2=CC=CC=C2	{1: 1, 34: 2, 14: 9, 31: 1}
Did not match all atoms present	2818-58-8	C1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O	{2: 1, 12: 5, 14: 5, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	2818-66-8	C1=CC2=C(C=C1N)NC(=S)N2	{32: 2, 30: 1, 14: 3}
Did not match all atoms present	2818-69-1	CC1=NC2=C(N1)C=C(C=C2)Cl	{32: 1, 1: 1, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	2818-76-0	CCN1C(=NC2=C1C=CC(=C2)Cl)C	{1: 2, 2: 1, 35: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	2818-88-4	CC1=NC2=CC=CC=C2[Se]1	{1: 1, 35: 1, 14: 4}
Did not match all atoms present	28181-92-2	C1=CC2=C(C(=C1)S(=O)(=O)O)C(=O)OC2=O	{28: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	28188-41-2	C1=CC(=CC(=C1)CBr)C#N	{2: 1, 18: 1, 14: 4, 37: 1}
Did not match all atoms present	2819-41-2	C1=CC=C(C=C1)C(CCCCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 4, 3: 2, 14: 20}
Did not match all atoms present	2819-86-5	CC1=C(C(=C(C(=C1C)C)O)C)C	{1: 5, 21: 1}
Did not match all atoms present	28192-05-4	C1CN1C2=CC=C(C=C2)Cl	{17: 1, 11: 2, 14: 4, 33: 1}
Did not match all atoms present	2820-37-3	CC1=C(NN=C1)C	{32: 1, 1: 2, 35: 1, 14: 1}
Did not match all atoms present	2820-51-1	CN1CCC[C@H]1C2=CN=CC=C2.Cl	{1: 1, 35: 1, 33: 1, 11: 3, 12: 1, 14: 4, 17: 1}
Did not match all atoms present	28202-32-6	C1=CC(=CC=C1[N+](=O)[O-])OC(C(F)F)(F)F	{3: 1, 4: 1, 38: 1, 14: 4, 16: 4, 22: 1}
Did not match all atoms present	282089-75-2	CO[Si](CCCN(C1=CC=CC=C1)C(=O)NCC2CCCC(C2)CN=C=O)(OC)OC	{1: 3, 2: 5, 33: 1, 8: 1, 11: 4, 12: 2, 34: 1, 14: 5, 22: 3, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	282089-87-6	CO[Si](CCCN(C1=CC=CC=C1)C(=O)NCC2CCCC(C2)CNC(=O)N(CCC[Si](OC)(OC)OC)C3=CC=CC=C3)(OC)OC	{1: 6, 2: 8, 33: 2, 11: 4, 12: 2, 14: 10, 22: 6, 24: 2, 31: 2}
Did not match all atoms present	28211-96-3	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C(=C5C(=C(C(=N5)C=C1N2)C)C(=O)OC)CC(=O)OC)CCC(=O)OC)C)C)CC)C	{32: 2, 1: 9, 2: 5, 35: 2, 14: 3, 28: 3}
Did not match all atoms present	28215-72-7	CCCCCCCCC=CCCCCCCCCOP(=O)(O)OCCCCCCCCC=CCCCCCCCC.CCCCN(CCCC)CCO	{1: 4, 2: 38, 6: 4, 33: 1, 20: 2, 22: 2, 29: 1}
Did not match all atoms present	28217-87-0	C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=NC=CN=C3	{35: 2, 3: 1, 14: 13}
Did not match all atoms present	28217-91-6	CCCCCCC1=NC=CN=C1	{1: 1, 2: 5, 35: 2, 14: 3}
Did not match all atoms present	28217-95-0	C1=CC=C(C=C1)CC2=NC=CN=C2	{2: 1, 35: 2, 14: 8}
Did not match all atoms present	2822-41-5	C1=CC(=C(C(=C1O)F)F)F	{16: 3, 21: 1, 14: 2}
Did not match all atoms present	28227-92-1	CC1C(=O)NC2CC3=C(NC4=CC=CC=C34)SCC(C(=O)N5CC(CC5C(=O)N1)O)NC(=O)C(NC(=O)C(NC(=O)C(NC2=O)CC(C)(C)O)C)C(C)O	{32: 7, 1: 5, 2: 1, 3: 1, 4: 1, 33: 1, 41: 1, 11: 4, 12: 8, 14: 4, 20: 3, 25: 7}
Did not match all atoms present	28229-69-8	C1=CC(=CC(=C1)Br)CCO	{2: 2, 20: 1, 18: 1, 14: 4}
Did not match all atoms present	2823-90-7	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=CC=C3F	{1: 1, 11: 1, 14: 6, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	2823-91-8	CC(=O)NC1=CC(=C2C(=C1)CC3=CC=CC=C32)F	{1: 1, 11: 1, 14: 6, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	2823-93-0	CC(=O)NC1=C(C=C2C(=C1)CC3=CC=CC=C32)F	{1: 1, 11: 1, 14: 6, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	2823-94-1	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=CC(=C3)F	{1: 1, 11: 1, 14: 6, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	2823-95-2	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C(=CC=C3)F	{1: 1, 11: 1, 14: 6, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	28230-32-2	C1=CC=C2C(=C1)C(=O)N(N=N2)O	{25: 1, 35: 2, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	28235-14-5	[K+].[K+].[K+].[Br-].[Br-].[Br-].[Br-].[Br-].[Br-].[Ir+3]	{18: 6}
Did not match all atoms present	28235-15-6	O.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[K+].[K+].[Ir+3]	{17: 5}
Did not match all atoms present	28235-81-6	CC(C)(C)C1=NN=C(S1)NC(=O)NC2=CC=CC=C2	{1: 3, 35: 2, 4: 1, 41: 1, 14: 5, 24: 1, 31: 2}
Did not match all atoms present	2824-10-4	CC(=O)NC1=C(C2=C(C=C1)C3=CC=CC=C3C2)F	{1: 1, 11: 1, 14: 6, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	28240-66-6	C1=CC=C(C=C1)PCCCPC2=CC=CC=C2	{2: 3, 14: 10}
Did not match all atoms present	28240-69-9	C(CP(Cl)Cl)P(Cl)Cl	{17: 4, 2: 2}
Did not match all atoms present	28241-06-7	C1CN=C(N1)C(C2=CC=C(C=C2)Cl)C3=CNC(=O)C=C3.C(=C/C(=O)O)\C(=O)O	{32: 2, 3: 1, 6: 2, 11: 2, 14: 7, 15: 1, 17: 1, 35: 1, 25: 1, 27: 2}
Did not match all atoms present	28249-77-6	CCN(CC)C(=O)SCC1=CC=C(C=C1)Cl	{1: 2, 2: 3, 33: 1, 40: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	2825-00-5	CC1=C(OC(=C(C1=O)C)OC)[C@H]2CC/C(=C/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C)/O2	{1: 4, 38: 1, 6: 2, 7: 1, 11: 2, 12: 1, 14: 4, 15: 1, 22: 1, 23: 2, 25: 1}
Did not match all atoms present	2826-28-0	CN(C)C1=CC=C(C=C1)C=C(C#N)C#N	{1: 2, 37: 2, 6: 1, 33: 1, 7: 1, 14: 4}
Did not match all atoms present	2826-32-6	C1=CC(=CC(=C1)[N+](=O)[O-])C=C(C#N)C#N	{37: 2, 38: 1, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	2826-80-4	CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)NC)OC)OC)OC	{1: 5, 11: 2, 12: 1, 14: 4, 22: 3, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	28265-17-0	CCC1=CC2=CC3=NC(=CC4=C(C(=C(N4CC)C(=C5C(=C(C(=N5)C(=C1N2)CC)CC)CC)CC)CC)CC)C=C3.[Cl-].[Cl-].[Cl-].[Mn+3]	{32: 1, 1: 8, 2: 8, 35: 2, 33: 1, 14: 5, 17: 3}
Did not match all atoms present	2827-46-5	CNC1=NC(=NC(=N1)NC)NC	{1: 3, 35: 3, 31: 3}
Did not match all atoms present	28279-27-8	CCN1C(=CC(=C2C(=O)N(C(=O)N(C2=O)CCOC)CCOC)C=C3N(C4=C(S3)C=CC5=CC=CC=C54)CC)SC6=C1C7=CC=CC=C7C=C6	{1: 4, 2: 6, 33: 4, 6: 2, 7: 1, 41: 2, 14: 12, 15: 3, 22: 2, 25: 3}
Did not match all atoms present	28279-41-6	CC1=C(C=C2C(=N1)N=CN2)Br	{32: 1, 1: 1, 18: 1, 35: 2, 14: 2}
Did not match all atoms present	2828-42-4	CC(=NOC(=O)NC1=CC=CC=C1)C	{1: 2, 34: 1, 7: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	2828-65-1	CC1=C(C=C(C=C1)SC2=CC=CC=C2)C	{40: 1, 1: 2, 14: 8}
Did not match all atoms present	28281-49-4	CCC(=O)C1=CC2=C(C=C1)OCO2	{1: 1, 2: 1, 11: 1, 14: 3, 23: 2, 24: 1}
Did not match all atoms present	28289-54-5	CN1CCC(=CC1)C2=CC=CC=C2	{1: 1, 11: 3, 33: 1, 14: 6, 15: 1}
Did not match all atoms present	28294-55-5	C1=CC(=CC(=C1)Cl)NC2=CC(=C(C=C2C(=O)O)NC3=CC(=CC=C3)Cl)C(=O)O	{17: 2, 27: 2, 14: 10, 31: 2}
Did not match all atoms present	28294-58-8	CCCCCCCCCCCCCCCCC1=CC(=C(C=C1)O)C(=O)O	{1: 1, 2: 15, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	283-56-7	B12OCCN(CCO1)CCO2	{33: 1, 11: 6, 23: 3}
Did not match all atoms present	283-60-3	C1CO[Si]2OCCN1CCO2	{33: 1, 11: 6, 23: 3}
Did not match all atoms present	28300-74-5	C12C(O[Sb]3OC(C(O[Sb](O1)OC2=O)C(=O)[O-])C(=O)O3)C(=O)[O-].O.O.O.[K+].[K+]	{24: 2, 28: 2, 12: 4, 23: 4}
Did not match all atoms present	28303-42-6	CCCCCCCCCCCCOC=O	{1: 1, 2: 11, 26: 1}
Did not match all atoms present	28308-00-1	CN(C)CCN(C)C.Cl[Zn]Cl	{1: 4, 2: 2, 33: 2, 17: 2}
Did not match all atoms present	28308-02-3	CCCCP(=[Co]Br)(CCCC)CCCC.[N-]=O.[N-]=O	{1: 3, 2: 9, 18: 1, 29: 2}
Did not match all atoms present	28308-70-5	C[Sn](=O)O[Sn](=O)C	{1: 2, 29: 2, 22: 1}
Did not match all atoms present	2831-60-9	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OCCO	{2: 2, 38: 2, 20: 1, 22: 1, 14: 3}
Did not match all atoms present	28313-53-3	COC(=O)C(=NNC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C#N	{1: 1, 34: 1, 4: 2, 37: 1, 7: 1, 14: 3, 16: 6, 28: 1, 31: 1}
Did not match all atoms present	28314-03-6	CC(=O)NC1=CC=CC2=C1CC3=CC=CC=C32	{24: 1, 1: 1, 11: 1, 14: 7, 31: 1}
Did not match all atoms present	28314-80-9	C1=C(C=C(C(=C1F)C(=O)O)F)F	{16: 3, 27: 1, 14: 2}
Did not match all atoms present	28315-93-7	C1CC2=C(C=CC=C2O)C(=O)C1	{25: 1, 11: 3, 21: 1, 14: 3}
Did not match all atoms present	2832-40-8	CC1=C/C(=N/NC2=CC=C(C=C2)NC(=O)C)/C(=O)C=C1	{1: 2, 34: 1, 14: 7, 15: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	2832-49-7	CCN(CC)S(=O)(=O)N(CC)CC	{1: 4, 2: 4, 29: 2, 33: 2}
Did not match all atoms present	28322-02-3	CC(=O)NC1=CC=CC2=C1C3=CC=CC=C3C2	{24: 1, 1: 1, 11: 1, 14: 7, 31: 1}
Did not match all atoms present	28330-86-1	CC(=C)C1=NC(=NC(=N1)N(C)C2=CC=CC=C2)N	{1: 2, 35: 3, 5: 1, 33: 1, 7: 1, 14: 5, 30: 1}
Did not match all atoms present	28334-98-7	CCOC1=CC(=CC(=C1)O)O	{1: 1, 2: 1, 22: 1, 21: 2, 14: 3}
Did not match all atoms present	28334-99-8	CCCOC1=CC(=CC(=C1)O)OCCC	{1: 2, 2: 4, 22: 2, 21: 1, 14: 3}
Did not match all atoms present	2834-79-9	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC(=N3)N	{41: 1, 35: 1, 30: 1, 14: 10}
Did not match all atoms present	2834-92-6	C1=CC=C2C(=C1)C=CC(=C2N)O	{30: 1, 21: 1, 14: 6}
Did not match all atoms present	28341-53-9	COC(=O)CCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	28341-66-4	CC1=C(C=CC(=C1O)SC2=C(C(=C(C=C2)O)C)O)O	{40: 1, 1: 2, 21: 4, 14: 4}
Did not match all atoms present	28341-67-5	CC1=C(C=CC(=C1O)S(=O)C2=C(C(=C(C=C2)O)C)O)O	{1: 2, 21: 4, 14: 4, 29: 1}
Did not match all atoms present	28341-68-6	C1=C(C(=CC(=C1O)Cl)SC2=CC(=C(C=C2O)O)Cl)O	{40: 1, 17: 2, 21: 4, 14: 4}
Did not match all atoms present	28348-54-1	CC(C)C1=C(C(=CC=C1)S(=O)(=O)[O-])C(C)C.[Na+]	{1: 4, 3: 2, 29: 3, 14: 3}
Did not match all atoms present	2835-04-3	C1=CC(=C(C=C1N)S(=O)(=O)O)O	{30: 1, 20: 1, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	2835-06-5	C1=CC=C(C=C1)C(C(=O)O)N	{27: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	2835-21-4	C=CC[N+]#[C-]	{2: 1, 34: 1, 5: 1, 6: 1}
Did not match all atoms present	2835-33-8	C=CCC1=CC=CC=N1	{35: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	2835-58-7	C1=CC=C(C=C1)N=NC2=CC=CC=C2N	{34: 2, 30: 1, 14: 9}
Did not match all atoms present	2835-61-2	C1=CC=C2C(=C1)C=CC=C2N=NC3=CC=C(C4=CC=CC=C43)N	{34: 2, 30: 1, 14: 13}
Did not match all atoms present	2835-68-9	C1=CC(=CC=C1C(=O)N)N	{24: 1, 30: 2, 14: 4}
Did not match all atoms present	2835-77-0	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2N	{24: 1, 30: 1, 14: 9}
Did not match all atoms present	2835-78-1	C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)N	{24: 1, 30: 1, 14: 9}
Did not match all atoms present	2835-95-2	CC1=C(C=C(C=C1)N)O	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	2835-96-3	CC1=C(C=CC(=C1)N)O	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	2835-97-4	CC1=C(C(=CC=C1)O)N	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	2835-98-5	CC1=CC(=C(C=C1)N)O	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	2835-99-6	CC1=C(C=CC(=C1)O)N	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	28356-58-3	C1=CN=CC=C1CC(=O)O	{35: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	28357-52-0	CN1CCCC1C2=CN=CC=C2.Cl.Cl	{1: 1, 35: 1, 33: 1, 11: 3, 12: 1, 14: 4, 17: 2}
Did not match all atoms present	2836-00-2	CC1=C(C=C(C=C1)O)N	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	2836-03-5	CN(C)C1=CC=CC=C1N	{1: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	2836-04-6	CN(C)C1=CC=CC(=C1)N	{1: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	2836-32-0	C(C(=O)[O-])O.[Na+]	{24: 1, 2: 1, 20: 1}
Did not match all atoms present	2836-82-0	CC(=O)CC1=CC=CC=C1F	{16: 1, 1: 1, 2: 1, 14: 4, 24: 1}
Did not match all atoms present	28361-43-5	CC1=C(C=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)C)C)C	{1: 4, 29: 2, 14: 6}
Did not match all atoms present	2839-37-4	C1=C(C=C(C(=C1Br)Br)F)Br	{16: 1, 18: 3, 14: 2}
Did not match all atoms present	28390-42-3	CC1=C2C=CC3=C4C2=C(C=C1)C=CC4=CC=C5C3=CC=C5	{1: 1, 14: 11}
Did not match all atoms present	28390-91-2	C1C(O1)CCl.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N	{2: 2, 11: 1, 12: 1, 14: 8, 17: 1, 23: 1, 30: 2}
Did not match all atoms present	28395-03-1	CCCCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2	{1: 1, 2: 3, 14: 7, 22: 1, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	2840-26-8	COC1=C(C=C(C=C1)C(=O)O)N	{1: 1, 30: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	2840-28-0	C1=CC(=C(C=C1C(=O)O)N)Cl	{17: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	28407-37-6	C1=CC(=C(C=C1C2=CC(=C(C=C2)N/N=C/3\C(=O)C4=C(C=C(C=C4C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])N)O)O)N/N=C/5\C(=O)C6=C(C=C(C=C6C=C5S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+].[Na+].[Cu].[Cu]	{34: 2, 14: 12, 15: 4, 21: 2, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	28407-51-4	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Rh].[Rh].[Rh].[Rh].[Rh].[Rh]	{29: 16}
Did not match all atoms present	28416-66-2	CC(C)C(CC(C)N(C)C)(C#N)C1=CC=CC=C1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 5, 2: 3, 3: 2, 4: 2, 37: 1, 33: 1, 14: 5, 20: 1, 27: 3}
Did not match all atoms present	2842-37-7	C1=CC=C(C=C1)CCNCCO	{2: 4, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	28425-04-9	CCP(CC)CC.CCP(CC)CC.Cl[Pd]Cl	{1: 6, 2: 6, 17: 2}
Did not match all atoms present	28427-24-9	C[N+](C)(C)CCOS(=O)O	{1: 3, 2: 2, 20: 1, 29: 1, 22: 1}
Did not match all atoms present	28434-86-8	C1=CC(=C(C=C1OC2=CC(=C(C=C2)N)Cl)Cl)N	{17: 2, 30: 2, 22: 1, 14: 6}
Did not match all atoms present	28439-86-3	CCCCOC1=CC=C(C=C1)N=C=O	{1: 1, 2: 3, 8: 1, 34: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	2844-17-9	CN(C)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C#N	{1: 2, 37: 1, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	2844-19-1	CN(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)Br	{1: 2, 18: 1, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	2844-24-8	CN(C)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)OC	{1: 3, 22: 1, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	28443-50-7	C1=CC(=C(C=C1Cl)O)N	{17: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	28446-68-6	COC1=CC=C(C=C1)/C=C/C#N	{1: 1, 22: 1, 14: 4, 6: 2, 37: 1}
Did not match all atoms present	28446-70-0	CC1=CC=C(C=C1)/C=C/C#N	{1: 1, 14: 4, 6: 2, 37: 1}
Did not match all atoms present	28447-26-9	COP(=O)(CN1C(=O)C2=CC=CC=C2C1=O)OC	{1: 2, 2: 1, 33: 1, 14: 4, 22: 2, 25: 2, 29: 1}
Did not match all atoms present	28449-98-1	CC1=CC(=C(C(=C1C)C)O)C	{1: 4, 21: 1, 14: 1}
Did not match all atoms present	284493-53-4	CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)OC	{1: 4, 2: 1, 3: 1, 4: 1, 14: 4, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	284493-65-8	CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=C(C=C1)Cl	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 17: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	284493-67-0	CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)Cl	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 17: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	284493-72-7	CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=C(C=C1)F	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	2845-62-7	C1=CC=C(C=C1)S(=O)(=O)N=C=O	{8: 1, 34: 1, 29: 3, 14: 5}
Did not match all atoms present	2845-78-5	C1=CC=C(C=C1)C2=C(C(=NN2)N)Br	{32: 1, 18: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	2845-82-1	C1=CN=CC=C1C2=NNC(=O)O2	{32: 1, 35: 2, 28: 1, 14: 4}
Did not match all atoms present	2845-89-8	COC1=CC(=CC=C1)Cl	{1: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	28452-78-0	CC(C)CCCCCC1=CC2=C(C=C1)NC3=C(S2)C=C(C=C3)CCCCCC(C)C	{32: 1, 1: 4, 2: 10, 3: 2, 41: 1, 14: 6}
Did not match all atoms present	28453-20-5	CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC=C(C=C1)O	{1: 3, 4: 1, 5: 1, 14: 9, 21: 2}
Did not match all atoms present	28453-24-9	C1=C(C=C2C(=C1[N+](=O)[O-])C3=C(C=C(C=C3N2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 38: 4, 14: 4}
Did not match all atoms present	2846-11-9	CCOC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(/C(=N\NC3=CC=C(C=C3)C4=NC5=C(S4)C=C(C=C5)C)/C2=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 1, 35: 1, 41: 1, 34: 1, 14: 10, 15: 2, 22: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	2846-89-1	C1=NC(=S)C(=C(N1)N)N	{32: 1, 35: 1, 30: 2, 14: 1}
Did not match all atoms present	28460-01-7	CCOP(=O)(CSC)OCC	{40: 1, 1: 3, 2: 3, 29: 1, 22: 2}
Did not match all atoms present	28466-21-9	CC1=C(C(=NN1C)C)N	{1: 3, 35: 1, 30: 1, 33: 1}
Did not match all atoms present	28466-26-4	C1=C(C=NN1)N	{32: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	28467-92-7	CCC(=CC1=CC=CC=C1)C=O	{1: 1, 2: 1, 6: 1, 7: 1, 14: 5, 26: 1}
Did not match all atoms present	28469-92-3	C=CC1=C(C=CC=C1Cl)Cl	{17: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	2847-16-7	CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 16}
Did not match all atoms present	2847-30-5	CC1=NC=CN=C1OC	{1: 2, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	2847-65-6	CC(=O)NC1=CC=C(C=C1)C(=O)O[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{24: 1, 1: 1, 28: 1, 14: 19, 31: 1}
Did not match all atoms present	28479-19-8	CSC1=CC=CC(=C1)N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 40: 1, 29: 1}
Did not match all atoms present	28479-22-3	CC1=C(C=C(C=C1)N=C=O)Cl	{1: 1, 34: 1, 8: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	2848-25-1	CC(=O)OC1=CC=CC=C1O	{1: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	2848-62-6	C[Ge](C)(C)CC1=CC=CC=C1	{1: 3, 2: 1, 14: 5}
Did not match all atoms present	28480-77-5	C1CC(CCC1CC2=CC=C(C=C2)N)N	{2: 1, 11: 4, 12: 2, 30: 2, 14: 4}
Did not match all atoms present	28486-22-8	[O]P(=O)([O-])F	{16: 1, 29: 3}
Did not match all atoms present	28488-34-8	CCC(=O)[O-]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	28489-45-4	CC1=C(C=CC(=O)N1)[N+](=O)[O-]	{32: 1, 1: 1, 38: 1, 14: 2, 25: 1}
Did not match all atoms present	28491-95-4	CCNC1=C(C=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 17: 1, 31: 1}
Did not match all atoms present	28493-54-1	CCCC[Sn](CCCC)(CCCC)CC1=CC=CC=C1	{1: 3, 2: 10, 14: 5}
Did not match all atoms present	2850-19-3	CCOC(=O)CS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 2, 28: 1, 29: 2, 14: 4}
Did not match all atoms present	2850-40-0	CC(C)C1=NC2=C(N1)C(=O)N(C(=O)N2C)C	{32: 1, 1: 4, 3: 1, 33: 2, 35: 1, 25: 2}
Did not match all atoms present	2850-41-1	CCCC1=NC2=C(N1)C(=O)N(C(=O)N2C)C	{32: 1, 1: 3, 2: 2, 35: 1, 33: 2, 25: 2}
Did not match all atoms present	2850-61-5	CCCC[As](=O)(CCCC)O	{1: 2, 2: 6, 20: 1, 29: 1}
Did not match all atoms present	2850-78-4	CN(C1=CC=CC=C1)C2=NC=CN=C2CC[Si](C)(C)C	{1: 4, 2: 2, 35: 2, 14: 7, 33: 1}
Did not match all atoms present	28503-70-0	CC1=CC=CC=C1[O-].CC1=CC=CC=C1[O-].CC1=CC=CC=C1[O-].CC1=CC=CC=C1[O-].[Ti+4]	{1: 4, 14: 16}
Did not match all atoms present	28504-80-5	C1=CSC(=C1Br)SC2=C(C=CS2)Br	{40: 1, 41: 2, 18: 2, 14: 4}
Did not match all atoms present	28504-81-6	C1=C(C(=CS1)Br)SC2=CSC=C2Br	{40: 1, 41: 2, 18: 2, 14: 4}
Did not match all atoms present	28504-85-0	C1=C2C3=CSC=C3S(=O)(=O)C2=CS1	{41: 2, 29: 2, 14: 4}
Did not match all atoms present	28504-86-1	C1=CSC2=C1C3=C(S2(=O)=O)SC=C3	{41: 2, 29: 2, 14: 4}
Did not match all atoms present	28505-89-7	CC(=O)NC1=CC(=CC=C1)N(CCC#N)CCOC(=O)C	{1: 2, 2: 4, 37: 1, 33: 1, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	2851-09-4	C1CCN(CC1)C2=NC3=CC=CC=C3O2	{33: 1, 11: 5, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	2851-73-2	B=P(N(C)C)(F)F	{16: 2, 1: 2, 33: 1}
Did not match all atoms present	2851-94-7	C=CN1C=CN=C1C2=CC=CC=C2	{33: 1, 14: 7, 35: 1, 5: 1, 6: 1}
Did not match all atoms present	2851-95-8	CC1=NC=CN1C=C	{1: 1, 35: 1, 5: 1, 6: 1, 33: 1, 14: 2}
Did not match all atoms present	28512-55-2	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C5=CC=CC6=C5C4=CC7=CC=CC=C67	{14: 16}
Did not match all atoms present	28515-57-3	C1=CC=C2C(=C1)C=CC=C2CC3=CC=CC4=CC=CC=C43	{2: 1, 14: 14}
Did not match all atoms present	28517-81-9	CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{1: 3, 2: 1, 4: 1, 14: 8, 20: 1, 21: 1, 22: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	28519-50-8	CC1=CC=C(C=C1)S(=O)(=S)[O-].[K+]	{1: 1, 29: 2, 14: 4}
Did not match all atoms present	28522-57-8	CC1=CC2=C(C=C1)N=C3C4=CC=CC=C4N=C5N3C2=NC6=CC=CC=C65	{1: 1, 35: 3, 14: 11, 33: 1}
Did not match all atoms present	28529-99-9	[Na+].[Na+].Br[Ir-2](Br)(Br)(Br)(Br)Br	{18: 6}
Did not match all atoms present	28543-87-5	CCN1C2=CC(=C(C=C2N(C1=CC=C3C(=O)N(C(=S)S3)CC)CCN(CC)CC)Cl)Cl	{1: 4, 2: 6, 6: 2, 33: 4, 41: 1, 14: 2, 15: 3, 17: 2, 25: 1}
Did not match all atoms present	28547-23-1	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)O	{27: 1, 28: 1, 14: 9}
Did not match all atoms present	28553-12-0	CC(C)CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCC(C)C	{1: 4, 2: 12, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	28556-81-2	CC1=C(C(=CC=C1)C)N=C=O	{8: 1, 1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	28557-25-7	CN1C2=C(C(=O)N(C1=O)C)N3CCN(C3=N2)CC=C	{1: 2, 2: 1, 35: 1, 5: 1, 6: 1, 33: 4, 11: 2, 25: 2}
Did not match all atoms present	2856-63-5	C1=CC=C(C(=C1)CC#N)Cl	{17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	2856-74-8	CC1=NC=CN=C1N2CCCCC2	{1: 1, 11: 5, 35: 2, 14: 2, 33: 1}
Did not match all atoms present	2856-75-9	CC1=NC=CN=C1N2CCCCC2.OS(=O)(=O)O	{1: 1, 35: 2, 33: 1, 11: 5, 14: 2, 20: 2, 29: 2}
Did not match all atoms present	28562-58-5	C1C(NC1=O)OC(=O)C2=CC=CC=C2	{32: 1, 11: 1, 12: 1, 14: 5, 25: 1, 28: 1}
Did not match all atoms present	28566-83-8	[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)[O-])[O-].[Cu+2]	{30: 1, 34: 2, 29: 9, 14: 6}
Did not match all atoms present	2857-03-6	CCCC[Sn](CCCC)(CCCC)OC(=O)C1=CC=C(C=C1)NC(=O)C	{1: 4, 2: 9, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	2857-97-8	C[Si](C)(C)Br	{1: 3, 18: 1}
Did not match all atoms present	28570-25-4	CCCCCCCCCCCC(=O)OCCS[Sn](CCCCCCCC)(CCCCCCCC)SCCOC(=O)CCCCCCCCCCC	{40: 2, 1: 4, 2: 38, 28: 2}
Did not match all atoms present	28573-66-2	CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C.Cl.Cl[Zn]Cl	{1: 3, 2: 2, 40: 1, 34: 1, 14: 6, 17: 3, 22: 2}
Did not match all atoms present	28588-74-1	CC1=C(C=CO1)S	{1: 1, 39: 1, 14: 2, 23: 1}
Did not match all atoms present	28588-75-2	CC1=C(C=CO1)SSC2=C(OC=C2)C	{40: 2, 1: 2, 14: 4, 23: 2}
Did not match all atoms present	2859-67-8	C1=CC(=CN=C1)CCCO	{2: 3, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	2859-68-9	C1=CC=NC(=C1)CCCO	{2: 3, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	2859-78-1	COC1=C(C=C(C=C1)Br)OC	{1: 2, 18: 1, 22: 2, 14: 3}
Did not match all atoms present	285996-74-9	C1CC(CCC1=O)(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 1, 11: 4, 12: 1, 13: 1, 14: 8, 25: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	286-85-1	C1C2=CC3=CC=CC=C3C=C21	{11: 1, 14: 6}
Did not match all atoms present	2860-50-6	CCOCN1C(=O)C2=CC=CC=C2C1=O	{1: 1, 2: 2, 33: 1, 14: 4, 22: 1, 25: 2}
Did not match all atoms present	28609-58-7	C1=CC=C(C=C1)O[Sb](=S)(OC2=CC=CC=C2)OC3=CC=CC=C3	{22: 3, 14: 15}
Did not match all atoms present	2861-28-1	C1OC2=C(O1)C=C(C=C2)CC(=O)O	{27: 1, 2: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	28610-84-6	CCOC(=O)C1=C[N+](=C2CCCC(N2C1=O)C)C.COS(=O)(=O)[O-]	{1: 4, 2: 1, 33: 2, 11: 3, 12: 1, 14: 1, 22: 1, 25: 1, 28: 1, 29: 3}
Did not match all atoms present	28611-39-4	B(C1=CC=C(C=C1)N(C)C)(O)O	{1: 2, 20: 2, 14: 4, 33: 1}
Did not match all atoms present	28611-73-6	C[S+](C)CC1=C(C=CC(=C1)[N+](=O)[O-])O.[Br-]	{1: 2, 2: 1, 38: 1, 14: 3, 18: 1, 21: 1}
Did not match all atoms present	28613-21-0	C1CN1P(=O)(NC(=O)OCC(COC(=O)NP(=O)(N2CC2)N3CC3)OC(=O)NP(=O)(N4CC4)N5CC5)N6CC6	{33: 6, 2: 2, 3: 1, 11: 12, 28: 3, 29: 3, 31: 3}
Did not match all atoms present	28616-48-0	CCOP(=O)(N(C)C)OP(=O)(N(C)C)OCC	{1: 6, 2: 2, 29: 2, 22: 3, 33: 2}
Did not match all atoms present	2862-16-0	C1=CN(C2=C1C(=O)N=CN2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{32: 1, 33: 1, 2: 1, 35: 1, 12: 4, 14: 3, 20: 3, 23: 1, 25: 1}
Did not match all atoms present	28622-66-4	C1=CC=C2C(=C1)C=CC3=C2C=CC(C3O)O	{20: 2, 12: 2, 14: 8}
Did not match all atoms present	28623-31-6	CC(C)N(C(C)C)P1OCCO1	{11: 2, 1: 4, 3: 2, 33: 1, 23: 2}
Did not match all atoms present	28631-44-9	CC(C)CCCCCCCOP(=S)(OCCCCCCCC(C)C)S	{1: 4, 2: 14, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	28633-58-1	C1=CC=C(C=C1)C2=C(N3C=CC=CC3=C2C=CC=C4C5=CC=CC=[N+]5C(=C4C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8.[Br-]	{33: 2, 18: 1, 14: 28, 6: 3, 15: 3}
Did not match all atoms present	28648-78-4	C1=CN=CN=C1C(C=O)C=O	{35: 2, 26: 2, 3: 1, 14: 3}
Did not match all atoms present	28648-89-7	C1=CN=CN=C1C2=CN=CN=C2	{35: 4, 14: 6}
Did not match all atoms present	2865-19-2	CCCC[Sn](CCCC)(I)I	{1: 2, 2: 6, 19: 2}
Did not match all atoms present	2865-70-5	C1=CC=C2C(=C1)OC3=CC=CC=C3[As]2Cl	{17: 1, 14: 8, 23: 1}
Did not match all atoms present	28655-63-2	CC1=CC(=C(C(=C1OCC=C)O)C)O	{1: 2, 2: 1, 5: 1, 6: 1, 14: 1, 21: 2, 22: 1}
Did not match all atoms present	28657-75-2	CC(=O)C1=CC2=C(C=C1N)OCO2	{1: 1, 11: 1, 14: 2, 23: 2, 24: 1, 30: 1}
Did not match all atoms present	28657-80-9	CCN1C2=CC3=C(C=C2C(=O)C(=N1)C(=O)O)OCO3	{1: 1, 2: 1, 35: 1, 33: 1, 11: 1, 14: 2, 23: 2, 25: 1, 27: 1}
Did not match all atoms present	28660-45-9	C1=CC=C(C=C1)C2=C3C=CC=CC3=[As]C4=CC=CC=C42	{14: 13, 15: 1}
Did not match all atoms present	28660-67-5	CCCCCCCCCCCCCC(=O)O[Sn](CCCC)(CCCC)OC(=O)CCCCCCCCCCCCC	{1: 4, 2: 30, 28: 2}
Did not match all atoms present	2867-63-2	C1CC(C(=O)C1)CC2=CC=CC=C2	{25: 1, 2: 1, 11: 3, 12: 1, 14: 5}
Did not match all atoms present	28672-54-0	CCOCCC1=CC=CC=N1	{1: 1, 2: 3, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	28675-08-3	C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)Cl	{17: 2, 22: 1, 14: 8}
Did not match all atoms present	28675-83-4	CC(C)CCCCCOC(=O)CS[Sn](CC1=CC=CC=C1)(CC2=CC=CC=C2)SCC(=O)OCCCCCC(C)C	{1: 4, 2: 14, 3: 2, 40: 2, 14: 10, 28: 2}
Did not match all atoms present	28679-24-5	CCCCCCCCCCCCC(C1=CC=CC=C1)[N+](CC)(CC)CC.[Cl-]	{1: 4, 2: 14, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	28683-81-0	C1=C/C(=C/2\NC3=C(C=C(C=C3)Cl)C(=O)N2)/C(=O)C=C1	{32: 2, 17: 1, 25: 2, 14: 7, 15: 2}
Did not match all atoms present	28683-91-2	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N/C(=C/3\C=C(C=CC3=O)Cl)/N2	{32: 2, 38: 1, 14: 6, 15: 3, 17: 1, 25: 2}
Did not match all atoms present	2869-09-2	CC1=CC2=C(C=C1)C3=CC4=CC=CC=C4C5=C3C6=C(C=CC=C26)C=C5	{1: 1, 14: 13}
Did not match all atoms present	2869-10-5	CC1=CC2=C(C=C1)C3=CC=CC4=C3C5=C(C=C4)C6=CC=CC=C6C=C25	{1: 1, 14: 13}
Did not match all atoms present	2869-12-7	CC1=CC2=C(C=C1)C3=CC4=CC=CC=C4C5=C3C6=C(C=C5)C7=CC=CC=C7C=C26	{1: 1, 14: 15}
Did not match all atoms present	2869-60-5	CC1=CC=CC2=CC3=C4C5=C(C=CC=C5C6=CC=CC=C6C4=C12)C=C3	{1: 1, 14: 13}
Did not match all atoms present	2869-83-2	CCN(CC)C1=CC2=[N+](C3=C(C=CC(=C3)N=NC4=CC=C(C=C4)N(C)C)N=C2C=C1)C5=CC=CC=C5.[Cl-]	{1: 4, 2: 2, 35: 1, 33: 3, 34: 2, 14: 15, 17: 1}
Did not match all atoms present	287-03-6	C1C2=CC3=CC4=CC=CC=C4C=C3C=C21	{11: 1, 14: 8}
Did not match all atoms present	287-29-6	C1C[Si]C1	{11: 3}
Did not match all atoms present	287-77-4	C1=C[As]C=C1	{14: 4}
Did not match all atoms present	2870-04-4	CCC1=C(C=CC=C1C)C	{1: 3, 2: 1, 14: 3}
Did not match all atoms present	2870-30-6	CCOP(=O)([O-])OCC.[Na+]	{1: 2, 2: 2, 29: 2, 22: 2}
Did not match all atoms present	2870-37-3	CC[N+]1=C([Se]C2=CC=CC=C21)C.[I-]	{1: 2, 2: 1, 19: 1, 14: 4, 33: 1}
Did not match all atoms present	2870-38-4	CC[N+]1=C([Se]C2=C1C=C(C=C2)OC)C.[Cl-]	{1: 3, 2: 1, 33: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	2870-71-5	C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[Br-]	{1: 2, 2: 1, 3: 1, 11: 4, 12: 3, 14: 5, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	2870-87-3	CCC[As](=O)(CCC)O	{1: 2, 2: 4, 20: 1, 29: 1}
Did not match all atoms present	28705-46-6	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCC	{1: 3, 2: 3, 28: 2, 14: 4, 33: 1}
Did not match all atoms present	2871-01-4	C1=CC(=C(C=C1N)[N+](=O)[O-])NCCO	{2: 2, 38: 1, 14: 3, 20: 1, 30: 1, 31: 1}
Did not match all atoms present	2871-26-3	C1=CC=C(C=C1)C=CC=C2C3=CC=CC=C3C4=CC=CC=C42	{14: 13, 6: 3, 15: 1}
Did not match all atoms present	2871-91-2	CC1=CC=CC2=C1C3=CC=CC=C3C4=CC=CC=C24	{1: 1, 14: 11}
Did not match all atoms present	28711-15-1	CN(CCS(=O)(=O)[O-])CCS(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 4, 29: 6, 33: 1}
Did not match all atoms present	28712-44-9	C1=CC2=C(C=C1Cl)C(=O)N/C(=C\3/C=C(C=C(C3=O)Cl)Cl)/N2	{32: 2, 17: 3, 25: 2, 14: 5, 15: 4}
Did not match all atoms present	28712-62-1	CC1=CN=C2CCCCC2=C1	{1: 1, 11: 4, 14: 2, 35: 1}
Did not match all atoms present	28715-26-6	CC1=C2C=COC2=C(C=C1)C	{1: 2, 14: 4, 23: 1}
Did not match all atoms present	28716-44-1	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCOC(=O)C=CC(=O)OCCOC3=CC(=C(C=C3)C(=O)C4=CC=CC=C4)O)O	{2: 4, 6: 2, 14: 16, 21: 2, 22: 2, 24: 2, 28: 2}
Did not match all atoms present	28716-53-2	CCN1C(=O)CC2=CC=CC=C2S1(=O)=O	{1: 1, 2: 1, 33: 1, 11: 1, 14: 4, 25: 1, 29: 2}
Did not match all atoms present	28719-79-1	CCCCCCCCCCCCCCCCCCOC(=O)C[N+](C)(C)CC[N+](C)(CC[N+](C)(C)CC(=O)OCCCCCCCCCCCCCCCCCC)CC(=O)OCCCCCCCCCCCCCCCCCC.[Cl-].[Cl-].[Cl-]	{1: 8, 2: 58, 28: 3, 17: 3}
Did not match all atoms present	2872-48-2	COC1=C(C2=C(C(=C1)N)C(=O)C3=CC=CC=C3C2=O)N	{1: 1, 30: 2, 22: 1, 14: 5, 25: 2}
Did not match all atoms present	2872-52-8	CCN(CCO)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 33: 1, 34: 2, 14: 8, 20: 1}
Did not match all atoms present	2872-66-4	CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)OC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C)OC(=O)C)OC(=O)C	{1: 4, 2: 1, 38: 1, 12: 5, 14: 4, 22: 1, 23: 1, 28: 4}
Did not match all atoms present	2873-18-9	C1=C(SC(=C1)Br)Cl	{17: 1, 18: 1, 14: 2, 41: 1}
Did not match all atoms present	2873-89-4	CCN(CC)C1=CC=C(C=C1)Cl	{1: 2, 2: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	2873-90-7	CCN(CC)C1=CC=C(C=C1)C#N	{1: 2, 2: 2, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	28732-65-2	CC1=NC(=NC=C1)NC#N	{1: 1, 35: 2, 37: 1, 14: 2, 31: 1}
Did not match all atoms present	28734-86-3	C12=C(C(=C(C(=C1F)F)F)F)N=NC(=C2F)F	{16: 6, 35: 2}
Did not match all atoms present	28734-87-4	C12=C(C(=C(C(=C1F)F)F)F)N=C(N=C2F)F	{16: 6, 35: 2}
Did not match all atoms present	28743-45-5	C[NH+](C)C1=CC=CC2=C1C=C3C(=N2)C=CC=C3[N+](=O)[O-].[Cl-]	{1: 2, 35: 1, 38: 1, 14: 7, 17: 1}
Did not match all atoms present	28746-04-5	C12=C(C(=C(C(=C1Br)Br)Br)Br)C3=NC4=NC(=NC5=NC(=NC6=C7C(=C(N6)N=C2N3)C(=C(C(=C7Br)Br)Br)Br)C8=C5C(=C(C(=C8Br)Br)Br)Br)C9=C4C(=C(C(=C9Br)Br)Br)Br	{32: 2, 18: 16, 35: 6}
Did not match all atoms present	2875-13-0	CN(C)C1=C(C(=NC(=C1F)F)F)F	{16: 4, 1: 2, 35: 1, 33: 1}
Did not match all atoms present	2875-18-5	C1=C(C(=NC(=C1F)F)F)F	{16: 4, 35: 1, 14: 1}
Did not match all atoms present	2875-32-3	C1=CC=C2C(=C1)N=C(S2)OCC(=O)O	{2: 1, 35: 1, 41: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	2875-92-5	C1=CC=C(C=C1)[GeH3]	{14: 5}
Did not match all atoms present	2875-94-7	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]	{1: 2, 2: 1}
Did not match all atoms present	2875-95-8	[2H]C([2H])(C)C	{1: 2, 2: 1}
Did not match all atoms present	2875-96-9	[2H]C([2H])([2H])CC([2H])([2H])[2H]	{1: 2, 2: 1}
Did not match all atoms present	2875-98-1	CN(C)[SiH3]	{1: 2, 33: 1}
Did not match all atoms present	28752-28-5	C1C(C1(C#N)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]	{37: 1, 38: 2, 11: 1, 12: 1, 13: 1, 14: 8}
Did not match all atoms present	28752-34-3	CN(C)C1=CC=C(C=C1)C2CC2(C#N)C3=CC=C(C=C3)[N+](=O)[O-]	{1: 2, 37: 1, 38: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 8}
Did not match all atoms present	28752-79-6	C1=COC(=C1)[Hg]C2=CC=CO2	{14: 6, 23: 2}
Did not match all atoms present	28752-80-9	C1=COC=C1[Hg]C2=COC=C2	{14: 6, 23: 2}
Did not match all atoms present	28752-81-0	C1=CSC=C1[Hg]C2=CSC=C2	{41: 2, 14: 6}
Did not match all atoms present	28752-82-1	C=CCOC1=CC=CC=C1C=O	{2: 1, 5: 1, 6: 1, 14: 4, 22: 1, 26: 1}
Did not match all atoms present	28755-00-2	CNCC(C1=CNC2=CC=CC=C21)O	{32: 1, 1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	28755-93-3	CCC1=CC2=CC3=NC(=CC4=C(C(=C(N4CC)C(=C5C(=C(C(=N5)C(=C1N2)CC)CC)CC)CC)CC)CC)C=C3.[Cl-].[Cl-].[Cl-].[Fe+3]	{32: 1, 1: 8, 2: 8, 35: 2, 33: 1, 14: 5, 17: 3}
Did not match all atoms present	2876-13-3	C1=CC=C(C=C1)C[N+]2=CC=CC=C2.[Cl-]	{17: 1, 2: 1, 14: 10, 33: 1}
Did not match all atoms present	2876-22-4	C1=CC=C2C(=C1)N=C3C=CC=C(C3=N2)N	{35: 2, 30: 1, 14: 7}
Did not match all atoms present	2876-29-1	COC1=CC2=[N+](C3=CC=CC=C3N=C2C=C1)[O-]	{1: 1, 35: 1, 33: 1, 14: 7, 22: 1, 29: 1}
Did not match all atoms present	2876-33-7	C1=CC=C2C(=C1)N=C3C=CC(=CC3=[N+]2[O-])[N+](=O)[O-]	{38: 1, 33: 1, 35: 1, 29: 1, 14: 7}
Did not match all atoms present	2876-35-9	CC(C)(C)C1=CC2=CC=CC=C2C=C1	{1: 3, 4: 1, 14: 7}
Did not match all atoms present	2876-46-2	CCCCCCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 5, 14: 7}
Did not match all atoms present	2876-51-9	CCCCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 7, 14: 7}
Did not match all atoms present	2876-52-0	CCCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 6, 14: 7}
Did not match all atoms present	2876-53-1	CCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 5, 14: 7}
Did not match all atoms present	2876-62-2	CCCC(=O)C1=CC=CC2=CC=CC=C21	{24: 1, 1: 1, 2: 2, 14: 7}
Did not match all atoms present	2876-78-0	COC(=O)CC1=CC=CC2=CC=CC=C21	{1: 1, 2: 1, 28: 1, 14: 7}
Did not match all atoms present	28766-22-5	CC1(C2=CC=CC=C2N(C1=CC=[N+]3CCNC4=CC=CC=C43)C)C.[Cl-]	{32: 1, 1: 3, 6: 2, 33: 2, 11: 2, 13: 1, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	28767-61-5	C1=CC2=C3C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C=CC4=C(C=C(C1=C43)[N+](=O)[O-])[N+](=O)[O-]	{38: 4, 14: 6}
Did not match all atoms present	2877-13-6	C1=CC(=CC=C1NC(=O)C(Cl)(Cl)Cl)Cl	{24: 1, 17: 4, 4: 1, 14: 4, 31: 1}
Did not match all atoms present	2877-26-1	CCCCCCCCCCCCCCCCCCN=C=S	{8: 1, 1: 1, 2: 17, 34: 1}
Did not match all atoms present	28772-19-2	C[N+]1=C(SC2=CC=CC=C21)S(=O)(=O)[O-]	{1: 1, 41: 1, 29: 3, 14: 4, 33: 1}
Did not match all atoms present	28772-56-7	C1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O	{2: 1, 3: 2, 14: 17, 18: 1, 20: 1, 21: 1, 28: 1}
Did not match all atoms present	28777-01-7	[H+].[H+].[H+].CCC\1=C2C=C3C(=C(C(=C(C4=NC(=CC5=NC(=CC(=N2)/C1=C/[O-])C(=C5C)C=C)C(C4CCC(=O)[O-])C)CC(=O)[O-])[N-]3)C(=O)[O-])C.[Cu+2]	{1: 4, 2: 4, 35: 4, 5: 1, 6: 2, 12: 2, 14: 3, 15: 11, 24: 3}
Did not match all atoms present	28777-70-0	CC(C)(C)C1=CC=CC=C1OP(=O)(OC2=CC=CC=C2C(C)(C)C)OC3=CC=CC=C3C(C)(C)C	{1: 9, 4: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	28782-42-5	C1CN(CCC1(C2=CC=CC=C2)C(=O)O)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4	{33: 1, 2: 2, 4: 1, 37: 1, 11: 4, 13: 1, 14: 15, 27: 1}
Did not match all atoms present	28785-06-0	CCCC1=CC=C(C=C1)C=O	{1: 1, 2: 2, 26: 1, 14: 4}
Did not match all atoms present	28788-62-7	CCCCC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 2: 3, 14: 4, 17: 1}
Did not match all atoms present	2879-20-1	CC(=O)C1=CC2=C(C=C1)OCCO2	{24: 1, 1: 1, 11: 2, 14: 3, 23: 2}
Did not match all atoms present	2879-60-9	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)OC(=O)C(Cl)(Cl)Cl	{17: 8, 4: 1, 28: 1}
Did not match all atoms present	28791-26-6	C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]	{38: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	288-01-7	C1=CPC=C1	{14: 4}
Did not match all atoms present	288-05-1	C1=C[Se]C=C1	{14: 4}
Did not match all atoms present	288-08-4	C1=C[Te]C=C1	{14: 4}
Did not match all atoms present	2880-05-9	CC1=CC=CC(=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 1, 6: 1, 38: 2, 14: 7, 31: 1}
Did not match all atoms present	28804-46-8	C1C(C2=CC=C(CC(C3=CC=C1C=C3)Cl)C=C2)Cl	{17: 2, 11: 2, 12: 2, 14: 8}
Did not match all atoms present	28805-86-9	CCCCC1=CC=CC=C1O	{1: 1, 2: 3, 21: 1, 14: 4}
Did not match all atoms present	28808-62-0	CC1=C2C(=O)O[C@H]([C@@]2(CCC1)C)C3=COC=C3	{1: 2, 11: 3, 12: 1, 13: 1, 14: 3, 15: 2, 23: 1, 28: 1}
Did not match all atoms present	28809-04-3	C1=CN=CC=C1CCSCC(C(=O)O)N	{2: 3, 35: 1, 40: 1, 14: 4, 3: 1, 27: 1, 30: 1}
Did not match all atoms present	2881-40-5	C1=C(C(=O)C=C(C1=O)[O-])[O-].[K+].[K+]	{25: 2, 14: 2, 15: 2}
Did not match all atoms present	2881-83-6	CCOC(=O)CC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 2, 14: 4, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	28819-89-8	CC(=O)OCCN(CCOC(=O)C)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 33: 1, 14: 4, 28: 2}
Did not match all atoms present	2882-15-7	CC1=C(C2=C(N1)C=CC(=C2)OC)CC(=O)O	{32: 1, 1: 2, 2: 1, 14: 3, 22: 1, 27: 1}
Did not match all atoms present	2882-19-1	CCOC(=O)C(C1=CC=CC=C1)Br	{1: 1, 2: 1, 3: 1, 14: 5, 18: 1, 28: 1}
Did not match all atoms present	2882-20-4	CC1=NC=CN=C1SC	{40: 1, 1: 2, 35: 2, 14: 2}
Did not match all atoms present	2882-21-5	CC1=CN=CC(=N1)OC	{1: 2, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	2882-22-6	CC1=CN=C(C=N1)OC	{1: 2, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	28820-59-9	C(C([N+](=O)[O-])([N+](=O)[O-])F)OC1=NC(=NC(=N1)OCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F	{2: 3, 35: 3, 4: 3, 38: 6, 16: 3, 22: 3}
Did not match all atoms present	28821-18-3	CCNC1=CC2=C(C=C1)C(=CC(=O)O2)C	{1: 2, 2: 1, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	28822-58-4	CC(C)CN1C2=C(C(=O)N(C1=O)C)NC=N2	{32: 1, 1: 3, 2: 1, 3: 1, 33: 2, 14: 1, 35: 1, 25: 2}
Did not match all atoms present	2883-12-7	C1CCC(C1)CCCC2=CC=CC=C2	{2: 3, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	2883-70-7	CCCCCCCCCCCCC1=C2C=CC=CC2=CC3=CC=CC=C31	{1: 1, 2: 11, 14: 9}
Did not match all atoms present	2883-98-9	C/C=C/C1=CC(=C(C=C1OC)OC)OC	{1: 4, 22: 3, 14: 2, 6: 2}
Did not match all atoms present	28832-64-6	C1=CC2=C3C(=C1)NC(=NC3=CC=C2)N	{32: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	2884-13-1	CC1=CN=CC(=N1)SC	{40: 1, 1: 2, 35: 2, 14: 2}
Did not match all atoms present	28842-05-9	CC1=CC(=CC=C1)N=NC2=CC=CC=C2C	{1: 2, 34: 2, 14: 8}
Did not match all atoms present	28844-11-3	F[Th]F	{16: 2}
Did not match all atoms present	28846-35-7	CN(C)NC1=C2C=CC=CC2=NC3=CC=CC=C31	{1: 2, 35: 1, 33: 1, 14: 8, 31: 1}
Did not match all atoms present	28846-36-8	CN(C1=C2C=CC=CC2=NC3=CC=CC=C31)N.Cl	{1: 1, 35: 1, 33: 1, 14: 8, 17: 1, 30: 1}
Did not match all atoms present	28846-37-9	CN(C(=S)NC1=C2C=CC=CC2=NC3=CC=CC=C31)N	{1: 1, 35: 1, 33: 1, 7: 1, 14: 8, 30: 1, 31: 1}
Did not match all atoms present	28846-38-0	CN(C)NC1=C2C=CC=CC2=NC3=CC=CC=C31.COS(=O)(=O)O	{1: 3, 35: 1, 33: 1, 14: 8, 20: 1, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	28846-39-1	CCCCN(CCCC)NC1=C2C=CC=CC2=NC3=CC=CC=C31.Cl	{1: 2, 2: 6, 35: 1, 33: 1, 14: 8, 17: 1, 31: 1}
Did not match all atoms present	28846-40-4	C1CCN(CC1)NC2=C3C=CC=CC3=NC4=CC=CC=C42	{33: 1, 11: 5, 35: 1, 14: 8, 31: 1}
Did not match all atoms present	28846-41-5	C1COCCN1NC2=C3C=CC=CC3=NC4=CC=CC=C42	{33: 1, 35: 1, 11: 4, 14: 8, 23: 1, 31: 1}
Did not match all atoms present	28846-42-6	COS(=O)(=O)O.C1COCCN1NC2=C3C=CC=CC3=NC4=CC=CC=C42	{1: 1, 35: 1, 33: 1, 11: 4, 14: 8, 20: 1, 22: 1, 23: 1, 29: 2, 31: 1}
Did not match all atoms present	28846-43-7	C/C=N/N(C)C(=S)NC1=C2C=CC=CC2=NC3=CC=CC=C31	{1: 2, 34: 1, 35: 1, 6: 1, 33: 1, 7: 1, 14: 8, 31: 1}
Did not match all atoms present	28846-44-8	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N(CCO)N.Cl	{33: 1, 2: 2, 35: 1, 14: 8, 17: 1, 20: 1, 30: 1}
Did not match all atoms present	2886-65-9	C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F	{32: 1, 35: 1, 11: 1, 14: 7, 15: 1, 16: 1, 17: 1, 25: 1}
Did not match all atoms present	28860-95-9	C[C@](CC1=CC(=C(C=C1)O)O)(C(=O)O)NN	{1: 1, 2: 1, 4: 1, 14: 3, 21: 2, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	28865-36-3	CCCCCCCCCCCCCCC(C[N+](CCO)(CCO)[O-])O	{1: 1, 2: 18, 3: 1, 20: 3, 29: 1}
Did not match all atoms present	28867-09-6	C[Sn](C)(C)C1=CC=[N+](C=C1)[O-]	{1: 3, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	2887-56-1	CCC(=O)C1=CC(=CC(=C1O)C)Br	{1: 2, 2: 1, 14: 2, 18: 1, 21: 1, 24: 1}
Did not match all atoms present	2887-61-8	CCCC(=O)C1=CC=CC=C1O	{24: 1, 1: 1, 2: 2, 21: 1, 14: 4}
Did not match all atoms present	2888-06-4	C1=CC(=CC(=C1)Cl)S(=O)(=O)Cl	{17: 2, 29: 2, 14: 4}
Did not match all atoms present	28882-22-6	[2H]C([2H])C	{1: 2}
Did not match all atoms present	28882-58-8	CC1=CC=C(C2=CC=CC=C12)C(C)C	{1: 3, 3: 1, 14: 6}
Did not match all atoms present	28888-44-0	COC1=C(C=C2C(=C1)C(=O)NC(=O)N2)OC	{32: 2, 1: 2, 22: 2, 14: 2, 25: 2}
Did not match all atoms present	28888-81-5	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C3=NC4=NC(=NC5=NC(=NC6=C7C(=C(N6)N=C2N3)C(=C(C(=C7Cl)Cl)Cl)Cl)C8=C5C(=C(C(=C8Cl)Cl)Cl)Cl)C9=C4C(=C(C(=C9Cl)Cl)Cl)Cl	{32: 2, 17: 16, 35: 6}
Did not match all atoms present	2889-58-9	CC(=C)C1=CC=C(C=C1)C(C)(C)N=C=O	{1: 3, 34: 1, 4: 1, 5: 1, 7: 1, 8: 1, 14: 4, 29: 1}
Did not match all atoms present	28896-49-3	C1=CC(=CC=C1OC2=CC=C(C=C2)I)I	{19: 2, 22: 1, 14: 8}
Did not match all atoms present	289-31-6	C1=CC=[As]C=C1	{14: 5}
Did not match all atoms present	289-52-1	C1=CC=[Bi]C=C1	{14: 5}
Did not match all atoms present	289-56-5	[B]1O[B]O[B]O1	{23: 3}
Did not match all atoms present	289-68-9	C1=CC=PC=C1	{14: 5}
Did not match all atoms present	289-75-8	C1=CC=[Sb]C=C1	{14: 5}
Did not match all atoms present	289-77-0	C1=CC=[Si]C=C1	{14: 5}
Did not match all atoms present	2890-28-0	C1CN=C(C2=C(N1)C=CC(=C2)C(F)(F)F)C3=CC=CC=C3	{32: 1, 35: 1, 4: 1, 11: 2, 14: 8, 15: 1, 16: 3}
Did not match all atoms present	28900-10-9	CC1=NC(=C(C=C1)C#N)Cl	{1: 1, 35: 1, 37: 1, 14: 2, 17: 1}
Did not match all atoms present	28901-77-1	CCCCOP(=O)(O)OP(=O)(O)OCCCC	{1: 2, 2: 6, 20: 2, 29: 2, 22: 3}
Did not match all atoms present	28904-29-2	CCCCOC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O	{1: 1, 2: 3, 27: 2, 28: 1, 14: 3}
Did not match all atoms present	28907-44-0	C[NH+](C)CCCN1C2=C(C=C(C=C2)Cl)C(=O)C3=C1N=CC=C3.[Cl-]	{1: 2, 2: 3, 35: 1, 33: 1, 14: 6, 17: 2, 25: 1}
Did not match all atoms present	28907-84-8	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C(=C1)N.[Na+]	{30: 1, 29: 3, 14: 6}
Did not match all atoms present	28908-00-1	C1=CC=C2C(=C1)N=C(S2)SCCl	{2: 1, 35: 1, 40: 1, 41: 1, 14: 4, 17: 1}
Did not match all atoms present	28911-01-5	CC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4Cl	{1: 1, 35: 3, 33: 1, 11: 1, 14: 7, 15: 1, 17: 2}
Did not match all atoms present	28912-93-8	[B-](F)(F)(F)F.C1=CC=C2C(=C1)C=CC=C2[N+]#N	{16: 4, 34: 1, 14: 7}
Did not match all atoms present	2892-18-4	CC(C)CC(=O)C=CC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 6: 2, 14: 5, 24: 1}
Did not match all atoms present	2892-51-5	C1(=C(C(=O)C1=O)O)O	{25: 2, 21: 2}
Did not match all atoms present	2892-62-8	CCCCOC1=C(C(=O)C1=O)OCCCC	{1: 2, 2: 6, 22: 2, 25: 2}
Did not match all atoms present	2892-63-9	C1(=C(C(=O)C1=O)Cl)Cl	{17: 2, 25: 2}
Did not match all atoms present	28920-43-6	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)Cl	{17: 1, 2: 1, 12: 1, 14: 8, 28: 1}
Did not match all atoms present	28921-35-9	CCOC(=O)C1=C(OC=C1)C	{1: 2, 2: 1, 28: 1, 14: 2, 23: 1}
Did not match all atoms present	28922-53-4	C=CC[Hg]Br	{2: 1, 18: 1, 5: 1, 6: 1}
Did not match all atoms present	28924-21-2	CC(=O)C1=CC(=CC(=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3	{24: 1, 1: 1, 2: 2, 22: 2, 14: 13}
Did not match all atoms present	28926-65-0	C1=CC=C(C=C1)P(C2=CC=CC=C2)C(P(C3=CC=CC=C3)C4=CC=CC=C4)P(C5=CC=CC=C5)C6=CC=CC=C6	{3: 1, 14: 30}
Did not match all atoms present	2893-80-3	C1=CC(=CC=C1C2=CC=C(C=C2)N/N=C/3\C=CC(=O)/C(=N\NC4=CC=C(C=C4)S(=O)(=O)[O-])/C3=O)N/N=C\5/C=CC(=O)C(=C5)C(=O)[O-].[Na+].[Na+]	{34: 3, 14: 17, 15: 2, 24: 1, 25: 3, 29: 3, 31: 3}
Did not match all atoms present	2894-67-9	C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3Cl	{32: 1, 35: 1, 11: 1, 14: 7, 15: 1, 17: 2, 25: 1}
Did not match all atoms present	28950-61-0	CC1=NC(=NC(=N1)NC2=CC=C(C=C2)S(=O)(=O)[O-])N3CCOCC3.CNC1=CC(=C(C=C1)/C=C/C2=C(C=C(C=C2)NC3=NC(=NC(=N3)NC4=CC=C(C=C4)S(=O)(=O)[O-])N5CCOCC5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na].[Na].[Na].[Na]	{1: 2, 35: 6, 6: 2, 33: 2, 11: 8, 14: 14, 23: 2, 29: 12, 31: 4}
Did not match all atoms present	28958-26-1	[O-]Br(=O)=O.[O-]Br(=O)=O.[O-]Br(=O)=O.[Sm+3]	{18: 3, 29: 9}
Did not match all atoms present	28959-35-5	C(CC(O)S(=O)(=O)[O-])CC(O)S(=O)(=O)[O-].[Na+].[Na+]	{2: 3, 3: 2, 20: 2, 29: 6}
Did not match all atoms present	2896-60-8	CCC1=C(C=C(C=C1)O)O	{1: 1, 2: 1, 21: 2, 14: 3}
Did not match all atoms present	2896-67-5	CC1=C(C(=CC=C1)OC)O	{1: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	2896-87-9	C(CC(=O)[O-])[C@@H](C(=O)[O-])N.[Fe+2]	{24: 2, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	28965-57-3	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].O.O.O.O.O.O.O.O.O.O.[Ho+3].[Ho+3]	{24: 6}
Did not match all atoms present	289651-10-1	[OH-].[Zn+3]	{}
Did not match all atoms present	2897-00-9	C1CC1CNC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3	{2: 1, 11: 2, 12: 1, 14: 8, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	2897-46-3	CCCCCC[Sn](CCCCCC)(CCCCCC)CC(=O)O	{1: 3, 2: 16, 27: 1}
Did not match all atoms present	2897-60-1	CCO[Si](C)(CCCOCC1CO1)OCC	{1: 3, 2: 6, 11: 1, 12: 1, 22: 3, 23: 1}
Did not match all atoms present	2898-12-6	CN1CCN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3	{1: 1, 35: 1, 33: 1, 11: 2, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	28980-49-6	[Sn].[Sb]	{}
Did not match all atoms present	28981-97-7	CC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4	{1: 1, 35: 3, 33: 1, 11: 1, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	28983-22-4	CCCC(C)C1=CC(=C(C=C1)O)C(C)CCC	{1: 4, 2: 4, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	28984-20-5	C1=CC=C(C=C1)C(=S)C(=S)C2=CC=CC=C2.C1=CC=C(C=C1)C(=S)C(=S)C2=CC=CC=C2.[Ni]	{14: 20, 7: 4}
Did not match all atoms present	28985-56-0	CCCCCCCCCCCCC1=CC(=C(C(=C1)C)S(=O)(=O)O)C	{1: 3, 2: 11, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	28985-91-3	C=O.C1=CC=C(C=C1)O.C(CN)N	{2: 2, 30: 2, 5: 1, 14: 5, 21: 1}
Did not match all atoms present	28986-55-2	CCCCCCCCCCCCC1=CC=C(C=C1)SSC2=CC=C(C=C2)CCCCCCCCCCCC	{40: 2, 1: 2, 2: 22, 14: 8}
Did not match all atoms present	28989-47-1	CC(=C1C(=O)NC(=S)S1)C	{32: 1, 1: 2, 7: 1, 41: 1, 15: 2, 25: 1}
Did not match all atoms present	2899-02-7	C1=C(C=C(C(=C1Cl)N(C(=O)N(C2=C(C=C(C=C2Cl)Cl)Cl)Cl)Cl)Cl)Cl	{24: 1, 17: 8, 14: 4, 33: 2}
Did not match all atoms present	28994-41-4	C1=CC=C(C=C1)CC2=CC=CC=C2O	{2: 1, 21: 1, 14: 9}
Did not match all atoms present	28995-89-3	C1=C2C=C(C=C(C2=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 4, 14: 4}
Did not match all atoms present	290-82-4	C1=C[Se]C=CS1	{41: 1, 14: 4}
Did not match all atoms present	2901-66-8	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)O	{32: 1, 1: 3, 33: 1, 11: 5, 12: 6, 14: 3, 20: 1, 22: 2, 28: 1}
Did not match all atoms present	2901-90-8	CCOP(=S)(OCC)SSP(=S)(OCC)OCC	{40: 2, 1: 4, 2: 4, 22: 4}
Did not match all atoms present	2902-64-9	COC(=O)C1=CC2=C(C=C1)C(=O)OC2=O	{1: 1, 28: 3, 14: 3}
Did not match all atoms present	2902-69-4	C1=CC=C(C=C1)C(=O)C(Cl)(Cl)Cl	{24: 1, 17: 3, 4: 1, 14: 5}
Did not match all atoms present	2902-98-9	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)Cl)Cl	{24: 1, 17: 2, 4: 1, 14: 10}
Did not match all atoms present	29022-11-5	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCC(=O)O	{2: 2, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	29023-82-3	CN(C)NC1=C2C=C(C=CC2=NC3=CC=CC=C31)Cl	{1: 2, 35: 1, 33: 1, 14: 7, 17: 1, 31: 1}
Did not match all atoms present	29023-83-4	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NN(CCCl)CCCl.Cl	{33: 1, 2: 4, 35: 1, 14: 8, 17: 3, 31: 1}
Did not match all atoms present	29023-84-5	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC(=S)NN	{35: 1, 31: 2, 30: 1, 14: 8, 7: 1}
Did not match all atoms present	29023-85-6	CC(=NN(C)C(=S)NC1=C2C=CC=CC2=NC3=CC=CC=C31)C	{1: 3, 34: 1, 35: 1, 33: 1, 7: 2, 14: 8, 31: 1}
Did not match all atoms present	29025-14-7	CCCCOC1=CC=C(C=C1)C[N+]2(C3CCC2CC(C3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.[Br-]	{1: 2, 2: 5, 3: 1, 11: 4, 12: 3, 14: 9, 18: 1, 20: 1, 22: 1, 28: 1}
Did not match all atoms present	29025-67-0	C1CO[Si]2(OCCN1CCO2)C3=CC=C(C=C3)Cl	{17: 1, 11: 6, 33: 1, 14: 4, 23: 3}
Did not match all atoms present	29026-74-2	CC(C)OC1=CC=CC=C1N	{1: 2, 30: 1, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	2903-34-6	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Cl	{1: 1, 31: 1, 29: 2, 14: 8, 17: 1}
Did not match all atoms present	2904-57-6	CC1=CC(=C(C(=C1)C)C#[N+][O-])C	{1: 3, 34: 1, 29: 1, 14: 2}
Did not match all atoms present	2904-59-8	COC1=CC(=C(C(=C1)OC)C#[N+][O-])OC	{1: 3, 34: 1, 22: 3, 14: 2, 29: 1}
Did not match all atoms present	2904-60-1	CC1=C(C(=C(C(=C1C#[N+][O-])C)C)C#[N+][O-])C	{1: 4, 34: 2, 29: 2}
Did not match all atoms present	29040-46-8	CC1=CC2=C(C=C1)OC(=C2)C	{1: 2, 14: 4, 23: 1}
Did not match all atoms present	29041-32-5	C1CC2=CC3=C(C=C2)C=C(CCC4=CC5=C(C=C4)C=C1C=C5)C=C3	{11: 4, 14: 12}
Did not match all atoms present	29046-78-4	COCCOC.Cl[Ni]Cl	{1: 2, 2: 2, 22: 2, 17: 2}
Did not match all atoms present	2905-17-1	CC1=C(C(=CC=C1)C)SSC2=C(C=CC=C2C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	2905-21-7	C1=CC=C(C(=C1)F)S(=O)(=O)Cl	{16: 1, 17: 1, 29: 2, 14: 4}
Did not match all atoms present	2905-23-9	C1=CC=C(C(=C1)S(=O)(=O)Cl)Cl	{17: 2, 29: 2, 14: 4}
Did not match all atoms present	2905-24-0	C1=CC(=CC(=C1)Br)S(=O)(=O)Cl	{17: 1, 18: 1, 29: 2, 14: 4}
Did not match all atoms present	2905-25-1	C1=CC=C(C(=C1)S(=O)(=O)Cl)Br	{17: 1, 18: 1, 29: 2, 14: 4}
Did not match all atoms present	2905-54-6	COC(=O)C1=C(C(=CC=C1)Cl)Cl	{1: 1, 28: 1, 14: 3, 17: 2}
Did not match all atoms present	2905-56-8	C1CCN(CC1)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 5, 14: 5}
Did not match all atoms present	2905-60-4	C1=CC(=C(C(=C1)Cl)Cl)C(=O)Cl	{24: 1, 17: 3, 14: 3}
Did not match all atoms present	2905-62-6	C1=C(C=C(C=C1Cl)Cl)C(=O)Cl	{24: 1, 17: 3, 14: 3}
Did not match all atoms present	2905-65-9	COC(=O)C1=CC(=CC=C1)Cl	{1: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	2905-67-1	COC(=O)C1=CC(=CC(=C1)Cl)Cl	{1: 1, 28: 1, 14: 3, 17: 2}
Did not match all atoms present	2905-69-3	COC(=O)C1=C(C=CC(=C1)Cl)Cl	{1: 1, 28: 1, 14: 3, 17: 2}
Did not match all atoms present	2905-82-0	COC1=CC(=C(C=C1)O)C(=O)OC	{1: 2, 22: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	29050-86-0	C1=CC(=O)C=CC1=NNC2=CC(=O)NC(=O)N2	{32: 2, 34: 1, 14: 5, 15: 1, 25: 3, 31: 1}
Did not match all atoms present	29053-27-8	CC1CC2N(O1)C(=O)C3=C(O2)C=CC(=C3)Cl	{1: 1, 33: 1, 11: 1, 12: 2, 14: 3, 17: 1, 23: 2, 25: 1}
Did not match all atoms present	29055-08-1	CNC1=CC=CC=C1CO	{1: 1, 2: 1, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	29061-52-7	CC1=CC=CC=C1S(=O)OC(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C	{1: 5, 3: 1, 33: 2, 14: 12, 22: 1, 29: 1}
Did not match all atoms present	29061-66-3	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CCCCCN	{1: 2, 2: 15, 14: 4, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	29063-00-1	CC1=C(C2=CC3=CC=CC=C3C=C2C=C1)C	{1: 2, 14: 8}
Did not match all atoms present	29067-70-7	CCCC(=O)NC1=C(C=C(C(=C1I)C(C)C(=O)O)I)I	{1: 2, 2: 2, 3: 1, 14: 1, 19: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	2907-79-1	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OC5=CC=CC=C5	{1: 1, 14: 14, 22: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	29081-63-8	C(C(CCl)OP(=S)(OC(CCl)CCl)OC(CCl)CCl)Cl	{17: 6, 2: 6, 3: 3, 22: 3}
Did not match all atoms present	29082-74-4	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C(=C(Cl)Cl)Cl	{17: 8, 7: 2}
Did not match all atoms present	290835-85-7	CC(=O)C1=C(C=CC(=C1Cl)F)Cl	{16: 1, 1: 1, 24: 1, 14: 2, 17: 2}
Did not match all atoms present	2909-38-8	C1=CC(=CC(=C1)Cl)N=C=O	{8: 1, 17: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	2909-76-4	CC(C)(C)C1=CC(=C(C=C1)N(C)C)C(C)(C)C	{1: 8, 4: 2, 14: 3, 33: 1}
Did not match all atoms present	2909-77-5	CC(C)C1=C(C(=CC=C1)C(C)C)N(C)C	{1: 6, 3: 2, 14: 3, 33: 1}
Did not match all atoms present	2909-79-7	CC(C)(C)C1=CC=C(C=C1)N(C)C	{1: 5, 4: 1, 14: 4, 33: 1}
Did not match all atoms present	2909-82-2	CC1=C(C=CC(=C1)C(C)(C)C)N	{1: 4, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	2909-84-4	CC(C)(C)C1=CC(=C(C=C1)N)C(C)(C)C	{1: 6, 4: 2, 30: 1, 14: 3}
Did not match all atoms present	29091-05-2	CCN(CC)C1=C(C=C(C(=C1[N+](=O)[O-])N)C(F)(F)F)[N+](=O)[O-]	{1: 2, 2: 2, 4: 1, 38: 2, 33: 1, 14: 1, 16: 3, 30: 1}
Did not match all atoms present	29091-09-6	C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl)C(F)(F)F	{16: 3, 17: 2, 4: 1, 38: 2, 14: 1}
Did not match all atoms present	29091-21-2	CCCN(CCC)C1=C(C=C(C(=C1[N+](=O)[O-])N)C(F)(F)F)[N+](=O)[O-]	{1: 2, 2: 4, 4: 1, 38: 2, 33: 1, 14: 1, 16: 3, 30: 1}
Did not match all atoms present	29092-13-5	CCOC(=O)C1=C(C(=C(C(=C1Br)Br)C(=O)O)Br)Br	{1: 1, 2: 1, 27: 1, 28: 1, 18: 4}
Did not match all atoms present	29092-63-5	COC1=CC(=C(C=C1N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C(=O)O)OC)S(=O)(=O)CCOS(=O)(=O)O	{1: 2, 2: 2, 35: 1, 33: 1, 12: 1, 34: 2, 14: 6, 15: 1, 20: 2, 22: 3, 25: 1, 27: 1, 29: 6}
Did not match all atoms present	29096-75-1	CC1=CC2=C(C=C1C)N=C(N2)N	{32: 1, 1: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	29097-12-9	CCN1C(=O)C=C(C(=C1O)C(=O)N)C	{1: 2, 2: 1, 33: 1, 14: 1, 21: 1, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	29097-31-2	C1=CC(=C(C=C1Cl)S(=O)C2=C(C=CC(=C2)Cl)O)O	{17: 2, 21: 2, 14: 6, 29: 1}
Did not match all atoms present	29098-15-5	CCOCOC(=O)C1=CC=CC=C1NC2=C(C=CC(=C2Cl)C)Cl	{1: 2, 2: 2, 14: 6, 17: 2, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	291-25-8	C1[Se]C[Se]C[Se]1	{11: 3}
Did not match all atoms present	291-37-2	N1=PN=PN=P1	{35: 3}
Did not match all atoms present	29103-26-2	CC(=O)NC1=C(C=CC(=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)N=NC4=C(C=C(C=C4)[N+](=O)[O-])Cl	{1: 1, 2: 2, 38: 1, 33: 1, 34: 2, 14: 16, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	29103-58-0	CCN(CC1=CC=CC=C1)C2=CC=CC(=C2)NC(=O)C	{1: 2, 2: 2, 33: 1, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	29103-59-1	CC(=O)NC1=CC(=CC=C1)NCC2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 14: 9, 31: 2}
Did not match all atoms present	29103-60-4	CC(=O)NC1=CC(=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3	{1: 1, 2: 2, 33: 1, 14: 14, 24: 1, 31: 1}
Did not match all atoms present	29107-36-6	CC(C)C(CC1=CC=CC=C1)C(=O)OC	{1: 3, 2: 1, 3: 2, 28: 1, 14: 5}
Did not match all atoms present	29110-22-3	CC(C(=O)[O-])(Cl)Cl.CC(C(=O)[O-])(Cl)Cl.[Mg+2]	{24: 2, 1: 2, 4: 2, 17: 4}
Did not match all atoms present	29110-48-3	C1=CC(=C(C(=C1)Cl)CC(=O)N=C(N)N)Cl.Cl	{2: 1, 7: 1, 34: 1, 14: 3, 17: 3, 24: 1, 30: 2}
Did not match all atoms present	29110-68-7	CC(C)(C)C1=CC(=CC(=C1OS(=O)(=O)C)[N+](=O)[O-])[N+](=O)[O-]	{1: 4, 4: 1, 38: 2, 14: 2, 22: 1, 29: 2}
Did not match all atoms present	29110-74-5	C1=CC2=C(NN=C2C=C1)Cl	{32: 1, 17: 1, 35: 1, 14: 4}
Did not match all atoms present	29112-90-1	CCC(=O)C1=C(C=CC(=C1)F)F	{16: 2, 1: 1, 2: 1, 14: 3, 24: 1}
Did not match all atoms present	29113-63-1	CCOC(=O)C1=C(OC(=C1)C)C	{1: 3, 2: 1, 28: 1, 14: 1, 23: 1}
Did not match all atoms present	29114-66-7	CCCCC(=O)C1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 3, 14: 4, 24: 1}
Did not match all atoms present	2912-62-1	C1=CC=C(C=C1)C(C(=O)Cl)Cl	{24: 1, 17: 2, 3: 1, 14: 5}
Did not match all atoms present	29122-56-3	CCC(C)C(CN(C(C)C)C(C)C)C1=C(C=CC(=C1)Cl)OCC	{1: 7, 2: 3, 3: 4, 33: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	29122-60-9	CCC(C)C(CN1CCCCC1)C2=C(C=CC(=C2)Cl)OCC	{1: 3, 2: 3, 3: 2, 33: 1, 11: 5, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	29122-68-7	CC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)O	{1: 2, 2: 3, 3: 2, 14: 4, 20: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	29124-54-7	CS(=O)(=O)C1=C(C=C(C=C1)Cl)N	{1: 1, 30: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	29126-51-0	[Li+].[Li+].C(CC(=O)[O-])CC(=O)[O-]	{24: 2, 2: 3}
Did not match all atoms present	29128-55-0	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)O)NN=C3C(=O)C=CC4=CC=CC=C43	{34: 1, 14: 12, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	2913-24-8	C1CC2=CC=C(CCCC3=CC=C(C1)C=C3)C=C2	{11: 6, 14: 8}
Did not match all atoms present	29135-62-4	C1=C(C=C(C(=C1[N+](=O)[O-])NC(=O)C(=O)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{24: 2, 38: 6, 14: 4, 31: 2}
Did not match all atoms present	29136-19-4	CCCCCCCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 18, 14: 5}
Did not match all atoms present	29138-86-1	CC[Hg]C	{1: 2, 2: 1}
Did not match all atoms present	29138-87-2	CCC[Hg]C	{1: 2, 2: 2}
Did not match all atoms present	29138-88-3	CC(C)[Hg]C	{1: 3, 3: 1}
Did not match all atoms present	29138-91-8	CCCCCCCCC1CCCC2=CC=CC=C12	{1: 1, 2: 7, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	2914-77-4	CN(C)CC1CCCCC1(C2=CC(=CC=C2)OC)O	{1: 3, 2: 1, 33: 1, 11: 4, 12: 1, 13: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	29144-42-1	CC1=C(C2=C(C=C1)C(=C3C[C@H]4[C@H](C(=O)C(=C([C@]4(C(=O)C3=C2O)O)O)C(=O)C)N)C)O	{1: 3, 11: 1, 12: 2, 13: 1, 14: 2, 15: 2, 20: 2, 21: 2, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	29145-79-7	[OH-].[OH-].[OH-].[OH-].[Fe+3]	{}
Did not match all atoms present	29146-24-5	CC(C)(C)P(C(C)(C)C)F	{16: 1, 1: 6, 4: 2}
Did not match all atoms present	29148-27-4	CCOC(=O)C(C1=CC=C(C=C1)C)C(=O)OCC	{1: 3, 2: 2, 3: 1, 28: 2, 14: 4}
Did not match all atoms present	29149-32-4	CC(C)(C)P(F)F	{16: 2, 1: 3, 4: 1}
Did not match all atoms present	2915-72-2	CCCCCCCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 11, 28: 1, 14: 5}
Did not match all atoms present	29150-13-8	C1CC12C=CC=CC3=CC=CC=C23	{11: 2, 13: 1, 14: 8}
Did not match all atoms present	29154-14-1	C1=CC(=NC(=C1Cl)Cl)Cl	{17: 3, 35: 1, 14: 2}
Did not match all atoms present	2916-68-9	C[Si](C)(C)CCO	{1: 3, 2: 2, 20: 1}
Did not match all atoms present	2916-76-9	COC(=O)C[Si](C)(C)C	{1: 4, 2: 1, 28: 1}
Did not match all atoms present	29162-73-0	C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)Br)C8=CC=C(C=C8)Br)C9=CC=C(C=C9)Br)N3)Br	{32: 2, 18: 4, 35: 2, 14: 24}
Did not match all atoms present	29167-65-5	C1CO[Si]2(OCCN1CCO2)OCCN(CCO[Si]34OCCN(CCO3)CCO4)CCO[Si]56OCCN(CCO5)CCO6	{33: 4, 2: 6, 11: 18, 22: 3, 23: 9}
Did not match all atoms present	29169-64-0	C1=CC=C(C=C1)[C@H](C(=O)Cl)OC=O	{24: 1, 17: 1, 26: 1, 3: 1, 14: 5}
Did not match all atoms present	29169-79-7	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C5=C6C(=C(C(=N6)C=C1N2)C)C(=O)C5C(=O)OC)CCC(=O)OC)C)C)CC)C	{32: 2, 1: 8, 2: 4, 35: 2, 12: 1, 14: 3, 25: 1, 28: 2}
Did not match all atoms present	2917-19-3	CCC(C)C1=CC(=C(C=C1)Cl)OC(=O)NC	{1: 3, 2: 1, 3: 1, 14: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	2917-46-6	C[Si](C)(CCl)CCl	{1: 2, 2: 2, 17: 2}
Did not match all atoms present	2917-47-7	C[Si](C)(C)CCCO	{1: 3, 2: 3, 20: 1}
Did not match all atoms present	2917-65-9	CC(=O)OC[Si](C)(C)C	{1: 4, 2: 1, 28: 1}
Did not match all atoms present	2917-96-6	CS(=O)(=O)OCC#CCOS(=O)(=O)C	{1: 2, 2: 2, 10: 2, 22: 2, 29: 4}
Did not match all atoms present	29171-24-2	CC1=CC=C(C=C1)N/N=C(/N=NC2=CC=C(C=C2)C)\[N+](=O)[O-]	{1: 2, 34: 3, 38: 1, 7: 1, 14: 8, 31: 1}
Did not match all atoms present	29172-20-1	C1=COC=C1I	{19: 1, 14: 3, 23: 1}
Did not match all atoms present	29173-12-4	B1(N(CCN1C)C)C	{1: 3, 11: 2, 33: 2}
Did not match all atoms present	29173-31-7	CN(C(=O)CSP(=S)(C)OC)C(=O)OC	{1: 4, 2: 1, 33: 1, 40: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	29173-65-7	C1=CC(=CC=C1CCl)N=C=O	{2: 1, 8: 1, 34: 1, 14: 4, 17: 1, 29: 1}
Did not match all atoms present	29177-84-2	CCOC(=O)C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F	{32: 1, 1: 1, 2: 1, 35: 1, 12: 1, 14: 7, 15: 1, 16: 1, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	2918-80-1	C1=CC(=C(C=C1S(=O)(=O)O)NN=C2C=CC(=O)C=C2O)O	{34: 1, 14: 6, 15: 2, 20: 2, 21: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	29181-23-5	CC(C)NC[C@@H](COC1=CC=CC=C1OCC=C)O.Cl	{1: 2, 2: 3, 3: 2, 5: 1, 6: 1, 14: 4, 17: 1, 20: 1, 22: 2, 31: 1}
Did not match all atoms present	29181-50-8	C1=CN=C(C=C1C#N)C#N	{35: 1, 37: 2, 14: 3}
Did not match all atoms present	29184-39-2	C1=CC=C(C=C1)C(CSSCC(C2=CC=CC=C2)Cl)Cl	{40: 2, 17: 2, 2: 2, 3: 2, 14: 10}
Did not match all atoms present	2919-19-9	CC1=CC=CC=C1C(=C)C2=CC=CC=C2C	{1: 2, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	2919-20-2	CC1=CC=C(C=C1)C(=C)C2=CC=C(C=C2)C	{1: 2, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	29193-35-9	CC(=O)N(CC1=CC=CC=C1)C2=C(C=C(C(=C2I)CC(=O)O)I)I	{1: 1, 2: 2, 33: 1, 14: 6, 19: 3, 24: 1, 27: 1}
Did not match all atoms present	29194-31-8	CC(=C)C(=O)N.OS(=O)(=O)O	{1: 1, 5: 1, 7: 1, 20: 2, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	29197-94-2	CC1=CC(=O)OC2=C1C=CC(=C2)NCS(=O)(=O)O	{1: 1, 2: 1, 14: 4, 20: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	29197-96-4	CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C3=CC=CC=C3)C	{1: 3, 2: 2, 28: 1, 14: 8, 33: 1}
Did not match all atoms present	2920-38-9	C1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{37: 1, 14: 9}
Did not match all atoms present	2921-14-4	C(C(=O)[O-])ON	{24: 1, 2: 1, 30: 1, 22: 1}
Did not match all atoms present	2921-31-5	CC1C2CCCCC2OP(=S)(O1)Cl	{23: 2, 1: 1, 11: 4, 12: 3, 17: 1}
Did not match all atoms present	2921-88-2	CCOP(=S)(OCC)OC1=NC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 2, 35: 1, 14: 1, 17: 3, 22: 3}
Did not match all atoms present	2921-92-8	CCC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-]	{1: 1, 2: 4, 4: 1, 22: 3}
Did not match all atoms present	29210-66-0	C(#N)[SiH3]	{37: 1}
Did not match all atoms present	29214-37-7	C(S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 18, 2: 1, 4: 8, 29: 4}
Did not match all atoms present	29216-28-2	C1CN2CCC1C(C2)CN3C4=CC=CC=C4SC5=CC=CC=C53	{33: 2, 2: 1, 41: 1, 11: 5, 12: 2, 14: 8}
Did not match all atoms present	29218-65-3	CC(=C)C=P(C)(C)C	{1: 4, 5: 1, 6: 1, 7: 1}
Did not match all atoms present	2922-28-3	C1=NC2=C(N1)C(=NC=N2)N.Cl	{32: 1, 17: 1, 35: 3, 30: 1, 14: 2}
Did not match all atoms present	2922-61-4	[Li+].CC(=O)C(=O)[O-]	{24: 2, 1: 1}
Did not match all atoms present	29225-91-0	CC(C)C1=C(C(=C(C=C1)C2=CC=CC=C2)C(C)C)C(C)C	{1: 6, 3: 3, 14: 7}
Did not match all atoms present	2923-14-0	C(=O)(C(F)(F)Cl)[O-].[Ag+]	{16: 2, 17: 1, 4: 1, 24: 1}
Did not match all atoms present	2923-16-2	C(=O)(C(F)(F)F)[O-].[K+]	{16: 3, 24: 1, 4: 1}
Did not match all atoms present	2923-17-3	[Li+].C(=O)(C(F)(F)F)[O-]	{16: 3, 24: 1, 4: 1}
Did not match all atoms present	2923-18-4	C(=O)(C(F)(F)F)[O-].[Na+]	{16: 3, 24: 1, 4: 1}
Did not match all atoms present	2923-26-4	C(=O)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-].[Na+]	{16: 11, 24: 1, 4: 5}
Did not match all atoms present	2923-28-6	C(F)(F)(F)S(=O)(=O)[O-].[Ag+]	{16: 3, 4: 1, 29: 3}
Did not match all atoms present	2923-41-3	C1=CC(=CC=[C-]1)C(F)(F)F.[Mg+2].[Cl-]	{16: 3, 17: 1, 4: 1, 14: 4}
Did not match all atoms present	2923-66-2	CC(=O)C1=CC(=C(C=C1)F)Cl	{16: 1, 1: 1, 24: 1, 14: 3, 17: 1}
Did not match all atoms present	2923-93-5	CCCCC(C(=O)NC1=CC(=C(C=C1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)O)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 5, 3: 1, 4: 5, 14: 6, 16: 7, 21: 1, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	2923-96-8	C1=CC(=C(C=C1F)[N+](=O)[O-])C=O	{16: 1, 26: 1, 38: 1, 14: 3}
Did not match all atoms present	29232-93-7	CCN(CC)C1=NC(=CC(=N1)OP(=S)(OC)OC)C	{1: 5, 2: 2, 35: 2, 33: 1, 14: 1, 22: 3}
Did not match all atoms present	29234-88-6	CC(C)COC(=O)C1=CC=C(C=C1)Cl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	2924-67-6	CCS(=O)(=O)C1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 1, 29: 2, 14: 4}
Did not match all atoms present	29240-30-0	CC1=CC=C(C=C1)C(=O)OCC(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	29241-60-9	CC1=CC(=CN=C1Cl)Br	{1: 1, 18: 1, 35: 1, 14: 2, 17: 1}
Did not match all atoms present	29243-26-3	CC1=CC(=CC=C1)NC2=CC=C(C=C2)C3=C(C=CC(=C3)NC4=CC=CC=C4)C=C5C=CC(=[NH+]C6=CC=CC=C6)C=C5.CC1=CC(=CC=C1)NC2=CC=C(C=C2)C3=C(C=CC(=C3)NC4=CC=CC=C4)C=C5C=CC(=[NH+]C6=CC=CC=C6)C=C5.[O-]S(=O)(=O)[O-]	{1: 2, 6: 2, 14: 50, 15: 4, 29: 4, 31: 6}
Did not match all atoms present	29245-72-5	CS[S]	{40: 1, 1: 1}
Did not match all atoms present	29246-97-7	CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O	{1: 1, 2: 11, 14: 10, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	2926-27-4	C(F)(F)(F)S(=O)(=O)[O-].[K+]	{16: 3, 4: 1, 29: 3}
Did not match all atoms present	29261-33-4	C(#N)C(=C1C(=C(C(=C(C#N)C#N)C(=C1F)F)F)F)C#N	{16: 4, 37: 4, 7: 2}
Did not match all atoms present	29267-67-2	COC1=C(C=CC=C1O)O	{1: 1, 22: 1, 21: 2, 14: 3}
Did not match all atoms present	29267-79-6	CC1=C(C=CC(=C1)N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)NC4=C(C=C(C=C4)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 14: 16, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	2927-34-6	CC1=CC(=C(C=C1)F)F	{16: 2, 1: 1, 14: 3}
Did not match all atoms present	29270-56-2	C1=C(C2=NON=C2C(=C1)F)[N+](=O)[O-]	{16: 1, 35: 2, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	2928-17-8	CC(C)(CC1=CC=C(C=C1)F)O	{1: 2, 2: 1, 4: 1, 14: 4, 16: 1, 20: 1}
Did not match all atoms present	2928-43-0	C1=CC=C(C=C1)C2=CC=CC=C2CO	{2: 1, 20: 1, 14: 9}
Did not match all atoms present	29289-13-2	CC1=CC(=C(C=C1)N)I	{1: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	2929-14-8	COC1=CC=CC2=C1NC(=CC2=O)C(=O)O	{32: 1, 1: 1, 14: 4, 22: 1, 25: 1, 27: 1}
Did not match all atoms present	2929-52-4	CCCCCC[Si](CCCCCC)CCCCCC	{1: 3, 2: 15}
Did not match all atoms present	2929-86-4	CCCCCCCCCCOP(OCCCCCCCCCC)OCCCCCCCCCC	{1: 3, 2: 27, 22: 3}
Did not match all atoms present	2929-95-5	CC(C)OP(=S)(OC(C)C)[S-].CC(C)OP(=S)(OC(C)C)[S-].[Zn+2]	{1: 8, 3: 4, 22: 4}
Did not match all atoms present	29291-35-8	C1=CC(=CC=C1C(=O)N([C@@H](CCC(=O)O)C(=O)O)N=O)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N	{32: 1, 33: 1, 2: 3, 3: 1, 34: 1, 14: 5, 35: 3, 24: 1, 25: 1, 27: 2, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	2930-05-4	C1C(O1)COCC2=CC=CC=C2	{2: 2, 11: 1, 12: 1, 14: 5, 22: 1, 23: 1}
Did not match all atoms present	2930-32-7	CCCCC[O+]=C1C=CC(=C2C=C(SC(=C2)C3=CC=C(C=C3)CC)C4=CC=C(C=C4)CC)C=C1.[O-]Cl(=O)(=O)=O	{1: 3, 2: 6, 41: 1, 14: 14, 15: 4, 17: 1, 22: 1, 29: 4}
Did not match all atoms present	29308-56-3	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N=NC3=C(C=C(C=C3)N(CCOC(=O)C4=CC=CC=C4)CCOC(=O)C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)C	{1: 2, 2: 4, 33: 1, 34: 4, 14: 25, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	29312-59-2	CN(C)C1=CC=C(C=C1)C2=CC(=NC(=C2)C3=CC=CC=C3)C4=CC=CC=C4	{1: 2, 35: 1, 14: 16, 33: 1}
Did not match all atoms present	2932-65-2	CCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 2, 14: 4}
Did not match all atoms present	2932-78-7	C=C=[CH]	{8: 1, 5: 1}
Did not match all atoms present	29329-88-2	CCN1C(N(C2=NC3=CC=CC=C3N=C21)CC)/C=C/C4=C(N(C5=CC=CC=C54)C)C6=CC=CC=C6.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 35: 2, 6: 2, 33: 3, 12: 1, 14: 17, 29: 3}
Did not match all atoms present	29329-99-5	C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2C4=CC=CC=C4)C=O	{33: 1, 26: 1, 14: 14}
Did not match all atoms present	2933-59-7	C1=CC=C2C(=C1)C=CC=C2NCCO	{2: 2, 20: 1, 14: 7, 31: 1}
Did not match all atoms present	2933-74-6	CC1=CC=C(C=C1)NCCO	{1: 1, 2: 2, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	2933-94-0	CC1=CC(=CC=C1)OCC(CNC(C)C)O	{1: 3, 2: 2, 3: 2, 14: 4, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	29331-39-3	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)OC5CCC6(C7CCC8(C(C7CC=C6C5)CCC8C(C)CCCC(C)C)C)C)C)C	{1: 10, 2: 6, 3: 4, 11: 16, 12: 10, 13: 4, 14: 2, 15: 2}
Did not match all atoms present	29333-57-1	CC1=C(C(=O)N(C(=O)C1=NNC2=CC(=CC=C2)OS(=O)(=O)N(C)C)C)C#N	{1: 4, 34: 1, 37: 1, 33: 2, 14: 4, 15: 3, 22: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	29334-16-5	C1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)O	{18: 1, 3: 1, 20: 1, 14: 9}
Did not match all atoms present	29334-18-7	C1=CC(=CC=C1C(C2=CC=C(C=C2)Br)O)Br	{18: 2, 3: 1, 20: 1, 14: 8}
Did not match all atoms present	29334-75-6	C1=CC=C(C=C1)CN(C2=CC=CC=C2)N(CC3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 2: 2, 14: 20}
Did not match all atoms present	29338-49-6	CC(C(C1=CC=CC=C1)C2=CC=CC=C2)O	{1: 1, 3: 2, 20: 1, 14: 10}
Did not match all atoms present	29339-44-4	CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)OC)C	{1: 3, 11: 2, 13: 1, 14: 5, 15: 1, 22: 1, 25: 1}
Did not match all atoms present	29339-45-5	CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)[N+](=O)[O-])C	{1: 2, 38: 1, 11: 2, 13: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	2934-05-6	CC(C)C1=CC(=C(C=C1)O)C(C)C	{1: 4, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	2934-07-8	CC(C)C1=CC(=C(C(=C1)C(C)C)O)C(C)C	{1: 6, 3: 3, 21: 1, 14: 2}
Did not match all atoms present	29349-67-5	CC1=C(C(=CC=C1)S(=O)(=O)C2=CC=CC=C2C)C	{1: 3, 29: 2, 14: 7}
Did not match all atoms present	2935-35-5	C1=CC=C(C=C1)[C@@H](C(=O)O)N	{27: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	29362-18-3	C1=CC(=C(C=C1C(F)(F)F)[N+]#N)Cl	{16: 3, 17: 1, 34: 1, 4: 1, 14: 3}
Did not match all atoms present	29366-06-1	[2H]C([2H])([2H])OC(C)C	{1: 3, 3: 1, 22: 1}
Did not match all atoms present	2937-53-3	C(CSS(=O)(=O)O)N	{40: 1, 2: 2, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	2938-46-7	C[Al](I)I	{1: 1, 19: 2}
Did not match all atoms present	2938-66-1	CCC1(CCCC2=CC=CC=C21)CC	{1: 2, 2: 2, 11: 3, 13: 1, 14: 4}
Did not match all atoms present	2938-72-9	C[Al](C)I	{1: 2, 19: 1}
Did not match all atoms present	29380-04-9	C1=NNC(=N1)N.OS(=O)(=O)O	{32: 1, 35: 2, 14: 1, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	29382-68-1	C=COC(=O)C1=CC=CC=C1C(=O)O	{14: 4, 27: 1, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	29385-30-6	CO[Si](CCC1=CC=CC=C1S(=O)(=O)N=[N+]=[N-])(OC)OC	{1: 3, 2: 2, 34: 2, 14: 4, 22: 3, 29: 2}
Did not match all atoms present	29385-40-8	CC(C1=CC=CC=C1)C2=CC=CC=C2OC	{1: 2, 3: 1, 22: 1, 14: 9}
Did not match all atoms present	29396-39-2	C1CCC(CC1)[N+]2=NOC(=C2)N.[Cl-]	{33: 1, 35: 1, 11: 5, 12: 1, 14: 1, 17: 1, 23: 1, 30: 1}
Did not match all atoms present	29407-84-9	CCCCOCC1CO1.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl	{1: 3, 2: 5, 4: 1, 11: 2, 12: 2, 14: 8, 17: 1, 21: 2, 22: 1, 23: 2}
Did not match all atoms present	2941-19-7	CCCC(C1=CC=CC=C1)N	{1: 1, 2: 2, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	2941-20-0	CCC(C1=CC=CC=C1)N	{1: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	2941-62-0	CC1=NC2=C(S1)C=C(C=C2)N	{1: 1, 35: 1, 30: 1, 14: 3, 41: 1}
Did not match all atoms present	2941-63-1	CC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 3, 41: 1}
Did not match all atoms present	2941-66-4	CC1=NC2=C(S1)C=CC(=C2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 3, 41: 1}
Did not match all atoms present	2941-69-7	CC1=NC2=C(S1)C=CC(=C2)OC	{1: 2, 35: 1, 22: 1, 14: 3, 41: 1}
Did not match all atoms present	2941-71-1	CC1=CC2=C(C=C1)N=C(S2)C	{1: 2, 35: 1, 14: 3, 41: 1}
Did not match all atoms present	2941-72-2	CC1=NC2=C(S1)C=C(C=C2)OC	{1: 2, 35: 1, 22: 1, 14: 3, 41: 1}
Did not match all atoms present	2941-78-8	CC1=CC(=C(C=C1)N)C(=O)O	{1: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	29411-74-3	C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=C(N=C2[Se])N	{33: 1, 2: 1, 35: 3, 12: 4, 14: 1, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	29416-86-2	C1=CC2=C3C(=C1)NC(=NC3=CC=C2)N.Cl	{32: 1, 17: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	29418-67-5	C1=CC=C(C(=C1)C(=O)NN)Br	{24: 1, 18: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	2942-06-5	C1=CC2=C(C=C1[N+](=O)[O-])SC=N2	{41: 1, 35: 1, 38: 1, 14: 4}
Did not match all atoms present	2942-42-9	C1=CC2=C(C(=C1)[N+](=O)[O-])NN=C2	{32: 1, 35: 1, 38: 1, 14: 4}
Did not match all atoms present	2942-58-7	CCOP(=O)(C#N)OCC	{1: 2, 2: 2, 29: 1, 22: 2, 37: 1}
Did not match all atoms present	29420-78-8	CC(C)CC(C)(C)CO.CC(C)CC(C)(C)CO.CC(C)CC(C)(C)CO.OP(=O)(O)O	{1: 12, 2: 6, 3: 3, 4: 3, 20: 6, 29: 1}
Did not match all atoms present	29427-58-5	COC(=N)N.OS(=O)(=O)O	{1: 1, 36: 1, 7: 1, 20: 2, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	2943-62-6	C[Si](C)(C)O[Si](C)(C)Cl	{1: 5, 22: 1, 17: 1}
Did not match all atoms present	2943-70-6	C[Si](C)(C(Cl)Cl)O[Si](C)(C)C(Cl)Cl	{1: 4, 3: 2, 22: 1, 17: 4}
Did not match all atoms present	2943-75-1	CCCCCCCC[Si](OCC)(OCC)OCC	{1: 4, 2: 10, 22: 3}
Did not match all atoms present	29431-45-6	C1=CC=C(C=C1)C2=C(N=C(O2)C3=CC=CC=C3)Cl	{17: 1, 35: 1, 14: 10, 23: 1}
Did not match all atoms present	2944-05-0	[C-]#[S+]	{}
Did not match all atoms present	2944-11-8	CCCCCCCCCCCCCCCCCCOC(=O)CCC(=O)[O-]	{24: 1, 1: 1, 2: 19, 28: 1}
Did not match all atoms present	2944-12-9	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O	{25: 2, 14: 16, 31: 2}
Did not match all atoms present	2944-19-6	CC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O	{1: 1, 31: 1, 14: 11, 25: 2}
Did not match all atoms present	2944-26-5	C1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C=CC=C4NC5=CC=CC=C5	{25: 2, 14: 16, 31: 2}
Did not match all atoms present	2944-27-6	C1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=CC=C5	{25: 2, 14: 16, 31: 2}
Did not match all atoms present	2944-49-2	CC1=C(C(=CC=C1)OC)C	{1: 3, 22: 1, 14: 3}
Did not match all atoms present	2944-58-3	C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)Cl)O	{17: 1, 28: 1, 21: 1, 14: 8}
Did not match all atoms present	2944-67-4	C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O.N.N.N.[Fe+3]	{24: 3, 27: 3}
Did not match all atoms present	29443-23-0	CC[N+](CC)(CC)CC=C.[Br-]	{1: 3, 2: 4, 18: 1, 5: 1, 6: 1}
Did not match all atoms present	29444-28-8	CCCCCCCCCCOC(=O)CS(=O)(=O)[O-].[Na+]	{1: 1, 2: 10, 28: 1, 29: 3}
Did not match all atoms present	29444-46-0	CCCC1=NC(=CN=C1)C	{1: 2, 2: 2, 35: 2, 14: 2}
Did not match all atoms present	29446-15-9	C1=CC=C2C(=C1)OC3=CC(=C(C=C3O2)Cl)Cl	{17: 2, 14: 6, 23: 2}
Did not match all atoms present	29449-91-0	CN(C)CCOC1=NC(=CC=C1)OCCN(C)C	{1: 4, 2: 4, 35: 1, 33: 2, 14: 3, 22: 2}
Did not match all atoms present	2945-08-6	COC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	2945-41-7	CC[Ge](CC)(CC)CC1=CC=CC=C1	{1: 3, 2: 4, 14: 5}
Did not match all atoms present	2945-96-2	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)N)OC)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-].[Na+]	{1: 2, 34: 3, 14: 10, 15: 2, 22: 1, 25: 1, 29: 3, 30: 2, 31: 1}
Did not match all atoms present	29450-09-7	CN(C)CCOC1=CC=CC=N1	{1: 2, 2: 2, 35: 1, 33: 1, 14: 4, 22: 1}
Did not match all atoms present	29450-63-3	C(=NO)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{17: 5, 34: 1, 20: 1, 6: 1}
Did not match all atoms present	29454-06-6	CCCCCCCCCC(=O)OCCS(=O)(=O)O.[Na+]	{1: 1, 2: 10, 20: 1, 29: 2, 28: 1}
Did not match all atoms present	29454-23-7	CCCCCCCCCCCCC(C(=O)OC)S(=O)(=O)O	{1: 2, 2: 11, 3: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	29457-72-5	[Li+].C(C(C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 17, 4: 8, 29: 3}
Did not match all atoms present	2946-15-8	CC1=NC2=C([Se]1)C=CC(=C2)Cl	{1: 1, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	2946-17-0	CC1=NC2=C([Se]1)C=CC(=C2)OC	{1: 2, 35: 1, 22: 1, 14: 3}
Did not match all atoms present	2946-20-5	CC1=CC2=C(C=C1C)[Se]C(=N2)C	{1: 3, 35: 1, 14: 2}
Did not match all atoms present	2946-39-6	C1=NC2=C(C(=N1)N)N=C(N2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)Br	{33: 1, 2: 1, 35: 3, 12: 4, 14: 1, 18: 1, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	2946-61-4	COP(C1=CC=CC=C1)OC	{1: 2, 22: 2, 14: 5}
Did not match all atoms present	2946-89-6	CC1=CC(=NN1C(=N[N+](=O)[O-])N)C	{1: 2, 34: 1, 35: 1, 38: 1, 33: 1, 7: 1, 14: 1, 30: 1}
Did not match all atoms present	29460-92-2	CC(C)CC1=NC=CN=C1	{1: 2, 2: 1, 3: 1, 14: 3, 35: 2}
Did not match all atoms present	29461-03-8	CCCC1=NC=C(N=C1)C	{1: 2, 2: 2, 35: 2, 14: 2}
Did not match all atoms present	29462-18-8	C1CCC2=C(C1)C3=C(NCC(=O)N=C3S2)C4=CC=CC=C4	{32: 1, 35: 1, 41: 1, 11: 5, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	29462-73-5	CCCCCCCCCCCCCCOC(=O)CS(=O)(=O)[O-].[Na+]	{1: 1, 2: 14, 28: 1, 29: 3}
Did not match all atoms present	29462-74-6	CCCCCCCCCCCCCCCCOC(=O)CS(=O)(=O)[O-].[Na+]	{1: 1, 2: 16, 28: 1, 29: 3}
Did not match all atoms present	29462-75-7	CCCCCCCCOC(=O)CS(=O)(=O)[O-].[Na+]	{1: 1, 2: 8, 28: 1, 29: 3}
Did not match all atoms present	2947-60-6	CC1=CC(=CC=C1)CC#N	{1: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	2947-61-7	CC1=CC=C(C=C1)CC#N	{1: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	29471-17-8	CC(C)(C)C1=CC2=C(C=C1)OCCOCCOC3=C(C=CC(=C3)C(C)(C)C)OCCOCCO2	{1: 6, 11: 8, 4: 2, 14: 6, 23: 6}
Did not match all atoms present	29471-80-5	C(CN)N.C(CN)N.C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].[Cu+2].[Hg+2]	{2: 4, 37: 4, 30: 4}
Did not match all atoms present	29472-95-5	CCC(C)C1=C(C=C(C=C1)C)O	{1: 3, 2: 1, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	29473-77-6	C(CCCCC(=O)[O-])CCCC(=O)[O-].[Pb+2]	{24: 2, 2: 8}
Did not match all atoms present	29477-83-6	C1OC2=C(O1)C(=C3C(=C2)C4=C[C@@H]([C@H]([C@H]([C@@H]4NC3=O)O)O)O)O	{32: 1, 11: 1, 12: 4, 14: 2, 15: 1, 20: 3, 21: 1, 23: 2, 25: 1}
Did not match all atoms present	2948-46-1	CC(C)(C1=CC=C(C=C1)C(C)(C)O)O	{1: 4, 4: 2, 14: 4, 20: 2}
Did not match all atoms present	29488-27-5	CC(C)C1=CSC=C1	{1: 2, 3: 1, 14: 3, 41: 1}
Did not match all atoms present	2949-26-0	C#CC1=CC2=CC=CC=C2C=C1	{9: 1, 10: 1, 14: 7}
Did not match all atoms present	2949-42-0	CC(C)[Sn](C(C)C)(C(C)C)C(C)C	{1: 8, 3: 4}
Did not match all atoms present	2949-92-0	CSS(=O)(=O)C	{40: 1, 1: 2, 29: 2}
Did not match all atoms present	29490-19-5	CC1=NNC(=S)S1	{32: 1, 1: 1, 35: 1, 41: 1}
Did not match all atoms present	2950-43-8	NOS(=O)(=O)O	{30: 1, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	2950-45-0	N1=P(N=P(N=P(N=P1(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 8, 35: 4}
Did not match all atoms present	29507-62-8	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Al+3]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	29507-64-0	CC(C)(C)C1=CC(=S)SS1	{1: 3, 4: 1, 14: 1, 41: 2}
Did not match all atoms present	29508-15-4	C(C(=O)O)S(=O)(=O)[O-].[Na+]	{2: 1, 27: 1, 29: 3}
Did not match all atoms present	29508-45-0	CC[N+](C)(C)CC.[Cl-]	{1: 4, 2: 2, 17: 1}
Did not match all atoms present	29508-47-2	CC1=[N+](N(N=C1)C)N=NC2=CC=C(C=C2)N(C)CC3=CC=CC=C3.[Cl-]	{1: 3, 2: 1, 35: 1, 33: 3, 34: 2, 14: 10, 17: 1}
Did not match all atoms present	29510-76-7	CC1=C[N+](=C(N1C2=CC(=C(C=C2)Cl)Cl)Cl)C(C)C.[Cl-]	{1: 3, 3: 1, 33: 2, 14: 4, 17: 4}
Did not match all atoms present	29515-37-5	CCOC1=C(C=CC=C1OC)OC	{1: 3, 2: 1, 22: 3, 14: 3}
Did not match all atoms present	29518-68-1	C1=CC=C2C(=C1)NC(=N2)CCN	{32: 1, 2: 2, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	29528-33-4	CCC(CC)C1=CC=C(C=C1)O	{1: 2, 2: 2, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	29529-99-5	CCCCN(CCCC)C1=NC(=S)NC(=S)N1	{32: 2, 1: 2, 2: 6, 35: 1, 33: 1}
Did not match all atoms present	2953-29-9	COP(=S)(OC)SC	{40: 1, 1: 3, 22: 2}
Did not match all atoms present	29530-50-5	CC1=CC(=C(C=C1)OC)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 2, 34: 2, 38: 1, 22: 1, 14: 7}
Did not match all atoms present	2954-50-9	C1CC2=CC=CC=C2CC1N	{11: 3, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	29540-83-8	CC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	29549-60-8	CCSC1=CC=CC=C1O	{40: 1, 1: 1, 2: 1, 21: 1, 14: 4}
Did not match all atoms present	2955-38-6	C1CC1CN2C(=O)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4	{33: 1, 2: 1, 35: 1, 11: 3, 12: 1, 14: 8, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	29554-26-5	C1=CC(=C(C=C1C=CC(=O)NCCCCN)O)O	{2: 4, 6: 2, 14: 3, 21: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	29556-33-0	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=[N+](C4=CC=CC=C4N3C)C.[Cl-]	{1: 4, 2: 2, 33: 3, 14: 8, 17: 1, 28: 1}
Did not match all atoms present	29558-77-8	C1=CC(=CC=C1C2=CC=C(C=C2)Br)O	{18: 1, 21: 1, 14: 8}
Did not match all atoms present	29559-27-1	CC1=CC=C(C=C1)C[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	29560-58-5	CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)CCN4CCOCC4.Cl	{1: 1, 2: 3, 33: 2, 41: 1, 11: 4, 14: 7, 17: 1, 23: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	29571-17-3	C1=CC=C2C(=C1)C=CC=C2CCCCC3=CC=CC4=CC=CC=C43	{2: 4, 14: 14}
Did not match all atoms present	29572-80-3	CCN1C2=C(C=CC(=C2)C3=CC=CC=C3)OC1=CC(=CC4=[N+](C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CC)C.[I-]	{1: 3, 2: 2, 33: 2, 6: 2, 7: 1, 14: 16, 15: 1, 19: 1, 23: 2}
Did not match all atoms present	29575-02-8	CCCCCCCC[Sn](CCCCCCCC)(OC(=O)C=CC(=O)OCCCC)OC(=O)C=CC(=O)OCCCC	{1: 4, 2: 20, 28: 4, 6: 4}
Did not match all atoms present	29577-53-5	COC1=CC=CC=C1/C=N/O	{1: 1, 34: 1, 6: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	2958-09-0	CCCCCCCCCCCCCCCCCCOP(=O)(O)O	{1: 1, 2: 17, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	2958-36-3	C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)Cl	{24: 1, 17: 2, 30: 1, 14: 7}
Did not match all atoms present	2958-46-5	CN(C)C1=CC=C(C=C1)C=C(C#N)C2=CC=C(C=C2)Cl	{1: 2, 37: 1, 6: 1, 33: 1, 7: 1, 14: 8, 17: 1}
Did not match all atoms present	2958-60-3	CC1=C(C(=CN=O)C(=C(C1=CNO)C)C)C	{1: 4, 34: 1, 6: 2, 20: 1, 29: 1, 31: 1}
Did not match all atoms present	2958-87-4	C1=CC2=C(C=C1Cl)N=C(C(=N2)Cl)Cl	{17: 3, 35: 2, 14: 3}
Did not match all atoms present	29584-42-7	CN(C)C=O.O=S(=O)=O	{1: 2, 26: 1, 29: 3, 33: 1}
Did not match all atoms present	29584-92-7	CCC1=C(N=CO1)C	{1: 2, 2: 1, 35: 1, 14: 1, 23: 1}
Did not match all atoms present	29585-45-3	C1=CC(C(C(C1O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{12: 4, 22: 4, 14: 2}
Did not match all atoms present	2959-03-7	C1=CC=C2C(=C1)C(=O)C(=O)N2Cl	{17: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	2959-75-3	CC(C)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 3: 1, 29: 1, 14: 10}
Did not match all atoms present	2959-96-8	C1CC(=O)OC(=O)C1C2=CC=CC=C2	{28: 2, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	2960-93-2	COC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OC	{1: 2, 22: 2, 14: 12}
Did not match all atoms present	29602-11-7	CCO[Si](CCCN1C(=O)C=CC1=O)(OCC)OCC	{1: 3, 2: 6, 33: 1, 14: 2, 22: 3, 25: 2}
Did not match all atoms present	29602-39-9	C1=CC(=NC=C1[N+](=O)[O-])NCCN	{2: 2, 35: 1, 38: 1, 14: 3, 30: 1, 31: 1}
Did not match all atoms present	29604-75-9	C1=CC(=C(C=C1Br)Br)Cl	{17: 1, 18: 2, 14: 3}
Did not match all atoms present	2961-47-9	CCCCC(CCCC)C1=CC=NC=C1	{1: 2, 2: 6, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	2961-49-1	CCCCC(CCCC)C1=CC=CC=N1	{1: 2, 2: 6, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	2961-50-4	CCCCCC1=CC=NC=C1	{1: 1, 2: 4, 35: 1, 14: 4}
Did not match all atoms present	2961-61-7	[Li+].C1=C(C=C(C(=C1I)[O-])I)C#N	{19: 2, 37: 1, 14: 2}
Did not match all atoms present	2962-90-5	CN1C2=NC3=CC=CC=C3N=C2C(=O)N(C1=O)C	{1: 2, 35: 2, 33: 2, 14: 4, 25: 2}
Did not match all atoms present	29621-88-3	C([C@@H](C(=O)O)N)[Se][Se]C[C@@H](C(=O)O)N	{27: 2, 2: 2, 3: 2, 30: 2}
Did not match all atoms present	29624-27-9	CS/C(=C/SC1=CC=C(C=C1)[N+](=O)[O-])/C2=CC=CC=C2	{1: 1, 6: 1, 38: 1, 7: 1, 40: 2, 14: 9}
Did not match all atoms present	2963-66-8	C1=CC=C2C(=C1)NC(=C3C=CC=CC3=O)N2	{32: 2, 25: 1, 14: 8, 15: 2}
Did not match all atoms present	2963-75-9	CCCCC(=O)OCC[N+](C)(C)C.[I-]	{1: 4, 2: 5, 19: 1, 28: 1}
Did not match all atoms present	2963-87-3	C1=CC2=C3C(=C1)[C@H]([C@@H](C3=CC=C2)O)O	{20: 2, 12: 2, 14: 6}
Did not match all atoms present	29633-64-5	CC(=O)NC1=CC(=C(C=C1)OC)NC2CCCCC2	{1: 2, 11: 5, 12: 1, 14: 3, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	29633-66-7	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])[N+](=O)[O-])OC)NC3CCCCC3	{1: 2, 34: 2, 37: 1, 38: 2, 11: 5, 12: 1, 14: 4, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	29634-17-1	C(C(F)(F)P1P(P1C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F)(F)(F)F	{16: 15, 4: 6}
Did not match all atoms present	29636-27-9	CNS(=O)(=O)C1=CC(=C(C=C1)N)C(=O)O	{1: 1, 14: 3, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	29636-87-1	CC1=C(N=CN1)CO	{32: 1, 1: 1, 2: 1, 35: 1, 14: 1, 20: 1}
Did not match all atoms present	29637-13-6	CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CCC(C)S(=O)(=O)[O-]	{1: 2, 2: 3, 3: 1, 6: 1, 33: 2, 41: 1, 14: 10, 15: 1, 29: 3}
Did not match all atoms present	29637-14-7	CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])C=CC4=CC=CC=C41	{1: 1, 2: 5, 6: 1, 33: 2, 14: 12, 15: 1, 29: 3}
Did not match all atoms present	29637-18-1	CCN1C(=CC(=C2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C)C)SC4=C1C5=CC=CC=C5C=C4	{1: 3, 2: 1, 35: 1, 33: 2, 6: 1, 7: 1, 41: 1, 14: 10, 15: 3, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	29637-29-4	CCN1C2=CC=CC=C2OC1=CC=CC=C3C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)O)C	{1: 2, 2: 1, 35: 1, 6: 4, 33: 2, 14: 8, 15: 3, 20: 1, 23: 1, 25: 1, 29: 2}
Did not match all atoms present	29638-63-9	CCCCNCC(COC1=CC=CC=C1)O	{1: 1, 2: 5, 3: 1, 14: 5, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	29639-53-0	CC1=CC=CC=CC1=O	{1: 1, 14: 5, 25: 1}
Did not match all atoms present	2964-48-9	C1=CC(=CC=C1[C@@H]([C@H](CO)N)O)[N+](=O)[O-]	{2: 1, 3: 2, 38: 1, 14: 4, 20: 2, 30: 1}
Did not match all atoms present	29644-99-3	CCC(C1=CC=C(C=C1)OC)C(=O)O	{1: 2, 2: 1, 3: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	29647-03-8	C1CC(CCC1CN=C=S)CN=C=S	{8: 2, 2: 2, 11: 4, 12: 2, 34: 2}
Did not match all atoms present	29649-47-6	CCN(CCN1C(=O)CCC1=O)C2=CC(=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)NC(=O)C	{1: 2, 2: 3, 38: 1, 33: 2, 11: 2, 34: 2, 14: 6, 17: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	29649-48-7	CCN(CCN1C(=O)CCC1=O)C2=CC(=C(C=C2)N=NC3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C	{1: 2, 2: 3, 38: 1, 33: 2, 11: 2, 34: 2, 14: 7, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	2965-52-8	CCN(CCOP(=O)(O)OCCN(CC)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 6, 4: 16, 33: 2, 16: 34, 20: 1, 22: 2, 29: 5}
Did not match all atoms present	29650-44-0	CC(=O)OC1=CC=CC=C1F	{16: 1, 1: 1, 28: 1, 14: 4}
Did not match all atoms present	29650-92-8	CCCCCCCCCCC1=NC(=NC(=N1)N)N	{1: 1, 2: 9, 35: 3, 30: 2}
Did not match all atoms present	29654-55-5	C1=C(C=C(C=C1O)O)CO	{2: 1, 20: 1, 21: 2, 14: 3}
Did not match all atoms present	2966-50-9	C(=O)(C(F)(F)F)[O-].[Ag+]	{16: 3, 24: 1, 4: 1}
Did not match all atoms present	29663-54-5	C1=CC=C[CH+]C=C1.F[P-](F)(F)(F)(F)F	{16: 6, 14: 7}
Did not match all atoms present	29664-84-4	[Sb]#[Sm]	{}
Did not match all atoms present	29665-46-1	CCCCCCCCCCCC(C1=CC(=CC=C1)OC)O	{1: 2, 2: 10, 3: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	29668-44-8	C1COC2=C(O1)C=CC(=C2)C=O	{26: 1, 11: 2, 14: 3, 23: 2}
Did not match all atoms present	29668-61-9	CCOP(=O)(C(C)C#N)OCC	{1: 3, 2: 2, 3: 1, 37: 1, 22: 2, 29: 1}
Did not match all atoms present	2967-66-0	COC(=O)C1=CC=C(C=C1)C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4, 28: 1}
Did not match all atoms present	29671-18-9	C[O-].C[O-].C[O-].[Sb+3]	{1: 3, 29: 3}
Did not match all atoms present	29674-96-2	CN[NH3+].[N+](=O)([O-])[O-]	{1: 1, 31: 1}
Did not match all atoms present	29676-71-9	C1=C(N=C(S1)N)CC(=O)O	{2: 1, 35: 1, 41: 1, 14: 1, 27: 1, 30: 1}
Did not match all atoms present	29676-95-7	CN1C=C(C(=O)C2=C1N=C(C=C2)/C=C/C3=CC=C(O3)[N+](=O)[O-])C(=O)[O-].[K+]	{1: 1, 35: 1, 38: 1, 6: 2, 33: 1, 14: 5, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	296775-93-4	C1=CC=C2C(=C1)C(=CN2)C[NH3+]	{32: 1, 2: 1, 14: 5}
Did not match all atoms present	29680-54-4	CC1=[N+](C2=CC=CC=C2[Se]1)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 29: 3, 14: 4, 33: 1}
Did not match all atoms present	29682-41-5	C1=CC(=C(C=C1Cl)I)Cl	{17: 2, 19: 1, 14: 3}
Did not match all atoms present	29682-46-0	CC1=C(C=CC(=C1Cl)[N+](=O)[O-])Cl	{1: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	29684-26-2	C1=C(C=C(C=C1C(F)(F)F)[N+]#N)C(F)(F)F	{16: 6, 34: 1, 4: 2, 14: 3}
Did not match all atoms present	29684-42-2	COC1=C(C=C(C=C1)Cl)[N+]#N	{1: 1, 34: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	29684-43-3	C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)[N+]#N)Cl.[Cl-]	{17: 3, 34: 1, 22: 1, 14: 7}
Did not match all atoms present	29684-56-8	CC[N+](CC)(CC)S(=O)(=O)/N=C(\[O-])/OC	{1: 4, 2: 3, 7: 1, 34: 1, 22: 1, 29: 2}
Did not match all atoms present	29689-14-3	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Cr+3].[Cr+3]	{24: 3}
Did not match all atoms present	29696-97-7	N=[Si]=N	{36: 2}
Did not match all atoms present	297-97-2	CCOP(=S)(OCC)OC1=NC=CN=C1	{1: 2, 2: 2, 35: 2, 22: 3, 14: 3}
Did not match all atoms present	297-99-4	CCN(CC)C(=O)C(=C(C)OP(=O)(OC)OC)Cl	{1: 5, 2: 2, 33: 1, 7: 2, 17: 1, 22: 3, 24: 1, 29: 1}
Did not match all atoms present	29701-07-3	C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)N)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)N)N.[O-]S(=O)(=O)[O-]	{2: 2, 11: 1, 12: 15, 20: 6, 22: 2, 23: 2, 29: 4, 30: 5}
Did not match all atoms present	29703-19-3	[O-].[OH-].[OH-].[O].[Sb+2]	{}
Did not match all atoms present	29704-02-7	CCN1CCNC1=S	{32: 1, 1: 1, 2: 1, 33: 1, 11: 2, 15: 1}
Did not match all atoms present	29705-38-2	C1=CC(=C(C=C1N(CCO)CCO)[N+](=O)[O-])F	{33: 1, 2: 4, 38: 1, 14: 3, 16: 1, 20: 2}
Did not match all atoms present	2971-22-4	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(Cl)(Cl)Cl	{17: 3, 3: 1, 4: 1, 14: 10}
Did not match all atoms present	2971-36-0	C1=CC(=CC=C1C(C2=CC=C(C=C2)O)C(Cl)(Cl)Cl)O	{17: 3, 3: 1, 4: 1, 21: 2, 14: 8}
Did not match all atoms present	2971-38-2	C1=CC(=C(C=C1Cl)Cl)OCC(=O)OCC=CCCl	{2: 3, 6: 2, 14: 3, 17: 3, 22: 1, 28: 1}
Did not match all atoms present	2971-90-6	CC1=C(C(=O)C(=C(N1)C)Cl)Cl	{32: 1, 1: 2, 25: 1, 17: 2}
Did not match all atoms present	29711-79-3	CN(C)C1=CC=C(C2=CC=CC=C21)N=C=S	{8: 1, 1: 2, 34: 1, 14: 6, 33: 1}
Did not match all atoms present	2972-81-8	CCOC1=C(C=C(C=C1)C=C(C#N)C#N)OCC	{1: 2, 2: 2, 37: 2, 6: 1, 7: 1, 14: 3, 22: 2}
Did not match all atoms present	29727-38-6	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+]#N.C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+]#N.[O-]S(=O)(=O)[O-]	{34: 2, 38: 4, 29: 4, 14: 6}
Did not match all atoms present	29727-70-6	C1=CC2=C(C=CC(=C2CS(=O)(=O)O)N)C=C1S(=O)(=O)O	{2: 1, 30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	2973-10-6	CC(C)OS(=O)(=O)OC(C)C	{1: 4, 3: 2, 29: 2, 22: 2}
Did not match all atoms present	2973-19-5	C1=CC(=C(C=C1[N+](=O)[O-])CCl)O	{17: 1, 2: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	2973-27-5	C1=CC=C2C(=C1)C(=CC=N2)C#N	{35: 1, 37: 1, 14: 6}
Did not match all atoms present	2973-75-3	COC1=C(C(=C(C(=C1)C=O)Br)Br)O	{1: 1, 14: 1, 18: 2, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	2973-76-4	COC1=C(C(=CC(=C1)C=O)Br)O	{1: 1, 14: 2, 18: 1, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	2973-77-5	C1=C(C=C(C(=C1Br)O)Br)C=O	{18: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	2973-78-6	C1=CC(=C(C=C1C=O)Br)O	{18: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	29732-59-0	C(C1C(C(C(C(O1)OP(=O)([O-])[O-])O)O)O)O.[K+].[K+]	{2: 1, 12: 5, 20: 4, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	29734-68-7	CO[C@@H]1C[C@@]23C(CC[NH+]2CCC4=C3CC(=O)OC4)C=C1.[Br-]	{1: 1, 11: 7, 12: 2, 13: 1, 14: 2, 15: 2, 18: 1, 22: 1, 28: 1}
Did not match all atoms present	29736-24-1	C(C(=O)[O-])(O)S(=O)(=O)[O-].[Na+].[Na+]	{24: 1, 3: 1, 20: 1, 29: 3}
Did not match all atoms present	29736-75-2	C1CO[Sb]2OCCO[Sb](O1)OCCO2	{11: 6, 23: 6}
Did not match all atoms present	2974-10-9	C1=CC=C(C=C1)SC2=CC(=CC=C2)SC3=CC=CC=C3	{40: 2, 14: 14}
Did not match all atoms present	2974-90-5	C1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)Cl	{17: 2, 14: 8}
Did not match all atoms present	2974-92-7	C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	29743-03-1	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[Sb](C2=CC=CC=C2)C3=CC=CC=C3.[W]	{29: 5, 14: 15}
Did not match all atoms present	29743-08-6	CCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCC	{1: 2, 34: 1, 6: 1, 2: 4, 14: 8, 22: 1}
Did not match all atoms present	29743-09-7	CCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCCCC	{1: 2, 34: 1, 6: 1, 2: 6, 14: 8, 22: 1}
Did not match all atoms present	29743-11-1	CCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)CCCC	{1: 2, 34: 1, 6: 1, 2: 8, 14: 8, 22: 1}
Did not match all atoms present	29743-12-2	CCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)CCCC	{1: 2, 34: 1, 6: 1, 2: 9, 14: 8, 22: 1}
Did not match all atoms present	29743-18-8	CCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC	{1: 2, 34: 1, 6: 1, 2: 1, 14: 8, 22: 1}
Did not match all atoms present	29743-21-3	CCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)C=NC3=CC=C(C=C3)CCCC	{1: 2, 2: 6, 34: 2, 14: 12, 6: 2}
Did not match all atoms present	29749-04-0	CC(C)[SeH]	{1: 2, 3: 1}
Did not match all atoms present	2975-34-0	CCC(=O)C1=CC2=C(SC3=CC=CC=C3N2CCCN4CCN(CC4)CCO)C=C1.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O	{1: 1, 2: 6, 6: 4, 33: 3, 41: 1, 11: 4, 14: 7, 20: 1, 24: 1, 27: 4}
Did not match all atoms present	2975-41-9	C1C(CC2=CC=CC=C21)N	{11: 2, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	29756-98-7	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[Al+3]	{1: 3, 2: 33, 29: 9, 14: 12}
Did not match all atoms present	2976-30-9	CS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	2976-74-1	C1=CC(=C(C(=C1)Cl)Cl)OCC(=O)O	{17: 2, 2: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	2976-75-2	C1=CC=C2C(=C1)C=CC=C2OCC(=O)O	{2: 1, 27: 1, 22: 1, 14: 7}
Did not match all atoms present	2976-98-9	CCCCS(=O)C	{1: 2, 2: 3, 29: 1}
Did not match all atoms present	2976-99-0	CCCCS(=O)CC	{1: 2, 2: 4, 29: 1}
Did not match all atoms present	29761-21-5	CC(C)CCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 2, 2: 7, 3: 1, 14: 10, 22: 3, 29: 1}
Did not match all atoms present	29767-20-2	COC1=CC(=CC(=C1O)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)OC6C(C(C7C(O6)COC(O7)C8=CC=CS8)O)O	{1: 2, 41: 1, 11: 3, 12: 10, 14: 7, 20: 2, 21: 1, 22: 3, 23: 5, 28: 1}
Did not match all atoms present	2977-69-7	CN(C)CC1=CC(=CC(=C1O)OC)[N+](=O)[O-]	{1: 3, 2: 1, 38: 1, 33: 1, 14: 2, 21: 1, 22: 1}
Did not match all atoms present	2977-70-0	CC1=CC(=CC(=C1O)OC)N.Cl	{1: 2, 14: 2, 17: 1, 21: 1, 22: 1, 30: 1}
Did not match all atoms present	29770-14-7	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=[N+](C2=C(S1)C=C(C=C2)[N+](=O)[O-])C	{1: 3, 38: 1, 33: 1, 41: 1, 14: 7, 29: 3}
Did not match all atoms present	29770-19-2	CC[N+]1=C(SC2=CC=CC=C21)C=NC3=CC=C(C=C3)N(C)C.CCOS(=O)(=O)[O-]	{1: 4, 2: 2, 6: 1, 33: 2, 41: 1, 34: 1, 14: 8, 22: 1, 29: 3}
Did not match all atoms present	29776-97-4	CC(=O)OCCOC=O	{1: 1, 2: 2, 28: 1, 26: 1}
Did not match all atoms present	29777-36-4	COC1=CC=CC(=C1)C2=C(N(C(=N2)C3=CC=CC=C3Cl)N4C(=C(N=C4C5=CC=CC=C5Cl)C6=CC(=CC=C6)OC)C7=CC(=CC=C7)OC)C8=CC(=CC=C8)OC	{1: 4, 35: 2, 33: 2, 14: 24, 17: 2, 22: 4}
Did not match all atoms present	29777-42-2	C1CCN(CC1)C(=O)C2=C(C3=CC=CC=C3C=C2)O	{24: 1, 33: 1, 11: 5, 21: 1, 14: 6}
Did not match all atoms present	29779-09-7	C1=CC=C2C(=C1)C=CC(=C2CS(=O)(=O)[O-])NN=C3C4=CC=CC=C4C=C(C3=O)C(=O)[O-].[Ca+2]	{2: 1, 34: 1, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	2978-11-2	CC(C)NC(=NC(C)C)OCC1=CC=C(C=C1)[N+](=O)[O-]	{1: 4, 2: 1, 3: 2, 38: 1, 7: 1, 34: 1, 14: 4, 22: 1, 31: 1}
Did not match all atoms present	2979-22-8	COC(CO)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	29790-52-1	CN1CCC[C@H]1C2=CN=CC=C2.C1=CC=C(C(=C1)C(=O)O)O	{1: 1, 35: 1, 33: 1, 11: 3, 12: 1, 14: 8, 21: 1, 27: 1}
Did not match all atoms present	298-00-0	COP(=S)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 38: 1, 22: 3, 14: 4}
Did not match all atoms present	298-02-2	CCOP(=S)(OCC)SCSCC	{40: 2, 1: 3, 2: 4, 22: 2}
Did not match all atoms present	298-03-3	CCOP(=S)(OCC)OCCSCC	{40: 1, 1: 3, 2: 5, 22: 3}
Did not match all atoms present	298-04-4	CCOP(=S)(OCC)SCCSCC	{40: 2, 1: 3, 2: 5, 22: 2}
Did not match all atoms present	298-06-6	CCOP(=S)(OCC)S	{1: 2, 2: 2, 22: 2, 39: 1}
Did not match all atoms present	298-07-7	CCCCC(CC)COP(=O)(O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	298-14-6	C(=O)(O)[O-].[K+]	{27: 1}
Did not match all atoms present	298-45-3	CN1CCC2=CC3=C(C4=C2[C@@H]1CC5=C4C(=C(C=C5)OC)O)OCO3	{1: 2, 33: 1, 11: 4, 12: 1, 14: 3, 21: 1, 22: 1, 23: 2}
Did not match all atoms present	298-46-4	C1=CC=C2C(=C1)C=CC3=CC=CC=C3N2C(=O)N	{24: 1, 33: 1, 30: 1, 14: 10}
Did not match all atoms present	298-51-1	CCN(CC)CCOC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31.Cl	{1: 2, 2: 4, 33: 2, 41: 1, 14: 8, 17: 1, 28: 1}
Did not match all atoms present	298-57-7	C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 2: 1, 3: 1, 6: 2, 11: 4, 14: 15}
Did not match all atoms present	298-59-9	COC(=O)C(C1CCCCN1)C2=CC=CC=C2.Cl	{32: 1, 1: 1, 3: 1, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	298-81-7	COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2	{1: 1, 28: 1, 22: 1, 14: 5, 23: 1}
Did not match all atoms present	298-83-9	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-]	{1: 2, 35: 4, 38: 2, 33: 4, 14: 24, 17: 2, 22: 2}
Did not match all atoms present	298-93-1	CC1=C(SC(=N1)[N+]2=NC(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]	{1: 2, 35: 3, 33: 2, 41: 1, 14: 10, 18: 1}
Did not match all atoms present	298-96-4	C1=CC=C(C=C1)C2=NN([N+](=N2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{17: 1, 35: 2, 14: 15, 33: 2}
Did not match all atoms present	2980-33-8	C1=C(C(=O)NC=C1[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 25: 1, 38: 2, 14: 2}
Did not match all atoms present	2980-59-8	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Fe+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	2980-64-5	CC1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].[NH4+]	{1: 1, 38: 2, 14: 2}
Did not match all atoms present	29800-89-3	COC(=O)CC1=CC=NC=C1	{1: 1, 2: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	29809-14-1	C1CCC2=C(C1)C=CC=C2[N+](=O)[O-]	{11: 4, 38: 1, 14: 3}
Did not match all atoms present	29813-38-5	CCCCCCCCC(=O)[O-].CCCCCCCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 14}
Did not match all atoms present	29814-17-3	C1CC2=C(C1)N=C3N=CNN3C2=O	{32: 1, 33: 1, 35: 2, 11: 3, 14: 1, 25: 1}
Did not match all atoms present	29816-55-5	CC1=CC=C(C=C1)/C=C(\C)/[N+](=O)[O-]	{1: 2, 38: 1, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	29817-09-2	C=C1CC1C2=CC=CC=C2	{11: 1, 12: 1, 5: 1, 14: 5, 15: 1}
Did not match all atoms present	29826-51-5	CC(C)CCCCCC(=O)[O-].CC(C)CCCCCC(=O)[O-].[Mn+2]	{24: 2, 1: 4, 2: 10, 3: 2}
Did not match all atoms present	2984-64-7	CCOP(=S)(CC)SC1=CC=C(C=C1)Cl	{1: 2, 2: 2, 40: 1, 14: 4, 17: 1, 22: 1}
Did not match all atoms present	29841-69-8	C1=CC=C(C=C1)[C@@H]([C@H](C2=CC=CC=C2)N)N	{3: 2, 30: 2, 14: 10}
Did not match all atoms present	29842-22-6	C1=CC=C(C=C1)CC(C(=O)O)OC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]	{2: 1, 3: 1, 38: 1, 6: 2, 14: 9, 27: 1, 28: 1}
Did not match all atoms present	2985-59-3	CCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 1, 2: 11, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	29857-13-4	CC(C)CCCCCCCOC(=O)CC(C(=O)OCCCCCCCC(C)C)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 15, 3: 3, 28: 2, 29: 3}
Did not match all atoms present	29858-07-9	CCOCC.[Mg+2].[Br-].[Br-]	{1: 2, 2: 2, 18: 2, 22: 1}
Did not match all atoms present	2986-17-6	CC(C)NC(=S)NC(C)C	{31: 2, 1: 4, 3: 2, 7: 1}
Did not match all atoms present	29864-31-1	COC1=CC=CC(=C1)C2=C(N=C(N2)C3=CC=CC=C3Cl)C4=CC(=CC=C4)OC	{32: 1, 1: 2, 35: 1, 14: 12, 17: 1, 22: 2}
Did not match all atoms present	29865-90-5	COC1=CC(=CC(=C1OC)O)C=O	{1: 2, 22: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	29868-97-1	CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4.Cl.Cl	{32: 1, 1: 1, 2: 1, 35: 1, 33: 3, 11: 4, 14: 7, 17: 2, 24: 1, 25: 1}
Did not match all atoms present	2987-53-3	CSC1=CC=CC=C1N	{40: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	2987-66-8	CNC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=CC=C3)NC	{1: 2, 31: 2, 14: 6, 25: 2}
Did not match all atoms present	2987-77-1	CC[Si](CC)(CC)C1=CC=CC=C1	{1: 3, 2: 3, 14: 5}
Did not match all atoms present	29870-99-3	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Sr+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	29871-59-8	CN(C)P1(=NP(=NP(=N1)(N(C)C)F)(N(C)C)F)F	{16: 3, 1: 6, 35: 3, 33: 3}
Did not match all atoms present	29871-62-3	N1=P(N=P(N=P1(F)Cl)(F)Cl)(F)F	{16: 4, 17: 2, 35: 3}
Did not match all atoms present	29871-63-4	N1=PN=P(N=P1(F)Br)(F)Br.FF	{16: 4, 18: 2, 35: 3}
Did not match all atoms present	29872-00-2	[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Sb+5]	{}
Did not match all atoms present	29874-00-8	[CH2-]C1=CC=CC=C1Cl.[Mg+2].[Cl-]	{17: 2, 5: 1, 14: 4}
Did not match all atoms present	29874-05-3	CC1=CC(=C(S1)C)S	{1: 2, 41: 1, 14: 1, 39: 1}
Did not match all atoms present	29875-05-6	CC1=CC=CC=C1[CH2-].[Mg+2].[Cl-]	{1: 1, 5: 1, 14: 4, 17: 1}
Did not match all atoms present	29876-14-0	C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C3=CN=CC=C3	{32: 1, 2: 2, 35: 1, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	29877-90-5	B(F)(SC)SC	{16: 1, 1: 2, 40: 2}
Did not match all atoms present	29877-93-8	B(OCCC)(OCCC)Cl	{1: 2, 2: 4, 22: 2, 17: 1}
Did not match all atoms present	29877-96-1	B(OC)(OC)Br	{1: 2, 18: 1, 22: 2}
Did not match all atoms present	29877-98-3	B(SC)(SC)Br	{40: 2, 1: 2, 18: 1}
Did not match all atoms present	29877-99-4	B(OC)(Br)Br	{1: 1, 18: 2, 22: 1}
Did not match all atoms present	29878-00-0	B(OC)(I)I	{1: 1, 19: 2, 22: 1}
Did not match all atoms present	29878-02-2	B(OC)(OC)I	{1: 2, 19: 1, 22: 2}
Did not match all atoms present	29878-05-5	B(SC)(Cl)Cl	{40: 1, 1: 1, 17: 2}
Did not match all atoms present	29878-91-9	C1=CC2=C(C(=C1)C3=CC=CC4=C3C(=CC=C4)C(=O)O)C(=CC=C2)C(=O)O	{27: 2, 14: 12}
Did not match all atoms present	29881-14-9	C1C(C1C2=CC=CC=C2)C3=CC=CC=C3	{11: 1, 12: 2, 14: 10}
Did not match all atoms present	29883-15-6	C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)O)O)O	{2: 2, 3: 1, 37: 1, 12: 10, 14: 5, 20: 7, 22: 2, 23: 2}
Did not match all atoms present	29885-95-8	C[NH2+]C1=CC=CC=C1.C(=O)(C(F)(F)F)[O-]	{16: 3, 1: 1, 4: 1, 14: 5, 24: 1}
Did not match all atoms present	29886-96-2	CC(C)C1=CC=C(C=C1)CC(C)C(OC)OC	{1: 5, 2: 1, 3: 3, 22: 2, 14: 4}
Did not match all atoms present	29890-05-9	[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[PH+](CC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[W]	{2: 2, 29: 4, 14: 20}
Did not match all atoms present	29897-82-3	C1CCN(C1)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 4, 14: 5}
Did not match all atoms present	29898-32-6	C1=CC(=C(C=C1Cl)Cl)I	{17: 2, 19: 1, 14: 3}
Did not match all atoms present	299-11-6	C[N+]1=C2C=CC=CC2=NC3=CC=CC=C31.COS(=O)(=O)[O-]	{1: 2, 35: 1, 33: 1, 14: 8, 22: 1, 29: 3}
Did not match all atoms present	299-20-7	C[C@@H]1[C@@H](C(=O)N[C@@H](C(=O)N2C[C@@H](C[C@@H]2C(=O)N(CC(=O)N(C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C3=CC=CC=C3)C)C)[C@@H](C)C(C)C)C)C)O)CC(C)C)NC(=O)C4=C(C=CC=N4)O	{32: 2, 1: 10, 2: 1, 3: 3, 33: 4, 11: 3, 12: 8, 14: 8, 35: 1, 20: 1, 21: 1, 24: 1, 25: 6, 28: 1, 31: 1}
Did not match all atoms present	299-26-3	CC(CC1=CNC2=CC=CC=C21)N	{32: 1, 1: 1, 2: 1, 3: 1, 14: 5, 30: 1}
Did not match all atoms present	299-27-4	C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.[K+]	{24: 1, 2: 1, 3: 4, 20: 5}
Did not match all atoms present	299-28-5	C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.[Ca+2]	{24: 2, 2: 2, 3: 8, 20: 10}
Did not match all atoms present	299-42-3	C[C@@H]([C@@H](C1=CC=CC=C1)O)NC	{1: 2, 3: 2, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	299-45-6	CCOP(=S)(OCC)OC1=CC2C(C=C1)C(=CC(=O)O2)C	{1: 3, 2: 2, 12: 2, 14: 4, 15: 2, 22: 3, 28: 1}
Did not match all atoms present	299-61-6	CCN(CC)CC(C)C(C)OC(=O)C1=CC=C(C=C1)OCC(C)C	{1: 6, 2: 4, 3: 3, 33: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	299-84-3	COP(=S)(OC)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 22: 3, 14: 2, 17: 3}
Did not match all atoms present	299-85-4	CC(C)NP(=S)(OC)OC1=C(C=C(C=C1)Cl)Cl	{1: 3, 3: 1, 14: 3, 17: 2, 22: 2, 31: 1}
Did not match all atoms present	299-86-5	CC(C)(C)C1=CC(=C(C=C1)OP(=O)(NC)OC)Cl	{1: 5, 4: 1, 14: 3, 17: 1, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	299-95-6	CC(C)NCC(C1=CC(=C(C=C1)O)O)O.CC(C)NCC(C1=CC(=C(C=C1)O)O)O.OS(=O)(=O)O	{1: 4, 2: 2, 3: 4, 14: 6, 20: 4, 21: 4, 29: 2, 31: 2}
Did not match all atoms present	2990-17-2	C1=CC(=CC=C1C(C2=CC=C(C=C2)Br)C(Cl)(Cl)Cl)Br	{17: 3, 18: 2, 3: 1, 4: 1, 14: 8}
Did not match all atoms present	29903-04-6	C1=CC=C2C(=C1)C=CC=C2C(=O)OOC(=O)C3=CC=CC4=CC=CC=C43	{28: 2, 14: 14}
Did not match all atoms present	29908-03-0	C[S+](CC[C@@H](C(=O)[O-])N)C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)O	{1: 1, 2: 3, 3: 1, 33: 1, 12: 4, 14: 2, 35: 3, 20: 2, 23: 1, 24: 1, 30: 2}
Did not match all atoms present	29909-46-4	C1CO[Si]2(OCCN1CCO2)CCCS	{33: 1, 2: 3, 11: 6, 39: 1, 23: 3}
Did not match all atoms present	2991-28-8	C1=CC(=C(C=C1F)C(=O)O)F	{16: 2, 27: 1, 14: 3}
Did not match all atoms present	2991-52-8	CCN(CC(=O)[O-])S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[NH4+]	{1: 1, 2: 2, 4: 8, 33: 1, 16: 17, 24: 1, 29: 2}
Did not match all atoms present	29911-73-7	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Gd+3]	{24: 3, 1: 3, 2: 18}
Did not match all atoms present	29915-38-6	C(CNC(CO)(CO)CO)CS(=O)(=O)O	{20: 4, 2: 6, 4: 1, 29: 2, 31: 1}
Did not match all atoms present	2992-95-2	CCCOP(=O)(CC)F	{16: 1, 1: 2, 2: 3, 29: 1, 22: 1}
Did not match all atoms present	29921-41-3	C1=CC=C(C=C1)CC2=CC=CC=C2Cl	{17: 1, 2: 1, 14: 9}
Did not match all atoms present	29921-50-4	C1=CC2=C(C=C(C=C2)O)C(=C1)Cl	{17: 1, 21: 1, 14: 6}
Did not match all atoms present	29923-31-7	CCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)[O-].[Na+]	{1: 1, 2: 12, 3: 1, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	29927-08-0	CC1=CC2=C(C=C1C)SC(=N2)N	{1: 2, 35: 1, 30: 1, 14: 2, 41: 1}
Did not match all atoms present	2993-22-8	C1=CC(=CC(=C1)S(F)(F)(F)(F)F)N	{16: 5, 30: 1, 14: 4}
Did not match all atoms present	29934-17-6	C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.Cl[Pd]Cl	{17: 2, 11: 30, 12: 6}
Did not match all atoms present	29939-31-9	CC(C)(C)C1=CC(=NC=C1)C(C)(C)C	{1: 6, 35: 1, 4: 2, 14: 3}
Did not match all atoms present	29939-34-2	CC1=NC(=C(C(=N1)OC)[N+](=O)[O-])OC	{1: 3, 35: 2, 38: 1, 22: 2}
Did not match all atoms present	29939-35-3	COC1=C(C(=NC(=N1)C2=CC=CC=C2)OC)[N+](=O)[O-]	{38: 1, 1: 2, 35: 2, 22: 2, 14: 5}
Did not match all atoms present	29947-67-9	C[Si](C)(C)[Si](C)(C)C=P(C)(C)C	{1: 8, 6: 1}
Did not match all atoms present	29949-19-7	CC(=O)OC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C	{1: 2, 3: 1, 28: 2, 38: 1, 14: 4}
Did not match all atoms present	29949-75-5	C=CCP(CC=C)C1=CC=CC=C1	{2: 2, 14: 5, 5: 2, 6: 2}
Did not match all atoms present	29949-82-4	CC(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)C(C)C)C3=CC=C(C=C3)C(C)C	{1: 6, 3: 3, 14: 12}
Did not match all atoms present	29949-84-6	COC1=CC(=CC=C1)P(C2=CC=CC(=C2)OC)C3=CC=CC(=C3)OC	{1: 3, 22: 3, 14: 12}
Did not match all atoms present	29949-85-7	C1=CC(=CC(=C1)Cl)P(C2=CC(=CC=C2)Cl)C3=CC(=CC=C3)Cl	{17: 3, 14: 12}
Did not match all atoms present	29949-96-0	CP(=C)(C)C1=CC=CC=C1	{1: 2, 5: 1, 14: 5}
Did not match all atoms present	29952-68-9	CP(SC)SC	{40: 2, 1: 3}
Did not match all atoms present	29953-71-7	C1=CC=C2C(=C1)C(=CN2)/C=C/C(=O)O	{32: 1, 27: 1, 14: 5, 6: 2}
Did not match all atoms present	29957-59-3	[B-]([S+](C)C)(Br)(Br)Br	{1: 2, 18: 3}
Did not match all atoms present	2996-92-1	CO[Si](C1=CC=CC=C1)(OC)OC	{1: 3, 22: 3, 14: 5}
Did not match all atoms present	29968-64-7	C1C2=CC=CC=C2C3=C1C(=CC=C3)N(C(=O)C4=CC=CC=C4)O	{24: 1, 33: 1, 11: 1, 20: 1, 14: 12}
Did not match all atoms present	29968-68-1	C1=CC=C(C=C1)C2=CC=C(C=C2)N(O)S(=O)(=O)C3=CC=CC=C3	{33: 1, 20: 1, 29: 2, 14: 14}
Did not match all atoms present	29968-75-0	CC(=O)[O-].C1C2=CC=CC=C2C3=C1C=C(C=C3)N(C(=O)C4=CC=CC=C4)O	{1: 1, 33: 1, 11: 1, 14: 12, 20: 1, 24: 2}
Did not match all atoms present	29969-49-1	CC1=CC2=C(C=C1)N(C(=O)C=C2)C	{1: 2, 33: 1, 14: 5, 25: 1}
Did not match all atoms present	29972-02-9	C1=CC=C2C=CC=CC2=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 21: 1, 14: 10}
Did not match all atoms present	29973-13-5	CCSCC1=CC=CC=C1OC(=O)NC	{1: 2, 2: 2, 40: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	29975-16-4	C1C2=NN=CN2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4	{33: 1, 35: 3, 11: 1, 14: 9, 15: 1, 17: 1}
Did not match all atoms present	29977-00-2	CC1=CSS2=C1C(=CS2)C	{1: 2, 41: 2, 14: 2, 15: 3}
Did not match all atoms present	29977-41-1	[Al]I	{19: 1}
Did not match all atoms present	2998-57-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)OC(=O)N(CCCl)CCCl	{1: 1, 2: 4, 33: 1, 11: 6, 12: 4, 13: 1, 14: 3, 17: 2, 20: 1, 28: 1}
Did not match all atoms present	29984-33-6	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 4, 22: 1, 23: 1, 29: 1, 30: 1}
Did not match all atoms present	29988-16-7	CCCCCCCCC1=C(C(=CC=C1)O)CCCCCCCC	{1: 2, 2: 14, 21: 1, 14: 3}
Did not match all atoms present	2999-46-4	CCOC(=O)C[N+]#[C-]	{1: 1, 2: 2, 28: 1, 34: 1}
Did not match all atoms present	2999-74-8	[CH3-].[CH3-].[Mg+2]	{}
Did not match all atoms present	29994-44-3	CCCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOCCOCCOP(=O)(O)O	{1: 1, 2: 20, 14: 4, 20: 2, 22: 7, 29: 1}
Did not match all atoms present	299953-00-7	C1=CC(=CC=C1C=C2C(=O)N=C(S2)N)O	{35: 1, 6: 1, 41: 1, 14: 4, 15: 2, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	300-01-6	C(C(=O)C(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 3, 2: 1}
Did not match all atoms present	300-30-1	C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)CC(C(=O)O)N	{2: 1, 3: 1, 14: 4, 19: 4, 21: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	300-39-0	C1=C(C=C(C(=C1I)O)I)C[C@@H](C(=O)O)N	{2: 1, 3: 1, 14: 2, 19: 2, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	300-42-5	CC(CC1=CC=CC=C1)NC.Cl	{1: 2, 2: 1, 3: 1, 14: 5, 17: 1, 31: 1}
Did not match all atoms present	300-54-9	C[C@H]1[C@@H](C[C@H](O1)C[N+](C)(C)C)O	{1: 4, 2: 1, 11: 1, 12: 3, 20: 1, 23: 1}
Did not match all atoms present	300-57-2	C=CCC1=CC=CC=C1	{2: 1, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	300-62-9	CC(CC1=CC=CC=C1)N	{1: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	300-76-5	COP(=O)(OC)OC(C(Cl)(Cl)Br)Br	{1: 2, 3: 1, 4: 1, 17: 2, 18: 2, 22: 3, 29: 1}
Did not match all atoms present	300-87-8	CC1=CC(=NO1)C	{1: 2, 35: 1, 14: 1, 23: 1}
Did not match all atoms present	300-88-9	CCCCCC(=C[As](=O)(O)[O-])Cl.[NH4+]	{1: 1, 2: 4, 6: 1, 7: 1, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	300-92-5	CCCCCCCCCCCCCCCCCC(=O)O[Al]OC(=O)CCCCCCCCCCCCCCCCC.O	{1: 2, 2: 32, 28: 2}
Did not match all atoms present	30001-51-5	B(OC)(OC)Cl	{1: 2, 22: 2, 17: 1}
Did not match all atoms present	30004-14-9	CN(C)P1(=NP(=NP(=N1)(F)F)(N(C)C)F)F	{16: 4, 1: 4, 35: 3, 33: 2}
Did not match all atoms present	30007-39-7	C1CC2=CC=CC=C2C(=O)C1C[NH2+]CCC3=CC=C(C=C3)O.[Cl-]	{2: 3, 11: 2, 12: 1, 14: 8, 17: 1, 21: 1, 25: 1}
Did not match all atoms present	30009-65-5	B(SC)(Br)Br	{40: 1, 1: 1, 18: 2}
Did not match all atoms present	3001-15-8	C1=CC(=CC=C1C2=CC=C(C=C2)I)I	{19: 2, 14: 8}
Did not match all atoms present	3001-57-8	C1C(C(CS1(=O)=O)Cl)Cl	{17: 2, 11: 2, 12: 2, 29: 2}
Did not match all atoms present	3001-98-7	CP1(=O)OCC2(CO1)COP(=O)(OC2)C	{1: 2, 11: 4, 29: 2, 13: 1, 23: 4}
Did not match all atoms present	3002-63-9	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Al+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	3002-78-6	CC1=C2C=CC=NC2=C3C(=C1)C=CC=N3	{1: 1, 35: 2, 14: 7}
Did not match all atoms present	3002-81-1	CC1=C2C=CC=NC2=C3C(=C1C)C=CC=N3	{1: 2, 35: 2, 14: 6}
Did not match all atoms present	30026-92-7	CC(C)(C)OOC(C)(C)C1=CC=CC=C1	{1: 5, 4: 2, 22: 2, 14: 5}
Did not match all atoms present	3003-15-4	C[Tl](C)C	{1: 3}
Did not match all atoms present	3004-42-0	C1=CC=C(C=C1)C2=NNC(=S)O2	{32: 1, 35: 1, 14: 5, 23: 1}
Did not match all atoms present	3004-51-1	C[N+](C)(C)CC=C.[Br-]	{1: 3, 2: 1, 18: 1, 5: 1, 6: 1}
Did not match all atoms present	3004-71-5	CC(C)NC1=NC(=NC(=N1)NC)Cl	{31: 2, 1: 3, 3: 1, 35: 3, 17: 1}
Did not match all atoms present	3004-73-7	C1=CC(=CC(=C1)Cl)NC(=O)C(Cl)(Cl)Cl	{24: 1, 17: 4, 4: 1, 14: 4, 31: 1}
Did not match all atoms present	30041-69-1	CN(C)C1=CC=C(C=C1)N=NC2=CC3=C(C=C2)N=CC=C3	{1: 2, 34: 2, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	3005-32-1	C1=CC=C(C=C1)[Ge](C2=CC=CC=C2)(C3=CC=CC=C3)Br	{18: 1, 14: 15}
Did not match all atoms present	3005-68-3	C1CNC(C1C2=CC=CC=C2)C(=O)O	{27: 1, 32: 1, 11: 2, 12: 2, 14: 5}
Did not match all atoms present	3006-10-8	CCCCCCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 17, 29: 3, 22: 1}
Did not match all atoms present	3006-13-1	CCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 13, 29: 3, 22: 1}
Did not match all atoms present	3006-15-3	CCCCCCOC(=O)CC(C(=O)OCCCCCC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 11, 3: 1, 28: 2, 29: 3}
Did not match all atoms present	3006-93-7	C1=CC(=CC(=C1)N2C(=O)C=CC2=O)N3C(=O)C=CC3=O	{25: 4, 14: 8, 33: 2}
Did not match all atoms present	3006-96-0	C1=CC(=CC=C1CO)C(=O)O	{2: 1, 27: 1, 20: 1, 14: 4}
Did not match all atoms present	3007-43-0	CC1=CC=[NH+]C2=CC=CC=C12.[Cl-]	{32: 1, 1: 1, 14: 6, 17: 1}
Did not match all atoms present	3007-70-3	CCCCCCCNC1=CC=CC=C1	{1: 1, 2: 6, 14: 5, 31: 1}
Did not match all atoms present	3007-71-4	CCCCCCCCNC1=CC=CC=C1	{1: 1, 2: 7, 14: 5, 31: 1}
Did not match all atoms present	3007-72-5	CCCCCCCCCNC1=CC=CC=C1	{1: 1, 2: 8, 14: 5, 31: 1}
Did not match all atoms present	3007-73-6	CCCCCCCCCCNC1=CC=CC=C1	{1: 1, 2: 9, 14: 5, 31: 1}
Did not match all atoms present	3007-74-7	CCCCCCCCCCCCNC1=CC=CC=C1	{1: 1, 2: 11, 14: 5, 31: 1}
Did not match all atoms present	3007-75-8	CCCCCCCCN(CCCCCCCC)C1=CC=CC=C1	{1: 2, 2: 14, 14: 5, 33: 1}
Did not match all atoms present	3007-91-8	CCOC(=O)C1=CC2=CC=CC=C2C=C1	{1: 1, 2: 1, 28: 1, 14: 7}
Did not match all atoms present	3007-97-4	CCOC(=O)C1=CC=CC2=CC=CC=C21	{1: 1, 2: 1, 28: 1, 14: 7}
Did not match all atoms present	30071-93-3	CC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{16: 6, 1: 1, 4: 2, 14: 3, 24: 1}
Did not match all atoms present	30074-79-4	CC(=O)OC1=NC2=CC=CC=C2C=C1	{1: 1, 35: 1, 28: 1, 14: 6}
Did not match all atoms present	30077-45-3	C(C[As](Cl)Cl)Cl	{17: 3, 2: 2}
Did not match all atoms present	30078-65-0	C1=COC=C1C#N	{37: 1, 14: 3, 23: 1}
Did not match all atoms present	30078-89-8	C1=CC=C(C=C1)CCCC(C2=CC=CC=C2)O	{2: 3, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	3008-31-9	C1(=C(C(=C(C(=C1F)F)C2=C(C(=C(C(=C2F)F)F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F	{16: 14}
Did not match all atoms present	3008-32-0	C1(=C(C(=C(C(=C1F)F)C2=C(C(=C(C(=C2F)F)F)F)F)F)F)C3=C(C(=C(C(=C3F)F)C4=C(C(=C(C(=C4F)F)F)F)F)F)F	{16: 18}
Did not match all atoms present	3008-76-2	CN(C)C1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)N(C)C	{1: 4, 31: 2, 33: 2, 14: 14, 25: 2}
Did not match all atoms present	3008-87-5	CC1=NC2=C(C=CC3=C2C(=C1)C4=CC=CC=C4C3=O)NC5CCCCC5	{1: 1, 35: 1, 11: 5, 12: 1, 14: 7, 25: 1, 31: 1}
Did not match all atoms present	30084-90-3	C1C2=CC=CC=C2C3=C1C=C(C=C3)C=O	{26: 1, 11: 1, 14: 7}
Did not match all atoms present	30084-91-4	C1CC2=C(C1)C=C(C=C2)C=O	{26: 1, 11: 3, 14: 3}
Did not match all atoms present	30085-34-8	C1=CC(=CC=C1NC(=O)NO)Cl	{24: 1, 17: 1, 20: 1, 14: 4, 31: 2}
Did not match all atoms present	3009-13-0	C1=CC=[N+](C=C1)COCC2=CC(=CC=C2)[N+](=O)[O-].[Cl-]	{33: 1, 2: 2, 38: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	3009-50-5	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC	{1: 3, 34: 2, 22: 1, 14: 8, 33: 1}
Did not match all atoms present	3009-55-0	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2OC	{1: 3, 34: 2, 22: 1, 14: 8, 33: 1}
Did not match all atoms present	3009-97-0	C1=CC=C(C=C1)NCC#N	{2: 1, 37: 1, 14: 5, 31: 1}
Did not match all atoms present	30090-17-6	CC(C)CC1=CC=C(C=C1)N	{1: 2, 2: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	30095-98-8	COC(=O)CC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	30096-82-3	CCN(CC)CC1=CSC(=N1)C2=CC=C(S2)[N+](=O)[O-].Cl	{1: 2, 2: 3, 35: 1, 38: 1, 33: 1, 41: 2, 14: 3, 17: 1}
Did not match all atoms present	30099-72-0	CCCC[Sn](CCCC)(CCCC)OC(=O)CCCCCCCCC(=O)O[Sn](CCCC)(CCCC)CCCC	{1: 6, 2: 26, 28: 2}
Did not match all atoms present	301-04-2	CC(=O)[O-].CC(=O)[O-].[Pb+2]	{24: 2, 1: 2}
Did not match all atoms present	301-08-6	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Pb+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	301-10-0	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Sn+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	301-12-2	CCS(=O)CCSP(=O)(OC)OC	{40: 1, 1: 3, 2: 3, 29: 2, 22: 2}
Did not match all atoms present	301-13-3	CCCCC(CC)COP(OCC(CC)CCCC)OCC(CC)CCCC	{1: 6, 2: 15, 3: 3, 22: 3}
Did not match all atoms present	301-21-3	CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC(=C(C=C3)OC)O)OC)OC	{1: 4, 2: 1, 33: 1, 11: 2, 12: 1, 14: 5, 21: 1, 22: 3}
Did not match all atoms present	3010-38-6	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2[N+](=O)[O-]	{1: 2, 34: 2, 38: 1, 14: 8, 33: 1}
Did not match all atoms present	3010-45-5	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC(=CC=C3)Cl	{34: 1, 14: 10, 15: 1, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	3010-47-7	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2Cl	{1: 2, 34: 2, 33: 1, 14: 8, 17: 1}
Did not match all atoms present	3010-57-9	CC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	3010-63-7	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCC	{1: 3, 2: 3, 33: 1, 34: 2, 14: 8, 22: 1}
Did not match all atoms present	3010-80-8	C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Cl)O)Cl	{17: 3, 4: 1, 14: 12, 20: 1}
Did not match all atoms present	3010-81-9	COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)(C3=CC=C(C=C3)OC)O	{1: 3, 4: 1, 22: 3, 14: 12, 20: 1}
Did not match all atoms present	3010-82-0	C1=CC(=CC=C1C(=O)N)C(=O)N	{24: 2, 30: 2, 14: 4}
Did not match all atoms present	30100-15-3	CCCCCOC(=O)C1=CC=CC=C1N	{1: 1, 2: 4, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	3011-34-5	C1=CC(=C(C=C1C=O)[N+](=O)[O-])O	{26: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	3011-89-0	C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)N	{24: 1, 17: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	3012-37-1	C1=CC=C(C=C1)CSC#N	{40: 1, 2: 1, 37: 1, 14: 5}
Did not match all atoms present	3012-50-8	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=NC4=CC=CC=C4S3	{34: 1, 35: 1, 41: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	3012-65-5	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)O)O.[NH4+].[NH4+]	{24: 2, 20: 1, 2: 2, 27: 1, 4: 1}
Did not match all atoms present	3012-80-4	CN1C2=CC=CC=C2N=C1C=O	{1: 1, 26: 1, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	30129-29-4	CCCC(CCC)C(=O)OC1=C(C=CC(=C1)C)C(C)C	{1: 5, 2: 4, 3: 2, 28: 1, 14: 3}
Did not match all atoms present	30129-30-7	CCCC(CCC)C(=O)OC1=C(C=CC(=C1)C(C)C)C	{1: 5, 2: 4, 3: 2, 28: 1, 14: 3}
Did not match all atoms present	30134-12-4	C1=CC=C(C=C1)CCCSC2=CC=CC=C2	{40: 1, 2: 3, 14: 10}
Did not match all atoms present	30144-12-8	CC1=CN(C=C1C)C	{1: 3, 14: 2, 33: 1}
Did not match all atoms present	3015-74-5	CCCCP(=O)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 14: 4, 22: 2, 29: 1}
Did not match all atoms present	3015-75-6	CCCCCP(=O)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 5, 38: 1, 14: 4, 22: 2, 29: 1}
Did not match all atoms present	3015-98-3	CCC[In](CCC)CCC	{1: 3, 2: 6}
Did not match all atoms present	3016-76-0	C1=CC(=C(C=C1C(C2=CC(=C(C=C2)C(=O)O)C(=O)O)(C(F)(F)F)C(F)(F)F)C(=O)O)C(=O)O	{16: 6, 27: 4, 4: 3, 14: 6}
Did not match all atoms present	3016-97-5	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3	{24: 2, 14: 14}
Did not match all atoms present	30165-79-8	CC1=C(C=CC(=C1)N(CCC2=CC=CC=C2)C(C)C(=O)OC)C=C(C#N)C#N	{1: 3, 2: 2, 3: 1, 33: 1, 6: 1, 7: 1, 14: 8, 28: 1, 37: 2}
Did not match all atoms present	3017-23-0	[2H]C#N	{37: 1}
Did not match all atoms present	3017-60-5	C(#N)[S-].C(#N)[S-].[Co+2]	{37: 2}
Did not match all atoms present	3017-75-2	C[Al](Br)Br	{1: 1, 18: 2}
Did not match all atoms present	3017-85-4	C[Al](C)Br	{1: 2, 18: 1}
Did not match all atoms present	3018-20-0	C1CC(C2=CC=CC=C2C1)C3=CC=CC=C3	{11: 3, 12: 1, 14: 9}
Did not match all atoms present	30184-88-4	CC1C(OC(N1)(C(F)(F)F)C(F)(F)F)C2=CC=CC=C2	{32: 1, 1: 1, 4: 2, 12: 2, 13: 1, 14: 5, 16: 6, 23: 1}
Did not match all atoms present	30185-90-1	CCN(CC)CC1CN(C(=O)O1)/N=C/C2=NC=C(N2C)[N+](=O)[O-].Cl	{1: 3, 2: 3, 35: 1, 38: 1, 6: 1, 33: 3, 11: 1, 12: 1, 34: 1, 14: 1, 17: 1, 28: 1}
Did not match all atoms present	3019-19-0	CC(C)(C)SC1=CC=CC=C1	{40: 1, 1: 3, 4: 1, 14: 5}
Did not match all atoms present	3019-20-3	CC(C)SC1=CC=CC=C1	{40: 1, 1: 2, 3: 1, 14: 5}
Did not match all atoms present	3019-36-1	C(=NP(=O)(O)O)(N)N	{34: 1, 20: 2, 29: 1, 30: 2, 7: 1}
Did not match all atoms present	30192-67-7	C1CCN(CC1)C(C(F)(F)F)(C(F)(F)F)O.O	{16: 6, 20: 1, 11: 5, 4: 3, 33: 1}
Did not match all atoms present	30194-63-9	C1CN(CCN1CCNC(=O)C2=CC=C(C=C2)N)C3=CC=CC=N3	{33: 2, 2: 2, 35: 1, 11: 4, 14: 8, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	30199-26-9	CC1=C(C=C(C=C1)[C@H](C)CCC=C(C)C)O	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 14: 3, 21: 1}
Did not match all atoms present	302-04-5	N#C[S-]	{37: 1}
Did not match all atoms present	302-15-8	CNN.OS(=O)(=O)O	{1: 1, 20: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	302-27-2	CCN1CC2(C(CC(C34C2C(C(C31)C5(C6C4CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)OC(=O)C)OC)OC)O)COC	{1: 6, 2: 2, 33: 1, 11: 3, 12: 11, 13: 4, 14: 5, 20: 3, 22: 4, 28: 2}
Did not match all atoms present	302-33-0	CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN(CC)CC	{1: 3, 2: 6, 4: 1, 33: 1, 14: 10, 28: 1}
Did not match all atoms present	302-40-9	CCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O	{1: 2, 2: 4, 4: 1, 33: 1, 14: 10, 20: 1, 28: 1}
Did not match all atoms present	302-41-0	C1CCN(CC1)C2(CCN(CC2)CCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N	{33: 2, 2: 2, 4: 1, 37: 1, 11: 9, 13: 1, 14: 10, 24: 1, 30: 1}
Did not match all atoms present	302-48-7	CCNP(=O)(N1CC1)N2CC2	{33: 2, 2: 1, 1: 1, 11: 4, 29: 1, 31: 1}
Did not match all atoms present	302-49-8	CCOC(=O)NP(=O)(N1CC1)N2CC2	{1: 1, 2: 1, 33: 2, 11: 4, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	302-70-5	C[N+](CCCl)(CCCl)[O-].Cl	{1: 1, 2: 4, 29: 1, 17: 3}
Did not match all atoms present	302-76-1	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CCC4=C3C=CC(=C4)O	{1: 2, 11: 6, 12: 3, 13: 2, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	302-83-0	CC[N+](C)(C)C1=CC(=CC=C1)O.[Br-]	{1: 3, 2: 1, 18: 1, 14: 4, 21: 1}
Did not match all atoms present	302-95-4	CC(CCC(=O)[O-])C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C.[Na+]	{1: 3, 2: 2, 3: 1, 11: 8, 12: 7, 13: 2, 20: 2, 24: 1}
Did not match all atoms present	30203-11-3	C1=CC(=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC(=C4)N)N	{30: 2, 22: 2, 14: 16, 29: 2}
Did not match all atoms present	3021-31-6	CC(C)(C)C1=CC=C(C=C1)OC2CCCCC2OS(=O)Cl	{1: 3, 4: 1, 11: 4, 12: 2, 14: 4, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	3021-41-8	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)OS(=O)(=O)O[Sn](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{22: 2, 14: 30, 29: 2}
Did not match all atoms present	30211-77-9	C1=CC(=C(C=C1SC#N)C(=O)O)[N+](=O)[O-]	{38: 1, 40: 1, 27: 1, 37: 1, 14: 3}
Did not match all atoms present	30216-44-5	C1=CC=C(C(=C1)C(=S)N)Br	{18: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	3022-16-0	CC1=C(C(=C(C(=C1CCl)C)C)CCl)C	{1: 4, 2: 2, 17: 2}
Did not match all atoms present	30223-48-4	CCN(CC)CCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F	{1: 2, 2: 4, 4: 1, 33: 2, 41: 1, 14: 7, 16: 3, 24: 1}
Did not match all atoms present	30233-80-8	CCCCC1=C(C(=C(C=C1)C2=CC=CC=C2)S(=O)(=O)[O-])O.[Na+]	{1: 1, 2: 3, 21: 1, 14: 7, 29: 3}
Did not match all atoms present	30233-81-9	CCCCC1=CC=CC(=C1S(=O)(=O)[O-])C2=CC=CC=C2.[Na+]	{1: 1, 2: 3, 29: 3, 14: 8}
Did not match all atoms present	30236-29-4	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{2: 3, 12: 8, 13: 1, 22: 9, 23: 2}
Did not match all atoms present	3024-56-4	CCN1C2=CC=CC=C2SC1=CC(=C3C(=O)N(C(=S)O3)CC)C	{1: 3, 2: 2, 33: 2, 6: 1, 7: 1, 41: 1, 14: 4, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	3024-72-4	C1=CC(=C(C=C1C(=O)Cl)Cl)Cl	{24: 1, 17: 3, 14: 3}
Did not match all atoms present	3025-52-3	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 33: 1, 34: 2, 14: 8}
Did not match all atoms present	3025-73-8	CC1=C(C=C(C=C1)N=NC2=CC=C(C=C2)N(C)C)C	{1: 4, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	30251-10-6	CCCCCCCCCCCCCCC(C)[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 4, 2: 14, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	30256-73-6	C1CCN(CC1)CC(=O)C2=CNC3=CC=CC=C32	{32: 1, 33: 1, 2: 1, 11: 5, 14: 5, 24: 1}
Did not match all atoms present	30256-74-7	C1COCCN1CC(=O)C2=CNC3=CC=CC=C32	{32: 1, 33: 1, 2: 1, 11: 4, 14: 5, 23: 1, 24: 1}
Did not match all atoms present	3026-63-9	CCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 12, 29: 3, 22: 1}
Did not match all atoms present	3026-81-1	CCCC[Sn](CCCC)(SCCO)SCCO	{40: 2, 1: 2, 2: 10, 20: 2}
Did not match all atoms present	3027-13-2	CC(=O)CC1=CC(=CC=C1)OC	{24: 1, 1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	3027-21-2	CO[Si](C)(C1=CC=CC=C1)OC	{1: 3, 22: 2, 14: 5}
Did not match all atoms present	3027-36-9	C1=CC(=CC(=C1)C(=O)N=[N+]=[N-])C(=O)N=[N+]=[N-]	{24: 2, 34: 4, 14: 4}
Did not match all atoms present	3027-38-1	C1=CC2=CC(=CC3=C2C(=C1)C(=O)OC3=O)[N+](=O)[O-]	{28: 2, 38: 1, 14: 5}
Did not match all atoms present	30273-11-1	CCC(C)C1=CC=C(C=C1)N	{1: 2, 2: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	30273-14-4	CCCC(C)C1=CC=C(C=C1)N	{1: 2, 2: 2, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	30273-41-7	CC1=CC(=CC(=C1N)Br)Br	{1: 1, 18: 2, 30: 1, 14: 2}
Did not match all atoms present	30276-99-4	CC1=CSC2=C(C=CC=[N+]12)[O-]	{1: 1, 41: 1, 14: 4, 33: 1}
Did not match all atoms present	30277-00-0	CC1=[N+]2C(=CSC2=C(C=C1)[O-])C	{1: 2, 41: 1, 14: 3, 33: 1}
Did not match all atoms present	30277-17-9	CC1=[N+]2C=CSC2=C(C=C1)[O-]	{1: 1, 41: 1, 14: 4, 33: 1}
Did not match all atoms present	30282-44-1	CC1=C(C(=CC=C1)N/N=C/2\C(=CC(=CC2=O)N=NC3=CC=C(C=C3)S(=O)(=O)O)O)C	{1: 2, 34: 3, 14: 9, 15: 3, 20: 2, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	30286-75-0	CC[N+]1(C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4)C.[Br-]	{1: 2, 2: 2, 3: 1, 11: 2, 12: 5, 14: 5, 18: 1, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	3029-19-4	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=O	{26: 1, 14: 9}
Did not match all atoms present	3029-32-1	C1=CC=C2C=C3C(=CC2=C1)C(=O)C4=CC5=CC=CC=C5C=C4C3=O	{25: 2, 14: 12}
Did not match all atoms present	3029-40-1	C1=CC=C(C=C1)/C=C/C=C/C=C/C=C/C2=CC=CC=C2	{14: 10, 6: 8}
Did not match all atoms present	3029-41-2	C1=CC=C(C=C1)/C=C/C=C/C=C/C=C/C=C/C2=CC=CC=C2	{14: 10, 6: 10}
Did not match all atoms present	3029-42-3	C1=CC=C(C=C1)/C=C/C=C/C=C/C=C/C=C/C=C/C2=CC=CC=C2	{14: 10, 6: 12}
Did not match all atoms present	3029-79-6	CC1=CC=CC(=C1)C=CC(=O)O	{1: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	30291-68-0	[Cu+].[I-].[I-]	{19: 2}
Did not match all atoms present	30299-08-2	CCC(C)(C(=O)O)OC1=CC=C(C=C1)C2(CCCCC2)C3=CC=C(C=C3)OC(C)(CC)C(=O)O	{1: 4, 2: 2, 4: 2, 11: 5, 13: 1, 14: 8, 22: 2, 27: 2}
Did not match all atoms present	303-07-1	C1=CC(=C(C(=C1)O)C(=O)O)O	{27: 1, 21: 2, 14: 3}
Did not match all atoms present	303-16-2	C1C(C(=O)NC1=O)N2C(=O)C3=CC=CC=C3C2=O	{32: 1, 33: 1, 11: 1, 12: 1, 14: 4, 25: 4}
Did not match all atoms present	303-21-9	CC1=C(C=C(C(=C1[N+](=O)[O-])O)C(C)C)[N+](=O)[O-]	{38: 2, 1: 3, 3: 1, 21: 1, 14: 1}
Did not match all atoms present	303-26-4	C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl	{32: 1, 33: 1, 3: 1, 11: 4, 14: 9, 17: 1}
Did not match all atoms present	303-38-8	C1=CC(=C(C(=C1)O)O)C(=O)O	{27: 1, 21: 2, 14: 3}
Did not match all atoms present	303-45-7	CC1=C(C(=C2C(=C1)C(=C(C(=C2C=O)O)O)C(C)C)O)C3=C(C=C4C(=C3O)C(=C(C(=C4C(C)C)O)O)C=O)C	{1: 6, 26: 2, 3: 2, 21: 6, 14: 2}
Did not match all atoms present	303-47-9	CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)NC(CC3=CC=CC=C3)C(=O)O)Cl	{1: 1, 2: 1, 3: 1, 11: 1, 12: 1, 14: 6, 17: 1, 21: 1, 24: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	303-49-1	CN(C)CCCN1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl	{1: 2, 2: 3, 33: 2, 11: 2, 14: 7, 17: 1}
Did not match all atoms present	303-53-7	CN(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31	{1: 2, 2: 2, 6: 1, 33: 1, 14: 10, 15: 1}
Did not match all atoms present	303-54-8	CN(C)CCCN1C2=CC=CC=C2C=CC3=CC=CC=C31	{1: 2, 2: 3, 14: 10, 33: 2}
Did not match all atoms present	303-69-5	CN(C)CCCN1C2=CC=CC=C2SC3=C1N=CC=C3	{1: 2, 2: 3, 35: 1, 33: 2, 41: 1, 14: 7}
Did not match all atoms present	303-70-8	CN(C)CCCN1C2=C(CCC3=CC=CC=C31)C=C(C=C2)O	{1: 2, 2: 3, 33: 2, 11: 2, 14: 7, 21: 1}
Did not match all atoms present	303-75-3	CCC1(CC2C3=CC(=C(C=C3CCN2CC1CC(C)C)OC)OC)O	{1: 5, 2: 2, 3: 1, 33: 1, 11: 4, 12: 2, 13: 1, 14: 2, 20: 1, 22: 2}
Did not match all atoms present	303-81-1	CC1=C(C=CC2=C1OC(=O)C(=C2O)NC(=O)C3=CC(=C(C=C3)O)CC=C(C)C)O[C@H]4[C@@H]([C@@H]([C@H](C(O4)(C)C)OC)OC(=O)N)O	{1: 6, 2: 1, 6: 1, 7: 1, 12: 4, 13: 1, 14: 5, 20: 1, 21: 2, 22: 2, 23: 1, 24: 1, 28: 2, 30: 1, 31: 1}
Did not match all atoms present	3030-80-6	C1=CC=C2C(=C1)NC(=N2)[S-].C1=CC=C2C(=C1)NC(=N2)[S-].[Zn+2]	{32: 2, 35: 2, 14: 8}
Did not match all atoms present	30304-41-7	CCCCCCCCCCCCC1=CC=C(C=C1)OP(=S)(OC2=CC=C(C=C2)CCCCCCCCCCCC)S	{1: 2, 2: 22, 22: 2, 14: 8, 39: 1}
Did not match all atoms present	303094-23-7	COC1=C(C=C2C(NCCC2=C1)CC(=O)O)OC.O	{32: 1, 1: 2, 2: 1, 11: 2, 12: 1, 14: 2, 22: 2, 27: 1}
Did not match all atoms present	3031-05-8	CC1=CC2=C(C=C1)C(=C(C=C2)C)C	{1: 3, 14: 5}
Did not match all atoms present	3031-08-1	CC1=CC2=CC(=CC(=C2C=C1)C)C	{1: 3, 14: 5}
Did not match all atoms present	3031-15-0	CC1=C(C2=CC=CC=C2C(=C1C)C)C	{1: 4, 14: 4}
Did not match all atoms present	3031-21-8	CC(C)OP(=S)(OC(C)C)SSP(=S)(OC(C)C)OC(C)C	{40: 2, 1: 8, 3: 4, 22: 4}
Did not match all atoms present	30316-17-7	CC1CCC2=C(C=CC(=C2C1)C)C	{1: 3, 11: 3, 12: 1, 14: 2}
Did not match all atoms present	30318-99-1	CC1=CSC=C1Br	{1: 1, 18: 1, 14: 2, 41: 1}
Did not match all atoms present	3032-11-9	CCOC(=O)C[N+](C)(C)C.[Cl-]	{1: 4, 2: 2, 28: 1, 17: 1}
Did not match all atoms present	3032-32-4	C1=CC(=C(C(=C1Cl)C(=O)O)N)Cl	{17: 2, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	3032-55-1	CC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-]	{1: 1, 2: 3, 4: 1, 22: 3}
Did not match all atoms present	3032-81-3	C1=C(C=C(C=C1Cl)I)Cl	{17: 2, 19: 1, 14: 3}
Did not match all atoms present	3032-92-6	C#CC1=CC=C(C=C1)C#N	{9: 1, 10: 1, 37: 1, 14: 4}
Did not match all atoms present	3033-29-2	CCCCCCCC[Sn]1(OC(=O)CCS1)CCCCCCCC	{1: 2, 2: 14, 11: 2, 28: 1, 41: 1}
Did not match all atoms present	3033-37-2	CCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCC)OCCCCCCCCCCCCC	{1: 3, 2: 36, 29: 1, 22: 3}
Did not match all atoms present	3033-73-6	C1=CC=C(C(=C1)C(=O)OOC(=O)C2=CC=CC=C2Cl)Cl	{17: 2, 28: 2, 14: 8}
Did not match all atoms present	3033-77-0	C[N+](C)(C)CC1CO1.[Cl-]	{1: 3, 2: 1, 11: 1, 12: 1, 17: 1, 23: 1}
Did not match all atoms present	3033-82-7	CC1=NC2=C(C=CC=C2Cl)C=C1	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	30335-72-9	COC1=CC2=C(C=C1)OC(=C2)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 4, 23: 1}
Did not match all atoms present	3034-19-3	C1=CC=C(C(=C1)NN)[N+](=O)[O-]	{38: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	3034-34-2	C1=CC(=CC=C1C#N)C(=O)N	{24: 1, 30: 1, 14: 4, 37: 1}
Did not match all atoms present	3034-38-6	C1=C(NC=N1)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 2}
Did not match all atoms present	3034-41-1	CN1C=C(N=C1)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 2, 33: 1}
Did not match all atoms present	3034-42-2	CN1C=NC=C1[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 2, 33: 1}
Did not match all atoms present	3034-48-8	C1=C(SC(=N1)Br)[N+](=O)[O-]	{41: 1, 18: 1, 35: 1, 38: 1, 14: 1}
Did not match all atoms present	3034-52-4	C1=CSC(=N1)Cl	{17: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	3034-53-5	C1=CSC(=N1)Br	{41: 1, 18: 1, 35: 1, 14: 2}
Did not match all atoms present	3034-79-5	CC1=CC=CC=C1C(=O)OOC(=O)C2=CC=CC=C2C	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	3034-94-4	C#CC1=CC(=CC=C1)[N+](=O)[O-]	{9: 1, 10: 1, 38: 1, 14: 4}
Did not match all atoms present	30345-27-8	CN1C=NC2=C1C(=O)N=C(N2O)N	{1: 1, 35: 2, 33: 2, 14: 1, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	30345-28-9	CN1C=NC2=C1N(C(=NC2=O)N)O	{1: 1, 35: 2, 33: 2, 14: 1, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	30355-60-3	C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CCl	{2: 1, 35: 3, 14: 5, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	30364-38-6	CC1=CC2=C(C=C1)C(CC=C2)(C)C	{1: 3, 11: 1, 13: 1, 14: 5}
Did not match all atoms present	30364-51-3	CCCCCCCCCCCCCC(=O)N(C)CC(=O)[O-].[Na+]	{24: 2, 1: 2, 2: 13, 33: 1}
Did not match all atoms present	30366-55-3	CCCCOP(=S)(OCCCC)[S-].CCCCOP(=S)(OCCCC)[S-].[Hg+2]	{1: 4, 2: 12, 22: 4}
Did not match all atoms present	30366-97-3	CC(=O)C1=CC(=CC=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O	{24: 2, 1: 1, 21: 1, 14: 10, 31: 1}
Did not match all atoms present	30367-05-6	C1COCCN1CCCNC(=O)C2=C(C3=CC=CC=C3C=C2)O	{33: 1, 2: 3, 11: 4, 14: 6, 21: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	3037-72-7	CCO[Si](C)(CCCCN)OCC	{1: 3, 2: 6, 30: 1, 22: 2}
Did not match all atoms present	30377-62-9	CCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]	{1: 1, 2: 1, 4: 1, 38: 1, 14: 3, 16: 3, 31: 1}
Did not match all atoms present	30377-63-0	CCNC1=C(C=C(C=C1)C(F)(F)F)N	{1: 1, 2: 1, 4: 1, 14: 3, 16: 3, 30: 1, 31: 1}
Did not match all atoms present	30377-68-5	CCN1C(=[N+](C2=C1C=C(C(=C2)C(F)(F)F)Cl)CCCS(=O)(=O)[O-])C	{1: 2, 2: 4, 4: 1, 33: 2, 14: 2, 16: 3, 17: 1, 29: 3}
Did not match all atoms present	30377-70-9	CCN1C2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=C1/C=C/C=C/3\N(C4=C(N3CCCS(=O)(=O)[O-])C=C(C(=C4)Cl)C(F)(F)F)CC)CCCS(=O)(=O)O	{1: 2, 2: 8, 4: 2, 6: 3, 33: 4, 14: 4, 15: 1, 16: 6, 17: 2, 20: 1, 29: 5}
Did not match all atoms present	30378-58-6	C1=CC=C(C(=C1)C2=C3C=CC(=N)C=C3OC4=C2C=CC(=C4)N)C(=O)O	{27: 1, 36: 1, 30: 1, 14: 10, 23: 1}
Did not match all atoms present	30379-55-6	C1=CC=C(C=C1)COCC(=O)O	{2: 2, 27: 1, 22: 1, 14: 5}
Did not match all atoms present	30379-58-9	C1=CC=C(C=C1)COC(=O)CO	{28: 1, 2: 2, 20: 1, 14: 5}
Did not match all atoms present	3038-47-9	C1=CC=C(C(=C1)CC#N)C(F)(F)F	{16: 3, 2: 1, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	3038-48-0	C1=CC=C(C(=C1)CC(=O)O)C(F)(F)F	{16: 3, 2: 1, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	3038-50-4	CC1=CC=CC=C1CC2=NCCN2	{32: 1, 1: 1, 2: 1, 35: 1, 11: 2, 14: 4, 15: 1}
Did not match all atoms present	30382-83-3	CC[N+](C)(C)C.[OH-]	{1: 4, 2: 1}
Did not match all atoms present	30386-01-7	C1=CC=C2C(=C1)C(=O)N(C(=O)N2)N	{32: 1, 25: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	30387-70-3	CCCCOCCOC(=O)CCOC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 7, 14: 2, 17: 3, 22: 2, 28: 1}
Did not match all atoms present	30391-89-0	CC(C)NC(=O)C1=CC=CC=C1N	{1: 2, 3: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	30392-41-7	CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(CNC(C)(C)C)O)OC(=O)C3=CC=C(C=C3)C.CS(=O)(=O)O	{1: 6, 2: 1, 3: 1, 4: 1, 14: 11, 20: 2, 28: 2, 29: 2, 31: 1}
Did not match all atoms present	30394-74-2	C=CC1=NCCN1.OS(=O)(=O)O	{32: 1, 35: 1, 5: 1, 6: 1, 11: 2, 15: 1, 20: 2, 29: 2}
Did not match all atoms present	304-06-3	C1=CC=C(C=C1)C2=C(C(=CC=C2)C(=O)O)O	{27: 1, 21: 1, 14: 8}
Did not match all atoms present	304-17-6	CC(C)N1C(=O)C2=CC=CC=C2C1=O	{1: 2, 3: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	304-20-1	C1=CC=C2C(=C1)C=NN=C2NN.Cl	{17: 1, 35: 2, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	304-21-2	CC1=C2C(=C3C=CC(=CC3=N2)OC)CCN1	{32: 1, 1: 2, 35: 1, 11: 2, 14: 3, 15: 3, 22: 1}
Did not match all atoms present	304-28-9	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)NC(=O)C	{24: 2, 1: 2, 11: 1, 14: 6, 31: 2}
Did not match all atoms present	304-43-8	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C3=CC=CC=C3C4=CC=CC=C4)C(=O)O)C	{1: 2, 33: 1, 41: 1, 12: 3, 13: 1, 14: 9, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	304-59-6	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Na+].[K+]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	304-81-4	C1=CC=C2C(=C1)N=C3C=CC=CC3=[N+]2[O-]	{33: 1, 35: 1, 29: 1, 14: 8}
Did not match all atoms present	304-84-7	CCN(CC)C(=O)C1=CC(=C(C=C1)O)OC	{1: 3, 2: 2, 33: 1, 14: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	304-88-1	C1=CC=C(C=C1)C(=O)N(C2=CC=CC=C2)O	{24: 1, 33: 1, 20: 1, 14: 10}
Did not match all atoms present	3040-71-9	C1CCC(CC1)P2P(P(P2C3CCCCC3)C4CCCCC4)C5CCCCC5	{11: 20, 12: 4}
Did not match all atoms present	30402-14-3	C1=CC=C2C(=C1)C3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 4, 14: 4, 23: 1}
Did not match all atoms present	30405-01-7	CCP(=O)(C)OCC(C)C	{1: 4, 2: 2, 3: 1, 29: 1, 22: 1}
Did not match all atoms present	30408-61-8	CCC1=C(OC(=N1)C)C	{1: 3, 2: 1, 35: 1, 23: 1}
Did not match all atoms present	3041-23-4	CCCCCCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC	{1: 3, 2: 51}
Did not match all atoms present	3041-40-5	C1=CC=C(C=C1)C(C#N)C#N	{3: 1, 37: 2, 14: 5}
Did not match all atoms present	30411-66-6	[B-](F)(F)(F)F.CCCC[NH+]=C1C=C(OC2=CC=CC=C21)C3=CC=C(C=C3)OC	{1: 2, 2: 3, 14: 9, 16: 4, 22: 1, 23: 1, 31: 1}
Did not match all atoms present	30416-77-4	CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 16, 22: 5, 14: 4, 29: 3}
Did not match all atoms present	30417-65-3	CP(=CC=C)(C)C	{1: 3, 5: 1, 6: 2}
Did not match all atoms present	30417-68-6	CP(=CC1=CC=CC=C1)(C)C	{1: 3, 14: 5, 6: 1}
Did not match all atoms present	30419-23-9	COC1=C2C3=C([C@H](CC3)O)C(=O)OC2=C4[C@@H]5C=CO[C@@H]5OC4=C1	{1: 1, 11: 2, 12: 3, 14: 3, 20: 1, 22: 1, 23: 2, 28: 1}
Did not match all atoms present	3042-00-0	C1=CC=C2C(=C1)NC(=N2)SCC(=O)O	{32: 1, 2: 1, 35: 1, 40: 1, 14: 4, 27: 1}
Did not match all atoms present	3042-22-6	C1=CC=C(C=C1)C2=CC=CN2	{32: 1, 14: 8}
Did not match all atoms present	3042-50-0	CCCC1=C(C=CC(=C1)C)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	3042-81-7	COC(=O)C(C1=CC=CC=C1)Br	{1: 1, 18: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	3043-83-2	CC1=C(C(=O)N=C2N1NC(=N2)SC)C(=O)O	{32: 1, 1: 2, 35: 2, 33: 1, 40: 1, 25: 1, 27: 1}
Did not match all atoms present	30431-53-9	CCCCCOC(=O)C1=C(C(=CC(=C1Cl)Cl)Cl)O	{1: 1, 2: 4, 14: 1, 17: 3, 21: 1, 28: 1}
Did not match all atoms present	30431-54-0	CCCCCOC(=O)C1=C(C(=CC(=C1Cl)Cl)Cl)OC(=O)C(=O)OC2=C(C(=C(C=C2Cl)Cl)Cl)C(=O)OCCCCC	{1: 2, 2: 8, 28: 4, 14: 2, 17: 6}
Did not match all atoms present	30433-57-9	CCN1C=CC(=N1)C	{1: 2, 2: 1, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	30433-91-1	C1=CSC(=C1)CCN	{41: 1, 2: 2, 30: 1, 14: 3}
Did not match all atoms present	30436-87-4	C1=CC=C2C(=C1)C(=C(C(=C2O)N=O)O)N=O	{34: 2, 21: 2, 14: 4, 29: 2}
Did not match all atoms present	3044-56-2	CCOC(=O)CC(=O)C1=CC(=C(C(=C1)OC)OC)OC	{1: 4, 2: 2, 14: 2, 22: 3, 24: 1, 28: 1}
Did not match all atoms present	30457-67-1	CC(=CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCCCS(=O)(=O)[O-])C=C3N(C4=C(S3)C=CC(=C4)Cl)CCCCS(=O)(=O)O	{1: 1, 2: 8, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 17: 2, 20: 1, 29: 5}
Did not match all atoms present	30458-69-6	CN1C2=C(C=CC=N2)N=C1N	{1: 1, 35: 2, 30: 1, 14: 3, 33: 1}
Did not match all atoms present	3046-82-0	C1=CC(=C(C=C1CC2=CC(=C(C=C2)O)C=O)C=O)O	{2: 1, 26: 2, 21: 2, 14: 6}
Did not match all atoms present	3046-94-4	CCCCN(CCO)C1=CC=CC=C1	{1: 1, 2: 5, 20: 1, 14: 5, 33: 1}
Did not match all atoms present	3047-33-4	C1(=NC(=NC(=N1)[O-])[O-])[O-].[Na+].[Na+].[Na+]	{35: 3}
Did not match all atoms present	3048-01-9	C1=CC=C(C(=C1)CN)C(F)(F)F	{16: 3, 2: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	30481-54-0	C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N	{24: 1, 38: 1, 30: 1, 14: 8, 31: 1}
Did not match all atoms present	30484-77-6	C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl	{33: 2, 2: 1, 3: 1, 6: 2, 11: 4, 14: 13, 16: 2, 17: 2}
Did not match all atoms present	30486-72-7	CCCCC1=CC2=C(C=C1)N=C(N2)N	{32: 1, 1: 1, 2: 3, 35: 1, 14: 3, 30: 1}
Did not match all atoms present	3049-24-9	C1=CC=C(C=C1)OP(=O)(C2=CC=CC=C2)OC3=CC=CC=C3	{22: 2, 14: 15, 29: 1}
Did not match all atoms present	305-01-1	C1=CC(=O)OC2=CC(=C(C=C21)O)O	{28: 1, 21: 2, 14: 4}
Did not match all atoms present	305-03-3	C1=CC(=CC=C1CCCC(=O)O)N(CCCl)CCCl	{17: 2, 2: 7, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	305-15-7	C1=CC(=C(C=C1Cl)NN)Cl	{17: 2, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	305-53-3	C(C(=O)[O-])I.[Na+]	{24: 1, 2: 1, 19: 1}
Did not match all atoms present	305-72-6	C(CC(=O)[O-])C(=O)C(=O)[O-].[Na+].[Na+]	{24: 3, 2: 2}
Did not match all atoms present	305-80-6	C1=CC(=CC=C1[N+]#N)S(=O)(=O)[O-]	{34: 1, 29: 3, 14: 4}
Did not match all atoms present	305-84-0	C1=C(NC=N1)CC(C(=O)O)NC(=O)CCN	{32: 1, 2: 3, 3: 1, 14: 2, 35: 1, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	305-85-1	C1=C(C=C(C(=C1I)O)I)[N+](=O)[O-]	{38: 1, 19: 2, 21: 1, 14: 2}
Did not match all atoms present	305-96-4	CC(CC1=CC(=CC=C1)O)(C(=O)O)N	{1: 1, 2: 1, 4: 1, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	3051-09-0	C1(=C(NC(=O)NC1=O)[O-])N=C2C(=O)NC(=O)NC2=O.[NH4+]	{32: 4, 25: 5, 34: 1, 15: 1}
Did not match all atoms present	3051-27-2	CC(=O)CC(=O)C1=CC=CS1	{24: 2, 1: 1, 2: 1, 14: 3, 41: 1}
Did not match all atoms present	30516-87-1	CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)N=[N+]=[N-]	{32: 1, 1: 1, 2: 1, 33: 1, 11: 1, 12: 3, 34: 2, 14: 1, 20: 1, 23: 1, 25: 2}
Did not match all atoms present	30517-65-8	C1=CC2=C(C(=C1)O)C(=O)C3=C(C4=C(C=C3C2=O)OC5C4C=CO5)O	{25: 2, 12: 2, 21: 2, 14: 6, 23: 2}
Did not match all atoms present	30529-70-5	CC1=NC(=C(C=C1)C(=O)O)Cl	{1: 1, 27: 1, 35: 1, 14: 2, 17: 1}
Did not match all atoms present	3054-01-1	C1=CC=C(C=C1)CSC[C@H](C(=O)O)N	{2: 2, 3: 1, 40: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	3054-07-7	C(CC[C@H](C(=O)[O-])[NH3+])CCC(=O)[O-]	{24: 2, 2: 5, 3: 1}
Did not match all atoms present	30540-39-7	CCCCP1C=C(C(=C1)C)C	{1: 3, 2: 3, 14: 2}
Did not match all atoms present	30544-34-4	C1=COC(=C1Br)Br	{18: 2, 14: 2, 23: 1}
Did not match all atoms present	30544-47-9	C1=CC=C(C(=C1)C(=O)OCCOCCO)NC2=CC=CC(=C2)C(F)(F)F	{2: 4, 4: 1, 14: 8, 16: 3, 20: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	30544-72-0	CC1=C(C(=CC=C1)C)N(CCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl	{1: 2, 2: 3, 33: 1, 14: 7, 17: 1, 24: 1, 27: 1}
Did not match all atoms present	3055-14-9	CC1=CC(=CC(=C1)C(C)C)C(C)C	{1: 5, 3: 2, 14: 3}
Did not match all atoms present	3056-17-5	CC1=CN(C(=O)NC1=O)[C@H]2C=C[C@H](O2)CO	{32: 1, 1: 1, 2: 1, 33: 1, 12: 2, 14: 3, 20: 1, 23: 1, 25: 2}
Did not match all atoms present	3056-18-6	CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3Cl)Cl)OC(=O)C)OC(=O)C	{1: 3, 2: 1, 35: 3, 33: 1, 12: 4, 14: 1, 17: 2, 23: 1, 28: 3}
Did not match all atoms present	3056-60-8	CCC1=CC(=CC=C1)OC(=O)C	{1: 2, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	3056-93-7	CC1=C(C2=CC=CC=C2N1)/C=C/C3=[N+](C4=CC=CC=C4C3(C)C)C.[Cl-]	{32: 1, 1: 4, 6: 2, 33: 1, 13: 1, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	30560-19-1	CC(=O)NP(=O)(OC)SC	{1: 3, 40: 1, 22: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	30563-77-0	CCN1C(=NC2=C1C=CC(=C2)C(F)(F)F)C	{1: 2, 2: 1, 35: 1, 4: 1, 33: 1, 14: 3, 16: 3}
Did not match all atoms present	30566-92-8	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)CC(=O)C3=CC(=C(C=C3)O)C(=O)N	{33: 1, 2: 3, 14: 13, 21: 1, 24: 2, 30: 1}
Did not match all atoms present	3057-08-7	CC1(COP(OC1)OC2=CC=CC=C2)C	{1: 2, 11: 2, 13: 1, 14: 5, 22: 1, 23: 2}
Did not match all atoms present	30573-52-5	CCC1=CC=CC=C1NCCO	{1: 1, 2: 3, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	30578-37-1	COC1=[N+](N=CC(=C1)N)C2=CC=CC=C2.COS(=O)(=O)[O-]	{1: 2, 35: 1, 33: 1, 14: 7, 22: 2, 29: 3, 30: 1}
Did not match all atoms present	3058-38-6	C1(=C(C(=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])N)[N+](=O)[O-])N	{38: 3, 30: 3}
Did not match all atoms present	3058-39-7	C1=CC(=CC=C1C#N)I	{19: 1, 37: 1, 14: 4}
Did not match all atoms present	3058-47-7	CSC1=CC=CC=C1[N+](=O)[O-]	{40: 1, 1: 1, 38: 1, 14: 4}
Did not match all atoms present	3058-82-0	C=CS(=O)(=O)OC1=CC=C(C=C1)Cl	{5: 1, 6: 1, 14: 4, 17: 1, 22: 1, 29: 2}
Did not match all atoms present	30586-13-1	CC1=C(C=CC(=C1)C(C2=CC=C(C=C2)NC3=CC=CC=C3)(C4=CC=C(C=C4)NC5=CC(=CC=C5)S(=O)(=O)[O-])O)N.[Na+]	{1: 1, 4: 1, 14: 20, 20: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	30590-60-4	CC1=CC=CC2=C1OC(C2)(C)C	{1: 3, 11: 1, 13: 1, 14: 3, 23: 1}
Did not match all atoms present	30594-15-1	CCOP(=O)(C=C)C=C	{1: 1, 2: 1, 5: 2, 6: 2, 22: 1, 29: 1}
Did not match all atoms present	30595-79-0	C1=CC(=C(C(=C1)Cl)CCO)Cl	{17: 2, 2: 2, 20: 1, 14: 3}
Did not match all atoms present	30597-15-0	C1=C(C=C(C(=C1O)O)O)C(=O)[O-].[Na+]	{24: 1, 21: 3, 14: 2}
Did not match all atoms present	306-03-6	CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.Br	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 5, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	306-07-0	CN(CC#C)CC1=CC=CC=C1.Cl	{1: 1, 2: 2, 33: 1, 9: 1, 10: 1, 14: 5, 17: 1}
Did not match all atoms present	306-08-1	COC1=C(C=CC(=C1)CC(=O)O)O	{1: 1, 2: 1, 14: 3, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	306-12-7	C1=CC(=C(C=C1[As]=O)N)O	{30: 1, 21: 1, 14: 3, 29: 1}
Did not match all atoms present	306-23-0	C1=CC(=CC=C1CC(C(=O)O)O)O	{2: 1, 3: 1, 14: 4, 20: 1, 21: 1, 27: 1}
Did not match all atoms present	306-40-1	C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C	{1: 6, 2: 6, 28: 2}
Did not match all atoms present	306-52-5	C(C(Cl)(Cl)Cl)OP(=O)(O)O	{2: 1, 4: 1, 17: 3, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	306-53-6	CC[N+](C)(C)CCN(C)CC[N+](C)(C)CC.[Br-].[Br-]	{1: 7, 2: 6, 18: 2, 33: 1}
Did not match all atoms present	306-61-6	C(#N)[S-].C(#N)[S-].[Mg+2]	{37: 2}
Did not match all atoms present	3060-37-5	CCC(CC)(C1=CC=CC2=CC=CC=C21)C(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 2, 4: 1, 14: 7}
Did not match all atoms present	3060-41-1	C1=CC=C(C=C1)C(CC(=O)O)CN.Cl	{2: 2, 3: 1, 14: 5, 17: 1, 27: 1, 30: 1}
Did not match all atoms present	3060-50-2	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)N	{27: 1, 4: 1, 30: 1, 14: 10}
Did not match all atoms present	3060-89-7	CN(C(=O)NC1=CC=C(C=C1)Br)OC	{1: 2, 33: 1, 14: 4, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	3061-36-7	C1=CC=C(C=C1)OC2=CC=C(C=C2)OC3=CC=CC=C3	{22: 2, 14: 14}
Did not match all atoms present	3061-42-5	CCCCCCCC[O-].CCCCCCCC[O-].CCCCCCCC[O-].CCCCCCCC[O-].[Ti+4]	{1: 4, 2: 28, 29: 4}
Did not match all atoms present	3061-91-4	CC(C)C(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)O)N	{1: 2, 2: 1, 3: 3, 14: 4, 21: 1, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	30611-20-2	CCCCC(=O)C1=CC=C(C=C1)C#N	{24: 1, 1: 1, 2: 3, 37: 1, 14: 4}
Did not match all atoms present	30614-22-3	CC1=C(N=C(N=C1OC(=O)N(C)C)NC)C	{1: 5, 35: 2, 28: 1, 33: 1, 31: 1}
Did not match all atoms present	30614-73-4	CC(=O)OCC1=COC=C1COC(=O)C	{1: 2, 2: 2, 28: 2, 14: 2, 23: 1}
Did not match all atoms present	30614-77-8	CCOC(=O)C1=COC=C1C(=O)OCC	{1: 2, 2: 2, 28: 2, 14: 2, 23: 1}
Did not match all atoms present	30615-19-1	CC(C)[Hg]Cl	{1: 2, 3: 1, 17: 1}
Did not match all atoms present	30618-31-6	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].O.O.O.O.O.O.O.O.O.O.[Er+3].[Er+3]	{24: 6}
Did not match all atoms present	3063-20-5	CCN.CCNC(=S)S	{1: 2, 2: 2, 39: 1, 7: 1, 30: 1, 31: 1}
Did not match all atoms present	3063-72-7	CCN(CC)CCOC1=CC=C(C=C1)C(CC2=CC=C(C=C2)OC)C3=CC=CC=C3.Cl	{1: 3, 2: 5, 3: 1, 33: 1, 14: 13, 17: 1, 22: 2}
Did not match all atoms present	3063-79-4	CC1=CC=C(C=C1)N2CCCC2=O	{1: 1, 11: 3, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	30633-94-4	CCCCC1=CC=C(C=C1)NC=C2C=CC(=CC2=O)OC	{1: 2, 2: 3, 6: 1, 14: 7, 15: 2, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	3064-70-8	C(S(=O)(=O)C(Cl)(Cl)Cl)(Cl)(Cl)Cl	{17: 6, 4: 2, 29: 2}
Did not match all atoms present	3064-73-1	CC(C)CN(CC(C)C)C(=S)SSC(=S)N(CC(C)C)CC(C)C	{1: 8, 2: 4, 3: 4, 33: 2, 40: 2, 7: 2}
Did not match all atoms present	30646-57-2	CC1=C(S1(=O)=O)C	{1: 2, 29: 2, 15: 2}
Did not match all atoms present	3065-79-0	CCN1C2=CC=CC=C2SC1=CC(=CC3=[N+](C4=CC=CC=C4S3)CC)C.[I-]	{1: 3, 2: 2, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 19: 1}
Did not match all atoms present	3065-87-0	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)[N+](=O)[O-]	{25: 2, 38: 1, 21: 2, 14: 9, 31: 1}
Did not match all atoms present	30650-47-6	CC(=CC(=O)OC)NC(C1=CC=C(C=C1)O)C(=O)[O-].[Na+]	{1: 2, 3: 1, 6: 1, 7: 1, 14: 4, 21: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	30651-24-2	C1=CC(=NC=C1[N+](=O)[O-])C(=O)O	{35: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	30652-11-0	CC1=C(C(=O)C=CN1C)O	{1: 2, 33: 1, 21: 1, 14: 2, 25: 1}
Did not match all atoms present	30654-45-6	CCCCC1=CC2=C(CCCC2)C=C1	{1: 1, 2: 3, 11: 4, 14: 3}
Did not match all atoms present	3066-75-9	CCOP(=O)(OCC)OCC=C	{1: 2, 2: 3, 5: 1, 6: 1, 22: 3, 29: 1}
Did not match all atoms present	30667-99-3	COC1=CC=C(C=C1)C(C2=CC=CC=C2OC)C(Cl)(Cl)Cl	{1: 2, 3: 1, 4: 1, 14: 8, 17: 3, 22: 2}
Did not match all atoms present	3067-12-7	C1=CC=C2C(=C1)C3=CC(=O)C4=CC=CC5=C4C3=C(C2=O)C=C5	{25: 2, 14: 10}
Did not match all atoms present	3067-13-8	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C(=O)C=C5)C2=O	{25: 2, 14: 10}
Did not match all atoms present	3067-14-9	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C=CC5=O)C2=O	{25: 2, 14: 10}
Did not match all atoms present	30681-90-4	CC1CC[Si]1(C)C	{1: 3, 11: 2, 12: 1}
Did not match all atoms present	30682-81-6	CN1C(=NNC1=S)C(F)(F)F	{32: 1, 1: 1, 35: 1, 4: 1, 33: 1, 16: 3}
Did not match all atoms present	30684-05-0	C1=CC=C(C=C1)CCC[NH3+].[Cl-]	{17: 1, 2: 3, 14: 5}
Did not match all atoms present	30684-06-1	C1=CC=C(C=C1)CCCCN.Cl	{17: 1, 2: 4, 30: 1, 14: 5}
Did not match all atoms present	3069-19-0	CCCCCC[Si](OC)(OC)OC	{1: 4, 2: 5, 22: 3}
Did not match all atoms present	3069-25-8	CNCCC[Si](OC)(OC)OC	{1: 4, 2: 3, 22: 3, 31: 1}
Did not match all atoms present	3069-30-5	CCO[Si](CCCCN)(OCC)OCC	{1: 3, 2: 7, 30: 1, 22: 3}
Did not match all atoms present	3069-40-7	CCCCCCCC[Si](OC)(OC)OC	{1: 4, 2: 7, 22: 3}
Did not match all atoms present	3069-42-9	CCCCCCCCCCCCCCCCCC[Si](OC)(OC)OC	{1: 4, 2: 17, 22: 3}
Did not match all atoms present	30693-53-9	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)[O-])N.[Na+]	{30: 1, 38: 1, 29: 3, 14: 3}
Did not match all atoms present	30698-64-7	CN(C)CCN(C)C.CN(C)CCN(C)C.O.O.Cl[Cu].Cl[Cu]	{1: 8, 2: 4, 33: 4, 17: 2}
Did not match all atoms present	307-35-7	C(C(C(C(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 18, 4: 8, 29: 2}
Did not match all atoms present	307-51-7	C(C(C(C(C(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 22, 4: 10, 29: 2}
Did not match all atoms present	307-71-1	C(C(C(C(C(C(C(C(C(C(C(=O)[O-])(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[K+]	{16: 20, 24: 1, 3: 1, 4: 9}
Did not match all atoms present	3070-15-3	CCOP(=S)(OCC)OC1=CC=C(C=C1)SC	{40: 1, 1: 3, 2: 2, 22: 3, 14: 4}
Did not match all atoms present	30707-68-7	C1C(=NN(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl	{33: 1, 35: 1, 38: 1, 11: 1, 14: 5, 15: 1, 17: 4, 25: 1, 31: 1}
Did not match all atoms present	30707-77-8	C1CCN(C1)C2=NN(C(=O)C2)C3=CC=C(C=C3)N	{33: 2, 35: 1, 11: 5, 14: 4, 15: 1, 25: 1, 30: 1}
Did not match all atoms present	30707-78-9	CCC(C(=O)NC1=CC=C(C=C1)N2C(=O)CC(=N2)N3CCCC3)OC4=C(C=C(C=C4)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 3, 3: 1, 4: 2, 33: 2, 11: 5, 14: 7, 15: 1, 35: 1, 22: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	30709-28-5	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=CC(=C4C=C(C=CC4=C3O)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]	{34: 1, 38: 1, 14: 10, 15: 1, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	3071-32-7	CC(C1=CC=CC=C1)OO	{1: 1, 3: 1, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	3071-70-3	CCN1C2=CC=CC=C2SC1=CC=CC=CC=CC3=[N+](C4=CC=CC=C4S3)CC.[I-]	{1: 2, 2: 2, 6: 7, 33: 2, 41: 2, 14: 8, 15: 1, 19: 1}
Did not match all atoms present	30711-40-1	CCCCCCC(=O)C1=CC=CS1	{24: 1, 1: 1, 2: 5, 14: 3, 41: 1}
Did not match all atoms present	30711-41-2	CCCCCCCC(=O)C1=CC=CS1	{24: 1, 1: 1, 2: 6, 14: 3, 41: 1}
Did not match all atoms present	30717-57-8	CN(C)C(=O)C1=CC=CS1	{24: 1, 1: 2, 41: 1, 14: 3, 33: 1}
Did not match all atoms present	30718-17-3	C[Si](C)(C)C[N+]#[C-]	{1: 3, 2: 1, 34: 1}
Did not match all atoms present	30719-67-6	CC1=C(C(=C2C(=C1)C(=C(C(=C2C=O)OC(=O)C)OC(=O)C)C(C)C)OC(=O)C)C3=C(C=C4C(=C3OC(=O)C)C(=C(C(=C4C(C)C)OC(=O)C)OC(=O)C)C=O)C	{1: 12, 26: 2, 3: 2, 28: 6, 14: 2}
Did not match all atoms present	3072-84-2	CC(C)(C1=CC(=C(C(=C1)Br)OCC2CO2)Br)C3=CC(=C(C(=C3)Br)OCC4CO4)Br	{1: 2, 2: 2, 4: 1, 11: 2, 12: 2, 14: 4, 18: 4, 22: 2, 23: 2}
Did not match all atoms present	30723-54-7	COC1=CC(=CC=C1)SC2=CC=CC=C2	{40: 1, 1: 1, 22: 1, 14: 9}
Did not match all atoms present	3073-05-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)C5=CC=CC=C5	{14: 22}
Did not match all atoms present	3073-77-6	C1=C(C=NC(=N1)N)[N+](=O)[O-]	{38: 1, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	3073-87-8	CC1=C(OC(=N1)C2=CC=C(C=C2)C3=NC(=C(O3)C4=CC=CC=C4)C)C5=CC=CC=C5	{1: 2, 35: 2, 14: 14, 23: 2}
Did not match all atoms present	30736-77-7	C1C2CC1C3=CC=CC4=C3C2=CC=C4	{11: 2, 12: 2, 14: 6}
Did not match all atoms present	30736-79-9	C1=CC2=C3C(=C1)C4C=CC4C3=CC=C2	{12: 2, 14: 8}
Did not match all atoms present	30737-24-7	C(=O)(C(=O)[O-])[O-].[Tl+].[Tl+]	{24: 2}
Did not match all atoms present	30738-69-3	C1=CC=C(C=C1)C(=O)C2=NC(=O)ON2	{24: 1, 32: 1, 35: 1, 28: 1, 14: 5}
Did not match all atoms present	3074-00-8	C1=CC2=C3C(=C1)C(=O)C4=CC=CC5=C4C3=C(C=C2)C=C5	{25: 1, 14: 10}
Did not match all atoms present	3074-43-9	CN1CCN(CC1)C2=CC=CC=C2	{1: 1, 11: 4, 14: 5, 33: 2}
Did not match all atoms present	30741-06-1	CCN1C2=CC=CC=C2OC1=O	{1: 1, 2: 1, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	30746-58-8	C1=CC=C2C(=C1)OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 4, 14: 4, 23: 2}
Did not match all atoms present	30748-29-9	CC(=CCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)C	{1: 2, 2: 1, 33: 2, 6: 1, 7: 1, 12: 1, 14: 10, 25: 2}
Did not match all atoms present	30749-25-8	CC(C)CC1=CC(=CC=C1)O	{1: 2, 2: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	3075-84-1	CC1=CC(=C(C=C1)C)C2=C(C=CC(=C2)C)C	{1: 4, 14: 6}
Did not match all atoms present	30752-19-3	CCCCCCOC1=CC=C(C=C1)Br	{1: 1, 2: 5, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	3076-26-4	CCCCCCCCCCCCCCCCC(C(=O)OC)S(=O)(=O)O	{1: 2, 2: 15, 3: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	3076-63-9	CCCCCCCCCCCCOP(OCCCCCCCCCCCC)OCCCCCCCCCCCC	{1: 3, 2: 33, 22: 3}
Did not match all atoms present	3077-12-1	CC1=CC=C(C=C1)N(CCO)CCO	{1: 1, 2: 4, 20: 2, 14: 4, 33: 1}
Did not match all atoms present	3077-16-5	CC1=CC=C(C=C1)N2CCOCC2	{1: 1, 11: 4, 33: 1, 14: 4, 23: 1}
Did not match all atoms present	3077-97-2	CC(C)C(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C	{1: 3, 34: 1, 3: 1, 38: 2, 7: 1, 14: 3, 31: 1}
Did not match all atoms present	30776-59-1	CCCCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O	{1: 1, 2: 13, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	3078-09-9	C1=CC=C(C=C1)C=NNC2=CC=C(C=C2)[N+](=O)[O-]	{34: 1, 38: 1, 14: 9, 6: 1, 31: 1}
Did not match all atoms present	3078-97-5	CCOP(=S)(OCC)OC1=CC=C(C=C1)S(=O)(=O)N(C)C	{1: 4, 2: 2, 33: 1, 14: 4, 22: 3, 29: 2}
Did not match all atoms present	30784-25-9	CCC(C)(CC)C1=CC=C(C=C1)O	{1: 3, 2: 2, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	3079-28-5	CCCCCCCCCCS(=O)C	{1: 2, 2: 9, 29: 1}
Did not match all atoms present	30796-92-0	C1=CC2=C3C(=C1)SC4=CC=CC(=C43)C=C2	{41: 1, 14: 8}
Did not match all atoms present	3080-42-0	C1CCC(CC1)NC(=O)N(C2CCCCC2)C(=O)C3=CC=CC=C3	{33: 1, 11: 10, 12: 2, 14: 5, 24: 2, 31: 1}
Did not match all atoms present	30806-83-8	CCOC(=O)C1=CC=C(C=C1)N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	3081-01-4	CC(C)CCC(C)NC1=CC=C(C=C1)NC2=CC=CC=C2	{1: 3, 2: 2, 3: 2, 14: 9, 31: 2}
Did not match all atoms present	3081-07-0	C[Si](C)(O)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O	{1: 8, 20: 2, 22: 3}
Did not match all atoms present	3081-14-9	CC(C)CCC(C)NC1=CC=C(C=C1)NC(C)CCC(C)C	{1: 6, 2: 4, 3: 4, 14: 4, 31: 2}
Did not match all atoms present	3081-20-7	CC1(C(O[Si](O1)(C)C)(C)C)C	{1: 6, 13: 2, 23: 2}
Did not match all atoms present	3081-24-1	CCOC(=O)[C@H](CC1=CC=CC=C1)N	{1: 1, 2: 2, 3: 1, 14: 5, 28: 1, 30: 1}
Did not match all atoms present	308103-40-4	B(C1=CC=CC=C1C(=O)C)(O)O	{24: 1, 1: 1, 20: 2, 14: 4}
Did not match all atoms present	30812-87-4	C1=CC=C(C=C1)CC(Br)Br	{2: 1, 3: 1, 18: 2, 14: 5}
Did not match all atoms present	30817-94-8	CO[Si](CS)(OC)OC	{1: 3, 2: 1, 22: 3, 39: 1}
Did not match all atoms present	30818-17-8	C1CCN(C1)C2=NN(C(=O)C2)C3=CC=C(C=C3)[N+](=O)[O-]	{33: 2, 35: 1, 38: 1, 11: 5, 14: 4, 15: 1, 25: 1}
Did not match all atoms present	30818-18-9	CCC(C(=O)NC1=CC=C(C=C1)N2C(=O)C(C(=N2)N3CCCC3)SC4=NN=NN4C5=CC=CC=C5)OC6=C(C=C(C=C6)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 3, 3: 1, 4: 2, 33: 3, 40: 1, 11: 4, 12: 1, 14: 12, 15: 1, 35: 4, 22: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	30818-70-3	CCOP(=O)(CC1=CC=C(C=C1)C2=CC=CC=C2)OCC	{1: 2, 2: 3, 22: 2, 14: 9, 29: 1}
Did not match all atoms present	30826-80-3	CCN1CCN(C1=S)CC	{1: 2, 2: 2, 11: 2, 33: 2, 15: 1}
Did not match all atoms present	30826-83-6	CCCCN1CCN(C1=S)CCCC	{1: 2, 2: 6, 11: 2, 33: 2, 15: 1}
Did not match all atoms present	308273-67-8	C[C@@H](C1=CC=CC=C1)NCC2=CC(=C(C=C2)OC)OC	{1: 3, 2: 1, 3: 1, 14: 8, 22: 2, 31: 1}
Did not match all atoms present	30830-55-8	C1OC2=C(O1)C=C(C=C2)CCC=O	{2: 2, 11: 1, 26: 1, 14: 3, 23: 2}
Did not match all atoms present	30833-53-5	CC(C)COC(=O)C1=CC=CC=C1C(=O)O	{1: 2, 2: 1, 3: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	30834-33-4	C1=CC=C2C(=C1)C(=C(S2=O)Cl)Cl	{17: 2, 29: 1, 14: 4, 15: 2}
Did not match all atoms present	30835-61-1	CC1=CC2=CC=CC=C2C3=C(C=C4C(=C13)CCC4=O)OC	{1: 2, 11: 2, 22: 1, 14: 6, 25: 1}
Did not match all atoms present	30835-65-5	CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)C(=O)CC4	{1: 1, 11: 2, 14: 7, 25: 1}
Did not match all atoms present	3084-25-1	C(NC(=S)NCO)O	{2: 2, 31: 2, 20: 2, 7: 1}
Did not match all atoms present	3084-40-0	CCOP(=O)(CO)OCC	{1: 2, 2: 3, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	3084-48-8	CCCCCCP(=O)(CCCCCC)CCCCCC	{1: 3, 2: 15, 29: 1}
Did not match all atoms present	3084-50-2	CCCCP(=S)(CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	3084-53-5	C[S+](C)C.[Br-]	{1: 3, 18: 1}
Did not match all atoms present	30842-90-1	CC1=NOC=C1	{1: 1, 35: 1, 14: 2, 23: 1}
Did not match all atoms present	30846-35-6	CCCCCCCCCC1=CC=C(C=C1)O.C=O.C1CO1	{1: 1, 2: 8, 5: 1, 11: 2, 14: 4, 21: 1, 23: 1}
Did not match all atoms present	3085-42-5	C1=CC(=CC=C1S(=O)C2=CC=C(C=C2)Cl)Cl	{17: 2, 29: 1, 14: 8}
Did not match all atoms present	3085-53-8	CC1=CC(=CC=C1)NC=O	{1: 1, 26: 1, 14: 4, 31: 1}
Did not match all atoms present	3085-54-9	CC1=CC=C(C=C1)NC=O	{1: 1, 26: 1, 14: 4, 31: 1}
Did not match all atoms present	3085-82-3	CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)N	{1: 2, 3: 1, 30: 1, 14: 9, 33: 1}
Did not match all atoms present	30855-79-9	C1CN1C2=CC=C(C=C2)[N+](=O)[O-]	{33: 1, 11: 2, 38: 1, 14: 4}
Did not match all atoms present	30855-80-2	C1CN1C2=CC=C(C=C2)C#N	{33: 1, 11: 2, 37: 1, 14: 4}
Did not match all atoms present	3086-62-2	COC1=CC(=CC(=C1OC)OC)C(=O)N	{24: 1, 1: 3, 30: 1, 22: 3, 14: 2}
Did not match all atoms present	30868-55-4	[F-].[F-].[F-].[F-].[F-].[F-].[Ni+2].[Zr+4]	{16: 6}
Did not match all atoms present	3087-16-9	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=C4C=CC(=CC4=CC(=C3O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 4, 33: 2, 7: 1, 14: 12, 15: 2, 21: 1, 29: 6}
Did not match all atoms present	3087-36-3	CC[O-].CC[O-].CC[O-].CC[O-].[Ti+4]	{1: 4, 2: 4, 29: 4}
Did not match all atoms present	3087-37-4	CCC[O-].CCC[O-].CCC[O-].CCC[O-].[Ti+4]	{1: 4, 2: 8, 29: 4}
Did not match all atoms present	3087-39-6	CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].[Ti+4]	{1: 12, 4: 4, 29: 4}
Did not match all atoms present	3088-05-9	C1=CC=C(C=C1)N(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O	{33: 1, 2: 4, 3: 2, 14: 15, 20: 2, 22: 2}
Did not match all atoms present	3088-15-1	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2O)O)C(=O)C3=CC=CC=C3	{24: 2, 21: 2, 14: 12}
Did not match all atoms present	3088-31-1	CCCCCCCCCCCCOCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 15, 29: 3, 22: 3}
Did not match all atoms present	3088-53-7	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Gd+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	3088-54-8	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Er+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	3088-78-6	B(CCCCCCCCC)(O)O	{1: 1, 2: 8, 20: 2}
Did not match all atoms present	3089-11-0	COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)COC	{1: 6, 2: 6, 35: 3, 22: 6, 33: 3}
Did not match all atoms present	3089-55-2	CCCCCCCCOC(=O)CCCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 12, 28: 2, 14: 5}
Did not match all atoms present	309-10-4	C1=CC=C(C=C1)C(C(F)(F)F)(Cl)Cl	{16: 3, 17: 2, 4: 2, 14: 5}
Did not match all atoms present	309-29-5	CCN1CC(C(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)CCN4CCOCC4	{1: 1, 2: 3, 33: 2, 11: 5, 12: 1, 13: 1, 14: 10, 23: 1, 25: 1}
Did not match all atoms present	309-36-4	CCC#CC(C)C1(C(=O)N=C(N(C1=O)C)[O-])CC=C.[Na+]	{1: 3, 2: 2, 3: 1, 5: 1, 6: 1, 33: 1, 10: 2, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	309-43-3	CCCC(C)C1(C(=O)NC(=O)[N-]C1=O)CC=C.[Na+]	{32: 1, 1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 13: 1, 35: 1, 25: 3}
Did not match all atoms present	3090-21-9	CO[Si](CCCOC(=O)C=CC(=O)OCCC[Si](OC)(OC)OC)(OC)OC	{1: 6, 2: 6, 28: 2, 22: 6, 6: 2}
Did not match all atoms present	3090-35-5	CCCCCCCCC=CCCCCCCCC(=O)O[Sn](CCCC)(CCCC)CCCC	{1: 4, 2: 23, 28: 1, 6: 2}
Did not match all atoms present	3090-36-6	CCCCCCCCCCCC(=O)O[Sn](CCCC)(CCCC)CCCC	{1: 4, 2: 19, 28: 1}
Did not match all atoms present	3090-45-7	C1C=CCC2=C(C=CC(=C21)O)O	{11: 2, 21: 2, 14: 4}
Did not match all atoms present	3090-47-9	C1C2C=CC1C3=C(C=CC(=C23)O)O	{11: 1, 12: 2, 21: 2, 14: 4}
Did not match all atoms present	30903-87-8	[Li+].C(=O)(C(=O)[O-])O	{24: 1, 27: 1}
Did not match all atoms present	3091-18-7	CCCCC[Sn](CCCCC)(CCCCC)Br	{1: 3, 2: 12, 18: 1}
Did not match all atoms present	3091-25-6	CCCCCCCC[Sn](Cl)(Cl)Cl	{1: 1, 2: 7, 17: 3}
Did not match all atoms present	3091-32-5	C1CCC(CC1)[Sn](C2CCCCC2)(C3CCCCC3)Cl	{17: 1, 11: 15, 12: 3}
Did not match all atoms present	30914-89-7	C1COC(CN1)C2=CC(=CC=C2)C(F)(F)F	{32: 1, 4: 1, 11: 3, 12: 1, 14: 4, 16: 3, 23: 1}
Did not match all atoms present	3092-17-9	COC1=CC(=C(C=C1)OC)C(CNC(=O)CN)O.Cl	{1: 2, 2: 2, 3: 1, 14: 3, 17: 1, 20: 1, 22: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	3092-46-4	C1=C[Te]C=CS1	{41: 1, 14: 4}
Did not match all atoms present	30926-22-8	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)O)C3=CC=CC=C3	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 9, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	30927-98-1	CCOC1=C(C=C(C(=C1)N=NC2=CC=C(C=C2)NC3=CC=C(C=C3)[N+]#N)C)[N+]#N	{1: 2, 2: 1, 34: 4, 14: 10, 22: 1, 31: 1}
Did not match all atoms present	30933-31-4	C1=CSC=C1C(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 3, 41: 1}
Did not match all atoms present	3094-09-5	C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=C(C(=O)NC2=O)F)O)O	{32: 1, 1: 1, 33: 1, 12: 4, 14: 1, 16: 1, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	3094-87-9	CC(=O)[O-].CC(=O)[O-].[Fe+2]	{24: 2, 1: 2}
Did not match all atoms present	30947-30-9	CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].[Ni+2]	{1: 14, 2: 4, 4: 4, 14: 4, 21: 2, 22: 2, 29: 4}
Did not match all atoms present	3095-65-6	C(C(C(=O)[O-])O)(C(=O)O)O.[NH4+]	{24: 1, 27: 1, 3: 2, 20: 2}
Did not match all atoms present	3095-95-2	CCOP(=O)(CC(=O)O)OCC	{1: 2, 2: 3, 27: 1, 29: 1, 22: 2}
Did not match all atoms present	30958-43-1	CC(=O)NNC1=C(C(=O)N=CN1)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 14: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	3096-47-7	C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)Cl	{17: 1, 14: 7, 25: 1}
Did not match all atoms present	3096-50-2	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2=O	{24: 1, 1: 1, 31: 1, 14: 7, 25: 1}
Did not match all atoms present	3096-52-4	C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]	{25: 1, 38: 1, 14: 7}
Did not match all atoms present	3096-56-8	C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)Br	{25: 1, 18: 1, 14: 7}
Did not match all atoms present	3096-57-9	C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)N	{25: 1, 30: 1, 14: 7}
Did not match all atoms present	3096-81-9	C1=CC=C(C=C1)OC2=CC=C(C=C2)C#N	{22: 1, 14: 9, 37: 1}
Did not match all atoms present	3096-95-5	CC1=C(C(=CC=C1)C)N=CC2=CC=CC=C2	{1: 2, 34: 1, 14: 8, 6: 1}
Did not match all atoms present	3098-18-8	CC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{24: 1, 1: 1, 21: 1, 14: 8}
Did not match all atoms present	3098-82-6	C[Si](C)(C)[Si](C)(C)CC1=CC=CC=C1	{1: 5, 2: 1, 14: 5}
Did not match all atoms present	30980-97-3	B(C)(C)NN(C)C	{1: 4, 33: 1, 31: 1}
Did not match all atoms present	3099-52-3	CCN(CC)CCOC(=O)C1=CN=CC=C1	{1: 2, 2: 4, 35: 1, 33: 1, 14: 4, 28: 1}
Did not match all atoms present	30991-42-5	CC1=CC=CC(=C1O)C(=O)NN	{1: 1, 14: 3, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	30994-24-2	C1C=CC=[C-]1.[K+]	{11: 1, 14: 3}
Did not match all atoms present	30995-65-4	CCC1=CC=CC=C1S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 29: 3, 14: 4}
Did not match all atoms present	31001-73-7	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)OS(=O)(=O)C5=CC=CC6=C5C=CC(=C6[O-])[N+]#N	{24: 1, 34: 2, 22: 2, 14: 18, 29: 4}
Did not match all atoms present	31001-77-1	CO[Si](C)(CCCS)OC	{1: 3, 2: 3, 22: 2, 39: 1}
Did not match all atoms present	31002-87-6	CC(C)(C1=CC(=CC=C1)Cl)O	{1: 2, 4: 1, 20: 1, 14: 4, 17: 1}
Did not match all atoms present	31004-82-7	C1=CC=C(C=C1)C2=C3C=CC(=N3)C=C4C=CC(=CC5=NC(=CC6=C(C(=C2N6C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9)C=C5)N4.[Mn]	{32: 1, 33: 1, 35: 2, 14: 29}
Did not match all atoms present	31005-02-4	CCOC1=CC2=C(C=C1)C=CC(=O)O2	{1: 1, 2: 1, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	31006-98-1	CC1=CC=C(C=C1)C(=C)C(C)(C)C	{1: 4, 4: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	3101-08-4	[CH]C1=CC=CC=C1	{14: 5}
Did not match all atoms present	3101-60-8	CC(C)(C)C1=CC=C(C=C1)OCC2CO2	{1: 3, 2: 1, 4: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	3101-79-9	C1=CC=C(C=C1)N.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 30: 1, 14: 8}
Did not match all atoms present	31010-51-2	CCN1C=NC2=C1NC=NC2=O	{32: 1, 1: 1, 2: 1, 35: 2, 33: 1, 14: 2, 25: 1}
Did not match all atoms present	31011-57-1	C1CCOC1.C1CCOC1.Cl[Ti](Cl)(Cl)Cl	{17: 4, 11: 8, 23: 2}
Did not match all atoms present	31012-29-0	CC1=C2C(=C(C3=CC=CC=C13)COC(=O)C4=CC=CC=C4)C=CC5=CC=CC=C52	{1: 1, 2: 1, 28: 1, 14: 15}
Did not match all atoms present	3102-00-9	CCCCOCC(COC1=CC=CC=C1)O	{1: 1, 2: 5, 3: 1, 14: 5, 20: 1, 22: 2}
Did not match all atoms present	3102-79-2	C[Si](CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(Cl)Cl	{16: 17, 1: 1, 2: 2, 4: 8, 17: 2}
Did not match all atoms present	3102-87-2	CC1=C(C(=C(C(=C1N)C)C)N)C	{1: 4, 30: 2}
Did not match all atoms present	31024-26-7	CO[Si](C)(C)CCCN	{1: 3, 2: 3, 30: 1, 22: 1}
Did not match all atoms present	31024-46-1	CO[Si](CCCNCC=C)(OC)OC	{1: 3, 2: 4, 5: 1, 6: 1, 22: 3, 31: 1}
Did not match all atoms present	31024-54-1	CO[Si](CCCN1CCOCC1)(OC)OC	{1: 3, 2: 3, 33: 1, 11: 4, 22: 3, 23: 1}
Did not match all atoms present	31024-56-3	CCCCNCCC[Si](OC)(OC)OC	{1: 4, 2: 6, 22: 3, 31: 1}
Did not match all atoms present	31027-31-3	CC(C)C1=CC=C(C=C1)N=C=O	{1: 2, 34: 1, 3: 1, 8: 1, 14: 4, 29: 1}
Did not match all atoms present	31031-74-0	CC(C)CCOC(=O)C(C1=CC=CC=C1)[NH3+].[Cl-]	{1: 2, 2: 2, 3: 2, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	31032-92-5	CCC1=CC=CC2=C1C=C(C=C2)C	{1: 2, 2: 1, 14: 6}
Did not match all atoms present	31037-02-2	CCOC(=O)C1=C(N(N=C1)C)N	{1: 2, 2: 1, 35: 1, 33: 1, 14: 1, 28: 1, 30: 1}
Did not match all atoms present	31038-11-6	C[Si](C)(C)OCC(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 12, 2: 2, 3: 1, 29: 1, 22: 5}
Did not match all atoms present	31039-66-4	CC1=C(C2=C(C(=O)C=CC2=O)C(=C1O)O)O	{1: 1, 21: 3, 14: 2, 25: 2}
Did not match all atoms present	31039-82-4	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)I)C(C)(C)C	{1: 9, 19: 1, 4: 3, 14: 2}
Did not match all atoms present	31044-12-9	CCCCC(CC)COP(=O)(O)[O-].[Na+]	{1: 2, 2: 5, 3: 1, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	31045-95-1	CCCC[Sn](CCCC)(OC(=O)CSCCCCCC(C)C)OC(=O)CSCCCCCC(C)C	{40: 2, 1: 6, 2: 18, 3: 2, 28: 2}
Did not match all atoms present	3105-55-3	C(=C/C(=O)O)\C(=O)O.[Na]	{27: 2, 6: 2}
Did not match all atoms present	3105-97-3	CCN(CC)CCNC1=C2C(=C(C=C1)CO)SC3=CC=CC=C3C2=O	{1: 2, 2: 5, 33: 1, 41: 1, 14: 6, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	31052-43-4	[Se-2].[Rb+].[Rb+]	{}
Did not match all atoms present	31052-46-7	[Se-2].[Cs+].[Cs+]	{}
Did not match all atoms present	31053-06-2	CN1C(=O)N(P1(C)(F)F)C2=CC=CC=C2	{16: 2, 1: 2, 33: 2, 14: 5, 25: 1}
Did not match all atoms present	31053-07-3	CCP1(N(C(=O)N1C2=CC=CC=C2)C)(F)F	{1: 2, 2: 1, 33: 2, 14: 5, 16: 2, 25: 1}
Did not match all atoms present	31053-08-4	CN1C(=O)N(P1(C)(F)F)C	{16: 2, 1: 3, 33: 2, 25: 1}
Did not match all atoms present	31053-09-5	CCP1(N(C(=O)N1C)C)(F)F	{16: 2, 1: 3, 2: 1, 33: 2, 25: 1}
Did not match all atoms present	31053-54-0	CSC1=CC=C[Se]1	{40: 1, 1: 1, 14: 3}
Did not match all atoms present	31053-55-1	CC1=CC=C(S1)OC	{1: 2, 22: 1, 14: 2, 41: 1}
Did not match all atoms present	31055-59-1	C1=CC=C2C=C(C(=CC2=C1)CC3=CC4=CC=CC=C4C=C3S(=O)(=O)[O-])S(=O)(=O)[O-].[Ag+].[Ag+]	{2: 1, 29: 6, 14: 12}
Did not match all atoms present	31058-81-8	CN(C)C1=NC(=NC=C1)Cl	{1: 2, 35: 2, 33: 1, 14: 2, 17: 1}
Did not match all atoms present	31061-58-2	C[N+](C)(C)C1=CC=CC=C1[O-]	{1: 3, 14: 4}
Did not match all atoms present	31065-88-0	[C-]#N.[OH-].[Hg+2]	{}
Did not match all atoms present	3107-20-8	C1=C(C=C(C(=C1Cl)Cl)F)Cl	{16: 1, 17: 3, 14: 2}
Did not match all atoms present	3108-15-4	[B-](F)(F)(F)F.COC1=CC(=C(C=C1)OC)[N+]#N	{16: 4, 1: 2, 34: 1, 22: 2, 14: 3}
Did not match all atoms present	31083-13-3	CCOC(=O)C1=CC=CC=C1C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 28: 1}
Did not match all atoms present	31083-55-3	C1=CC=C2C(=C1)C(=O)C(=CC3=CN=CC=C3)C2=O	{25: 2, 35: 1, 14: 8, 6: 1, 15: 1}
Did not match all atoms present	31087-39-5	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Cr+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	31088-06-9	CCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@@H](O1)N2C=CC(=NC2=O)N)O)O	{1: 1, 2: 15, 35: 1, 33: 1, 12: 4, 14: 2, 20: 2, 23: 1, 25: 1, 28: 1, 30: 1}
Did not match all atoms present	3109-63-5	CCCC[N+](CCCC)(CCCC)CCCC.F[P-](F)(F)(F)(F)F	{16: 6, 1: 4, 2: 12}
Did not match all atoms present	31096-47-6	O.O.O.O.[O-]P(=O)([O-])[O-].[Fe+3]	{29: 4}
Did not match all atoms present	31098-21-2	CC(=C)C(=O)OCCCS(=O)(=O)[O-].[K+]	{1: 1, 2: 3, 5: 1, 7: 1, 28: 1, 29: 3}
Did not match all atoms present	311-28-4	CCCC[N+](CCCC)(CCCC)CCCC.[I-]	{1: 4, 2: 12, 19: 1}
Did not match all atoms present	311-44-4	C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(OCCCl)OCCCl	{2: 4, 38: 1, 14: 4, 17: 2, 22: 3, 29: 1}
Did not match all atoms present	311-45-5	CCOP(=O)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 14: 4, 22: 3, 29: 1}
Did not match all atoms present	311-47-7	CCOP(=O)(OCC)OC=CCl	{1: 2, 2: 2, 6: 2, 17: 1, 22: 3, 29: 1}
Did not match all atoms present	31111-21-4	[O-][Ru](=O)(=O)[O-].[K+].[K+]	{29: 4}
Did not match all atoms present	31112-62-6	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)N[C@@H]2[C@H]([C@@H]([C@H](OC2O)CO)O)O)I)N(C)C(=O)C)I	{1: 3, 2: 1, 33: 1, 12: 5, 19: 3, 20: 4, 23: 1, 24: 3, 31: 2}
Did not match all atoms present	3112-74-1	CCC(=O)[O-].CCC(=O)[O-].[Cu+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	3112-79-6	CC1=CC(=C(C(=C1)C)S(=O)(=O)C2=C(C=C(C=C2C)C)C)C	{1: 6, 29: 2, 14: 4}
Did not match all atoms present	3112-82-1	CC1=CC(=C(C(=C1)C)S(=O)(=O)C2=CC=CC=C2)C	{1: 3, 29: 2, 14: 7}
Did not match all atoms present	3112-85-4	CS(=O)(=O)C1=CC=CC=C1	{1: 1, 29: 2, 14: 5}
Did not match all atoms present	3112-87-6	CC1=CC=C(C=C1)S(=O)(=O)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 4, 29: 2}
Did not match all atoms present	3112-88-7	C1=CC=C(C=C1)CS(=O)(=O)C2=CC=CC=C2	{2: 1, 29: 2, 14: 10}
Did not match all atoms present	3112-90-1	CS(=O)(=O)CC1=CC=CC=C1	{1: 1, 2: 1, 29: 2, 14: 5}
Did not match all atoms present	31121-06-9	COP1OCCCO1	{1: 1, 11: 3, 22: 1, 23: 2}
Did not match all atoms present	31121-93-4	CC(C)CC1=CC=C(C=C1)C(C)C(=O)[O-].[Na+]	{24: 1, 1: 3, 2: 1, 3: 2, 14: 4}
Did not match all atoms present	31122-82-4	CC(=O)N(CCO)C1=C(C(=C(C(=C1I)C(=O)N(C)CC(CO)O)I)C(=O)N(C)CC(CO)O)I	{1: 3, 2: 6, 3: 2, 33: 3, 19: 3, 20: 5, 24: 3}
Did not match all atoms present	31122-84-6	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)N(C)CC(CO)O)I)C(=O)N(C)CC(CO)O)I	{1: 3, 2: 4, 3: 2, 33: 2, 19: 3, 20: 4, 24: 3, 31: 1}
Did not match all atoms present	31124-38-6	CCCCS(=O)(=O)CC	{1: 2, 2: 4, 29: 2}
Did not match all atoms present	31126-81-5	CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].[Rh+2].[Rh+2]	{24: 4, 1: 4, 2: 4}
Did not match all atoms present	3113-71-1	CC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]	{1: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	3113-72-2	CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O	{1: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	311341-94-3	CCOC(=O)[C@@H]1CCC[C@@H]1N=C=S	{1: 1, 2: 1, 8: 1, 11: 3, 12: 2, 34: 1, 28: 1}
Did not match all atoms present	31137-74-3	C[C@H](C[C@@H](C(=O)[O-])[NH3+])C(=O)[O-]	{24: 2, 1: 1, 2: 1, 3: 2}
Did not match all atoms present	31139-16-9	[B]C#N	{37: 1}
Did not match all atoms present	31139-36-3	C1=CC=C(C=C1)COC(=O)OC(=O)OCC2=CC=CC=C2	{2: 2, 14: 10}
Did not match all atoms present	31139-42-1	C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O.[Na+]	{20: 2, 29: 4, 14: 8}
Did not match all atoms present	31142-56-0	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Al+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	31148-95-5	CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C#N)C	{1: 4, 3: 1, 37: 1, 11: 5, 12: 1, 13: 2, 14: 3}
Did not match all atoms present	3115-05-7	C1=CC=C(C=C1)N(CCC(=O)O)C(=O)C2=C(C(=C(C=C2I)I)N)I	{33: 1, 2: 2, 14: 6, 19: 3, 24: 1, 27: 1, 30: 1}
Did not match all atoms present	3115-39-7	CCCCCCCCOP(=O)(O)OCCCCCCCC	{1: 2, 2: 14, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	3115-68-2	CCCC[P+](CCCC)(CCCC)CCCC.[Br-]	{1: 4, 2: 12, 18: 1}
Did not match all atoms present	31158-25-5	C1CC=CC(C1)(C2=CC=CC=C2)C3=CC=CC=C3	{11: 3, 13: 1, 14: 12}
Did not match all atoms present	31160-10-8	CC1=CC=C(C=C1)NP(=O)(NC2=CC=C(C=C2)C)NC3=CC=C(C=C3)C	{1: 3, 29: 1, 14: 12, 31: 3}
Did not match all atoms present	31161-71-4	CCCCCCCCCCCCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 13, 28: 1, 14: 5}
Did not match all atoms present	31165-67-0	CC(=O)C1=CC=CC=C1OCC2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	31166-44-6	C1CN(CCN1)C(=O)OCC2=CC=CC=C2	{32: 1, 33: 1, 2: 1, 11: 4, 14: 5, 28: 1}
Did not match all atoms present	31169-63-8	CCCCCCCCCCCCCCCS(=O)(=O)O	{1: 1, 2: 14, 20: 1, 29: 2}
Did not match all atoms present	3117-37-1	C1=CC=C(C=C1)C2C3=CC=CC=C3OC2=O	{28: 1, 12: 1, 14: 9}
Did not match all atoms present	31173-90-7	CCC(CC)C1=CC=C(C=C1)C(CC)CC	{1: 4, 2: 4, 3: 2, 14: 4}
Did not match all atoms present	31174-04-6	C1=COC(=C1)C(=O)F	{16: 1, 24: 1, 14: 3, 23: 1}
Did not match all atoms present	3118-97-6	CC1=CC(=C(C=C1)NN=C2C(=O)C=CC3=CC=CC=C32)C	{1: 2, 34: 1, 14: 9, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	31185-58-7	CC1C(OC(N1)C(F)(F)F)C2=CC=CC=C2	{32: 1, 1: 1, 4: 1, 12: 3, 14: 5, 16: 3, 23: 1}
Did not match all atoms present	3119-15-1	C1=C(C(=C(C(=C1I)N)I)C(=O)O)I	{27: 1, 19: 3, 30: 1, 14: 1}
Did not match all atoms present	3119-88-8	COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2F)O	{1: 1, 14: 7, 16: 1, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	3119-93-5	CC[N+]1=C(SC2=CC=CC=C21)C.[I-]	{1: 2, 2: 1, 33: 1, 41: 1, 14: 4, 19: 1}
Did not match all atoms present	3119-94-6	CC[N+]1=CSC2=CC=CC=C21.[I-]	{1: 1, 2: 1, 33: 1, 41: 1, 14: 5, 19: 1}
Did not match all atoms present	31195-17-2	C1=CC=C(C=C1)CC(Br)(Br)Br	{2: 1, 4: 1, 18: 3, 14: 5}
Did not match all atoms present	312-30-1	C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])[N+](=O)[O-])F	{16: 2, 38: 2, 29: 2, 14: 6}
Did not match all atoms present	312-31-2	C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)F	{16: 1, 29: 2, 14: 9}
Did not match all atoms present	312-40-3	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(F)F	{16: 2, 14: 10}
Did not match all atoms present	312-45-8	C[N+]1(CCOC(C1)(C2=CC=C(C=C2)C3=CC=C(C=C3)C4(C[N+](CCO4)(C)C)O)O)C.[Br-].[Br-]	{1: 4, 11: 6, 13: 2, 14: 8, 18: 2, 20: 2, 23: 2}
Did not match all atoms present	312-73-2	C1=CC=C2C(=C1)NC(=N2)C(F)(F)F	{16: 3, 32: 1, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	312-81-2	C[Si](C)(C)C1CC(C1(F)F)(F)F	{16: 4, 1: 3, 11: 1, 12: 1, 13: 2}
Did not match all atoms present	312-93-6	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COP(=O)(O)O)O)C)O)F)C	{1: 3, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 4, 22: 1, 24: 1, 25: 1, 29: 1}
Did not match all atoms present	312-94-7	C1=CC=C(C(=C1)C(=O)Cl)C(F)(F)F	{16: 3, 17: 1, 4: 1, 14: 4, 24: 1}
Did not match all atoms present	3120-04-5	CC1=CC(=O)N(C1=O)C2=CC=CC=C2	{1: 1, 25: 2, 33: 1, 14: 6, 15: 1}
Did not match all atoms present	3120-74-9	CC1=C(C=CC(=C1)O)SC	{40: 1, 1: 2, 21: 1, 14: 3}
Did not match all atoms present	3121-52-6	CC1=[N+](C2=CC=CC=C2S1)CC(=O)O.[Br-]	{1: 1, 2: 1, 33: 1, 41: 1, 14: 4, 18: 1, 27: 1}
Did not match all atoms present	3121-70-8	CCCC(=O)OC1=CC=CC2=CC=CC=C21	{1: 1, 2: 2, 28: 1, 14: 7}
Did not match all atoms present	3121-74-2	C1=CC=C(C=C1)NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O	{34: 3, 38: 1, 14: 11, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	3121-77-5	CC[Si](C)(C)CCl	{1: 3, 2: 2, 17: 1}
Did not match all atoms present	31212-28-9	C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)O	{38: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	31215-06-2	CCCCCCCCCC1=CC(=CC2=CC=CC=C21)O	{1: 1, 2: 8, 21: 1, 14: 6}
Did not match all atoms present	31218-83-4	CCNP(=S)(OC)OC(=CC(=O)OC(C)C)C	{1: 5, 2: 1, 3: 1, 6: 1, 7: 1, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	31219-53-1	O=[AsH3]	{29: 1}
Did not match all atoms present	31219-54-2	O=[SbH3]	{29: 1}
Did not match all atoms present	3122-01-8	CN(C)CCN1C(=O)CC(SC2=CC=CC=C21)C3=CC=CC=C3.Cl	{1: 2, 2: 2, 33: 2, 41: 1, 11: 1, 12: 1, 14: 9, 17: 1, 25: 1}
Did not match all atoms present	3122-21-2	C1=CC=C(C=C1)C(C#N)(C2=CC=CC=C2)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4	{4: 2, 37: 2, 14: 20}
Did not match all atoms present	31221-68-8	C1(=C(N=C(N=C1Cl)Cl)N)[N+](=O)[O-]	{17: 2, 35: 2, 38: 1, 30: 1}
Did not match all atoms present	31225-17-9	C1=CC(=C(C=C1NC(=O)NO)Cl)Cl	{24: 1, 17: 2, 20: 1, 14: 3, 31: 2}
Did not match all atoms present	31228-08-7	C1=CC=C2C(=C1)C=CC=C2SSC3=CC=CC4=CC=CC=C43	{40: 2, 14: 14}
Did not match all atoms present	3123-27-1	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)C#N	{35: 1, 37: 1, 14: 10}
Did not match all atoms present	31230-17-8	CC1=CC(=NN1)N	{32: 1, 1: 1, 35: 1, 30: 1, 14: 1}
Did not match all atoms present	31232-27-6	C[NH+]1CCC(=C2C3=CC=CC=C3C(C4=CC=CC=C42)O)CC1.[Cl-]	{1: 1, 11: 4, 12: 1, 14: 8, 15: 2, 17: 1, 20: 1}
Did not match all atoms present	3124-01-4	C1=CC=C(C=C1)[Pb](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[Pb](C2=CC=CC=C2)C3=CC=CC=C3	{14: 30}
Did not match all atoms present	3124-29-6	C1=CC=C(C=C1)[Pb](C2=CC=CC=C2)(Br)Br	{18: 2, 14: 10}
Did not match all atoms present	31242-93-0	C1=CC(=C(C(=C1OC2=C(C(=C(C=C2)Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 22: 1, 14: 4}
Did not match all atoms present	31247-21-9	C1=CC=C(C=C1)C2=C(S2=O)C3=CC=CC=C3	{29: 1, 14: 10, 15: 2}
Did not match all atoms present	31248-66-5	CO[C@@H]1CC23C(=CCN2CCC4=CC5=C(C=C34)OCO5)C=C1.Br	{1: 1, 33: 1, 11: 5, 12: 1, 13: 1, 14: 5, 15: 1, 18: 1, 22: 1, 23: 2}
Did not match all atoms present	3125-64-2	COC1=CC=CC(=C1)N=C=S	{8: 1, 1: 1, 34: 1, 22: 1, 14: 4}
Did not match all atoms present	3125-66-4	COC(=O)C1=CC(=CC=C1)N=C=S	{8: 1, 1: 1, 34: 1, 28: 1, 14: 4}
Did not match all atoms present	3125-71-1	CC(=O)C1=CC(=CC=C1)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4, 24: 1}
Did not match all atoms present	3125-73-3	C1=CC(=CC(=C1)I)N=C=S	{8: 1, 34: 1, 19: 1, 14: 4}
Did not match all atoms present	3125-78-8	C1=CC(=CC(=C1)N=C=S)C#N	{8: 1, 34: 1, 37: 1, 14: 4}
Did not match all atoms present	31252-42-3	C1CNCCC1CC2=CC=CC=C2	{32: 1, 2: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	31252-85-4	C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CI	{2: 1, 19: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	3126-80-5	CCCCC(CC)COC(=O)C1=CC(=C(C=C1C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC	{1: 8, 2: 20, 3: 4, 28: 4, 14: 2}
Did not match all atoms present	3126-90-7	CCCCOC(=O)C1=CC(=CC=C1)C(=O)OCCCC	{1: 2, 2: 6, 28: 2, 14: 4}
Did not match all atoms present	31265-39-1	C1=CC(=C(C=C1O)O)CC2=CC(=CC(=C2O)CC3=C(C=C(C=C3)O)O)Cl	{17: 1, 2: 2, 21: 5, 14: 8}
Did not match all atoms present	31270-74-3	C1=CSC(=C1)CC2=CSC=C2	{41: 2, 2: 1, 14: 6}
Did not match all atoms present	31272-21-6	CC1=NN(C(=C1C(=O)C2=CC=CC=C2F)N)C	{1: 2, 35: 1, 33: 1, 14: 4, 16: 1, 24: 1, 30: 1}
Did not match all atoms present	312739-77-8	CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.[Y+3]	{1: 3, 2: 9, 11: 3, 14: 6, 15: 3}
Did not match all atoms present	31274-42-7	C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)C(Br)(Br)Br	{35: 1, 4: 1, 41: 1, 14: 4, 18: 3, 29: 2}
Did not match all atoms present	31277-98-2	C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Pd]	{2: 4, 14: 40}
Did not match all atoms present	31283-14-4	CCC1=CSC2=CC=CC=C21	{1: 1, 2: 1, 14: 5, 41: 1}
Did not match all atoms present	3129-90-6	C(=N)=S	{8: 1, 36: 1}
Did not match all atoms present	3129-91-7	C1CCC(CC1)[NH2+]C2CCCCC2.N(=O)[O-]	{34: 1, 11: 10, 12: 2, 29: 2}
Did not match all atoms present	3129-92-8	C1CCC(CC1)N.C1=CC=C(C=C1)C(=O)O	{27: 1, 11: 5, 12: 1, 30: 1, 14: 5}
Did not match all atoms present	3129-93-9	CC(C)[N-]C(C)C.N(=O)[OH2+]	{1: 4, 34: 2, 3: 2, 29: 1}
Did not match all atoms present	31291-42-6	CCCCCCCCCC1=CC=CC=C1[O-].CCCCCCCCCC1=CC=CC=C1[O-].[Sr+2]	{1: 2, 2: 16, 14: 8}
Did not match all atoms present	31291-60-8	CCC(C)C1=C(C(=CC=C1)O)C(C)CC	{1: 4, 2: 2, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	313-06-4	CC12CCC3C(C1CCC2OC(=O)CCC4CCCC4)CCC5=C3C=CC(=C5)O	{1: 1, 2: 2, 11: 10, 12: 5, 13: 1, 14: 3, 21: 1, 28: 1}
Did not match all atoms present	313-56-4	CC1=CC(=C(C(=C1)C)C(=O)C(F)(F)F)C	{16: 3, 1: 3, 4: 1, 14: 2, 24: 1}
Did not match all atoms present	313-63-3	C1=CC=C2C(=C1)C3=C4C(=CC=C3)C5=CC=CC6=C5C7=C(C8=CC=CC=C68)C9=CC=CC=C9C2=C47	{14: 18}
Did not match all atoms present	313-67-7	COC1=CC=CC2=C3C(=C(C=C21)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)O	{1: 1, 38: 1, 11: 1, 14: 5, 22: 1, 23: 2, 27: 1}
Did not match all atoms present	313-71-3	C1=CC=C2C=C3C=C4C=C5C6=CC=CC7=C6C8=C(C=CC=C8C5=CC4=CC3=CC2=C1)C=C7	{14: 18}
Did not match all atoms present	313-72-4	C12=C(C(=C(C(=C1F)F)F)F)C(=C(C(=C2F)F)F)F	{16: 8}
Did not match all atoms present	313-74-6	CC1=CC=CC2=C1C3=C(C4=CC=CC=C4C=C3C=C2)C	{1: 2, 14: 10}
Did not match all atoms present	313-80-4	C1=CC2=C3C(=C1)C=CC4=NC=CC(=C43)C=C2	{35: 1, 14: 9}
Did not match all atoms present	313-93-9	CCC1=CC2=C(C=C1)N=C3C4=CC=CC=C4N=C5N3C2=NC6=CC=CC=C65	{1: 1, 2: 1, 35: 3, 14: 11, 33: 1}
Did not match all atoms present	313-94-0	CC(C)(C)C1=CC2=C3N=C4C=CC=CC4=C5N3C(=C6C=CC=CC6=N5)N=C2C=C1	{1: 3, 35: 3, 4: 1, 14: 11, 33: 1}
Did not match all atoms present	313-95-1	C1=CC=C2C(=C1)C3=NC4=CC=CC=C4C5=NC6=C(C=CC(=C6)F)C(=N2)N35	{16: 1, 33: 1, 35: 3, 14: 11}
Did not match all atoms present	313-96-2	COC1=CC2=C(C=C1)C3=NC4=CC=CC=C4C5=NC6=CC=CC=C6C(=N2)N35	{1: 1, 35: 3, 22: 1, 14: 11, 33: 1}
Did not match all atoms present	31301-20-9	C[C@H](C1=CC=C(C=C1)Cl)[C@H](C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OCCN4CCCC4	{1: 1, 2: 2, 3: 2, 33: 1, 11: 4, 14: 13, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	31301-28-7	CC1=C2C=CC3=C(C2=NC=C1)N=CC=C3	{1: 1, 35: 2, 14: 7}
Did not match all atoms present	31304-44-6	CC(=O)[O-].O.[Na+]	{24: 1, 1: 1}
Did not match all atoms present	313052-02-7	CC(C)(C)OC(=O)N1CCC(CC1)C[C@@H](C(=O)[O-])NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{1: 3, 2: 2, 3: 1, 4: 1, 33: 1, 11: 4, 12: 2, 14: 8, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	313052-08-3	CC(C)(C)OC(=O)N1CCCC1CC(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{1: 3, 2: 2, 3: 1, 4: 1, 33: 1, 11: 3, 12: 2, 14: 8, 27: 1, 28: 2, 31: 1}
Did not match all atoms present	31307-59-2	C1=CC=C(C=C1)CC2=CC=CC=C2C3=CC=CC=C3	{2: 1, 14: 14}
Did not match all atoms present	3131-03-1	CCC1C(=O)N2CCCC2C(=O)N(C(C(=O)N3CCC(=O)CC3C(=O)NC(C(=O)OC(C(C(=O)N1)NC(=O)C4=C(C=CC=N4)O)C)C5=CC=CC=C5)CC6=CC=C(C=C6)N(C)C)C	{32: 2, 1: 5, 2: 2, 35: 1, 33: 4, 11: 6, 12: 7, 14: 12, 21: 1, 24: 1, 25: 6, 28: 1, 31: 1}
Did not match all atoms present	3131-23-5	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4O)O	{1: 1, 11: 6, 12: 3, 13: 1, 14: 2, 21: 2, 25: 1}
Did not match all atoms present	3131-27-9	CC1=NC=C(C(=C1O)COC)CO.Cl	{1: 2, 2: 2, 35: 1, 14: 1, 17: 1, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	3131-60-0	C1=NN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{33: 1, 2: 1, 35: 2, 12: 4, 14: 1, 20: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	3131-63-3	CCC1=CC2=CC=CC=C2O1	{1: 1, 2: 1, 14: 5, 23: 1}
Did not match all atoms present	3132-99-8	C1=CC(=CC(=C1)Br)C=O	{18: 1, 26: 1, 14: 4}
Did not match all atoms present	31323-44-1	O([Si](O[Si](Cl)(Cl)Cl)(Cl)Cl)[Si](Cl)(Cl)Cl	{17: 8, 22: 2}
Did not match all atoms present	31329-57-4	CCN(CC)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32	{1: 2, 2: 6, 3: 1, 33: 1, 11: 3, 12: 1, 14: 7, 23: 1, 28: 1}
Did not match all atoms present	31335-41-8	C(S(=O)(=O)SC(Cl)(Cl)Cl)(Cl)Cl	{40: 1, 17: 5, 3: 1, 4: 1, 29: 2}
Did not match all atoms present	3135-18-0	CCCCCCCCCCCCCCCCCCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)OCCCCCCCCCCCCCCCCCC	{1: 8, 2: 35, 4: 2, 14: 2, 21: 1, 22: 2, 29: 1}
Did not match all atoms present	3135-54-4	C1=CC=C(C=C1)NC(=O)C2=C3C=CC=CN3C4=C2C(=O)C5=CC=CC=C5C4=O	{24: 1, 25: 2, 33: 1, 14: 13, 31: 1}
Did not match all atoms present	3135-63-5	CN(C)P(C(F)(F)F)Cl	{16: 3, 1: 2, 4: 1, 33: 1, 17: 1}
Did not match all atoms present	31350-46-6	CC1=CC(=CC=C1)S(=O)(=O)C(I)I	{19: 2, 1: 1, 3: 1, 29: 2, 14: 4}
Did not match all atoms present	31350-47-7	CC1=CC=CC=C1S(=O)(=O)C(I)I	{19: 2, 1: 1, 3: 1, 29: 2, 14: 4}
Did not match all atoms present	31350-54-6	C1=CC=C(C=C1)CS(=O)(=O)C(I)I	{19: 2, 2: 1, 3: 1, 29: 2, 14: 5}
Did not match all atoms present	31352-16-6	CCN(CC)C1=CC=C(C=C1)C2=[N+](C3=C4C2=CC=CC4=C(C=C3)Br)CCC#N.[Cl-]	{1: 2, 2: 4, 37: 1, 33: 2, 14: 9, 15: 1, 17: 1, 18: 1}
Did not match all atoms present	31352-31-5	COC(=O)C1=CC(=CC(=C1)OCCCS(=O)(=O)[O-])C(=O)OC.[Na+]	{1: 2, 2: 3, 14: 3, 22: 1, 28: 2, 29: 3}
Did not match all atoms present	31353-87-4	COC1=CC(=C(C=C1)NN=C2C(=O)NC(=O)NC2=O)[N+](=O)[O-]	{32: 2, 1: 1, 34: 1, 38: 1, 14: 3, 15: 1, 22: 1, 25: 3, 31: 1}
Did not match all atoms present	31353-92-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)CC5=CC=C(C=C5)NC6=CC(=C(C7=C6C(=O)C8=CC=CC=C8C7=O)N)S(=O)(=O)O)S(=O)(=O)O)N	{2: 1, 14: 18, 20: 2, 25: 4, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	31354-57-1	C1=CN=C(N=C1)NC=O	{26: 1, 35: 2, 14: 3, 31: 1}
Did not match all atoms present	31354-67-3	CCN(C)C1=CC2=C(C=C1C)OC3=CC(=[N+](CC)CCC#N)C=CC3=N2.CCN(C)C1=CC2=C(C=C1C)OC3=CC(=[N+](CC)CCC#N)C=CC3=N2.Cl[Zn-2](Cl)(Cl)Cl	{1: 8, 2: 8, 35: 2, 37: 2, 33: 4, 14: 10, 17: 4, 23: 2}
Did not match all atoms present	31366-00-4	CCC1=CC(=C(C(=C1)C)C)C	{1: 4, 2: 1, 14: 2}
Did not match all atoms present	31366-95-7	CCC(C)(C)C1=CC=C(C=C1)[O-].[Na+]	{1: 3, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	3137-54-0	C1=NC(=C(C(=N1)NN)[N+](=O)[O-])N	{38: 1, 35: 2, 30: 2, 14: 1, 31: 1}
Did not match all atoms present	3137-55-1	C1=NC(=O)C(=C(N1)NN)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	3137-56-2	C1=NC(=O)C(=C(N1)Cl)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 1, 17: 1, 25: 1}
Did not match all atoms present	3137-60-8	C1=NC(=O)C(=C(N1)Cl)N	{32: 1, 35: 1, 14: 1, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	3137-83-5	CC(=O)NC1=CC=CC(=C1)N=C=S	{1: 1, 34: 1, 8: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	3137-84-6	CCOC(=O)C1=CC(=CC=C1)N=C=S	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 28: 1}
Did not match all atoms present	31377-23-8	C1C2CC3CC1CC(C2)(C3)N.OS(=O)(=O)O	{11: 6, 12: 3, 13: 1, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	31378-03-7	CC1=CC=C(C=C1)S(=O)(=O)CC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 29: 2, 14: 9}
Did not match all atoms present	3138-42-9	CCCCCOP(=O)(O)OCCCCC	{1: 2, 2: 8, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	3138-86-1	C1=CC=C2C(=C1)N=C(C(=N2)CBr)CBr	{2: 2, 35: 2, 18: 2, 14: 4}
Did not match all atoms present	31385-05-4	CCCCC(CCN1CCCC1)(CN=CC(CCCC)(CCN2CCCC2)C3=CC=CC4=CC=CC=C43)C5=CC=CC6=CC=CC=C65	{1: 2, 2: 11, 4: 2, 6: 1, 33: 2, 11: 8, 34: 1, 14: 14}
Did not match all atoms present	31385-10-1	C1=C(C(=O)NC(=O)N1)NC(=O)C(Cl)Cl	{32: 2, 3: 1, 14: 1, 17: 2, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	3139-05-7	CC1=CC(=C(C=C1O)C)[N+](=O)[O-]	{1: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	3139-42-2	C1=CC=C(C=C1)/C=C\2/C(=O)C3=CC=CC=C3S2	{25: 1, 41: 1, 14: 9, 6: 1, 15: 1}
Did not match all atoms present	3139-99-9	COCC[O-].[Na+]	{1: 1, 2: 2, 29: 1, 22: 1}
Did not match all atoms present	31391-49-8	CC1=CC(=C(C(=C1)O)C)C(C)(C)C	{1: 5, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	31395-95-6	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Na+].[Au+3]	{}
Did not match all atoms present	31397-22-5	CN1C=CC=C1C=NNC(=S)NC2=CC=CC=C2	{1: 1, 34: 1, 6: 1, 33: 1, 7: 1, 14: 8, 31: 2}
Did not match all atoms present	314-04-5	C1=CC=C2C(=C1)C3=NC4=C(C=C(C=C4)F)C5=NC6=C(C=C(C=C6)F)C(=N2)N35	{16: 2, 33: 1, 35: 3, 14: 10}
Did not match all atoms present	314-08-9	C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C=CC5=C4C6=CC=CC=C6N5	{32: 1, 14: 14}
Did not match all atoms present	314-13-6	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C=CC4=C(C3=O)C(=C(C=C4S(=O)(=O)[O-])S(=O)(=O)[O-])N)C)N/N=C/5\C=CC6=C(C5=O)C(=C(C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 12, 15: 2, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	314-19-2	CN1CCC2=CC=CC3=C2[C@H]1CC4=C3C(=C(C=C4)O)O.Cl	{1: 1, 33: 1, 11: 3, 12: 1, 14: 5, 17: 1, 21: 2}
Did not match all atoms present	314-35-2	CCN(CC)CCN1C=NC2=C1C(=O)N(C(=O)N2C)C	{1: 4, 2: 4, 35: 1, 33: 4, 14: 1, 25: 2}
Did not match all atoms present	314-40-9	CCC(C)N1C(=O)C(=C(NC1=O)C)Br	{32: 1, 1: 3, 2: 1, 3: 1, 33: 1, 18: 1, 25: 2}
Did not match all atoms present	314-41-0	C1=C(C(=C(C(=C1F)F)F)[N+](=O)[O-])F	{16: 4, 38: 1, 14: 1}
Did not match all atoms present	314-42-1	CC1=C(C(=O)N(C(=O)N1)C(C)C)Br	{32: 1, 1: 3, 3: 1, 33: 1, 18: 1, 25: 2}
Did not match all atoms present	314-98-7	COC1=CC(=C(C(=C1)OC)C(=O)C(F)(F)F)OC	{1: 3, 4: 1, 14: 2, 16: 3, 22: 3, 24: 1}
Did not match all atoms present	3140-73-6	COC1=NC(=NC(=N1)Cl)OC	{1: 2, 35: 3, 22: 2, 17: 1}
Did not match all atoms present	3140-92-9	C1=C(SC=C1Br)Br	{41: 1, 18: 2, 14: 2}
Did not match all atoms present	3140-93-0	C1=CSC(=C1Br)Br	{41: 1, 18: 2, 14: 2}
Did not match all atoms present	31401-21-5	CCS(=O)OC	{1: 2, 2: 1, 29: 1, 22: 1}
Did not match all atoms present	31401-34-0	CCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCC	{1: 2, 2: 4, 34: 2, 22: 1, 14: 8}
Did not match all atoms present	31405-07-9	CC1=CC2=S(S1)SC(=C2Br)C	{1: 2, 18: 1, 41: 2, 14: 1, 15: 4}
Did not match all atoms present	314071-48-2	C(=C(/[O-])\C(F)(F)F)\C(=O)C(F)(F)F.C(=C(/[O-])\C(F)(F)F)\C(=O)C(F)(F)F.[Ba+2]	{16: 12, 24: 2, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	31409-15-1	CCNC(=S)NNC=O	{1: 1, 2: 1, 31: 3, 26: 1, 7: 1}
Did not match all atoms present	3141-12-6	CCO[As](OCC)OCC	{1: 3, 2: 3, 22: 3}
Did not match all atoms present	3141-24-0	C1=C(SC(=C1Br)Br)Br	{41: 1, 18: 3, 14: 1}
Did not match all atoms present	3141-25-1	C1=C(C(=C(S1)Br)Br)Br	{41: 1, 18: 3, 14: 1}
Did not match all atoms present	3141-26-2	C1=C(C(=CS1)Br)Br	{41: 1, 18: 2, 14: 2}
Did not match all atoms present	3141-27-3	C1=C(SC(=C1)Br)Br	{41: 1, 18: 2, 14: 2}
Did not match all atoms present	31411-71-9	C[Si](C)(C)OC(=C)C(=C)O[Si](C)(C)C	{1: 6, 5: 2, 22: 2, 7: 2}
Did not match all atoms present	31416-33-8	CCCC(=O)[O-].CCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 4}
Did not match all atoms present	31416-87-2	C1=CC(=CC(=C1)F)C(C[NH3+])O.[Br-]	{2: 1, 3: 1, 14: 4, 16: 1, 18: 1, 20: 1}
Did not match all atoms present	3142-42-5	CCCCCCCCCCCCC1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2	{1: 1, 2: 11, 35: 2, 33: 1, 14: 7, 21: 1}
Did not match all atoms present	3143-06-4	CCCOC(=O)C1=CC(=CC=C1)C(=O)OCCC	{1: 2, 2: 4, 28: 2, 14: 4}
Did not match all atoms present	3143-08-6	CCCOC(=O)C1=CC(=C(C=C1C(=O)OCCC)C(=O)OCCC)C(=O)OCCC	{1: 4, 2: 8, 28: 4, 14: 2}
Did not match all atoms present	31430-15-6	COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=C(C=C3)F	{32: 1, 1: 1, 35: 1, 14: 7, 16: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	31430-18-9	COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CS3	{32: 1, 1: 1, 35: 1, 41: 1, 14: 6, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	31431-13-7	C1CC(C1)C(=O)C2=CC=C(C=C2)F	{16: 1, 24: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	31431-19-3	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]	{24: 1, 38: 1, 30: 1, 14: 8}
Did not match all atoms present	31431-39-7	COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3	{32: 1, 1: 1, 35: 1, 14: 8, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	31431-43-3	COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3CC3	{32: 1, 1: 1, 35: 1, 11: 2, 12: 1, 14: 3, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	31432-46-9	N.[15N+](=O)(O)[O-]	{20: 1}
Did not match all atoms present	31432-48-1	[15NH3].[N+](=O)(O)[O-]	{20: 1}
Did not match all atoms present	3144-09-0	CS(=O)(=O)N	{1: 1, 29: 2, 30: 1}
Did not match all atoms present	3144-54-5	CCCCCC(=O)C1=C(C=C(C=C1)O)O	{24: 1, 1: 1, 2: 4, 21: 2, 14: 3}
Did not match all atoms present	3144-74-9	C[Si](C)CCl	{1: 2, 2: 1, 17: 1}
Did not match all atoms present	3145-76-4	CC1CC1C2=CC=CC=C2	{1: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	31462-59-6	C1=CN=CN=C1C(=O)O	{35: 2, 27: 1, 14: 3}
Did not match all atoms present	31469-15-5	C/C(=C(\O[Si](C)(C)C)/OC)/C	{1: 6, 22: 2, 7: 2}
Did not match all atoms present	31469-23-5	CC(C)(C)C=C(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 4: 1, 22: 2, 6: 1, 7: 1}
Did not match all atoms present	31469-83-7	C1=CC=C(C=C1)NC2=C(C(=C(C(=C2F)F)C#N)F)F	{16: 4, 37: 1, 14: 5, 31: 1}
Did not match all atoms present	3147-15-7	C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C(C(=C(C=C35)CN(CC(=O)O)CC(=O)O)O)CN(CC(=O)O)CC(=O)O	{33: 2, 2: 6, 13: 1, 14: 8, 21: 2, 23: 1, 27: 4, 28: 1}
Did not match all atoms present	3147-18-0	CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C=O)N2)N6)C=C)C)C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(=O)OC)C	{32: 2, 1: 10, 2: 13, 3: 3, 5: 1, 6: 2, 7: 1, 12: 3, 14: 3, 35: 2, 25: 1, 26: 1, 28: 2}
Did not match all atoms present	3147-39-5	COC(=O)C1=C(C=C(C=C1O)O)O	{1: 1, 28: 1, 21: 3, 14: 2}
Did not match all atoms present	3147-45-3	C1=CC(=C(C=C1O)O)C(=O)N	{24: 1, 30: 1, 21: 2, 14: 3}
Did not match all atoms present	3147-50-0	C1=CC(=C(C(=C1)O)C(=O)N)O	{24: 1, 30: 1, 21: 2, 14: 3}
Did not match all atoms present	3147-55-5	C1=C(C=C(C(=C1Br)O)C(=O)O)Br	{18: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	3147-62-4	C1=C(C=C(C=C1O)O)C(=O)N	{24: 1, 30: 1, 21: 2, 14: 3}
Did not match all atoms present	3147-76-0	CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2	{1: 3, 35: 2, 4: 1, 33: 1, 14: 7, 21: 1}
Did not match all atoms present	31473-75-3	C1=CC2=C3C(=C1)C4=CC=CC5=C4C6=C(C=C5)SC(=C36)C=C2	{41: 1, 14: 10}
Did not match all atoms present	31477-60-8	CC1([C@H]([C@@H](C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCCN4CCCC4)C5=CC=CC=C5)C	{1: 3, 2: 2, 33: 1, 11: 4, 12: 2, 13: 1, 14: 12, 22: 2, 23: 1}
Did not match all atoms present	31479-14-8	[NH3+][NH3+]	{}
Did not match all atoms present	31479-19-3	F[Pu](F)(F)(F)F	{16: 5}
Did not match all atoms present	31480-93-0	CC(=C)C(=O)OC1=CC=C(C=C1)O	{1: 1, 5: 1, 7: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	31488-71-8	CN1C(=C)N(C2=CC=CC=C21)C	{1: 2, 33: 2, 5: 1, 14: 4, 15: 1}
Did not match all atoms present	3149-28-8	COC1=NC=CN=C1	{1: 1, 35: 2, 22: 1, 14: 3}
Did not match all atoms present	315-12-8	CC1=CC(=CC(=C1[N+](=O)[O-])C)F	{16: 1, 1: 2, 38: 1, 14: 2}
Did not match all atoms present	315-14-0	C1=C(C=C(C(=C1F)[N+](=O)[O-])F)F	{16: 3, 38: 1, 14: 2}
Did not match all atoms present	315-18-4	CC1=CC(=CC(=C1N(C)C)C)OC(=O)NC	{1: 5, 28: 1, 33: 1, 14: 2, 31: 1}
Did not match all atoms present	315-30-0	C1=C2C(=NC=NC2=O)NN1	{32: 2, 25: 1, 35: 2, 14: 2}
Did not match all atoms present	315-72-0	C1CN(CCN1CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42)CCO	{33: 3, 2: 5, 11: 4, 20: 1, 14: 10}
Did not match all atoms present	3150-24-1	C1=CC(=CC=C1[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O	{2: 1, 38: 1, 12: 5, 14: 4, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	3150-82-1	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl	{17: 1, 34: 2, 38: 1, 14: 12, 31: 1}
Did not match all atoms present	31501-01-6	CC(=O)OCCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C3=CC=CC=C3	{1: 2, 2: 4, 38: 1, 33: 1, 34: 2, 14: 11, 17: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	31508-00-6	C1=CC(=C(C=C1C2=CC(=C(C=C2Cl)Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	3151-39-1	CCCCC(CC)COP(=O)(C1=CC=CC=C1)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 14: 5, 22: 2, 29: 1}
Did not match all atoms present	3151-41-5	C1=CC=C(C=C1)C[Sn](CC2=CC=CC=C2)(CC3=CC=CC=C3)Cl	{17: 1, 2: 3, 14: 15}
Did not match all atoms present	31516-55-9	CC(CC(C)(C)C1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 2: 1, 3: 1, 4: 1, 14: 10}
Did not match all atoms present	31519-22-9	C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)O)O	{27: 1, 21: 2, 14: 5}
Did not match all atoms present	3152-41-8	CCOP(=S)(OCC)SCSC1=CC(=C(C=C1)Cl)Cl	{1: 2, 2: 3, 40: 2, 14: 3, 17: 2, 22: 2}
Did not match all atoms present	3152-68-9	CCC(=O)C=CC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	31521-55-8	CC1=CC=C(C=C1)S(=O)(=O)O.CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=C1C3=CC=CC=C3)/C=C/C4N(C5=[NH+]C6=CC=CC=C6N=C5N4CC=C)CC=C	{32: 1, 1: 2, 2: 2, 35: 1, 5: 2, 6: 4, 33: 3, 12: 1, 14: 16, 20: 1, 38: 1, 29: 2}
Did not match all atoms present	31529-29-0	C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CCCC(=O)O	{32: 1, 2: 3, 27: 2, 14: 4}
Did not match all atoms present	3153-26-2	C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.O=[V]	{1: 4, 6: 2, 7: 2, 20: 2, 24: 2, 29: 1}
Did not match all atoms present	3153-44-4	COC1=CC=C(C=C1)C(=O)CCC(=O)O	{1: 1, 2: 2, 14: 4, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	31540-62-2	C1C[NH+](CC2=C1NC3=C2C=C(C=C3)F)CCCC(=O)C4=CC=C(C=C4)F.[Cl-]	{32: 1, 2: 3, 11: 3, 14: 7, 16: 2, 17: 1, 24: 1}
Did not match all atoms present	31541-02-3	C1=CC=C2C(=C1)C=C3C4=CC=CC=C4C5=CC6=CC=CC=C6C7=C5C3=C2C8=CC=CC=C87	{14: 18}
Did not match all atoms present	31541-03-4	C1=CC=C2C=C3C(=CC2=C1)C4=CC5=CC=CC=C5C6=C4C7=C(C=C6)C8=CC=CC=C8C=C37	{14: 18}
Did not match all atoms present	31541-07-8	C1=CC=C2C=C3C(=CC2=C1)C4=C5C(=CC6=CC=CC=C64)C=CC7=CC8=CC=CC=C8C3=C75	{14: 18}
Did not match all atoms present	31541-10-3	C1=CC=C2C=C3C(=CC2=C1)C4=C5C(=CC6=CC=CC=C64)C7=CC=CC=C7C8=CC9=CC=CC=C9C3=C85	{14: 20}
Did not match all atoms present	31543-75-6	CC1=C(C=C(C=C1)Br)Br	{1: 1, 18: 2, 14: 3}
Did not match all atoms present	3155-16-6	C1=CC=C(C=C1)OC(=O)C(=O)OC2=CC=CC=C2	{28: 2, 14: 10}
Did not match all atoms present	3155-89-3	CCCC[NH2+]C1CCCC2=CC3=CC=CC=C3N=C12.[Cl-]	{1: 1, 2: 3, 35: 1, 11: 3, 12: 1, 14: 5, 17: 1}
Did not match all atoms present	31551-45-8	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=C2C=CC(=C3)[N+](=O)[O-]	{25: 1, 38: 2, 14: 6}
Did not match all atoms present	31554-48-0	C1C=C(CS1(=O)=O)CBr	{2: 1, 11: 2, 14: 1, 15: 1, 18: 1, 29: 2}
Did not match all atoms present	31556-40-8	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC3=C(C4=C(C(=C3)O)C(=O)C5=CC=CC=C5C4=O)N	{1: 2, 4: 1, 14: 14, 21: 1, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	31558-46-0	COC1=CC=C(C=C1)COC(=O)OC2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	31559-43-0	C1=CC=C(C=C1)C#CC2(C3=CC=CC=C3C(C4=CC5=CC=CC=C5C=C42)(C#CC6=CC=CC=C6)O)O	{10: 4, 20: 2, 13: 2, 14: 20}
Did not match all atoms present	3156-41-0	C1=CC(=CC=C1C=C[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 4, 6: 2}
Did not match all atoms present	31563-86-7	CP1(=O)CCC=C1	{1: 1, 11: 2, 29: 1, 14: 2}
Did not match all atoms present	31571-52-5	C12=NNNC1=NC(=S)NC2=O	{32: 3, 25: 1, 35: 2}
Did not match all atoms present	31574-44-4	CC1=CC(=C(C=C1)OC)C(C)C	{1: 4, 3: 1, 22: 1, 14: 3}
Did not match all atoms present	31575-35-6	C1=CN=C(N=C1)F	{16: 1, 35: 2, 14: 3}
Did not match all atoms present	3158-56-3	CCCCCCCCCCCCCCCC1=CC(=CC(=C1)O)O	{1: 1, 2: 14, 21: 2, 14: 3}
Did not match all atoms present	31580-45-7	CC1=CSC(=CC=CC2=[N+](C3=C(O2)C=C(C=C3)Cl)C)N1CC4=CC=CC=C4.[I-]	{1: 2, 2: 1, 6: 3, 33: 2, 41: 1, 14: 9, 15: 2, 17: 1, 19: 1, 23: 1}
Did not match all atoms present	31581-09-6	CC1=C(C(=CC=C1)N2C(=O)C=CC2=O)C	{1: 2, 33: 1, 14: 5, 25: 2}
Did not match all atoms present	3159-62-4	CCCCCCC(CCCCCCCCCCC(=O)[O-])O.CCCCCCC(CCCCCCCCCCC(=O)[O-])O.[Ca+2]	{24: 2, 1: 2, 2: 30, 3: 2, 20: 2}
Did not match all atoms present	31599-32-3	COC1=C(C=C(C=C1)C(=O)N)[N+]#N	{1: 1, 34: 1, 14: 3, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	31599-60-7	CC1=C(C(=CC=C1)I)C	{1: 2, 19: 1, 14: 3}
Did not match all atoms present	31599-61-8	CC1=C(C=C(C=C1)I)C	{1: 2, 19: 1, 14: 3}
Did not match all atoms present	316-14-3	CC1=CC2=CC=CC=C2C3=CC4=CC=CC=C4C=C13	{1: 1, 14: 11}
Did not match all atoms present	316-41-6	COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[O-]S(=O)(=O)[O-]	{1: 4, 33: 2, 11: 6, 14: 12, 22: 4, 23: 4, 29: 4}
Did not match all atoms present	316-42-7	CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1C[C@@H]4C5=CC(=C(C=C5CCN4)OC)OC)OC)OC.Cl.Cl	{32: 1, 1: 5, 2: 2, 33: 1, 11: 6, 12: 4, 14: 4, 17: 2, 22: 4}
Did not match all atoms present	316-46-1	C1=C(C(=O)NC(=O)N1C2C(C(C(O2)CO)O)O)F	{32: 1, 33: 1, 2: 1, 12: 4, 14: 1, 16: 1, 20: 3, 23: 1, 25: 2}
Did not match all atoms present	316-49-4	CC1=CC=CC2=C1C=CC3=CC4=CC=CC=C4C=C32	{1: 1, 14: 11}
Did not match all atoms present	316-51-8	CC1=CC2=C(C=C1)C3=CC4=C(C=C(C=C4)C)C=C3C=C2	{1: 2, 14: 10}
Did not match all atoms present	316-68-7	CC(=O)C1=CC=C(C2=CC=CC=C21)F	{16: 1, 1: 1, 14: 6, 24: 1}
Did not match all atoms present	316-81-4	CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C	{1: 3, 2: 3, 33: 4, 41: 1, 11: 4, 14: 7, 29: 2}
Did not match all atoms present	3160-32-5	CC(C)C(=O)/C=C/C1=CC=CC=C1	{24: 1, 1: 2, 3: 1, 14: 5, 6: 2}
Did not match all atoms present	3160-35-8	CC(=O)C=CC1=CC=C(C=C1)O	{24: 1, 1: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	3160-37-0	CC(=O)C=CC1=CC2=C(C=C1)OCO2	{1: 1, 6: 2, 11: 1, 14: 3, 23: 2, 24: 1}
Did not match all atoms present	3160-38-1	CC1=CC=C(C=C1)C=CC(=O)C	{24: 1, 1: 2, 14: 4, 6: 2}
Did not match all atoms present	3160-40-5	CC(=O)C=CC1=CC=C(C=C1)Cl	{24: 1, 1: 1, 14: 4, 6: 2, 17: 1}
Did not match all atoms present	3160-59-6	CC[C@H](C)[C@@H](C(=O)O)NC(=O)OCC1=CC=CC=C1	{1: 2, 2: 2, 3: 2, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	31600-99-4	CC(C)(C)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N	{1: 3, 34: 1, 4: 1, 14: 9, 22: 1, 29: 2}
Did not match all atoms present	31601-41-9	CC1=C(C=CC(=C1)OC)NC(=O)C	{24: 1, 1: 3, 22: 1, 14: 3, 31: 1}
Did not match all atoms present	31608-60-3	C[Ge](C)(C)C1=CC=CC2=CC=CC=C21	{1: 3, 14: 7}
Did not match all atoms present	31608-80-7	C[Si](C)C.C[Ge](C)C	{1: 6}
Did not match all atoms present	3161-59-9	CN(C)C1=C(C=C(C(=C1)Cl)[N+]#N)OC2=CC=C(C=C2)Cl.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 1, 33: 1, 14: 6, 17: 5, 22: 1}
Did not match all atoms present	31611-84-4	C1=CC=C(C=C1)C(C(C(C(C(=O)C2=CC=CC=C2)Br)Br)Br)Br	{24: 1, 18: 4, 3: 4, 14: 10}
Did not match all atoms present	31612-53-0	CC1(C2=CC=CC=C2[N+](=C1/C=C/N3CCC(=N3)C4=CC=CC=C4)C)C.[Cl-]	{1: 3, 35: 1, 6: 2, 33: 2, 11: 2, 13: 1, 14: 9, 15: 2, 17: 1}
Did not match all atoms present	3162-29-6	CC(=O)C1=CC2=C(C=C1)OCO2	{24: 1, 1: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	3162-96-7	COC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)O)O	{1: 1, 11: 1, 12: 6, 14: 5, 20: 2, 22: 1, 23: 3}
Did not match all atoms present	31620-87-8	C1=CC=C(C=C1)NC(=O)C(Cl)Cl	{24: 1, 17: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	3163-27-7	C1=CC=C2C(=C1)C=CC=C2CBr	{2: 1, 18: 1, 14: 7}
Did not match all atoms present	31636-06-3	CCOP(=O)([O-])OCC.CCOP(=O)([O-])OCC.CCOP(=O)([O-])OCC.[Cr+3]	{1: 6, 2: 6, 29: 6, 22: 6}
Did not match all atoms present	31639-80-2	C[Si](C)(C)N1C=CN(C=C1)[Si](C)(C)C	{1: 6, 14: 4, 33: 2}
Did not match all atoms present	3164-29-2	C(C(C(=O)[O-])O)(C(=O)[O-])O.[NH4+].[NH4+]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	3164-34-9	C(C(C(=O)[O-])O)(C(=O)[O-])O.[Ca+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	3164-55-4	CCCCCCCCOP(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 7, 22: 3, 14: 10}
Did not match all atoms present	31642-65-6	CC1=CC=CC=C1C(C2=CC=CC=C2)OC3CC4CCC(C3)N4C.Br	{1: 2, 3: 1, 33: 1, 11: 4, 12: 3, 14: 9, 18: 1, 22: 1}
Did not match all atoms present	31643-49-9	C1=CC(=C(C=C1[N+](=O)[O-])C#N)C#N	{38: 1, 37: 2, 14: 3}
Did not match all atoms present	31644-71-0	C1=CC=C(C=C1)C(C(Cl)(Cl)Cl)OC(=O)C2=CC=CC=C2	{17: 3, 3: 1, 4: 1, 14: 10, 28: 1}
Did not match all atoms present	31645-12-2	C1C(=O)NC(=S)[N-]C1=O.[Na+]	{32: 1, 25: 2, 11: 1, 35: 1, 15: 1}
Did not match all atoms present	31647-36-6	CC1=CC2=CC=CC3=C2C4=C(C=C3)C5=CC=CC=C5C=C14	{1: 1, 14: 11}
Did not match all atoms present	3165-93-3	CC1=C(C=CC(=C1)Cl)N.Cl	{1: 1, 30: 1, 14: 3, 17: 2}
Did not match all atoms present	31656-92-5	CC1=CC=CC=C1N=[N+]=[N-]	{1: 1, 34: 2, 14: 4}
Did not match all atoms present	31657-37-1	CCCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 9, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	3166-00-5	C1=CC=C(C=C1)C(=O)N=C(N)N	{24: 1, 34: 1, 30: 2, 14: 5, 7: 1}
Did not match all atoms present	3167-49-5	C1=CC(=NC=C1C(=O)O)N	{35: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	3167-63-3	CCOP(=O)(CCl)OCC	{1: 2, 2: 3, 29: 1, 22: 2, 17: 1}
Did not match all atoms present	3167-69-9	CCN(CC)P(=O)(OCC)OCC	{1: 4, 2: 4, 29: 1, 22: 2, 33: 1}
Did not match all atoms present	31677-93-7	CC(C(=O)C1=CC(=CC=C1)Cl)NC(C)(C)C.Cl	{1: 4, 3: 1, 4: 1, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	31680-07-6	CC1=C(C=C(C=C1)C=O)[N+](=O)[O-]	{1: 1, 26: 1, 38: 1, 14: 3}
Did not match all atoms present	31681-13-7	CC(=C)C(=O)OCC[N+](C)(C)CCC[Si](OC)(OC)OC.[Cl-]	{1: 6, 2: 5, 5: 1, 7: 1, 17: 1, 22: 3, 28: 1}
Did not match all atoms present	31681-98-8	C1=CC=C2C=C(C=CC2=C1)OP(=O)(O)[O-].[Na+].[Na+]	{20: 1, 22: 1, 14: 7, 29: 2}
Did not match all atoms present	31698-14-3	C1=CN2[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)OC2=NC1=N	{33: 1, 2: 1, 35: 1, 36: 1, 12: 4, 14: 2, 20: 2, 23: 2}
Did not match all atoms present	31699-72-6	C1=CC=C2C(=C1)C(=CN2)CCCCC[NH3+].C(CCC(=O)[O-])CC(=O)O	{24: 1, 32: 1, 2: 9, 27: 1, 14: 5}
Did not match all atoms present	317-34-0	CN1C2=C(C(=O)N(C1=O)C)NC=N2.CN1C2=C(C(=O)N(C1=O)C)NC=N2.C(CN)N	{32: 2, 1: 4, 2: 2, 35: 2, 33: 4, 14: 2, 25: 4, 30: 2}
Did not match all atoms present	317-52-2	C[N+](C)(CCCCCC[N+](C)(C)C1C2=CC=CC=C2C3=CC=CC=C13)C4C5=CC=CC=C5C6=CC=CC=C46.[Br-].[Br-]	{1: 4, 2: 6, 12: 2, 18: 2, 14: 16}
Did not match all atoms present	317-64-6	CC1=CC=CC2=CC3=C(C=C12)C(=CC4=CC=CC=C43)C	{1: 2, 14: 10}
Did not match all atoms present	317-83-9	C1CCC(CC1)C2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-].C1CCC(CC1)NC2CCCCC2	{38: 2, 11: 15, 12: 3, 14: 2, 21: 1, 31: 1}
Did not match all atoms present	317-97-5	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2=NC4=CC=C(C=C4)F	{1: 1, 34: 1, 14: 11, 15: 1, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	3170-69-2	C[C]=O	{1: 1, 29: 1}
Did not match all atoms present	31701-42-5	C1=CC=C2C(=C1)NN(N2)C3=CC(=O)C=CC3=O	{32: 2, 25: 2, 33: 1, 14: 7, 15: 1}
Did not match all atoms present	31703-08-9	CCC1=CN(C(=O)N(C1=O)C)C	{1: 3, 2: 1, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	31704-09-3	C[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)SC	{40: 1, 1: 10, 4: 1}
Did not match all atoms present	31706-95-3	COC1=C(C=C(C=C1)C(C=C)O)OC	{1: 2, 3: 1, 5: 1, 6: 1, 14: 3, 20: 1, 22: 2}
Did not match all atoms present	3171-45-7	CC1=CC(=C(C=C1C)N)N	{1: 2, 30: 2, 14: 2}
Did not match all atoms present	31715-42-1	CCC(C)NC1=C2C(=C(C=C1)N)C(=O)C3=C(C=CC(=C3C2=O)O)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1, 14: 4, 21: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	31719-77-4	C1=CC(=CC(=C1)CCl)C(=O)O	{17: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	3172-33-6	C1=CC=C(C=C1)C2=CC=C(C=C2)[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=C(C=C5)C6=CC=CC=C6	{14: 28}
Did not match all atoms present	3172-34-7	C1=CC=C(C=C1)C2=CC=C(C=C2)[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5	{14: 24}
Did not match all atoms present	3172-42-7	C1=CC=C(C(=C1)N/C=C/2\C=CC=CC2=O)Cl	{6: 1, 14: 8, 15: 1, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	3172-52-9	C1=C(SC(=C1)Cl)Cl	{17: 2, 14: 2, 41: 1}
Did not match all atoms present	3172-56-3	C1=CSC=C1C2=CSC=C2	{41: 2, 14: 6}
Did not match all atoms present	31729-66-5	C1CC1(CO)C2=CC=CC=C2	{2: 1, 11: 2, 20: 1, 13: 1, 14: 5}
Did not match all atoms present	3173-56-6	C1=CC=C(C=C1)CN=C=O	{8: 1, 2: 1, 34: 1, 29: 1, 14: 5}
Did not match all atoms present	3173-72-6	C1=CC2=C(C=CC=C2N=C=O)C(=C1)N=C=O	{8: 2, 34: 2, 29: 2, 14: 6}
Did not match all atoms present	31732-40-8	B1(NB(N(N1C)C)C)C	{32: 1, 1: 4, 33: 2}
Did not match all atoms present	31732-41-9	B1(N(B(N(N1C)C)C)C)C	{1: 5, 33: 3}
Did not match all atoms present	31732-71-5	CCCC[Sn](CCCC)(CCCC)OC(=O)C(C(C(=O)O[Sn](CCCC)(CCCC)CCCC)Br)Br	{1: 6, 2: 18, 3: 2, 28: 2, 18: 2}
Did not match all atoms present	31736-73-9	C1=CC(=CC=C1C(=O)CCCl)Br	{24: 1, 17: 1, 2: 2, 18: 1, 14: 4}
Did not match all atoms present	31737-09-4	CN1C(=CC(=O)NC1=O)Cl	{32: 1, 1: 1, 33: 1, 14: 1, 17: 1, 25: 2}
Did not match all atoms present	3174-30-9	C1=CC=C2C(=C1)NC(=N2)C(Cl)Cl.Cl	{32: 1, 17: 3, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	3174-48-9	CC1=CC=C(C=C1)[O]	{1: 1, 14: 4}
Did not match all atoms present	3174-49-0	CC1=CC=CC=C1[O]	{1: 1, 14: 4}
Did not match all atoms present	31741-94-3	C[Si](C)(C)[C-]1[CH-][CH-][CH-][CH-][CH-]1.C[Si](C)(C)C1=CC=CC=C1.[Cr]	{1: 6, 14: 10, 15: 1}
Did not match all atoms present	31750-48-8	CC/C(=C(/C1=CC=CC=C1)\C2=CC=C(C=C2)OCCNC)/C3=CC=CC=C3	{1: 2, 2: 3, 7: 2, 14: 14, 22: 1, 31: 1}
Did not match all atoms present	31751-59-4	C[Si]1(O[Si](O[Si](O1)(C)C2=CC=CC=C2)(C)C3=CC=CC=C3)C	{1: 4, 14: 10, 23: 3}
Did not match all atoms present	31752-99-5	C1[C@H]2[C@H](CC(=O)O2)[C@H]([C@@H]1OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CO	{2: 1, 11: 2, 12: 4, 14: 9, 20: 1, 28: 2}
Did not match all atoms present	3176-03-2	CN1CC[C@]23C[C@@H](CC[C@]2([C@H]1CC4=C3C(=C(C=C4)OC)OC)O)O	{1: 3, 33: 1, 11: 6, 12: 2, 13: 2, 14: 2, 20: 2, 22: 2}
Did not match all atoms present	3176-62-3	CC1=C2C=CC=CC2=NN1	{32: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	3176-77-0	CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 41: 1, 14: 6, 29: 3}
Did not match all atoms present	3177-13-7	C1=CC=C2C(=C1)C(=CC=C2N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])[N+](=O)[O-])NCCO	{2: 2, 38: 2, 34: 2, 14: 8, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	3177-22-8	C1=CC(=C(C=C1N)N)S(=O)(=O)[O-].[Na+]	{30: 2, 29: 3, 14: 3}
Did not match all atoms present	31774-90-0	CC[N+](CCO)(CCO)CCO.CCOS(=O)(=O)[O-]	{1: 2, 2: 8, 20: 3, 29: 3, 22: 1}
Did not match all atoms present	31775-20-9	CCOC1=CC=C(C=C1)NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=C(C=C4)OCC)Cl)Cl	{1: 4, 2: 2, 3: 2, 34: 4, 14: 14, 17: 2, 22: 2, 24: 4, 31: 2}
Did not match all atoms present	3178-03-8	COC1=C(C=CC2=CC=CC=C21)N	{1: 1, 30: 1, 22: 1, 14: 6}
Did not match all atoms present	3178-78-7	C1=CC(=CC(=C1)S(=O)(=O)N)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)N	{14: 8, 21: 2, 25: 2, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	31785-60-1	C1=CC=C2C(=C1)C=CC=C2C3NC4=CC=CC=C4C(=O)N3	{32: 2, 25: 1, 12: 1, 14: 11}
Did not match all atoms present	3179-09-7	COC1=CC=CC(=C1)/C=C/[N+](=O)[O-]	{1: 1, 22: 1, 38: 1, 14: 4, 6: 2}
Did not match all atoms present	3179-10-0	COC1=CC=C(C=C1)/C=C/[N+](=O)[O-]	{1: 1, 22: 1, 38: 1, 14: 4, 6: 2}
Did not match all atoms present	3179-31-5	C1=NC(=S)NN1	{32: 2, 35: 1, 14: 1}
Did not match all atoms present	3179-56-4	CC(=O)OOS(=O)(=O)C1CCCCC1	{1: 1, 11: 5, 12: 1, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	3179-76-8	CCO[Si](C)(CCCN)OCC	{1: 3, 2: 5, 30: 1, 22: 2}
Did not match all atoms present	3179-89-3	CC1=C(C=C(C=C1)N(CCO)CCO)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 4, 38: 1, 33: 1, 34: 2, 14: 7, 20: 2}
Did not match all atoms present	3179-90-6	C1=CC(=C2C(=C1NCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCO	{2: 4, 14: 4, 20: 2, 21: 2, 25: 2, 31: 2}
Did not match all atoms present	3179-96-2	CNC1=C2C(=C(C=C1)NC3=CC=CC=C3)C(=O)C4=CC=CC=C4C2=O	{1: 1, 31: 2, 14: 11, 25: 2}
Did not match all atoms present	31791-37-4	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Ta+5].[Ta+5]	{24: 10}
Did not match all atoms present	31793-07-4	CC(C1=CC(=C(C=C1)N2CC=CC2)Cl)C(=O)O	{1: 1, 3: 1, 33: 1, 11: 2, 14: 5, 17: 1, 27: 1}
Did not match all atoms present	31793-29-0	C1=C(C(=C(C=N1)[N+](=O)[O-])N)[N+](=O)[O-]	{38: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	31794-92-0	F[Al-2](F)(F)(F)F.[Sr+2]	{16: 5}
Did not match all atoms present	31795-44-5	C1=C(OC(=C1)S(=O)(=O)[O-])C=O.[Na+]	{26: 1, 29: 3, 14: 2, 23: 1}
Did not match all atoms present	318-03-6	C1=CC=C2C(=C1)C=CC3=C2NC4=C3C=NC=C4	{32: 1, 35: 1, 14: 9}
Did not match all atoms present	318-22-9	C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)NC(=O)C(F)(F)F	{4: 1, 14: 7, 16: 3, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	318-23-0	CCN(CC)CCN1C(=NOC1=N)C2=CC=CC=C2	{1: 2, 2: 4, 35: 1, 36: 1, 33: 2, 14: 5, 23: 1}
Did not match all atoms present	318-98-9	CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O.Cl	{1: 2, 2: 2, 3: 2, 14: 7, 17: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	3180-81-2	CCN(CCO)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 2: 3, 38: 1, 33: 1, 34: 2, 14: 7, 17: 1, 20: 1}
Did not match all atoms present	31805-48-8	CCC1=C(C=CS1)C	{1: 2, 2: 1, 14: 2, 41: 1}
Did not match all atoms present	3181-86-0	CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C)S(=O)(=O)O	{1: 2, 35: 2, 41: 1, 14: 7, 20: 1, 29: 2}
Did not match all atoms present	31817-29-5	CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCC(CC4)OC	{1: 2, 2: 3, 33: 2, 41: 1, 11: 4, 12: 1, 14: 7, 22: 1, 24: 1}
Did not match all atoms present	31818-94-7	CCN1N=C(N=N1)C2=CC=CC=C2	{1: 1, 2: 1, 35: 3, 14: 5, 33: 1}
Did not match all atoms present	3182-02-3	C1C(=NN(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl)NC3=C(C=C(C=C3)Cl)Cl	{33: 1, 35: 1, 11: 1, 14: 5, 15: 1, 17: 5, 25: 1, 31: 1}
Did not match all atoms present	3182-95-4	C1=CC=C(C=C1)C[C@@H](CO)N	{2: 2, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	31820-78-7	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=CC=C(C5=CC=CC=C54)N=NC6=CC=CC=C6)C=CC=C3S(=O)(=O)[O-].[Na+]	{34: 4, 29: 3, 14: 21, 31: 1}
Did not match all atoms present	31820-90-3	C1CCC(CC1)C2=CC=C(C=C2)NC3=C4C(=C(C=C3)O)C(=O)C5=CC=CC=C5C4=O	{11: 5, 12: 1, 14: 10, 21: 1, 25: 2, 31: 1}
Did not match all atoms present	31828-71-4	CC1=C(C(=CC=C1)C)OCC(C)N	{1: 3, 2: 1, 3: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	31832-27-6	C1=CC(=C2C=C(C3=C(C2=C1O)N=C4C=C(C5=CC(=CC(=O)C5=C4N3)Br)Br)Br)Br	{32: 1, 35: 1, 14: 6, 18: 4, 21: 1, 25: 1}
Did not match all atoms present	31835-45-7	C1=CC=C(C(=C1)C2=CC(=CC=C2)O)O	{21: 2, 14: 8}
Did not match all atoms present	3184-65-4	C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)[O-].[Na+]	{17: 1, 2: 1, 14: 8}
Did not match all atoms present	31841-41-5	C[N+](CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCO)CCO.[I-]	{1: 1, 2: 6, 4: 8, 16: 17, 19: 1, 20: 2}
Did not match all atoms present	31842-01-0	CC(C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O)C(=O)O	{1: 1, 3: 1, 33: 1, 11: 1, 14: 8, 25: 1, 27: 1}
Did not match all atoms present	31848-01-8	COC1=CC(=CC(=C1OCCN2CCOCC2)OC)C(=O)C3=CC=C(C=C3)Cl	{1: 2, 2: 2, 33: 1, 11: 4, 14: 6, 17: 1, 22: 3, 23: 1, 24: 1}
Did not match all atoms present	3185-99-7	CC1=CC=C(C=C1)S(=O)(=O)C	{1: 2, 29: 2, 14: 4}
Did not match all atoms present	31857-42-8	C1=CN=CC2=C3C=NC=CC3=C21	{35: 2, 14: 6}
Did not match all atoms present	31865-49-3	C1CCC(CC1)[Si]23OCCN(CCO2)CCO3	{33: 1, 11: 11, 12: 1, 23: 3}
Did not match all atoms present	31868-18-5	CC1COC2(N1CC(=O)NC3=C2C=C(C=C3)Cl)C4=CC=CC=C4Cl	{32: 1, 1: 1, 33: 1, 11: 2, 12: 1, 13: 1, 14: 7, 17: 2, 23: 1, 25: 1}
Did not match all atoms present	3187-19-7	COC1=CC(=C(C(=C1)OC)C(=O)O)O	{1: 2, 22: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	3187-58-4	CC1=CC(=CC(=C1C(=O)OC)O)O	{1: 2, 28: 1, 21: 2, 14: 2}
Did not match all atoms present	3187-94-8	C1=COC(=C1)Cl	{17: 1, 14: 3, 23: 1}
Did not match all atoms present	31874-15-4	C1C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=CC=C4)O	{33: 1, 11: 1, 20: 1, 14: 12}
Did not match all atoms present	31876-38-7	C1=C(C(=O)C1=O)O	{25: 2, 21: 1, 14: 1}
Did not match all atoms present	31879-05-7	CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)O	{27: 1, 1: 1, 3: 1, 22: 1, 14: 9}
Did not match all atoms present	3188-83-8	CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC(=C(C=C3)OCC4CO4)CO	{1: 2, 2: 3, 4: 1, 11: 2, 12: 2, 14: 7, 20: 1, 22: 2, 23: 2}
Did not match all atoms present	31881-09-1	CC1=CC=CC=C1/C(=C/C2=CC=CC=C2Cl)/C#N	{1: 1, 37: 1, 6: 1, 7: 1, 14: 8, 17: 1}
Did not match all atoms present	31881-10-4	CC1=CC=CC=C1/C(=C/C2=CC(=CC=C2)Cl)/C#N	{1: 1, 37: 1, 6: 1, 7: 1, 14: 8, 17: 1}
Did not match all atoms present	31881-12-6	CC1=CC=CC=C1/C(=C/C2=CC=CC=C2[N+](=O)[O-])/C#N	{1: 1, 37: 1, 38: 1, 7: 1, 14: 8, 6: 1}
Did not match all atoms present	31881-13-7	CC1=CC=CC=C1/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C#N	{1: 1, 37: 1, 38: 1, 7: 1, 14: 8, 6: 1}
Did not match all atoms present	31881-14-8	CC1=CC=CC=C1/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C#N	{1: 1, 37: 1, 38: 1, 7: 1, 14: 8, 6: 1}
Did not match all atoms present	31881-17-1	CC1=CC(=C(C=C1)C)/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C#N	{1: 2, 37: 1, 38: 1, 7: 1, 14: 7, 6: 1}
Did not match all atoms present	31883-01-9	CCC1=C(N=CS1)C	{1: 2, 2: 1, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	3189-12-6	CC1=CC2=C(C=C1)NC=C2C	{32: 1, 1: 2, 14: 4}
Did not match all atoms present	3189-13-7	COC1=CC2=C(C=C1)C=CN2	{32: 1, 1: 1, 22: 1, 14: 5}
Did not match all atoms present	3189-22-8	COC1=CC=CC2=C1NC=C2	{32: 1, 1: 1, 22: 1, 14: 5}
Did not match all atoms present	319-03-9	C1=CC2=C(C=C1F)C(=O)OC2=O	{16: 1, 28: 2, 14: 3}
Did not match all atoms present	319-23-3	C1=CC=C2C=C3C=C4C=C5C(=CC4=CC3=CC2=C1)C6=CC=CC=C6N5	{32: 1, 14: 14}
Did not match all atoms present	319-88-0	C1(=C(C(=C(C(=C1Cl)F)Cl)F)Cl)F	{16: 3, 17: 3}
Did not match all atoms present	31904-18-4	C1=CC(=C(C(=C1)Cl)Cl)C(Cl)(Cl)Cl	{17: 5, 4: 1, 14: 3}
Did not match all atoms present	31904-79-7	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.Cl[Ni]	{17: 1, 14: 20}
Did not match all atoms present	31909-58-7	C1=COC(=C1)C(=O)CC#N	{24: 1, 2: 1, 37: 1, 14: 3, 23: 1}
Did not match all atoms present	31927-64-7	CC1=C2C=CC3=C4C2=C5C(=CC4=CC=C3)C=CC6=C5C1=CC=C6	{1: 1, 14: 11}
Did not match all atoms present	31938-07-5	C1=CC(=CC(=C1)Br)CC#N	{2: 1, 18: 1, 14: 4, 37: 1}
Did not match all atoms present	3194-15-8	CCC(=O)C1=CC=CO1	{24: 1, 1: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	31943-70-1	C=CC1=CC2=C(C=C1)OCCOCCOCCOCCO2	{14: 3, 11: 8, 5: 1, 6: 1, 23: 5}
Did not match all atoms present	31944-64-6	CCCCCCCCCC(=O)NC(C)C(=O)NC(CC1=CN=CN1)C(=O)OC	{32: 1, 1: 3, 2: 9, 3: 2, 14: 2, 35: 1, 24: 2, 28: 1, 31: 2}
Did not match all atoms present	31949-21-0	COC1=CC=CC=C1C(=O)CBr	{1: 1, 2: 1, 14: 4, 18: 1, 22: 1, 24: 1}
Did not match all atoms present	3195-37-7	C1=CC=C(C=C1)OC(=O)CCCCC(=O)OC2=CC=CC=C2	{2: 4, 28: 2, 14: 10}
Did not match all atoms present	31951-84-5	CC1(COP(=S)(OC1)OC2=CC=CC=C2)C	{1: 2, 11: 2, 13: 1, 14: 5, 22: 1, 23: 2}
Did not match all atoms present	31959-87-2	C/C(=N\N=C(N)N)/C=N/N=C(N)N.O.O.Cl.Cl	{1: 1, 34: 4, 6: 1, 7: 3, 17: 2, 30: 4}
Did not match all atoms present	3196-56-3	CC12COP(=S)(OC1)OC2	{1: 1, 11: 3, 13: 1, 23: 3}
Did not match all atoms present	31968-33-9	CC(=O)C1=C(C=CS1)N	{24: 1, 1: 1, 30: 1, 14: 2, 41: 1}
Did not match all atoms present	31969-05-8	CC(C)(C)NCC(COC1=CC=CC2=C1CCCC2=O)O.Cl	{1: 3, 2: 2, 3: 1, 4: 1, 11: 3, 14: 3, 17: 1, 20: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	31970-04-4	C1C=CCN1C(=O)OCC2=CC=CC=C2	{33: 1, 2: 1, 11: 2, 28: 1, 14: 7}
Did not match all atoms present	31978-07-1	CCCCCCCCCCCC[N+](C)(C)CC=C.[Cl-]	{1: 3, 2: 12, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	3198-07-0	CCC(C(C1=CC(=C(C=C1)O)O)O)[NH3+].[Cl-]	{1: 1, 2: 1, 3: 2, 14: 3, 17: 1, 20: 1, 21: 2}
Did not match all atoms present	3198-15-0	C[C@@H]([C@@H](C1=CC=CC=C1)O)N.Cl	{1: 1, 3: 2, 14: 5, 17: 1, 20: 1, 30: 1}
Did not match all atoms present	3198-30-9	C1=CC(=CC=C1C(=O)[O-])C(=O)[O-]	{24: 2, 14: 4}
Did not match all atoms present	3198-32-1	O=S(=O)([O-])c1ccccc1	{29: 3, 14: 5}
Did not match all atoms present	31981-99-4	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)/C(=C/[N+]#N)/[O-]	{1: 2, 34: 1, 3: 1, 6: 1, 7: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	31982-00-0	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)CCl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	3199-61-9	CCOC(=O)C1=CC2=CC=CC=C2O1	{1: 1, 2: 1, 28: 1, 14: 5, 23: 1}
Did not match all atoms present	31996-10-8	COC(=O)C1=C2C(=CC=C(C2=C(C=C1)C(=O)OC)C(=O)OC)C(=O)OC	{1: 4, 28: 4, 14: 4}
Did not match all atoms present	320-23-0	C1=C(C(=CC(=C1C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 12, 4: 4, 14: 2}
Did not match all atoms present	320-50-3	C1=CC(=C(C=C1Cl)C(F)(F)F)Cl	{16: 3, 17: 2, 4: 1, 14: 3}
Did not match all atoms present	320-51-4	C1=CC(=C(C=C1N)C(F)(F)F)Cl	{16: 3, 17: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	320-60-5	C1=CC(=C(C=C1Cl)Cl)C(F)(F)F	{16: 3, 17: 2, 4: 1, 14: 3}
Did not match all atoms present	320-65-0	C1=CC=C(C(=C1)C(Cl)Cl)F	{16: 1, 17: 2, 3: 1, 14: 4}
Did not match all atoms present	320-67-2	C1=NC(=NC(=O)N1C2C(C(C(O2)CO)O)O)N	{33: 1, 2: 1, 35: 2, 12: 4, 14: 1, 20: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	320-72-9	C1=C(C=C(C(=C1Cl)O)C(=O)O)Cl	{17: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	320-96-7	CCOC(=O)C1=C(C=C(C=C1)F)C(=O)OCC	{16: 1, 1: 2, 2: 2, 28: 2, 14: 3}
Did not match all atoms present	3200-06-4	CCN(CC)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)O)O	{1: 2, 2: 6, 3: 1, 33: 1, 11: 3, 12: 1, 14: 7, 23: 1, 27: 2, 28: 1}
Did not match all atoms present	32002-92-9	CC(=O)OC1=C2[N+](=CC=C1)C(=C(S2)C3=CC=CC=C3)[O-]	{1: 1, 28: 1, 41: 1, 14: 8, 33: 1}
Did not match all atoms present	32005-36-0	C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.[Pd]	{24: 2, 14: 20, 6: 8}
Did not match all atoms present	32011-19-1	CCCC[Sn](CCCC)(SCCC(=O)OC)SCCC(=O)OC	{40: 2, 1: 4, 2: 10, 28: 2}
Did not match all atoms present	32014-19-0	[Li+].C1=CC(=CC=C1OCC(CO)O)S(=O)(=O)[O-]	{2: 2, 3: 1, 14: 4, 20: 2, 22: 1, 29: 3}
Did not match all atoms present	32014-22-5	C1=CC(=CC=C1CBr)S(=O)(=O)[O-].[Na+]	{2: 1, 18: 1, 14: 4, 29: 3}
Did not match all atoms present	32017-76-8	C1C(O1)C2=CC=C(C=C2)Br	{18: 1, 11: 1, 12: 1, 14: 4, 23: 1}
Did not match all atoms present	32018-88-5	C1=CC2=C(C=CC=C2N)C(=C1)C(=O)O	{27: 1, 30: 1, 14: 6}
Did not match all atoms present	3202-84-4	C1COCCN1C(=O)C2=CC=CC=C2O	{33: 1, 11: 4, 14: 4, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	32022-53-0	CCN(CC)CCOC(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(=O)OCCN(CC)CC	{1: 4, 2: 9, 33: 2, 14: 8, 28: 2, 31: 2}
Did not match all atoms present	3204-27-1	CC(=O)OC1=C(C=C(C=C1C(C)(C)C)[N+](=O)[O-])[N+](=O)[O-]	{1: 4, 4: 1, 38: 2, 14: 2, 28: 1}
Did not match all atoms present	3204-31-7	CN1CN(C2=CC=CC=C21)C	{1: 2, 11: 1, 14: 4, 33: 2}
Did not match all atoms present	3204-73-7	COC(=O)C1=CC=C(C=C1)OCCO	{1: 1, 2: 2, 14: 4, 20: 1, 22: 1, 28: 1}
Did not match all atoms present	32041-58-0	CCC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)[O-].[Na+].[Na+]	{1: 1, 2: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	32042-38-9	C(C(F)(F)F)OC=O	{16: 3, 2: 1, 4: 1, 26: 1}
Did not match all atoms present	32044-03-4	C1=CC=C(C=C1)C2=C([N+]3=CC=CC=C3S2)[O-]	{33: 1, 14: 9, 41: 1}
Did not match all atoms present	32046-75-6	CCCCOCC(CN(CC(=O)O)CC(=O)[O-])O.[Na+]	{1: 1, 2: 7, 3: 1, 33: 1, 20: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	32060-64-3	C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)OS(=O)(=O)C5=CC=CC6=C5C=CC(=C6[O-])[N+]#N)O	{34: 2, 14: 17, 21: 1, 22: 2, 24: 1, 29: 4}
Did not match all atoms present	32065-38-6	CC1=CC=C(C=C1)S(=O)(=O)NCC/C(=C/[N+]#N)/[O-]	{1: 1, 2: 2, 6: 1, 7: 1, 34: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	32072-08-5	C=CN1C2=C(C=C(C=C2)Br)C3=CC=CC=C31	{33: 1, 14: 7, 18: 1, 5: 1, 6: 1}
Did not match all atoms present	3208-16-0	CCC1=CC=CO1	{1: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	3208-25-1	C1=CC=C(C=C1)CCCCCCCO	{2: 7, 20: 1, 14: 5}
Did not match all atoms present	3208-26-2	C1=CC=C(C=C1)CCCCCCCCCO	{2: 9, 20: 1, 14: 5}
Did not match all atoms present	32084-28-9	C1=C(NC(=S)N=C1)NN	{32: 1, 35: 1, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	32085-88-4	C1=C(C=C(C=C1F)F)C=O	{16: 2, 26: 1, 14: 3}
Did not match all atoms present	32089-69-3	CCN(CC(COC1=CC=CC=C1)OC(=O)NC2=CC=CC=C2)C3=CC(=C(C=C3)C=O)C	{1: 2, 2: 3, 3: 1, 33: 1, 14: 13, 22: 1, 26: 1, 28: 1, 31: 1}
Did not match all atoms present	32089-70-6	CCN(CC(COC1=CC=CC=C1)OC(=O)NC2=CC=CC=C2)C3=CC(=C(C=C3)C=C(C#N)C#N)C	{1: 2, 2: 3, 3: 1, 33: 1, 6: 1, 7: 1, 14: 13, 22: 1, 28: 1, 37: 2, 31: 1}
Did not match all atoms present	3209-22-1	C1=CC(=C(C(=C1)Cl)Cl)[N+](=O)[O-]	{17: 2, 38: 1, 14: 3}
Did not match all atoms present	3209-30-1	CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NC5=C(C=C(C=C5)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 14: 10, 21: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	32092-29-8	CC1CCCC2=NC=CC(=O)N12	{1: 1, 35: 1, 33: 1, 11: 3, 12: 1, 14: 2, 25: 1}
Did not match all atoms present	321-04-0	CCOC1=C(C=C(C=C1)F)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 16: 1, 22: 1}
Did not match all atoms present	321-14-2	C1=CC(=C(C=C1Cl)C(=O)O)O	{17: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	321-25-5	CN(C)C1=C(C=C(C=C1)N=NC2=CC=CC=C2)F	{16: 1, 1: 2, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	321-28-8	COC1=CC=CC=C1F	{16: 1, 1: 1, 22: 1, 14: 4}
Did not match all atoms present	321-37-9	C1=CC(=CC=C1C(=O)C(F)(F)F)Cl	{16: 3, 17: 1, 4: 1, 14: 4, 24: 1}
Did not match all atoms present	321-38-0	C1=CC=C2C(=C1)C=CC=C2F	{16: 1, 14: 7}
Did not match all atoms present	321-54-0	CCOP(=O)(OCC)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C	{1: 3, 2: 2, 14: 3, 17: 1, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	321-60-8	C1=CC=C(C=C1)C2=CC=CC=C2F	{16: 1, 14: 9}
Did not match all atoms present	321-64-2	C1CCC2=NC3=CC=CC=C3C(=C2C1)N	{35: 1, 11: 4, 30: 1, 14: 4}
Did not match all atoms present	32111-34-5	C1=CC=NC(=C1)C2=CC=C(C=C2)C#N	{35: 1, 37: 1, 14: 8}
Did not match all atoms present	32112-80-4	CCN1C(=O)C(=C2C=CN(C=C2)CCO)SC1=S	{1: 1, 2: 3, 33: 2, 41: 1, 14: 4, 15: 3, 20: 1, 25: 1}
Did not match all atoms present	32113-77-2	C1=CC(=CC(=C1)Cl)NC2=CC(=CC=C2)Cl	{17: 2, 14: 8, 31: 1}
Did not match all atoms present	32115-55-2	CN(C)C(=O)O[Si](C)(C)C	{1: 5, 28: 1, 33: 1}
Did not match all atoms present	32116-24-8	CC(=O)C1=CC(=CN1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 2, 32: 1}
Did not match all atoms present	32116-25-9	CC(=O)C1=CC=C(N1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 2, 32: 1}
Did not match all atoms present	32118-33-5	C1=CC(=C(C=C1N=C=S)Cl)Br	{8: 1, 17: 1, 18: 1, 34: 1, 14: 3}
Did not match all atoms present	32120-16-4	C=CC(=O)OCCOP(=O)(O)O	{2: 2, 5: 1, 6: 1, 20: 2, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	3213-15-8	CC[NH+](CC)CC(=O)NC1=CC=CC=C1.[Cl-]	{1: 2, 2: 3, 14: 5, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	3213-28-3	COC1=CC(=CC(=C1)CCN)OC	{1: 2, 2: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	3213-29-4	COC1=CC=CC(=C1OC)CCN	{1: 2, 2: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	3213-79-4	CNC1=CC=CC=C1NC	{1: 2, 14: 4, 31: 2}
Did not match all atoms present	32137-19-2	C1=CC(=C(C=C1C(F)(F)F)F)F	{16: 5, 4: 1, 14: 3}
Did not match all atoms present	32137-39-6	C1CCC#CC2=CC=CC3=CC=CC(=C32)C#CC1	{10: 4, 11: 4, 14: 6}
Did not match all atoms present	32137-40-9	C1CC#CC2=C3C(=CC=C2)C=CC=C3C#CC1	{10: 4, 11: 3, 14: 6}
Did not match all atoms present	32137-73-8	C[Si](C)(C)C1=NC2=CC=CC=C2S1	{1: 3, 35: 1, 14: 4, 41: 1}
Did not match all atoms present	32139-72-3	C1=C(C(=C(C(=C1Cl)Cl)O)O)Cl	{17: 3, 21: 2, 14: 1}
Did not match all atoms present	3215-64-3	C1=CC(=C(C(=C1)Cl)CC#N)Cl	{17: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	3215-65-4	C1=CC(=C(C(=C1Cl)CC#N)Cl)Cl	{17: 3, 2: 1, 37: 1, 14: 2}
Did not match all atoms present	3215-84-7	CC(C)(CCC(=O)C1=CC=C(C=C1)OC)C(C2=CC=C(C=C2)OC)N(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 33: 1, 14: 8, 22: 2, 24: 1}
Did not match all atoms present	3215-85-8	CC(C)(CCC(=O)C1=CC=CC=C1OC)C(C2=CC=CC=C2OC)N(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 33: 1, 14: 8, 22: 2, 24: 1}
Did not match all atoms present	3215-87-0	CC1=CC=C(C=C1)C(C(C)(C)CCC(=O)C2=CC=C(C=C2)C)N(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 33: 1, 14: 8, 24: 1}
Did not match all atoms present	3215-88-1	CC1=CC(=CC=C1)C(C(C)(C)CCC(=O)C2=CC(=CC=C2)C)N(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 33: 1, 14: 8, 24: 1}
Did not match all atoms present	3215-89-2	CC1=CC=CC=C1C(C(C)(C)CCC(=O)C2=CC=CC=C2C)N(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 33: 1, 14: 8, 24: 1}
Did not match all atoms present	32154-05-5	CCCCCCCCCCCC(=O)OCCOC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCCOC(=O)CCCCCCCCCCC	{1: 4, 2: 24, 4: 1, 14: 8, 22: 2, 28: 2}
Did not match all atoms present	32156-25-5	CC(CC1=CC(=C(C=C1Br)OC)OC)N	{1: 3, 2: 1, 3: 1, 14: 2, 18: 1, 22: 2, 30: 1}
Did not match all atoms present	32156-26-6	CC(CC1=CC(=C(C=C1OC)Br)OC)N	{1: 3, 2: 1, 3: 1, 14: 2, 18: 1, 22: 2, 30: 1}
Did not match all atoms present	3216-06-6	C[N+]1(C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4C(F)(F)F)C.[I-]	{1: 2, 3: 1, 4: 1, 11: 4, 12: 3, 14: 9, 16: 3, 19: 1, 22: 1}
Did not match all atoms present	3216-14-6	C1COCCN1CCOC(C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F.C(=C/C(=O)O)\C(=O)O	{33: 1, 2: 2, 3: 1, 4: 1, 6: 2, 11: 4, 14: 9, 16: 3, 22: 1, 23: 1, 27: 2}
Did not match all atoms present	3216-48-6	C1=CC=C2C(=C1)C(=CS2)CC#N	{41: 1, 2: 1, 37: 1, 14: 5}
Did not match all atoms present	32166-80-6	C[Si](C)(C)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 15, 2: 1, 12: 5, 22: 5, 23: 1}
Did not match all atoms present	32179-45-6	C[N+]1(CCC2=C1C=CC(=C2)Cl)C.[Br-]	{1: 2, 18: 1, 11: 2, 14: 3, 17: 1}
Did not match all atoms present	3218-36-8	C1=CC=C(C=C1)C2=CC=C(C=C2)C=O	{26: 1, 14: 9}
Did not match all atoms present	3218-37-9	CCN(CC)CCCC(C)OC(C1=CC=CC=C1)C2=CC=CC=C2C(F)(F)F.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 7, 3: 2, 4: 2, 33: 1, 14: 9, 16: 3, 20: 1, 22: 1, 27: 3}
Did not match all atoms present	3218-49-3	C1=CC(=C(C=C1CC#N)Cl)Cl	{17: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	32180-65-7	COC1=CC(=C(C=C1)OC)/C=C/C2=CC=C(C=C2)N	{1: 2, 22: 2, 30: 1, 14: 7, 6: 2}
Did not match all atoms present	32180-75-9	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C=C2)O)C(C)(C)CC	{1: 6, 2: 6, 4: 2, 14: 9, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	32180-77-1	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C/C(=N/NC3=CC=CC=C3C(=O)C)/C4=CC=CC=C4C2=O)C(C)(C)CC	{1: 7, 2: 6, 4: 2, 34: 1, 14: 12, 15: 2, 22: 1, 24: 2, 25: 1, 31: 2}
Did not match all atoms present	32185-10-7	CCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)O	{1: 1, 2: 3, 6: 1, 34: 1, 14: 8, 21: 1, 22: 1}
Did not match all atoms present	3219-63-4	C[Si](C)(C)CO	{1: 3, 2: 1, 20: 1}
Did not match all atoms present	3219-73-6	CC1=CC(=O)C(=NNC2=NC3=C(S2)C=C(C=C3)OC)C=C1	{1: 2, 34: 1, 35: 1, 41: 1, 14: 6, 15: 2, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	32195-55-4	C1=CC=C(C=C1)C2=C3C=CC(=N3)C=C4C=CC(=CC5=NC(=CC6=C(C(=C2N6C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9)C=C5)N4.[Cl-].[Cl-].[Cl-].[Mn+3]	{32: 1, 17: 3, 35: 2, 14: 29, 33: 1}
Did not match all atoms present	322-46-3	C1=CC2=NC=CN=C2N=C1	{35: 3, 14: 5}
Did not match all atoms present	322-97-4	C1=CC2=C(C=C1C(F)(F)F)NC=CC2=O	{16: 3, 25: 1, 4: 1, 14: 5, 32: 1}
Did not match all atoms present	32202-61-2	C1CC2=C(C1)C(=CC=C2)N	{11: 3, 30: 1, 14: 3}
Did not match all atoms present	3222-47-7	CC1=NC=C(C=C1)C(=O)O	{1: 1, 27: 1, 14: 3, 35: 1}
Did not match all atoms present	3222-48-8	CC1=NC=C(C=C1)C#N	{1: 1, 35: 1, 37: 1, 14: 3}
Did not match all atoms present	32226-65-6	C1=CC=C2C(=C1)C=CC3=C2C4=CSC5=C(C4=N3)C=C(C=C5)Cl	{17: 1, 35: 1, 14: 10, 41: 1}
Did not match all atoms present	32226-69-0	C1CCN(C1)CCOC2=CC=NC3=CC=CC=C32	{33: 1, 2: 2, 35: 1, 11: 4, 14: 6, 22: 1}
Did not match all atoms present	32228-15-2	C/C=C/S(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	32228-97-0	C1C2=CC=CC=C2C3=C1C=C(C=C3)NC4=CC=CC=C4	{11: 1, 14: 12, 31: 1}
Did not match all atoms present	32229-35-9	CC1=CC(=C(C=C1)O)C(=O)C2=C(C=CC(=C2)C)OC	{24: 1, 1: 3, 22: 1, 21: 1, 14: 6}
Did not match all atoms present	32229-36-0	CC1=CC(=C(C=C1)OC)C(=O)C2=C(C=CC(=C2)C)OC	{24: 1, 1: 4, 22: 2, 14: 6}
Did not match all atoms present	3223-07-2	C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCCl)CCCl.Cl	{33: 1, 2: 5, 3: 1, 14: 4, 17: 3, 27: 1, 30: 1}
Did not match all atoms present	3223-94-7	C1=CC2=C(C(=C1)N)C(=O)C3=C(C=CC(=C3C2=O)Cl)Cl	{17: 2, 30: 1, 14: 5, 25: 2}
Did not match all atoms present	32231-06-4	C1CN(CCN1)CC2=CC3=C(C=C2)OCO3	{32: 1, 33: 1, 2: 1, 11: 5, 14: 3, 23: 2}
Did not match all atoms present	32238-28-1	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C1=CC(=CC=C1OCCO)OCCO.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 13, 8: 2, 34: 2, 14: 12, 20: 4, 22: 2, 27: 2, 29: 2}
Did not match all atoms present	3224-48-4	CCCCCCCCCCCCCCN=C=S	{8: 1, 1: 1, 2: 13, 34: 1}
Did not match all atoms present	32241-08-0	C1=C2C(=C(C(=C1Cl)Cl)Cl)C(=C(C(=C2Cl)Cl)Cl)Cl	{17: 7, 14: 1}
Did not match all atoms present	32246-34-7	COC1=C(C(=C(C=C1)C=O)OC)O	{1: 2, 22: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	32247-96-4	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CBr	{16: 6, 2: 1, 4: 2, 18: 1, 14: 3}
Did not match all atoms present	322470-97-3	[O].[O].[Zn-]	{}
Did not match all atoms present	32249-59-5	COP(=O)(C(C1=CC=CC=C1)(O)P(=O)(OC)OC)OC	{1: 4, 4: 1, 14: 5, 20: 1, 22: 4, 29: 2}
Did not match all atoms present	32251-53-9	CCOC(=O)C(C#N)C1=C(C(=C(C(=C1F)F)C(F)(F)F)F)F	{1: 1, 2: 1, 3: 1, 4: 1, 37: 1, 16: 7, 28: 1}
Did not match all atoms present	32255-35-9	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 38: 5, 14: 5}
Did not match all atoms present	3226-32-2	CCCCCCC1=CC=CC=C1O	{1: 1, 2: 5, 21: 1, 14: 4}
Did not match all atoms present	3226-36-6	CN(C)C(=S)[S-].[NH4+]	{1: 2, 33: 1, 7: 1}
Did not match all atoms present	32262-18-3	CN1C2=CC=CC=C2C(=CC1=O)OC	{1: 2, 33: 1, 22: 1, 14: 5, 25: 1}
Did not match all atoms present	32262-98-9	CCCC1=CN=C(C(=N1)C)C	{1: 3, 2: 2, 35: 2, 14: 1}
Did not match all atoms present	32263-00-6	CCC(C)C1=CN=C(C(=N1)C)C	{1: 4, 2: 1, 3: 1, 14: 1, 35: 2}
Did not match all atoms present	32266-10-7	C1=CC(=C(C=C1C(CNCCCCCCNCC(C2=CC(=C(C=C2)O)O)O)O)O)O.OS(=O)(=O)O	{2: 8, 3: 2, 14: 6, 20: 4, 21: 4, 29: 2, 31: 2}
Did not match all atoms present	32272-48-3	CCC1=CSC(=N1)C	{1: 2, 2: 1, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	32272-49-4	CCC1=CSC(=N1)CC	{1: 2, 2: 2, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	32272-57-4	CCC1=C(SC(=N1)C)C	{1: 3, 2: 1, 35: 1, 41: 1}
Did not match all atoms present	32276-64-5	CC1=CC=CC=C1C(=O)OCC(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	32277-35-3	C1CC2=C1C=CC3=CC=CC=C23	{11: 2, 14: 6}
Did not match all atoms present	3228-02-2	CC1=C(C=CC(=C1)O)C(C)C	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	3228-03-3	CC1=CC(=CC(=C1)O)C(C)C	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	3228-04-4	CC1=C(C(=CC=C1)C(C)C)O	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	32283-21-9	C1=CC=C2C(=C1)SC=[S+]2.OCl(=O)(=O)=O	{17: 1, 20: 1, 29: 3, 14: 5, 41: 2}
Did not match all atoms present	32283-91-3	C1=CC(=CC=C1N)N2C(=O)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C(=O)N(C8=O)C9=CC=C(C=C9)N)C2=O	{25: 4, 30: 2, 14: 16, 33: 2}
Did not match all atoms present	32283-97-9	CC1=CC=C(C=C1)N2C(=O)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C(=O)N(C8=O)C9=CC=C(C=C9)C)C2=O	{1: 2, 33: 2, 14: 16, 25: 4}
Did not match all atoms present	32284-96-1	C[Ge](C)C.C[Ge](C)C1=CC=CC=C1	{1: 5, 14: 5}
Did not match all atoms present	32287-37-9	C1=CC=C(C=C1)C2=C3C(=C(C4=CC=CC=C42)C5=CC=CC=C5)C6(C7=CC=CC=C7C3(OO6)C8=CC=CC=C8)C9=CC=CC=C9	{13: 2, 14: 28, 23: 2}
Did not match all atoms present	32287-65-3	O.F[Al](F)F	{16: 3}
Did not match all atoms present	32288-17-8	CCOP(=O)(C)OP(=O)(C)OCC	{1: 4, 2: 2, 29: 2, 22: 3}
Did not match all atoms present	32294-58-9	C1=CC=C2C(=C1)C=CC=C2[Te][Te]C3=CC=CC4=CC=CC=C43	{14: 14}
Did not match all atoms present	32294-60-3	C1=CC=C(C=C1)[Te][Te]C2=CC=CC=C2	{14: 10}
Did not match all atoms present	323-09-1	C1=CC=C2C=C(C=CC2=C1)F	{16: 1, 14: 7}
Did not match all atoms present	323-60-4	C1=CC(=CC(=C1)F)N(CCO)CCO	{16: 1, 33: 1, 2: 4, 20: 2, 14: 4}
Did not match all atoms present	3230-39-5	COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)O	{1: 1, 34: 1, 6: 1, 14: 8, 21: 1, 22: 1}
Did not match all atoms present	32305-98-9	CC1(O[C@H]([C@@H](O1)CP(C2=CC=CC=C2)C3=CC=CC=C3)CP(C4=CC=CC=C4)C5=CC=CC=C5)C	{1: 2, 2: 2, 12: 2, 13: 1, 14: 20, 23: 2}
Did not match all atoms present	3231-93-4	CCCC[Sn]1(OC(=O)CCSCSCCC(=O)O1)CCCC	{1: 2, 2: 6, 11: 5, 28: 2, 41: 2}
Did not match all atoms present	32315-05-2	CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)N(C)C)OC	{1: 5, 4: 1, 22: 1, 14: 13, 33: 2}
Did not match all atoms present	32315-10-9	C(=O)(OC(Cl)(Cl)Cl)OC(Cl)(Cl)Cl	{17: 6, 4: 2}
Did not match all atoms present	32319-89-4	C1CS(=O)(=O)CCC1NC(=O)N(CCF)N=O	{33: 1, 2: 2, 11: 4, 12: 1, 34: 1, 16: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	32324-19-9	CC1=CC=CC=C1S(=O)(=O)N=C=O	{8: 1, 1: 1, 34: 1, 29: 3, 14: 4}
Did not match all atoms present	32324-48-4	CCCCN(CCCC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O	{1: 2, 2: 6, 33: 1, 34: 2, 14: 8, 20: 1, 29: 2}
Did not match all atoms present	32329-20-7	CC1COC2=CC=CC=C2N1	{32: 1, 1: 1, 11: 1, 12: 1, 14: 4, 23: 1}
Did not match all atoms present	32332-65-3	CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)Cl)Cl)/C2=O	{1: 1, 34: 1, 14: 12, 15: 2, 17: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	32341-91-6	CC1=CC(=CC=C1)C(C)C2=CC=CC=C2	{1: 2, 3: 1, 14: 9}
Did not match all atoms present	32345-29-2	CCOP(=S)(OCC)OC1=CC=CC=C1	{1: 2, 2: 2, 22: 3, 14: 5}
Did not match all atoms present	32348-90-6	C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)[O-].[Mg+2].[Mg+2]	{38: 1, 20: 1, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	32348-91-7	C1=CC(=CC=C1[N+](=O)[O-])OP(=O)([O-])[O-].[NH4+].[NH4+]	{38: 1, 22: 1, 14: 4, 29: 3}
Did not match all atoms present	3235-02-7	CC1=CC=C(C=C1)/C=N/O	{1: 1, 34: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	3235-09-4	CC1=CC=CC=C1[O-].[K+]	{1: 1, 14: 4}
Did not match all atoms present	32350-16-6	CCCC1=NC=C(N=C1C)C	{1: 3, 2: 2, 35: 2, 14: 1}
Did not match all atoms present	32353-63-2	CC1=CC2=C(C=C1)OC(=[N+]2CCC(=O)O)C.[Br-]	{1: 2, 2: 2, 33: 1, 14: 3, 18: 1, 23: 1, 27: 1}
Did not match all atoms present	32354-50-0	C/C(=C/C(=O)C)/O.C1C2C=CC1C=C2.[Rh]	{1: 2, 6: 1, 7: 1, 11: 1, 12: 2, 14: 4, 20: 1, 24: 1}
Did not match all atoms present	32357-17-8	CC(C)COC(=O)C1=CC=CC=C1Cl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	32357-46-3	CCCCOCCOC(=O)CCCOC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 8, 14: 3, 17: 2, 22: 2, 28: 1}
Did not match all atoms present	3236-63-3	CC1=CC(=C(C=C1)O)CC2=C(C=CC(=C2)C)O	{1: 2, 2: 1, 21: 2, 14: 6}
Did not match all atoms present	3236-71-3	C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC=C(C=C4)O)C5=CC=C(C=C5)O	{13: 1, 14: 16, 21: 2}
Did not match all atoms present	3236-82-6	CC[O-].CC[O-].CC[O-].CC[O-].CC[O-].[Nb+5]	{1: 5, 2: 5, 29: 5}
Did not match all atoms present	32360-03-5	CCCCCCCCCCCCCCCC1=CC(=C(C=C1)C(C)(C)C)O	{1: 4, 2: 14, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	32360-04-6	CCCCCCCCCCCCCCCC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O	{1: 7, 2: 14, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	32361-96-9	CCCCCCCCCCCCC(C(=O)[O-])S(=O)(=O)O.[Na+]	{1: 1, 2: 11, 3: 1, 20: 1, 24: 1, 29: 2}
Did not match all atoms present	32362-68-8	CC1=C2C3=CC=CC=C3SC2=C(C4=CC=CC=C14)C	{1: 2, 14: 8, 41: 1}
Did not match all atoms present	32367-54-7	CCC1CCC2=CC=CC=C2C1	{1: 1, 2: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	3237-62-5	CCN1C(=NC2=CC(=C(C=C21)Cl)Cl)C	{1: 2, 2: 1, 35: 1, 33: 1, 14: 2, 17: 2}
Did not match all atoms present	3238-40-2	C1=C(OC(=C1)C(=O)O)C(=O)O	{27: 2, 14: 2, 23: 1}
Did not match all atoms present	3238-55-9	CCC(=O)C1=CC=CC=N1	{24: 1, 1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	32387-83-0	CC1=NC2=C(C(=C(C=C2)OC)N)N=C1C	{1: 3, 30: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	32388-21-9	C1=C(C(=O)NC(=O)O1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{32: 1, 2: 1, 12: 4, 14: 1, 20: 3, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	32393-32-1	CC(C1=CC=CC=C1)N=C=S	{8: 1, 1: 1, 34: 1, 3: 1, 14: 5}
Did not match all atoms present	32395-96-3	CCCCCCCOC1=CC=CC=C1	{1: 1, 2: 6, 22: 1, 14: 5}
Did not match all atoms present	32398-67-7	CC(C)(C)C(=O)C#CC1=CC=CC=C1	{24: 1, 1: 3, 10: 2, 4: 1, 14: 5}
Did not match all atoms present	324-00-5	CCCCOC1CC(C=CO1)C2=CC=CC=C2	{1: 1, 2: 3, 11: 1, 12: 2, 14: 7, 22: 1, 23: 1}
Did not match all atoms present	324-74-3	C1=CC=C(C=C1)C2=CC=C(C=C2)F	{16: 1, 14: 9}
Did not match all atoms present	324-93-6	C1=CC(=CC=C1C2=CC=C(C=C2)F)N	{16: 1, 30: 1, 14: 8}
Did not match all atoms present	3240-34-4	CC(=O)OI(C1=CC=CC=C1)OC(=O)C	{1: 2, 19: 1, 28: 2, 14: 5}
Did not match all atoms present	3240-72-0	C1(=C(NC(=O)NC1=O)N)N	{32: 2, 25: 2, 30: 2}
Did not match all atoms present	32405-88-2	CCOP(=O)(NC1CCCCC1)OCC	{1: 2, 2: 2, 11: 5, 12: 1, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	32407-67-3	CCOC(=O)C(C1=CC(=C(C=C1)OC)OC)O	{1: 3, 2: 1, 3: 1, 14: 3, 20: 1, 22: 2, 28: 1}
Did not match all atoms present	32407-79-7	[CH3-].C[PH+](C)C.[Au]	{1: 3}
Did not match all atoms present	32417-74-6	CC1=C(C=CC(=C1)[N+](=O)[O-])N(C)C	{1: 3, 38: 1, 14: 3, 33: 1}
Did not match all atoms present	32418-95-4	C1=CC=C(C=C1)CSCC2(C(=O)NC(=O)N2)CSCC3=CC=CC=C3	{32: 2, 2: 4, 40: 2, 13: 1, 14: 10, 25: 2}
Did not match all atoms present	32422-02-9	C1COP(=O)(CN1CP(=O)(O)O)O	{33: 1, 2: 1, 11: 3, 20: 3, 23: 1, 29: 2}
Did not match all atoms present	32426-10-1	CCCCCCCCCC[N+](C)(CCCCCCCCCC)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 19, 14: 5, 17: 1}
Did not match all atoms present	32426-11-2	CCCCCCCCCC[N+](C)(C)CCCCCCCC.[Cl-]	{1: 4, 2: 16, 17: 1}
Did not match all atoms present	32426-62-3	C[Si](C)(C)OC1=CC=CC=C1C=CC(=O)O[Si](C)(C)C	{1: 6, 22: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	3243-42-3	C1=CC=C2C(=C1)C=CC=C2CCC(=O)O	{2: 2, 27: 1, 14: 7}
Did not match all atoms present	32432-55-6	CC1=C(C(=C(C(=C1N)C)S(=O)(=O)O)C)N	{1: 3, 20: 1, 29: 2, 30: 2}
Did not match all atoms present	32433-28-6	CC(=O)NC1=CC=NC2=CC=CC=C21	{24: 1, 1: 1, 35: 1, 14: 6, 31: 1}
Did not match all atoms present	32438-31-6	CCOC(COC1=CC=CC=C1)OCC	{1: 2, 2: 3, 3: 1, 22: 3, 14: 5}
Did not match all atoms present	3244-41-5	[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[K+]	{14: 20}
Did not match all atoms present	3244-90-4	CCCOP(=S)(OCCC)OP(=S)(OCCC)OCCC	{1: 4, 2: 8, 22: 5}
Did not match all atoms present	32444-84-1	CCCCCC1=NNC(=S)N1NC(=O)C2=CC=CC=C2	{32: 1, 1: 1, 2: 4, 35: 1, 33: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	32445-12-8	COC1=C(C=CC(=C1)NC2=CC=CC=C2)[N+]#N	{1: 1, 34: 1, 22: 1, 14: 8, 31: 1}
Did not match all atoms present	32445-13-9	COC1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N	{1: 1, 34: 1, 22: 1, 14: 8, 31: 1}
Did not match all atoms present	32449-36-8	CCN1C(=CC(=NC2=CC=C(C=C2)C)C)SC3=C1C4=CC=CC=C4C=C3	{1: 3, 2: 1, 33: 1, 6: 1, 7: 1, 41: 1, 34: 1, 14: 10, 15: 1}
Did not match all atoms present	32449-41-5	CC1=C(C(=O)N2C(=N1)N=CN2)Br	{32: 1, 1: 1, 35: 2, 33: 1, 14: 1, 18: 1, 25: 1}
Did not match all atoms present	32457-96-8	CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCOCC2.Cl[Zn-](Cl)Cl	{1: 2, 2: 6, 33: 1, 11: 4, 34: 1, 14: 2, 17: 3, 22: 2, 23: 1}
Did not match all atoms present	32458-06-3	CCCCOC(=O)C(=C)C.CC(=C)C(=O)OC.CC(=C)C(=O)OCCO.C=CC1=CC=CC=C1	{1: 5, 2: 5, 5: 4, 6: 1, 7: 3, 14: 5, 20: 1, 28: 3}
Did not match all atoms present	32458-57-4	CC[NH2+]/N=C/SCC[N+](C)(C)C.[Br-].[Br-]	{1: 4, 2: 3, 6: 1, 40: 1, 34: 1, 18: 2}
Did not match all atoms present	32459-62-4	CCOC1=CC=C(C=C1)N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	3246-20-6	CCCCCCCCCOC(=O)CC(C(=O)OCCCCCCCCC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 17, 3: 1, 28: 2, 29: 3}
Did not match all atoms present	32460-00-7	C1=C(OC(=C1)Br)Br	{18: 2, 14: 2, 23: 1}
Did not match all atoms present	32462-30-9	C1=CC(=CC=C1[C@@H](C(=O)O)N)O	{27: 1, 30: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	32465-49-9	[Sb].[Pu]	{}
Did not match all atoms present	32467-66-6	CC(=O)C1=CC(=C(C=C1)SC)Cl	{24: 1, 1: 2, 40: 1, 14: 3, 17: 1}
Did not match all atoms present	3247-00-5	CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)O	{1: 3, 4: 1, 14: 12, 20: 1}
Did not match all atoms present	3247-34-5	C1=C(C(=C(C(=C1Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)[O-])[O-])Cl.[Na+].[Na+]	{17: 6, 2: 1, 14: 2}
Did not match all atoms present	32479-72-4	CC1=CC=C(C=C1)S(=O)(=O)O.CN1C=CC=CC1=N	{1: 2, 36: 1, 33: 1, 14: 8, 20: 1, 29: 2}
Did not match all atoms present	3248-05-3	CC1=C2C=CC3=C(C=CN=C3C2=NC=C1)C	{1: 2, 35: 2, 14: 6}
Did not match all atoms present	3248-93-9	CC1=CC(=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N)C=CC1=N	{1: 1, 36: 1, 7: 1, 14: 11, 15: 3, 30: 2}
Did not match all atoms present	32488-48-5	C1=CC=C(C=C1)[13C](=O)C2=CC=CC=C2	{24: 1, 14: 10}
Did not match all atoms present	32497-38-4	CC(=O)NC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)C4=C(C=CC5=C4C(=O)C6=CC=CC=C6C5=O)NC(=O)C	{24: 2, 1: 2, 31: 2, 14: 12, 25: 4}
Did not match all atoms present	325-23-5	C1=CC=C(C=C1)CNNCC2=COC3=CC=CC=C3O2.C(C(C(=O)O)O)(C(=O)O)O	{2: 2, 3: 2, 14: 10, 15: 1, 20: 2, 23: 2, 27: 2, 31: 2}
Did not match all atoms present	32503-27-8	CCCC[N+](CCCC)(CCCC)CCCC.OS(=O)(=O)[O-]	{1: 4, 2: 12, 20: 1, 29: 3}
Did not match all atoms present	32503-34-7	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.OS(=O)(=O)[O-]	{1: 4, 2: 20, 20: 1, 29: 3}
Did not match all atoms present	32504-14-6	CC1=CC=C(C=C1)CCNN	{1: 1, 2: 2, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	3251-23-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]	{}
Did not match all atoms present	3251-56-7	COC1=C(C=CC(=C1)[N+](=O)[O-])O	{1: 1, 22: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	3251-96-5	C(=O)O.[Mn]	{26: 1, 27: 1}
Did not match all atoms present	3252-99-1	C/C(=C(/N=O)\C)/NO.C/C(=C(/N=O)\C)/NO.[Co]	{1: 4, 34: 2, 7: 4, 20: 2, 29: 2, 31: 2}
Did not match all atoms present	32522-68-2	C1CCC(CC1)C2=C(C=C(C=C2)C3(CC3)C(=O)NO)Cl	{11: 7, 12: 1, 13: 1, 14: 3, 17: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	32524-44-0	C1=CC=C2C=C(C=CC2=C1)N=NC3=C(N=C(N=C3N)N)N	{34: 2, 35: 2, 30: 3, 14: 7}
Did not match all atoms present	32527-15-4	CC1=CC=C(C=C1)S(=O)(=O)OCC#CC#CCOS(=O)(=O)C2=CC=C(C=C2)C	{1: 2, 2: 2, 10: 4, 14: 8, 22: 2, 29: 4}
Did not match all atoms present	3253-39-2	CC(=C)C(=O)OC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OC(=O)C(=C)C	{1: 4, 4: 1, 5: 2, 7: 2, 14: 8, 28: 2}
Did not match all atoms present	32539-16-5	CSC1=NN=C(S1)C(F)(F)F	{1: 1, 35: 2, 4: 1, 40: 1, 41: 1, 16: 3}
Did not match all atoms present	3254-63-5	COP(=O)(OC)OC1=CC=C(C=C1)SC	{40: 1, 1: 3, 22: 3, 14: 4, 29: 1}
Did not match all atoms present	3254-66-8	CC(C)OP(=O)(OC1=CC=C(C=C1)[N+](=O)[O-])OC(C)C	{1: 4, 3: 2, 38: 1, 14: 4, 22: 3, 29: 1}
Did not match all atoms present	3254-79-3	CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)OC)Cl	{1: 2, 31: 1, 28: 1, 14: 6, 17: 2}
Did not match all atoms present	3254-89-5	C1CCN(CC1)CCCC(C2=CC=CC=C2)(C3=CC=CC=C3)O.Cl	{33: 1, 2: 3, 4: 1, 11: 5, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	3254-93-1	C1NC(=O)C(N1)(C2=CC=CC=C2)C3=CC=CC=C3	{32: 2, 25: 1, 11: 1, 13: 1, 14: 10}
Did not match all atoms present	3255-05-8	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O[N+](=O)[O-])C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 22: 1}
Did not match all atoms present	3256-88-0	CC1=NC=C(C=C1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 8}
Did not match all atoms present	3257-28-1	CC1=CC(=C(C(=C1)S(=O)(=O)[O-])N/N=C\2/C=CC3=C(C2=O)C=CC=C3S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 34: 1, 14: 7, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	3257-49-6	CC1=CC=C(C=C1)OCCCCBr	{1: 1, 2: 4, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	32571-82-7	C1=CC=C(C=C1)NC2=C3C(=C(C(=C2)C#N)N)C(=O)C4=CC=CC=C4C3=O	{25: 2, 37: 1, 30: 1, 14: 10, 31: 1}
Did not match all atoms present	32575-57-8	C(CNCC(=O)[O-])NCC(=O)[O-].[Cu+2]	{24: 2, 2: 4, 31: 2}
Did not match all atoms present	3258-02-4	C1=CN(C(=O)N=C1NO)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 2, 20: 4, 23: 1, 25: 1, 31: 1}
Did not match all atoms present	3258-84-2	CC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 2, 33: 2, 11: 4, 12: 1, 14: 10, 24: 1}
Did not match all atoms present	32588-54-8	CCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O	{1: 3, 2: 1, 4: 1, 14: 7, 25: 2}
Did not match all atoms present	32588-74-2	C1=CC(=CC=C1CC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C(=C(C(=C4Br)Br)Br)Br)N5C(=O)C6=C(C5=O)C(=C(C(=C6Br)Br)Br)Br	{25: 4, 2: 1, 18: 8, 14: 8, 33: 2}
Did not match all atoms present	32588-76-4	C(CN1C(=O)C2=C(C1=O)C(=C(C(=C2Br)Br)Br)Br)N3C(=O)C4=C(C3=O)C(=C(C(=C4Br)Br)Br)Br	{25: 4, 2: 2, 18: 8, 33: 2}
Did not match all atoms present	32589-49-4	CN(C)C1=CC=C(C=C1)C2CC2(C#N)C3=CC=C(C=C3)Br	{1: 2, 37: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 8, 18: 1}
Did not match all atoms present	32589-51-8	CC1=CC=C(C=C1)C2(CC2C3=CC=C(C=C3)N(C)C)C#N	{1: 3, 37: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 8}
Did not match all atoms present	32589-54-1	COC1=CC=C(C=C1)C2CC2(C#N)C3=CC=C(C=C3)Cl	{1: 1, 37: 1, 11: 1, 12: 1, 13: 1, 14: 8, 17: 1, 22: 1}
Did not match all atoms present	32589-55-2	C1C(C1(C#N)C2=CC=C(C=C2)Cl)C3=CC=CC=C3	{37: 1, 11: 1, 12: 1, 13: 1, 14: 9, 17: 1}
Did not match all atoms present	32596-43-3	C1=C(C=C(C(=C1C=O)O)C=O)Cl	{17: 1, 26: 2, 21: 1, 14: 2}
Did not match all atoms present	32598-10-0	C1=CC(=C(C=C1C2=C(C=C(C=C2)Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	32598-11-1	C1=CC(=C(C=C1C2=C(C=CC(=C2)Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	32598-13-3	C1=CC(=C(C=C1C2=CC(=C(C=C2)Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	32598-14-4	C1=CC(=C(C=C1C2=C(C(=C(C=C2)Cl)Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	326-06-7	C1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F	{16: 3, 24: 2, 2: 1, 4: 1, 14: 5}
Did not match all atoms present	326-43-2	C1=CC=C(C=C1)C(CNC2=CC=CC=N2)O.Cl	{2: 1, 3: 1, 14: 9, 17: 1, 35: 1, 20: 1, 31: 1}
Did not match all atoms present	326-52-3	C1=CC=C(C=C1)C(=O)CCCCCCCCF	{16: 1, 24: 1, 2: 8, 14: 5}
Did not match all atoms present	326-56-7	COC(=O)C1=CC2=C(C=C1)OCO2	{1: 1, 11: 1, 28: 1, 14: 3, 23: 2}
Did not match all atoms present	326-59-0	COC(=O)CC1=CC2=C(C=C1)OCO2	{1: 1, 2: 1, 11: 1, 14: 3, 23: 2, 28: 1}
Did not match all atoms present	326-61-4	CC(=O)OCC1=CC2=C(C=C1)OCO2	{1: 1, 2: 1, 11: 1, 14: 3, 23: 2, 28: 1}
Did not match all atoms present	326-62-5	C1=CC=C(C(=C1)CC#N)F	{16: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	326-66-9	CC(=O)NC1=C(C=C(C=C1)Br)F	{1: 1, 14: 3, 16: 1, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	326-90-9	C1=COC(=C1)C(=O)CC(=O)C(F)(F)F	{2: 1, 4: 1, 14: 3, 16: 3, 23: 1, 24: 2}
Did not match all atoms present	326-91-0	C1=CSC(=C1)C(=O)CC(=O)C(F)(F)F	{2: 1, 4: 1, 41: 1, 14: 3, 16: 3, 24: 2}
Did not match all atoms present	3260-63-7	CC(=O)OC1=CN(C2=CC=CC=C21)C	{1: 2, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	3260-85-3	CC1=C(C=CC(=C1)Cl)OC	{1: 2, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	3260-87-5	CC1=C(C=CC=C1Cl)O	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	3260-88-6	CC1=C(C=CC=C1Cl)OC	{1: 2, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	32602-06-5	C1=CC=C2C(=C1)N=C(C(=N2)C(Br)Br)C(Br)Br	{35: 2, 18: 4, 3: 2, 14: 4}
Did not match all atoms present	32607-23-1	C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].[La+3].[La+3]	{17: 6, 25: 6, 15: 12}
Did not match all atoms present	3261-53-8	C[C@@H]1[C@H]([C@H](CC(O1)O[C@@H]2[C@H](OC(C[C@@H]2O)O[C@@H]3[C@H](OC(C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(C[C@@H]([C@@H]7C8=CC(=O)OC8)OC=O)O)C)C)C)C)O)O	{1: 5, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 5, 22: 3, 23: 3, 26: 1, 28: 1}
Did not match all atoms present	3261-62-9	CC1=CC=C(C=C1)CCN	{1: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	32610-45-0	C1CCCC1.C1CCCCCCC1.[Rh]	{11: 13}
Did not match all atoms present	32617-22-4	[C-]([N+](=O)[O-])[N+](=O)[O-].[K+]	{38: 2}
Did not match all atoms present	32624-91-2	C1CC2C1C3=CC=CC4=C3C2=CC=C4	{11: 2, 12: 2, 14: 6}
Did not match all atoms present	3263-31-8	CCOC1=CC2=C(C=C1)C(=O)/C(=C/3\C(=O)C4=C(S3)C=C(C=C4)OCC)/S2	{1: 2, 2: 2, 41: 2, 14: 6, 15: 2, 22: 2, 25: 2}
Did not match all atoms present	3263-46-5	CC(C1=CC(=CC=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)[N+](=O)[O-])O)O	{1: 1, 3: 1, 38: 1, 14: 8, 20: 1, 21: 2, 25: 2, 31: 1}
Did not match all atoms present	3263-47-6	CC(C1=CC(=CC=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)[N+](=O)[O-])O	{1: 1, 3: 1, 38: 1, 14: 8, 20: 1, 21: 2, 25: 2, 31: 1}
Did not match all atoms present	3263-79-4	C1=CC=C(C=C1)C2=C(NC(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5	{32: 1, 14: 20}
Did not match all atoms present	32634-37-0	CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCCCS(=O)(=O)[O-])C	{1: 2, 2: 5, 33: 2, 14: 2, 17: 2, 29: 3}
Did not match all atoms present	32634-66-5	CC1=CC=C(C=C1)C(=O)O[C@H]([C@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O	{27: 2, 1: 2, 3: 2, 28: 2, 14: 8}
Did not match all atoms present	32634-68-7	CC1=CC=C(C=C1)C(=O)O[C@@H]([C@@H](C(=O)O)OC(=O)C2=CC=C(C=C2)C)C(=O)O	{27: 2, 1: 2, 3: 2, 28: 2, 14: 8}
Did not match all atoms present	32637-37-9	CSC1=C(C=CC=N1)O	{40: 1, 1: 1, 35: 1, 21: 1, 14: 3}
Did not match all atoms present	32638-88-3	C1=CC=C2C(=C1)C3(C4=C(C(=C(C=C4)O)O)OC5=C3C=CC(=C5O)O)OS2(=O)=O	{23: 2, 29: 2, 13: 1, 14: 8, 21: 4}
Did not match all atoms present	3264-21-9	CC(=O)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1	{24: 1, 1: 1, 14: 9}
Did not match all atoms present	3264-31-1	C/C(=N/O)/C1CC2=CC=CC=C12	{1: 1, 34: 1, 7: 1, 11: 1, 12: 1, 14: 4, 20: 1}
Did not match all atoms present	3264-67-3	CC[O+](CC)CC.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sb]	{1: 3, 2: 3, 17: 6}
Did not match all atoms present	32650-55-8	CC(C)CCOP(=S)(OCCC(C)C)S	{1: 4, 2: 4, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	32651-66-4	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=[N+](C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=NC5=CC=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 34: 6, 14: 22, 6: 2, 29: 14}
Did not match all atoms present	32654-83-4	C1=CC=C(C=C1)C2=CC3=C(C=C2)C(=NC3=N)N	{35: 1, 36: 1, 30: 1, 14: 8, 15: 2}
Did not match all atoms present	32657-12-8	CC1=CC(=C(C(=C1CSC(=O)C2=CC=C(C=C2)C(=O)SCC3=C(C(=C(C=C3C)C(C)(C)C)O)C)C)O)C(C)(C)C	{1: 10, 2: 2, 4: 2, 40: 2, 14: 6, 21: 2, 24: 2}
Did not match all atoms present	32658-60-9	CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2[N+](=O)[O-])Cl)[N+](=O)[O-]	{1: 1, 38: 2, 14: 6, 17: 1, 29: 2, 31: 1}
Did not match all atoms present	32665-18-2	C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].[Zr+4]	{1: 12, 5: 4}
Did not match all atoms present	32665-36-4	COC(CN1CCN(CC1)CCC(C2=CC=CC=C2)O)C3=CC=CC=C3	{1: 1, 2: 3, 3: 2, 33: 2, 11: 4, 14: 10, 20: 1, 22: 1}
Did not match all atoms present	32666-56-1	C1C=CCC2=C1C=CC=C2N	{11: 2, 30: 1, 14: 5}
Did not match all atoms present	32669-06-0	C1=CC=C(C=C1)C(C2=CC=CC=C2)OCCCl	{17: 1, 2: 2, 3: 1, 22: 1, 14: 10}
Did not match all atoms present	3267-78-5	CCC[Sn](CCC)(CCC)OC(=O)C	{1: 4, 2: 6, 28: 1}
Did not match all atoms present	32673-05-5	C[Sn]1(OC(=O)CCS1)C	{1: 2, 11: 2, 28: 1, 41: 1}
Did not match all atoms present	32674-23-0	COP(=O)(OC)SCCSP(=O)(OC)OC	{40: 2, 1: 4, 2: 2, 29: 2, 22: 4}
Did not match all atoms present	32677-78-4	[CH-]1[CH-][CH-][C-]([CH-]1)SSS[C-]2C=CC=C2.[Fe]	{40: 3, 14: 8}
Did not match all atoms present	3268-19-7	COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O[C@H]6[C@@H]([C@H]([C@H]7[C@H](O6)COC(O7)C8=CC=CC=C8)O)O	{1: 3, 11: 3, 12: 10, 14: 9, 20: 2, 22: 4, 23: 5, 28: 1}
Did not match all atoms present	3268-27-7	CCCCCCCCCCCC(=O)O[Pb](C1=CC=CC=C1)(OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC	{1: 3, 2: 30, 28: 3, 14: 5}
Did not match all atoms present	3268-61-9	CC1=CC2=NC(=CN2C=C1)C	{1: 2, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	3268-87-9	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 8, 23: 2}
Did not match all atoms present	32680-29-8	[NH4+].[O-][As](=O)([O-])[O-].[Cu+2]	{29: 4}
Did not match all atoms present	326800-75-3	CC1C(=CCN1C)C2=CC3=C(C=C2)C=C(C=C3)O.Cl	{1: 2, 33: 1, 11: 1, 12: 1, 14: 7, 15: 1, 17: 1, 21: 1}
Did not match all atoms present	32683-48-0	CN1C(=CC(=N1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 35: 1, 38: 2, 14: 1, 33: 1}
Did not match all atoms present	32685-16-8	C1=CC=C(C=C1)C(=O)N[O-].[K+]	{24: 1, 29: 1, 14: 5, 31: 1}
Did not match all atoms present	32687-77-7	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)NN	{1: 6, 2: 2, 4: 2, 14: 2, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	3269-10-1	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Pr+3].[Pr+3]	{24: 6}
Did not match all atoms present	3269-15-6	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Ho+3].[Ho+3]	{24: 6}
Did not match all atoms present	3269-17-8	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Tm+3].[Tm+3]	{24: 6}
Did not match all atoms present	32690-28-1	C1=C(C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])N)N	{38: 2, 30: 2, 14: 2}
Did not match all atoms present	32690-93-0	C1=CC(=CC=C1C2=CC(=C(C=C2Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	32693-05-3	CC1=CC=CC2=C1C(=CC=C2)C3=CC=CC4=C3C(=CC=C4)C	{1: 2, 14: 12}
Did not match all atoms present	327-19-5	C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 38: 1, 14: 3, 16: 3}
Did not match all atoms present	327-25-3	C1=CSC=CC2=CSC=C21	{41: 2, 14: 6}
Did not match all atoms present	327-51-5	C1=C(C(=CC(=C1Br)F)Br)F	{16: 2, 18: 2, 14: 2}
Did not match all atoms present	327-52-6	C1=C(C(=CC(=C1F)Br)F)F	{16: 3, 18: 1, 14: 2}
Did not match all atoms present	327-54-8	C1=C(C(=CC(=C1F)F)F)F	{16: 4, 14: 2}
Did not match all atoms present	327-62-8	CCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	327-75-3	C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)Br	{16: 6, 18: 1, 4: 2, 14: 3}
Did not match all atoms present	327-78-6	C1=CC(=C(C=C1N=C=O)C(F)(F)F)Cl	{34: 1, 4: 1, 8: 1, 14: 3, 16: 3, 17: 1, 29: 1}
Did not match all atoms present	327-92-4	C1=C(C(=CC(=C1[N+](=O)[O-])F)F)[N+](=O)[O-]	{16: 2, 38: 2, 14: 2}
Did not match all atoms present	327-97-9	C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O	{6: 2, 11: 2, 12: 3, 13: 1, 14: 3, 20: 3, 21: 2, 27: 1, 28: 1}
Did not match all atoms present	327-98-0	CCOP(=S)(CC)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 2, 22: 2, 14: 2, 17: 3}
Did not match all atoms present	3270-02-8	CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3=CN(C4=CC=CC(=C34)C2=C1)C(=O)C)C	{1: 4, 2: 2, 33: 3, 11: 2, 12: 2, 14: 5, 15: 1, 24: 2}
Did not match all atoms present	3270-86-8	CCOP(=O)(OCC)SC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 40: 1, 14: 4, 22: 2, 29: 1}
Did not match all atoms present	32703-80-3	CC(C)(C)C1=CC(=C(C=C1)C#N)C#N	{1: 3, 4: 1, 37: 2, 14: 3}
Did not match all atoms present	32707-12-3	CN1C(=O)N(P1(F)(F)F)C	{16: 3, 1: 2, 33: 2, 25: 1}
Did not match all atoms present	32707-15-6	CN1C(=O)N(P1(C2=CC=CC=C2)(F)F)C	{16: 2, 1: 2, 33: 2, 14: 5, 25: 1}
Did not match all atoms present	32707-17-8	CCN(CC)P1(N(C(=O)N1C)C)(F)F	{16: 2, 1: 4, 2: 2, 33: 3, 25: 1}
Did not match all atoms present	32707-18-9	CN1C(=O)N(P1(C)(C)F)C	{16: 1, 1: 4, 33: 2, 25: 1}
Did not match all atoms present	32707-89-4	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CO	{16: 6, 20: 1, 2: 1, 4: 2, 14: 3}
Did not match all atoms present	3271-05-4	CN1C(=O)C2=C3C(=C(C=C2)OC)C=CC=C3C1=O	{1: 2, 33: 1, 22: 1, 14: 5, 25: 2}
Did not match all atoms present	3271-76-9	C1=CC=C2C(=C1)C3=CC=C4C5=C(C=CC(=C35)C2=O)C6=C(N4)C7=C(C=C6)C(=O)C8=CC=CC=C8C7=O	{32: 1, 25: 3, 14: 14}
Did not match all atoms present	32714-42-4	C[C-]1C=CC=C1.[N-]=O.[Ni]	{1: 1, 29: 1, 14: 4}
Did not match all atoms present	32717-31-0	CCCCCCC=CO.CC(=O)[O-]	{24: 1, 1: 2, 2: 5, 20: 1, 6: 2}
Did not match all atoms present	32718-50-6	COCC1=CC=C(C=C1)OC2=CC=CC=C2	{1: 1, 2: 1, 22: 2, 14: 9}
Did not match all atoms present	3272-08-0	C1=CC(=C(C=C1C#N)[N+](=O)[O-])O	{38: 1, 21: 1, 14: 3, 37: 1}
Did not match all atoms present	3272-86-4	C[Si](C)(C)C=P(C)(C)C	{1: 6, 6: 1}
Did not match all atoms present	3272-91-1	C1=CC2=C(C=CC=C2[N+](=O)[O-])C(=C1)N	{38: 1, 30: 1, 14: 6}
Did not match all atoms present	32723-67-4	CC1=C(C=CC(=C1)C=O)OC	{1: 2, 26: 1, 22: 1, 14: 3}
Did not match all atoms present	32725-29-4	C1CN2CC3=CC=CC=C3NC2=N1	{32: 1, 33: 1, 35: 1, 11: 3, 14: 4, 15: 1}
Did not match all atoms present	32728-27-1	C1=CC(=CC=C1C(C2=CC=C(C=C2)OC#N)(C(F)(F)F)C(F)(F)F)OC#N	{16: 6, 4: 3, 22: 2, 14: 8, 37: 2}
Did not match all atoms present	32736-64-4	[NH4+].[NH4+].[O-]S(=O)S(=O)(=O)[O-]	{29: 5}
Did not match all atoms present	32736-94-0	CC1=CN=C(C(=N1)CC(C)C)C	{1: 4, 2: 1, 3: 1, 14: 1, 35: 2}
Did not match all atoms present	32737-06-7	CC1=NC=CN=C1CCC(C)C	{1: 3, 2: 2, 3: 1, 14: 2, 35: 2}
Did not match all atoms present	32737-14-7	CCOC1=NC=CN=C1C	{1: 2, 2: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	32737-33-0	CC1(CC2(CC(C3=CC(=C(C(=C32)O)O)O)(C)C)C4=C(C(=C(C=C41)O)O)O)C	{1: 4, 11: 2, 13: 3, 14: 2, 21: 6}
Did not match all atoms present	3274-20-2	COC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O	{1: 1, 22: 1, 14: 7, 25: 2}
Did not match all atoms present	3274-56-4	C1=CC=C(C=C1)C2=CC(=CN2)C3=CC=CC=C3	{32: 1, 14: 12}
Did not match all atoms present	32740-01-5	CC1=CC=CC2=C(C3=C(C4=CC=CC=C4C=C3)N=C12)C	{1: 2, 35: 1, 14: 9}
Did not match all atoms present	32740-61-7	C1CC2C=CC1C3=C2C(=O)C4=CC=CC=C4C3=O	{25: 2, 11: 2, 12: 2, 14: 6, 15: 2}
Did not match all atoms present	32741-83-6	C1=CC(=CC(=C1)C(=O)OCCOC(=O)N=[N+]=[N-])C(=O)OCCOC(=O)N=[N+]=[N-]	{2: 4, 28: 4, 34: 4, 14: 4}
Did not match all atoms present	32741-92-7	COC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)C(=O)OC)C(=O)OC	{1: 3, 28: 3, 14: 7}
Did not match all atoms present	32745-15-6	[SnH3].[SnH3]	{}
Did not match all atoms present	32745-55-4	C1C2C=CC1C3=C2C(=O)C4=CC=CC=C4C3=O	{25: 2, 11: 1, 12: 2, 14: 6, 15: 2}
Did not match all atoms present	3275-24-9	C[N-]C.C[N-]C.C[N-]C.C[N-]C.[Ti+4]	{1: 8, 34: 4}
Did not match all atoms present	32750-14-4	CC1(C=CC=C(C1(O)O)C2=CC=CC=C2)C	{1: 2, 20: 2, 13: 2, 14: 8, 15: 1}
Did not match all atoms present	32754-35-1	[H+].[CH3-].C(C(C(=O)[O-])N)[S-].[Hg+2]	{24: 1, 2: 1, 3: 1, 30: 1}
Did not match all atoms present	32760-80-8	C1C=CC=[C-]1.C1=CC=[C-]C=C1.F[P-](F)(F)(F)(F)F.[Fe+3]	{16: 6, 11: 1, 14: 8}
Did not match all atoms present	32761-50-5	CP(C)C1=CC=CC=C1.CP(C)C1=CC=CC=C1.CP(C)C1=CC=CC=C1.C1C2C=CC1C=C2.F[P-](F)(F)(F)(F)F.[Rh]	{16: 6, 1: 6, 11: 1, 12: 2, 14: 19}
Did not match all atoms present	32768-54-0	CC1=C(C(=CC=C1)Cl)Cl	{1: 1, 14: 3, 17: 2}
Did not match all atoms present	3277-26-7	C[Si](C)O[Si](C)C	{1: 4, 22: 1}
Did not match all atoms present	3277-27-8	CCOP(=O)(C(=O)C1=CC=CC=C1)OCC	{1: 2, 2: 2, 14: 5, 22: 2, 24: 1, 29: 1}
Did not match all atoms present	32770-82-4	C1=C(C(=C(C(=C1Cl)Cl)I)Cl)Cl	{17: 4, 19: 1, 14: 1}
Did not match all atoms present	32774-16-6	C1=C(C=C(C(=C1Cl)Cl)Cl)C2=CC(=C(C(=C2)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	32777-10-9	COC(=O)C1(C2C1C=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]	{1: 1, 38: 1, 12: 2, 13: 1, 14: 8, 28: 1}
Did not match all atoms present	32777-11-0	COC1=CC=C(C=C1)C2(C3C2C=CC=C3)C(=O)OC	{1: 2, 12: 2, 13: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	32777-15-4	C1=CC=C(C=C1)C2(C3C2C=CC=C3)C#N	{12: 2, 13: 1, 14: 9, 37: 1}
Did not match all atoms present	3278-31-7	C1=CC(=CC=C1N2C(=O)C=CC2=O)N3C(=O)C=CC3=O	{25: 4, 14: 8, 33: 2}
Did not match all atoms present	3278-35-1	CCOC(=O)SC(=S)OCC	{1: 2, 2: 2, 7: 1, 40: 1, 22: 1, 28: 1}
Did not match all atoms present	3278-43-1	CCCC[N+](CCCC)(CCCC)CC1=C(C=C(C=C1)Cl)Cl.[Cl-]	{1: 3, 2: 10, 14: 3, 17: 3}
Did not match all atoms present	3278-88-4	CC1=CC(=C(C=C1Br)Br)Br	{1: 1, 18: 3, 14: 2}
Did not match all atoms present	3278-89-5	C=CCOC1=C(C=C(C=C1Br)Br)Br	{2: 1, 5: 1, 6: 1, 14: 2, 18: 3, 22: 1}
Did not match all atoms present	32780-64-6	CC(CCC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)O)C(=O)N)O.Cl	{1: 1, 2: 3, 3: 2, 14: 8, 17: 1, 20: 1, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	32784-82-0	CC1=CC=C(C=C1)S(=O)(=O)O.CS(=O)(=O)OCCCNCCCOS(=O)(=O)C	{1: 3, 2: 6, 14: 4, 20: 1, 22: 2, 29: 6, 31: 1}
Did not match all atoms present	32787-68-1	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C3=NC(=O)C4=CC=CC=C4N3	{32: 1, 1: 1, 35: 1, 14: 12, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	3279-07-0	CC(C)(C)C1=CC(=C(C=C1)O)[N+](=O)[O-]	{1: 3, 38: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	3279-26-3	COP(Cl)Cl	{1: 1, 22: 1, 17: 2}
Did not match all atoms present	3279-27-4	CCC(C)(C)C1=CC=CC=C1O	{1: 3, 2: 1, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	3279-54-7	C1=CC=C(C=C1)OP(=O)([O-])[O-].[Na+].[Na+]	{22: 1, 14: 5, 29: 3}
Did not match all atoms present	3279-62-7	CCOP(=O)(OCC)OC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 2, 14: 3, 17: 2, 22: 3, 29: 1}
Did not match all atoms present	3279-76-3	CC1=CC=CC(=O)N1	{32: 1, 1: 1, 14: 3, 25: 1}
Did not match all atoms present	32795-47-4	CN1CC(C2=C(C1)C(=CC=C2)N)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O	{1: 1, 6: 2, 33: 1, 11: 2, 12: 1, 14: 8, 27: 2, 30: 1}
Did not match all atoms present	32795-84-9	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)Br	{18: 1, 14: 11}
Did not match all atoms present	32796-95-5	C=C1C=CC=CC1=C	{5: 2, 14: 4}
Did not match all atoms present	328-04-1	CCP(=S)(OC1=C(C=C(C=C1)[N+](=O)[O-])Cl)OC(C)C	{1: 3, 2: 1, 3: 1, 38: 1, 14: 3, 17: 1, 22: 2}
Did not match all atoms present	328-55-2	C1C2CO[Sb](O1)O2	{11: 2, 12: 1, 23: 3}
Did not match all atoms present	328-56-3	C1CC2CCC1[Si]2	{11: 4, 12: 2}
Did not match all atoms present	328-57-4	C[Si](C1=CC=CC=C1)(F)F	{16: 2, 1: 1, 14: 5}
Did not match all atoms present	328-70-1	C1=C(C=C(C=C1C(F)(F)F)Br)C(F)(F)F	{16: 6, 18: 1, 4: 2, 14: 3}
Did not match all atoms present	328-73-4	C1=C(C=C(C=C1C(F)(F)F)I)C(F)(F)F	{16: 6, 19: 1, 4: 2, 14: 3}
Did not match all atoms present	328-74-5	C1=C(C=C(C=C1C(F)(F)F)N)C(F)(F)F	{16: 6, 4: 2, 30: 1, 14: 3}
Did not match all atoms present	328-75-6	C1=C(C=C(C=C1C(F)(F)F)[N+](=O)[O-])C(F)(F)F	{16: 6, 4: 2, 38: 1, 14: 3}
Did not match all atoms present	328-79-0	COC1=CC(=CC(=C1)[N+](=O)[O-])C(F)(F)F	{1: 1, 4: 1, 38: 1, 14: 3, 16: 3, 22: 1}
Did not match all atoms present	328-84-7	C1=CC(=C(C=C1C(F)(F)F)Cl)Cl	{16: 3, 17: 2, 4: 1, 14: 3}
Did not match all atoms present	328-87-0	C1=CC(=C(C=C1C(F)(F)F)C#N)Cl	{16: 3, 17: 1, 4: 1, 37: 1, 14: 3}
Did not match all atoms present	328-93-8	C1=CC(=C(C=C1C(F)(F)F)N)C(F)(F)F	{16: 6, 4: 2, 30: 1, 14: 3}
Did not match all atoms present	328-96-1	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC(=C2)C(F)(F)F	{1: 2, 34: 2, 4: 1, 33: 1, 14: 8, 16: 3}
Did not match all atoms present	328-99-4	C1=CC(=CC(=C1)C(F)(F)F)C(=O)F	{16: 4, 24: 1, 4: 1, 14: 4}
Did not match all atoms present	3280-08-8	CC(C1=CC=CC=C1)C(C)(C)O	{1: 3, 3: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	32808-51-8	C1CCC(CC1)C2=C(C=C(C=C2)C(=O)CCC(=O)O)Cl	{2: 2, 11: 5, 12: 1, 14: 3, 17: 1, 24: 1, 27: 1}
Did not match all atoms present	32809-16-8	CC12CC1(C(=O)N(C2=O)C3=CC(=CC(=C3)Cl)Cl)C	{1: 2, 33: 1, 11: 1, 13: 2, 14: 3, 17: 2, 25: 2}
Did not match all atoms present	32812-65-0	CC1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 11: 4, 12: 1, 13: 1, 14: 10}
Did not match all atoms present	32813-50-6	C1COCCN1CCCN=C=S	{33: 1, 2: 3, 8: 1, 11: 4, 34: 1, 23: 1}
Did not match all atoms present	3282-18-6	C1CC1(C2=CC=CC=C2)C3=CC=CC=C3	{11: 2, 13: 1, 14: 10}
Did not match all atoms present	3282-32-4	C1=CC=C(C=C1)/C(=C\[N+]#N)/[O-]	{34: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	3282-33-5	C1=CC(=CC=C1/C(=C/[N+]#N)/[O-])Cl	{17: 1, 34: 1, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	3282-56-2	CC(C)(C)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	3282-73-3	CCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCC.[Br-]	{1: 4, 2: 22, 18: 1}
Did not match all atoms present	3282-85-7	CCCCC(CC)CCC(CCC(CC)CC)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 10, 3: 3, 29: 3}
Did not match all atoms present	32823-06-6	[O-]P1(=O)OP(=O)(OP(=O)(O1)[O-])[O-].[Al]	{29: 6, 23: 3}
Did not match all atoms present	3283-05-4	C1=CC(=CC=C1N(C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])N(C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)[N+](=O)[O-]	{33: 2, 38: 4, 14: 20}
Did not match all atoms present	3283-07-6	C1=CC(=CC=C1N)N(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N(C4=CC=C(C=C4)N)C5=CC=C(C=C5)N	{33: 2, 30: 4, 14: 20}
Did not match all atoms present	3283-12-3	CP(=O)(C)O	{1: 2, 20: 1, 29: 1}
Did not match all atoms present	32837-75-5	C[N+](C)(C)CCOS(=O)[O-]	{1: 3, 2: 2, 29: 2, 22: 1}
Did not match all atoms present	32838-55-4	C1CCNC(C1)CC2=CC=CC=C2	{32: 1, 2: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	3284-07-9	C1=CC=C(C=C1)N2[Si](N([Si]2(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7	{33: 2, 14: 30}
Did not match all atoms present	32841-23-9	CCCCN(CCCC)C(=S)N	{1: 2, 2: 6, 33: 1, 30: 1, 7: 1}
Did not match all atoms present	32852-21-4	CC1=CSC(=N1)NNC=O	{1: 1, 35: 1, 41: 1, 14: 1, 26: 1, 31: 2}
Did not match all atoms present	32852-81-6	C1=CC=C(C=C1)OC2=CC=CC(=C2)CC(=O)O	{2: 1, 27: 1, 22: 1, 14: 9}
Did not match all atoms present	32852-92-9	CC(=O)C1=CC(=CC=C1)OC2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9}
Did not match all atoms present	32854-75-4	CCN1CC2(CCC(C34C2CC(C31)C5(CC(C6CC4C5(C6OC)O)OC)O)OC)OC(=O)C7=CC=CC=C7NC(=O)C	{1: 5, 2: 1, 33: 1, 11: 6, 12: 8, 13: 4, 14: 4, 20: 2, 22: 3, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	32857-62-8	C1=CC(=CC=C1CC(=O)O)C(F)(F)F	{16: 3, 2: 1, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	32857-63-9	CC(C)(C)C1=CC=C(C=C1)CC(=O)O	{1: 3, 2: 1, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	3286-46-2	CC1=NC=C(C(=N1)N)CN(/C(=C(/SS/C(=C(/N(C=O)CC2=CN=C(N=C2N)C)\C)/CCOC(=O)C(C)C)\CCOC(=O)C(C)C)/C)C=O	{1: 8, 2: 6, 3: 2, 33: 2, 7: 4, 40: 2, 14: 2, 35: 4, 26: 2, 28: 2, 30: 2}
Did not match all atoms present	3286-98-4	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)CC2=CC=CC=C2	{1: 6, 2: 1, 4: 2, 21: 1, 14: 7}
Did not match all atoms present	32861-85-1	COC1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 22: 2, 14: 6, 17: 2}
Did not match all atoms present	32862-97-8	C1=CC(=CC(=C1)Br)/C=C/C(=O)O	{18: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	32863-55-1	CCC[N+]1=CC=C(C2=CC=CC=C21)C.[I-]	{1: 2, 2: 2, 19: 1, 14: 6, 33: 1}
Did not match all atoms present	32863-56-2	CCCC[N+]1=CC=C(C2=CC=CC=C21)C.[I-]	{1: 2, 2: 3, 19: 1, 14: 6, 33: 1}
Did not match all atoms present	32865-61-5	CC(=O)OC1=CC=CC=C1I	{1: 1, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	32865-88-6	CC1=CN=C(N=C1N[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 35: 2, 22: 1, 14: 1, 31: 1}
Did not match all atoms present	32866-11-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{25: 2, 30: 2, 29: 6, 14: 8, 31: 1}
Did not match all atoms present	3287-10-3	CC1=CC(=C(C=C1)C(C)(C)CC(C)(C)C)O	{1: 6, 2: 1, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	3287-99-8	C1=CC=C(C=C1)CN.Cl	{17: 1, 2: 1, 30: 1, 14: 5}
Did not match all atoms present	32871-90-2	COC1=C(C=C2C(=C1)C=[NH+]C=C2CC3=CC=CC=C3)OC.[Br-]	{32: 1, 1: 2, 2: 1, 14: 9, 18: 1, 22: 2}
Did not match all atoms present	32873-14-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCCCCCOC(=O)C4=CC=CC=C4N)N	{2: 6, 14: 9, 21: 1, 22: 1, 25: 2, 28: 1, 30: 2}
Did not match all atoms present	3288-04-8	COC1=CC=CC=C1N=C=S	{8: 1, 1: 1, 34: 1, 22: 1, 14: 4}
Did not match all atoms present	3288-58-2	CCOP(=S)(OCC)SC	{40: 1, 1: 3, 2: 2, 22: 2}
Did not match all atoms present	3288-80-0	C[N+](C)(C)N.[I-]	{1: 3, 19: 1, 30: 1}
Did not match all atoms present	32886-16-1	CCCCCCCCCC(=O)NC(CSCC(=O)OC)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)OC	{1: 3, 2: 11, 3: 2, 40: 1, 14: 4, 21: 1, 24: 2, 28: 2, 31: 2}
Did not match all atoms present	32889-48-8	CC(C)(C#N)NC1=NC(=NC(=N1)NC2CC2)Cl	{1: 2, 35: 3, 4: 1, 37: 1, 11: 2, 12: 1, 17: 1, 31: 2}
Did not match all atoms present	3289-23-4	CC1CCS(=O)(=O)O1	{1: 1, 11: 2, 12: 1, 29: 2, 23: 1}
Did not match all atoms present	3289-50-7	COC1=NC(=NC(=C1)N)OC	{1: 2, 30: 1, 35: 2, 22: 2, 14: 1}
Did not match all atoms present	3289-75-6	C1=CC(=CC=C1NC(=O)CCl)Cl	{24: 1, 17: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	32890-87-2	C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)O	{16: 6, 27: 1, 4: 2, 14: 3}
Did not match all atoms present	32890-94-1	C1=CC(=C(C(=C1)F)C(=O)O)C(F)(F)F	{16: 4, 27: 1, 4: 1, 14: 3}
Did not match all atoms present	32891-29-5	CC1(CCC2CC(CC1N2C)OC(=O)C(C3=CC=CS3)(C4=CC=CS4)O)C.Cl	{1: 3, 4: 1, 33: 1, 41: 2, 11: 4, 12: 3, 13: 1, 14: 6, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	329-00-0	CN(C)C1=CC=CC(=C1)C(F)(F)F	{16: 3, 1: 2, 4: 1, 14: 4, 33: 1}
Did not match all atoms present	329-01-1	C1=CC(=CC(=C1)N=C=O)C(F)(F)F	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 29: 1}
Did not match all atoms present	329-15-7	C1=CC(=CC=C1C(=O)Cl)C(F)(F)F	{16: 3, 17: 1, 4: 1, 14: 4, 24: 1}
Did not match all atoms present	329-20-4	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)F	{1: 1, 14: 4, 16: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	329-30-6	CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)CCl	{1: 1, 2: 2, 3: 1, 14: 9, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	329-63-5	CNCC(C1=CC(=C(C=C1)O)O)O.Cl	{1: 1, 2: 1, 3: 1, 14: 3, 17: 1, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	329-65-7	CNCC(C1=CC(=C(C=C1)O)O)O	{1: 1, 2: 1, 3: 1, 14: 3, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	329-71-5	C1=CC(=C(C=C1[N+](=O)[O-])O)[N+](=O)[O-]	{38: 2, 21: 1, 14: 3}
Did not match all atoms present	329-89-5	C1=CC(=NC=C1C(=O)N)N	{24: 1, 35: 1, 30: 2, 14: 3}
Did not match all atoms present	329-98-6	C1=CC=C(C=C1)CS(=O)(=O)F	{16: 1, 2: 1, 29: 2, 14: 5}
Did not match all atoms present	329-99-7	CP(=O)(OC1CCCCC1)F	{1: 1, 11: 5, 12: 1, 16: 1, 22: 1, 29: 1}
Did not match all atoms present	3290-01-5	C1=CC(=C(C(=C1)Cl)Cl)CCl	{17: 3, 2: 1, 14: 3}
Did not match all atoms present	3290-06-0	C1=C(C=C(C=C1Cl)Cl)CCl	{17: 3, 2: 1, 14: 3}
Did not match all atoms present	3290-24-2	CCCC1=NC2=CC=CC=C2C=C1CC	{1: 2, 2: 3, 35: 1, 14: 5}
Did not match all atoms present	3290-53-7	CC(=C)CC1=CC=CC=C1	{1: 1, 2: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	3290-99-1	COC1=CC=C(C=C1)C(=O)NN	{1: 1, 14: 4, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	32900-09-7	CCNC(=S)NCC=C	{1: 1, 2: 2, 5: 1, 6: 1, 7: 1, 31: 2}
Did not match all atoms present	3291-03-0	COC1=CC(=CC(=C1OC)OC)C(=O)NN	{1: 3, 14: 2, 22: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	32915-71-2	CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCN(CC)CC)C.Cl.[Cl-]	{1: 4, 2: 5, 33: 3, 14: 2, 17: 4}
Did not match all atoms present	32915-78-9	C(=O)([O-])[O-].C(=O)([O-])[O-].[Sr+2].[Ba+2]	{24: 2}
Did not match all atoms present	3292-42-0	C1=CC=C(C(=C1)N)S.Cl	{17: 1, 30: 1, 14: 4, 39: 1}
Did not match all atoms present	32921-15-6	CCOC1=CC=C(C=C1)C(=O)C2=CN=CC=C2	{1: 1, 2: 1, 35: 1, 14: 8, 22: 1, 24: 1}
Did not match all atoms present	32921-23-6	C1CCC(CC1)C(=O)C2=CC=NC=C2	{24: 1, 35: 1, 11: 5, 12: 1, 14: 4}
Did not match all atoms present	32937-02-3	C12=C(C3=C(C4=C1C(C4(F)F)(F)F)C(C3(F)F)(F)F)C(C2(F)F)(F)F	{16: 12, 13: 6}
Did not match all atoms present	3294-03-9	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)SC2=C(C=CC(=C2)C(C)(C)CC(C)(C)C)O	{1: 10, 2: 2, 4: 4, 40: 1, 14: 6, 21: 2}
Did not match all atoms present	3294-57-3	C1=CC=C(C=C1)[Hg]C(Cl)(Cl)Cl	{17: 3, 4: 1, 14: 5}
Did not match all atoms present	32940-15-1	COC1=CC=CC2=C1CCC(=O)C2	{1: 1, 11: 3, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	32941-23-4	CCOC1=CC=C(C=C1)C(=O)C2=CC=CC=N2	{1: 1, 2: 1, 35: 1, 14: 8, 22: 1, 24: 1}
Did not match all atoms present	32941-30-3	CCCCCCC(=O)C1=CC=NC=C1	{24: 1, 1: 1, 2: 5, 35: 1, 14: 4}
Did not match all atoms present	32949-37-4	C1=CC=C(C=C1)C2=NN(C(=O)C=C2)CO	{33: 1, 2: 1, 35: 1, 14: 7, 20: 1, 25: 1}
Did not match all atoms present	3295-92-9	CC(C)OC(=O)N(C)C1=CC=CC=C1	{1: 3, 3: 1, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	32953-14-3	CCNC1=CC2=C(C=C1)OCO2	{1: 1, 2: 1, 11: 1, 14: 3, 23: 2, 31: 1}
Did not match all atoms present	32954-43-1	CCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]	{24: 2, 1: 3, 2: 18, 31: 1}
Did not match all atoms present	32954-58-8	CC(CCC(=O)C1=COC=C1)O	{1: 1, 2: 2, 3: 1, 14: 3, 20: 1, 23: 1, 24: 1}
Did not match all atoms present	3296-05-7	C1=CC(=CC=C1N=[N+]=[N-])Cl	{17: 1, 34: 2, 14: 4}
Did not match all atoms present	32965-49-4	C=CCCC=C.C=CCCC=C.[Cl-].[Cl-].[Rh].[Rh]	{17: 2, 2: 4, 5: 4, 6: 4}
Did not match all atoms present	3297-72-1	C1=CC=C(C=C1)C2=NC=CC3=CC=CC=C32	{35: 1, 14: 11}
Did not match all atoms present	329735-72-0	CC1=[C-]CC=C1.CC1=[C-]CC=C1.CC1=[C-]CC=C1.[Y+3]	{1: 3, 11: 3, 14: 6, 15: 3}
Did not match all atoms present	329735-73-1	CC(C)C1=[C-]CC=C1.CC(C)C1=[C-]CC=C1.CC(C)C1=[C-]CC=C1.[Y+3]	{11: 3, 1: 6, 3: 3, 14: 6, 15: 3}
Did not match all atoms present	32974-92-8	CCC1=NC=CN=C1C(=O)C	{24: 1, 1: 2, 2: 1, 35: 2, 14: 2}
Did not match all atoms present	32976-87-7	[2H]C1=C(C(=C2C(=C1[2H])C(=C(C3=C(C4=C(C(=C(C(=C4C(=C32)C([2H])([2H])[2H])[2H])[2H])[2H])[2H])C([2H])([2H])[2H])[2H])[2H])[2H])[2H]	{1: 2, 14: 10}
Did not match all atoms present	32981-86-5	CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O	{1: 5, 11: 3, 12: 6, 13: 4, 14: 5, 15: 2, 20: 4, 23: 1, 25: 1, 28: 2}
Did not match all atoms present	3299-99-8	CC(C)C1C2=CC=CC=C2C3=CC=CC=C13	{1: 2, 3: 1, 12: 1, 14: 8}
Did not match all atoms present	32993-05-8	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.Cl[Ru]	{17: 1, 14: 35}
Did not match all atoms present	32997-03-8	CC(C)(C)[Pb](C)(C)C	{1: 6, 4: 1}
Did not match all atoms present	32997-62-9	[H-].[H-].[H-].[Yb+3]	{}
Did not match all atoms present	32998-00-8	C1(=NC(=O)N=C(N1)Cl)[O-].[Na+]	{32: 1, 17: 1, 35: 2, 25: 1}
Did not match all atoms present	32999-80-7	C1=C(NC=N1)C[C@@H](C(=O)NCC(=O)NCC(=O)O)N	{32: 1, 2: 3, 3: 1, 14: 2, 35: 1, 24: 2, 27: 1, 30: 1, 31: 2}
Did not match all atoms present	330-11-0	C1=CC(=CC=C1C(=O)F)OC(F)(F)F	{16: 4, 24: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	330-12-1	C1=CC(=CC=C1C(=O)O)OC(F)(F)F	{16: 3, 27: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	330-54-1	CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl	{1: 2, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	330-55-2	CN(C(=O)NC1=CC(=C(C=C1)Cl)Cl)OC	{1: 2, 33: 1, 14: 3, 17: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	330-64-3	CC(C)C1=CC(=CC(=C1)OC(=O)NC)C(C)C	{1: 5, 3: 2, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	330-68-7	C1=CC=C(C=C1)NC(=O)CF	{16: 1, 24: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	330-84-7	C1=CC=C(C=C1)OC2=CC=C(C=C2)F	{16: 1, 22: 1, 14: 9}
Did not match all atoms present	330-93-8	C1=CC(=CC=C1OC2=CC=C(C=C2)F)F	{16: 2, 22: 1, 14: 8}
Did not match all atoms present	330-95-0	CC1=CC(=NC(=O)N1)C.C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 1: 2, 35: 1, 38: 2, 14: 9, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	3300-51-4	C1=CC(=CC=C1CN)C(F)(F)F	{16: 3, 2: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	3300-67-2	C1=CC=C(C=C1)C(=O)/C=C/C2=CC=CC=C2Cl	{24: 1, 17: 1, 14: 9, 6: 2}
Did not match all atoms present	33005-95-7	CC(C1=CC=C(S1)C(=O)C2=CC=CC=C2)C(=O)O	{1: 1, 3: 1, 41: 1, 14: 7, 24: 1, 27: 1}
Did not match all atoms present	33006-24-5	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC=C1C=CC2=CC=C(C=C2)N(C)C	{1: 4, 33: 2, 14: 12, 6: 2, 29: 3}
Did not match all atoms present	33006-46-1	CCN1C(=O)C(C(=O)N(C1=S)CC)/C=C/C=C/C=C2C(=O)N(C(=S)N(C2=O)CC)CC.C1=CC=NC=C1	{1: 4, 2: 4, 35: 1, 6: 5, 33: 4, 12: 1, 14: 5, 15: 3, 25: 4}
Did not match all atoms present	33006-80-3	CCN1C2=CC=CC=C2SC1=CC=C3C(=O)N(C(=C4C(=O)N(C(=S)S4)CC(=O)O)S3)CC(=O)O	{1: 1, 2: 3, 6: 2, 33: 3, 41: 3, 14: 4, 15: 3, 25: 2, 27: 2}
Did not match all atoms present	33008-68-3	CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)NC2=NN(C(=O)C2)C3=C(C=C(C=C3OC)Cl)Cl	{1: 2, 2: 11, 35: 1, 33: 1, 11: 1, 14: 6, 15: 1, 17: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	3301-75-5	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)C=O	{26: 1, 35: 1, 14: 10}
Did not match all atoms present	3301-79-9	C1=CC2=C(C=C1C(=O)O)C3(C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O)OC2=O	{13: 1, 14: 9, 21: 2, 23: 1, 27: 1, 28: 1}
Did not match all atoms present	33010-07-0	CC(C)[CH2-].CC(C)[CH2-].[Pt+2]	{1: 4, 3: 2, 5: 2}
Did not match all atoms present	33012-33-8	[CH3-].[CH3-].[CH3-].C[PH+](C)C.[Au]	{1: 3}
Did not match all atoms present	3302-51-0	C=C1C2=CC=CC=C2C(=C)C3=CC=CC=C13	{5: 2, 14: 8}
Did not match all atoms present	3302-52-1	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6C=CC=CC6C5=O)C2=O	{25: 2, 12: 2, 14: 12}
Did not match all atoms present	3302-87-2	C1CCP(C1)C2=CC=CC=C2	{11: 4, 14: 5}
Did not match all atoms present	33020-34-7	CC(C)[Hg].O	{1: 2, 3: 1}
Did not match all atoms present	33021-47-5	C12=C(C3=C(C4=C1C(C(C4(F)F)(F)F)(F)F)C(C(C3(F)F)(F)F)(F)F)C(C(C2(F)F)(F)F)(F)F	{16: 18, 13: 9}
Did not match all atoms present	33022-24-1	C[Si]1(C2=CC=CC=C2[Si](C3=CC=CC=C31)(C)C)C	{1: 4, 14: 8}
Did not match all atoms present	33024-33-8	C1=C(SC(=N1)NC(=O)N(CCCl)N=O)[N+](=O)[O-]	{33: 1, 2: 2, 35: 1, 38: 1, 41: 1, 34: 1, 14: 1, 17: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	33024-34-9	CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(CCCl)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 14: 4, 17: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	33024-69-0	CNC(=O)NS(=O)(=O)C	{24: 1, 1: 2, 29: 2, 31: 2}
Did not match all atoms present	33025-41-1	C1=CC(=CC=C1C2=C(C(=C(C=C2)Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	33026-77-6	C1=CC=C(C=C1)CONC(=O)NC2=CC=CC=C2	{24: 1, 2: 1, 22: 1, 14: 10, 31: 2}
Did not match all atoms present	33034-67-2	C1=CN=C(N=C1C(F)(F)F)Cl	{16: 3, 17: 1, 35: 2, 4: 1, 14: 2}
Did not match all atoms present	3304-70-9	COC(=O)C1=C(N=CN1)C(=O)OC	{32: 1, 1: 2, 35: 1, 28: 2, 14: 1}
Did not match all atoms present	3304-97-0	CC(C)(C)SSC(=S)N(C)C	{40: 2, 1: 5, 4: 1, 33: 1, 7: 1}
Did not match all atoms present	33059-05-1	CC(C)CCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 2, 2: 5, 3: 1, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	3306-36-3	CCC(C)OC(=O)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	3306-62-5	C1=CC=C(C(=C1)N)S(=O)(=O)N	{30: 2, 29: 2, 14: 4}
Did not match all atoms present	3306-93-2	CCOC(=O)C1=C2C=CC=CN2C3=C1C(=O)C4=CC=CC=C4C3=O	{1: 1, 2: 1, 33: 1, 14: 8, 25: 2, 28: 1}
Did not match all atoms present	33067-78-6	CN(CC(=O)[O-])N=NC1=C(C=CC(=C1)Cl)OC.[Na+]	{1: 2, 2: 1, 33: 1, 34: 2, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	33069-62-4	CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C	{1: 6, 3: 2, 11: 3, 12: 6, 13: 4, 14: 15, 15: 2, 20: 3, 23: 1, 24: 1, 25: 1, 28: 4, 31: 1}
Did not match all atoms present	3307-31-1	CCCCCCCCC1=C(C(=CC=C1)CCCCCCCC)O	{1: 2, 2: 14, 21: 1, 14: 3}
Did not match all atoms present	33077-69-9	CCOC1=CC=C(C=C1)C(=O)C2=CC=NC=C2	{1: 1, 2: 1, 35: 1, 14: 8, 22: 1, 24: 1}
Did not match all atoms present	33077-70-2	C1=CC=NC(=C1)C(=O)C2=CC=C(C=C2)O	{24: 1, 35: 1, 21: 1, 14: 8}
Did not match all atoms present	33079-11-7	C1COCCN1C(=O)C2=C(C3=CC=CC=C3C=C2)O	{33: 1, 11: 4, 14: 6, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	3308-51-8	C(CN)COP(=O)(N(CCCl)CCCl)O	{33: 1, 2: 7, 17: 2, 20: 1, 22: 1, 29: 1, 30: 1}
Did not match all atoms present	3308-64-3	CC1=C2C(CC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1)O	{1: 1, 11: 1, 12: 1, 14: 9, 20: 1}
Did not match all atoms present	3308-94-9	C1COC(O1)(CCCCl)C2=CC=C(C=C2)F	{2: 3, 11: 2, 13: 1, 14: 4, 16: 1, 17: 1, 23: 2}
Did not match all atoms present	33082-80-3	CC(C)(CC1=CC=CC=C1)NC(=O)NCCCl	{1: 2, 2: 3, 4: 1, 14: 5, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	33082-88-1	C1CCC(CC1)(C2=CC=C(C=C2)F)NC(=O)NCCCl	{2: 2, 11: 5, 13: 1, 14: 4, 16: 1, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	33082-92-7	COC(=O)NC1=NC2=CC=CC=C2NS1	{32: 1, 1: 1, 35: 1, 41: 1, 14: 4, 15: 1, 28: 1, 31: 1}
Did not match all atoms present	33089-61-1	CC1=CC(=C(C=C1)N=CN(C)C=NC2=C(C=C(C=C2)C)C)C	{1: 5, 34: 2, 14: 6, 6: 2, 33: 1}
Did not match all atoms present	3309-77-1	CC(=CC(=O)OCC1=CC=C(C=C1)Cl)OP(=O)(OC)OC	{1: 3, 2: 1, 6: 1, 7: 1, 14: 4, 17: 1, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	33091-17-7	C1=C(C(=C(C(=C1Cl)Cl)Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl)Cl	{17: 8, 14: 2}
Did not match all atoms present	33094-66-5	C1=CC=C2C(=C1)C=C(O2)[N+](=O)[O-]	{38: 1, 14: 5, 23: 1}
Did not match all atoms present	33094-74-5	CC1=C(OC2=C1C=C(C=C2)Cl)[N+](=O)[O-]	{1: 1, 23: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	33097-39-1	C1=CC(=NN=C1F)F	{16: 2, 35: 2, 14: 2}
Did not match all atoms present	33098-26-9	CCC(C)C(CN(C)C)C1=NC2=CC=CC=C2C=C1	{1: 4, 2: 2, 3: 2, 33: 1, 14: 6, 35: 1}
Did not match all atoms present	33098-65-6	CCC1=CC=CC=C1NC(=O)C	{24: 1, 1: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	33098-80-5	CC(=O)NC1=C(C=CC=C1Br)Br	{24: 1, 1: 1, 18: 2, 14: 3, 31: 1}
Did not match all atoms present	331-25-9	C1=CC(=CC(=C1)F)CC(=O)O	{16: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	331-39-5	C1=CC(=C(C=C1/C=C/C(=O)O)O)O	{27: 1, 14: 3, 6: 2, 21: 2}
Did not match all atoms present	331-54-4	C1=CC(=CC(=C1)Cl)NCC(F)F	{2: 1, 3: 1, 14: 4, 16: 2, 17: 1, 31: 1}
Did not match all atoms present	331-91-9	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2F	{16: 1, 1: 2, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	3311-98-6	C1=C(SC(=N1)NC(=O)NCCCl)[N+](=O)[O-]	{2: 2, 35: 1, 38: 1, 41: 1, 14: 1, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	33113-08-5	C(=O)(O)O.N.[Cu+].[Cu+2]	{27: 2}
Did not match all atoms present	33114-15-7	C1C=CC=[C-]1.[Cl-].[Cl-].[Cl-].[Cl-].[Nb+5]	{17: 4, 11: 1, 14: 3}
Did not match all atoms present	33119-65-2	C1=CC=C(C=C1)C2=COC(=N2)N	{35: 1, 30: 1, 14: 6, 23: 1}
Did not match all atoms present	3312-04-7	C1=CC(=CC=C1C(CCCCl)C2=CC=C(C=C2)F)F	{16: 2, 17: 1, 2: 3, 3: 1, 14: 8}
Did not match all atoms present	3312-83-2	C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)N=[N+]=[N-]	{34: 2, 3: 1, 28: 1, 14: 10}
Did not match all atoms present	33125-86-9	C(COP(=O)(OCCCl)OCCCl)OP(=O)(OCCCl)OCCCl	{17: 4, 2: 10, 29: 2, 22: 6}
Did not match all atoms present	33125-97-2	CCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 33: 1, 14: 7, 35: 1, 28: 1}
Did not match all atoms present	33129-84-9	CC(C)(C)C1=CC=C(C=C1)OC(=O)Cl	{1: 3, 4: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	3313-92-6	C(=O)([O-])OOC(=O)[O-].[Na+].[Na+]	{}
Did not match all atoms present	33130-03-9	COC1=C(C(=C(C=C1)C=CC(=O)O)OC)OC	{1: 3, 22: 3, 27: 1, 14: 2, 6: 2}
Did not match all atoms present	33132-61-5	CCC(C)C(CN(C)C)C1=CC=CC=C1	{1: 4, 2: 2, 3: 2, 14: 5, 33: 1}
Did not match all atoms present	33132-75-1	CCC(C)C(CN(C)C)C1=CC=C(C=C1)N	{1: 4, 2: 2, 3: 2, 33: 1, 14: 4, 30: 1}
Did not match all atoms present	3314-35-0	C1CN(N=C1N)C2=CC=CC=C2	{33: 1, 35: 1, 11: 2, 14: 5, 15: 1, 30: 1}
Did not match all atoms present	33144-12-6	CC1=C(C(=C(C(=C1[N+](=O)[O-])C)S(=O)(=O)O)C)[N+](=O)[O-]	{1: 3, 20: 1, 29: 2, 38: 2}
Did not match all atoms present	33144-86-4	CC1=NC(=NN1)[Se]	{32: 1, 1: 1, 35: 2}
Did not match all atoms present	33145-10-7	CC1=CC(=C(C(=C1)C(C2=CC(=CC(=C2O)C)C)C(C)C)O)C	{1: 6, 3: 2, 21: 2, 14: 4}
Did not match all atoms present	33146-45-1	C1=CC=C(C=C1)C2=C(C=CC=C2Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	3315-16-0	C(#N)[O-].[Ag+]	{29: 1, 37: 1}
Did not match all atoms present	33150-87-7	CCC1=CC2=C(C=C1)SC3=CC=CC=C3N2CC(C)CN(C)C.Cl	{1: 4, 2: 3, 3: 1, 33: 2, 41: 1, 14: 7, 17: 1}
Did not match all atoms present	33151-84-7	C[C-]1C(=C(C(=C1C)C)C)C.[Ti](Br)(Br)Br	{1: 5, 18: 3}
Did not match all atoms present	3316-02-7	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)O)S(=O)(=O)O)S(=O)(=O)O	{20: 3, 21: 1, 14: 4, 29: 6}
Did not match all atoms present	3316-09-4	C1=CC(=C(C=C1[N+](=O)[O-])O)O	{38: 1, 21: 2, 14: 3}
Did not match all atoms present	3316-24-3	COC1=CC=CC=C1/C=C/[N+](=O)[O-]	{1: 1, 22: 1, 38: 1, 14: 4, 6: 2}
Did not match all atoms present	3316-46-9	CC(=O)OC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC(=O)C)OC(=O)C	{1: 3, 25: 1, 28: 3, 14: 7, 23: 1}
Did not match all atoms present	3317-67-7	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Co+2]	{35: 8, 14: 16}
Did not match all atoms present	33175-34-7	C1=CC(=C(C=C1NO)Cl)Cl	{17: 2, 20: 1, 14: 3, 31: 1}
Did not match all atoms present	3318-61-4	CC(=O)CC(=O)CC1=CC=CC=C1	{24: 2, 1: 1, 2: 2, 14: 5}
Did not match all atoms present	33184-16-6	CC1=C(C=C(C=C1)F)C(=O)O	{16: 1, 1: 1, 27: 1, 14: 3}
Did not match all atoms present	33184-48-4	CC1=C(C=C(C=C1)Cl)I	{1: 1, 19: 1, 14: 3, 17: 1}
Did not match all atoms present	33189-33-2	CC(CC1=CC2=C(C(=C1)OC)OCO2)N.Cl	{1: 2, 2: 1, 3: 1, 11: 1, 14: 2, 17: 1, 22: 1, 23: 2, 30: 1}
Did not match all atoms present	3319-03-7	CN(C)CC(=O)C1=CC=CC=C1	{24: 1, 1: 2, 2: 1, 14: 5, 33: 1}
Did not match all atoms present	3319-15-1	CC(C1=CC=C(C=C1)OC)O	{1: 2, 3: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	3319-31-1	CCCCC(CC)COC(=O)C1=CC(=C(C=C1)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC	{1: 6, 2: 15, 3: 3, 28: 3, 14: 3}
Did not match all atoms present	33197-77-2	CN1C=CC(=CC=C2C=CC=C2)C=C1.[CH-]1C=CC=C1.[Fe+2].[I-]	{1: 1, 6: 2, 33: 1, 14: 13, 15: 2, 19: 1}
Did not match all atoms present	332-07-0	C1=CC(=CC=C1N=NC2=CC=C(C=C2)F)F	{16: 2, 34: 2, 14: 8}
Did not match all atoms present	332-25-2	C1=CC(=CC=C1C#N)OC(F)(F)F	{16: 3, 4: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	332-34-3	COC1=CC=C(C=C1)NC(=O)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	332-48-9	C1=CC(=CC=C1OCCBr)F	{16: 1, 2: 2, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	332-54-7	CN(C)C1=CC=C(C=C1)N=NC2=CC(=CC=C2)F	{16: 1, 1: 2, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	332-80-9	CN1C=C(N=C1)C[C@@H](C(=O)O)N	{1: 1, 2: 1, 3: 1, 33: 1, 14: 2, 35: 1, 27: 1, 30: 1}
Did not match all atoms present	3320-83-0	C1=CC=C(C(=C1)N=C=O)Cl	{8: 1, 17: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	3320-86-3	C1=CC=C(C(=C1)N=C=O)[N+](=O)[O-]	{8: 1, 34: 1, 38: 1, 29: 1, 14: 4}
Did not match all atoms present	3320-87-4	C1=CC(=CC(=C1)[N+](=O)[O-])N=C=O	{8: 1, 34: 1, 38: 1, 29: 1, 14: 4}
Did not match all atoms present	33209-85-7	CC1=C(N=NN=C1C)C	{1: 3, 35: 3}
Did not match all atoms present	3321-03-7	C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)CN	{2: 2, 3: 1, 14: 5, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	3321-80-0	CN1CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{1: 1, 4: 1, 33: 1, 11: 4, 12: 1, 14: 10, 20: 1, 28: 1}
Did not match all atoms present	3321-86-6	C1=CC=C2C(=C1)C(=C=C=C3C4=CC=CC=C4C(=O)C5=CC=CC=C53)C6=CC=CC=C6C2=O	{8: 2, 25: 2, 14: 16, 15: 2}
Did not match all atoms present	3321-92-4	CC(=O)C1=CC(=CC(=C1O)Cl)Cl	{24: 1, 1: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	33213-65-9	C1[C@H]2[C@@H](COS(=O)O1)C3(C(=C([C@@]2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{11: 2, 12: 2, 13: 3, 15: 2, 17: 6, 23: 2, 29: 1}
Did not match all atoms present	33216-52-3	C1=C(C(=C(C=N1)Cl)Cl)Cl	{17: 3, 35: 1, 14: 2}
Did not match all atoms present	33225-03-5	C1CCNC(C1)C(C2=CC(=NC3=C(C=C(C=C23)Cl)Cl)C4=CC=CC=C4)O	{32: 1, 3: 1, 11: 4, 12: 1, 14: 8, 17: 2, 35: 1, 20: 1}
Did not match all atoms present	33226-98-1	CNC1=C2C(=C(C=C1)NC3=CC=C(C=C3)OC)C(=O)C4=CC=CC=C4C2=O	{1: 2, 31: 2, 22: 1, 14: 10, 25: 2}
Did not match all atoms present	33228-44-3	CCCCCC1=CC=C(C=C1)N	{1: 1, 2: 4, 30: 1, 14: 4}
Did not match all atoms present	33228-45-4	CCCCCCC1=CC=C(C=C1)N	{1: 1, 2: 5, 30: 1, 14: 4}
Did not match all atoms present	33229-34-4	C1=CC(=C(C=C1N(CCO)CCO)[N+](=O)[O-])NCCO	{33: 1, 2: 6, 38: 1, 14: 3, 20: 3, 31: 1}
Did not match all atoms present	33233-29-3	CCCCCCCCCCCCCCCCCCOC(=O)C1=CN=CC=C1	{1: 1, 2: 17, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	33236-07-6	CCC1(CNC(=NC1)C(C2=CC=CC=C2)OCC)C	{32: 1, 1: 3, 2: 2, 3: 1, 11: 2, 13: 1, 14: 5, 15: 1, 35: 1, 22: 1}
Did not match all atoms present	3324-58-1	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-].[Na+]	{38: 3, 14: 2}
Did not match all atoms present	3324-99-0	CN(C)C1=CC2=C(C=C1)[NH+]=C3C(=CC=C4C3=CC(=O)C=C4)O2.[Cl-]	{32: 1, 1: 2, 33: 1, 14: 8, 17: 1, 23: 1, 25: 1}
Did not match all atoms present	33240-34-5	C1CC[CH-]C1.[Mg+2].[Br-]	{18: 1, 11: 4, 14: 1}
Did not match all atoms present	33244-00-7	C1=CC=C(C=C1)/C(=N/NC2=CC=CC=C2)/N.Cl	{34: 1, 7: 1, 14: 10, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	33244-95-0	CC(C)NC(=O)C1=CC(=CC(=C1)Cl)Cl	{1: 2, 3: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	33245-39-5	CCCN(CCCl)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]	{1: 1, 2: 4, 4: 1, 38: 2, 33: 1, 14: 2, 16: 3, 17: 1}
Did not match all atoms present	3325-10-8	CCN1C2=CC(=C(C=C2[N+](=C1C=CC=C3N(C4=CC(=C(C=C4N3CCC(C)S(=O)(=O)[O-])Cl)Cl)CC)CCC(C)S(=O)(=O)O)Cl)Cl	{1: 4, 2: 6, 3: 2, 6: 3, 33: 4, 14: 4, 15: 1, 17: 4, 20: 1, 29: 5}
Did not match all atoms present	3325-11-9	C1=CC2=NNN=C2C=C1N	{32: 1, 35: 2, 30: 1, 14: 3}
Did not match all atoms present	33251-51-3	C1CN=C(N1)[Se]	{32: 1, 35: 1, 11: 2, 15: 1}
Did not match all atoms present	33259-72-2	CC1=NC(=C(C=C1)N)N	{1: 1, 35: 1, 30: 2, 14: 2}
Did not match all atoms present	3326-32-7	C1=CC2=C(C=C1N=C=S)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O	{34: 1, 8: 1, 13: 1, 14: 9, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	3326-34-9	C1=CC2=C(C=C1N)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O	{13: 1, 14: 9, 21: 2, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	3326-71-4	C1=COC(=C1)C(=O)NN	{24: 1, 31: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	33265-60-0	C1=CC=C(C(=C1)N2C=CC=C2)[N+](=O)[O-]	{33: 1, 38: 1, 14: 8}
Did not match all atoms present	3327-06-8	COC(=O)C1=CC(=C(C(=C1C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC	{1: 5, 28: 5, 14: 1}
Did not match all atoms present	3327-22-8	C[N+](C)(C)CC(CCl)O.[Cl-]	{1: 3, 2: 2, 3: 1, 20: 1, 17: 2}
Did not match all atoms present	3327-61-5	C[Si](C)(C)OCC1C(C(C(C(O1)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 15, 2: 1, 12: 5, 22: 5, 23: 1}
Did not match all atoms present	33273-09-5	C1=CC2=CC3=C4NC(=C3C=C2C=C1)NC5=C6C=C7C=CC=CC7=CC6=C([N-]5)NC8=C9C=C1C=CC=CC1=CC9=C(N8)NC1=C2C=C3C=CC=CC3=CC2=C(N4)[N-]1.[Cu+2]	{32: 6, 35: 2, 14: 24}
Did not match all atoms present	33273-14-2	C1=CC2=CC3=C4NC(=C3C=C2C=C1)NC5=C6C=C7C=CC=CC7=CC6=C8N5[Al](N9C(=C1C=C2C=CC=CC2=CC1=C9NC1=C2C=C3C=CC=CC3=CC2=C(N1)N8)N4)Cl	{32: 6, 17: 1, 14: 24, 33: 2}
Did not match all atoms present	33273-26-6	CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3O2.Cl[Zn-](Cl)Cl	{1: 4, 2: 4, 35: 1, 33: 2, 14: 6, 17: 3, 23: 1}
Did not match all atoms present	3328-33-4	COP(=O)(C(=C)OP(=O)(OC)OC)OC	{1: 4, 29: 2, 5: 1, 22: 5, 7: 1}
Did not match all atoms present	3328-86-7	C1=CC=C(C=C1)C2=CC(=CS2)C3=CC=CC=C3	{41: 1, 14: 12}
Did not match all atoms present	33284-50-3	C1=CC=C(C=C1)C2=C(C=C(C=C2)Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	33284-52-5	C1=C(C=C(C=C1Cl)Cl)C2=CC(=CC(=C2)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	33284-53-6	C1=CC=C(C=C1)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	33287-50-2	C[SiH](C)C1=CC=C(C=C1)[Si](Cl)(Cl)Cl	{1: 2, 14: 4, 17: 3}
Did not match all atoms present	33292-37-4	C[C-]1[CH-][CH-][CH-][CH-]1.C[C-]1C=CC=C1.[Ru]	{1: 2, 14: 8}
Did not match all atoms present	333-20-0	C(#N)[S-].[K+]	{37: 1}
Did not match all atoms present	333-27-7	COS(=O)(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 29: 2, 22: 1}
Did not match all atoms present	333-31-3	CC(C[N+](C)(C)C)OC(=O)C.[Br-]	{1: 5, 2: 1, 3: 1, 28: 1, 18: 1}
Did not match all atoms present	333-41-5	CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C	{1: 5, 2: 2, 3: 1, 14: 1, 35: 2, 22: 3}
Did not match all atoms present	333-47-1	C1=CC(=CC=C1SC(F)(F)F)Br	{16: 3, 40: 1, 18: 1, 4: 1, 14: 4}
Did not match all atoms present	333-49-3	C1=C(NC(=S)N=C1)N	{32: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	33301-21-2	C1C2=CC=CC=C2C(=O)C3=CC=CC=C3S1(=O)=O	{25: 1, 11: 1, 29: 2, 14: 8}
Did not match all atoms present	33306-54-6	[CH-]1[CH-][C-]([C-]([CH-]1)Cl)Cl.C1=C[C-](C(=C1)Cl)Cl.[Fe]	{17: 4, 14: 6}
Did not match all atoms present	33306-55-7	[CH-]1[CH-][C-]([C-]([C-]1Cl)Cl)Cl.C1=C([C-](C(=C1)Cl)Cl)Cl.[Fe]	{17: 6, 14: 4}
Did not match all atoms present	33306-56-8	[CH-]1[C-]([C-]([C-]([C-]1Cl)Cl)Cl)Cl.C1=C([C-](C(=C1Cl)Cl)Cl)Cl.[Fe]	{17: 8, 14: 2}
Did not match all atoms present	3331-46-2	C1CC2=C(C=C3C=CC4=C5C3=C2C=CC5=CC=C4)C(=O)C1	{25: 1, 11: 3, 14: 8}
Did not match all atoms present	33310-62-2	CCCCC(CCN1CCCCC1)(CN=CC(CCCC)(CCN2CCCCC2)C3=CC=CC4=CC=CC=C43)C5=CC=CC6=CC=CC=C65	{1: 2, 2: 11, 4: 2, 6: 1, 33: 2, 11: 10, 34: 1, 14: 14}
Did not match all atoms present	33317-65-6	C(C[Si](CCCCl)(Cl)Cl)CCl	{17: 4, 2: 6}
Did not match all atoms present	33319-19-6	C1=CN=C2C(=C(C(=C(C2=N1)F)F)F)F	{16: 4, 35: 2, 14: 2}
Did not match all atoms present	33322-60-0	CN(C)C(=O)C1=CC(=CC=C1)N	{24: 1, 1: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	3333-13-9	CC1=CC=C(C=C1)CC=C	{1: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	3333-15-1	C1=CC=C(C=C1)CC(C2=CC=CC=C2)C(=O)O	{27: 1, 2: 1, 3: 1, 14: 10}
Did not match all atoms present	3333-20-8	CC1=CC(=CC=C1)CC=C	{1: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	3333-23-1	C1CC2=CC=CC=C2C(=C1)C(=O)O	{27: 1, 11: 2, 14: 5, 15: 1}
Did not match all atoms present	3333-67-3	C(=O)([O-])[O-].[Ni+2]	{24: 1}
Did not match all atoms present	3333-85-5	COC1=CC2=C(C=C1)C(=C(O2)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCC5.Cl	{1: 1, 2: 2, 33: 1, 11: 4, 14: 12, 17: 1, 22: 2, 23: 1}
Did not match all atoms present	33330-91-5	CN(C)N=NC1=CC=C(C=C1)C(=O)N	{1: 2, 34: 2, 33: 1, 14: 4, 24: 1, 30: 1}
Did not match all atoms present	33332-28-4	C1=C(N=C(C=N1)Cl)N	{17: 1, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	3334-89-2	C1CN(C1)C2=CC=CC=C2	{33: 1, 11: 3, 14: 5}
Did not match all atoms present	33340-33-9	CC(=O)NC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N)C(=O)C4=C(C3=O)C=CC(=C4S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 14: 8, 24: 1, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	33342-05-1	CC1(C2=C(C=C(C=C2)OC)C(=O)N(C1=O)CCC3=CC=C(C=C3)S(=O)(=O)NC(=O)NC4CCCCC4)C	{1: 3, 2: 2, 33: 1, 11: 5, 12: 1, 13: 1, 14: 7, 22: 1, 24: 1, 25: 2, 29: 2, 31: 2}
Did not match all atoms present	33347-85-2	C1=CC=[NH+]C=C1.C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)[O-]	{32: 1, 38: 1, 14: 9, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	33356-85-3	CC1=CC=C(C=C1)C=CC=C	{1: 1, 14: 4, 5: 1, 6: 3}
Did not match all atoms present	33357-44-7	CCC1=NC2=CC=CC=C2C(=C1)C	{1: 2, 2: 1, 35: 1, 14: 5}
Did not match all atoms present	3336-39-8	COC1=C(C=C(C=C1Br)C#N)Br	{1: 1, 18: 2, 22: 1, 14: 2, 37: 1}
Did not match all atoms present	3336-41-2	C1=C(C=C(C(=C1Cl)O)Cl)C(=O)O	{17: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	3336-58-1	C(=O)(C(F)(F)F)[O-].[NH4+]	{16: 3, 24: 1, 4: 1}
Did not match all atoms present	33368-94-4	CC1C(=O)NC(=S)N1	{32: 2, 1: 1, 12: 1, 25: 1, 15: 1}
Did not match all atoms present	33369-45-8	CC1=CN(C(=C1C(=O)O)CC(=O)O)C	{1: 2, 2: 1, 27: 2, 14: 1, 33: 1}
Did not match all atoms present	3337-59-5	COC(=O)C1=CC(=C(C(=C1)Cl)O)Cl	{1: 1, 28: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	3337-62-0	C1=C(C=C(C(=C1Br)O)Br)C(=O)O	{18: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	3337-71-1	COC(=O)NS(=O)(=O)C1=CC=C(C=C1)N	{1: 1, 14: 4, 28: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	33372-39-3	C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(S3)[N+](=O)[O-])N(CCO)CCO	{33: 1, 2: 4, 35: 2, 38: 1, 41: 1, 14: 6, 20: 2}
Did not match all atoms present	33372-40-6	C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(S3)[N+](=O)[O-])NCC(CO)O	{2: 2, 35: 2, 38: 1, 41: 1, 14: 6, 3: 1, 20: 2, 31: 1}
Did not match all atoms present	33374-34-4	C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)OC(=O)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br	{18: 10}
Did not match all atoms present	33374-48-0	CCCCP(C)CCCC	{1: 3, 2: 6}
Did not match all atoms present	33375-06-3	CC(C1=CC=CC=C1)N=C=O	{1: 1, 34: 1, 3: 1, 8: 1, 14: 5, 29: 1}
Did not match all atoms present	33376-96-4	CC1=NC2=NC=NN2C(=C1)N	{1: 1, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	3338-24-7	CCOP(=S)(OCC)[S-].[Na+]	{1: 2, 2: 2, 22: 2}
Did not match all atoms present	33384-03-1	CC(=O)N(C1=CC=C(C=C1)CCC2=CC=CC=C2)O	{1: 1, 2: 2, 33: 1, 14: 9, 20: 1, 24: 1}
Did not match all atoms present	33389-33-2	C1=CC=C2C(=C1)C(=O)NC(N2)C3=CC=C(S3)[N+](=O)[O-]	{32: 2, 38: 1, 41: 1, 12: 1, 14: 6, 25: 1}
Did not match all atoms present	33389-36-5	C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(S3)[N+](=O)[O-])NCCO	{2: 2, 35: 2, 38: 1, 41: 1, 14: 6, 20: 1, 31: 1}
Did not match all atoms present	3339-73-9	C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(=O)O	{25: 2, 2: 2, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	33390-21-5	CC1=CC(=CC2=C1C(=O)C3=C(O2)C(=C4C(=C3O)C(=O)C=C(C4=O)OC)O)OC	{1: 3, 14: 3, 15: 1, 21: 2, 22: 2, 23: 1, 25: 3}
Did not match all atoms present	33396-37-1	CC1[C@@H](C(C([C@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CCC3=C2)O)C6=COC(=O)C=C6)C)C)O)O)OC	{1: 4, 11: 8, 12: 9, 13: 3, 14: 4, 15: 1, 20: 3, 22: 2, 23: 1, 28: 1}
Did not match all atoms present	33399-46-1	CCOC1=CC=NC=C1	{1: 1, 2: 1, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	33399-48-3	C1=CC=C(C=C1)SC2=CC=NC=C2	{40: 1, 35: 1, 14: 9}
Did not match all atoms present	33399-53-0	C1=CC=C(C=C1)OC2=CC=[N+](C=C2)[O-]	{33: 1, 22: 1, 14: 9, 29: 1}
Did not match all atoms present	334-88-3	C=[N+]=[N-]	{34: 1, 5: 1}
Did not match all atoms present	3340-93-0	CC1=C2C(=NC3=CC=CC=C13)C=CC4=CC=CC=C42	{1: 1, 35: 1, 14: 10}
Did not match all atoms present	3340-94-1	CC1=C2C=CC3=CC=CC=C3C2=NC4=CC=CC=C14	{1: 1, 35: 1, 14: 10}
Did not match all atoms present	33400-47-4	CCOC(=O)NC1=C(N=C(C=C1)NC(CC2=CC=CC=C2)C3=CC=CC=C3)N.Cl	{1: 1, 2: 2, 3: 1, 14: 12, 17: 1, 35: 1, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	33401-94-4	CN1CCCN=C1/C=C/C2=CC=CS2.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 1, 3: 2, 6: 2, 33: 1, 41: 1, 11: 3, 14: 3, 15: 1, 35: 1, 20: 2, 27: 2}
Did not match all atoms present	33402-03-8	C[C@@H]([C@@H](C1=CC(=CC=C1)O)O)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 1, 3: 4, 14: 4, 20: 3, 21: 1, 27: 2, 30: 1}
Did not match all atoms present	33406-36-9	CCC(=C(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OCCN(CC)CC)C3=CC=C(C=C3)OC	{1: 5, 2: 5, 33: 1, 7: 2, 14: 12, 22: 3}
Did not match all atoms present	33406-96-1	CC1=C(C=CC(=C1)F)Cl	{16: 1, 1: 1, 14: 3, 17: 1}
Did not match all atoms present	33407-02-2	CCC1=C(C=CC=C1Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	33410-62-7	S.S	{}
Did not match all atoms present	33414-29-8	C1COCCN1CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F	{33: 2, 2: 2, 4: 1, 41: 1, 11: 4, 14: 7, 16: 3, 23: 1, 24: 1}
Did not match all atoms present	33419-42-0	CC1OCC2C(O1)C(C(C(O2)OC3C4COC(=O)C4C(C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)O)OC)O)O	{1: 3, 11: 3, 12: 10, 14: 4, 20: 2, 21: 1, 22: 3, 23: 5, 28: 1}
Did not match all atoms present	3342-64-1	CC1\2CCC3C(C1CC/C2=N\OC)CCC4=C3C=CC(=C4)O	{1: 2, 34: 1, 11: 6, 12: 3, 13: 1, 14: 3, 15: 1, 21: 1, 22: 1}
Did not match all atoms present	3342-98-1	CC1=C2CC(C3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1)O	{1: 1, 11: 1, 12: 1, 14: 9, 20: 1}
Did not match all atoms present	33421-40-8	C1=CC=C(C=C1)C2=CN=C(C=C2)N	{35: 1, 30: 1, 14: 8}
Did not match all atoms present	33423-92-6	C1=C(C=C2C(=C1Cl)OC3=CC(=CC(=C3O2)Cl)Cl)Cl	{17: 4, 14: 4, 23: 2}
Did not match all atoms present	33426-53-8	CSC1=NC2=NC=NC=C2N1	{32: 1, 1: 1, 35: 3, 14: 2, 40: 1}
Did not match all atoms present	33426-60-7	CC1=CC=CC=C1OC(C)C	{1: 3, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	33426-70-9	CCCCCOC1=CC=C(C=C1)C	{1: 2, 2: 4, 22: 1, 14: 4}
Did not match all atoms present	3343-07-5	CC1=C2CC(=O)C3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1	{1: 1, 11: 1, 14: 9, 25: 1}
Did not match all atoms present	3343-08-6	CC1=C2C(=O)CC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1	{1: 1, 11: 1, 14: 9, 25: 1}
Did not match all atoms present	3343-10-0	CC1=C2C=CC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1	{1: 1, 14: 11}
Did not match all atoms present	3343-15-5	CC(NC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C)O	{32: 1, 1: 2, 3: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	3343-24-6	C1=CC=C(C=C1)CCCCCCCCCCC(=O)O	{2: 10, 27: 1, 14: 5}
Did not match all atoms present	3343-28-0	C1CC(=O)OC(=O)C1N2C(=O)C3=CC=CC=C3C2=O	{33: 1, 11: 2, 12: 1, 14: 4, 25: 2, 28: 2}
Did not match all atoms present	3343-45-1	C1=CC(=CC=C1C(=O)CO)Br	{24: 1, 2: 1, 20: 1, 18: 1, 14: 4}
Did not match all atoms present	3343-80-4	CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)OC	{1: 2, 2: 1, 14: 8, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	33432-08-5	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)S(=O)(=O)O)C=C(/C(=N/NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)O)/C3=O)S(=O)(=O)O	{2: 2, 34: 1, 14: 12, 15: 2, 20: 3, 22: 1, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	33432-52-9	CC(C)(C#CC1=CC(=CC=C1)[N+](=O)[O-])O	{1: 2, 4: 1, 38: 1, 10: 2, 14: 4, 20: 1}
Did not match all atoms present	33433-82-8	CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].[Ca+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	3344-12-5	CCOC(=O)CC(C(=O)OCC)SP(=O)(OC)SC	{1: 4, 2: 3, 3: 1, 40: 2, 22: 1, 28: 2, 29: 1}
Did not match all atoms present	3344-14-7	CC1=C(C=CC(=C1)OP(=O)(OC)SC)[N+](=O)[O-]	{1: 3, 38: 1, 40: 1, 14: 3, 22: 2, 29: 1}
Did not match all atoms present	33440-88-9	[C-]#CC1=CC=CC=C1.[Ag+]	{10: 1, 14: 5}
Did not match all atoms present	33446-81-0	C1CO[Si]2(OCCN1CCO2)Cl	{17: 1, 11: 6, 33: 1, 23: 3}
Did not match all atoms present	33446-84-3	CO[Si]1(CCC1)OC	{1: 2, 11: 3, 22: 2}
Did not match all atoms present	33447-90-4	CC(CCC(C)OS(=O)(=O)C)OS(=O)(=O)C	{1: 4, 2: 2, 3: 2, 29: 4, 22: 2}
Did not match all atoms present	3345-29-7	C1=CC2=CC=C1C(C(C3=CC=C(C=C3)C(C2(F)F)(F)F)(F)F)(F)F	{16: 8, 13: 4, 14: 8}
Did not match all atoms present	33450-33-8	CCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC=C(C=C2)N=NC3=CC=C(C4=CC=CC=C43)N=NC5=CC=CC=C5	{1: 1, 2: 2, 33: 1, 34: 4, 14: 19, 20: 1, 29: 2}
Did not match all atoms present	33453-19-9	C1CC1CN2C3=C(C=C(C=C3)Cl)C(=NC2=O)C4=CC=CC=C4	{33: 1, 2: 1, 35: 1, 11: 2, 12: 1, 14: 8, 17: 1, 25: 1}
Did not match all atoms present	33454-82-9	[Li+].C(F)(F)(F)S(=O)(=O)[O-]	{16: 3, 4: 1, 29: 3}
Did not match all atoms present	33467-73-1	CCC=CCCOC=O	{1: 1, 2: 3, 26: 1, 6: 2}
Did not match all atoms present	33468-15-4	CCCCCCCCC1=CC=C(C=C1)/C(=C/C2=CC=C(C=C2)OCC)/Cl	{1: 2, 2: 8, 6: 1, 7: 1, 14: 8, 17: 1, 22: 1}
Did not match all atoms present	3347-22-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)SC(=C(S3)C#N)C#N	{25: 2, 37: 2, 14: 4, 41: 2}
Did not match all atoms present	3347-62-4	CC1=CC(=NN1)C2=CC=CC=C2	{32: 1, 1: 1, 35: 1, 14: 6}
Did not match all atoms present	3348-44-5	CN(C)P(N(C)C)Cl	{1: 4, 33: 2, 17: 1}
Did not match all atoms present	33486-90-7	COCC1=C(C=CC=C1Cl)Cl	{1: 1, 2: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	3349-06-2	C(=O)[O-].C(=O)[O-].[Ni+2]	{26: 2}
Did not match all atoms present	3349-63-1	C1C(=NO)CC2=CC=CC=C21	{34: 1, 11: 2, 20: 1, 14: 4, 15: 1}
Did not match all atoms present	33491-88-2	C1=C(C=C(C(=C1[N+](=O)[O-])C2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 8, 14: 6}
Did not match all atoms present	33493-71-9	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OCC2=CC=CC=C2)COC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)O)O	{1: 1, 2: 2, 4: 1, 12: 5, 14: 20, 20: 2, 22: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	33497-30-2	[O-]Br(=O)(=O)=O.[Na+]	{18: 1, 29: 4}
Did not match all atoms present	33499-42-2	CCOC(=O)C1=C(C=C(C=C1)C)C	{1: 3, 2: 1, 28: 1, 14: 3}
Did not match all atoms present	33499-44-4	CCOC(=O)C1=CC(=C(C=C1)C)C	{1: 3, 2: 1, 28: 1, 14: 3}
Did not match all atoms present	33499-84-2	COC1=CC(=C2C(=C1)C(=O)C3=CC4=C(C5C=COC5O4)C(=C3C2=O)O)OC	{1: 2, 12: 2, 14: 5, 21: 1, 22: 2, 23: 2, 25: 2}
Did not match all atoms present	335-05-7	C(F)(F)(F)S(=O)(=O)F	{16: 4, 4: 1, 29: 2}
Did not match all atoms present	335-24-0	C1(C(C(C(C(C1(F)F)(F)F)(F)S(=O)(=O)[O-])(F)F)(F)F)(C(C(F)(F)F)(F)F)F.[K+]	{16: 15, 4: 2, 13: 6, 29: 3}
Did not match all atoms present	335-71-7	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F	{16: 16, 4: 7, 29: 2}
Did not match all atoms present	335-77-3	C(C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 21, 20: 1, 4: 10, 29: 2}
Did not match all atoms present	335-95-5	C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-].[Na+]	{16: 15, 24: 1, 4: 7}
Did not match all atoms present	335-97-7	C=CCNS(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 5, 5: 1, 6: 1, 16: 11, 29: 2, 31: 1}
Did not match all atoms present	33509-43-2	CC(C)(C)C1=NNC(=S)N(C1=O)N	{32: 1, 1: 3, 35: 1, 4: 1, 33: 1, 25: 1, 30: 1}
Did not match all atoms present	3351-28-8	CC1=CC=CC2=C1C=CC3=C2C=CC4=CC=CC=C43	{1: 1, 14: 11}
Did not match all atoms present	3351-30-2	CC1=CC=CC2=C1C3=C(C=C2)C4=CC=CC=C4C=C3	{1: 1, 14: 11}
Did not match all atoms present	3351-31-3	CC1=CC2=C(C=C1)C=CC3=C2C=CC4=CC=CC=C43	{1: 1, 14: 11}
Did not match all atoms present	3351-32-4	CC1=CC2=C(C=C1)C3=C(C=C2)C4=CC=CC=C4C=C3	{1: 1, 14: 11}
Did not match all atoms present	33512-26-4	CCOP(=O)(CN1C(=O)C2=CC=CC=C2C1=O)OCC	{1: 2, 2: 3, 33: 1, 14: 4, 22: 2, 25: 2, 29: 1}
Did not match all atoms present	33513-44-9	C1=CC(=C(C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])C=O.[Na+].[Na+]	{26: 1, 29: 6, 14: 3}
Did not match all atoms present	33515-09-2	CC(C)CC(C(=O)NC(CCCN=C(N)N)C(=O)N1CCCC1C(=O)NCC(=O)N)NC(=O)CNC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CO)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C(CC5=CN=CN5)NC(=O)C6CCC(=O)N6	{32: 3, 1: 2, 2: 10, 3: 7, 33: 1, 7: 1, 11: 5, 12: 2, 34: 1, 14: 11, 35: 1, 20: 1, 21: 1, 24: 10, 25: 1, 30: 3, 31: 8}
Did not match all atoms present	33516-09-5	CCCCCCCCCCCCCCCCCCN(C(C)C)C(=S)[S-].CCCCCCCCCCCCCCCCCCN(C(C)C)C(=S)[S-].[Zn+2]	{1: 6, 2: 34, 3: 2, 33: 2, 7: 2}
Did not match all atoms present	3352-54-3	C1=CC=C(C=C1)C2=CC=C(C=C2)[Si](C3=CC=C(C=C3)C4=CC=CC=C4)(C5=CC=C(C=C5)C6=CC=CC=C6)C7=CC=C(C=C7)C8=CC=CC=C8	{14: 36}
Did not match all atoms present	33522-03-1	C1CCC(C1)N=C=S	{8: 1, 34: 1, 11: 4, 12: 1}
Did not match all atoms present	33522-04-2	C1CCCC(CCC1)N=C=S	{8: 1, 34: 1, 11: 7, 12: 1}
Did not match all atoms present	33524-31-1	COC1=CC(=C(C=C1)OC)CO	{1: 2, 2: 1, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	33525-68-7	CCO[Si](CCCNC(=O)/C=C/C(=O)O)(OCC)OCC	{1: 3, 2: 6, 6: 2, 22: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	33527-99-0	CN1C2=CC=CC=C2N(C3=C1C(=O)C3=O)C	{1: 2, 33: 2, 14: 4, 25: 2}
Did not match all atoms present	3353-08-0	CC1C=CC2=C1C=CC3=C2C=CC4=CC=CC=C43	{1: 1, 12: 1, 14: 10}
Did not match all atoms present	3353-12-6	CC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3	{1: 1, 14: 9}
Did not match all atoms present	3353-68-2	C[Si](C)(CCCC(=O)O)O[Si](C)(C)CCCC(=O)O	{1: 4, 2: 6, 27: 2, 22: 1}
Did not match all atoms present	33530-26-6	CC1C(C1=C=C(C)C)C2=CC=CC=C2	{1: 3, 7: 1, 8: 1, 12: 2, 14: 5, 15: 1}
Did not match all atoms present	33531-34-9	CC1=C(C(=CC=C1)Cl)NC(=O)OC2CCN(CC2)C	{1: 2, 33: 1, 11: 4, 12: 1, 14: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	33531-59-8	CCN1CCCC(C1)OC(=O)NC2=CC=CC=C2C	{1: 2, 2: 1, 33: 1, 11: 4, 12: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	33534-88-2	CC1=CC=C(C=C1)C(C#N)C#N	{1: 1, 3: 1, 37: 2, 14: 4}
Did not match all atoms present	33538-81-7	COC1=CC(=C(C=C1)OC)CCCO	{1: 2, 2: 3, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	3354-40-3	CC1=CC(=S)SS1	{1: 1, 14: 1, 41: 2}
Did not match all atoms present	3354-41-4	CC1=CSSC1=S	{1: 1, 14: 1, 41: 2}
Did not match all atoms present	3354-42-5	C1=CC=C2C(=C1)C(=S)SS2	{41: 2, 14: 4}
Did not match all atoms present	3354-58-3	CC1=C(C(=CC=C1)CC=C)O	{1: 1, 2: 1, 5: 1, 6: 1, 14: 3, 21: 1}
Did not match all atoms present	3354-66-3	CC(C)(C)OCCC1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 22: 1, 14: 5}
Did not match all atoms present	33543-31-6	CC1=CC2=C3C(=C1)C=CC=C3C4=CC=CC=C42	{1: 1, 14: 9}
Did not match all atoms present	33546-26-8	CO[Si](C)(C)C1=CC=C(C=C1)[SiH](C)C	{1: 5, 22: 1, 14: 4}
Did not match all atoms present	33546-27-9	CO[Si](C)(C1=CC=CC(=C1)[Si](C)C)OC	{1: 5, 22: 2, 14: 4}
Did not match all atoms present	33546-28-0	CO[Si](C1=CC=CC(=C1)[Si](C)C)(OC)OC	{1: 5, 22: 3, 14: 4}
Did not match all atoms present	33546-29-1	C[SiH](C)C1=CC=C(C=C1)[Si](C)(C)F	{16: 1, 1: 4, 14: 4}
Did not match all atoms present	33546-30-4	C[SiH](C)C1=CC=C(C=C1)[Si](C)(F)F	{16: 2, 1: 3, 14: 4}
Did not match all atoms present	3356-37-4	CN(C)P(=O)(C=C=C)N(C)C	{1: 4, 5: 1, 6: 1, 33: 2, 8: 1, 29: 1}
Did not match all atoms present	33560-53-1	C1=CC(=C(C(=C1)Cl)Cl)NC(=O)C(Cl)(Cl)Cl	{24: 1, 17: 5, 4: 1, 14: 3, 31: 1}
Did not match all atoms present	33560-54-2	C1=CC(=C(C=C1Cl)Cl)NC(=O)C(Cl)(Cl)Cl	{24: 1, 17: 5, 4: 1, 14: 3, 31: 1}
Did not match all atoms present	33564-30-6	CO[C@@]1([C@@H]2N(C1=O)C(=C(CS2)COC(=O)N)C(=O)[O-])NC(=O)CC3=CC=CS3.[Na+]	{1: 1, 2: 2, 33: 1, 41: 2, 11: 1, 12: 1, 13: 1, 14: 3, 15: 2, 22: 1, 24: 2, 25: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	33567-59-8	COC1=CC=CC=C1CC=O	{1: 1, 2: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	33568-99-9	CCCCCCCC[Sn](OC(=O)/C=C/C(=O)OCCCCCC(C)C)(OC(=O)/C=C/C(=O)OCCCCCC(C)C)CCCCCCCC	{1: 6, 2: 24, 3: 2, 28: 4, 6: 4}
Did not match all atoms present	33574-11-7	CC(C)C1=CC(=C(C(=C1)C(C)C)C(=O)C2=CC=CC=C2)C(C)C	{24: 1, 1: 6, 3: 3, 14: 7}
Did not match all atoms present	33574-16-2	CC(C)C1=CC(=C2C(=C1)C(C2(C3=CC=CC=C3)O)(C)C)C(C)C	{1: 6, 3: 2, 20: 1, 13: 2, 14: 7}
Did not match all atoms present	33577-16-1	CSCS(=O)C	{40: 1, 1: 2, 2: 1, 29: 1}
Did not match all atoms present	33580-59-5	COCCC[Si](OC)(OC)OC	{1: 4, 2: 3, 22: 4}
Did not match all atoms present	33581-77-0	C[Si](C)(C)OCC(=O)O[Si](C)(C)C	{1: 6, 2: 1, 28: 1, 22: 1}
Did not match all atoms present	33588-54-4	CC(=O)N1C=C(C2=C1C=CC(=C2)Br)OC(=O)C	{1: 2, 33: 1, 14: 4, 18: 1, 24: 1, 28: 1}
Did not match all atoms present	33589-44-5	CCCCC#[C-].[Cu+]	{1: 1, 2: 3, 10: 1}
Did not match all atoms present	3359-70-4	CC(C)S(=O)(=O)C(C)C	{1: 4, 3: 2, 29: 2}
Did not match all atoms present	33598-22-0	CC#CCC1=CC=CC=C1	{1: 1, 2: 1, 10: 2, 14: 5}
Did not match all atoms present	3360-41-6	C1=CC=C(C=C1)CCCCO	{2: 4, 20: 1, 14: 5}
Did not match all atoms present	33602-98-1	CCOC(=O)CC(=NN(C)C1=CC=CC=C1)C	{1: 3, 2: 2, 33: 1, 7: 1, 34: 1, 14: 5, 28: 1}
Did not match all atoms present	33602-99-2	CCOC(=O)C/C(=N\N(C)C1=CC=CC=C1)/C	{1: 3, 2: 2, 33: 1, 7: 1, 34: 1, 14: 5, 28: 1}
Did not match all atoms present	33603-63-3	CC(=O)/C=C/C1=CC=CS1	{24: 1, 1: 1, 14: 3, 6: 2, 41: 1}
Did not match all atoms present	33604-10-3	CCOC(=O)/C=C(/C)\NN(C)C1=CC=CC=C1	{1: 3, 2: 1, 33: 1, 6: 1, 7: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	33609-19-7	CCN\1C2=CC=CC=C2[Se]/C1=C\C=C\C3=[N+](CCS3)CC.[I-]	{1: 2, 2: 2, 6: 3, 33: 2, 41: 1, 11: 2, 14: 4, 15: 2, 19: 1}
Did not match all atoms present	336101-27-0	COC1=CC(=C(C=C1)C=CC(=O)C2=CC=C(C=C2)F)OC	{1: 2, 6: 2, 14: 7, 16: 1, 22: 2, 24: 1}
Did not match all atoms present	33611-48-2	C1=CC(=CN=C1)CNCCC#N	{2: 3, 35: 1, 37: 1, 14: 4, 31: 1}
Did not match all atoms present	33614-49-2	O.O.[O-]S(=O)(=S)[O-].[O-]S(=O)(=S)[O-].[Na+].[Na+].[Na+].[Au+]	{29: 6}
Did not match all atoms present	33617-59-3	C1=CC(=C(C=C1O)O)CO	{2: 1, 20: 1, 21: 2, 14: 3}
Did not match all atoms present	33618-25-6	C1=CC(C=C1)[SiH3]	{12: 1, 14: 4}
Did not match all atoms present	336185-23-0	CCOC1=C(C=C2C(NCCC2=C1)CC(=O)O)OCC	{32: 1, 1: 2, 2: 3, 11: 2, 12: 1, 14: 2, 22: 2, 27: 1}
Did not match all atoms present	336185-28-5	CCOC1=C(C=C2C(=C1)CCNC2=S)OCC	{32: 1, 1: 2, 2: 2, 11: 2, 14: 2, 15: 1, 22: 2}
Did not match all atoms present	336185-30-9	CCOC(=O)[C@@H]1CCCC[C@@H]1N=C=S	{1: 1, 2: 1, 8: 1, 11: 4, 12: 2, 34: 1, 28: 1}
Did not match all atoms present	33627-04-2	C1C2C=CC=CC1C3=CC=CC=C23	{11: 1, 12: 2, 14: 8}
Did not match all atoms present	33627-05-3	C1CCC2CC(C1)C3=CC=CC=C23	{11: 5, 12: 2, 14: 4}
Did not match all atoms present	33628-03-4	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCS(=O)(=O)[O-])C=C4N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 7, 33: 2, 6: 2, 7: 1, 14: 16, 15: 1, 23: 2, 29: 6}
Did not match all atoms present	33628-05-6	CCN1C2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=C1C=CC=C3N(C4=C(N3CCCS(=O)(=O)[O-])C=C(C(=C4)Cl)C(F)(F)F)CC)CCCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 8, 4: 2, 6: 3, 33: 4, 14: 4, 15: 1, 16: 6, 17: 2, 29: 6}
Did not match all atoms present	33628-07-8	CCN1C2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=C1C=CC=C3N(C4=C(N3CCCCS(=O)(=O)[O-])C=C(C(=C4)Cl)C(F)(F)F)CC)CCCCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 10, 4: 2, 6: 3, 33: 4, 14: 4, 15: 1, 16: 6, 17: 2, 29: 6}
Did not match all atoms present	33628-30-7	C1=CC=C(C(=C1)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)S(=O)(=O)[O-])/C=C/C4=C(C=CC(=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6Cl)NC7=CC=CC=C7Cl)S(=O)(=O)[O-])NC8=CC=CC=C8Cl)Cl.[Na+].[Na+]	{35: 6, 6: 2, 14: 22, 17: 4, 29: 6, 31: 6}
Did not match all atoms present	33629-47-9	CCC(C)NC1=C(C=C(C=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-]	{1: 5, 2: 1, 3: 1, 4: 1, 38: 2, 14: 2, 31: 1}
Did not match all atoms present	33629-97-9	CC1=CC=CC(=C1)C=NC2=CC=CC=C2C	{1: 2, 34: 1, 14: 8, 6: 1}
Did not match all atoms present	3363-97-1	C1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)C(=O)C(=O)C3=CC=CC=C3	{24: 4, 14: 14}
Did not match all atoms present	33630-76-1	C[Si](C)(C)C1(C=CC=C1)[Si](C)(C)C	{1: 6, 13: 1, 14: 4}
Did not match all atoms present	33630-94-3	C1=CC(=O)NC=C1N	{32: 1, 25: 1, 30: 1, 14: 3}
Did not match all atoms present	33630-99-8	C1=CNC(=O)C(=C1)N	{32: 1, 25: 1, 30: 1, 14: 3}
Did not match all atoms present	33631-63-9	C1CCC(CC1)C[Hg+].[Cl-]	{17: 1, 2: 1, 11: 5, 12: 1}
Did not match all atoms present	33632-27-8	CC(=O)N1CCC2=C1C=CC(=C2)[N+](=O)[O-]	{1: 1, 38: 1, 33: 1, 11: 2, 14: 3, 24: 1}
Did not match all atoms present	33634-55-8	CN.CN.[I-].[I-].[Pt+2]	{1: 2, 19: 2, 30: 2}
Did not match all atoms present	33636-93-0	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cu].[Cu].[Cu].[Cu].[Cu].[Cu]	{14: 90}
Did not match all atoms present	33641-61-1	CCN(CC)S(=O)N(CC)CC	{1: 4, 2: 4, 29: 1, 33: 2}
Did not match all atoms present	3365-26-2	C1CC(=C1)C2=CC=CC=C2	{11: 2, 14: 6, 15: 1}
Did not match all atoms present	3365-81-9	CNC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 14: 9, 31: 1}
Did not match all atoms present	3365-85-3	C1=CC(=CC=C1C2=CC=C(C=C2)N)C3=CC=C(C=C3)N	{30: 2, 14: 12}
Did not match all atoms present	3365-94-4	C1=CC(=CC=C1C2=CC(=C(C=C2)N)OS(=O)(=O)O)N	{30: 2, 20: 1, 22: 1, 14: 7, 29: 2}
Did not match all atoms present	33656-20-1	C1CN(CCN1C2=NC=CC=N2)C(=O)CC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{33: 2, 2: 1, 3: 1, 11: 4, 14: 12, 17: 1, 35: 2, 24: 1}
Did not match all atoms present	3366-61-8	CC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)N	{24: 1, 1: 1, 30: 1, 14: 8, 31: 1}
Did not match all atoms present	3366-65-2	C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)N	{30: 1, 14: 9}
Did not match all atoms present	33663-41-1	C1=CC(=C(C=C1Cl)N)Cl.Cl	{17: 3, 30: 1, 14: 3}
Did not match all atoms present	33663-50-2	C1=C(C=C(C(=C1Cl)N)Cl)Cl.Cl	{17: 4, 30: 1, 14: 2}
Did not match all atoms present	33664-04-9	CC1=CC(=CC=C1)[Si](C)(C)F	{16: 1, 1: 3, 14: 4}
Did not match all atoms present	33664-05-0	CC1=CC=C(C=C1)[Si](C)(C)F	{16: 1, 1: 3, 14: 4}
Did not match all atoms present	33664-21-0	C1[Si]2(C[Si]3(C[Si]1(C[Si](C2)(C3)F)F)F)F	{16: 4, 11: 6}
Did not match all atoms present	33667-47-9	C[N+](C)(CCO)CC1=CC=CC=C1.[OH-]	{1: 2, 2: 3, 20: 1, 14: 5}
Did not match all atoms present	33667-48-0	C[N+](CCO)(CCO)CCO.[OH-]	{1: 1, 2: 6, 20: 3}
Did not match all atoms present	33667-49-1	C[N+](CCO)(CCO)CC1=CC=CC=C1.[OH-]	{1: 1, 2: 5, 20: 2, 14: 5}
Did not match all atoms present	33669-58-8	OS(=O)(=O)OS(=O)(=O)[O-]	{20: 1, 29: 5, 22: 1}
Did not match all atoms present	3367-28-0	CN1CC(=O)N(C1=O)CC(C[Hg]Cl)OC	{1: 2, 2: 2, 3: 1, 33: 2, 11: 1, 17: 1, 22: 1, 25: 2}
Did not match all atoms present	3367-29-1	COC(CN1C(=O)CNC1=O)C[Hg]Cl	{32: 1, 1: 1, 2: 2, 3: 1, 33: 1, 11: 1, 17: 1, 22: 1, 25: 2}
Did not match all atoms present	3367-30-4	CN1C(=O)C(NC1=O)CC(C[Hg]Cl)OC	{32: 1, 1: 2, 2: 2, 3: 1, 33: 1, 12: 1, 17: 1, 22: 1, 25: 2}
Did not match all atoms present	3367-31-5	COC(CC1C(=O)NC(=O)N1)C[Hg]Cl	{32: 2, 1: 1, 2: 2, 3: 1, 12: 1, 17: 1, 22: 1, 25: 2}
Did not match all atoms present	3367-32-6	COC(CN1CC(=O)NC1=O)C[Hg]Cl	{32: 1, 1: 1, 2: 2, 3: 1, 33: 1, 11: 1, 17: 1, 22: 1, 25: 2}
Did not match all atoms present	33670-50-7	C1CCC(C1)N=[N+]=[N-]	{34: 2, 11: 4, 12: 1}
Did not match all atoms present	33671-46-4	CCC1=CC2=C(S1)N(C(=O)CN=C2C3=CC=CC=C3Cl)C	{1: 2, 2: 1, 35: 1, 33: 1, 41: 1, 11: 1, 14: 5, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	33675-75-1	C1=CC=C(C=C1)CCC2=CC(=CC=C2)O	{2: 2, 21: 1, 14: 9}
Did not match all atoms present	33678-73-8	CCN(C1=CCC(=[N+]=[N-])C=C1C)O	{1: 2, 2: 1, 33: 1, 11: 1, 34: 1, 14: 2, 15: 3, 20: 1}
Did not match all atoms present	3368-04-5	CC1=CC(=O)OC2=C1C=CC(=C2)OP(=O)(O)O	{1: 1, 14: 4, 20: 2, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	3368-13-6	C1=CC=C(C=C1)S(=O)(=O)NC2=NN=C(S2)S(=O)(=O)N	{35: 2, 41: 1, 14: 5, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	33687-03-5	CCCCCCCN1C(=O)C(=CC=CC=C2N(C3=C(S2)C4=CC=CC=C4C=C3)CC)N(C1=S)C5=CC=CC=C5	{1: 2, 2: 7, 6: 4, 33: 3, 41: 1, 14: 11, 15: 3, 25: 1}
Did not match all atoms present	33687-74-0	CC(C)(C(C1=CC=CC=C1)O)[N+](=O)[O-]	{1: 2, 3: 1, 4: 1, 38: 1, 14: 5, 20: 1}
Did not match all atoms present	33687-87-5	CC1=C(SC=C1)OC	{1: 2, 22: 1, 14: 2, 41: 1}
Did not match all atoms present	33689-71-3	CCCCCCCCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 8, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	33689-81-5	[Br-].[Br-].[Br-].[Ac]	{18: 3}
Did not match all atoms present	33691-06-4	CS(=O)(=O)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F	{1: 1, 2: 2, 35: 1, 33: 1, 11: 1, 14: 7, 15: 1, 16: 1, 17: 1, 25: 1, 29: 2}
Did not match all atoms present	33693-04-8	CCNC1=NC(=NC(=N1)OC)NC(C)(C)C	{1: 5, 2: 1, 35: 3, 4: 1, 22: 1, 31: 2}
Did not match all atoms present	33693-48-0	COC1=C(C=CC(=C1)CO)OCC2=CC=CC=C2	{1: 1, 2: 2, 20: 1, 22: 2, 14: 8}
Did not match all atoms present	33694-15-4	CCCC(=O)NC1=CC=CC=C1Cl	{1: 1, 2: 2, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	337-47-3	CCCC(C)C1(C(=O)NC(=NC1=O)[S-])CC=C.[Na+]	{32: 1, 1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	3370-27-2	CCC(C)(C)C1=CC(=CC=C1)C(C)(C)CC	{1: 6, 2: 2, 4: 2, 14: 4}
Did not match all atoms present	3370-28-3	CCC(C)(C)C1=CC=CC=C1C(C)(C)CC	{1: 6, 2: 2, 4: 2, 14: 4}
Did not match all atoms present	33709-38-5	CC(=O)OCCC1=CC=C(C=C1)N	{1: 1, 2: 2, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	33709-39-6	CC(=O)OCCC1=CC(=CC=C1)OC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	33709-40-9	CC1=CC(=CC=C1)CCOC(=O)C	{1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	33709-41-0	CC(=O)OCCC1=CC(=CC=C1)Cl	{1: 1, 2: 2, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	33715-52-5	C1=CC=C(C=C1)O[Al](Cl)Cl	{17: 2, 22: 1, 14: 5}
Did not match all atoms present	33715-64-9	C1=CC(=C(C=C1Cl)NC(=O)C(Cl)(Cl)Cl)Cl	{24: 1, 17: 5, 4: 1, 14: 3, 31: 1}
Did not match all atoms present	33719-66-3	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C(=C5C=C(C(=N5)C=C1N2)C)C)CCC(=O)OC)C)C)CC)C	{32: 2, 1: 8, 2: 4, 35: 2, 14: 4, 28: 1}
Did not match all atoms present	33719-74-3	COC1=CC(=CC(=C1)Cl)Cl	{1: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	33719-95-8	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C5=C6C(=C(C(=N6)C=C1N2)C)C(=O)C5)CCC(=O)OC)C)C)CC)C	{32: 2, 1: 7, 2: 4, 35: 2, 11: 1, 14: 3, 25: 1, 28: 1}
Did not match all atoms present	33721-54-9	CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC	{1: 2, 38: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	33725-74-5	[BH4-].CCCC[N+](CCCC)(CCCC)CCCC	{1: 4, 2: 12}
Did not match all atoms present	3373-10-2	CCC(C)(C)C1=CC=C(C=C1)C(C)(C)CC	{1: 6, 2: 2, 4: 2, 14: 4}
Did not match all atoms present	3373-53-3	C1=NC2=NC(=O)NC(=C2N1)N	{32: 2, 25: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	33734-55-3	CCCCCCCCCCCCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 14}
Did not match all atoms present	33734-56-4	CCCCCCCCCCCCCCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 16}
Did not match all atoms present	33738-48-6	CC1=CC=C(C2=CC=CC=C12)C=O	{1: 1, 26: 1, 14: 6}
Did not match all atoms present	33739-50-3	C1=CC(=C(C(=O)C=C1)O)O	{25: 1, 21: 2, 14: 4}
Did not match all atoms present	3374-05-8	CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)[O-].[Na+]	{1: 2, 2: 1, 35: 1, 33: 1, 14: 3, 24: 1, 25: 1}
Did not match all atoms present	3374-30-9	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC=CC=C4)C=C3)C5=CC(=C(C=C5S(=O)(=O)O)S(=O)(=O)O)O	{1: 2, 2: 4, 33: 2, 7: 1, 14: 20, 15: 2, 20: 2, 21: 1, 29: 4}
Did not match all atoms present	33741-19-4	C1=CC=C2C(=C1)C3C(C4=CC=CC=C42)C5=CC=CC=C5C6=CC=CC=C36	{12: 2, 14: 16}
Did not match all atoms present	3375-23-3	C1=CC=C(C=C1)NN=C2C=CC3=CC=CC=C3C2=O	{25: 1, 34: 1, 31: 1, 14: 11, 15: 1}
Did not match all atoms present	3375-25-5	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)[O-]	{1: 4, 2: 4, 33: 2, 14: 10, 23: 1, 24: 1}
Did not match all atoms present	3375-31-3	CC(=O)[O-].CC(=O)[O-].[Pd+2]	{24: 2, 1: 2}
Did not match all atoms present	3375-37-9	CC/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C2=CC=CC=C2	{1: 1, 2: 1, 38: 2, 7: 1, 34: 1, 14: 8, 31: 1}
Did not match all atoms present	3375-38-0	C1=CC=C(C=C1)C(=O)CCCCC(=O)C2=CC=CC=C2	{24: 2, 2: 4, 14: 10}
Did not match all atoms present	33759-64-7	CC1=CC(=O)OC2=C1OC=C(C2=O)C	{1: 2, 25: 1, 28: 1, 14: 2, 23: 1}
Did not match all atoms present	3376-23-6	C[N+](=CC1=CC=CC=C1)[O-]	{1: 1, 33: 1, 14: 5, 6: 1, 29: 1}
Did not match all atoms present	3376-27-0	C1=CC=C(C=C1)/C=[N+](/C(C2=CC=CC=C2)C3=CC=CC=C3)\[O-]	{33: 1, 3: 1, 14: 15, 6: 1, 29: 1}
Did not match all atoms present	3376-32-7	CC1=CC=CC=C1/C=N/O	{1: 1, 34: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	3376-59-8	C1=CC=C(C=C1)C(=O)OCC(CO)O	{28: 1, 2: 2, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	3376-94-1	CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CNC	{1: 3, 2: 3, 3: 1, 4: 1, 14: 10, 28: 1, 31: 1}
Did not match all atoms present	3377-71-7	C1=CC=C(C=C1)CN2C=CC3=CC=CC=C32	{33: 1, 2: 1, 14: 11}
Did not match all atoms present	33770-83-1	CC1=C(C(=C(C(=C1CC(C)(C)C)C)C)CC(C)(C)C)C	{1: 10, 2: 2, 4: 2}
Did not match all atoms present	33773-63-6	[H+].[H+].[H+].CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(C(=C2[O-])N=NC3=C(C4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-])[O-])S(=O)(=O)[O-].[Cu+2]	{1: 1, 2: 2, 34: 2, 14: 7, 22: 1, 24: 1, 29: 14, 31: 1}
Did not match all atoms present	3378-72-1	CC(C)(C)NCC1=CC=CC=C1	{1: 3, 2: 1, 4: 1, 14: 5, 31: 1}
Did not match all atoms present	33781-73-6	CC1=C(C(=C(C(=C1C)CC(C)(C)C)C)CC(C)(C)C)C	{1: 10, 2: 2, 4: 2}
Did not match all atoms present	33786-89-9	C1=C(C=C(C=C1N)Cl)N	{17: 1, 30: 2, 14: 3}
Did not match all atoms present	3379-36-0	C1=CC=C(C=C1)SC2=CC=CC=C2SC3=CC=CC=C3	{40: 2, 14: 14}
Did not match all atoms present	3379-38-2	C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC=CC=C3	{22: 2, 14: 14}
Did not match all atoms present	33790-67-9	F[Al-2](F)(F)(F)F.[Ca+2]	{16: 5}
Did not match all atoms present	33795-18-5	C1=CC(=CC=C1O)P(=O)(O)O	{20: 2, 21: 1, 14: 4, 29: 1}
Did not match all atoms present	33798-02-6	CC(=O)OC1=C(C=C(C=C1Br)C(C)(C)C2=CC(=C(C(=C2)Br)OC(=O)C)Br)Br	{1: 4, 18: 4, 4: 1, 14: 4, 28: 2}
Did not match all atoms present	338-70-5	O=C([O-])C(=O)[O-]	{24: 2}
Did not match all atoms present	3380-34-5	C1=CC(=C(C=C1Cl)O)OC2=C(C=C(C=C2)Cl)Cl	{17: 3, 22: 1, 21: 1, 14: 6}
Did not match all atoms present	33804-48-7	CC(=O)N(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{24: 1, 1: 4, 34: 2, 14: 8, 33: 2}
Did not match all atoms present	33804-84-1	CN1C=C2C=CC=CC2=C1	{1: 1, 14: 6, 33: 1}
Did not match all atoms present	3381-54-2	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OS(=O)(=O)C)C)C	{1: 6, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 22: 1, 29: 2}
Did not match all atoms present	33813-20-6	C1CN2C(=N1)SSC2=S	{33: 1, 11: 2, 41: 2, 35: 1, 15: 2}
Did not match all atoms present	33817-09-3	C[C@H](CC1=CC=CC=C1)NC	{1: 2, 2: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	3382-99-8	C=CCC1=C(C(=CC=C1)CC=C)O	{2: 2, 14: 3, 5: 2, 6: 2, 21: 1}
Did not match all atoms present	33820-53-0	CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(C)C)[N+](=O)[O-]	{1: 4, 2: 4, 3: 1, 38: 2, 33: 1, 14: 2}
Did not match all atoms present	3383-08-2	C=CCC1=CC=CC=C1[O-].[Na+]	{2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	3383-96-8	COP(=S)(OC)OC1=CC=C(C=C1)SC2=CC=C(C=C2)OP(=S)(OC)OC	{40: 1, 1: 4, 22: 6, 14: 8}
Did not match all atoms present	3384-04-1	C1=CC=C(C=C1)OCCCCl	{17: 1, 2: 3, 22: 1, 14: 5}
Did not match all atoms present	3385-34-0	CCOC(=O)C1=C(OC(=O)C=C1C)C	{1: 3, 2: 1, 28: 2, 14: 1}
Did not match all atoms present	3385-41-9	C(CCC(=O)[O-])CC(=O)[O-].[NH4+].[NH4+]	{24: 2, 2: 4}
Did not match all atoms present	3385-78-2	C[In](C)C	{1: 3}
Did not match all atoms present	3385-94-2	C[Si](C)(C)S[Si](C)(C)C	{40: 1, 1: 6}
Did not match all atoms present	33855-47-9	CC[NH+](C)CCN(CC1=CC=C(C=C1)Br)C2=CC=CC=N2.C(=C\C(=O)[O-])\C(=O)O	{1: 2, 2: 4, 35: 1, 6: 2, 33: 1, 14: 8, 18: 1, 24: 1, 27: 1}
Did not match all atoms present	33857-23-7	CCOP(=S)(NC(C)C)OC1=C(C=C(C=C1)C)[N+](=O)[O-]	{1: 4, 2: 1, 3: 1, 38: 1, 14: 3, 22: 2, 31: 1}
Did not match all atoms present	33857-26-0	C1=CC2=C(C=C1Cl)OC3=C(O2)C=C(C=C3)Cl	{17: 2, 14: 6, 23: 2}
Did not match all atoms present	33857-28-2	C1=CC2=C(C=C1Cl)OC3=CC(=C(C=C3O2)Cl)Cl	{17: 3, 14: 5, 23: 2}
Did not match all atoms present	3386-42-3	C1=CC(=C(C=C1Cl)N=C=S)Cl	{8: 1, 17: 2, 34: 1, 14: 3}
Did not match all atoms present	3386-57-0	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 12}
Did not match all atoms present	3386-97-8	C=CCCN=C=S	{8: 1, 2: 2, 34: 1, 5: 1, 6: 1}
Did not match all atoms present	33861-17-5	C[Si](C)(C)[Se]C1=CC=CC=C1	{1: 3, 14: 5}
Did not match all atoms present	33863-86-4	CCCCOC1=CC=C(C=C1)C(=O)Cl	{1: 1, 2: 3, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	33864-12-9	CN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N.CN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N.Cl[Zn-2](Cl)(Cl)Cl	{1: 2, 2: 2, 33: 2, 34: 2, 14: 18, 17: 4}
Did not match all atoms present	33864-17-4	CCCN(CCC)C1=CC=C(C=C1)[N+]#N.CCCN(CCC)C1=CC=C(C=C1)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 8, 33: 2, 34: 2, 14: 8, 17: 4}
Did not match all atoms present	33872-80-9	CC1=CC=CC=[C-]1.[Mg+2].[Cl-]	{1: 1, 14: 4, 17: 1}
Did not match all atoms present	33873-09-5	C1=C(N=C(C=N1)F)F	{16: 2, 35: 2, 14: 2}
Did not match all atoms present	33876-97-0	C1COCCN1[N+]2=CC(=N)O[N-]2	{33: 2, 35: 1, 36: 1, 11: 4, 14: 1, 23: 2}
Did not match all atoms present	3388-01-0	C1CC(OC1)COC(=O)C2=CC=CC=C2C(=O)OCC3CCCO3	{2: 2, 11: 6, 12: 2, 14: 4, 23: 2, 28: 2}
Did not match all atoms present	3388-04-3	CO[Si](CCC1CCC2C(C1)O2)(OC)OC	{1: 3, 2: 2, 11: 3, 12: 3, 22: 3, 23: 1}
Did not match all atoms present	33880-20-5	C1=C[Se]C2=CSC=C21	{41: 1, 14: 4}
Did not match all atoms present	33892-75-0	COC1=CC=CC2=C1CCCC2=O	{1: 1, 11: 3, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	33892-95-4	CC1CCOP(O1)OC	{1: 2, 11: 2, 12: 1, 22: 1, 23: 2}
Did not match all atoms present	33893-36-6	CS(=O)(=O)NCCC1=CC=CC=C1	{1: 1, 2: 2, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	33898-90-7	C1=CSC(=C1)C(=O)CC#N	{24: 1, 41: 1, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	33898-93-0	CCN(CCOC(=O)NC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 3, 33: 1, 14: 10, 28: 1, 31: 1}
Did not match all atoms present	339-43-5	CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)N	{1: 1, 2: 3, 14: 4, 24: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	339-59-3	C1=CC(=CC=C1C(=O)NN)C(F)(F)F	{4: 1, 14: 4, 16: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	3390-61-2	C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)O[Si](C)(C3=CC=CC=C3)O[Si](C)(C4=CC=CC=C4)C5=CC=CC=C5	{1: 3, 22: 2, 14: 25}
Did not match all atoms present	33901-44-9	CC1=CC=C(C=C1)OCC#N	{1: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	33901-46-1	C1=CC(=CC=C1[N+](=O)[O-])OCC#N	{2: 1, 38: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	33902-83-9	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C5=C6C(=C(C(=N6)C=C1N2)C)CC5)CCC(=O)OC)C)C)CC)C	{32: 2, 1: 7, 2: 4, 35: 2, 11: 2, 14: 3, 28: 1}
Did not match all atoms present	33904-03-9	COC1=CC(=C(C=C1)N=C=S)OC	{8: 1, 1: 2, 34: 1, 22: 2, 14: 3}
Did not match all atoms present	33904-04-0	COC1=C(C=C(C=C1)N=C=S)OC	{8: 1, 1: 2, 34: 1, 22: 2, 14: 3}
Did not match all atoms present	33908-66-6	[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Na+].[Sb]	{}
Did not match all atoms present	3391-10-4	CC(C1=CC=C(C=C1)Cl)O	{1: 1, 3: 1, 20: 1, 14: 4, 17: 1}
Did not match all atoms present	33911-28-3	CC(=C[C@@H]1[C@H](C1(C)C)C(=O)OCC2=CC=C(O2)CC3=CC=CC=C3)C	{1: 4, 2: 2, 6: 1, 7: 1, 12: 2, 13: 1, 14: 7, 23: 1, 28: 1}
Did not match all atoms present	33919-18-5	CC1=C(C(=C(C(=C1CCl)C)O)C)CCl	{1: 3, 2: 2, 21: 1, 17: 2}
Did not match all atoms present	3392-97-0	COC1=C(C(=CC=C1)OC)C=O	{1: 2, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	33924-48-0	COC1=C(C=C(C=C1)Cl)C(=O)OC	{1: 2, 28: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	3393-59-7	C1=C(C2=C(C(=C1Cl)Cl)NC(=N2)C(F)(F)F)Cl	{32: 1, 35: 1, 4: 1, 14: 1, 16: 3, 17: 3}
Did not match all atoms present	3393-72-4	CC1=CN=C2C(=C1C)C=CC=C2N	{1: 2, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	3393-96-2	C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9, 31: 1}
Did not match all atoms present	33933-73-2	CCCC1=CC=C(S1)C	{1: 2, 2: 2, 14: 2, 41: 1}
Did not match all atoms present	3394-09-0	C1=CC=C(C(=C1)N)NC(=S)N	{31: 1, 30: 2, 14: 4, 7: 1}
Did not match all atoms present	33941-99-0	CC1OCC(O1)C2=CC=CC=C2	{1: 1, 11: 1, 12: 2, 14: 5, 23: 2}
Did not match all atoms present	33942-87-9	CC1=CC2=CC3=CC=CC=C3C4=C2C5=C1C6=CC=CC=C6C=C5C=C4	{1: 1, 14: 13}
Did not match all atoms present	33942-88-0	CC1=C2C=CC3=CC4=CC=CC=C4C5=C3C2=C(C=C5)C6=CC=CC=C16	{1: 1, 14: 13}
Did not match all atoms present	33948-28-6	C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].[Ti+4]	{1: 12, 5: 4}
Did not match all atoms present	3395-03-7	COC1=C(C=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])OC	{1: 2, 38: 2, 22: 2, 14: 2}
Did not match all atoms present	3395-62-8	COC1=CC=C(C=C1)[C@@H](C[N+](=O)[O-])C2=CNC3=CC=CC=C32	{32: 1, 1: 1, 2: 1, 3: 1, 38: 1, 14: 9, 22: 1}
Did not match all atoms present	3395-79-7	COC(C1=CC(=CC=C1)[N+](=O)[O-])OC	{38: 1, 1: 2, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	3395-81-1	COC(C1=CC=C(C=C1)Cl)OC	{1: 2, 3: 1, 22: 2, 14: 4, 17: 1}
Did not match all atoms present	3395-83-3	CC1=CC=C(C=C1)C(OC)OC	{1: 3, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	33950-46-8	CC(C)(CO)C(C1=CC=CC=C1)O	{1: 2, 2: 1, 3: 1, 4: 1, 14: 5, 20: 2}
Did not match all atoms present	33953-73-0	C1=CC=C2C(=C1)C3=C4C(=C2O)C=CC5=CC=CC(=C54)C=C3	{21: 1, 14: 11}
Did not match all atoms present	33955-42-9	C1=CC2=C3C(=CC=C4C3=C1C5=C6C4=CC=C7C6=C(C=C5)C(=O)OC7=O)C(=O)NC2=O	{32: 1, 25: 2, 28: 2, 14: 8}
Did not match all atoms present	3396-11-0	CC(=O)[O-].[Cs+]	{24: 1, 1: 1}
Did not match all atoms present	33963-15-4	F[W]F	{16: 2}
Did not match all atoms present	33963-55-2	CS(=O)(=O)C1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	3397-62-4	C1(=NC(=NC(=N1)Cl)N)N	{17: 1, 35: 3, 30: 2}
Did not match all atoms present	33979-03-2	C1=C(C=C(C(=C1Cl)C2=C(C=C(C=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	33979-15-6	CC1/C=C(/C(=O)OC2CC[N+]3(C2(C(=CC3)COC(=O)C1(C)OC(=O)C)O)C)\C=C	{1: 4, 5: 1, 6: 1, 11: 4, 12: 2, 13: 2, 14: 2, 15: 2, 20: 1, 28: 3}
Did not match all atoms present	3398-09-2	CC1=CC(=CC=C1)N=NC2=C(C=C(C=C2)N)C	{1: 2, 34: 2, 30: 1, 14: 7}
Did not match all atoms present	3398-16-1	CC1=C(C(=NN1)C)Br	{32: 1, 1: 2, 18: 1, 35: 1}
Did not match all atoms present	3398-46-7	CC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O.CS(=O)(=O)O	{32: 1, 1: 5, 3: 1, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	3398-48-9	CC\1=C(NC(=C(/C1=C\2/C=CC(=C(C2=O)OC)OC)N)C3=NC4=C(C=C3)C(=O)C(=C(C4=O)N)OC)C(=O)OC	{32: 1, 1: 5, 35: 1, 14: 4, 15: 10, 22: 3, 25: 3, 28: 1, 30: 2}
Did not match all atoms present	33984-50-8	COC1=CC=C(C=C1)CNC2=CC=C(C3=NON=C23)[N+](=O)[O-]	{1: 1, 2: 1, 35: 2, 38: 1, 14: 6, 22: 1, 23: 1, 31: 1}
Did not match all atoms present	33985-07-8	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)OCC#C)C)C	{1: 5, 2: 4, 3: 2, 9: 1, 10: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1}
Did not match all atoms present	33985-71-6	C1CC2=CC(=CC3=C2N(C1)CCC3)C=O	{33: 1, 26: 1, 11: 6, 14: 2}
Did not match all atoms present	3399-96-0	CC[As](CC)Br	{1: 2, 2: 2, 18: 1}
Did not match all atoms present	33993-53-2	CN=S(=O)(C)C1=CC=CC=C1	{1: 2, 34: 1, 29: 1, 14: 5}
Did not match all atoms present	340-05-6	C1=CC=C(C=C1)C(C(F)(F)F)O	{16: 3, 20: 1, 3: 1, 4: 1, 14: 5}
Did not match all atoms present	340-06-7	C1=CC=C(C=C1)[C@@H](C(F)(F)F)O	{16: 3, 20: 1, 3: 1, 4: 1, 14: 5}
Did not match all atoms present	340-56-7	CC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)C.Cl	{1: 2, 35: 1, 33: 1, 14: 8, 17: 1, 25: 1}
Did not match all atoms present	340-57-8	CC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl	{1: 1, 35: 1, 33: 1, 14: 8, 17: 1, 25: 1}
Did not match all atoms present	3400-12-2	CN1C(O1)C2=CC=CC=C2	{1: 1, 12: 1, 33: 1, 14: 5, 23: 1}
Did not match all atoms present	34000-48-1	CC(C)(C)N=NC1=CC=CC=C1	{1: 3, 34: 2, 4: 1, 14: 5}
Did not match all atoms present	34003-80-0	CC1=CC2=C(C=CC=C2C3=CC=CC4=C3C=C(C=C4)C)C=C1	{1: 2, 14: 12}
Did not match all atoms present	34004-36-9	C[N+](C)(C)CC(CO)O.[Cl-]	{1: 3, 2: 2, 3: 1, 20: 2, 17: 1}
Did not match all atoms present	34005-16-8	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{38: 1, 21: 1, 14: 3, 29: 3}
Did not match all atoms present	34008-91-8	CCS(=O)(=O)CC=C	{1: 1, 2: 2, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	34008-93-0	CCS(=O)(=O)CC(C)C	{1: 3, 2: 2, 3: 1, 29: 2}
Did not match all atoms present	34008-94-1	CCS(=O)(=O)C(C)(C)C	{1: 4, 2: 1, 4: 1, 29: 2}
Did not match all atoms present	34009-07-9	CC(C)CS(=O)(=O)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 29: 2, 14: 5}
Did not match all atoms present	3401-26-1	C1=CC=C(C=C1)[Si](CCCCl)(Cl)Cl	{17: 3, 2: 3, 14: 5}
Did not match all atoms present	3401-74-9	CCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCC.[Cl-]	{1: 4, 2: 22, 17: 1}
Did not match all atoms present	3401-80-7	C1=CC(=C(C(=C1Cl)C(=O)O)O)Cl	{17: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	34014-18-1	CC(C)(C)C1=NN=C(S1)N(C)C(=O)NC	{1: 5, 35: 2, 4: 1, 33: 1, 41: 1, 24: 1, 31: 1}
Did not match all atoms present	34018-28-5	[O-]Br(=O)=O.[O-]Br(=O)=O.[Pb+2]	{18: 2, 29: 6}
Did not match all atoms present	3402-24-2	CCOP(N(C)C)N(C)C	{1: 5, 2: 1, 22: 1, 33: 2}
Did not match all atoms present	3402-74-2	CC1=CC=C(C=C1)OC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 8}
Did not match all atoms present	3402-76-4	C1=CC=C(C=C1)OC2=CC=CC3=CC=CC=C32	{22: 1, 14: 12}
Did not match all atoms present	34028-37-0	C1C(OC(=NC2=CC=CC=C2)N1C3=CC=CC=C3)COC4=CC=CC=C4	{33: 1, 2: 1, 11: 1, 12: 1, 34: 1, 14: 15, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	3403-23-4	C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)NN	{3: 1, 28: 1, 30: 1, 14: 10, 31: 1}
Did not match all atoms present	3403-42-7	CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)OC.C(=C\C(=O)O)\C(=O)O	{1: 3, 2: 3, 6: 2, 33: 2, 41: 1, 14: 7, 22: 1, 27: 2}
Did not match all atoms present	34031-32-8	CC[PH+](CC)CC.CC(=O)OCC1C(C(C(C(O1)[S-])OC(=O)C)OC(=O)C)OC(=O)C.[Au+]	{1: 7, 2: 4, 12: 5, 28: 4, 23: 1}
Did not match all atoms present	34036-07-2	C1=CC(=C(C=C1C=O)F)F	{16: 2, 26: 1, 14: 3}
Did not match all atoms present	34036-80-1	CC/C(=N/O[Si](O/N=C(/CC)\C)(O/N=C(/CC)\C)C1=CC=CC=C1)/C	{1: 6, 2: 3, 7: 3, 34: 3, 14: 5, 22: 3}
Did not match all atoms present	34042-82-5	CC1=CC2=CC=CC=C2C(=C1)C3=CC(=CC4=CC=CC=C43)C	{1: 2, 14: 12}
Did not match all atoms present	34044-10-5	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)O)OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)OC7CCC(=O)C(O7)C)O)N(C)C)O	{1: 7, 2: 1, 33: 1, 11: 5, 12: 12, 13: 1, 14: 3, 20: 2, 21: 3, 22: 3, 23: 3, 25: 3, 28: 1}
Did not match all atoms present	34045-66-4	C1=CC=C(C=C1)P(=O)([O-])[O-].[Zn+2]	{29: 3, 14: 5}
Did not match all atoms present	3405-88-7	C1=CC(=CC=C1SCC(=O)O)Cl	{40: 1, 17: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	34052-37-4	C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl	{24: 1, 17: 1, 38: 1, 14: 8}
Did not match all atoms present	3406-02-8	C1=CC=C(C=C1)S(=O)(=O)CS(=O)(=O)C2=CC=CC=C2	{2: 1, 29: 4, 14: 10}
Did not match all atoms present	3406-03-9	C1=CC=C(C=C1)C(=O)CS(=O)(=O)C2=CC=CC=C2	{24: 1, 2: 1, 29: 2, 14: 10}
Did not match all atoms present	3406-84-6	C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)Cl)S(=O)(=O)Cl	{17: 2, 29: 4, 14: 8}
Did not match all atoms present	34068-01-4	CC(=O)C1=CC(=CC=C1)OCC2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	3407-93-0	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NN	{35: 1, 30: 1, 14: 8, 31: 1}
Did not match all atoms present	3407-94-1	C1=CC(=CC2=NC3=C(C=C21)C=C(C=C3)N)N	{35: 1, 30: 2, 14: 7}
Did not match all atoms present	34071-95-9	C1CC(=O)N(C1=O)OC(=O)CCC2=CC=C(C=C2)O	{33: 1, 2: 2, 11: 2, 14: 4, 21: 1, 25: 2, 28: 1}
Did not match all atoms present	34074-98-1	CCOC1=CC=C(C=C1)NC=CC2=[N+](C3=CC=CC=C3C2(C)C)C.[Cl-]	{1: 4, 2: 1, 6: 2, 33: 1, 13: 1, 14: 8, 15: 1, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	34079-22-6	CC[C@](C1=C(C(=O)N2CC3=CC4=CC=CC=C4N=C3C2=C1)CO)(C(=O)O)O	{1: 1, 2: 2, 35: 1, 4: 1, 33: 1, 11: 1, 14: 6, 20: 2, 25: 1, 27: 1}
Did not match all atoms present	34081-17-9	CCOC(=O)C(CC1=CC=C(C=C1)O)N	{1: 1, 2: 2, 3: 1, 14: 4, 21: 1, 28: 1, 30: 1}
Did not match all atoms present	34097-60-4	COC(=O)CS(=O)(=O)C1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 29: 2, 14: 5}
Did not match all atoms present	341-02-6	[B-](F)(F)(F)F.C1=CC=C(C=C1)[C+](C2=CC=CC=C2)C3=CC=CC=C3	{16: 4, 14: 15, 7: 1}
Did not match all atoms present	341-69-5	CC1=CC=CC=C1C(C2=CC=CC=C2)OCCN(C)C.Cl	{1: 3, 2: 2, 3: 1, 33: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	341-70-8	CCN(CC)CCN1C2=CC=CC=C2SC3=CC=CC=C31.Cl	{1: 2, 2: 4, 33: 2, 41: 1, 14: 8, 17: 1}
Did not match all atoms present	3410-77-3	C(=N[Si](N=C=O)(N=C=O)N=C=O)=O	{8: 4, 34: 4, 29: 4}
Did not match all atoms present	34109-80-3	F[Ti-2](F)(F)(F)(F)F.[Ni+2]	{16: 6}
Did not match all atoms present	3411-04-9	CC1=C(C(=C(C=C1)C(=O)O)NC(=O)C)O	{1: 2, 14: 2, 21: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	3411-48-1	C1=CC=C2C(=C1)C=CC=C2P(C3=CC=CC4=CC=CC=C43)C5=CC=CC6=CC=CC=C65	{14: 21}
Did not match all atoms present	3411-95-8	C1=CC=C2C(=C1)NC(=C3C=CC=CC3=O)S2	{32: 1, 25: 1, 41: 1, 14: 8, 15: 2}
Did not match all atoms present	34113-69-4	C1=CC(=C(C=C1C(=O)O)O)Cl	{17: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	34114-36-8	CC1=CC=CC=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{1: 1, 14: 9, 20: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	34118-39-3	N(=P(F)(F)F)P(F)F	{16: 5, 34: 1}
Did not match all atoms present	3412-76-8	C1=CC=C(C=C1)C[NH2+]CC[NH2+]CC2=CC=CC=C2.[Cl-].[Cl-]	{17: 2, 2: 4, 14: 10}
Did not match all atoms present	34123-59-6	CC(C)C1=CC=C(C=C1)NC(=O)N(C)C	{1: 4, 3: 1, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	34124-14-6	C1=CC=C(C(=C1)CCC2=CC=CC=C2N)N	{2: 2, 30: 2, 14: 8}
Did not match all atoms present	34126-16-4	COC(=O)C1=CC(=C(C(=C1)O)Br)O	{1: 1, 18: 1, 28: 1, 21: 2, 14: 2}
Did not match all atoms present	34128-01-3	C(C(C(=O)[O-])OCC(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]	{24: 3, 2: 2, 3: 1, 22: 1}
Did not match all atoms present	3413-58-9	CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OCC)O	{1: 2, 2: 2, 3: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	34136-59-9	CCC1=CC=CC=C1C#N	{1: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	3414-47-9	C1C(OC(=S)N1)COC2=CC=CC(=C2)C(F)(F)F	{32: 1, 2: 1, 4: 1, 11: 1, 12: 1, 14: 4, 15: 1, 16: 3, 22: 1, 23: 1}
Did not match all atoms present	3414-62-8	C1=NC2=C(C(=N1)NO)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 4, 23: 1, 31: 1}
Did not match all atoms present	3414-82-2	CCC1(CCC(=O)N1)C2=CC=CC=C2	{32: 1, 1: 1, 2: 1, 11: 2, 13: 1, 14: 5, 25: 1}
Did not match all atoms present	3414-89-9	CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 12, 6: 4}
Did not match all atoms present	34140-59-5	CCC(COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)N(C)C.C(=C\C(=O)O)\C(=O)O	{1: 6, 2: 2, 4: 1, 6: 2, 33: 1, 14: 7, 22: 3, 27: 2, 28: 1}
Did not match all atoms present	34142-26-2	CC1=NN(C(=O)C1C=C2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C)C4=CC=C(C=C4)S(=O)(=O)O	{1: 2, 35: 2, 6: 1, 33: 2, 12: 1, 14: 8, 15: 3, 20: 2, 25: 2, 29: 4}
Did not match all atoms present	34145-05-6	C1=CC(=C(C=C1Cl)CO)Cl	{17: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	34148-01-1	C1CCC(CC1)C2=C(C=C3C(CCC3=C2)C(=O)O)Cl	{27: 1, 17: 1, 11: 7, 12: 2, 14: 2}
Did not match all atoms present	34158-72-0	C1=CC=C(C(=C1)C=NO)Br	{18: 1, 34: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	3416-26-0	CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F	{1: 2, 2: 4, 3: 1, 33: 2, 11: 4, 14: 11, 16: 2, 24: 1, 31: 1}
Did not match all atoms present	34160-24-2	COC1=CC=C(O1)OC	{1: 2, 22: 2, 14: 2, 23: 1}
Did not match all atoms present	34161-24-5	C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)COC4=CC=C(C=C4)Cl	{33: 2, 2: 2, 11: 5, 14: 7, 17: 1, 22: 1, 23: 2, 24: 1}
Did not match all atoms present	34164-06-2	C(C(=O)Cl)P(=O)(Cl)Cl	{24: 1, 17: 3, 2: 1, 29: 1}
Did not match all atoms present	34165-19-0	CC1=CC=CC2=NC(=C(N12)C)C	{1: 3, 35: 1, 14: 3, 33: 1}
Did not match all atoms present	34169-62-5	C1=CC=C2C(=C1)C(=O)C=C(C2=O)S(=O)(=O)[O-].[K+]	{25: 2, 29: 3, 14: 5, 15: 1}
Did not match all atoms present	3417-91-2	COC(=O)[C@H](CC1=CC=C(C=C1)O)N.Cl	{1: 1, 2: 1, 3: 1, 14: 4, 17: 1, 21: 1, 28: 1, 30: 1}
Did not match all atoms present	34171-46-5	C1=CC=C(C=C1)C(=O)OCC2=CC=CO2	{2: 1, 28: 1, 14: 8, 23: 1}
Did not match all atoms present	34171-69-2	C(#N)[C-](C#N)C#N.[K+]	{37: 3, 7: 1}
Did not match all atoms present	34175-11-6	O=S([O-])S(=O)O	{20: 1, 29: 3}
Did not match all atoms present	34176-91-5	C1=CC=C(C=C1)CCC2=CC=CC(=C2)C#N	{2: 2, 37: 1, 14: 9}
Did not match all atoms present	3418-46-0	CN1C2=CC=CC=C2N(C1=S)C	{1: 2, 14: 4, 33: 2}
Did not match all atoms present	34183-06-7	C1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)Cl)O)Cl	{24: 1, 17: 2, 21: 1, 14: 7}
Did not match all atoms present	34183-22-7	CCCNCC(COC1=CC=CC=C1C(=O)CCC2=CC=CC=C2)O.Cl	{1: 1, 2: 6, 3: 1, 14: 9, 17: 1, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	3419-18-9	C1=CC(=CC=C1C=NO)N	{30: 1, 34: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	341972-98-3	CCCCCCCCCCCCCCCC(=O)OC1=CNC2=C1C(=C(C=C2)Br)Cl	{32: 1, 1: 1, 2: 14, 14: 3, 17: 1, 18: 1, 28: 1}
Did not match all atoms present	342-23-4	C1=CC=C(C(=C1)C(=O)C2=CC=CC=C2F)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	342-24-5	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2F	{16: 1, 24: 1, 14: 9}
Did not match all atoms present	342-25-6	C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)F)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	342-69-8	CSC1=NC=NC2=C1N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{1: 1, 2: 1, 35: 3, 33: 1, 40: 1, 12: 4, 14: 2, 20: 3, 23: 1}
Did not match all atoms present	342-95-0	C1=CC=C(C(=C1)CC(C(=O)O)N)N(CCCl)CCCl	{33: 1, 2: 5, 3: 1, 14: 4, 17: 2, 27: 1, 30: 1}
Did not match all atoms present	3420-02-8	CC1=CC2=C(C=C1)C=CN2	{32: 1, 1: 1, 14: 5}
Did not match all atoms present	3420-59-5	CC(=O)C1=C(C=CO1)O	{24: 1, 1: 1, 21: 1, 14: 2, 23: 1}
Did not match all atoms present	3420-62-0	C1CN(C1)C(=O)C2=CC=CC=C2	{24: 1, 33: 1, 11: 3, 14: 5}
Did not match all atoms present	3420-97-1	CCOC1=CC=C(C=C1)N=O	{1: 1, 2: 1, 34: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	34200-53-8	CCN(CC)C1=CC=C(C=C1)C=C2C(=O)C3=CC=CC=C3C2=O	{1: 2, 2: 2, 6: 1, 33: 1, 14: 8, 15: 1, 25: 2}
Did not match all atoms present	34202-30-7	CC(=O)O[Al]OC=O.O	{1: 1, 26: 1, 28: 1}
Did not match all atoms present	34202-69-2	C(=O)(C(F)(F)F)C(F)(F)F.O.O.O	{16: 6, 24: 1, 4: 2}
Did not match all atoms present	34205-21-5	CC(C)(C)C1=NN(C(=O)O1)C2=C(C=C(C=C2)NC(=O)N(C)C)Cl	{1: 5, 35: 1, 4: 1, 33: 2, 14: 3, 17: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	34209-97-7	C1=CC(=C(C=C1Cl)Cl)/C=C/[N+](=O)[O-]	{17: 2, 38: 1, 14: 3, 6: 2}
Did not match all atoms present	34214-51-2	CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)[O-].O.[Na+]	{1: 3, 35: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 3, 16: 1, 17: 1, 23: 1, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	34217-90-8	CCC1C(C(=O)NC1CC2=NC(=CC3=C(C(=C(N3)CC4C(C(C(=O)N4)CC)C)C)CCC(=O)O)C(=C2C)CCC(=O)O)C	{32: 3, 1: 6, 2: 8, 35: 1, 6: 1, 12: 6, 15: 4, 25: 2, 27: 2}
Did not match all atoms present	3422-01-3	CC(C)(C)OC(=O)NC1=CC=CC=C1	{1: 3, 31: 1, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	34228-15-4	CC(/C(=C/C(=O)C(C)(C)C)/O[Ga](O/C(=C\C(=O)C(C)(C)C)/C(C)(C)C)O/C(=C\C(=O)C(C)(C)C)/C(C)(C)C)(C)C	{1: 18, 4: 6, 6: 3, 7: 3, 22: 3, 24: 3}
Did not match all atoms present	34230-57-4	CC[PH+](CC)CC.CC[PH+](CC)CC.C#[C-].C#[C-].[Pd+2]	{1: 6, 2: 6, 9: 2}
Did not match all atoms present	34230-58-5	CC[PH+](CC)CC.CC[PH+](CC)CC.C#[C-].C#[C-].[Pt+2]	{1: 6, 2: 6, 9: 2}
Did not match all atoms present	34230-60-9	CC[PH+](CC)CC.CC[PH+](CC)CC.CC#[C-].CC#[C-].[Pd+2]	{1: 8, 2: 6, 10: 2}
Did not match all atoms present	34230-61-0	CC[PH+](CC)CC.CC[PH+](CC)CC.CC#[C-].CC#[C-].[Pt+2]	{1: 8, 2: 6, 10: 2}
Did not match all atoms present	34231-78-2	CC(=O)OC1=CC=CC(=C1)C=O	{1: 1, 26: 1, 28: 1, 14: 4}
Did not match all atoms present	34232-11-6	C[Sn](C)(C)CCCC=C	{1: 3, 2: 3, 5: 1, 6: 1}
Did not match all atoms present	34233-64-2	C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])NC7=CC=CC=C7)S(=O)(=O)[O-])S(=O)(=O)O)NC8=CC=C(C=C8)S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+]	{35: 6, 6: 2, 14: 24, 20: 2, 29: 10, 31: 6}
Did not match all atoms present	34237-88-2	C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2NC3=CC=CC=C3	{24: 1, 14: 14, 31: 2}
Did not match all atoms present	34239-00-4	CO[Si](C)(C)C1=CC=CC(=C1)[Si](C)C	{1: 5, 22: 1, 14: 4}
Did not match all atoms present	3424-82-6	C1=CC=C(C(=C1)C(=C(Cl)Cl)C2=CC=C(C=C2)Cl)Cl	{17: 4, 14: 8, 7: 2}
Did not match all atoms present	3424-93-9	COC1=CC=C(C=C1)C(=O)N	{24: 1, 1: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	34240-10-3	CC1=C(C=C(C(=C1)C(=O)O)C(=O)O)C(=O)O	{1: 1, 27: 3, 14: 2}
Did not match all atoms present	34240-80-7	[Cl-].[Co]	{17: 1}
Did not match all atoms present	34240-84-1	[Li+].[O-]F	{16: 1, 29: 1}
Did not match all atoms present	34241-86-6	C=C(C1=CC=CC=C1)C2=CC(=CC=C2)C(=C)C3=CC=CC=C3	{5: 2, 14: 14, 7: 2}
Did not match all atoms present	34244-05-8	CN(P(OC)OC)P(OC)OC	{1: 5, 22: 4, 33: 1}
Did not match all atoms present	34244-14-9	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)Cl	{17: 1, 14: 9}
Did not match all atoms present	34244-89-8	CCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 3}
Did not match all atoms present	34244-90-1	CCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 4}
Did not match all atoms present	34244-91-2	CCCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 5}
Did not match all atoms present	34244-92-3	CCCCCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 7}
Did not match all atoms present	34244-93-4	CCCCCCCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 9}
Did not match all atoms present	34246-57-6	CC(C)C1=CC=CC(=C1)C=O	{1: 2, 26: 1, 3: 1, 14: 4}
Did not match all atoms present	3425-46-5	C(#N)[Se-].[K+]	{37: 1}
Did not match all atoms present	34255-03-3	C1CCN2CC(CCC2C1)CC3=CC=C(C=C3)Cl.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{33: 1, 2: 1, 3: 2, 11: 7, 12: 2, 14: 4, 17: 1, 20: 2, 27: 2}
Did not match all atoms present	34255-45-3	CCN1C(=O)C(=CN2CCCCC2)SC1=S	{1: 1, 2: 1, 6: 1, 33: 2, 41: 1, 11: 5, 15: 2, 25: 1}
Did not match all atoms present	34256-82-1	CCC1=CC=CC(=C1N(COCC)C(=O)CCl)C	{1: 3, 2: 4, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	342573-75-5	CCOS(=O)(=O)[O-].CCn1cc[n+](C)c1	{1: 3, 2: 2, 33: 2, 14: 3, 22: 1, 29: 3}
Did not match all atoms present	34259-70-6	C[Si](C)C1=CC(=CC=C1)[Si](C)(C)Cl	{1: 4, 14: 4, 17: 1}
Did not match all atoms present	34259-71-7	C[Si](C)C1=CC(=CC=C1)[Si](C)(Cl)Cl	{1: 3, 14: 4, 17: 2}
Did not match all atoms present	34259-72-8	C[Si](C)C1=CC(=CC=C1)[Si](Cl)(Cl)Cl	{1: 2, 14: 4, 17: 3}
Did not match all atoms present	3426-01-5	C1=CC=C(C=C1)C2C(=O)NN(C2=O)C3=CC=CC=C3	{32: 1, 25: 2, 12: 1, 14: 10, 33: 1}
Did not match all atoms present	3426-28-6	C=CC=NNC1=CC=C(C=C1)[N+](=O)[O-]	{34: 1, 5: 1, 38: 1, 14: 4, 6: 2, 31: 1}
Did not match all atoms present	3426-43-5	COC1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)OC)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC=CC=C6.[Na+].[Na+]	{1: 2, 35: 6, 6: 2, 14: 16, 22: 2, 29: 6, 31: 4}
Did not match all atoms present	3426-62-8	C[NH2+]C.C1=CC(=C(C(=C1Cl)C(=O)[O-])Cl)Cl	{24: 1, 1: 2, 14: 2, 17: 3}
Did not match all atoms present	3426-71-9	C1=CC=C(C=C1)COC(=O)NO	{28: 1, 2: 1, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	3426-89-9	C1=CC=C(C=C1)OP(Cl)Cl	{17: 2, 22: 1, 14: 5}
Did not match all atoms present	34262-88-9	COC1=CC=C(C=C1)SCC(=O)O	{1: 1, 2: 1, 40: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	34265-58-2	CCOC(=O)C1=C(C=CC(=C1)C)O	{1: 2, 2: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	34274-30-1	C(CN(CP(=O)(O)[O-])CP(=O)(O)[O-])N(CP(=O)(O)[O-])CP(=O)(O)[O-].[K+].[K+].[K+].[K+]	{33: 2, 2: 6, 20: 4, 29: 8}
Did not match all atoms present	34276-89-6	CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4[Se]3)CCCCS(=O)(=O)[O-]	{1: 1, 2: 5, 6: 1, 33: 2, 14: 10, 15: 1, 29: 3}
Did not match all atoms present	3428-24-8	C1=C(C(=CC(=C1Cl)Cl)O)O	{17: 2, 21: 2, 14: 2}
Did not match all atoms present	34281-92-0	C1CC[C@@H]([C@H](C1)C2=CC=CC=C2)O	{20: 1, 11: 4, 12: 2, 14: 5}
Did not match all atoms present	34289-01-5	COC1=CC2=C(C=C1)C(=C(S2)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCC5	{1: 1, 2: 2, 33: 1, 41: 1, 11: 4, 14: 12, 22: 2}
Did not match all atoms present	3429-52-5	CC(C)[Si](C)(C)C	{1: 5, 3: 1}
Did not match all atoms present	34294-53-6	CCCCCCCCCCCCCCOP(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 13, 22: 3, 14: 10}
Did not match all atoms present	343-01-1	C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)F	{16: 1, 25: 1, 14: 7}
Did not match all atoms present	343-21-5	C1=CC=C2C(=C1)NC3=CC=CC(=C3S2)C(F)(F)F	{16: 3, 32: 1, 4: 1, 14: 7, 41: 1}
Did not match all atoms present	343-65-7	C1=CC=C(C(=C1)C(=O)CC(C(=O)O)N)N	{2: 1, 3: 1, 14: 4, 24: 1, 27: 1, 30: 2}
Did not match all atoms present	343-75-9	CN(C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2F)F)F	{16: 3, 1: 2, 34: 2, 14: 6, 33: 1}
Did not match all atoms present	343-89-5	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)F	{1: 1, 11: 1, 14: 6, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	343-94-2	C1=CC=C2C(=C1)C(=CN2)CCN.Cl	{32: 1, 17: 1, 2: 2, 30: 1, 14: 5}
Did not match all atoms present	3430-09-9	C1=CC=C(C=C1)C(=O)C2=NC=CN=C2	{24: 1, 35: 2, 14: 8}
Did not match all atoms present	3430-17-9	CC1=C(N=CC=C1)Br	{1: 1, 18: 1, 35: 1, 14: 3}
Did not match all atoms present	3430-18-0	CC1=CC(=CN=C1Br)Br	{1: 1, 18: 2, 35: 1, 14: 2}
Did not match all atoms present	3430-21-5	CC1=CC(=CN=C1N)Br	{1: 1, 18: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	3430-26-0	CC1=CC(=NC=C1Br)Br	{1: 1, 18: 2, 35: 1, 14: 2}
Did not match all atoms present	3430-27-1	CC1=C(C=NC=C1)N	{1: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	3430-33-9	CC1=NC(=C(C=C1)N)C	{1: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	34305-47-0	C1=CC=C2C3C4C3C4C2=C1	{12: 4, 14: 4}
Did not match all atoms present	34314-31-3	CCC(O)OCC1=C(C=CC(=C1Cl)Cl)Cl	{1: 1, 2: 2, 3: 1, 14: 2, 17: 3, 20: 1, 22: 1}
Did not match all atoms present	34316-15-9	C[N+]1=C2C(=C3C=CC(=C(C3=C1)OC)OC)C=CC4=CC5=C(C=C42)OCO5	{1: 3, 33: 1, 11: 1, 14: 7, 22: 2, 23: 2}
Did not match all atoms present	34317-61-8	C1=CC=C(C=C1)SC[C@@H](C(=O)O)N	{2: 1, 3: 1, 40: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	3432-10-8	CC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)[N+](=C(C=C3)C=CC4=CC=C(C=C4)N)C.CC(=O)[O-]	{1: 3, 6: 2, 33: 1, 14: 13, 24: 3, 30: 1, 31: 2}
Did not match all atoms present	34320-82-6	C1C(=NN(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl)NC3=CC=C(C=C3)[N+](=O)[O-]	{33: 1, 35: 1, 38: 1, 11: 1, 14: 6, 15: 1, 17: 3, 25: 1, 31: 1}
Did not match all atoms present	34326-59-5	N(P(F)F)P(F)F	{16: 4, 31: 1}
Did not match all atoms present	34328-00-2	C1=CC=C(C=C1)N2C(=O)/C(=C\C=C\3/N(C4=CC=CC=C4O3)CCCS(=O)(=O)[O-])/N(C2=S)CCO.[Na+]	{33: 3, 2: 5, 6: 2, 14: 9, 15: 3, 20: 1, 23: 1, 25: 1, 29: 3}
Did not match all atoms present	34328-46-6	C1=CC(=C(C=C1C=O)C(F)(F)F)Cl	{16: 3, 17: 1, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	34328-61-5	C1=CC(=C(C=C1C=O)Cl)F	{16: 1, 17: 1, 26: 1, 14: 3}
Did not match all atoms present	3433-80-5	C1=CC=C(C(=C1)CBr)Br	{2: 1, 18: 2, 14: 4}
Did not match all atoms present	34330-15-9	CN1C=CC=CC1=C2C(=O)N(C(=S)S2)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 33: 2, 41: 1, 14: 4, 15: 3, 25: 1}
Did not match all atoms present	34333-07-8	[B]C(CC)O[Sn](CCCC)(CCCSB(SCCC[Sn](CCCC)(COCC)OCCS)S/C=C\O[Sn](CCCC)(/C=C\CC)OCCS)OCCS	{1: 6, 2: 25, 3: 1, 6: 4, 39: 3, 40: 3, 22: 6}
Did not match all atoms present	34334-47-9	CC1(C2CCC1(CN(C2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)F)C)C	{1: 3, 33: 1, 11: 4, 12: 1, 13: 2, 14: 4, 16: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	3434-88-6	CC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)OC(=O)C)C	{1: 3, 11: 6, 12: 4, 13: 1, 14: 3, 28: 2}
Did not match all atoms present	34346-90-2	COC1=CC(=CC(=C1OC)OC)C=CC=O	{1: 3, 22: 3, 26: 1, 14: 2, 6: 2}
Did not match all atoms present	34346-96-8	CC1=CC=CC2=C1C3=CC4=CC=CC=C4C(=C3C=C2)CBr	{1: 1, 2: 1, 18: 1, 14: 10}
Did not match all atoms present	34346-97-9	C1=CC=C2C(=C1)C=C3C4=CC=CC=C4C=C(C3=C2CBr)F	{16: 1, 2: 1, 18: 1, 14: 10}
Did not match all atoms present	34348-46-4	C[N+](C)(CC(C[N+](C)(C)CC(CCl)O)O)CC(CCl)O.[Cl-].[Cl-]	{1: 4, 2: 6, 3: 3, 20: 3, 17: 4}
Did not match all atoms present	3435-15-2	CC(=O)O[Si](C)OC(=O)C	{1: 3, 28: 2}
Did not match all atoms present	3435-28-7	CC1=CC(=NC=N1)N	{1: 1, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	3435-51-6	C=CC1=CC=C(C=C1)C#N	{14: 4, 5: 1, 6: 1, 37: 1}
Did not match all atoms present	34352-74-4	CC(C)(C1=CC=C(C=C1)C2=CC=CC=C2)O	{1: 2, 4: 1, 14: 9, 20: 1}
Did not match all atoms present	34359-90-5	CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 2, 2: 15, 29: 3, 14: 9, 33: 1}
Did not match all atoms present	34362-37-3	CC(CC1=CC=CC=C1)C(C)OC(=O)C	{1: 3, 2: 1, 3: 2, 28: 1, 14: 5}
Did not match all atoms present	34367-95-8	CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)N=NC4=NC=CS4	{1: 1, 34: 2, 35: 1, 33: 1, 41: 1, 14: 11}
Did not match all atoms present	34367-96-9	COC1=CC(=C(C=C1C=C(C#N)C#N)OC)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3	{1: 2, 2: 4, 33: 1, 6: 1, 7: 1, 14: 12, 22: 2, 28: 2, 37: 2}
Did not match all atoms present	3437-89-6	CCC(=CC1=CC=CC=C1)C(=O)C	{1: 2, 2: 1, 6: 1, 7: 1, 14: 5, 24: 1}
Did not match all atoms present	3437-95-4	C1=CSC(=C1)I	{41: 1, 19: 1, 14: 3}
Did not match all atoms present	34372-72-0	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)N(CC6=CC=CC=C6)CC7=CC=CC=C7	{1: 2, 2: 4, 33: 2, 13: 1, 14: 20, 23: 1, 28: 1}
Did not match all atoms present	34375-78-5	CC1=NN(C2=C1NCC3=CC=CC=C3O2)C.Cl	{32: 1, 1: 2, 35: 1, 33: 1, 11: 1, 14: 4, 17: 1, 23: 1}
Did not match all atoms present	34376-24-4	CC(=O)CC(=O)NC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 1, 14: 4, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	34378-76-2	C(C1C(C(C(C(O1)O)O)O)O)OP(=O)([O-])[O-].[Mg+2]	{2: 1, 12: 5, 20: 4, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	3438-16-2	COC1=C(C=C(C=C1)Cl)C(=O)O	{1: 1, 27: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	3438-46-8	CC1=NC=NC=C1	{1: 1, 35: 2, 14: 3}
Did not match all atoms present	3438-48-0	C1=CC=C(C=C1)C2=NC=NC=C2	{35: 2, 14: 8}
Did not match all atoms present	34381-68-5	CCCC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)C)O)C(=O)C.Cl	{1: 4, 2: 4, 3: 2, 14: 3, 17: 1, 20: 1, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	3439-15-4	C[Si](C)(C)O[Si](C)(C)CCC1=CC=CC=C1	{1: 5, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	3439-38-1	CC[Si](C)(C)C	{1: 4, 2: 1}
Did not match all atoms present	3439-97-2	C[Si](OC1=CC=CC=C1)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 1, 22: 3, 14: 15}
Did not match all atoms present	3439-98-3	C1=C(C=C(C2=NO[N+](=C21)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 35: 1, 38: 2, 14: 2, 23: 1}
Did not match all atoms present	34395-10-3	CC(C)OC(=O)C1=C[N+](=CC=C1)CC2=CC=CC=C2.[Cl-]	{1: 2, 2: 1, 3: 1, 33: 1, 14: 9, 17: 1, 28: 1}
Did not match all atoms present	344-03-6	C1(=C(C(=C(C(=C1Br)F)F)Br)F)F	{16: 4, 18: 2}
Did not match all atoms present	344-04-7	C1(=C(C(=C(C(=C1F)F)Br)F)F)F	{16: 5, 18: 1}
Did not match all atoms present	344-07-0	C1(=C(C(=C(C(=C1F)F)Cl)F)F)F	{16: 5, 17: 1}
Did not match all atoms present	344-18-3	C1=C(C=C(C(=C1Br)N)Br)F	{16: 1, 18: 2, 30: 1, 14: 2}
Did not match all atoms present	344-38-7	C1=CC(=C(C=C1Br)C(F)(F)F)[N+](=O)[O-]	{16: 3, 18: 1, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	344-62-7	CC(=O)NC1=CC=CC=C1C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	344-65-0	C1=CC(=C(C=C1Cl)C(F)(F)F)Br	{16: 3, 17: 1, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	344-72-9	CCOC(=O)C1=C(N=C(S1)N)C(F)(F)F	{1: 1, 2: 1, 35: 1, 4: 1, 41: 1, 16: 3, 28: 1, 30: 1}
Did not match all atoms present	3440-02-6	C[Si](C)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 2, 22: 2, 14: 10}
Did not match all atoms present	3440-19-5	CCNC1=NC(=NC(=N1)Cl)Cl	{1: 1, 2: 1, 31: 1, 35: 3, 17: 2}
Did not match all atoms present	3440-75-3	CCC[Pb](CCC)(CCC)CCC	{1: 4, 2: 8}
Did not match all atoms present	34403-05-9	CC1=CC=CC=C1CCC2=CC=CC=C2	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	34403-06-0	CC1=CC(=CC=C1)CCC2=CC=CC=C2	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	34408-25-8	COC(=O)C1=CC(=CC(=C1Cl)[N+](=O)[O-])Cl	{1: 1, 28: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	3441-64-3	CC(CC1=CC=CC=C1)N2C=C(O[NH2+]2)N.[Cl-]	{1: 1, 2: 1, 3: 1, 33: 1, 14: 6, 15: 1, 17: 1, 23: 1, 30: 1}
Did not match all atoms present	34413-35-9	C1CCC2=NC=CN=C2C1	{35: 2, 11: 4, 14: 2}
Did not match all atoms present	34415-31-1	C1(=C(C(=NC(=C1Cl)Cl)F)Cl)F	{16: 2, 17: 3, 35: 1}
Did not match all atoms present	3442-15-7	C1=CC=C(C=C1)CC(=O)C=C(C2=CC=CC=C2)O	{2: 1, 6: 1, 7: 1, 14: 10, 20: 1, 24: 1}
Did not match all atoms present	3442-78-2	CC1=CC2=C3C(=C1)C=CC4=C3C(=CC=C4)C=C2	{1: 1, 14: 9}
Did not match all atoms present	34421-94-8	CCOC(C1=CC=C(C=C1)Br)OCC	{1: 2, 2: 2, 3: 1, 14: 4, 18: 1, 22: 2}
Did not match all atoms present	3443-04-7	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\5/C=CC6=C(C5=O)C(=C(C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 12, 15: 3, 22: 2, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	3443-15-0	C1=CC2=C(C=C1[NH3+])C(=O)NC(O2)CCCl.[Cl-]	{32: 1, 2: 2, 12: 1, 14: 3, 17: 2, 23: 1, 25: 1}
Did not match all atoms present	3443-45-6	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCC(=O)O	{2: 3, 27: 1, 14: 9}
Did not match all atoms present	3443-90-1	CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)C)S(=O)(=O)O)C(=O)C5=CC=CC=C5C3=O)S(=O)(=O)O	{1: 2, 14: 12, 20: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	3443-92-3	CC1=C(C(=CC=C1)S(=O)(=O)O)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O	{1: 1, 14: 9, 20: 1, 21: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	34431-26-0	CCCCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 34, 29: 4, 22: 1}
Did not match all atoms present	34432-82-1	C(C(CBr)Br)OP(=O)(O)OCC(CBr)Br.N	{2: 4, 3: 2, 18: 4, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	34432-92-3	CCN(CCOC(C)OCC(C)C)C1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 4, 2: 4, 3: 2, 33: 1, 34: 2, 14: 9, 22: 2}
Did not match all atoms present	34433-31-3	C1=C/C(=C/[NH+]=O)/N(C=C1)COC[N+]2=CC=C(C=C2)C(=O)N.[Cl-].[Cl-]	{33: 2, 2: 2, 6: 1, 14: 8, 15: 1, 17: 2, 22: 1, 24: 1, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	34435-70-6	CC(=O)CCC(C1=COC=C1)O	{1: 1, 2: 2, 3: 1, 14: 3, 20: 1, 23: 1, 24: 1}
Did not match all atoms present	34438-27-2	CC1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)O1)C2=CC=C(C=C2)O)C)CC3CNC(=N3)N)C4=CC(=C(C(=C4)Cl)O)Cl)CO)C5=CC=C(C=C5)O)CC6CNC(=N6)N)CCCNC(=O)N)C(C)O)C7=CC=C(C=C7)O)C8=CC=C(C=C8)O)C(C)O)CCCN)C9=CC=C(C=C9)O)NC(=O)C(CC(=O)O)NC(=O)/C=C\C=C\CCCCC(C)C	{32: 17, 1: 6, 2: 14, 3: 4, 6: 4, 11: 3, 12: 18, 14: 22, 15: 2, 17: 2, 35: 2, 20: 3, 21: 6, 24: 3, 25: 15, 27: 1, 28: 1, 30: 4, 31: 3}
Did not match all atoms present	3444-13-1	C(=O)(C(=O)[O-])[O-].[Hg+2]	{24: 2}
Did not match all atoms present	3444-17-5	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Cr+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	34443-12-4	CCCCC(CC)COC(=O)OOC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1, 22: 1}
Did not match all atoms present	34444-01-4	CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)[C@@H](C4=CC=CC=C4)O)SC2)C(=O)O	{1: 1, 2: 1, 3: 1, 33: 2, 40: 1, 41: 1, 11: 1, 12: 2, 14: 5, 15: 2, 35: 3, 20: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	34446-13-4	C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C#N	{24: 1, 37: 1, 14: 9, 31: 1}
Did not match all atoms present	34446-26-9	CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)N=NC4=CC=C(C=C4)[N+](=O)[O-])C	{1: 3, 2: 2, 38: 1, 33: 1, 34: 4, 14: 13}
Did not match all atoms present	3445-42-9	CC(C)C1=CC=C(C=C1)C(C)(C)O	{1: 4, 3: 1, 4: 1, 14: 4, 20: 1}
Did not match all atoms present	3445-76-9	C1=CC=C(C=C1)C2=CC(=S)SS2	{41: 2, 14: 6}
Did not match all atoms present	34452-51-2	C(C(=O)[O-])S.[K+]	{24: 1, 2: 1, 39: 1}
Did not match all atoms present	3446-89-7	CSC1=CC=C(C=C1)C=O	{40: 1, 1: 1, 26: 1, 14: 4}
Did not match all atoms present	3446-90-0	CSC1=CC=C(C=C1)CO	{40: 1, 1: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	34461-00-2	C(=O)C(=[N+]([O-])[O-])C=O.[Na+]	{26: 2, 7: 1}
Did not match all atoms present	34462-96-9	C=CC(=O)OC1=C(C=C(C2=C1N=CC=C2)Cl)Br	{35: 1, 5: 1, 6: 1, 14: 4, 17: 1, 18: 1, 28: 1}
Did not match all atoms present	34472-48-5	CC(=C1C=CC2=CC=CC=C21)C	{1: 2, 15: 1, 14: 6, 7: 1}
Did not match all atoms present	34472-62-3	C[Ge](C)(C)N=NC1=CC=CC=C1	{1: 3, 34: 2, 14: 5}
Did not match all atoms present	34481-84-0	COC(=O)C1=C(C(=CC=C1)CC2=CC=CC(=C2N)C(=O)OC)N	{1: 2, 2: 1, 28: 2, 30: 2, 14: 6}
Did not match all atoms present	3449-28-3	CCCC[Si](CCCC)(Cl)Cl	{1: 2, 2: 6, 17: 2}
Did not match all atoms present	34491-04-8	C/C(=C\C(=O)NCOP(=O)(OC)OC)/Cl	{1: 3, 2: 1, 6: 1, 7: 1, 17: 1, 22: 3, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	34491-12-8	CCSP(=O)(CCl)SCC	{40: 2, 1: 2, 2: 3, 29: 1, 17: 1}
Did not match all atoms present	34494-09-2	C1=CC2=C3C(=C1)N=C4C=CC5=C6C4=C3C(=NC6=CC=C5)C=C2.OS(=O)(=O)O	{35: 2, 20: 2, 29: 2, 14: 10}
Did not match all atoms present	345-16-4	C1=CC(=C(C=C1F)C(=O)O)O	{16: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	345-17-5	C1=CC(=C(C=C1F)[N+](=O)[O-])Cl	{16: 1, 17: 1, 38: 1, 14: 3}
Did not match all atoms present	345-35-7	C1=CC=C(C(=C1)CCl)F	{16: 1, 17: 1, 2: 1, 14: 4}
Did not match all atoms present	345-71-1	C1=CC(=CC(=C1)F)C(=O)C2=CC=C(C=C2)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	345-78-8	C[C@@H]([C@H](C1=CC=CC=C1)O)NC.Cl	{1: 2, 3: 2, 14: 5, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	345-83-5	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)F	{16: 1, 24: 1, 14: 9}
Did not match all atoms present	345-92-6	C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)F)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	34503-47-4	C=CC1=CC=CC=N1.II	{35: 1, 14: 4, 19: 2, 5: 1, 6: 1}
Did not match all atoms present	34503-94-1	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=[N+](C2=C(C1(C)C)C=C(C=C2)[N+](=O)[O-])C	{1: 5, 38: 1, 33: 1, 13: 1, 14: 7, 15: 1, 29: 3}
Did not match all atoms present	34506-45-1	CCCCCCCCCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 12, 29: 3, 22: 1}
Did not match all atoms present	3451-02-3	COC(=O)C1=C(C(=C(C=C1)C(=O)OC)C(=O)OC)C(=O)OC	{1: 4, 28: 4, 14: 2}
Did not match all atoms present	34510-96-8	CCC(C)P(=O)(OCC)OCC	{1: 4, 2: 3, 3: 1, 29: 1, 22: 2}
Did not match all atoms present	34521-09-0	C12C3C(=O)O[Sb-]4(O3)OC(C5C(=O)O[Sb-](O1)(O5)OC2=O)C(=O)O4.[Na+].[Na+]	{28: 4, 12: 4, 23: 4}
Did not match all atoms present	34521-14-7	CC[N+](CC)(CC)CCSC(=N)[NH3+].[Br-].[Br-]	{1: 3, 2: 5, 36: 1, 7: 1, 40: 1, 18: 2}
Did not match all atoms present	34521-16-9	CC[N+](CC)(CC)CCSC1=NCC[NH2+]1.[Br-].[Br-]	{1: 3, 2: 5, 35: 1, 40: 1, 11: 2, 15: 1, 18: 2}
Did not match all atoms present	34522-40-2	CC1=CC(=CC(=C1C)C)N=NC2=CC=C(C=C2)N(C)C	{1: 5, 34: 2, 14: 6, 33: 1}
Did not match all atoms present	34522-72-0	C1=CC2=C(C=C(C=C2N=C1)F)F	{16: 2, 35: 1, 14: 5}
Did not match all atoms present	34523-28-9	CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)F	{16: 1, 1: 2, 29: 2, 14: 6, 33: 1}
Did not match all atoms present	34529-29-8	CCC1=NONC1=O	{32: 1, 1: 1, 2: 1, 35: 1, 23: 1, 25: 1}
Did not match all atoms present	3453-00-7	CCOP(=O)(CC(=O)C1=CC=CC=C1)OCC	{1: 2, 2: 3, 14: 5, 22: 2, 24: 1, 29: 1}
Did not match all atoms present	34531-26-5	CCCCC(CC)COC(=O)C1=CC(=C(C(=C1)O)O)O	{1: 2, 2: 5, 3: 1, 14: 2, 21: 3, 28: 1}
Did not match all atoms present	3454-07-7	CCC1=CC=C(C=C1)C=C	{1: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	3454-28-2	CC(=C)C(=O)OCC1=CC=CO1	{1: 1, 2: 1, 5: 1, 7: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	34548-72-6	CCC(C)C(CN(C)C)C1=CC=CS1	{1: 4, 2: 2, 3: 2, 33: 1, 41: 1, 14: 3}
Did not match all atoms present	34552-13-1	CC1=CC(=C(N=C1)Cl)N	{1: 1, 35: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	34552-83-5	CN(C)C(=O)C(CCN1CCC(CC1)(C2=CC=C(C=C2)Cl)O)(C3=CC=CC=C3)C4=CC=CC=C4.Cl	{1: 2, 2: 2, 4: 1, 33: 2, 11: 4, 13: 1, 14: 14, 17: 2, 20: 1, 24: 1}
Did not match all atoms present	34559-71-2	COCC(=O)C1=CC2=CC=CC=C2N1	{32: 1, 1: 1, 2: 1, 14: 5, 22: 1, 24: 1}
Did not match all atoms present	3456-75-5	C1=CC(=C(C=C1F)CC#N)[N+](=O)[O-]	{16: 1, 2: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	3456-79-9	C1=CC=C(C=C1)C2C3=CC=CC=C3NC2=O	{32: 1, 25: 1, 12: 1, 14: 9}
Did not match all atoms present	34560-30-0	C1=CC2=C(C(=C1)N)C(=O)C3=C(C2=O)C(=CC=C3)NC4=CC=CC5=C4C(=O)C6=C(C5=O)C(=CC=C6)N	{25: 4, 30: 2, 14: 12, 31: 1}
Did not match all atoms present	34560-81-1	CCCSC1=CC=CC=C1Cl	{40: 1, 1: 1, 2: 2, 14: 4, 17: 1}
Did not match all atoms present	3457-13-4	CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 1, 2: 17, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	3457-46-3	C1=CC(=CC=C1C(=O)C(=O)C2=CC=C(C=C2)Cl)Cl	{24: 2, 17: 2, 14: 8}
Did not match all atoms present	3457-48-5	CC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)C	{24: 2, 1: 2, 14: 8}
Did not match all atoms present	3457-58-7	CC(C)(C1=CC=CC=C1)[N+](=O)[O-]	{1: 2, 4: 1, 38: 1, 14: 5}
Did not match all atoms present	3457-90-7	C(CO[N+](=O)[O-])CO[N+](=O)[O-]	{2: 3, 22: 2}
Did not match all atoms present	3457-92-9	C(CCO[N+](=O)[O-])CCO[N+](=O)[O-]	{2: 5, 22: 2}
Did not match all atoms present	3457-98-5	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N.Cl	{17: 1, 34: 2, 30: 1, 14: 9}
Did not match all atoms present	3457-99-6	C1=CC(=CC=C1CC#N)N.Cl	{17: 1, 2: 1, 30: 1, 14: 4, 37: 1}
Did not match all atoms present	34577-40-7	CCC(CC)(CC1=CC=CC=C1)O	{1: 2, 2: 3, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	3458-22-8	CS(=O)(=O)OCCC[NH2+]CCCOS(=O)(=O)C.[Cl-]	{1: 2, 2: 6, 29: 4, 22: 2, 17: 1}
Did not match all atoms present	3458-72-8	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[NH4+].[NH4+].[NH4+]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	34580-13-7	CN1CCC(=C2C3=C(C(=O)CC4=CC=CC=C42)SC=C3)CC1	{1: 1, 33: 1, 41: 1, 11: 5, 14: 6, 15: 2, 25: 1}
Did not match all atoms present	34580-14-8	CN1CCC(=C2C3=C(C(=O)CC4=CC=CC=C42)SC=C3)CC1.C(=C/C(=O)O)\C(=O)O	{1: 1, 6: 2, 33: 1, 41: 1, 11: 5, 14: 6, 15: 2, 25: 1, 27: 2}
Did not match all atoms present	34586-49-7	CCC1=CC=CC=C1S(=O)(=O)F	{16: 1, 1: 1, 2: 1, 29: 2, 14: 4}
Did not match all atoms present	34586-50-0	CCC1=CC(=CC=C1)S(=O)(=O)F	{16: 1, 1: 1, 2: 1, 29: 2, 14: 4}
Did not match all atoms present	3459-18-5	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC2=CC=C(C=C2)[N+](=O)[O-])CO)O)O	{1: 1, 2: 1, 38: 1, 12: 5, 14: 4, 20: 3, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	3459-20-9	COCCOC1=CN=C(N=C1)[N-]S(=O)(=O)C2=CC=CC=C2.[Na+]	{1: 1, 2: 2, 35: 2, 34: 1, 14: 7, 22: 2, 29: 2}
Did not match all atoms present	3459-88-9	C1=CC=C(C=C1)OCCCCOC2=CC=CC=C2	{2: 4, 22: 2, 14: 10}
Did not match all atoms present	3459-92-5	C1=CC=C(C=C1)COC(=O)OCC2=CC=CC=C2	{2: 2, 14: 10}
Did not match all atoms present	34591-13-4	CCCCCCCCCCCCCCCCOP(=O)(O)O.N	{1: 1, 2: 15, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	34598-49-7	C1CC(=O)C2=C1C=C(C=C2)Br	{25: 1, 18: 1, 11: 2, 14: 3}
Did not match all atoms present	346-06-5	C1=CC=C(C(=C1)CO)C(F)(F)F	{16: 3, 20: 1, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	346-18-9	CN1C(NC2=CC(=C(C=C2S1(=O)=O)S(=O)(=O)N)Cl)CSCC(F)(F)F	{32: 1, 1: 1, 2: 2, 4: 1, 33: 1, 40: 1, 12: 1, 14: 2, 16: 3, 17: 1, 29: 4, 30: 1}
Did not match all atoms present	346-55-4	C1=CC2=C(C=CN=C2C=C1C(F)(F)F)Cl	{16: 3, 17: 1, 35: 1, 4: 1, 14: 5}
Did not match all atoms present	3460-18-2	C1=CC(=C(C=C1Br)[N+](=O)[O-])Br	{18: 2, 38: 1, 14: 3}
Did not match all atoms present	3460-20-6	C1=C(C=C(C(=C1Br)Br)Br)[N+](=O)[O-]	{18: 3, 38: 1, 14: 2}
Did not match all atoms present	3460-24-0	C1=CC(=C(C=C1Br)Cl)Br	{17: 1, 18: 2, 14: 3}
Did not match all atoms present	3460-49-9	CCOC1=CC=C(C=C1)N=C=S	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 22: 1}
Did not match all atoms present	3461-39-0	CC(CC(=O)OC)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	34613-03-1	CCN(CCSC1=NC2=CC=CC=C2S1)C3=CC(=C(C=C3)C=C(C#N)C#N)C	{1: 2, 2: 3, 35: 1, 37: 2, 6: 1, 33: 1, 40: 1, 41: 1, 7: 1, 14: 7}
Did not match all atoms present	34618-17-2	CC(=O)ON1C2=NNN=C2C(=O)NC1=O	{32: 2, 1: 1, 35: 2, 33: 1, 25: 2, 28: 1}
Did not match all atoms present	34618-67-2	CN1C(=C[N+](=N1)C)[S-]	{1: 2, 35: 1, 14: 1, 33: 2}
Did not match all atoms present	34619-03-9	CC(C)(C)OC(=O)OC(C)(C)C	{1: 6, 4: 2}
Did not match all atoms present	34621-99-3	CC(CCl)OP(=O)(OCCOP(=O)(OC(C)CCl)OC(C)CCl)OC(C)CCl	{1: 4, 2: 6, 3: 4, 17: 4, 22: 6, 29: 2}
Did not match all atoms present	34622-08-7	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Nd+3]	{16: 9, 4: 3, 29: 9}
Did not match all atoms present	34627-31-1	CC#P	{1: 1, 10: 1}
Did not match all atoms present	34627-78-6	CC(=O)OC(C=C)C1=CC2=C(C=C1)OCO2	{1: 1, 3: 1, 5: 1, 6: 1, 11: 1, 14: 3, 23: 2, 28: 1}
Did not match all atoms present	3463-21-6	CCO[Si]12OCCN(CCO1)CCO2	{1: 1, 2: 1, 33: 1, 11: 6, 22: 1, 23: 3}
Did not match all atoms present	3463-22-7	C1CO[Si]2(OCCN1CCO2)OC3=CC=CC=C3	{33: 1, 11: 6, 22: 1, 14: 5, 23: 3}
Did not match all atoms present	3463-26-1	CN1C=CC(=N1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	3463-27-2	CN1C(=CC=N1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	3463-35-2	CC(C)(C)C1=CC(=C(C=C1)C(C)(C)C)[N+](=O)[O-]	{1: 6, 4: 2, 38: 1, 14: 3}
Did not match all atoms present	3463-40-9	C1=C(C=C(C(=C1Br)[N+](=O)[O-])Br)Br	{18: 3, 38: 1, 14: 2}
Did not match all atoms present	3463-79-4	C1C2C1C3=CC=CC=C3C=C2	{11: 1, 12: 2, 14: 6}
Did not match all atoms present	34631-88-4	C1=C(N=CSC1=O)Cl	{17: 1, 35: 1, 41: 1, 14: 2, 25: 1}
Did not match all atoms present	34634-22-5	C1=CC=C(C=C1)C(CN=C=S)C2=CC=CC=C2	{8: 1, 2: 1, 3: 1, 34: 1, 14: 10}
Did not match all atoms present	34643-46-4	CCCSP(=S)(OCC)OC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 3, 40: 1, 14: 3, 17: 2, 22: 2}
Did not match all atoms present	34643-52-2	CCCSP(=S)(OCC)OC1=C(C=C(C=C1Cl)Cl)Cl	{1: 2, 2: 3, 40: 1, 14: 2, 17: 3, 22: 2}
Did not match all atoms present	3465-75-6	CCCCCCCCCC(=O)O[Sn](CCCC)(CCCC)OC(=O)CCCCCCCCC	{1: 4, 2: 22, 28: 2}
Did not match all atoms present	3465-77-8	CCCCCCCCCCCCCCCCCC(=O)O[Sn](CCCC)(CCCC)O[Sn](CCCC)(CCCC)OC(=O)CCCCCCCCCCCCCCCCC	{1: 6, 2: 44, 28: 2, 22: 1}
Did not match all atoms present	3465-98-3	C1CC[Se]C1	{11: 4}
Did not match all atoms present	3465-99-4	C1CC[Te]C1	{11: 4}
Did not match all atoms present	34651-95-1	C1(=NC(=O)N(C(=O)N1Cl)Cl)[O-].C1(=NC(=O)N(C(=O)N1Cl)Cl)[O-].C1(=NC(=O)N(C(=O)N1Cl)Cl)[O-].C1(=NC(=O)N(C(=O)N1Cl)Cl)[O-].C1(=O)N(C(=O)N(C(=O)N1Cl)Cl)Cl.[K+].[K+].[K+].[K+]	{17: 11, 35: 4, 33: 11, 25: 11}
Did not match all atoms present	34657-68-6	CC1(C(=O)N(C(=O)N1)CC2=CC=CC=C2)C	{32: 1, 1: 2, 2: 1, 33: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	34661-75-1	CN1C(=CC(=O)N(C1=O)C)NCCCN2CCN(CC2)C3=CC=CC=C3OC	{1: 3, 2: 3, 33: 4, 11: 4, 14: 5, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	34662-31-2	C1=CC(=C(C=C1Cl)C#N)[N+](=O)[O-]	{17: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	34662-32-3	C1=CC(=C(C=C1Cl)[N+](=O)[O-])C#N	{17: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	34668-19-4	C1C=CCC(C1C2=CC=C(C=C2)C3CC=CCC3[N+](=O)[O-])[N+](=O)[O-]	{11: 4, 12: 4, 38: 2, 14: 8}
Did not match all atoms present	34668-73-0	C1COCCN1.C1COCCN1.C1COCCN1.OP(=O)(O)O	{32: 3, 11: 12, 20: 3, 29: 1, 23: 3}
Did not match all atoms present	3467-59-2	CC(=O)NC1=C(C=CC(=C1)OC)OC	{24: 1, 1: 3, 22: 2, 14: 3, 31: 1}
Did not match all atoms present	34671-83-5	C1=CN=C(N=C1)C2=NC=CC=N2	{35: 4, 14: 6}
Did not match all atoms present	34675-84-8	C1CC(CCC1CN)C(=O)OC2=CC=C(C=C2)CCC(=O)O	{2: 3, 11: 4, 12: 2, 14: 4, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	3468-02-8	CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCC[NH+]3CCOCC3)C4=CC=CC=C4.[Cl-]	{1: 1, 2: 2, 11: 4, 14: 8, 17: 1, 23: 2, 25: 1, 28: 1}
Did not match all atoms present	3468-11-9	C1=CC=C2C(=C1)C(=NC2=N)N	{35: 1, 36: 1, 30: 1, 14: 4, 15: 2}
Did not match all atoms present	3468-53-9	C1=CC=C(C=C1)OC(=O)C2=CN=CC=C2	{35: 1, 28: 1, 14: 9}
Did not match all atoms present	3468-63-1	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]	{34: 1, 38: 2, 14: 9, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	3468-99-3	CCOC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 28: 1, 14: 10}
Did not match all atoms present	34681-23-7	CC(/C(=N/OC(=O)NC)/C)S(=O)(=O)C	{1: 4, 34: 1, 3: 1, 7: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	34684-43-0	CC1=CC(=C(C=C1NC(=O)C)S(=O)(=O)Cl)C	{1: 3, 14: 2, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	34685-93-3	CC[N+]1=C(SC2=CC=CC=C21)C=C3CC(CC(=C3)C)(C)C.[I-]	{1: 4, 2: 1, 6: 1, 33: 1, 41: 1, 11: 2, 13: 1, 14: 5, 15: 2, 19: 1}
Did not match all atoms present	34688-70-5	CC1=C(C(=C(C=C1)C(C)(C)C#N)C)C	{1: 5, 4: 1, 37: 1, 14: 2}
Did not match all atoms present	34688-71-6	CC1=CC(=C(C(=C1)C)CC#N)C	{1: 3, 2: 1, 37: 1, 14: 2}
Did not match all atoms present	3469-00-9	COC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 3: 1, 28: 1, 14: 10}
Did not match all atoms present	3469-06-5	C1C2=CC=CC=C2C1=O	{25: 1, 11: 1, 14: 4}
Did not match all atoms present	3469-17-8	C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)[O-])[N+]#N	{34: 1, 14: 10, 7: 2}
Did not match all atoms present	3469-20-3	C1=CC=C(C=C1)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4	{32: 1, 14: 14}
Did not match all atoms present	3469-26-9	COC1=CC2=C(C=C1)C=CC(=C2)OC	{1: 2, 22: 2, 14: 6}
Did not match all atoms present	34691-31-1	CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].[Na+]	{24: 1, 1: 1, 3: 1, 22: 1, 14: 9}
Did not match all atoms present	34692-97-2	C1=CC(=O)C(=CC=C1N)[NH3+].[Cl-]	{17: 1, 30: 1, 14: 4, 25: 1}
Did not match all atoms present	34698-41-4	C1CC2=CC=CC=C2C1N	{11: 2, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	347-55-7	C1=CC=C(C(=C1)N)SC(F)(F)F	{16: 3, 40: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	347-63-7	COC1=C(C=C(C=C1)C(=O)CCC(=O)O)F	{1: 1, 2: 2, 14: 3, 16: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	347-93-3	C1=CC(=CC=C1C(=O)CCCl)F	{16: 1, 17: 1, 2: 2, 14: 4, 24: 1}
Did not match all atoms present	3470-17-5	C12=NO[N+](=C1C3=NO[N+](=C3C4=NO[N+](=C24)[O-])[O-])[O-]	{33: 3, 35: 3, 23: 3}
Did not match all atoms present	34701-14-9	C1CC2=C(C1)C(=CC=C2)[N+](=O)[O-]	{11: 3, 38: 1, 14: 3}
Did not match all atoms present	34708-08-2	CCO[Si](CCCSC#N)(OCC)OCC	{40: 1, 1: 3, 2: 6, 37: 1, 22: 3}
Did not match all atoms present	34709-44-9	C1=CC=C(C(=C1)/C=C\2/C(=O)NC(=S)S2)O	{32: 1, 6: 1, 41: 1, 14: 4, 15: 2, 21: 1, 25: 1}
Did not match all atoms present	3471-05-4	C1CCN=C(C1)C2=CN=CC=C2	{35: 2, 11: 4, 14: 4, 15: 1}
Did not match all atoms present	3471-31-6	COC1=CC2=C(C=C1)NC=C2CC(=O)O	{32: 1, 1: 1, 2: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	34717-03-8	C1=C(NC(=O)NC1=O)C(=O)[O-].C1=C(NC(=O)NC1=O)C(=O)[O-].[Mg+2]	{24: 2, 25: 4, 14: 2, 32: 4}
Did not match all atoms present	34721-69-2	C1CC2=C3C=CC=CC3=C(CCC4=CC=C1O4)C5=CC=CC=C25	{11: 4, 14: 10, 23: 1}
Did not match all atoms present	34722-01-5	CCCCC1=CSC=C1	{1: 1, 2: 3, 14: 3, 41: 1}
Did not match all atoms present	34729-16-3	CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCC[O-].[Ti+4]	{1: 4, 2: 60, 29: 4}
Did not match all atoms present	34729-62-9	CC1=CC(=C(C(=C1)C(C)(C)CC(C)(C)C)O)C(C)(C)C	{1: 9, 2: 1, 4: 3, 21: 1, 14: 2}
Did not match all atoms present	3473-12-9	C1=CC=C(C=C1)CCN(C(=S)N)N	{33: 1, 2: 2, 30: 2, 14: 5, 7: 1}
Did not match all atoms present	34730-59-1	C(CNCCS(=O)(=O)[O-])N.[Na+]	{2: 4, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	34732-09-7	C1=CC(=C(C(=C1S(=O)(=O)Cl)Cl)Cl)Cl	{17: 4, 29: 2, 14: 2}
Did not match all atoms present	34733-85-2	C1=CC=C(C=C1)C2=NN=NS2	{41: 1, 35: 3, 14: 5}
Did not match all atoms present	34736-33-9	C1C=CC[Si]1(F)F	{16: 2, 11: 2, 14: 2}
Did not match all atoms present	34737-89-8	CC1CN(CCC1=O)CC2=CC=CC=C2	{1: 1, 2: 1, 33: 1, 11: 3, 12: 1, 14: 5, 25: 1}
Did not match all atoms present	34743-88-9	C1=CC(=CC=C1OCCO)Br	{2: 2, 22: 1, 20: 1, 18: 1, 14: 4}
Did not match all atoms present	3475-60-3	CCCCC[N+](CCCCC)(CCCCC)CCCCC.C(#N)[S-]	{1: 4, 2: 16, 37: 1}
Did not match all atoms present	3475-74-9	CN(C)C1=C(C=C(C=C1[N+](=O)[O-])N2C(=O)C=CC2=O)[N+](=O)[O-]	{1: 2, 38: 2, 33: 2, 14: 4, 25: 2}
Did not match all atoms present	34757-40-9	CCS(=O)CC=C	{1: 1, 2: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	34758-83-3	COC(CN1CCN(CC1)CC(C(C2=CC=CC=C2)OC)O)C3=CC=CC=C3	{1: 2, 2: 2, 3: 3, 33: 2, 11: 4, 14: 10, 20: 1, 22: 2}
Did not match all atoms present	34758-84-4	COC(CN1CCN(CC1)CC(C(C2=CC=CC=C2)OC)O)C3=CC=CC=C3.Cl.Cl	{1: 2, 2: 2, 3: 3, 33: 2, 11: 4, 14: 10, 17: 2, 20: 1, 22: 2}
Did not match all atoms present	34759-29-0	C1=CC(=CC(=C1)S(=O)(=O)[O-])NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)S(=O)(=O)[O-])NC4=NC(=NC(=N4)NC5=CC(=C(C=C5)N=NC6=C(C=C7C=C(C=C(C7=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)Cl)Cl.[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 2, 35: 6, 14: 14, 17: 2, 24: 1, 29: 15, 30: 1, 31: 5}
Did not match all atoms present	3476-50-4	COC1=CC=C2C(=CC1=O)[C@H](CCC3=CC(=C(C(=C32)OC)OC)OC)N	{1: 4, 11: 2, 12: 1, 14: 4, 22: 4, 25: 1, 30: 1}
Did not match all atoms present	3476-65-1	CCN1C=NC2=CC=CC=C2C1=O	{1: 1, 2: 1, 35: 1, 33: 1, 14: 5, 25: 1}
Did not match all atoms present	3476-89-9	C1CNC2=CC=CC=C2N1	{32: 2, 11: 2, 14: 4}
Did not match all atoms present	34761-82-5	CC1=CC(=CC(=C1[N+](=O)[O-])C)N	{1: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	34763-19-4	CC(C)(CC1=CC=C(C=C1)Cl)SC(=S)NC2=CN=CC=C2	{1: 2, 2: 1, 35: 1, 4: 1, 7: 1, 40: 1, 14: 8, 17: 1, 31: 1}
Did not match all atoms present	34763-20-7	CCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)Cl	{1: 1, 2: 4, 35: 1, 7: 1, 40: 2, 34: 1, 14: 8, 17: 1}
Did not match all atoms present	34763-22-9	CC(C)(CCC1=CC=C(C=C1)Cl)SC(=S)NC2=CN=CC=C2	{1: 2, 2: 2, 35: 1, 4: 1, 7: 1, 40: 1, 14: 8, 17: 1, 31: 1}
Did not match all atoms present	34763-25-2	CC(CC1=CC=C(C=C1)Cl)C(C)(C)SC(=S)NC2=CN=CC=C2	{1: 3, 2: 1, 3: 1, 4: 1, 7: 1, 40: 1, 14: 8, 17: 1, 35: 1, 31: 1}
Did not match all atoms present	34763-27-4	CCC(C)(C(C)CC1=CC=C(C=C1)Cl)SC(=S)NC2=CN=CC=C2	{1: 3, 2: 2, 3: 1, 4: 1, 7: 1, 40: 1, 14: 8, 17: 1, 35: 1, 31: 1}
Did not match all atoms present	34763-31-0	CC(C1=C(C=C(C=C1)Cl)Cl)(C2=CC=CC=C2Cl)SC(=S)NC3=CN=CC=C3	{1: 1, 35: 1, 4: 1, 7: 1, 40: 1, 14: 11, 17: 3, 31: 1}
Did not match all atoms present	34763-34-3	CC(C1=CC=C(C=C1)Cl)(C2=CC=CC=C2Cl)SC(=S)NC3=CN=CC=C3	{1: 1, 35: 1, 4: 1, 7: 1, 40: 1, 14: 12, 17: 2, 31: 1}
Did not match all atoms present	34763-36-5	CSC(=NC1=CN=CC=C1)SCC2=CC=CC=C2Cl	{1: 1, 2: 1, 35: 1, 7: 1, 40: 2, 34: 1, 14: 8, 17: 1}
Did not match all atoms present	34763-39-8	CSC(=NC1=CN=CC=C1)SCC2=C(C=CC=C2Cl)Cl	{1: 1, 2: 1, 35: 1, 7: 1, 40: 2, 34: 1, 14: 7, 17: 2}
Did not match all atoms present	34763-43-4	CCCCC1=C(C=CC=N1)N=C(SC)SC2=CC(=C(C=C2)Cl)Cl	{1: 2, 2: 3, 35: 1, 7: 1, 40: 2, 34: 1, 14: 6, 17: 2}
Did not match all atoms present	34763-45-6	CC(C)(CC1=CC=C(C=C1)Br)SC(=S)NC2=CN=CC=C2	{1: 2, 2: 1, 35: 1, 4: 1, 7: 1, 40: 1, 14: 8, 18: 1, 31: 1}
Did not match all atoms present	34763-52-5	CCC1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)Cl	{1: 1, 2: 2, 35: 1, 40: 1, 14: 7, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	34767-44-7	[CH-]1C=CC=C1.[Cl-].[Cl-].[Cl-].[Zr+4]	{17: 3, 14: 5}
Did not match all atoms present	3477-28-9	CC1(C(=O)N(C(=O)N1)CC(C[Hg]Cl)OC)C	{32: 1, 1: 3, 2: 2, 3: 1, 33: 1, 13: 1, 17: 1, 22: 1, 25: 2}
Did not match all atoms present	3477-94-9	C1=CC=C(C=C1)C(=O)OCC(CCl)O	{2: 2, 3: 1, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	34771-63-6	[H+].[H+].[H+].C1=CC(=C(C=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)[O-])[O-].[Cu+2].[Cu+2]	{34: 4, 29: 9, 14: 15}
Did not match all atoms present	34771-66-9	CC1=NN(N=C1C2=CC=CC=C2)C3=CC4=C(C=C3)C=C(C(=O)O4)N5C=C(C=N5)Cl	{1: 1, 35: 3, 33: 2, 14: 11, 17: 1, 28: 1}
Did not match all atoms present	34776-95-9	C1COCO1.O	{11: 3, 23: 2}
Did not match all atoms present	34777-33-8	C1C=CC=C2C1=C3C(=NC4=CC=CC=C43)C=C2	{35: 1, 11: 1, 14: 9}
Did not match all atoms present	3478-44-2	CCCCCCOCC(COC1=CC=CC=C1C(=O)[O-])O.[Na+]	{1: 1, 2: 7, 3: 1, 14: 4, 20: 1, 22: 2, 24: 1}
Did not match all atoms present	3478-74-8	CN1N(P2N(N(P1N(N2C)C)C)C)C	{1: 6, 33: 6}
Did not match all atoms present	3478-88-4	CC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)C)C)C	{24: 1, 1: 4, 14: 6}
Did not match all atoms present	3478-94-2	CC1CCCCN1CCCOC(=O)C2=CC(=C(C=C2)Cl)Cl	{1: 1, 2: 3, 33: 1, 11: 4, 12: 1, 14: 3, 17: 2, 28: 1}
Did not match all atoms present	34786-24-8	CCSC1=CC=CC(=C1)C	{40: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	34786-26-0	CC1=CC(=CC=C1)SC(C)(C)C	{40: 1, 1: 4, 4: 1, 14: 4}
Did not match all atoms present	34786-97-5	[O-].[OH-].[OH-].[O].[V+2]	{}
Did not match all atoms present	34788-82-4	CC1(C2CCC1(C(=O)C2=C(C(C(C(F)(F)F)(F)F)(F)F)[O-])C)C.CC1(C2CCC1(C(=O)C2=C(C(C(C(F)(F)F)(F)F)(F)F)[O-])C)C.CC1(C2CCC1(C(=O)C2=C(C(C(C(F)(F)F)(F)F)(F)F)[O-])C)C.[Eu+3]	{1: 9, 4: 9, 7: 3, 11: 6, 12: 3, 13: 6, 15: 3, 16: 21, 25: 3}
Did not match all atoms present	3479-30-9	C=CCO[P+](=O)OCC=C	{2: 2, 22: 2, 5: 2, 6: 2, 29: 1}
Did not match all atoms present	34791-88-3	CC1=CC(=C(C=C1)N=NC(C(=O)C2=CC=CC=C2)C(=O)NC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]	{1: 1, 34: 2, 3: 1, 38: 1, 14: 15, 24: 2, 31: 1}
Did not match all atoms present	34798-80-6	CC(=O)C1(CCNCC1)C2=CC=CC=C2	{32: 1, 1: 1, 11: 4, 13: 1, 14: 5, 24: 1}
Did not match all atoms present	348-40-3	C1=CC2=C(C=C1F)SC(=N2)N	{16: 1, 41: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	348-51-6	C1=CC=C(C(=C1)F)Cl	{16: 1, 17: 1, 14: 4}
Did not match all atoms present	348-52-7	C1=CC=C(C(=C1)F)I	{16: 1, 19: 1, 14: 4}
Did not match all atoms present	348-54-9	C1=CC=C(C(=C1)N)F	{16: 1, 30: 1, 14: 4}
Did not match all atoms present	348-57-2	C1=CC(=C(C=C1F)F)Br	{16: 2, 18: 1, 14: 3}
Did not match all atoms present	348-59-4	C1=CC(=C(C=C1Cl)F)Cl	{16: 1, 17: 2, 14: 3}
Did not match all atoms present	348-60-7	C1=CC(=C(C=C1O)F)Cl	{16: 1, 17: 1, 21: 1, 14: 3}
Did not match all atoms present	348-61-8	C1=CC(=C(C=C1Br)F)F	{16: 2, 18: 1, 14: 3}
Did not match all atoms present	348-62-9	C1=CC(=C(C=C1Cl)F)O	{16: 1, 17: 1, 21: 1, 14: 3}
Did not match all atoms present	34800-90-3	C1=CC=C2C(=C1)C=CC=C2CC(=O)NN	{24: 1, 2: 1, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	34801-09-7	CC(=O)NC1=CC=CC=C1N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	34803-66-2	C1CN(CCN1)C2=CC=CC=N2	{32: 1, 33: 1, 11: 4, 14: 4, 35: 1}
Did not match all atoms present	34807-41-5	CC1C(C2(C3C4C1(C5C=C(C(=O)C5(C(C6(C4O6)CO)O)O)C)OC(O3)(O2)C7=CC=CC=C7)C(=C)C)OC(=O)C=CC=CC8=CC=CC=C8	{1: 3, 2: 1, 5: 1, 6: 4, 7: 1, 12: 7, 13: 5, 14: 11, 15: 1, 20: 3, 23: 4, 25: 1, 28: 1}
Did not match all atoms present	3481-02-5	C1CC1C(=O)C2=CC=CC=C2	{24: 1, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	3481-09-2	C1=CC=C2C(=C1)C(=O)N(C2=O)Cl	{17: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	3481-20-7	C1=C(C(=C(C(=C1Cl)Cl)N)Cl)Cl	{17: 4, 30: 1, 14: 1}
Did not match all atoms present	34814-77-2	C1=CC=C2C3=C4C(=CC=C3)C5=C6C(=CC=C7C6=C(C=C5)C8=CC=CC9=C8C7=CC3=CC=CC=C93)C4=CC2=C1	{14: 20}
Did not match all atoms present	34814-80-7	C1=CC=C2C3=C4C5=C(C2=C1)C=CC=C5C6=C7C4=C(C=C3)C8=C9C7=C(C=C6)C=C1C9=C(C=C8)C2=CC=CC3=C2C1=CC=C3	{14: 20}
Did not match all atoms present	34814-82-9	C1=CC=C2C3=C4C(=CC=C3)C5=CC=C6C7=CC=CC8=C7C(=CC9=CC=CC=C89)C3=C6C5=C(C4=CC2=C1)C1=CC=CC=C13	{14: 22}
Did not match all atoms present	34815-01-5	C1=NC(=NN1[N+](=O)[O-])N	{38: 1, 33: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	34816-53-0	C1=CC(=C(C2=C1OC3=CC(=C(C=C3O2)Cl)Cl)Cl)Cl	{17: 4, 14: 4, 23: 2}
Did not match all atoms present	34816-55-2	C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O)OC	{1: 2, 9: 1, 10: 1, 11: 5, 12: 4, 13: 2, 14: 3, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	3482-37-9	COC1=C(C(=C2C(=C1)CCC(C3=CC(=O)C(=CC=C32)O)N)OC)OC	{1: 3, 11: 2, 12: 1, 14: 4, 21: 1, 22: 3, 25: 1, 30: 1}
Did not match all atoms present	34820-80-9	COC1=CC=C(C=C1)C[Hg]Cl	{1: 1, 2: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	34824-60-7	CCNC1=CC(=C(C2=C1C(=O)C3=CC=CC=C3C2=O)N)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 14: 5, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	3483-11-2	[Li+].CC(=O)CC(=O)[O-]	{24: 2, 1: 1, 2: 1}
Did not match all atoms present	3483-82-7	CCOC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C2=CC=CC=C2	{1: 1, 2: 2, 3: 1, 14: 9, 21: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	34830-11-0	CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.[Eu]	{1: 9, 4: 3, 7: 3, 11: 6, 12: 3, 13: 6, 15: 3, 16: 9, 20: 3, 25: 3}
Did not match all atoms present	34831-03-3	[H+].C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Ni+3]	{24: 3, 33: 1, 2: 3}
Did not match all atoms present	34836-53-8	COP(OC)OC.[Cu]I	{1: 3, 19: 1, 22: 3}
Did not match all atoms present	34837-55-3	C1=CC=C(C=C1)[Se]Br	{18: 1, 14: 5}
Did not match all atoms present	34837-84-8	COC(=O)CC1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	3484-22-8	CC1=NC2=C(C1(C)C)C=C(C=C2)[N+](=O)[O-]	{1: 3, 35: 1, 38: 1, 13: 1, 14: 3, 15: 1}
Did not match all atoms present	34840-79-4	CC1=C(C(=C(C=C1)C)Cl)Cl	{1: 2, 14: 2, 17: 2}
Did not match all atoms present	34841-06-0	COC1=C(C=C(C=C1)C=O)Br	{1: 1, 18: 1, 26: 1, 22: 1, 14: 3}
Did not match all atoms present	34841-35-5	CCC(=O)C1=CC(=CC=C1)Cl	{24: 1, 1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	34842-17-6	CCCC[Sn](CCCC)(SC(=S)N(C)C)SC(=S)N(C)C	{40: 2, 1: 6, 2: 6, 33: 2, 7: 2}
Did not match all atoms present	34846-44-1	C1=CSC=C1CBr	{41: 1, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	3485-84-5	C=CN1C(=O)C2=CC=CC=C2C1=O	{25: 2, 14: 4, 5: 1, 6: 1, 33: 1}
Did not match all atoms present	34850-66-3	CC1(C2CCC1(C(=O)C2)CS(=O)(=O)[O-])C.[Na+]	{1: 2, 2: 1, 11: 3, 12: 1, 13: 2, 25: 1, 29: 3}
Did not match all atoms present	34851-48-4	CCCCNC(=O)N=C(C1=CC=C(C=C1)N(C)C)C2=CC=C(C=C2)N(C)C	{1: 5, 2: 3, 33: 2, 7: 1, 34: 1, 14: 8, 24: 1, 31: 1}
Did not match all atoms present	3486-30-4	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC=CC=C4)C=C3)C5=C(C=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 21, 15: 2, 29: 6}
Did not match all atoms present	3486-35-9	C(=O)([O-])[O-].[Zn+2]	{24: 1}
Did not match all atoms present	3486-66-6	C1C[N+]2=C(C=C3C=CC4=C(C3=C2)OCO4)C5=CC6=C(C=C51)OCO6	{33: 1, 11: 4, 14: 6, 23: 4}
Did not match all atoms present	3486-86-0	CCC(C)C1(C(=O)NC(=NC1=O)[O-])CC(=C)Br.[Na+]	{32: 1, 1: 2, 2: 2, 3: 1, 5: 1, 7: 1, 13: 1, 15: 1, 18: 1, 35: 1, 25: 2}
Did not match all atoms present	34866-46-1	CC(C)(C)NCC(C1=CC(=C(C=C1)O)NC(=O)N)O.Cl	{1: 3, 2: 1, 3: 1, 4: 1, 14: 3, 17: 1, 20: 1, 21: 1, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	34869-32-4	CCCCOC(=O)C1=C(C(=C(C=C1I)I)I)I	{1: 1, 2: 3, 19: 4, 28: 1, 14: 1}
Did not match all atoms present	3487-44-3	C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{5: 1, 14: 15}
Did not match all atoms present	3487-99-8	CCCCCOC(=O)C=CC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	34870-88-7	CCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCC)C(=O)O	{1: 2, 2: 16, 27: 1, 28: 2, 14: 3}
Did not match all atoms present	34871-84-6	CCCC[Sn](SCC(=O)OCCCCCC(C)C)(SCC(=O)OCCCCCC(C)C)S[Sn](CCCC)(SCC(=O)OCCCCCC(C)C)SCC(=O)OCCCCCC(C)C	{40: 5, 1: 10, 2: 30, 3: 4, 28: 4}
Did not match all atoms present	34879-34-0	C1=NC(=C(N1)C(=O)N)N.C(C(C(=O)O)NC(=O)N)C(=O)O	{32: 1, 2: 1, 3: 1, 14: 1, 35: 1, 24: 2, 27: 2, 30: 3, 31: 1}
Did not match all atoms present	3488-87-7	B1(OC2=CC=CC=C2O1)OCCCC	{1: 1, 2: 3, 22: 1, 14: 4, 23: 2}
Did not match all atoms present	34883-39-1	C1=CC=C(C=C1)C2=C(C=CC(=C2)Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	34883-41-5	C1=CC=C(C=C1)C2=CC(=CC(=C2)Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	34883-43-7	C1=CC=C(C(=C1)C2=CC=C(C=C2)Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	34888-05-6	C1=CC=C(C=C1)OC(Cl)(Cl)Cl	{17: 3, 4: 1, 22: 1, 14: 5}
Did not match all atoms present	34893-92-0	C1=C(C=C(C=C1Cl)Cl)N=C=O	{8: 1, 17: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	349-01-9	CC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F	{16: 1, 1: 1, 38: 2, 14: 2}
Did not match all atoms present	349-03-1	C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])Br	{16: 3, 18: 1, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	349-04-2	C1=CC(=C(C=C1S(=O)(=O)F)[N+](=O)[O-])Cl	{16: 1, 17: 1, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	349-37-1	CN(C)C1=CC=C(C=C1)N=NC2=C(C=CC(=C2)F)F	{16: 2, 1: 2, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	349-58-6	C1=C(C=C(C=C1C(F)(F)F)O)C(F)(F)F	{16: 6, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	349-59-7	C=CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{16: 6, 14: 3, 4: 2, 5: 1, 6: 1}
Did not match all atoms present	349-65-5	COC1=C(C=C(C=C1)C(F)(F)F)N	{1: 1, 4: 1, 14: 3, 16: 3, 22: 1, 30: 1}
Did not match all atoms present	349-75-7	C1=CC(=CC(=C1)C(F)(F)F)CO	{16: 3, 20: 1, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	349-76-8	CC(=O)C1=CC(=CC=C1)C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4, 24: 1}
Did not match all atoms present	349-78-0	C1=CC(=CC(=C1)S(=O)(=O)F)[N+](=O)[O-]	{16: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	349-88-2	C1=CC(=CC=C1F)S(=O)(=O)Cl	{16: 1, 17: 1, 29: 2, 14: 4}
Did not match all atoms present	349-95-1	C1=CC(=CC=C1CO)C(F)(F)F	{16: 3, 20: 1, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	349-96-2	C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)F	{16: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	349-97-3	CC(=O)NC1=CC=C(C=C1)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	3490-06-0	CNCCC1=CC(=C(C=C1)OC)OC	{1: 3, 2: 2, 22: 2, 14: 3, 31: 1}
Did not match all atoms present	34901-26-3	C1=CC=C(C(=C1)CCCCCCCCCCCCCl)OC2=CC=CC=C2S(=O)(=O)[O-].[Na+]	{17: 1, 2: 12, 22: 1, 14: 8, 29: 3}
Did not match all atoms present	34906-70-2	CN(C)C1=CC=C(C=C1)CC#N	{1: 2, 2: 1, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	3491-12-1	C1=CC(=CC=C1N)OC2=CC=C(C=C2)OC3=CC=C(C=C3)N	{30: 2, 22: 2, 14: 12}
Did not match all atoms present	34920-64-4	C1=CC=C(C=C1)SCCC[NH2+]CCC(C2=CC=C(C=C2)O)O.[Cl-]	{2: 5, 3: 1, 40: 1, 14: 9, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	34924-20-4	CC[NH+](CC)CC(=O)C1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)C(=O)C[NH+](CC)CC.[Cl-].[Cl-]	{1: 4, 2: 6, 11: 1, 14: 6, 17: 2, 24: 2}
Did not match all atoms present	34929-08-3	C1=CC=C2C(=C1)C(=O)N(C(=O)N2C3=CC=CC(=C3)C(F)(F)F)CCO	{33: 2, 2: 2, 4: 1, 14: 8, 16: 3, 20: 1, 25: 2}
Did not match all atoms present	34935-38-1	CCN1C2=CC=CC=C2SC1=CC(=CC3=[N+](C4=CC=CC=C4S3)CCC(C)S(=O)(=O)[O-])C	{1: 3, 2: 3, 3: 1, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 29: 3}
Did not match all atoms present	34943-62-9	C[As](C)C#C[As](C)C	{1: 4, 10: 2}
Did not match all atoms present	34946-82-2	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Cu+2]	{16: 6, 4: 2, 29: 6}
Did not match all atoms present	3495-35-0	C(=O)[O-].[Rb+]	{26: 1}
Did not match all atoms present	3495-42-9	C1=CN=C2C(=C(C(=C(C2=N1)Cl)Cl)Cl)Cl	{17: 4, 35: 2, 14: 2}
Did not match all atoms present	3495-54-3	C[N+](=O)[O-].[Al](Cl)(Cl)Cl	{1: 1, 38: 1, 17: 3}
Did not match all atoms present	34958-53-7	C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC(=C(C=C3)O)CN(CC(=O)[O-])CC(=O)[O-])C4=CC(=C(C=C4)O)CN(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 6, 13: 1, 14: 10, 21: 2, 23: 1, 24: 4, 29: 2}
Did not match all atoms present	3496-32-0	C1=CC=C(C=C1)C=C=O	{8: 1, 14: 5, 6: 1, 29: 1}
Did not match all atoms present	34961-28-9	C1CCC(CC1)[NH3+].C(=O)[O-]	{26: 1, 11: 5, 12: 1}
Did not match all atoms present	34963-48-9	CCN(CC)CCN1C(N(C(=O)C2=CC=CC=C21)C3=CC=CC=C3C)C.C(=O)(C(=O)O)O	{1: 4, 2: 4, 33: 3, 12: 1, 14: 8, 25: 1, 27: 2}
Did not match all atoms present	34964-55-1	COC1=CC=CC(=C1OC)CN=C=S	{1: 2, 2: 1, 8: 1, 34: 1, 14: 3, 22: 2}
Did not match all atoms present	34967-24-3	COC1=CC(=CC(=C1)CN)OC	{1: 2, 2: 1, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	3497-00-5	C1=CC=C(C=C1)P(=S)(Cl)Cl	{17: 2, 14: 5}
Did not match all atoms present	34973-08-5	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)CNC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CC5=CN=CN5)NC(=O)[C@@H]6CCC(=O)N6.CC(=O)O	{32: 3, 1: 3, 2: 10, 3: 7, 33: 1, 7: 1, 11: 5, 12: 2, 34: 1, 14: 11, 35: 1, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 8}
Did not match all atoms present	34983-45-4	CC/C(=C(/CC)\C1=CC=C(C=C1)C)/C2=CC=C(C=C2)C	{1: 4, 2: 2, 14: 8, 7: 2}
Did not match all atoms present	34993-27-6	CC(=O)NN1C=NC2=C1NC=NC2=S	{32: 1, 1: 1, 35: 2, 33: 1, 14: 2, 24: 1, 31: 1}
Did not match all atoms present	34994-91-7	C(COP(=O)(O)OCCOP(=O)(O)OCCO)O	{2: 6, 20: 4, 29: 2, 22: 4}
Did not match all atoms present	350-03-8	CC(=O)C1=CN=CC=C1	{24: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	350-09-4	C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)C(F)(F)F	{2: 1, 3: 1, 4: 1, 14: 5, 16: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	350-12-9	C1N(CSC(=S)N1CC2=CC=CC=C2)CC3=CC=CC=C3	{33: 2, 2: 2, 41: 1, 11: 2, 14: 10, 15: 1}
Did not match all atoms present	350-28-7	CC1=C(C=C(C=C1)C(=O)O)F	{16: 1, 1: 1, 27: 1, 14: 3}
Did not match all atoms present	350-30-1	C1=CC(=C(C=C1[N+](=O)[O-])Cl)F	{16: 1, 17: 1, 38: 1, 14: 3}
Did not match all atoms present	350-40-3	CC(=C)C1=CC=C(C=C1)F	{16: 1, 1: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	350-46-9	C1=CC(=CC=C1[N+](=O)[O-])F	{16: 1, 38: 1, 14: 4}
Did not match all atoms present	350-50-5	C1=CC=C(C=C1)CF	{16: 1, 2: 1, 14: 5}
Did not match all atoms present	350-51-6	C=CC1=CC(=CC=C1)F	{16: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	350-62-9	C1=CC=C(C=C1)CC(C2=CC=CC=C2)(F)F	{16: 2, 2: 1, 4: 1, 14: 10}
Did not match all atoms present	350-70-9	B(OC(=O)C(F)(F)F)(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F	{16: 9, 28: 3, 4: 3}
Did not match all atoms present	350-87-8	CN(C)C1=CC=C(C=C1)N=NC2=CC(=CC(=C2)F)F	{16: 2, 1: 2, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	350-92-5	C1=CC=C(C=C1)CC(=O)C(F)(F)F	{16: 3, 24: 1, 2: 1, 4: 1, 14: 5}
Did not match all atoms present	350-96-9	CC1=CC=C(C=C1)NC(=O)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	35001-52-6	CCC1=CC=CC=C1NC(=O)C(=O)NC2=C(C=CC(=C2)C(C)(C)C)OCC	{1: 5, 2: 2, 4: 1, 14: 7, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	35008-50-5	C1=CC=C(C=C1)S(=O)(=O)CC(=O)N	{24: 1, 2: 1, 30: 1, 29: 2, 14: 5}
Did not match all atoms present	35021-67-1	CCCCCCCCCCOC1=CC=CC=C1	{1: 1, 2: 9, 22: 1, 14: 5}
Did not match all atoms present	35021-68-2	CCCCCCCCCCCCOC1=CC=CC=C1	{1: 1, 2: 11, 22: 1, 14: 5}
Did not match all atoms present	35021-70-6	CCCCCCCCCCCCCCCCOC1=CC=CC=C1	{1: 1, 2: 15, 22: 1, 14: 5}
Did not match all atoms present	35033-79-5	C1C[C@H]([C@@H](C[C@H]1C2=CC=CC=C2)C(=O)O)C(=O)C3=CC=CC=C3	{24: 1, 27: 1, 11: 3, 12: 3, 14: 10}
Did not match all atoms present	35035-05-3	C[N+]1(CC(CC(=C(C2=CC=CS2)C3=CC=CS3)C1)OC)C	{1: 3, 7: 1, 41: 2, 11: 3, 12: 1, 14: 6, 15: 1, 22: 1}
Did not match all atoms present	35037-73-1	C1=CC(=CC=C1N=C=O)OC(F)(F)F	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 22: 1, 29: 1}
Did not match all atoms present	35038-32-5	CCC1=C2C=C3C(=C(C(=N3)C(=C4C(C(C(=N4)C=C5C(=C(C(=CC(=C1C)N2)N5)C=C)C)C)CCC(=O)OC)CC(=O)OC)C(=O)OC)C	{32: 2, 1: 8, 2: 4, 35: 2, 5: 1, 6: 1, 12: 2, 14: 3, 28: 3}
Did not match all atoms present	35038-46-1	C1(=NNN=N1)N=[N+]=[N-]	{32: 1, 34: 2, 35: 3}
Did not match all atoms present	3504-40-3	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Sm+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	35047-04-2	CCCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCCC	{1: 2, 34: 1, 6: 1, 2: 6, 14: 8, 22: 1}
Did not match all atoms present	35048-13-6	C1=CC2=C(C=C(C(=C2N=C1)O)Cl)I	{17: 1, 19: 1, 21: 1, 14: 4, 35: 1}
Did not match all atoms present	3505-38-2	CN(C)CCOC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O	{1: 2, 2: 2, 3: 1, 6: 2, 33: 1, 14: 8, 17: 1, 35: 1, 22: 1, 27: 2}
Did not match all atoms present	35050-10-3	CCCCCCCCCCCC1=NC=C(N1)C	{32: 1, 1: 2, 2: 10, 35: 1, 14: 1}
Did not match all atoms present	35050-55-6	C/C=C/1\C[C@@H]2C(NC3=CC(=C(C=C3C(=O)N2C1)OC)O)OC	{32: 1, 1: 3, 6: 1, 33: 1, 11: 2, 12: 2, 14: 2, 15: 1, 21: 1, 22: 2, 25: 1}
Did not match all atoms present	35059-50-8	CC(C)(C)OC(=C[N+]#N)[O-]	{1: 3, 34: 1, 4: 1, 6: 1, 7: 1, 22: 1}
Did not match all atoms present	35065-27-1	C1=C(C(=CC(=C1Cl)Cl)Cl)C2=CC(=C(C=C2Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	35065-28-2	C1=CC(=C(C(=C1C2=CC(=C(C=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	35065-29-3	C1=C(C(=CC(=C1Cl)Cl)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	35065-30-6	C1=CC(=C(C(=C1C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	35065-62-4	C[Se]C1=CC=C(C=C1)N	{1: 1, 30: 1, 14: 4}
Did not match all atoms present	35065-86-2	CC(=O)OC1=CC(=CC=C1)Br	{1: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	35068-34-9	C1CCC2=CC=CC=C2C(C1)C3=CC=CC=C3	{11: 4, 12: 1, 14: 9}
Did not match all atoms present	3507-99-1	CCCCCCCCCCCCCCCCCC(=O)[O-].[Ag+]	{24: 1, 1: 1, 2: 16}
Did not match all atoms present	35073-27-9	CCC(C)COC=O	{1: 2, 2: 2, 3: 1, 26: 1}
Did not match all atoms present	35074-30-7	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)NCC(COC)O	{1: 3, 2: 2, 3: 1, 38: 2, 34: 2, 14: 4, 18: 1, 20: 1, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	35077-51-1	CC(=O)N(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C(=O)C	{24: 2, 1: 4, 34: 2, 14: 8, 33: 2}
Did not match all atoms present	35079-64-2	CCCCN(CCCCS(=O)(=O)O)C1=CC=C(C=C1)N	{1: 1, 2: 7, 33: 1, 14: 4, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	3508-01-8	CCCCCCCCCCCCCCCC(=O)[O-].[Ag+]	{24: 1, 1: 1, 2: 14}
Did not match all atoms present	3508-94-9	CC(C)C(C1=CC=CC=C1)C(=O)O	{27: 1, 1: 2, 3: 2, 14: 5}
Did not match all atoms present	35080-11-6	CCC[N+]12[C@H]3CC([C@@H]([C@H]1O)CC)C4[C@@H]2C[C@@]5([C@H]3N(C6=CC=CC=C65)C)[C@@H]4O	{1: 3, 2: 3, 33: 1, 11: 2, 12: 8, 13: 1, 14: 4, 20: 2}
Did not match all atoms present	35080-47-8	CC[N+]1=C(SC2=CC=CC=C21)/C=C/N(C3=CC=CC=C3)C(=O)C.[I-]	{1: 2, 2: 1, 6: 2, 33: 2, 41: 1, 14: 9, 19: 1, 24: 1}
Did not match all atoms present	35086-59-0	CC(=O)C1=CC(=CC(=C1)OC(=O)C)OC(=O)C	{24: 1, 1: 3, 28: 2, 14: 3}
Did not match all atoms present	35092-67-2	CCOC(=O)C(C1=C(C=C(C=C1)O)O)N.Cl	{1: 1, 2: 1, 3: 1, 14: 3, 17: 1, 21: 2, 28: 1, 30: 1}
Did not match all atoms present	35094-87-2	C1=C(C(=CC(=C1O)O)O)C=O	{26: 1, 21: 3, 14: 2}
Did not match all atoms present	351-28-0	CC(=O)NC1=CC(=CC=C1)F	{16: 1, 1: 1, 31: 1, 14: 4, 24: 1}
Did not match all atoms present	351-32-6	CC(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	351-35-9	C1=CC(=CC(=C1)C(F)(F)F)CC(=O)O	{16: 3, 2: 1, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	351-36-0	CC(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	351-50-8	C1=C(NC=N1)C[C@H](C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 2, 35: 1, 27: 1, 30: 1}
Did not match all atoms present	351-61-1	C1=CC=C(C=C1)NCC(F)(F)F	{16: 3, 2: 1, 4: 1, 14: 5, 31: 1}
Did not match all atoms present	351-63-3	CN(C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)F)F	{16: 2, 1: 2, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	351-65-5	CN(C)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)F)F	{16: 2, 1: 2, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	351-83-7	CC(=O)NC1=CC=C(C=C1)F	{16: 1, 1: 1, 31: 1, 14: 4, 24: 1}
Did not match all atoms present	3510-66-5	CC1=CN=C(C=C1)Br	{1: 1, 18: 1, 35: 1, 14: 3}
Did not match all atoms present	3510-70-1	CCC[Si](C)(C)C	{1: 4, 2: 2}
Did not match all atoms present	35103-79-8	O.[OH-].[Cs+]	{}
Did not match all atoms present	35104-88-2	CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC(=O)[O-].[Sn+2]	{24: 2, 1: 2, 2: 28}
Did not match all atoms present	35106-15-1	CCOC(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)C)C	{11: 3, 1: 4, 2: 1, 3: 1, 12: 3}
Did not match all atoms present	35109-60-5	C1=C(C=C(C(=C1Br)OCC(CBr)Br)Br)Br	{22: 1, 2: 2, 3: 1, 18: 5, 14: 2}
Did not match all atoms present	3511-90-8	C1(=C(C(=C(N=C1F)F)F)Br)F	{16: 4, 18: 1, 35: 1}
Did not match all atoms present	35112-27-7	CCOC(=O)C1=C(C=CC(=C1)Cl)Cl	{1: 1, 2: 1, 28: 1, 14: 3, 17: 2}
Did not match all atoms present	35112-53-9	[O-]S(=O)(=S)[O-].[Ba+2]	{29: 3}
Did not match all atoms present	35112-74-4	CO[Si](CCCSSCCC[Si](OC)(OC)OC)(OC)OC	{40: 2, 1: 6, 2: 6, 22: 6}
Did not match all atoms present	35113-90-7	CN(C)C1=C(C=C(C=C1)Cl)Cl	{1: 2, 33: 1, 14: 3, 17: 2}
Did not match all atoms present	35117-21-6	C1CC2=CC3=C(CCC4=CC=C1C=C4)C=C2CCC5=CC=CC(=C5)CC3	{11: 8, 14: 10}
Did not match all atoms present	35118-50-4	CC(C)OC(=O)C1=CC=CC=C1C(=O)O	{27: 1, 1: 2, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	3512-80-9	CC1=CC(=CC(=N1)C)N	{1: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	3513-92-6	CCOP(=S)(OCC)OCC1CCCO1	{1: 2, 2: 3, 11: 3, 12: 1, 22: 3, 23: 1}
Did not match all atoms present	35130-97-3	CN1C2CCC1CC(C2)OS(=O)(=O)C	{1: 2, 33: 1, 11: 4, 12: 3, 22: 1, 29: 2}
Did not match all atoms present	35132-20-8	C1=CC=C(C=C1)[C@H]([C@@H](C2=CC=CC=C2)N)N	{3: 2, 30: 2, 14: 10}
Did not match all atoms present	35133-55-2	CC(C(C1=CC=C(C=C1)OC)O)N2CCC(CC2)CC3=CC=CC=C3	{1: 2, 2: 1, 3: 2, 33: 1, 11: 4, 12: 1, 14: 9, 20: 1, 22: 1}
Did not match all atoms present	35133-58-5	CC(C(C1=CC=C(C=C1)OC)O)N2CCC(CC2)CC3CCCCC3	{1: 2, 2: 1, 3: 2, 33: 1, 11: 9, 12: 2, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	35133-59-6	CC(C(C1=CC=C(C=C1)OC)O)N2CCC(=CC2)CC3=CC=CC=C3	{1: 2, 2: 1, 3: 2, 33: 1, 11: 3, 14: 10, 15: 1, 20: 1, 22: 1}
Did not match all atoms present	35135-42-3	CCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)OC	{1: 2, 2: 3, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	35135-43-4	CCCCCOC1=CC=C(C=C1)C=CC2=CC=CC=C2OC	{1: 2, 2: 4, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	35135-44-5	CCCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)OC	{1: 2, 2: 5, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	35135-45-6	CCCCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)OC	{1: 2, 2: 6, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	35135-46-7	CCCCCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)OC	{1: 2, 2: 7, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	35135-49-0	CCCCCCCCCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)OC	{1: 2, 2: 11, 22: 2, 14: 8, 6: 2}
Did not match all atoms present	35138-23-9	[B-](F)(F)(F)F.C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.[Ir]	{16: 4, 11: 8, 14: 8}
Did not match all atoms present	35141-30-1	CO[Si](CCCNCCNCCN)(OC)OC	{1: 3, 2: 7, 30: 1, 22: 3, 31: 2}
Did not match all atoms present	35141-35-6	CC(=O)O.CN(C)CCC[Si](OC)(OC)OC	{1: 6, 2: 3, 27: 1, 22: 3, 33: 1}
Did not match all atoms present	35141-36-7	C[N+](C)(C)CCC[Si](OC)(OC)OC.[Cl-]	{1: 6, 2: 3, 22: 3, 17: 1}
Did not match all atoms present	35142-05-3	COC1=CC=CC2=C1C=CC3=C2C4=C(C=C3C(=O)O)OCO4	{1: 1, 11: 1, 14: 6, 22: 1, 23: 2, 27: 1}
Did not match all atoms present	35142-06-4	COC1=CC=CC2=C1C=CC3=C2C4=C(C=C3C(=O)OC)OCO4	{1: 2, 11: 1, 14: 6, 22: 1, 23: 2, 28: 1}
Did not match all atoms present	35143-55-6	C1=CC(=C2[N+](=C1)C(=CS2)O)[O-]	{33: 1, 21: 1, 14: 4, 41: 1}
Did not match all atoms present	35143-57-8	C1=CC=C(C=C1)C2=C([N+]3=CC=CC(=C3S2)[O-])O	{33: 1, 21: 1, 14: 8, 41: 1}
Did not match all atoms present	35146-63-5	CCC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC(C)C)C(=O)NCC(=O)NC(CSCC(=O)OC)C(=O)OC	{1: 5, 2: 6, 3: 4, 40: 1, 14: 5, 24: 4, 28: 2, 31: 4}
Did not match all atoms present	35148-00-6	CC1=C(SC(=C1C)[Si](C)(C)C)[Si](C)(C)C	{1: 8, 41: 1}
Did not match all atoms present	35154-05-3	CCC(=O)C1=CC(=C(C=C1)OC)C(C)(C)C	{1: 5, 2: 1, 4: 1, 14: 3, 22: 1, 24: 1}
Did not match all atoms present	35154-28-0	CCC(=O)C1=CC(=C(C=C1O)C(C)(C)C)Br	{1: 4, 2: 1, 4: 1, 14: 2, 18: 1, 21: 1, 24: 1}
Did not match all atoms present	3516-87-8	CCOC(=O)CC(=O)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 1, 2: 2, 28: 1, 24: 1}
Did not match all atoms present	3517-90-6	COC1=CC=C(C=C1)S(=O)(=O)C	{1: 2, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	35170-28-6	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)[O-])O)O.[K+]	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 3, 22: 1, 23: 1, 29: 2, 30: 1}
Did not match all atoms present	35170-70-8	CCCCCCCCN1C(=O)C2=C(C3=C(C(=C2C1=O)N)C(=O)C4=CC=CC=C4C3=O)N	{1: 1, 2: 7, 33: 1, 14: 4, 25: 4, 30: 2}
Did not match all atoms present	35173-80-9	C1=CN=C(C=C1C(=NN)N)C(=NN)N	{34: 2, 35: 1, 30: 4, 14: 3, 7: 2}
Did not match all atoms present	3518-05-6	CC1=CC=CC2=C(C3=C(C=CC4=CC=CC=C43)N=C12)C	{1: 2, 35: 1, 14: 9}
Did not match all atoms present	3518-65-8	C(S(=O)(=O)Cl)Cl	{17: 2, 2: 1, 29: 2}
Did not match all atoms present	35182-15-1	[OH-].[OH-].[OH-].[OH-].[Np]	{}
Did not match all atoms present	35182-51-5	CCC(CC)C1=CC=NC=C1	{1: 2, 2: 2, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	35185-96-7	C1CC2C3=CC=CC=C3C1O2	{11: 2, 12: 2, 14: 4, 23: 1}
Did not match all atoms present	35186-03-9	C[Si](C)(C)/C(=C/C(F)(F)F)/C(F)(F)F	{16: 6, 1: 3, 4: 2, 6: 1, 7: 1}
Did not match all atoms present	35186-09-5	CC[As](CC)/C(=C\C(F)(F)F)/C(F)(F)F	{1: 2, 2: 2, 4: 2, 6: 1, 7: 1, 16: 6}
Did not match all atoms present	35186-69-7	C1=C(N2C(=NC1=O)N=CN2)N	{32: 1, 33: 1, 35: 2, 14: 2, 25: 1, 30: 1}
Did not match all atoms present	35187-24-7	CC1=CC=CC2=C1C=CC3=C(C4=CC=CC=C4C(=C23)C)C	{1: 3, 14: 9}
Did not match all atoms present	35187-27-0	CC1=CC2=C(C3=C(C=CC4=CC=CC=C43)C(=C2C=C1)C)C	{1: 3, 14: 9}
Did not match all atoms present	35187-28-1	CC1=CC=CC2=C1C=C3C(=C2C)C=CC4=CC=CC=C43	{1: 2, 14: 10}
Did not match all atoms present	35191-20-9	CC1=C([N+]2=CC=CC(=C2S1)[O-])O	{1: 1, 41: 1, 21: 1, 14: 3, 33: 1}
Did not match all atoms present	35192-74-6	CCCCCCCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 8, 29: 3}
Did not match all atoms present	35193-14-7	C(C#CCOCC(CS(=O)(=O)[O-])O)O.[Na+]	{2: 4, 3: 1, 10: 2, 20: 2, 22: 1, 29: 3}
Did not match all atoms present	35193-63-6	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=CC=CC=C54)OP(=O)(O3)O	{20: 1, 29: 1, 14: 12, 23: 2}
Did not match all atoms present	35199-58-7	CN1C2=C(C3=CC=CC=C3C=C2)N=C1N	{1: 1, 35: 1, 30: 1, 14: 6, 33: 1}
Did not match all atoms present	352-11-4	C1=CC(=CC=C1CCl)F	{16: 1, 17: 1, 2: 1, 14: 4}
Did not match all atoms present	352-32-9	CC1=CC=C(C=C1)F	{16: 1, 1: 1, 14: 4}
Did not match all atoms present	352-33-0	C1=CC(=CC=C1F)Cl	{16: 1, 17: 1, 14: 4}
Did not match all atoms present	352-34-1	C1=CC(=CC=C1F)I	{16: 1, 19: 1, 14: 4}
Did not match all atoms present	352-52-3	CCC(C)OP(=O)(C)F	{1: 3, 2: 1, 3: 1, 16: 1, 22: 1, 29: 1}
Did not match all atoms present	352-63-6	CCCCOP(=O)(C)F	{16: 1, 1: 2, 2: 3, 29: 1, 22: 1}
Did not match all atoms present	352-67-0	C1=CC(=CC=C1OC(F)(F)F)F	{16: 4, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	352-70-5	CC1=CC(=CC=C1)F	{16: 1, 1: 1, 14: 4}
Did not match all atoms present	3520-52-3	CCCC1=CC=CC(=C1O)C	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	35200-02-3	CC(C)OC(=S)SC	{40: 1, 1: 3, 3: 1, 22: 1, 7: 1}
Did not match all atoms present	35203-02-2	CC1=C(C(=CC=C1)C)N=C	{1: 2, 34: 1, 5: 1, 14: 3}
Did not match all atoms present	35203-06-6	CCC1=CC=CC(=C1N=C)C	{1: 2, 2: 1, 34: 1, 5: 1, 14: 3}
Did not match all atoms present	35203-08-8	CCC1=C(C(=CC=C1)CC)N=C	{1: 2, 2: 2, 34: 1, 5: 1, 14: 3}
Did not match all atoms present	35203-93-1	C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N	{30: 1, 11: 3, 29: 2, 14: 3}
Did not match all atoms present	35205-54-0	CC(COC1=CC=CC=C1)N	{1: 1, 2: 1, 3: 1, 14: 5, 22: 1, 30: 1}
Did not match all atoms present	35206-70-3	CC(CC(=O)[O-])CC(C)(C)C.CC(CC(=O)[O-])CC(C)(C)C.[Cu+2]	{24: 2, 1: 8, 2: 4, 3: 2, 4: 2}
Did not match all atoms present	3521-84-4	CNCC(C(C(C(CO)O)O)O)O.CNCC(C(C(C(CO)O)O)O)O.C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I	{1: 2, 2: 8, 3: 8, 14: 2, 19: 6, 20: 10, 24: 2, 27: 2, 31: 4}
Did not match all atoms present	35212-01-2	CC1=C(C=C(C=C1N=[N+](C2=C(C(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 34: 1, 38: 4, 33: 1, 14: 4, 29: 1}
Did not match all atoms present	35212-22-7	CC(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3	{1: 2, 3: 1, 14: 9, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	35213-00-4	C1=CC(=C(C(=C1)[N+](=O)[O-])C#N)[N+](=O)[O-]	{38: 2, 37: 1, 14: 3}
Did not match all atoms present	35216-39-8	CS(=O)(=O)C1=CC=CC(=C1)N	{1: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	35218-75-8	C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)S(=O)(=O)O)C8=CC=C(C=C8)S(=O)(=O)O)C9=CC=C(C=C9)S(=O)(=O)O)N3)S(=O)(=O)O	{32: 2, 35: 2, 20: 4, 29: 8, 14: 24}
Did not match all atoms present	3522-50-7	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Fe+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	35225-79-7	C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2	{24: 1, 14: 10, 6: 4}
Did not match all atoms present	35231-36-8	CC1=CC(=C(C=C1O)C(C)C)OCCN(C)C	{1: 5, 2: 2, 3: 1, 33: 1, 14: 2, 21: 1, 22: 1}
Did not match all atoms present	35233-69-3	[2H]C(=C(C(=O)OC([2H])([2H])[2H])C([2H])([2H])[2H])[2H]	{1: 2, 28: 1, 5: 1, 7: 1}
Did not match all atoms present	35233-71-7	CC1=CC2=CC(=C1CCC3=C(C=C(CC2)C=C3C)C)C	{1: 4, 11: 4, 14: 4}
Did not match all atoms present	35233-72-8	CC1=CC2=C(C=C1CCC3=CC(=C(CC2)C=C3C)C)C	{1: 4, 11: 4, 14: 4}
Did not match all atoms present	35238-97-2	C1C[CH][CH]CC[CH][CH]1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C(Cl)Cl.F[P-](F)(F)(F)(F)F.[Rh]	{16: 6, 17: 2, 2: 1, 11: 4, 14: 34}
Did not match all atoms present	35239-30-6	CC1=CC=C(C=C1)[Si](C)(C)Cl	{1: 3, 14: 4, 17: 1}
Did not match all atoms present	3524-32-1	CC1=NN(C(=C1)N)C	{1: 2, 35: 1, 30: 1, 14: 1, 33: 1}
Did not match all atoms present	3524-87-6	CC1=CC(=O)N=CN1	{32: 1, 1: 1, 35: 1, 14: 2, 25: 1}
Did not match all atoms present	35243-43-7	CCC1=NC=CN=C1OCC	{1: 2, 2: 2, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	35246-18-5	CCC1=C(NC2=CC=CC=C21)C	{32: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	35246-22-1	C1=C[Te]C(=C1)C(=O)O	{27: 1, 14: 3}
Did not match all atoms present	35246-23-2	COC(=O)C1=CC=C[Te]1	{1: 1, 28: 1, 14: 3}
Did not match all atoms present	35246-25-4	CC1=CC=C[Te]1	{1: 1, 14: 3}
Did not match all atoms present	35247-09-7	CCCC[N+]1=C(C=C(C=C1C)O)C.[O-]Cl(=O)(=O)=O	{1: 3, 2: 3, 33: 1, 14: 2, 17: 1, 21: 1, 29: 4}
Did not match all atoms present	35249-69-5	C(C(=O)[O-])OCC(=O)[O-].[Na+].[Na+]	{24: 2, 2: 2, 22: 1}
Did not match all atoms present	35250-53-4	C1=CN=C(C=N1)CCS	{2: 2, 35: 2, 14: 3, 39: 1}
Did not match all atoms present	35255-37-9	CC1=CC(=NC(=N1)N(C(=O)C)S(=O)(=O)C2=CC=C(C=C2)N)C	{1: 3, 35: 2, 33: 1, 14: 5, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	35257-18-2	C1=CC=C(C=C1)C2=NN3C=CC4=CC=CC=C4C3=N2	{33: 1, 35: 2, 14: 11}
Did not match all atoms present	35258-12-9	CC/C(=C(/C1=CC=C(C=C1)OC)\C2=CC=C(C=C2)OCCN(CC)CC)/C3=CC=C(C=C3)OC.Cl	{1: 5, 2: 5, 33: 1, 7: 2, 14: 12, 17: 1, 22: 3}
Did not match all atoms present	3526-04-3	C1=CC=C2C=C3C=CC=CC4=CC(=C1)C2=C43	{14: 10}
Did not match all atoms present	35262-23-8	CN1C(=CN=N1)SC	{40: 1, 1: 2, 35: 2, 14: 1, 33: 1}
Did not match all atoms present	35263-47-9	CN(C)C(=O)NC1=CC=CC=C1NC(=O)N(C)C	{24: 2, 1: 4, 33: 2, 14: 4, 31: 2}
Did not match all atoms present	35266-49-0	COC(=O)N=C=S	{8: 1, 1: 1, 34: 1, 28: 1}
Did not match all atoms present	3527-05-7	C/[N+](=N\COC(=O)C1=CC=CC=C1)/[O-]	{1: 1, 2: 1, 33: 1, 34: 1, 14: 5, 28: 1, 29: 1}
Did not match all atoms present	35271-57-9	CC1=C(C=CC(=C1)[NH2+]C)O.CC1=C(C=CC(=C1)[NH2+]C)O.[O-]S(=O)(=O)[O-]	{1: 4, 21: 2, 14: 6, 29: 4}
Did not match all atoms present	35273-64-4	C1=C[Te]C(=C1)C=O	{26: 1, 14: 3}
Did not match all atoms present	35273-65-5	CC(=O)C1=CC=C[Te]1	{24: 1, 1: 1, 14: 3}
Did not match all atoms present	35277-02-2	C1=C(C=NN1)F	{16: 1, 32: 1, 35: 1, 14: 2}
Did not match all atoms present	35278-53-6	CC/C(=C(/C1=CC=C(C=C1)OC)\C2=CC=C(C=C2)OCCN3CCCC3)/C4=CC=C(C=C4)OC.Cl	{1: 3, 2: 3, 33: 1, 7: 2, 11: 4, 14: 12, 17: 1, 22: 3}
Did not match all atoms present	35279-80-2	COC(=O)[C-]=C(C(=[C-]C(=O)OC)C(=O)OC)C(=O)OC.[Pd+2]	{1: 4, 28: 4, 7: 2}
Did not match all atoms present	3528-17-4	C1CSC2=CC=CC=C2C1=O	{25: 1, 11: 2, 14: 4, 41: 1}
Did not match all atoms present	3528-58-3	CCN1C(=CC=N1)N	{1: 1, 2: 1, 35: 1, 33: 1, 14: 2, 30: 1}
Did not match all atoms present	35280-78-5	CCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N	{1: 1, 34: 1, 37: 1, 6: 1, 2: 5, 14: 8, 22: 1}
Did not match all atoms present	35281-29-9	CC1=C2CCC3=CC=CC=C3C2=C(C4=CC=CC=C14)C	{1: 2, 11: 2, 14: 8}
Did not match all atoms present	35281-34-6	C1CC2=C3C(=CC4=C5C3=C(C=C2)C=C6C5=C(CCC6)C=C4)C1	{11: 6, 14: 6}
Did not match all atoms present	35282-68-9	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2CO	{1: 2, 2: 1, 33: 1, 34: 2, 14: 8, 20: 1}
Did not match all atoms present	35282-69-0	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC(=C2)CO	{1: 2, 2: 1, 33: 1, 34: 2, 14: 8, 20: 1}
Did not match all atoms present	35285-69-9	CCCOC(=O)C1=CC=C(C=C1)[O-].[Na+]	{1: 1, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	35287-69-5	C[C@H]1CC(=O)C2=C(C3=C(C=CC(=C3O)C4=C(C5=C(C=C4)O[C@]6([C@@H]([C@H](CC(=O)C6=C5O)C)O)C(=O)OC)O)O[C@]2([C@@H]1O)C(=O)OC)O	{1: 4, 11: 2, 12: 4, 13: 2, 14: 4, 15: 4, 20: 4, 21: 2, 23: 2, 25: 2, 28: 2}
Did not match all atoms present	3529-01-9	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=CC=C(C5=CC=CC=C54)N=NC6=CC(=CC=C6)S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 4, 29: 6, 14: 19, 31: 1}
Did not match all atoms present	3529-82-6	C1=CC(=CC(=C1)[N+](=O)[O-])N=C=S	{8: 1, 34: 1, 38: 1, 14: 4}
Did not match all atoms present	35293-35-7	CC(C)([CH2-])C1=CC=CC=C1.[Mg+2].[Cl-]	{1: 2, 4: 1, 5: 1, 14: 5, 17: 1}
Did not match all atoms present	35295-35-3	C1=CC(=CC(=C1)OC(C(F)F)(F)F)C=O	{3: 1, 4: 1, 14: 4, 16: 4, 22: 1, 26: 1}
Did not match all atoms present	35295-36-4	C1=CC(=CC=C1C=O)OC(C(F)F)(F)F	{3: 1, 4: 1, 14: 4, 16: 4, 22: 1, 26: 1}
Did not match all atoms present	35298-13-6	CCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O	{1: 1, 2: 8, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	353-43-5	[B-](F)(F)(F)[S+](C)C	{16: 3, 1: 2}
Did not match all atoms present	353-46-8	B(C)(C)F	{16: 1, 1: 2}
Did not match all atoms present	353-66-2	C[Si](C)(F)F	{16: 2, 1: 2}
Did not match all atoms present	353-88-8	COP(=O)(C)F	{16: 1, 1: 2, 29: 1, 22: 1}
Did not match all atoms present	353-89-9	CC[Si](F)(F)F	{16: 3, 1: 1, 2: 1}
Did not match all atoms present	3530-19-6	CCOC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C3=CC=C(C=C3)N/N=C\4/C(=O)C=CC5=CC(=CC(=C54)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 1, 34: 3, 14: 16, 15: 1, 22: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	3530-36-7	C=CC(=O)OCCC1=CC=CC=C1	{2: 2, 14: 5, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	35302-14-8	CCN(CC)C1=NC(=NC(=N1)SNC2CCCCC2)SNC3CCCCC3	{1: 2, 2: 2, 35: 3, 33: 1, 40: 2, 11: 10, 12: 2, 31: 2}
Did not match all atoms present	35302-16-0	CCN(CC)C1=NC(=NC(=N1)SNC(C)(C)C)SNC(C)(C)C	{1: 8, 2: 2, 35: 3, 4: 2, 33: 1, 40: 2, 31: 2}
Did not match all atoms present	35303-76-5	C1=CC(=CC=C1CCN)S(=O)(=O)N	{2: 2, 30: 2, 29: 2, 14: 4}
Did not match all atoms present	35308-00-0	COC1=CC=CC2=C1NC3=CC=CC=C3C2=O	{32: 1, 1: 1, 22: 1, 14: 7, 25: 1}
Did not match all atoms present	3531-19-9	C1=C(C=C(C(=C1[N+](=O)[O-])N)Cl)[N+](=O)[O-]	{17: 1, 38: 2, 30: 1, 14: 2}
Did not match all atoms present	3531-43-9	CC(C)C[Sn](CC(C)C)(CC(C)C)CC(C)C	{1: 8, 2: 4, 3: 4}
Did not match all atoms present	3531-44-0	CC[Sn](C)(C)C	{1: 4, 2: 1}
Did not match all atoms present	3531-45-1	CCC[Sn](C)(C)C	{1: 4, 2: 2}
Did not match all atoms present	3531-46-2	CC(C)[Sn](C)(C)C	{1: 5, 3: 1}
Did not match all atoms present	3531-48-4	C[Sn](C)(C)C1CCCCC1	{1: 3, 11: 5, 12: 1}
Did not match all atoms present	35317-79-4	C1=CSC(=N1)NC(C(Cl)(Cl)Cl)O	{3: 1, 4: 1, 41: 1, 14: 2, 17: 3, 35: 1, 20: 1, 31: 1}
Did not match all atoms present	3532-31-8	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N=[N+]=[N-]	{24: 1, 34: 2, 38: 1, 14: 4}
Did not match all atoms present	35322-07-7	CP(=O)(C)CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3	{1: 2, 2: 1, 35: 1, 33: 1, 11: 1, 14: 8, 15: 1, 17: 1, 25: 1, 29: 1}
Did not match all atoms present	35323-91-2	C1[C@@H]([C@@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O	{11: 1, 12: 2, 14: 5, 20: 1, 21: 4, 23: 1}
Did not match all atoms present	35331-89-6	CCCC=C(CC)C=NC1=CC=CC=C1	{1: 2, 2: 3, 6: 2, 7: 1, 34: 1, 14: 5}
Did not match all atoms present	35335-07-0	CC1=C2C=CC3=CC=CC=C3C2=C(C4=C1C5=CC=CC=C5C=C4)C	{1: 2, 14: 12}
Did not match all atoms present	35335-60-5	CCP(=S)(N)OC1=CC(=C(C=C1)SC)C	{1: 3, 2: 1, 40: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	35344-11-7	C[C]1[C]([C]([C]([C]1C)C)C)C.C[C]1[C]([C]([C]([C]1C)C)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe]	{1: 10, 29: 4, 15: 10}
Did not match all atoms present	3535-37-3	COC1=C(C=C(C=C1)C(=O)Cl)OC	{24: 1, 1: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	3535-50-0	CCOC(=O)C=CC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)C=CC(=O)OCC)[O-]	{1: 2, 2: 2, 6: 4, 33: 1, 34: 1, 14: 8, 28: 2, 29: 1}
Did not match all atoms present	3535-67-9	COC1=C(C=CC=C1[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 22: 1, 14: 3}
Did not match all atoms present	3535-75-9	C1=CN(C=CC1=N)O	{33: 1, 36: 1, 21: 1, 14: 4}
Did not match all atoms present	3535-83-9	CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[I-]	{1: 4, 2: 24, 19: 1}
Did not match all atoms present	3535-84-0	C(#N)S.[Tl]	{37: 1, 39: 1}
Did not match all atoms present	3535-88-4	CC(C)(C)C1=CC(=C(C=C1)N)OC	{1: 4, 30: 1, 4: 1, 22: 1, 14: 3}
Did not match all atoms present	35350-31-3	CC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)C)[N+](=O)[O-])[N+](=O)[O-]	{40: 2, 1: 2, 38: 2, 14: 6}
Did not match all atoms present	35350-43-7	C1=CC=C(C(=C1)[N+](=O)[O-])[Se][Se]C2=CC=CC=C2[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	35350-45-9	COC1=CC(=C(C=C1)[Se][Se]C2=C(C=C(C=C2)OC)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 2, 22: 2, 14: 6}
Did not match all atoms present	3536-29-6	C1=CC=C(C=C1)CC(CO)C2=CC=CC=C2	{2: 2, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	3536-49-0	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC(=C(C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])O.CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC(=C(C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Ca+2]	{1: 8, 2: 8, 33: 4, 7: 2, 14: 20, 15: 4, 21: 2, 29: 12}
Did not match all atoms present	35363-12-3	CCC1=C(C=C[N+](=C1)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 33: 1, 14: 3, 29: 1}
Did not match all atoms present	35364-31-9	C1=CC=C(C=C1)N=NN(C2=CC=CC=C2)N	{33: 1, 34: 2, 30: 1, 14: 10}
Did not match all atoms present	35364-79-5	C1=CC(=C(C=C1CCO)Cl)Cl	{17: 2, 2: 2, 20: 1, 14: 3}
Did not match all atoms present	35364-90-0	CCOC(C1=CC=C(C=C1)C(C)C)OCC	{1: 4, 2: 2, 3: 2, 22: 2, 14: 4}
Did not match all atoms present	35367-38-5	C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=CC=C(C=C2)Cl)F	{16: 2, 17: 1, 31: 2, 14: 7, 24: 2}
Did not match all atoms present	35368-44-6	C1=CC(=CC=C1OCC(=S)N)Cl	{2: 1, 7: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	3537-86-8	CCCC[Al](CCCC)Cl	{1: 2, 2: 6, 17: 1}
Did not match all atoms present	35370-94-6	C1=CC=C(C(=C1)OCC(=S)N)Cl	{2: 1, 7: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	35370-95-7	C1=CC(=CC(=C1)Cl)OCC(=S)N	{2: 1, 7: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	35371-03-0	CSC1=CC=C(C=C1)I	{40: 1, 1: 1, 19: 1, 14: 4}
Did not match all atoms present	35379-58-9	CCC(=CC1=[N+](C2=CC=CC=C2S1)CCC(=O)O)C=C3N(C4=CC=CC=C4S3)CCC(=O)[O-]	{1: 1, 2: 5, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 24: 1, 27: 1}
Did not match all atoms present	3538-36-1	CCCCCCOCCOP(=O)(O)OCCOCCCCCC	{1: 2, 2: 14, 20: 1, 29: 1, 22: 4}
Did not match all atoms present	35386-24-4	COC1=CC=CC=C1N2CCNCC2	{32: 1, 1: 1, 33: 1, 11: 4, 14: 4, 22: 1}
Did not match all atoms present	3539-29-5	CCCCCCCCOS(=O)(=O)OC	{1: 2, 2: 7, 29: 2, 22: 2}
Did not match all atoms present	35391-95-8	C1C2C=CC1C3=C2C=CC(=C3)N	{11: 1, 12: 2, 30: 1, 14: 5}
Did not match all atoms present	35394-18-4	C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].[Cr+4]	{1: 12, 5: 4}
Did not match all atoms present	354-83-6	C(C(F)(F)[Si](Cl)(Cl)Cl)(F)F	{16: 4, 17: 3, 3: 1, 4: 1}
Did not match all atoms present	354-87-0	C(C(F)(F)S(=O)(=O)F)(F)(F)F	{16: 6, 4: 2, 29: 2}
Did not match all atoms present	3540-95-2	C1CCN(CC1)CCC(C2=CC=CC=C2)C3=CC=CC=C3	{11: 5, 33: 1, 2: 2, 3: 1, 14: 10}
Did not match all atoms present	35400-43-2	CCCSP(=S)(OCC)OC1=CC=C(C=C1)SC	{40: 2, 1: 3, 2: 3, 22: 2, 14: 4}
Did not match all atoms present	35406-29-2	C1CCC(CC1)C2=CC(=C(C=C2)O)C3CCCCC3	{11: 10, 12: 2, 21: 1, 14: 3}
Did not match all atoms present	35414-25-6	CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC	{1: 4, 2: 24}
Did not match all atoms present	35416-42-3	CC=CC=CC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5, 6: 4}
Did not match all atoms present	3542-36-7	CCCCCCCC[Sn](CCCCCCCC)(Cl)Cl	{1: 2, 2: 14, 17: 2}
Did not match all atoms present	35425-33-3	B(Cl)(Br)I	{17: 1, 18: 1, 19: 1}
Did not match all atoms present	3543-75-7	CN1C2=C(C=C(C=C2)N(CCCl)CCCl)N=C1CCCC(=O)O.Cl	{1: 1, 2: 7, 35: 1, 33: 2, 14: 3, 17: 3, 27: 1}
Did not match all atoms present	35432-36-1	CC(C)CS(=O)(=O)Cl	{1: 2, 2: 1, 3: 1, 29: 2, 17: 1}
Did not match all atoms present	35434-81-2	C[Sn](C)(C)CCC[Sn](C)(C)C	{1: 6, 2: 3}
Did not match all atoms present	35437-21-9	CC1=C2CCCC3=C(SS(=C23)S1)C	{1: 2, 11: 3, 41: 2, 15: 5}
Did not match all atoms present	3544-23-8	COC1=C(C=CC(=C1)N=NC2=CC=CC=C2)N	{1: 1, 30: 1, 34: 2, 22: 1, 14: 8}
Did not match all atoms present	3544-24-9	C1=CC(=CC(=C1)N)C(=O)N	{24: 1, 30: 2, 14: 4}
Did not match all atoms present	3544-25-0	C1=CC(=CC=C1CC#N)N	{2: 1, 30: 1, 14: 4, 37: 1}
Did not match all atoms present	3544-35-2	CC(C)NNC(=O)COC1=CC=C(C=C1)Cl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	3544-94-3	C1=CC(=CC=C1[C@H]([C@@H](COC(=O)CCC(=O)O)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]	{2: 3, 3: 3, 38: 1, 14: 4, 17: 2, 20: 1, 24: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	35449-08-2	C[Si](C)(C)C(CC1=CC=CC=C1)([Si](C)(C)C)[Si](C)(C)C	{1: 9, 2: 1, 4: 1, 14: 5}
Did not match all atoms present	35449-60-6	CP(C)SC	{40: 1, 1: 3}
Did not match all atoms present	35449-91-3	C(C(F)(F)P1P(P(P1C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F)(F)(F)F	{16: 20, 4: 8}
Did not match all atoms present	3545-88-8	C1=C2C=C(C(=C(C2=C(C=C1S(=O)(=O)O)N)O)N)S(=O)(=O)O	{30: 2, 20: 2, 21: 1, 14: 3, 29: 4}
Did not match all atoms present	3546-10-9	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)CC5=CC=C(C=C5)N(CCCl)CCCl)C)C	{1: 5, 2: 8, 3: 2, 33: 1, 11: 8, 12: 5, 13: 2, 14: 5, 15: 1, 17: 2, 28: 1}
Did not match all atoms present	3546-29-0	C=CCC1(C(=O)NC(=NC1=O)[S-])C2CCCC=C2.[Na+]	{32: 1, 2: 1, 35: 1, 5: 1, 6: 1, 11: 3, 12: 1, 13: 1, 14: 2, 15: 1, 25: 2}
Did not match all atoms present	3546-41-6	CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C/C3=[N+](C4=C(C=C(C=C4)N(C)C)C=C3)C.CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C/C3=[N+](C4=C(C=C(C=C4)N(C)C)C=C3)C.C1=CC=C2C(=C(C(=CC2=C1)C(=O)O)[O-])CC3=C(C(=CC4=CC=CC=C34)C(=O)O)[O-]	{1: 10, 2: 1, 6: 4, 33: 6, 14: 32, 27: 2}
Did not match all atoms present	3546-96-1	CCCCCCCCCCCCNCCC(=O)O.[Na+]	{1: 1, 2: 13, 27: 1, 31: 1}
Did not match all atoms present	35464-32-5	C1CCCCCC1.C1CCCCCC1.[Ti]	{11: 14}
Did not match all atoms present	35465-66-8	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CCN	{1: 2, 2: 12, 14: 4, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	35466-83-2	COC(=O)OCC=C	{1: 1, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	3547-04-4	CC(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl	{1: 1, 3: 1, 14: 8, 17: 2}
Did not match all atoms present	3547-07-7	C1=CC(=CC=C1OCCCC(=O)O)Cl	{17: 1, 2: 3, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	35471-49-9	C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)[O-].[K+]	{17: 1, 2: 1, 14: 8}
Did not match all atoms present	35472-56-1	CCOC(=O)C1=CC=CC=C1NC	{1: 2, 2: 1, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	35472-85-6	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)[N+]#N)C	{1: 2, 34: 3, 14: 7}
Did not match all atoms present	35473-23-5	COC1=CC(=C(C=C1C=O)OC)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3	{1: 2, 2: 4, 33: 1, 14: 12, 22: 2, 26: 1, 28: 2}
Did not match all atoms present	35473-24-6	CC1=CC(=CC=C1)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3	{1: 1, 2: 4, 28: 2, 14: 14, 33: 1}
Did not match all atoms present	35483-50-2	COC1=CC2=CC3=C(C(=C2C(=C1C4=C(C5=C(C6=C(CC(OC6=O)CC(=O)OC)C=C5C=C4OC)O)O)O)O)C(=O)OC(C3)CC(=O)OC	{1: 4, 2: 2, 11: 2, 12: 2, 14: 4, 21: 4, 22: 2, 28: 4}
Did not match all atoms present	355-03-3	C1(C(C(C(C(C1(F)F)(F)F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F	{16: 12, 13: 6, 29: 2}
Did not match all atoms present	355-46-4	C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 13, 20: 1, 4: 6, 29: 2}
Did not match all atoms present	355-86-2	C(C(C(C(C(F)F)(F)F)(F)F)(F)F)OP(=O)(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(F)F)(F)F)(F)F)(F)F	{2: 3, 3: 3, 4: 9, 16: 24, 22: 3, 29: 1}
Did not match all atoms present	3550-21-8	C1=CC=C(C=C1)C(C2=CC=CC=C2)N=C=S	{8: 1, 34: 1, 3: 1, 14: 10}
Did not match all atoms present	35503-54-9	C(CO)C1=NC(=NC(=O)N1CO)CO	{25: 1, 2: 4, 35: 2, 20: 3, 33: 1}
Did not match all atoms present	35505-46-5	CCC1=C2CCCC3=C(SS(=C23)S1)CC	{1: 2, 2: 2, 11: 3, 41: 2, 15: 5}
Did not match all atoms present	35505-47-6	CC(C)C1=C2CCCC3=C(SS(=C23)S1)C(C)C	{11: 3, 1: 4, 3: 2, 41: 2, 15: 5}
Did not match all atoms present	35505-51-2	C[Si](C)(C)C1=CN=C(C=C1)[Si](C)(C)C	{1: 6, 35: 1, 14: 3}
Did not match all atoms present	35505-52-3	C[Si](C)(C)C1=NC(=CC=C1)[Si](C)(C)C	{1: 6, 35: 1, 14: 3}
Did not match all atoms present	35506-85-5	C1=CC=C(C=C1)COS(=O)OCC2=CC=CC=C2	{2: 2, 22: 2, 14: 10, 29: 1}
Did not match all atoms present	35507-35-8	C1=CC(=CC=C1N)[Se][Se]C2=CC=C(C=C2)N	{30: 2, 14: 8}
Did not match all atoms present	35507-78-9	CCS(=O)(=O)O.CC1=C(C(=NC(=N1)N)N)C23CC4CC(C2)CC(C4)C3	{1: 2, 2: 1, 35: 2, 11: 6, 12: 3, 13: 1, 20: 1, 29: 2, 30: 2}
Did not match all atoms present	3551-55-1	COC1=NC(=NC=C1)OC	{1: 2, 35: 2, 22: 2, 14: 2}
Did not match all atoms present	35511-93-4	C1=CC=C(C=C1)CCCCCCCCCCC2=CC=CC=C2	{2: 10, 14: 10}
Did not match all atoms present	35515-91-4	[V](=[Te])=[Te]	{}
Did not match all atoms present	3553-78-4	CCCCS[Si](C)(C)C	{40: 1, 1: 4, 2: 3}
Did not match all atoms present	35533-29-0	C1C(=O)N(C(=S)S1)N/C=C\2/C=CC=CC2=O	{33: 1, 6: 1, 41: 1, 11: 1, 14: 4, 15: 2, 25: 2, 31: 1}
Did not match all atoms present	35542-88-2	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Mn+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	3555-11-1	C=CCOC1=C(C(=C(C(=C1Br)Br)Br)Br)Br	{22: 1, 2: 1, 18: 5, 5: 1, 6: 1}
Did not match all atoms present	3555-18-8	CCC(C)C1=CC(=C(C=C1)O)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1, 14: 3, 21: 1}
Did not match all atoms present	3555-47-3	C[Si](C)(C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 12, 22: 4}
Did not match all atoms present	3555-84-8	COC1=CC=CC(=C1OC)C(=O)C2=CC=CC=C2	{24: 1, 1: 2, 22: 2, 14: 8}
Did not match all atoms present	3555-86-0	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2O)O)O	{24: 1, 21: 3, 14: 7}
Did not match all atoms present	35551-81-6	CC(C)(C)CC(C)(C)CC(=O)[O-].CC(C)(C)CC(C)(C)CC(=O)[O-].CC(C)(C)CC(C)(C)CC(=O)[O-].[Bi+3]	{24: 3, 1: 15, 2: 6, 4: 6}
Did not match all atoms present	35554-44-0	C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl	{33: 1, 2: 2, 3: 1, 5: 1, 6: 1, 14: 6, 17: 2, 35: 1, 22: 1}
Did not match all atoms present	35556-06-0	C[NH+](C)CC(=O)C1=CC2=C(C=C1)SC3=C2C=C(C=C3)C(=O)C[NH+](C)C.[Cl-].[Cl-]	{1: 4, 2: 2, 41: 1, 14: 6, 17: 2, 24: 2}
Did not match all atoms present	35564-19-3	C1=C(C=C(C=C1C(F)(F)F)F)C(F)(F)F	{16: 7, 4: 2, 14: 3}
Did not match all atoms present	35572-34-0	CC1=CC(=CC=C1)N=C2N(C(=O)CS2)CCC3=CC=C(C=C3)Cl	{1: 1, 2: 2, 33: 1, 41: 1, 11: 1, 34: 1, 14: 8, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	35572-78-2	CC1=C(C=C(C=C1N)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 30: 1, 14: 2}
Did not match all atoms present	35575-96-3	COP(=O)(OC)SCN1C2=NC=C(C=C2OC1=O)Cl	{1: 2, 2: 1, 35: 1, 33: 1, 40: 1, 14: 2, 17: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	35578-47-3	C1=CC(=CC=C1C(=O)C(=O)C2=CC=C(C=C2)Br)Br	{24: 2, 18: 2, 14: 8}
Did not match all atoms present	3558-17-6	CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C=O	{32: 1, 1: 1, 26: 1, 38: 1, 14: 3}
Did not match all atoms present	3558-24-5	CN1C2=CC=CC=C2C=C1C3=CC=CC=C3	{1: 1, 14: 10, 33: 1}
Did not match all atoms present	3558-60-9	COCCC1=CC=CC=C1	{1: 1, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	3558-69-8	C1=CC=C(C=C1)C2=NC(=CC=C2)C3=CC=CC=C3	{35: 1, 14: 13}
Did not match all atoms present	3559-74-8	C[Si](C)(C)C1C=CC=C1	{1: 3, 12: 1, 14: 4}
Did not match all atoms present	3560-78-9	CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=C(C=C4)C(F)(F)F.C(=C/C(=O)O)\C(=O)O	{1: 1, 3: 1, 4: 1, 6: 2, 33: 1, 11: 4, 12: 3, 14: 9, 16: 3, 22: 1, 27: 2}
Did not match all atoms present	35604-67-2	CCOC1=CC=CC=C1OCC2CNCCO2.Cl	{32: 1, 1: 1, 2: 2, 11: 3, 12: 1, 14: 4, 17: 1, 22: 2, 23: 1}
Did not match all atoms present	35607-13-7	C1=CC=C(C=C1)OCC(CNCCNCC(COC2=CC=CC=C2)O)O.Cl.Cl	{2: 6, 3: 2, 14: 10, 17: 2, 20: 2, 22: 2, 31: 2}
Did not match all atoms present	35607-66-0	CO[C@@]1([C@@H]2N(C1=O)C(=C(CS2)COC(=O)N)C(=O)O)NC(=O)CC3=CC=CS3	{1: 1, 2: 2, 33: 1, 41: 2, 11: 1, 12: 1, 13: 1, 14: 3, 15: 2, 22: 1, 24: 1, 25: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	3561-67-9	C1=CC=C(C=C1)SCSC2=CC=CC=C2	{40: 2, 2: 1, 14: 10}
Did not match all atoms present	35610-74-3	C1CCC(=C2C(=O)N(C(=S)S2)C3=CC=CC=C3)CC1	{33: 1, 41: 1, 11: 5, 14: 5, 15: 3, 25: 1}
Did not match all atoms present	35619-65-9	COC1=CC(=CC(=C1OC)OC)C(=S)N2CCOCC2	{1: 3, 33: 1, 7: 1, 11: 4, 14: 2, 22: 3, 23: 1}
Did not match all atoms present	3562-84-3	CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)Br)O)Br	{1: 1, 2: 1, 14: 6, 18: 2, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	3562-99-0	COC1=CC=C(C2=CC=CC=C21)C(=O)CCC(=O)O	{1: 1, 2: 2, 14: 6, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	35620-71-4	C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)O	{35: 1, 27: 1, 22: 1, 14: 8}
Did not match all atoms present	35623-09-7	CC1=NC=C(C(=C1N)COC)CN	{1: 2, 2: 2, 35: 1, 14: 1, 22: 1, 30: 2}
Did not match all atoms present	35629-37-9	CC1=C(OC(=N1)NC(=O)C)C	{24: 1, 1: 3, 31: 1, 35: 1, 23: 1}
Did not match all atoms present	35629-38-0	CC(=O)NC1=NC(=CO1)C2=CC=CC=C2	{1: 1, 35: 1, 14: 6, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	35629-39-1	CC(=O)NC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 35: 1, 14: 10, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	35629-40-4	CC(=O)N(C1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C	{1: 2, 35: 1, 33: 1, 14: 10, 23: 1, 24: 2}
Did not match all atoms present	35629-70-0	CC1=COC(=N1)N	{1: 1, 35: 1, 30: 1, 14: 1, 23: 1}
Did not match all atoms present	3563-27-7	CC12CCC3C(=CCC4=C3C=CC(=C4)O)C1CCC2O	{1: 1, 11: 5, 12: 3, 13: 1, 14: 4, 15: 1, 20: 1, 21: 1}
Did not match all atoms present	3563-57-3	C=CCC(CC=C)(C1=CC=CC=C1)C(=O)N	{2: 2, 4: 1, 5: 2, 6: 2, 14: 5, 24: 1, 30: 1}
Did not match all atoms present	3563-92-6	CCN[C@H](CC1=CC=CC=C1)[C@H]2CCCO2	{1: 1, 2: 2, 3: 1, 11: 3, 12: 1, 14: 5, 23: 1, 31: 1}
Did not match all atoms present	3564-09-8	CC1=CC(=C(C=C1C)N/N=C\2/C3=C(C=C(C=C3)S(=O)(=O)[O-])C=C(C2=O)S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 3, 34: 1, 14: 6, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	3564-14-5	C1=CC=C2C(=C1)C=CC(=C2O)N/N=C/3\C4=CC=CC=C4C(=CC3=O)S(=O)(=O)[O-].[Na+]	{34: 1, 14: 11, 15: 2, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	3564-15-6	C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)N=NC3=CC(=C(C=C3N)N)N/N=C\4/C=C(C=CC4=O)[N+](=O)[O-].[Na+]	{34: 3, 38: 1, 14: 11, 15: 2, 25: 1, 29: 3, 30: 2, 31: 1}
Did not match all atoms present	3564-22-5	CC1=CC(=C(C=C1)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 1, 38: 2, 14: 12, 15: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	3564-26-9	C1=CC(=C(C=C1S(=O)(=O)[O-])N/N=C/2\C=CC(=O)C=C2O)O.[Na+]	{34: 1, 14: 6, 15: 2, 20: 1, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	3564-27-0	C1=CC(=CC=C1N/N=C/2\C=CC(=O)C(=C2)C(=O)[O-])N=NC3=CC=C(C=C3)S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	35640-09-6	C1CCN(C1)C(=O)NC2=CC=C(C=C2)Cl	{33: 1, 11: 4, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	3565-26-2	C1=CC2=C(C=CC(=C2N=C1)O)N=O	{34: 1, 35: 1, 21: 1, 14: 5, 29: 1}
Did not match all atoms present	3565-72-8	CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Br)OCCN(C)C	{1: 3, 2: 2, 4: 1, 33: 1, 14: 9, 18: 1, 22: 1}
Did not match all atoms present	35656-51-0	C1=CC=C2C(=C1)OC3=C(O2)C(=CC=C3)Cl	{17: 1, 14: 7, 23: 2}
Did not match all atoms present	3566-00-5	CC1=C(C=CC(=C1)OC(=O)NC)SC	{40: 1, 1: 3, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	3566-10-7	C(CNC(=S)[S-])NC(=S)[S-].[NH4+].[NH4+]	{2: 2, 31: 2, 7: 2}
Did not match all atoms present	3566-65-2	C1=CC2=C(C(=C1)Cl)C(=O)C3=CC=C4C5=C6C(=CC=C7C6=C(C=C5)C8=C(C7=O)C(=CC=C8)Cl)C9=C4C3=C2C=C9	{17: 2, 14: 14, 25: 2}
Did not match all atoms present	3566-95-8	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=NC4=C(S3)C=C(C=C4)Br	{34: 1, 35: 1, 41: 1, 14: 9, 15: 1, 18: 1, 25: 1, 31: 1}
Did not match all atoms present	35661-39-3	C[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 1, 2: 1, 3: 1, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	35661-40-6	C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 2, 3: 1, 12: 1, 14: 13, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	35661-60-0	CC(C)C[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 2, 2: 2, 3: 2, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	3567-38-2	C#CC(C1=CC=CC=C1)OC(=O)N	{3: 1, 9: 1, 10: 1, 14: 5, 28: 1, 30: 1}
Did not match all atoms present	3567-65-5	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)N/N=C/5\C(=O)C=CC6=CC(=CC(=C65)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 3, 14: 20, 15: 1, 22: 1, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	3567-66-6	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 8, 15: 2, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	3567-69-9	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C\3/C=C(C4=CC=CC=C4C3=O)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 11, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	3567-72-4	C1=CC=C2C(=C1)N(C(=O)O2)SC(Cl)(Cl)Cl	{33: 1, 4: 1, 40: 1, 14: 4, 17: 3, 28: 1}
Did not match all atoms present	3567-76-8	C1=CC2=C(C=C1N)C(=O)NC(O2)CCCl	{32: 1, 2: 2, 12: 1, 14: 3, 17: 1, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	3567-96-2	CC1=C(C(=C(C(=C1OC)C(=O)CC(C)C)OC)C)OC	{24: 1, 1: 7, 2: 1, 3: 1, 22: 3}
Did not match all atoms present	35673-03-1	CC=C(C1=CC=CC=C1)Cl	{1: 1, 17: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	35677-29-3	CCC(C#N)(C1=CC=CC=C1)C(=O)O	{1: 1, 2: 1, 4: 1, 37: 1, 14: 5, 27: 1}
Did not match all atoms present	3568-23-8	CCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CC(C)N(C)C.C(=C\C(=O)O)\C(=O)O	{1: 4, 2: 2, 3: 1, 6: 2, 33: 2, 41: 1, 14: 7, 24: 1, 27: 2}
Did not match all atoms present	3568-24-9	CCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C	{1: 3, 2: 4, 33: 2, 41: 1, 14: 7, 24: 1}
Did not match all atoms present	3568-26-1	CC(CC=NC1=CC=CC2=CC=CC=C21)O	{1: 1, 2: 1, 3: 1, 6: 1, 34: 1, 14: 7, 20: 1}
Did not match all atoms present	35682-28-1	C1=CC(C=C1)[GeH3]	{12: 1, 14: 4}
Did not match all atoms present	35684-23-2	CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC	{1: 2, 2: 3, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	35686-14-7	CCC1=CSC=C1CC	{1: 2, 2: 2, 14: 2, 41: 1}
Did not match all atoms present	35688-69-8	CC1=CC=C(C(=S)N1C=C)O	{1: 1, 5: 1, 6: 1, 33: 1, 14: 2, 21: 1}
Did not match all atoms present	35688-70-1	CC1=NC2=C(C=C1)OCCS2	{1: 1, 35: 1, 41: 1, 11: 2, 14: 2, 23: 1}
Did not match all atoms present	3569-01-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)C(=O)C5=CC=CC=C5N4	{32: 1, 25: 3, 14: 10}
Did not match all atoms present	3569-18-4	CC1(CC(C2=C1C=CC(=C2)C(=O)O)(C)C3=CC=C(C=C3)C(=O)O)C	{27: 2, 1: 3, 11: 1, 13: 2, 14: 7}
Did not match all atoms present	3569-57-1	CCCCCCCCS(=O)CCCCl	{1: 1, 2: 10, 29: 1, 17: 1}
Did not match all atoms present	3569-58-2	C[S+](C)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.[I-]	{1: 2, 2: 2, 4: 1, 11: 5, 12: 1, 14: 5, 19: 1, 20: 1, 28: 1}
Did not match all atoms present	35693-92-6	C1=CC=C(C=C1)C2=C(C=C(C=C2Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	35693-99-3	C1=CC(=C(C=C1Cl)C2=C(C=CC(=C2)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	35694-04-3	C1=C(C=C(C(=C1Cl)Cl)C2=CC(=CC(=C2Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	35694-06-5	C1=CC(=C(C=C1Cl)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	35694-08-7	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl	{17: 8, 14: 2}
Did not match all atoms present	35697-34-8	CC[NH+](CC)CCOC1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=CC(=C3)OCC[NH+](CC)CC.[Cl-].[Cl-]	{1: 4, 2: 8, 14: 6, 17: 2, 22: 2, 25: 2}
Did not match all atoms present	357-07-3	CN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O.Cl	{1: 1, 33: 1, 11: 5, 12: 2, 13: 2, 14: 2, 17: 1, 20: 1, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	357-08-4	C=CCN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O.Cl	{33: 1, 2: 1, 5: 1, 6: 1, 11: 5, 12: 2, 13: 2, 14: 2, 17: 1, 20: 1, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	357-56-2	C[C@H](CN1CCOCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N4CCCC4	{1: 1, 2: 1, 3: 1, 4: 1, 33: 2, 11: 8, 14: 10, 23: 1, 24: 1}
Did not match all atoms present	357-57-3	COC1=C(C=C2C(=C1)[C@]34CCN5[C@H]3C[C@@H]6[C@@H]7C4N2C(=O)CC7OCC=C6C5)OC	{1: 2, 33: 2, 11: 6, 12: 5, 13: 1, 14: 3, 15: 1, 22: 2, 23: 1, 25: 1}
Did not match all atoms present	357-67-5	CCC1(C(=O)NC(=O)N(C1=O)C2=CC=CC=C2)CC	{32: 1, 1: 2, 2: 2, 33: 1, 13: 1, 14: 5, 25: 3}
Did not match all atoms present	357-70-0	CN1CC[C@@]23C=C[C@@H](C[C@@H]2OC4=C(C=CC(=C34)C1)OC)O	{1: 2, 33: 1, 11: 4, 12: 2, 13: 1, 14: 4, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	3570-54-5	C1CC2=C3C=CC4=CC=CC=C4C3=C5CCC6=C5C2=C1C=C6	{11: 4, 14: 8}
Did not match all atoms present	3570-58-9	CS(=O)(=O)OCCCl	{1: 1, 2: 2, 29: 2, 22: 1, 17: 1}
Did not match all atoms present	3570-61-4	C1=C(C(=CC(=C1Cl)Cl)Cl)OCCOS(=O)(=O)[O-].[Na+]	{17: 3, 2: 2, 22: 2, 14: 2, 29: 3}
Did not match all atoms present	3570-75-0	C1=C(OC(=C1)[N+](=O)[O-])C2=CSC(=N2)NNC=O	{35: 1, 38: 1, 41: 1, 14: 3, 23: 1, 26: 1, 31: 2}
Did not match all atoms present	3570-80-7	CC(=O)O[Hg]C1=C(C=C2C(=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)O)[Hg]OC(=O)C)O	{1: 2, 13: 1, 14: 8, 21: 2, 23: 1, 28: 3}
Did not match all atoms present	35703-14-1	CC(=O)C1=CC(=CC=C1)[N+]#N.[Cl-]	{24: 1, 1: 1, 34: 1, 14: 4, 17: 1}
Did not match all atoms present	35709-09-2	CCCCCCCCC=CCCCCCCCCOS(=O)(=O)C	{1: 2, 2: 15, 22: 1, 6: 2, 29: 2}
Did not match all atoms present	35710-05-5	C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=O)OC2=O	{33: 1, 2: 1, 28: 2, 14: 9}
Did not match all atoms present	35711-34-3	CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)[O-].[Na+]	{24: 2, 1: 2, 2: 1, 14: 6, 33: 1}
Did not match all atoms present	35714-87-5	CCN(CC[N+](C)(C)CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl.[Cl-]	{1: 3, 2: 4, 38: 1, 33: 1, 34: 2, 14: 12, 17: 2}
Did not match all atoms present	35714-88-6	CCN(CC[N+](C)(C)CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl.COS(=O)(=O)[O-]	{1: 4, 2: 4, 38: 1, 33: 1, 34: 2, 14: 12, 17: 1, 22: 1, 29: 3}
Did not match all atoms present	35718-03-7	C1CC2CC1CC2NCC3=CC=CC=C3	{2: 1, 11: 4, 12: 3, 14: 5, 31: 1}
Did not match all atoms present	3572-06-3	CC(=O)CCC1=CC=C(C=C1)OC(=O)C	{24: 1, 1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	3572-35-8	CC[N+](C)(CC)CCCOC1=NN=C(C=C1)OCCC[N+](C)(CC)CC.[I-].[I-]	{1: 6, 2: 10, 35: 2, 14: 2, 19: 2, 22: 2}
Did not match all atoms present	3572-43-8	CN(CC1=CC(=CC(=C1N)Br)Br)C2CCCCC2	{1: 1, 2: 1, 33: 1, 11: 5, 12: 1, 14: 2, 18: 2, 30: 1}
Did not match all atoms present	3572-47-2	CCCCCCCC[Sn](=S)CCCCCCCC	{1: 2, 2: 14}
Did not match all atoms present	3572-52-9	CCN(CC)CCOC(=O)C1=CC=CC(=C1O)C2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 14: 8, 21: 1, 28: 1}
Did not match all atoms present	3572-74-5	CC(C1=CC=CC=C1)(C2=CC=CC=C2)OCCN(C)C	{1: 3, 2: 2, 4: 1, 33: 1, 14: 10, 22: 1}
Did not match all atoms present	3572-80-3	CC1C2CC3=C(C1(CCN2CC4CC4)C)C=C(C=C3)O	{1: 2, 2: 1, 33: 1, 11: 5, 12: 3, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	35724-06-2	CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Sb+3]	{24: 3, 1: 9, 2: 15, 4: 3}
Did not match all atoms present	35725-30-5	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Dy+3]	{}
Did not match all atoms present	35725-31-6	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Ho+3]	{}
Did not match all atoms present	35725-33-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.[Tm+3]	{}
Did not match all atoms present	35725-34-9	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Yb+3]	{}
Did not match all atoms present	35728-99-5	CCOC(=O)C1=C(SC(=C1N)C(=O)OCC)C	{1: 3, 2: 2, 28: 2, 30: 1, 41: 1}
Did not match all atoms present	35730-09-7	C1=CC(=C(C=C1F)C(=O)Cl)F	{16: 2, 17: 1, 14: 3, 24: 1}
Did not match all atoms present	35735-32-1	CC1=CC(=C(C(=C1)C(C)(C)C)N)C	{1: 5, 4: 1, 30: 1, 14: 2}
Did not match all atoms present	35737-10-1	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCC(=O)O	{2: 3, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	35737-15-6	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)O	{32: 1, 2: 2, 3: 1, 12: 1, 14: 13, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	3574-96-7	C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)Cl	{32: 1, 17: 1, 35: 1, 14: 8}
Did not match all atoms present	35743-94-3	CC(C)([C@H](C(=O)[O-])N)S.[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Na+].[Sb+3]	{1: 2, 3: 3, 4: 1, 39: 1, 20: 2, 24: 3, 30: 1}
Did not match all atoms present	35747-58-1	C1=CC(=C(C=C1N)C#N)Cl	{17: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	3575-31-3	CCCCCCCCC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 7, 27: 1, 14: 4}
Did not match all atoms present	3576-20-3	CN1C(=O)N(P1(Cl)(Cl)Cl)C	{1: 2, 25: 1, 33: 2, 17: 3}
Did not match all atoms present	3576-44-1	CN(C)CCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31	{1: 2, 2: 2, 33: 2, 41: 1, 14: 8, 24: 1}
Did not match all atoms present	3576-45-2	CN(C)CCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl	{1: 2, 2: 2, 33: 2, 41: 1, 14: 7, 17: 1, 24: 1}
Did not match all atoms present	3576-47-4	CCN(CC)CCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31	{1: 2, 2: 4, 33: 2, 41: 1, 14: 8, 24: 1}
Did not match all atoms present	3576-75-8	C1C2(CN3CC(C2O)(CN1C3)C4=CC=CC=C4)C5=CC=CC=C5	{33: 2, 11: 5, 12: 1, 13: 2, 14: 10, 20: 1}
Did not match all atoms present	35763-62-3	COC1=C(C(=O)C2=C3C1=CC=C4C3=C(C=C2)C5=CC=CC=C5S4)C6=CC=CC=C6	{1: 1, 41: 1, 22: 1, 14: 13, 25: 1}
Did not match all atoms present	35764-54-6	COC1=CC2=C(C=C1)NC3=C2CCNC3.Cl	{32: 2, 1: 1, 11: 3, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	35764-73-9	CC1C2=C(C=C(C=C2)C(F)(F)F)C(C3=CC=CC=C13)CCCN(C)C	{1: 3, 2: 3, 4: 1, 33: 1, 12: 2, 14: 7, 16: 3}
Did not match all atoms present	3577-01-3	CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)SC1)C(=O)O	{1: 1, 2: 1, 3: 1, 33: 1, 41: 1, 11: 1, 12: 2, 14: 5, 15: 2, 24: 1, 25: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	3577-63-7	C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)N	{30: 1, 27: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	3577-87-5	COP(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 22: 3, 14: 10}
Did not match all atoms present	35773-42-3	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4O3	{1: 2, 2: 2, 35: 1, 33: 1, 14: 8, 23: 1, 28: 1}
Did not match all atoms present	35773-44-5	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=C(O3)C=CC(=C4)S(=O)(=O)N(C)C	{1: 4, 2: 2, 35: 1, 33: 2, 14: 7, 23: 1, 28: 1, 29: 2}
Did not match all atoms present	35778-58-6	CCN(CC)C1=CC=C(C=C1)/C=C/2\C(=O)NC(=S)S2	{32: 1, 1: 2, 2: 2, 6: 1, 33: 1, 41: 1, 14: 4, 15: 2, 25: 1}
Did not match all atoms present	35779-04-5	CC(C)(C)C1=CC=C(C=C1)I	{1: 3, 19: 1, 4: 1, 14: 4}
Did not match all atoms present	3578-64-1	CCCCCC/C=C/S(=O)(=O)O	{1: 1, 2: 5, 20: 1, 29: 2, 6: 2}
Did not match all atoms present	3578-72-1	CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 40}
Did not match all atoms present	35788-00-2	[O-]S(=O)[O-].[Cu+].[Cu+]	{29: 3}
Did not match all atoms present	35788-21-7	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)C(=O)N)O)O	{33: 1, 35: 3, 12: 4, 14: 2, 20: 2, 23: 1, 24: 1, 30: 2}
Did not match all atoms present	35788-27-3	CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)O	{1: 1, 35: 3, 33: 1, 12: 4, 14: 2, 20: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	35788-28-4	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)C(=O)NCCO)O)O	{33: 1, 2: 2, 35: 3, 12: 4, 14: 2, 20: 3, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	35795-44-9	CCN1C(=O)C(=CC=C2N(CCS2)C)OC1=S	{1: 2, 2: 1, 6: 2, 33: 2, 41: 1, 11: 2, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	358-06-5	CC[Si](CC)(F)F	{16: 2, 1: 2, 2: 2}
Did not match all atoms present	358-23-6	C(F)(F)(F)S(=O)(=O)OS(=O)(=O)C(F)(F)F	{16: 6, 4: 2, 29: 4, 22: 1}
Did not match all atoms present	358-43-0	CC[Si](CC)(CC)F	{16: 1, 1: 3, 2: 3}
Did not match all atoms present	358-67-8	CO[Si](C)(CCC(F)(F)F)OC	{16: 3, 1: 3, 2: 2, 4: 1, 22: 2}
Did not match all atoms present	358-74-7	CCOP(=O)(OCC)F	{16: 1, 1: 2, 2: 2, 29: 1, 22: 2}
Did not match all atoms present	358-95-2	B(C=C)(F)F	{16: 2, 5: 1, 6: 1}
Did not match all atoms present	3581-30-4	C1COCCN1C(=S)S	{23: 1, 33: 1, 11: 4, 39: 1, 7: 1}
Did not match all atoms present	3581-87-1	CC1=NC=CS1	{1: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	3581-89-3	CC1=CN=CS1	{1: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	3581-91-7	CC1=C(SC=N1)C	{1: 2, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	35813-38-8	CC(=O)N(C)C1=CC=C(C=C1)OC	{24: 1, 1: 3, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	35817-13-1	CC(=C)C1CC2=C(O1)C(=C(C(=C2)C(=O)C)O)OC	{1: 3, 5: 1, 7: 1, 11: 1, 12: 1, 14: 1, 21: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	35817-27-7	CCOC1=CC(=O)OC2=CC=CC=C21	{1: 1, 2: 1, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	3582-11-4	C(P(Cl)Cl)(Cl)(Cl)Cl	{17: 5, 4: 1}
Did not match all atoms present	3582-17-0	C[Sn](C)(F)F	{16: 2, 1: 2}
Did not match all atoms present	3582-71-6	C[Si](C)(O[Si](C)(C)Cl)O[Si](C)(C)Cl	{1: 6, 22: 2, 17: 2}
Did not match all atoms present	3582-72-7	C[Si](C1=CC=CC=C1)(O[Si](C)(C2=CC=CC=C2)Cl)Cl	{1: 2, 22: 1, 14: 10, 17: 2}
Did not match all atoms present	35822-46-9	C1=C2C(=C(C(=C1Cl)Cl)Cl)OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 7, 14: 1, 23: 2}
Did not match all atoms present	35822-50-5	CS/C=C/C1=CC=CC=C1	{40: 1, 1: 1, 14: 5, 6: 2}
Did not match all atoms present	3583-05-9	CC(CC1=CC(=C(C=C1)O)O)N	{1: 1, 2: 1, 3: 1, 14: 3, 21: 2, 30: 1}
Did not match all atoms present	3583-64-0	CCCCC(C(=O)N(C1=CC=CC=C1)NC2=CC=CC=C2)C(=O)O	{1: 1, 2: 3, 3: 1, 33: 1, 14: 10, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	3584-66-5	C1=CC2=C(C=C1Cl)NC(=N2)C(Cl)(Cl)Cl	{32: 1, 17: 4, 35: 1, 4: 1, 14: 3}
Did not match all atoms present	35840-78-9	CN(C)C(=S)C(=S)N(C)C	{1: 4, 33: 2, 7: 2}
Did not match all atoms present	35843-88-0	CC(=C)C1=CC(=CC=C1)N(C)C	{1: 3, 33: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	35846-53-8	C[C@@H]1[C@@H]2C[C@]([C@@H](/C=C/C=C(/CC3=CC(=C(C(=C3)OC)Cl)N(C(=O)C[C@@H]([C@]4([C@H]1O4)C)OC(=O)[C@H](C)N(C)C(=O)C)C)\C)OC)(NC(=O)O2)O	{32: 1, 1: 9, 3: 1, 33: 2, 11: 3, 12: 5, 13: 2, 14: 5, 15: 1, 17: 1, 20: 1, 22: 2, 23: 1, 24: 1, 25: 1, 28: 2}
Did not match all atoms present	35849-41-3	C1=CC(=CC=C1CC(C(=O)O)NC=O)N(CCCl)CCCl	{33: 1, 2: 5, 3: 1, 14: 4, 17: 2, 26: 1, 27: 1, 31: 1}
Did not match all atoms present	3585-33-9	[Li+].C[N-]C	{1: 2, 34: 1}
Did not match all atoms present	3585-88-4	CC(C)(C)[N+](=CC1=CC=C(C=C1)[N+](=O)[O-])[O-]	{1: 3, 4: 1, 38: 1, 6: 1, 33: 1, 14: 4, 29: 1}
Did not match all atoms present	3585-93-1	COC1=CC=C(C=C1)C=[N+](C2=CC=CC=C2)[O-]	{1: 1, 6: 1, 33: 1, 14: 9, 22: 1, 29: 1}
Did not match all atoms present	35850-29-4	C1=CC(=CC=C1S(=O)C2=CC(=C(C=C2Cl)Cl)Cl)Cl	{17: 4, 29: 1, 14: 6}
Did not match all atoms present	35853-41-9	C1=CC2=C(C(=C1)C(F)(F)F)NC(=CC2=O)C(F)(F)F	{16: 6, 25: 1, 4: 2, 14: 4, 32: 1}
Did not match all atoms present	3586-12-7	C1=CC=C(C=C1)OC2=CC=CC(=C2)N	{30: 1, 22: 1, 14: 9}
Did not match all atoms present	3586-14-9	CC1=CC(=CC=C1)OC2=CC=CC=C2	{1: 1, 22: 1, 14: 9}
Did not match all atoms present	3586-69-4	C1=CC=C2C=C3C=C(C=CC3=CC2=C1)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	3586-84-3	C1CC[C@H]([C@@H](C1)C(=O)C2=CC=CC=C2)C(=O)O	{24: 1, 27: 1, 11: 4, 12: 2, 14: 5}
Did not match all atoms present	35860-37-8	CC(C)C1=CC=CC2=C(C=C(C=C21)C(C)C)C(C)C	{1: 6, 3: 3, 14: 5}
Did not match all atoms present	35869-74-0	CC1=NN=C(N1O)C	{1: 2, 35: 2, 21: 1, 33: 1}
Did not match all atoms present	3587-60-8	C1=CC=C(C=C1)COCCl	{17: 1, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	35873-40-6	CCCCC1=NC2=C(N1)C(=O)N(C(=O)N2C)C	{32: 1, 1: 3, 2: 3, 35: 1, 33: 2, 25: 2}
Did not match all atoms present	35873-41-7	CCCCCC1=NC2=C(N1)C(=O)N(C(=O)N2C)C	{32: 1, 1: 3, 2: 4, 35: 1, 33: 2, 25: 2}
Did not match all atoms present	35873-43-9	CCCCCCCC1=NC2=C(N1)C(=O)N(C(=O)N2C)C	{32: 1, 1: 3, 2: 6, 35: 1, 33: 2, 25: 2}
Did not match all atoms present	3588-63-4	CC(C)C(C(=O)O)NC(=O)OCC1=CC=CC=C1	{1: 2, 2: 1, 3: 2, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	35884-66-3	CC1=CC=C(C=C1)OP(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C.CC1=CC=C(C=C1)OP(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C.CC1=CC=C(C=C1)OP(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C.CC1=CC=C(C=C1)OP(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C.[Ni]	{1: 12, 22: 12, 14: 48}
Did not match all atoms present	35888-63-2	C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)[O-])N=C=S)S(=O)(=O)[O-].[Na+].[Na+]	{8: 1, 34: 1, 29: 6, 14: 5}
Did not match all atoms present	3589-21-7	CC(CN1C2=CC=CC=C2CCC3=CC=CC=C31)CN(C)C.Cl	{1: 3, 2: 2, 3: 1, 33: 2, 11: 2, 14: 8, 17: 1}
Did not match all atoms present	3589-58-0	CCOC(=O)CNC1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	3589-72-8	CC1=NC=CC2=C1NC3=C2C=C(C=C3)OC	{32: 1, 1: 2, 35: 1, 22: 1, 14: 5}
Did not match all atoms present	35897-82-6	COC1=C2C(=O)C=CC3=CC=CC(=C32)C=C1	{1: 1, 22: 1, 14: 7, 25: 1}
Did not match all atoms present	359-18-2	B(N(C)C)(F)F	{16: 2, 1: 2, 33: 1}
Did not match all atoms present	359-53-5	C(F)(F)(F)[As](C(F)(F)F)Cl	{16: 6, 17: 1, 4: 2}
Did not match all atoms present	359-64-8	C(F)(F)(F)P(C(F)(F)F)I	{16: 6, 19: 1, 4: 2}
Did not match all atoms present	359-65-9	C(F)(F)(F)P(C(F)(F)F)O	{16: 6, 20: 1, 4: 2}
Did not match all atoms present	359-83-1	C[C@@H]1[C@H]2CC3=C([C@@]1(CCN2CC=C(C)C)C)C=C(C=C3)O	{1: 4, 2: 1, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	3590-16-7	CCN(CC)CC(CN(CC)CC)C(C1CCCCC1)C2=CC=CC=C2	{1: 4, 2: 6, 3: 2, 33: 2, 11: 5, 12: 1, 14: 5}
Did not match all atoms present	3590-52-1	C1=CC(=CC=C1N=O)N(CCO)CCO	{33: 1, 2: 4, 34: 1, 14: 4, 20: 2, 29: 1}
Did not match all atoms present	3590-83-8	CCCCCC[Sn](CCCCCC)(CCCCCC)CCCCCC	{1: 4, 2: 20}
Did not match all atoms present	3590-84-9	CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)CCCCCCCC	{1: 4, 2: 28}
Did not match all atoms present	3590-93-0	COC1=CC(=CC(=C1O)OC)[C@H]2[C@@H]3[C@@H](CC4=CC5=C(C=C24)OCO5)COC3=O	{1: 2, 11: 3, 12: 3, 14: 4, 21: 1, 22: 2, 23: 2, 28: 1}
Did not match all atoms present	35906-51-5	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@H]7[C@@H]([C@@H](O6)C)O[C@H]8[C@@H](O7)CC(=O)[C@@H](O8)C)N(C)C)O	{1: 7, 2: 1, 33: 1, 11: 4, 12: 13, 13: 1, 14: 3, 20: 1, 21: 3, 22: 2, 23: 5, 25: 3, 28: 1}
Did not match all atoms present	3591-42-2	CC1(CC1(Cl)Cl)C2=CC=CC=C2	{1: 1, 11: 1, 13: 2, 14: 5, 17: 2}
Did not match all atoms present	3592-12-9	CC1(COC(=O)OC1)C	{1: 2, 11: 2, 13: 1}
Did not match all atoms present	35920-39-9	CCNC(=O)[C@@H]1[C@H]([C@H](C(O1)N2C=NC3=C2N=CN=C3N)O)O	{1: 1, 2: 1, 35: 3, 33: 1, 12: 4, 14: 2, 20: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	35923-79-6	C(=NC1=C(C(=C(C(=C1F)F)F)F)F)=S	{8: 1, 16: 5, 34: 1}
Did not match all atoms present	3593-24-6	CCCC[N+](CCC)(CCC)CCC.[I-]	{1: 4, 2: 9, 19: 1}
Did not match all atoms present	3593-75-7	C1=CSC2=C1SC3=C2SC=C3	{41: 3, 14: 4}
Did not match all atoms present	35933-93-8	CC1=CC2=C(C=C1)OC3=C(C24C5=CC=CC=C5C(=O)O4)C=CC(=C3)NC6CCCCC6	{1: 1, 11: 5, 12: 1, 13: 1, 14: 10, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	3594-37-4	CC(=O)CC(=O)C1=CN=CC=C1	{24: 2, 1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	3594-55-6	C1=CC(=CC=C1[O-])S(=O)(=O)C2=CC=C(C=C2)[O-].[Na+].[Na+]	{29: 2, 14: 8}
Did not match all atoms present	35940-77-3	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=CC=CC5=C4C(=O)C6=C(C5=O)C(=CC=C6)N)N	{25: 4, 30: 2, 14: 12, 31: 1}
Did not match all atoms present	35941-65-2	CC(CC1C2=CC=CC=C2CCC3=CC=CC=C13)CN(C)C	{1: 3, 2: 2, 3: 1, 33: 1, 11: 2, 12: 1, 14: 8}
Did not match all atoms present	35941-71-0	C1CN(CCN1CCO)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O.Cl	{33: 3, 2: 3, 41: 1, 11: 4, 14: 3, 17: 2, 20: 1, 24: 1, 25: 1}
Did not match all atoms present	35942-95-1	C1=COC(=C1)CCO	{2: 2, 20: 1, 14: 3, 23: 1}
Did not match all atoms present	35943-35-2	CN1C2=NC=NC3=C2C(=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)C(=N1)N	{1: 1, 2: 1, 35: 3, 33: 2, 12: 4, 14: 2, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	35944-73-1	C1CC(CC1S(=O)(=O)F)S(=O)(=O)F	{16: 2, 11: 3, 12: 2, 29: 4}
Did not match all atoms present	35944-74-2	CC(C1=CC=CC=C1)N2C=NC=C2C(=O)OC.Cl	{1: 2, 3: 1, 33: 1, 14: 7, 17: 1, 35: 1, 28: 1}
Did not match all atoms present	35944-83-3	CC(C)NP(=S)(O)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 3: 1, 14: 2, 17: 3, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	35944-84-4	CC(C)OP(=S)(NC)O	{1: 3, 3: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	35945-15-4	CCNC1=C(C=CC(=C1)OCC)OCC	{1: 3, 2: 3, 22: 2, 14: 3, 31: 1}
Did not match all atoms present	35945-16-5	CCN(CC)C1=C(C=CC(=C1)OCC)OCC	{1: 4, 2: 4, 22: 2, 14: 3, 33: 1}
Did not match all atoms present	35946-91-9	CC(C)C1=CC(=C(C=C1)C(C)C)O	{1: 4, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	35947-07-0	C(C(=O)[O-])N.C(C(=O)[O-])N.[Ca+2]	{24: 2, 2: 2, 30: 2}
Did not match all atoms present	35947-10-5	CC1CNCCN1C2=CC=CC(=C2)C	{32: 1, 1: 2, 33: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	35947-11-6	CC1CNCCN1C2=CC=C(C=C2)C	{32: 1, 1: 2, 33: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	35947-12-7	CC1CNCCN1C2=CC=C(C=C2)OC	{32: 1, 1: 2, 33: 1, 11: 3, 12: 1, 14: 4, 22: 1}
Did not match all atoms present	35948-25-5	C1=CC=C2C(=C1)C3=CC=CC=C3[P+](=O)O2	{29: 1, 14: 8, 23: 1}
Did not match all atoms present	35948-27-7	C1=CC=C(C=C1)OP2C3=CC=CC=C3C4=CC=CC=C4O2	{22: 1, 14: 13, 23: 1}
Did not match all atoms present	35950-55-1	C1=C(OC(=C1)Br)/C=C(\[N+](=O)[O-])/Br	{6: 1, 38: 1, 7: 1, 14: 2, 18: 2, 23: 1}
Did not match all atoms present	35958-30-6	CC(C1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)O)C2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)O	{1: 13, 3: 1, 4: 4, 21: 2, 14: 4}
Did not match all atoms present	35966-84-8	CNC1=C(C=CC(=C1)Cl)[N+](=O)[O-]	{1: 1, 31: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	35966-97-3	C1CCC(C1)N2C=NC3=C2N=CN(C3=N)O	{33: 2, 35: 2, 36: 1, 11: 4, 12: 1, 14: 2, 21: 1}
Did not match all atoms present	35967-24-9	COC1=CC(=CC(=C1OC)OC)N=C=S	{8: 1, 1: 3, 34: 1, 22: 3, 14: 2}
Did not match all atoms present	35967-28-3	CN(C)N=NC1=CC=CC=C1C(=O)OC	{1: 3, 34: 2, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	3597-20-4	C1=CC(=CC=C1C[NH+](CCCl)CCCl)Cl.[Cl-]	{17: 4, 2: 5, 14: 4}
Did not match all atoms present	3597-21-5	CC1=CC=C(C=C1)C[NH+](CCCl)CCCl.[Cl-]	{1: 1, 2: 5, 14: 4, 17: 3}
Did not match all atoms present	3597-91-9	C1=CC=C(C=C1)C2=CC=C(C=C2)CO	{2: 1, 20: 1, 14: 9}
Did not match all atoms present	35973-14-9	C1=CC2=C(C=C1Cl)C(=O)C(=CN2)C(=O)O	{32: 1, 17: 1, 27: 1, 14: 4, 25: 1}
Did not match all atoms present	35975-00-9	C1=CC2=C(C=CC(=C2N)[N+](=O)[O-])N=C1	{38: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	35976-48-8	CCN1C(=CC(=O)C2=CC=CC=C2)SC3=C1C4=CC=CC=C4C=C3	{1: 1, 2: 1, 6: 1, 33: 1, 41: 1, 14: 11, 15: 1, 24: 1}
Did not match all atoms present	35976-76-2	[1H]C(=O)OCC	{1: 1, 2: 1, 26: 1}
Did not match all atoms present	3598-14-9	C1=CC=C(C=C1)OCC#N	{2: 1, 22: 1, 14: 5, 37: 1}
Did not match all atoms present	3598-16-1	C1=CC=C(C=C1)OCC(=O)[O-].[Na+]	{24: 1, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	3598-30-9	C1=CC(=C(C=C1C2=CC(=C(C=C2)O)O)O)O	{21: 4, 14: 6}
Did not match all atoms present	3598-66-1	C#CCOC1=C(C=CC=C1Cl)Cl	{2: 1, 9: 1, 10: 1, 14: 3, 17: 2, 22: 1}
Did not match all atoms present	3599-20-0	C1=CC2=C3C(=C(C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])C=CC4=C3C1=CC5=C4N=C6C(=C(C7=NC8=C(C=C9C=CC1=C2C9=C8C=CC2=C(C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])OC7=C6Cl)Cl)O5.[Na+].[Na+].[Na+].[Na+]	{17: 2, 35: 2, 29: 12, 14: 12, 23: 2}
Did not match all atoms present	3599-28-8	C1=CC(=CC=C1NC2=NC(=NC(=N2)N)N)[As](=O)([O-])[O-].[Na+].[Na+]	{30: 2, 35: 3, 29: 3, 14: 4, 31: 1}
Did not match all atoms present	3599-32-4	CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])C=CC=CC=CC=C4C(C5=C(N4CCCCS(=O)(=O)[O-])C=CC6=CC=CC=C65)(C)C)C.[Na+]	{1: 4, 2: 8, 6: 7, 33: 2, 13: 2, 14: 12, 15: 2, 29: 6}
Did not match all atoms present	35991-93-6	C1=CC=C2C(=C1)C=CC=C2OCC(C/C(=N/O)/[NH3+])O.[Cl-]	{2: 2, 3: 1, 7: 1, 34: 1, 14: 7, 17: 1, 20: 2, 22: 1}
Did not match all atoms present	35998-29-9	C1=CC=C(C(=C1)CN(CCN(CC2=CC=CC=C2O)CC(=O)O)CC(=O)O)O	{33: 2, 2: 6, 27: 2, 21: 2, 14: 8}
Did not match all atoms present	360-11-2	C1=CC=C(C=C1)C(C2=CC=CC=C2)(F)F	{16: 2, 4: 1, 14: 10}
Did not match all atoms present	360-56-5	C(F)(F)(F)[As](C(F)(F)F)[As](C(F)(F)F)C(F)(F)F	{16: 12, 4: 4}
Did not match all atoms present	360-64-5	C1=CC=C(C(=C1)C(=O)N)C(F)(F)F	{16: 3, 24: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	360-91-8	C1(=C(SS1)C(F)(F)F)C(F)(F)F	{16: 6, 41: 2, 4: 2}
Did not match all atoms present	360-97-4	C1=NC(=C(N1)C(=O)N)N	{24: 1, 32: 1, 35: 1, 30: 2, 14: 1}
Did not match all atoms present	3600-86-0	COC1=CC(=C(C=C1)OC)CCN	{1: 2, 2: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	36001-88-4	CC1=CC(=C(C=C1)OP(=S)(NC(C)C)OC)[N+](=O)[O-]	{1: 4, 3: 1, 38: 1, 14: 3, 22: 2, 31: 1}
Did not match all atoms present	36007-20-2	[CH3-].C[C-]1[C-]([C-]([C-]([C-]1C)C)C)C.CC1=C(C(=C([C-]1[CH2-])C)C)C.[Ti]	{1: 9, 5: 1}
Did not match all atoms present	36011-19-5	CC1CC=CC2C3C(O3)(C(C4C2(C(=O)NC4CC5=CC=CC=C5)OC(=O)OC=CC(C1=O)(C)O)C)C	{32: 1, 1: 4, 2: 1, 11: 1, 12: 6, 13: 3, 14: 9, 20: 1, 23: 1, 25: 2}
Did not match all atoms present	36015-19-7	C1=CC(=C(C=C1[N+](=O)[O-])C=CC(=O)O)Cl	{38: 1, 17: 1, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	36015-91-5	CCCC(=O)CC(=O)C.CCCC(=O)CC(=O)C.[Cu]	{24: 4, 1: 4, 2: 6}
Did not match all atoms present	36018-09-4	CC(C(=O)C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC(C)C(=O)C3=CC=CC=C3	{24: 4, 1: 2, 3: 2, 14: 14, 31: 2}
Did not match all atoms present	36031-66-0	CCNP(=O)(O)OC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2, 20: 1, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	36039-40-4	C1=CC(=O)C(=CC=C1N)N	{25: 1, 30: 2, 14: 4}
Did not match all atoms present	36047-17-3	CC1(CC(=CC(=O)C1)C2=CC=CC=C2)C	{1: 2, 11: 2, 13: 1, 14: 6, 15: 1, 25: 1}
Did not match all atoms present	36047-43-5	CCCCCCCCCOP(=O)(O)O	{1: 1, 2: 8, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	3605-01-4	C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=CC=N4	{33: 2, 2: 1, 35: 2, 11: 5, 14: 6, 23: 2}
Did not match all atoms present	3605-31-0	CC1(CCC2=C1C=C(C=C2)C(C)(C)C)C	{1: 5, 11: 2, 4: 1, 13: 1, 14: 3}
Did not match all atoms present	36055-83-1	CC(C)OP(N(C)C)N(C)C	{1: 6, 3: 1, 22: 1, 33: 2}
Did not match all atoms present	36058-28-3	[CH]=S	{}
Did not match all atoms present	36059-21-9	CC1=C(C(=C(C(=C1Br)Br)Br)Br)C	{1: 2, 18: 4}
Did not match all atoms present	3606-21-1	CC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OC	{1: 2, 38: 2, 22: 1, 14: 2}
Did not match all atoms present	36062-93-8	CC1=CC=C(C2=CC=CC=C12)C#N	{1: 1, 37: 1, 14: 6}
Did not match all atoms present	36063-07-7	COC(=O)C1=C(C(=C(C2=CC=CC=C21)C(=O)OC)C(=O)OC)C(=O)OC	{1: 4, 28: 4, 14: 4}
Did not match all atoms present	36063-64-6	C1CCC2=C(C3=CC=CC=C3N=C2CC1)C(=O)N4CCN(CC4)C5=CC=CC=C5	{24: 1, 33: 2, 11: 9, 14: 9, 35: 1}
Did not match all atoms present	3607-03-2	C[Si](C)(C)C(=P(C)(C)C)[Si](C)(C)C	{1: 9, 7: 1}
Did not match all atoms present	3607-04-3	C[Si](C)(C)C=[As](C)(C)C	{1: 6, 6: 1}
Did not match all atoms present	3607-17-8	C1=CC=C(C=C1)[P+](CCCBr)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{2: 3, 18: 2, 14: 15}
Did not match all atoms present	36073-00-4	C1=CC=C(C=C1)C(=O)CNC(=O)C2=CC=C(C=C2)C(=O)NCC(=O)C3=CC=CC=C3	{24: 4, 2: 2, 14: 14, 31: 2}
Did not match all atoms present	36076-25-2	COC(=O)CC1=CC=C(C=C1)CC(=O)OC	{1: 2, 2: 2, 28: 2, 14: 4}
Did not match all atoms present	3608-67-1	CN1CCC(CC1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{1: 1, 4: 1, 33: 1, 11: 4, 12: 1, 14: 10, 20: 1, 28: 1}
Did not match all atoms present	3608-75-1	C1=CC=NC(=C1)C=NNC(=S)N	{34: 1, 35: 1, 6: 1, 7: 1, 14: 4, 30: 1, 31: 1}
Did not match all atoms present	36082-50-5	C1=C(C(=NC(=N1)Cl)Cl)Br	{17: 2, 18: 1, 35: 2, 14: 1}
Did not match all atoms present	3609-53-8	CC(=O)C1=CC=C(C=C1)C(=O)OC	{24: 1, 1: 2, 28: 1, 14: 4}
Did not match all atoms present	36090-33-2	CCC1(CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N)C	{1: 2, 2: 1, 33: 1, 11: 2, 13: 1, 14: 4, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	361-09-1	CC(CCC(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[Na+]	{1: 3, 2: 2, 3: 1, 11: 7, 12: 8, 13: 2, 20: 3, 24: 1}
Did not match all atoms present	361-37-5	CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CN(C4=CC=CC(=C34)C2=C1)C)C	{1: 3, 2: 2, 3: 1, 33: 2, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	3610-02-4	C1=CC(=C2C=CSC2=C1)O	{41: 1, 21: 1, 14: 5}
Did not match all atoms present	3610-36-4	COC1=CC2=C(C=C1)C(=CN2)CCN	{32: 1, 1: 1, 2: 2, 14: 4, 22: 1, 30: 1}
Did not match all atoms present	36100-40-0	CN(C)C1=C[N+](=CC=C1)[O-]	{1: 2, 29: 1, 14: 4, 33: 2}
Did not match all atoms present	36104-80-0	CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)OC(=O)N(C)C)C3=CC=CC=C3	{1: 3, 35: 1, 33: 2, 12: 1, 14: 8, 15: 1, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	36105-20-1	CCN(CC)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F.Cl	{1: 2, 2: 4, 35: 1, 33: 2, 11: 1, 14: 7, 15: 1, 16: 1, 17: 2, 25: 1}
Did not match all atoms present	36116-25-3	CCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC(=CC3=C2N(NN3C)C)Cl.COS(=O)(=O)[O-]	{32: 1, 1: 4, 2: 3, 37: 1, 33: 3, 34: 2, 14: 6, 17: 1, 22: 1, 29: 3}
Did not match all atoms present	36116-28-6	CCN(CCC#N)C1=CC(=C(C=C1)N=NC2=C(C=CC(=C2)[N+](C)(C)C)Cl)C.[Cl-]	{1: 5, 2: 3, 37: 1, 33: 1, 34: 2, 14: 6, 17: 2}
Did not match all atoms present	36116-31-1	CCN(CCO)C1=CC(=C(C=C1)N=NC2=C3C(=C(C=C2)Cl)[N+](=CN3C)C)C.[Cl-]	{1: 4, 2: 3, 33: 3, 34: 2, 14: 6, 17: 2, 20: 1}
Did not match all atoms present	36116-84-4	CC(C)CCCCCO[P+](=O)OCCCCCC(C)C	{1: 4, 2: 10, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	3612-20-2	C1CN(CCC1=O)CC2=CC=CC=C2	{25: 1, 2: 1, 11: 4, 14: 5, 33: 1}
Did not match all atoms present	36121-95-6	[O-].[O].[O].[Sb]	{}
Did not match all atoms present	36122-35-7	C1=CC=C(C=C1)C2=CC(=O)OC2=O	{28: 2, 14: 6, 15: 1}
Did not match all atoms present	3613-42-1	C1=CC=C(C=C1)CC2=C3C=CC=CC3=C(C4=CC=CC=C42)CC5=CC=CC=C5	{2: 2, 14: 18}
Did not match all atoms present	3613-73-8	CC1=CC2=C(C=C1)N(C3=C2CN(CC3)C)CCC4=CN=C(C=C4)C	{1: 3, 2: 2, 35: 1, 33: 2, 11: 3, 14: 6}
Did not match all atoms present	3613-97-6	CCN(CC)C(=O)COC1=CC=CC=C1	{1: 2, 2: 3, 33: 1, 14: 5, 22: 1, 24: 1}
Did not match all atoms present	36133-73-0	[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[W]	{}
Did not match all atoms present	36133-88-7	CC(=O)NCC1=NC(=NO1)C2=CC=C(O2)[N+](=O)[O-]	{1: 1, 2: 1, 35: 2, 38: 1, 14: 2, 23: 2, 24: 1, 31: 1}
Did not match all atoms present	36136-05-7	CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(C1=CC=C(C=C1)[N+](=O)[O-])O	{1: 1, 2: 17, 3: 2, 38: 1, 14: 4, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	3614-57-1	CC[C@H](C1=CC=CC=C1)[C@H](C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)OCCN4CCCC4	{1: 1, 2: 3, 3: 2, 33: 1, 11: 4, 14: 14, 22: 1, 24: 1}
Did not match all atoms present	3614-69-5	CC(C1=CC=CC=N1)C2=C(CC3=CC=CC=C32)CCN(C)C.C(=C\C(=O)O)\C(=O)O	{1: 3, 2: 2, 3: 1, 6: 2, 33: 1, 11: 1, 14: 8, 15: 2, 35: 1, 27: 2}
Did not match all atoms present	36148-59-1	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)[N+](C)(C)C.[Zn+2]	{1: 7, 15: 2, 33: 2, 14: 12, 7: 1}
Did not match all atoms present	36148-80-8	CN(CCCOS(=O)(=O)C)CCCOS(=O)(=O)C.C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 3, 2: 6, 33: 1, 14: 8, 20: 2, 22: 2, 29: 8}
Did not match all atoms present	3615-21-2	C1=CC(=C(C2=C1NC(=N2)C(F)(F)F)Cl)Cl	{32: 1, 35: 1, 4: 1, 14: 2, 16: 3, 17: 2}
Did not match all atoms present	3615-24-5	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(C)C	{1: 4, 3: 1, 33: 2, 14: 5, 25: 1, 31: 1}
Did not match all atoms present	36157-40-1	CC(=O)C1=C(SC(=C1)Cl)Cl	{24: 1, 1: 1, 41: 1, 14: 1, 17: 2}
Did not match all atoms present	36167-63-2	CCCCN(CCCC)CCC(C1=C2C=CC(=CC2=C3C=C(C=C(C3=C1)Cl)Cl)C(F)(F)F)O.Cl	{1: 2, 2: 8, 3: 1, 4: 1, 33: 1, 14: 6, 16: 3, 17: 3, 20: 1}
Did not match all atoms present	36169-16-1	CCCC[S-].CCCC[S-].[Sn+2]	{1: 2, 2: 6}
Did not match all atoms present	36170-25-9	CC(C)C1=CC(=CC(=C(C1=O)O)C[NH+]2CCOCC2)C[NH+]3CCOCC3.[Cl-].[Cl-]	{1: 2, 2: 2, 3: 1, 11: 8, 14: 2, 17: 2, 21: 1, 23: 2, 25: 1}
Did not match all atoms present	36176-31-5	CC(C)C1=CC=CC=C1N=C=S	{8: 1, 1: 2, 34: 1, 3: 1, 14: 4}
Did not match all atoms present	3618-58-4	C1=CC=C2C(=C1)C=CC(=C2N/N=C\3/C4=C(C=C(C=C4)[N+](=O)[O-])C(=CC3=O)S(=O)(=O)[O-])O.[Na+]	{34: 1, 38: 1, 14: 10, 15: 2, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	3618-62-0	C1=CC(=O)/C(=N/NC2=CC(=C(C=C2N)N)S(=O)(=O)[O-])/C=C1[N+](=O)[O-].[Na+]	{34: 1, 38: 1, 14: 5, 15: 2, 25: 1, 29: 3, 30: 2, 31: 1}
Did not match all atoms present	3618-65-3	CCOC1=C(C=C(C(=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C)N(CCOC(=O)C)CCOC(=O)C	{1: 4, 2: 5, 38: 2, 33: 1, 34: 2, 14: 5, 22: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	36189-45-4	C1=CC=C2C(=C1)C3=C4C(=C(C=C3)I)C=CC=C4C2=O	{25: 1, 19: 1, 14: 9}
Did not match all atoms present	3619-22-5	CC1=CC=C(C=C1)C(=O)NN	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	36190-62-2	CC(C)CN(CC(C)C)C(=S)[S-].CC(C)CN(CC(C)C)C(=S)[S-].[Zn+2]	{1: 8, 2: 4, 3: 4, 33: 2, 7: 2}
Did not match all atoms present	36190-75-7	CCCNC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 2, 14: 7, 31: 1}
Did not match all atoms present	36192-63-9	CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2N	{24: 1, 1: 1, 30: 1, 14: 8}
Did not match all atoms present	36195-56-9	C/C=C/CSC1=CC=CC=C1	{40: 1, 1: 1, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	36198-58-0	C[As](=S)(C)C1=CC=CC=C1	{1: 2, 14: 5}
Did not match all atoms present	36198-81-9	CC(C)C(=O)C1=CC=C(C2=CC=CC=C21)OC	{24: 1, 1: 3, 3: 1, 22: 1, 14: 6}
Did not match all atoms present	36198-87-5	COP(OC)O[Si](C)(C)C	{1: 5, 22: 3}
Did not match all atoms present	362-02-7	C[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.[I-]	{1: 3, 2: 3, 33: 1, 41: 1, 14: 7, 17: 1, 19: 1}
Did not match all atoms present	362-05-0	CC12CCC3C(C1CCC2O)CCC4=CC(=C(C=C34)O)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 2, 20: 1, 21: 2}
Did not match all atoms present	362-06-1	CC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)O)O	{1: 1, 11: 6, 12: 3, 13: 1, 14: 2, 21: 2, 25: 1}
Did not match all atoms present	362-07-2	CC12CCC3C(C1CCC2O)CCC4=CC(=C(C=C34)OC)O	{1: 2, 11: 6, 12: 4, 13: 1, 14: 2, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	362-29-8	CCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CC(C)N(C)C	{1: 4, 2: 2, 3: 1, 33: 2, 41: 1, 14: 7, 24: 1}
Did not match all atoms present	362-74-3	CCCC(=O)NC1=NC=NC2=C1N=CN2C3C(C4C(O3)COP(=O)(O4)O)OC(=O)CCC	{1: 2, 2: 4, 35: 3, 33: 1, 11: 1, 12: 4, 14: 2, 20: 1, 23: 3, 24: 1, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	362-75-4	CC1(O[C@H]2[C@@H](O[C@@H](C2O1)CO)N3C=NC4=C3N=CN=C4N)C	{1: 2, 2: 1, 35: 3, 33: 1, 12: 4, 13: 1, 14: 2, 20: 1, 23: 3, 30: 1}
Did not match all atoms present	36207-13-3	CCC1=CC=C(C=C1)C(=O)OCC	{1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	36209-71-9	CC(CC1=CC2=C(C=C1)OCO2)NC(=O)C	{1: 2, 2: 1, 3: 1, 11: 1, 14: 3, 23: 2, 24: 1, 31: 1}
Did not match all atoms present	3622-23-9	C1=CC2=C(C=C1Cl)SC(=N2)Cl	{17: 2, 35: 1, 14: 3, 41: 1}
Did not match all atoms present	3622-84-2	CCCCNS(=O)(=O)C1=CC=CC=C1	{1: 1, 2: 3, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	36226-32-1	C1=CC(=CN=C1)CNC(=O)N	{2: 1, 35: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	36226-64-9	CCC1(C(=O)NC(=O)NC1=O)CC2=CC=CC=C2	{32: 2, 1: 1, 2: 2, 13: 1, 14: 5, 25: 3}
Did not match all atoms present	36230-20-3	C1=CC=C2C=CC=C3C2=C4C3=CC=CC4=C1	{14: 10}
Did not match all atoms present	36230-21-4	C=CC1=CC=CC2=C3C=CC=C(C3=C21)C=C	{14: 6, 5: 2, 6: 2}
Did not match all atoms present	36231-67-1	CCN(CC)C1=C([P+](=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)N(CC)CC)C4=CC=CC=C4	{1: 4, 2: 4, 14: 16, 33: 2}
Did not match all atoms present	36232-89-0	C(C(C(C(C(=O)[O-])O)O)O)O.[K+]	{24: 1, 2: 1, 3: 3, 20: 4}
Did not match all atoms present	36238-99-0	CC(C)OP(C1=CC=CC=C1)OC(C)C	{1: 4, 3: 2, 22: 2, 14: 5}
Did not match all atoms present	3624-87-1	CCCCOC1=C(C=CC=C1N)C(=O)OCCN(CC)CC	{1: 3, 2: 7, 33: 1, 14: 3, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	3624-90-6	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2N	{1: 1, 30: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	36253-76-6	CCCC[Sn+](CCCC)CCCC.CC[O-]	{1: 4, 2: 10, 29: 1}
Did not match all atoms present	36258-87-4	C1=CN=C2C(=C1N)N=NS2	{41: 1, 35: 3, 30: 1, 14: 2}
Did not match all atoms present	36259-37-7	CCCCCN(CCCCC)C(=S)[S-].CCCCCN(CCCCC)C(=S)[S-].[Ni+2]	{1: 4, 2: 16, 33: 2, 7: 2}
Did not match all atoms present	3626-28-6	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)C5=CC=C(C=C5)NN=C6C=CC(=O)C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 4, 14: 19, 15: 3, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	3626-30-0	C1=CC(=CC=C1N)N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C5C=C(C=CC5=C(C=C4)N/N=C/6\C7=C(C=CC6=O)C=C(C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 5, 14: 19, 15: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	3626-94-6	COC1=CC=CC(=C1O)C=CC(=O)O	{1: 1, 6: 2, 14: 3, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	36263-51-1	COC1=CC=C(C=C1)C2(CCCCC2)C#N	{1: 1, 37: 1, 11: 5, 13: 1, 14: 4, 22: 1}
Did not match all atoms present	36264-19-4	C1=CC=C2C(=C1)SS(=O)S2	{41: 2, 29: 1, 14: 4}
Did not match all atoms present	36266-38-3	CC(CC1=CC(=C(C(=C1)OC)OC)OC)N2CC2	{1: 4, 2: 1, 3: 1, 33: 1, 11: 2, 14: 2, 22: 3}
Did not match all atoms present	36268-65-2	CCC(C)(C)C1=CC(=C(C=C1)OCCCC#N)C(C)(C)CC	{1: 6, 2: 5, 4: 2, 37: 1, 14: 3, 22: 1}
Did not match all atoms present	3627-49-4	CCOC(=O)C1(CCN(CC1)CCC(C2=CC=CC=C2)O)C3=CC=CC=C3.Cl	{1: 1, 2: 3, 3: 1, 33: 1, 11: 4, 13: 1, 14: 10, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	36273-11-7	C1C[N+]2(CCN1CC2)CCl.[Cl-]	{17: 2, 2: 1, 11: 6, 33: 1}
Did not match all atoms present	36275-66-8	C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].[Na+].[Na+]	{17: 2, 25: 2, 15: 4}
Did not match all atoms present	36283-44-0	C[C@H](C1=CC=CC=C1)NC(=O)C	{24: 1, 1: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	36294-21-0	C1=CC=C2C=C(C=CC2=C1)[O-].[K+]	{14: 7}
Did not match all atoms present	36299-64-6	C1C[C@H]([C@H](C[C@@H]1C2=CC=CC=C2)C(=O)[O-])C(=O)[O-]	{24: 2, 11: 3, 12: 3, 14: 5}
Did not match all atoms present	363-02-0	C1=CC(=CC=C1C(=NO)C2=CC=C(C=C2)F)F	{16: 2, 34: 1, 20: 1, 14: 8, 7: 1}
Did not match all atoms present	363-03-1	C1=CC=C(C=C1)C2=CC(=O)C=CC2=O	{25: 2, 14: 8, 15: 1}
Did not match all atoms present	363-13-3	C1=CC=C(C=C1)CN2C3=CC=CC=CC3=NC2=O	{25: 1, 2: 1, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	363-17-7	C1C2=CC=CC=C2C3=C1C=C(C=C3)NC(=O)C(F)(F)F	{4: 1, 11: 1, 14: 7, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	363-20-2	CCN(CC)C(=O)CNC(=O)C1=CC(=C(C(=C1)OC)OC)OC	{1: 5, 2: 3, 33: 1, 14: 2, 22: 3, 24: 2, 31: 1}
Did not match all atoms present	363-42-8	CC1=C(C(=CC=C1)C)OC(C)C[N+](C)(C)C.O.[Cl-]	{1: 6, 2: 1, 3: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	363-49-5	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)O	{1: 1, 11: 1, 14: 6, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	363-51-9	C1=CC(=C(C(=C1)Cl)N)F	{16: 1, 17: 1, 30: 1, 14: 3}
Did not match all atoms present	363-52-0	C1=CC(=C(C(=C1)F)O)O	{16: 1, 21: 2, 14: 3}
Did not match all atoms present	363-64-4	CC1=C(C(=C(C(=C1F)C)F)C)F	{16: 3, 1: 3}
Did not match all atoms present	363-72-4	C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 14: 1}
Did not match all atoms present	363-73-5	C1=C(C(=C(C(=C1F)F)F)N)F	{16: 4, 30: 1, 14: 1}
Did not match all atoms present	363-81-5	C1=C(C=C(C(=C1F)N)F)F	{16: 3, 30: 1, 14: 2}
Did not match all atoms present	363-84-8	CCN(CC)P(F)F	{16: 2, 1: 2, 2: 2, 33: 1}
Did not match all atoms present	36304-84-4	CC1=CC2=C(C[C@H]3[C@@H]4[C@]2(CCCC4)CCN3C)C=C1.OP(=O)(O)O	{1: 2, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 20: 3, 29: 1}
Did not match all atoms present	36305-05-2	COC1=C(C=CC(=C1)NC2=CC=CC=C2)[N+]#N.[O-]S(=O)(=O)[O-]	{1: 1, 34: 1, 14: 8, 22: 1, 29: 4, 31: 1}
Did not match all atoms present	36315-01-2	COC1=CC(=NC(=N1)N)OC	{1: 2, 30: 1, 35: 2, 22: 2, 14: 1}
Did not match all atoms present	36316-69-5	CC1=C(C=NC=C1)C.Cl	{1: 2, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	36318-56-6	CC1=CC=CC=C1NC2=NCCN2	{32: 1, 1: 1, 35: 1, 11: 2, 14: 4, 15: 1, 31: 1}
Did not match all atoms present	36318-77-1	CCC(C)(C1=CC=CC=C1)C(Cl)Cl	{1: 2, 2: 1, 3: 1, 4: 1, 14: 5, 17: 2}
Did not match all atoms present	3632-91-5	C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Mg+2]	{24: 1, 2: 1, 3: 4, 20: 5}
Did not match all atoms present	36322-90-4	CN1C(=C(C2=CC=CC=C2S1(=O)=O)O)C(=O)NC3=CC=CC=N3	{1: 1, 35: 1, 33: 1, 14: 8, 15: 2, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	36323-28-1	C1=CC(=CC(=C1)C(Br)Br)C(Br)Br	{18: 4, 3: 2, 14: 4}
Did not match all atoms present	36330-05-9	CC(C)CC1=CN=C(C=N1)OC	{1: 3, 2: 1, 3: 1, 14: 2, 35: 2, 22: 1}
Did not match all atoms present	36330-85-5	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCC(=O)O	{24: 1, 2: 2, 27: 1, 14: 9}
Did not match all atoms present	36333-79-6	C1C[C-]2CCC1C2.C1C[C-]2CCC1C2.C1C[C-]2CCC1C2.C1C[C-]2CCC1C2.[Mn]	{11: 20, 12: 4, 15: 4}
Did not match all atoms present	36335-67-8	CCC(C)NP(=S)(OCC)OC1=C(C=CC(=C1)C)[N+](=O)[O-]	{1: 4, 2: 2, 3: 1, 38: 1, 14: 3, 22: 2, 31: 1}
Did not match all atoms present	36339-04-5	CC(=O)NC1=CC(=C(C=C1)OC)NCCC(=O)OCCOC	{1: 3, 2: 4, 14: 3, 22: 2, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	36339-47-6	CC1=CC(=C(C=C1SC2=CC(=C(C=C2C)OP(OC3=C(C=C(C(=C3)C)SC4=CC(=C(C=C4C)O)C(C)(C)C)C(C)(C)C)OC5=C(C=C(C(=C5)C)SC6=CC(=C(C=C6C)O)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)O	{1: 24, 4: 6, 40: 3, 14: 12, 21: 3, 22: 3}
Did not match all atoms present	3634-47-7	CCCCC[Ge](CCCCC)(CCCCC)CCCCC	{1: 4, 2: 16}
Did not match all atoms present	3634-56-8	CC(C)[Si](C)(C)Cl	{1: 4, 3: 1, 17: 1}
Did not match all atoms present	3634-59-1	CCCCCC[Si](C)(C)Cl	{1: 3, 2: 5, 17: 1}
Did not match all atoms present	3634-67-1	CCCCCC[Si](CCCCCC)(CCCCCC)Cl	{1: 3, 2: 15, 17: 1}
Did not match all atoms present	3634-83-1	C1=CC(=CC(=C1)CN=C=O)CN=C=O	{8: 2, 2: 2, 34: 2, 29: 2, 14: 4}
Did not match all atoms present	36346-97-1	[Be+2].[CH-]1C=CC=C1.[Cl-]	{17: 1, 14: 5}
Did not match all atoms present	3635-74-3	CC(=O)NC1=CC=C(C=C1)C(=O)O.CN(C)CCO	{1: 3, 2: 2, 33: 1, 14: 4, 20: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	36350-95-5	C1CO[Si]2(OCCN1CCO2)CNC3=CC=CC=C3	{33: 1, 2: 1, 11: 6, 14: 5, 23: 3, 31: 1}
Did not match all atoms present	36351-95-8	[Be+2].[CH3-].[CH-]1C=CC=C1	{14: 5}
Did not match all atoms present	36357-38-7	CC1=NC=C(C=C1)C(=O)C	{24: 1, 1: 2, 35: 1, 14: 3}
Did not match all atoms present	36366-90-2	CCC[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N(C)C)N(C)C	{1: 5, 2: 2, 14: 7, 33: 3}
Did not match all atoms present	36366-93-5	C1=CC=C(C=C1)OCCOCCOCCOCCO	{2: 8, 20: 1, 22: 4, 14: 5}
Did not match all atoms present	36368-30-6	C1=CC=C(C=C1)N/N=C/2\C(=O)C=CC3=CC4=CC=CC=C4C=C32	{25: 1, 34: 1, 31: 1, 14: 13, 15: 1}
Did not match all atoms present	3637-01-2	CC1=C(C=C(C=C1)C(=O)C)C	{24: 1, 1: 3, 14: 3}
Did not match all atoms present	36377-59-0	CCOC1=C(C=C(C=C1)CCN)OC	{1: 2, 2: 3, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	36377-94-3	[I-].[I-].[Dy]	{19: 2}
Did not match all atoms present	3638-73-1	C1=CC(=C(C=C1Br)N)Br	{18: 2, 30: 1, 14: 3}
Did not match all atoms present	36389-86-3	CCCCCCCCCCCCCCCCCCN(C(C)C)C(=S)SSC(=S)N(CCCCCCCCCCCCCCCCCC)C(C)C	{1: 6, 2: 34, 3: 2, 33: 2, 40: 2, 7: 2}
Did not match all atoms present	3639-66-5	CCC12CCN(C(C1C)CC3=C2C=C(C=C3)O)CC=C(C)C	{1: 4, 2: 2, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	36393-56-3	CC(C(C1=CC=CC=C1)O)N	{1: 1, 3: 2, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	36398-39-7	C1CCC#CC2=CC=CC=C2C3=CC=CC=C3C#CC1	{10: 4, 11: 4, 14: 8}
Did not match all atoms present	364-13-6	C1=CC(=C(C=C1N)C(F)(F)F)N	{16: 3, 4: 1, 30: 2, 14: 3}
Did not match all atoms present	364-32-9	C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])F	{16: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	364-62-5	CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Cl	{1: 3, 2: 4, 33: 1, 14: 2, 17: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	364-74-9	C1=CC(=C(C=C1F)[N+](=O)[O-])F	{16: 2, 38: 1, 14: 3}
Did not match all atoms present	364-76-1	C1=CC(=C(C=C1N)[N+](=O)[O-])F	{16: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	364-78-3	C1=CC(=C(C=C1F)[N+](=O)[O-])N	{16: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	364-83-0	CC(=O)C1=C(C=C(C=C1)F)F	{16: 2, 1: 1, 14: 3, 24: 1}
Did not match all atoms present	364-98-7	CC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)Cl	{32: 1, 1: 1, 35: 1, 14: 3, 15: 1, 17: 1, 29: 2}
Did not match all atoms present	36404-30-5	COC1=CC(=C(C=C1)Cl)Cl	{1: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	36405-17-1	CCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N	{1: 1, 34: 1, 37: 1, 6: 1, 2: 3, 14: 8, 22: 1}
Did not match all atoms present	3641-13-2	C1(=NC(=NN1)N)C(=O)O	{32: 1, 35: 2, 27: 1, 30: 1}
Did not match all atoms present	3641-14-3	COC(=O)C1=NC(=NN1)N	{32: 1, 1: 1, 35: 2, 28: 1, 30: 1}
Did not match all atoms present	36410-81-8	CC1(CC(CC(N1[O])(C)C)N=C=S)C	{1: 4, 34: 1, 33: 1, 8: 1, 11: 2, 12: 1, 13: 2, 29: 1}
Did not match all atoms present	36412-26-7	C1=CC=C(C=C1)CC2=CSN=C2	{41: 1, 2: 1, 35: 1, 14: 7}
Did not match all atoms present	36415-21-1	C1=COC(=C1)CSCCN	{40: 1, 2: 3, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	36417-16-0	C1=CC=C2C(=C1)C(=C(C(=O)C2=O)CC=C(Cl)Cl)O	{2: 1, 6: 1, 7: 1, 14: 4, 15: 2, 17: 2, 20: 1, 25: 2}
Did not match all atoms present	36422-95-4	[B-](F)(F)(F)F.CC1=C(C=CC(=C1)[N+]#N)N2CCCC2	{1: 1, 34: 1, 33: 1, 11: 4, 14: 3, 16: 4}
Did not match all atoms present	36429-11-5	C=P	{5: 1}
Did not match all atoms present	3643-70-7	C1C2(COP(O1)Cl)COP(OC2)Cl	{17: 2, 11: 4, 13: 1, 23: 4}
Did not match all atoms present	36432-42-5	CCCCCCCC[Sn](=S)S[Sn](=S)CCCCCCCC	{40: 1, 1: 2, 2: 14}
Did not match all atoms present	36436-65-4	CC1=C(C=C(C(=C1)C(=O)C)O)C	{24: 1, 1: 3, 21: 1, 14: 2}
Did not match all atoms present	36437-36-2	CCCC(NC(=O)C1=C(C2=CC=CC=C2C=C1)O)OC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 4, 3: 1, 4: 2, 14: 9, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	36437-64-6	CCN1C2=C(C=C(C=C2)OC)SC1=CC=CC=CC3=[N+](C4=C(S3)C=C(C=C4)OC)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 2, 6: 5, 33: 2, 41: 2, 14: 10, 15: 1, 22: 2, 29: 3}
Did not match all atoms present	36438-51-4	CCN(CC)C1=C(C=C(C(=C1[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]	{1: 2, 2: 2, 4: 1, 38: 2, 33: 1, 14: 1, 16: 3, 17: 1}
Did not match all atoms present	3644-32-4	CCCC[Sn](CCCC)(CCCC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 2: 9, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	3644-37-9	CCCC[Sn](CCCC)(CCCC)OC1=CC=CC=C1C2=CC=CC=C2	{1: 3, 2: 9, 22: 1, 14: 9}
Did not match all atoms present	3644-61-9	CC1=CC=C(C=C1)C(=O)C(C)CN2CCCCC2.Cl	{1: 2, 2: 1, 3: 1, 33: 1, 11: 5, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	36441-31-3	C1=CC=C(C=C1)CC2=C(C=CC3=CC=CC=C32)O	{2: 1, 21: 1, 14: 11}
Did not match all atoms present	36441-32-4	C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3C=C2)O	{2: 1, 21: 1, 14: 11}
Did not match all atoms present	36443-68-2	CC1=C(C(=CC(=C1)CCC(=O)OCCOCCOCCOC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C)C(C)(C)C)O	{1: 8, 2: 10, 4: 2, 14: 4, 21: 2, 22: 2, 28: 2}
Did not match all atoms present	36448-60-9	CC(C)C(=O)C1=CC=CS1	{24: 1, 1: 2, 3: 1, 14: 3, 41: 1}
Did not match all atoms present	3645-00-9	COC(=O)C1=CC=C(C=C1)C(=O)OCCO	{1: 1, 2: 2, 20: 1, 14: 4, 28: 2}
Did not match all atoms present	3645-34-9	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ti+4]	{24: 4, 1: 8, 2: 16, 3: 4}
Did not match all atoms present	3645-61-2	C1=CC=C(C=C1)C2=CC=C(C=C2)[O-].[Na+]	{14: 9}
Did not match all atoms present	36452-21-8	C1(=NC(=NC(=O)N1)[O-])[O-].[Na+].[Na+]	{32: 1, 25: 1, 35: 2}
Did not match all atoms present	36452-23-0	C1CCC(=O)N(CC1)SC2=CC=CC=C2	{40: 1, 25: 1, 11: 5, 14: 5, 33: 1}
Did not match all atoms present	36452-66-1	CCCCCCCCCCCCSCCC(=O)[O-].CCCCCCCCCCCCSCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 26, 40: 2}
Did not match all atoms present	36457-20-2	CCCCOC(=O)C1=CC=C(C=C1)[O-].[Na+]	{1: 1, 2: 3, 28: 1, 14: 4}
Did not match all atoms present	36457-58-6	C1=CC=C(C=C1)CNS(=O)(=O)C(F)(F)F	{2: 1, 4: 1, 14: 5, 16: 3, 29: 2, 31: 1}
Did not match all atoms present	3646-57-9	C1=CC(=CC=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{34: 2, 38: 2, 14: 8}
Did not match all atoms present	3646-61-5	C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=NC4=C2C=C(C=C4)Cl)C5=CC=CC=C5	{17: 2, 35: 2, 14: 16, 15: 2}
Did not match all atoms present	3647-17-4	COC1=CC=C(C=C1)NC(=O)N2CC2	{1: 1, 33: 1, 11: 2, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	3647-19-6	C1CN1C(=O)NC2=CC(=CC=C2)Cl	{33: 1, 11: 2, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	3647-48-1	C1=NC2=NC(=S)NC(=C2N1)N	{32: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	3647-71-0	C1=CC=C(C=C1)CCNCC2=CC=CC=C2	{2: 3, 14: 10, 31: 1}
Did not match all atoms present	36474-85-8	C1=CC=C2C(=C1)C=C3C4=CC5=CC=CC=C5C6=C4C(=CC7=CC=CC=C76)C8=CC9=CC=CC=C9C2=C38	{14: 20}
Did not match all atoms present	36476-29-6	CC1=CC(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)CO)O)O)NC(=O)C	{1: 2, 2: 1, 12: 5, 14: 4, 20: 3, 22: 1, 23: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	3648-18-8	CCCCCCCCCCCC(=O)O[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)CCCCCCCCCCC	{1: 4, 2: 34, 28: 2}
Did not match all atoms present	3648-20-2	CCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCC	{1: 2, 2: 20, 28: 2, 14: 4}
Did not match all atoms present	3648-21-3	CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCC	{1: 2, 2: 12, 28: 2, 14: 4}
Did not match all atoms present	3648-36-0	CC1(C2=CC=CC=C2[N+](=C1/C=C/C3=CC=C(C=C3)N(C)CCCl)C)C.[Cl-]	{1: 4, 2: 2, 6: 2, 33: 2, 13: 1, 14: 8, 15: 1, 17: 2}
Did not match all atoms present	36480-40-7	C1=CC(=C(C=C1CS)Cl)Cl	{17: 2, 2: 1, 14: 3, 39: 1}
Did not match all atoms present	3649-39-6	C1=CC=C(C=C1)CN2C=NC(=O)C3=C2N=CN3	{32: 1, 33: 1, 2: 1, 35: 2, 14: 7, 25: 1}
Did not match all atoms present	36499-65-7	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Co+2].[Co+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	365-07-1	CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)O)O	{32: 1, 1: 1, 2: 1, 33: 1, 11: 1, 12: 3, 14: 1, 20: 3, 22: 1, 23: 1, 25: 2, 29: 1}
Did not match all atoms present	365-24-2	C1=CC(=CC=C1C(C2=CC=C(C=C2)F)O)F	{16: 2, 3: 1, 20: 1, 14: 8}
Did not match all atoms present	365-26-4	CC(C(C1=CC=C(C=C1)O)O)NC	{1: 2, 3: 2, 14: 4, 20: 1, 21: 1, 31: 1}
Did not match all atoms present	365-34-4	C1=CC=C(C(=C1)C(F)(F)F)NN	{16: 3, 4: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	36502-09-7	O.O.O.O.[PbH].[PbH].[PbH].[PbH]	{}
Did not match all atoms present	36503-55-6	CCOC1=CC=C(C=C1)NC(=O)N(C)C	{1: 3, 2: 1, 33: 1, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	36504-65-1	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC6C5O6)C=C2	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	36504-66-2	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C6C(O6)C=C5)C=C2	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	36504-67-3	C1CC2=C(C=C3C=CC4=C5C3=C2C=CC5=CC=C4)C6C1O6	{11: 2, 12: 2, 14: 8, 23: 1}
Did not match all atoms present	36504-68-4	C1CC2=C(C3C1O3)C4=C5C(=C2)C=CC6=C5C(=CC=C6)C=C4	{11: 2, 12: 2, 14: 8, 23: 1}
Did not match all atoms present	36505-84-7	C1CCC2(C1)CC(=O)N(C(=O)C2)CCCCN3CCN(CC3)C4=NC=CC=N4	{33: 3, 2: 4, 35: 2, 11: 10, 13: 1, 14: 3, 25: 2}
Did not match all atoms present	36508-71-1	CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(/C(=N/NC(=O)C6=CC=CC=C6)/C)O)N)O.Cl	{1: 3, 34: 1, 7: 1, 11: 3, 12: 5, 13: 1, 14: 8, 17: 1, 20: 2, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	36508-80-2	CN1C(CCC1=O)C2=C[N+](=CC=C2)[O-]	{1: 1, 33: 2, 11: 2, 12: 1, 14: 4, 25: 1, 29: 1}
Did not match all atoms present	3651-02-3	C1=CC=C(C=C1)N/N=C/2\C=CC(=O)C3=CC=CC=C23	{25: 1, 34: 1, 31: 1, 14: 11, 15: 1}
Did not match all atoms present	3651-23-8	C=CC[Si](CC=C)(Cl)Cl	{17: 2, 2: 2, 5: 2, 6: 2}
Did not match all atoms present	3651-62-5	CC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O	{24: 1, 1: 1, 21: 1, 14: 10, 31: 1}
Did not match all atoms present	36516-81-1	C1=CC=C(C=C1)C2=C3C(=C(S2)C4=CC=CC=C4)C(=S=C3C5=CC=CC=C5)C6=CC=CC=C6	{41: 2, 14: 20, 15: 2}
Did not match all atoms present	36518-74-8	CCCOC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 1, 2: 2, 22: 1, 17: 5}
Did not match all atoms present	36519-31-0	CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O.CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O.OS(=O)(=O)O	{1: 6, 2: 4, 3: 2, 4: 2, 14: 6, 20: 6, 21: 2, 29: 2, 31: 2}
Did not match all atoms present	3652-91-3	CC1=CC2=C(C=C1)C3=CC=CC=C3N2	{32: 1, 1: 1, 14: 7}
Did not match all atoms present	36525-03-8	C1=CC=C(C=C1)/C=C/[Hg]Cl	{17: 1, 14: 5, 6: 2}
Did not match all atoms present	36525-74-3	C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)[O-])N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)S(=O)(=O)[O-])N.[Na+].[Na+]	{34: 1, 14: 12, 15: 2, 24: 1, 25: 1, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	36528-80-0	CCN1C2=CC=CC=C2SC1=CC3=CC(=CC=CC=CC4=[N+](C5=CC=CC=C5S4)CC)CC(C3)(C)C.[I-]	{1: 4, 2: 2, 6: 6, 33: 2, 41: 2, 11: 2, 13: 1, 14: 9, 15: 3, 19: 1}
Did not match all atoms present	36536-22-8	CC1(C2=CC=CC=C2[N+](=C1C=CC=CC=C3C(C4=CC=CC=C4N3C)(C)C)C)C.[I-]	{1: 6, 6: 5, 33: 2, 13: 2, 14: 8, 15: 2, 19: 1}
Did not match all atoms present	3655-88-7	CN1CN(CSC1=S)CC(=O)O	{1: 1, 2: 1, 33: 2, 41: 1, 11: 2, 15: 1, 27: 1}
Did not match all atoms present	36551-21-0	CCC(C)OC(=S)[S-].[Na+]	{1: 2, 2: 1, 3: 1, 22: 1, 7: 1}
Did not match all atoms present	36554-90-2	C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[In+3]	{16: 9, 24: 3, 4: 3}
Did not match all atoms present	36556-06-6	C1CCC2=C(C1)C=CN=C2	{35: 1, 11: 4, 14: 3}
Did not match all atoms present	36556-33-9	C1=C(C=C(C(=C1Cl)F)Cl)Cl	{16: 1, 17: 3, 14: 2}
Did not match all atoms present	36556-36-2	C1=CC(=C(C(=C1F)Cl)Cl)Cl	{16: 1, 17: 3, 14: 2}
Did not match all atoms present	36556-37-3	C1=CC(=C(C(=C1F)Cl)F)Cl	{16: 2, 17: 2, 14: 2}
Did not match all atoms present	36556-39-5	C1=CC(=C(C(=C1F)F)Cl)Cl	{16: 2, 17: 2, 14: 2}
Did not match all atoms present	36556-42-0	C1=CC(=C(C(=C1F)F)F)Cl	{16: 3, 17: 1, 14: 2}
Did not match all atoms present	36556-50-0	C1=CC(=C(C(=C1)Cl)Cl)F	{16: 1, 17: 2, 14: 3}
Did not match all atoms present	36556-54-4	C1=CC(=C(C(=C1F)Cl)Cl)F	{16: 2, 17: 2, 14: 2}
Did not match all atoms present	36556-56-6	C1=C(C=C(C(=C1F)N)Cl)F	{16: 2, 17: 1, 30: 1, 14: 2}
Did not match all atoms present	36556-75-9	CC1=C2C=CC(=O)OC2=C(C=C1)OCC(CNC(C)(C)C)O.Cl	{1: 4, 2: 2, 3: 1, 4: 1, 14: 4, 17: 1, 20: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	36559-22-5	C1=CC(=C(C(=C1)Cl)Cl)C2=C(C=C(C=C2)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	36567-72-3	C1=CC=C(C=C1)[C@H](CC(=O)O)O	{27: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	36576-14-4	CC(C)NCC(COC1=CC=CC2=C1C=CC2)O.Cl	{1: 2, 2: 2, 3: 2, 11: 1, 14: 5, 17: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	36576-23-5	CC1=C(C=CC(=C1C)N=NC2=CC=CC=C2)N	{1: 2, 34: 2, 30: 1, 14: 7}
Did not match all atoms present	36576-70-2	[B-](F)(F)(F)F.COC1=C(C=CC(=C1)[N+]#N)N2CCCC2	{1: 1, 34: 1, 33: 1, 11: 4, 14: 3, 16: 4, 22: 1}
Did not match all atoms present	36579-71-2	C1=CC2=C3C(=C1)[Se][Se]C3=CC=C2	{14: 6}
Did not match all atoms present	3658-48-8	CCCCC(CC)CO[P+](=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	3658-62-6	C(=O)(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O.N	{16: 17, 27: 1, 4: 8}
Did not match all atoms present	36586-31-9	C1=CC(=CC=C1C(=O)NNC2=CC=C(C=C2)Cl)Cl	{24: 1, 17: 2, 14: 8, 31: 2}
Did not match all atoms present	36588-31-5	CCCCCCCCCOC1=CC=CC=C1	{1: 1, 2: 8, 22: 1, 14: 5}
Did not match all atoms present	36589-61-4	C(CCS(=O)(=O)[O-])CS(=O)(=O)[O-].[Na+].[Na+]	{2: 4, 29: 6}
Did not match all atoms present	36596-36-8	C1=CC2=C(C=C1N/N=C/3\C(=O)C4=C(C=C3S(=O)(=O)O)C=C(C=C4)NC(=O)NC5=CC6=C(C(=O)/C(=N\NC7=CC8=C(C=C(C=C8)S(=O)(=O)O)C=C7)/C(=C6)S(=O)(=O)O)C=C5)C=CC(=C2)S(=O)(=O)O.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO	{33: 4, 2: 24, 34: 2, 14: 20, 15: 4, 20: 16, 24: 1, 25: 2, 29: 8, 31: 4}
Did not match all atoms present	36596-67-5	CCOC(=O)C1=C(C=CC=C1C)C	{1: 3, 2: 1, 28: 1, 14: 3}
Did not match all atoms present	366-18-7	C1=CC=NC(=C1)C2=CC=CC=N2	{35: 2, 14: 8}
Did not match all atoms present	366-29-0	CN(C)C1=CC=C(C=C1)C2=CC=C(C=C2)N(C)C	{1: 4, 14: 8, 33: 2}
Did not match all atoms present	366-70-1	CC(C)NC(=O)C1=CC=C(C=C1)CNNC.Cl	{1: 3, 2: 1, 3: 1, 14: 4, 17: 1, 24: 1, 31: 3}
Did not match all atoms present	366-77-8	C1=CC(=CC=C1C(=O)CCC(=O)O)F	{16: 1, 24: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	366-93-8	C1CC(CCC1CNCC2=CC=CC=C2Cl)CNCC3=CC=CC=C3Cl.Cl.Cl	{2: 4, 11: 4, 12: 2, 14: 8, 17: 4, 31: 2}
Did not match all atoms present	366-99-4	COC1=C(C=C(C=C1)N)F	{16: 1, 1: 1, 30: 1, 22: 1, 14: 3}
Did not match all atoms present	36608-07-8	C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.[Mo]#[Mo]	{16: 12, 27: 4, 4: 4}
Did not match all atoms present	36614-38-7	CC(C)SCCSP(=S)(OC)OC	{40: 2, 1: 4, 2: 2, 3: 1, 22: 2}
Did not match all atoms present	3662-78-0	COC(=O)C1=CC=C(C=C1)N=C=S	{8: 1, 1: 1, 34: 1, 28: 1, 14: 4}
Did not match all atoms present	36626-52-5	C1=CC=C(C=C1)C(CCOC=O)OC=O	{2: 2, 3: 1, 26: 2, 14: 5}
Did not match all atoms present	36629-42-2	COC(=O)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 1, 28: 1}
Did not match all atoms present	3663-23-8	CCCCC1=CC(=C(C=C1)N)N	{1: 1, 2: 3, 30: 2, 14: 3}
Did not match all atoms present	3663-34-1	CCC1=CC=C(C=C1)NC(=O)C	{24: 1, 1: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	3663-35-2	CCC1=CC(=C(C=C1)N)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	3663-42-1	C[Si](C)(CCCCN)O[Si](C)(C)CCCCN	{1: 4, 2: 8, 30: 2, 22: 1}
Did not match all atoms present	3663-43-2	CO[Si](C)(C)CCCCN	{1: 3, 2: 4, 30: 1, 22: 1}
Did not match all atoms present	3663-50-1	C[Si](C)(O)O[Si](C)(C)O[Si](C)(C)O	{1: 6, 20: 2, 22: 2}
Did not match all atoms present	3663-82-9	C1C(OC2=CC=CC=C2O1)CO	{2: 1, 11: 1, 12: 1, 14: 4, 20: 1, 23: 2}
Did not match all atoms present	3663-99-8	CCCCCCCCCCSCC(C[N+](C)(C)C)O.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 11, 3: 1, 40: 1, 14: 4, 20: 1, 29: 3}
Did not match all atoms present	36635-61-7	CC1=CC=C(C=C1)S(=O)(=O)C[N+]#[C-]	{1: 1, 2: 1, 34: 1, 29: 2, 14: 4}
Did not match all atoms present	36637-18-0	CCCN(CC)C(CC)C(=O)NC1=C(C=CC=C1C)C	{1: 5, 2: 4, 3: 1, 33: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	3665-51-8	C1=CC=C2C=C(C(=CC2=C1)C(=O)N)O	{24: 1, 30: 1, 21: 1, 14: 6}
Did not match all atoms present	3665-80-3	CCNC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	3666-67-9	C1CC[NH2+]C(C1)C2COC(O2)(CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-]	{2: 2, 11: 5, 12: 2, 13: 1, 14: 10, 17: 1, 23: 2}
Did not match all atoms present	3666-69-1	C1CCNC(C1)C2COC(O2)(C3=CC=CC=C3)C4=CC=CC=C4.Cl	{32: 1, 11: 5, 12: 2, 13: 1, 14: 10, 17: 1, 23: 2}
Did not match all atoms present	36663-75-9	CC(C)C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)[N+](=O)[O-]	{1: 2, 3: 1, 38: 2, 14: 2, 17: 1}
Did not match all atoms present	36670-42-5	O.[La]	{}
Did not match all atoms present	36670-43-6	O.[Pr]	{}
Did not match all atoms present	36670-44-7	O.[Nd]	{}
Did not match all atoms present	36670-46-9	O.[Eu+2]	{}
Did not match all atoms present	36678-76-9	C[As](C)CC1=CC=CC=C1	{1: 2, 2: 1, 14: 5}
Did not match all atoms present	36685-97-9	CCCCCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 9, 28: 1, 14: 5}
Did not match all atoms present	3669-32-7	C1=CC=C(C=C1)/C=C/C(=O)NO	{24: 1, 20: 1, 14: 5, 6: 2, 31: 1}
Did not match all atoms present	3669-41-8	C1=CC=C(C=C1)CC(=O)C2=C(C=C(C=C2)O)O	{24: 1, 2: 1, 21: 2, 14: 8}
Did not match all atoms present	36692-49-6	COC(=O)C1=CC(=C(C=C1)N)N	{1: 1, 28: 1, 30: 2, 14: 3}
Did not match all atoms present	367-11-3	C1=CC=C(C(=C1)F)F	{16: 2, 14: 4}
Did not match all atoms present	367-12-4	C1=CC=C(C(=C1)O)F	{16: 1, 21: 1, 14: 4}
Did not match all atoms present	367-21-5	C1=CC(=C(C=C1N)Cl)F	{16: 1, 17: 1, 30: 1, 14: 3}
Did not match all atoms present	367-23-7	C1=CC(=C(C=C1F)F)F	{16: 3, 14: 3}
Did not match all atoms present	367-24-8	C1=CC(=C(C=C1Br)F)N	{16: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	367-25-9	C1=CC(=C(C=C1F)F)N	{16: 2, 30: 1, 14: 3}
Did not match all atoms present	367-27-1	C1=CC(=C(C=C1F)F)O	{16: 2, 21: 1, 14: 3}
Did not match all atoms present	367-29-3	CC1=C(C=C(C=C1)F)N	{16: 1, 1: 1, 30: 1, 14: 3}
Did not match all atoms present	367-30-6	C1=CC(=C(C=C1F)N)F	{16: 2, 30: 1, 14: 3}
Did not match all atoms present	367-34-0	C1=C(C(=CC(=C1F)F)F)N	{16: 3, 30: 1, 14: 2}
Did not match all atoms present	367-44-2	CC[Al](CC)F	{16: 1, 1: 2, 2: 2}
Did not match all atoms present	367-45-3	B(CC)(CC)F	{16: 1, 1: 2, 2: 2}
Did not match all atoms present	367-46-4	B(OC)(OC)F	{16: 1, 1: 2, 22: 2}
Did not match all atoms present	367-51-1	C(C(=O)[O-])S.[Na+]	{24: 1, 2: 1, 39: 1}
Did not match all atoms present	367-67-9	C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)Br	{16: 3, 18: 1, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	367-86-2	C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])F	{16: 4, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	3670-09-5	C1=CC=C(C=C1)CC(=NNC(=S)N)C2=CC=NC=C2	{34: 1, 35: 1, 7: 2, 2: 1, 14: 9, 30: 1, 31: 1}
Did not match all atoms present	36700-77-3	[2H][N+]([2H])([2H])[2H].C(#N)[S-]	{37: 1}
Did not match all atoms present	36701-01-6	CCCCC(=O)OCC1=CC=CO1	{1: 1, 2: 4, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	3671-00-9	CN1CCC(C1)C2=CNC3=CC=CC=C32	{32: 1, 1: 1, 33: 1, 11: 3, 12: 1, 14: 5}
Did not match all atoms present	3671-18-9	C1=C(C=C2C(=C1[N+](=O)[O-])N=C(N2)C(F)(F)F)Cl	{32: 1, 35: 1, 4: 1, 38: 1, 14: 2, 16: 3, 17: 1}
Did not match all atoms present	3671-61-2	C1=CC2=C(C=C1C#N)NC(=N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 37: 1, 14: 3, 16: 3}
Did not match all atoms present	3671-65-6	COC1=CC2=C(C=C1)N=C(N2)C(F)(F)F	{32: 1, 1: 1, 35: 1, 4: 1, 14: 3, 16: 3, 22: 1}
Did not match all atoms present	3671-71-4	C1C2=CC=CC=C2C3=C1C=C(C=C3)N(C(=O)C4=CC=CC=C4)O	{24: 1, 33: 1, 11: 1, 20: 1, 14: 12}
Did not match all atoms present	3671-78-1	C1C2=CC=CC=C2C3=C1C=C(C=C3)NC(=O)C4=CC=CC=C4	{24: 1, 11: 1, 14: 12, 31: 1}
Did not match all atoms present	36711-31-6	C(C(CBr)Br)OP(=O)([O-])OCC(CBr)Br.C(C(CBr)Br)OP(=O)([O-])OCC(CBr)Br.[Mg+2]	{2: 8, 3: 4, 18: 8, 22: 4, 29: 4}
Did not match all atoms present	3672-47-7	COC1=CC=C(C=C1)C(=O)CC#N	{1: 1, 2: 1, 37: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	36724-43-3	C(CS(=O)(=O)COCS(=O)(=O)CCO)O	{2: 6, 20: 2, 29: 4, 22: 1}
Did not match all atoms present	36732-55-5	[H+].[H+].[H+].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Ir+3]	{17: 6}
Did not match all atoms present	36734-19-7	CC(C)NC(=O)N1CC(=O)N(C1=O)C2=CC(=CC(=C2)Cl)Cl	{1: 2, 3: 1, 33: 2, 11: 1, 14: 3, 17: 2, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	3674-65-5	CC1=C(C=C2C(=C1)C=CC3=CC=CC=C32)C	{1: 2, 14: 8}
Did not match all atoms present	3674-66-6	CC1=CC2=C(C=C1)C3=C(C=CC=C3C)C=C2	{1: 2, 14: 8}
Did not match all atoms present	3674-69-9	CC1=CC=CC2=C1C3=C(C=CC=C3C)C=C2	{1: 2, 14: 8}
Did not match all atoms present	3674-72-4	CCCCCCCCCCCCC1=CC2=C(C=C1)C3=CC=CC=C3C=C2	{1: 1, 2: 11, 14: 9}
Did not match all atoms present	3674-73-5	CC1=CC=CC2=C1C3=CC(=C(C=C3C=C2)C)C	{1: 3, 14: 7}
Did not match all atoms present	3674-74-6	CCC1=CC2=C(C=C1)C3=CC=CC=C3C=C2	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	3674-75-7	CCC1=CC2=CC=CC=C2C3=CC=CC=C31	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	3674-77-9	CC1(OCCO1)C2=CC=CC=C2	{1: 1, 11: 2, 13: 1, 14: 5, 23: 2}
Did not match all atoms present	36747-51-0	C1=CC(=CC(=C1)C(Cl)Cl)C(=O)Cl	{24: 1, 17: 3, 3: 1, 14: 4}
Did not match all atoms present	36748-84-2	CCC(C)C(CO)C1=CC=CC=C1	{1: 2, 2: 2, 3: 2, 20: 1, 14: 5}
Did not match all atoms present	36753-03-4	[Br-].[Br-].[Br-].[Br-].[Re]	{18: 4}
Did not match all atoms present	36756-53-3	[Re+3]	{}
Did not match all atoms present	36756-65-7	[Tm+4]	{}
Did not match all atoms present	36756-79-3	CCC(C)N(C(C)CC)C(=O)SCC1=CC=CC=C1	{1: 4, 2: 3, 3: 2, 33: 1, 40: 1, 14: 5, 24: 1}
Did not match all atoms present	36759-10-1	[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)[O-])[O-])N=NC2=C(C3=C(C=CC(=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)[O-].[Cu+2]	{34: 2, 2: 2, 14: 6, 22: 1, 29: 11, 30: 1}
Did not match all atoms present	3676-85-5	C1=CC2=C(C=C1N)C(=O)NC2=O	{32: 1, 25: 2, 30: 1, 14: 3}
Did not match all atoms present	3676-91-3	CP(C)P(C)C	{1: 4}
Did not match all atoms present	3676-97-9	CP(=S)(C)P(=S)(C)C	{1: 4}
Did not match all atoms present	36760-43-7	CC(C)(C)OC(=O)SC1=CC=CC=C1	{40: 1, 1: 3, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	36761-83-8	C1CNP(=O)(OC1)NCCCl	{32: 1, 2: 2, 11: 3, 17: 1, 23: 1, 29: 1, 31: 1}
Did not match all atoms present	36764-94-0	C1=C(C=C(C(=C1Cl)N)C#N)Cl	{17: 2, 30: 1, 14: 2, 37: 1}
Did not match all atoms present	36765-01-2	C1=C(C=C(C(=C1Cl)N)C(=O)N)Cl	{24: 1, 17: 2, 30: 2, 14: 2}
Did not match all atoms present	36774-74-0	C1=CC=C(C=C1)C2=NC3=C(S2)C=CC(=C3)CC(=O)O	{35: 1, 2: 1, 27: 1, 14: 8, 41: 1}
Did not match all atoms present	36776-45-1	CC1=CC(=CC(=C1Br)OCC2=CC=CC=C2)OC	{1: 2, 2: 1, 22: 2, 18: 1, 14: 7}
Did not match all atoms present	3678-62-4	CC1=CC(=NC=C1)Cl	{1: 1, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	3678-70-4	C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=CC=N3	{35: 1, 3: 1, 14: 14}
Did not match all atoms present	3678-72-6	C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=NC=C3	{35: 1, 3: 1, 14: 14}
Did not match all atoms present	36783-03-6	CCN(CCCS(=O)(=O)O)C1=CC=CC(=C1)C	{1: 2, 2: 4, 33: 1, 14: 4, 20: 1, 29: 2}
Did not match all atoms present	36783-07-0	CCN(CC)C1=CC(=C(C=C1)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)NCCS(=O)(=O)O)Cl)C	{1: 3, 2: 4, 33: 1, 34: 2, 14: 5, 17: 2, 20: 1, 29: 4, 31: 1}
Did not match all atoms present	3679-63-8	C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)Cl)O	{24: 1, 17: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	36790-28-0	CCN(CCN(C)C)C1=CC=CC(=C1)C	{1: 4, 2: 3, 14: 4, 33: 2}
Did not match all atoms present	36791-04-5	C1=NC(=NN1C2C(C(C(O2)CO)O)O)C(=O)N	{33: 1, 2: 1, 35: 2, 12: 4, 14: 1, 20: 3, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	36798-79-5	CC(=CC(=NNC1=NN=CC2=CC=CC=C21)C)C	{1: 3, 34: 1, 35: 2, 6: 1, 7: 2, 14: 5, 31: 1}
Did not match all atoms present	368-16-1	CN1C=NC=C1C[C@@H](C(=O)O)N	{1: 1, 2: 1, 3: 1, 33: 1, 14: 2, 35: 1, 27: 1, 30: 1}
Did not match all atoms present	368-39-8	[B-](F)(F)(F)F.CC[O+](CC)CC	{16: 4, 1: 3, 2: 3}
Did not match all atoms present	368-43-4	C1=CC=C(C=C1)S(=O)(=O)F	{16: 1, 29: 2, 14: 5}
Did not match all atoms present	368-47-8	C1=CC=C(C=C1)[Si](F)(F)F	{16: 3, 14: 5}
Did not match all atoms present	368-48-9	C1=CC=NC(=C1)C(F)(F)F	{16: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	368-50-3	C1=CC(=CC(=C1)S(=O)(=O)F)N	{16: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	368-53-6	C1=C(C=C(C=C1N)N)C(F)(F)F	{16: 3, 4: 1, 30: 2, 14: 3}
Did not match all atoms present	368-54-7	C1=C(NC(=S)NC1=O)C(F)(F)F	{16: 3, 25: 1, 4: 1, 14: 1, 32: 2}
Did not match all atoms present	368-66-1	C1(=NC(=NC(=N1)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 9, 35: 3, 4: 3}
Did not match all atoms present	368-68-3	C1=CC(=C(C=C1[As](=O)(O)O)F)F	{16: 2, 20: 2, 29: 1, 14: 3}
Did not match all atoms present	368-71-8	C1=CC(=C(C=C1C(F)(F)F)N)N	{16: 3, 4: 1, 30: 2, 14: 3}
Did not match all atoms present	368-72-9	C1=CC(=C(C=C1S(=O)(=O)F)N)Cl	{16: 1, 17: 1, 30: 1, 29: 2, 14: 3}
Did not match all atoms present	368-77-4	C1=CC(=CC(=C1)C(F)(F)F)C#N	{16: 3, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	368-78-5	C1=CC(=CC(=C1)NN)C(F)(F)F	{16: 3, 4: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	368-88-7	C1=CC(=CC=C1F)S(=O)(=O)O	{16: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	368-90-1	C1=CC(=CC=C1C(F)(F)F)NN	{16: 3, 4: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	368-94-5	C1=CC(=CC=C1C(=O)F)C(F)(F)F	{16: 4, 24: 1, 4: 1, 14: 4}
Did not match all atoms present	368-97-8	C1=CC=C(C=C1)[As](F)F	{16: 2, 14: 5}
Did not match all atoms present	3680-02-2	CS(=O)(=O)C=C	{1: 1, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	36802-01-4	COC(=O)C1=CC=C(O1)CO	{1: 1, 2: 1, 14: 2, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	36809-75-3	CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].CC(C)(C)[O-].[Sn+4]	{1: 12, 4: 4, 29: 4}
Did not match all atoms present	3681-93-4	C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O	{2: 1, 12: 5, 14: 6, 20: 4, 21: 3, 23: 2, 25: 1}
Did not match all atoms present	36811-14-0	CN1C=C(N=N1)SC	{40: 1, 1: 2, 35: 2, 14: 1, 33: 1}
Did not match all atoms present	36812-31-4	[Ca+2].[OH-]	{}
Did not match all atoms present	36812-32-5	[OH-].[Sr+2]	{}
Did not match all atoms present	36818-89-0	CC(C)(C)/C(=C\C(=O)C(C)(C)C)/[O-].CC(C)(C)/C(=C/C(=O)C(C)(C)C)/[O-].[Ca+2]	{24: 2, 1: 12, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	3682-15-3	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)NNC2=O	{32: 2, 25: 2, 38: 1, 14: 3}
Did not match all atoms present	3682-32-4	C1=CC=C2C(=C1)C(=CC(=C2O)N=O)S(=O)(=O)O	{34: 1, 20: 1, 21: 1, 14: 5, 29: 3}
Did not match all atoms present	3682-35-7	C1=CC=NC(=C1)C2=NC(=NC(=N2)C3=CC=CC=N3)C4=CC=CC=N4	{35: 6, 14: 12}
Did not match all atoms present	36821-08-6	CC1=CC=CC2=C1SC3=CC4=CC=CC=C4C=C23	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	36823-84-4	CCCCCOC1=CC=C(C=C1)C(=O)Cl	{1: 1, 2: 4, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	36823-88-8	C1=CC(=CC=C1C(=O)Cl)OC(F)(F)F	{4: 1, 14: 4, 16: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	36825-36-2	C1=CC=C2C(=C1)C(=C(C=N2)Br)N	{18: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	3683-12-3	CC(=C)C(=O)OCCC1=CC=CC=C1	{1: 1, 2: 2, 5: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	36832-52-7	CC1=CC=C(C=C1)S(=O)(=O)CCC#C	{1: 1, 2: 2, 9: 1, 10: 1, 14: 4, 29: 2}
Did not match all atoms present	36835-58-2	[SiH3][SiH3]	{}
Did not match all atoms present	36840-25-2	[Fr]	{}
Did not match all atoms present	36847-86-6	C1=CC(=CC=C1NC(=O)C=CC(=O)O)Br	{6: 2, 14: 4, 18: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	3685-84-5	CN(C)CCOC(=O)COC1=CC=C(C=C1)Cl.Cl	{1: 2, 2: 3, 33: 1, 14: 4, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	36854-57-6	CCC(C1=CC=CC=C1)C(=O)Cl	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	3686-55-3	CCOC1=CC=CC=C1C(=O)OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	3686-58-6	CCN(CC)CC(=O)NC1=C(C=CC=C1C)C(=O)OC	{1: 4, 2: 3, 33: 1, 14: 3, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	3686-69-9	CCCOC1=CC=C(C=C1)C(=O)OCC[NH+]2CCCC2.[Cl-]	{1: 1, 2: 4, 11: 4, 14: 4, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	36867-70-6	CC1=C(C=CC(=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)O)N=NC4=CC=C(C=C4)S(=O)(=O)O	{1: 1, 34: 3, 14: 11, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	3687-13-6	CS(=O)(=O)OC1=C(C=C(C=C1)Cl)Cl	{1: 1, 29: 2, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	3687-18-1	C(CN)CS(=O)(=O)O	{2: 3, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	3687-31-8	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Pb+2].[Pb+2].[Pb+2]	{29: 8}
Did not match all atoms present	3687-61-4	CC(C)N(CC1=NN=CO1)C2CCCCC2	{1: 2, 2: 1, 3: 1, 33: 1, 11: 5, 12: 1, 14: 1, 35: 2, 23: 1}
Did not match all atoms present	3687-67-0	C1=CC2=C(C(=C1)Cl)C3=C(C=C2)C(=O)/C(=C\4/C(=O)C5=C(N4)C=CC(=C5)Br)/S3	{32: 1, 41: 1, 14: 8, 15: 2, 17: 1, 18: 1, 25: 2}
Did not match all atoms present	36878-91-8	CCOC(=O)CC(=O)C1=COC=C1	{1: 1, 2: 2, 14: 3, 23: 1, 24: 1, 28: 1}
Did not match all atoms present	3688-08-2	C(CN=C=S)N=C=S	{8: 2, 2: 2, 34: 2}
Did not match all atoms present	3688-11-7	C1=CC=C(C=C1)[Hg]OC2=CC=CC=C2O	{22: 1, 21: 1, 14: 9}
Did not match all atoms present	3688-35-5	C1=CC(=CC=C1CCC(C(=O)O)N)N(CCCl)CCCl	{33: 1, 2: 6, 3: 1, 14: 4, 17: 2, 27: 1, 30: 1}
Did not match all atoms present	3688-53-7	C1=COC(=C1)/C(=C/C2=CC=C(O2)[N+](=O)[O-])/C(=O)N	{38: 1, 6: 1, 7: 1, 14: 5, 23: 2, 24: 1, 30: 1}
Did not match all atoms present	3688-66-2	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)OC(=O)C6=CN=CC=C6	{1: 2, 35: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 8, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	3688-79-7	COC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC=C4C3=O	{1: 1, 22: 1, 14: 9, 25: 1}
Did not match all atoms present	3688-85-5	CNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NC	{1: 2, 14: 3, 17: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	36880-33-8	CCC1=CC=C(S1)C=O	{1: 1, 2: 1, 26: 1, 14: 2, 41: 1}
Did not match all atoms present	36882-13-0	N=[N]	{36: 1}
Did not match all atoms present	36882-17-4	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C(=O)[O-].[Na+]	{24: 1, 14: 14}
Did not match all atoms present	36885-29-7	CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.CC(/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)/[O-])(C)C.[Ca+2]	{1: 6, 4: 8, 6: 2, 7: 2, 16: 14, 24: 2}
Did not match all atoms present	36885-31-1	CC(C)(C)C(=CC(=O)C(C(C(F)(F)F)(F)F)(F)F)[O-].CC(C)(C)C(=CC(=O)C(C(C(F)(F)F)(F)F)(F)F)[O-].[Ba+2]	{1: 6, 4: 8, 6: 2, 7: 2, 16: 14, 24: 2}
Did not match all atoms present	36885-49-1	C=COP(=O)(O)O	{22: 1, 20: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	36886-76-7	COC1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)OC)C5=CC=CC=C5C(=O)O3	{1: 2, 13: 1, 14: 10, 22: 2, 23: 1, 28: 1}
Did not match all atoms present	36888-18-3	CC1=CC=CC=C1/C=C/C2=CC=CC=C2C	{1: 2, 14: 8, 6: 2}
Did not match all atoms present	36889-43-7	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)C(=S)N)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=C(C=C8)C(=S)N.[Cl-].[Cl-]	{1: 2, 35: 4, 33: 4, 38: 2, 7: 2, 14: 22, 17: 2, 22: 2, 30: 2}
Did not match all atoms present	3689-20-1	CC1=C(C=CC(=C1)OC)NC(=O)C2=CC3=CC=CC=C3C=C2O	{1: 2, 14: 9, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	3689-24-5	CCOP(=S)(OCC)OP(=S)(OCC)OCC	{1: 4, 2: 4, 22: 5}
Did not match all atoms present	3689-50-7	CC(CN1C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C31)CN(C)C	{1: 3, 2: 2, 3: 1, 33: 2, 14: 8, 29: 2}
Did not match all atoms present	3689-76-7	CC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)Cl	{1: 1, 2: 1, 35: 1, 33: 1, 14: 8, 17: 1}
Did not match all atoms present	36895-62-2	C=CC[N+]12CN3CN(C1)CN(C3)C2	{33: 3, 2: 1, 11: 6, 5: 1, 6: 1}
Did not match all atoms present	36897-37-7	O.[OH-].[OH-].[Ni+2]	{}
Did not match all atoms present	36898-42-7	C1=CC(=CC=C1N2C(=O)C=CC2=O)S(=O)(=O)Cl	{17: 1, 33: 1, 29: 2, 14: 6, 25: 2}
Did not match all atoms present	369-07-3	C1=CC=C(C(=C1)[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O	{2: 1, 38: 1, 12: 5, 14: 4, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	369-33-5	CC(=O)C1=CC(=C(C=C1)F)F	{16: 2, 1: 1, 14: 3, 24: 1}
Did not match all atoms present	369-34-6	C1=CC(=C(C=C1[N+](=O)[O-])F)F	{16: 2, 38: 1, 14: 3}
Did not match all atoms present	369-36-8	C1=CC(=C(C=C1[N+](=O)[O-])N)F	{16: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	369-54-0	C1=CC(=CC=C1C(F)F)C(F)F	{16: 4, 3: 2, 14: 4}
Did not match all atoms present	369-57-3	[B-](F)(F)(F)F.C1=CC=C(C=C1)[N+]#N	{16: 4, 34: 1, 14: 5}
Did not match all atoms present	369-58-4	C1=CC=C(C=C1)[N+]#N.F[P-](F)(F)(F)(F)F	{16: 6, 34: 1, 14: 5}
Did not match all atoms present	369-68-6	C1=CC(=CC(=C1)SC(F)(F)F)N	{16: 3, 40: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	369-77-7	C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)Cl	{4: 1, 14: 7, 16: 3, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	3690-04-8	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C)N(C)C	{1: 5, 3: 1, 33: 3, 14: 5, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	3690-12-8	COC1=NC=C(C(=N1)N)CO	{1: 1, 2: 1, 35: 2, 14: 1, 20: 1, 22: 1, 30: 1}
Did not match all atoms present	3690-18-4	CC(CC(=O)NC1=CC=CC=C1)N2CCCC2	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	3690-28-6	CCOC(=O)C(C1=CC=CC=C1)SP(=O)(OC)OC	{1: 3, 2: 1, 3: 1, 40: 1, 14: 5, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	3690-53-7	CCN(CC)CCNC(=O)C1=CC=CC=C1	{1: 2, 2: 4, 33: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	36904-42-4	CC1=C(C=CC(=C1)N)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C.[Cl-]	{1: 4, 2: 1, 34: 2, 14: 7, 17: 1, 24: 1, 30: 1}
Did not match all atoms present	36904-62-8	CCN(CCCS(=O)(=O)[O-])C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=CC=C3)C.[Na+]	{1: 2, 2: 4, 33: 1, 34: 4, 14: 12, 29: 3}
Did not match all atoms present	36907-37-6	O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[La+3]	{17: 3, 29: 12}
Did not match all atoms present	36907-42-3	O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[V+2]	{29: 4}
Did not match all atoms present	3691-35-8	C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)C(=O)C3C(=O)C4=CC=CC=C4C3=O	{3: 1, 12: 1, 14: 13, 17: 1, 24: 1, 25: 2}
Did not match all atoms present	3691-71-2	CC/C(=C\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O	{1: 1, 2: 1, 6: 1, 7: 1, 14: 8, 21: 2}
Did not match all atoms present	3691-74-5	C1=CN=CC=C1C(=O)N/N=C/[C@@H]([C@@H]2[C@@H]([C@@H](C(=O)O2)O)O)O	{34: 1, 3: 1, 6: 1, 12: 3, 14: 4, 35: 1, 20: 3, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	3691-78-9	CCOC(=O)C1(CCN(CC1)CCOCC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 4, 33: 1, 11: 4, 13: 1, 14: 10, 22: 1, 28: 1}
Did not match all atoms present	3691-93-8	CCOC1=CC=CC=C1NC(=O)C2=C(C=C3C4=CC=CC=C4OC3=C2)O	{1: 1, 2: 1, 14: 10, 21: 1, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	36911-94-1	CCC1=CC=CC2=CC3=C(C=C21)C(=CC4=CC=CC=C43)CC	{1: 2, 2: 2, 14: 10}
Did not match all atoms present	36911-95-2	CCC1=CC=CC2=C1C=C3C=CC4=CC=CC=C4C3=C2CC	{1: 2, 2: 2, 14: 10}
Did not match all atoms present	36914-78-0	CC(=O)OC1=C(C=CC=C1F)F	{16: 2, 1: 1, 28: 1, 14: 3}
Did not match all atoms present	36914-79-1	CC(=O)OC1=C(C=C(C=C1)Br)Br	{1: 1, 18: 2, 28: 1, 14: 3}
Did not match all atoms present	36914-80-4	CC(=O)OC1=C(C=C(C=C1)I)I	{1: 1, 19: 2, 28: 1, 14: 3}
Did not match all atoms present	36915-65-8	CCCCCCCCCCCCCCCC(=O)OCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 16, 28: 1, 29: 3}
Did not match all atoms present	36917-22-3	C1=CC(C=C1)P(F)F	{16: 2, 12: 1, 14: 4}
Did not match all atoms present	36917-36-9	CCC1=CC(=NC(=C1)C)C	{1: 3, 2: 1, 35: 1, 14: 2}
Did not match all atoms present	3692-05-5	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3O)C)NC(=O)C5=CC6=CC=CC=C6C=C5O	{24: 2, 1: 2, 21: 2, 14: 18, 31: 2}
Did not match all atoms present	3692-81-7	CCCC[Bi](CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	3693-22-9	C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)N	{30: 1, 14: 7, 23: 1}
Did not match all atoms present	36930-63-9	C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)NCCNC(=O)CI	{2: 3, 14: 6, 19: 1, 20: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	3694-45-9	C1=CC(=CC=C1CN=C=S)Cl	{8: 1, 17: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	3694-46-0	CC1=CC=C(C=C1)CN=C=S	{8: 1, 1: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	3694-52-8	C1=CC(=C(C(=C1)[N+](=O)[O-])N)N	{38: 1, 30: 2, 14: 3}
Did not match all atoms present	3694-57-3	COC1=CC=C(C=C1)CN=C=S	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 22: 1}
Did not match all atoms present	3694-58-4	C1=CC(=CC(=C1)Cl)CN=C=S	{8: 1, 17: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	3694-83-5	CCC1=C(C=C(C=C1)S(=O)(=O)O)N	{1: 1, 2: 1, 14: 3, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	369402-96-0	C1CS(=O)(=O)CCC1(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{2: 1, 11: 4, 12: 1, 13: 1, 14: 8, 27: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	36945-13-8	CC(C)(C)[CH2-].CC(C)(C)[CH2-].CC(C)(C)[CH2-].CC(C)(C)[CH2-].[Ti+4]	{1: 12, 4: 4, 5: 4}
Did not match all atoms present	36947-68-9	CC(C)C1=NC=CN1	{32: 1, 1: 2, 3: 1, 14: 2, 35: 1}
Did not match all atoms present	3695-00-9	CC1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=C(C=C2)C	{1: 2, 29: 4, 14: 8, 31: 1}
Did not match all atoms present	3695-24-7	COC1=C(C=C(C=C1)C(C(=O)O)O)O	{1: 1, 3: 1, 14: 3, 20: 1, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	3695-48-5	CN(C)C1=CC=C(C=C1)C=C2C(=O)NC(=O)S2	{32: 1, 1: 2, 6: 1, 33: 1, 41: 1, 14: 4, 15: 1, 25: 2}
Did not match all atoms present	3695-77-0	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)S	{4: 1, 14: 15, 39: 1}
Did not match all atoms present	3695-84-9	COC(=O)C(=CC1=CC=CC=C1)C#N	{1: 1, 37: 1, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	3695-92-9	C1=CC=C(C=C1)/C(=C/C2=CC=C(C=C2)Cl)/C#N	{17: 1, 37: 1, 14: 9, 6: 1, 7: 1}
Did not match all atoms present	3695-94-1	C1=CC(=CC=C1C=C(C#N)C2=CC=C(C=C2)Cl)Cl	{17: 2, 37: 1, 14: 8, 6: 1, 7: 1}
Did not match all atoms present	3696-23-9	C1=CC(=CC=C1NC(=S)N)Cl	{17: 1, 31: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	3696-28-4	C1=CC=[N+](C(=C1)SSC2=CC=CC=[N+]2[O-])[O-]	{40: 2, 33: 2, 29: 2, 14: 8}
Did not match all atoms present	3696-36-4	B(C1=NC=CC2=CC=CC=C12)(O)O	{35: 1, 20: 2, 14: 6}
Did not match all atoms present	3696-66-0	CC1=CC(=CC=C1)CN=C=S	{8: 1, 1: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	36965-71-6	C1=CC2=CC3=NC(=C(C4=C(C(=C(N4C5=C(C(=C(C(=C5F)F)F)F)F)C=C6C=CC(=N6)C=C1N2)C7=C(C(=C(C(=C7F)F)F)F)F)C8=C(C(=C(C(=C8F)F)F)F)F)C9=C(C(=C(C(=C9F)F)F)F)F)C=C3.[Cl-].[Cl-].[Fe+2]	{32: 1, 33: 1, 35: 2, 14: 9, 16: 20, 17: 2}
Did not match all atoms present	36969-89-8	CCCCCC(=O)CP(=O)(OC)OC	{24: 1, 1: 3, 2: 5, 29: 1, 22: 2}
Did not match all atoms present	3697-24-3	CC1=CC2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3	{1: 1, 14: 11}
Did not match all atoms present	3697-25-4	C1CC=C2C(=C1)C=C3C=CC4=C3C2=CC5=CC=CC=C45	{11: 2, 14: 10}
Did not match all atoms present	3697-27-6	CC1=C(C2=C(C=CC3=CC=CC=C32)C4=CC=CC=C14)C	{1: 2, 14: 10}
Did not match all atoms present	3697-30-1	CCC1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC=C41	{1: 1, 2: 1, 14: 11}
Did not match all atoms present	36972-84-6	C[Si](C)(C)OC1=CC(=NC2=CC=CC=C21)C(=O)O[Si](C)(C)C	{1: 6, 35: 1, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	36978-41-3	C1=CC(=C2C(=C1)C(=O)OC2=O)C3=CC4=C(C=C3)C(=O)OC4=O	{28: 4, 14: 6}
Did not match all atoms present	36978-49-1	C1=CC(=CC=C1C(=O)CCCC(=O)O)Cl	{24: 1, 17: 1, 2: 3, 27: 1, 14: 4}
Did not match all atoms present	3698-06-4	C1CCC(=C2C(=O)NC(=S)S2)CC1	{32: 1, 25: 1, 11: 5, 41: 1, 15: 3}
Did not match all atoms present	3698-10-0	CCCN1C(=O)C(=CC2=CC=C(C=C2)N(C)C)SC1=S	{1: 3, 2: 2, 6: 1, 33: 2, 41: 1, 14: 4, 15: 2, 25: 1}
Did not match all atoms present	3698-12-2	CN(C)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC=C3	{1: 2, 6: 1, 33: 2, 41: 1, 14: 9, 15: 2, 25: 1}
Did not match all atoms present	3698-54-2	C1=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N)[N+](=O)[O-]	{38: 4, 30: 1, 14: 1}
Did not match all atoms present	3698-83-7	C1=C(C(=CC(=C1[N+](=O)[O-])Cl)Cl)[N+](=O)[O-]	{17: 2, 38: 2, 14: 2}
Did not match all atoms present	36981-93-8	CC1(COC(CN1)C2=CC=CC=C2)C.Cl	{32: 1, 1: 2, 11: 2, 12: 1, 13: 1, 14: 5, 17: 1, 23: 1}
Did not match all atoms present	3699-01-2	CC1=CC=C(C=C1)SC2=CC=CC=C2	{40: 1, 1: 1, 14: 9}
Did not match all atoms present	3699-66-9	CCOC(=O)C(C)P(=O)(OCC)OCC	{1: 4, 2: 3, 3: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	3699-67-0	CCOC(=O)CCP(=O)(OCC)OCC	{1: 3, 2: 5, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	36993-63-2	CCC1(C(=O)NC(=S)[N-]C1=O)C(C)C.[Na+]	{32: 1, 1: 3, 2: 1, 3: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	36994-69-1	C1=CC=C(C(=C1)C(=O)OC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)O	{17: 5, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	36994-79-3	CC1=C(C=C(C=C1I)I)I	{1: 1, 19: 3, 14: 2}
Did not match all atoms present	370-14-9	CC(CC1=CC=C(C=C1)O)NC	{1: 2, 2: 1, 3: 1, 14: 4, 21: 1, 31: 1}
Did not match all atoms present	370-35-4	CCOC(=O)C(=CNC1=CC=CC(=C1)C(F)(F)F)C(=O)OCC	{1: 2, 2: 2, 4: 1, 6: 1, 7: 1, 14: 4, 16: 3, 28: 2, 31: 1}
Did not match all atoms present	370-47-8	C1=CC(=CC(=C1)SC(F)(F)F)[N+](=O)[O-]	{16: 3, 40: 1, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	370-56-9	CC(C)OC(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 2, 3: 1, 4: 1, 14: 4, 16: 3, 28: 1, 31: 1}
Did not match all atoms present	370-69-4	C(C(F)(F)F)OP(OCC(F)(F)F)OCC(F)(F)F	{16: 9, 2: 3, 4: 3, 22: 3}
Did not match all atoms present	370-76-3	C1=CC=C(C=C1)CCC2=CC=C(C=C2)F	{16: 1, 2: 2, 14: 9}
Did not match all atoms present	3700-19-4	C1=CC=C(C=C1)N(C(F)(F)F)C(F)(F)F	{16: 6, 33: 1, 4: 2, 14: 5}
Did not match all atoms present	3700-67-2	CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.[Br-]	{1: 4, 2: 34, 18: 1}
Did not match all atoms present	3700-89-8	COC(=O)CC(C(=O)OC)SP(=S)(OC)OC	{1: 4, 2: 1, 3: 1, 40: 1, 22: 2, 28: 2}
Did not match all atoms present	37002-45-2	CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2[C@@H](OC(O2)(C)C)COS(=O)(=O)C3=CC=C(C=C3)C	{1: 4, 2: 2, 12: 2, 13: 1, 14: 8, 22: 2, 23: 2, 29: 4}
Did not match all atoms present	37002-48-5	CC1(O[C@@H]([C@H](O1)CP(C2=CC=CC=C2)C3=CC=CC=C3)CP(C4=CC=CC=C4)C5=CC=CC=C5)C	{1: 2, 2: 2, 12: 2, 13: 1, 14: 20, 23: 2}
Did not match all atoms present	37002-52-1	C1=CC=C(C=C1)C[C@H](C(=O)O)NC(=O)C2=CC=CC=C2	{2: 1, 3: 1, 14: 10, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	37007-84-4	CC(C)(C)[CH2-].CC(C)(C)[CH2-].CC(C)(C)[CH2-].CC(C)(C)[CH2-].[Cr+4]	{1: 12, 4: 4, 5: 4}
Did not match all atoms present	3701-40-4	CC1=C(C=CC(=C1)N/N=C/2\C(=O)C=CC3=CC=CC=C32)C4=C(C=C(C=C4)N/N=C/5\C(=CC6=C(C5=O)C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 34: 2, 14: 16, 15: 3, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	37013-20-0	C[Si](C)(C)CCC(=O)[O-].[Na+]	{24: 1, 1: 3, 2: 2}
Did not match all atoms present	37014-01-0	C1C(SC(CC1=O)C2=CC=CC=C2)C3=CC=CC=C3	{25: 1, 11: 2, 12: 2, 14: 10, 41: 1}
Did not match all atoms present	37017-22-4	C[AsH](C)C.C[AsH](C)C.[C-](F)(F)F.[C-](F)(F)F.[Pt+2]	{16: 6, 1: 6, 7: 2}
Did not match all atoms present	37018-31-8	C1C2CC3CC1CC(C2)(C3)NCCSS(=O)(=O)O	{2: 2, 40: 1, 11: 6, 12: 3, 13: 1, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	37021-14-0	CCN1C(=O)CN(C1=S)C2=CC=CC=C2	{1: 1, 2: 1, 33: 2, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	3703-76-2	C1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl	{33: 1, 2: 2, 3: 1, 11: 5, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	3703-79-5	CCCCNCC(C1=CC=C(C=C1)O)O	{1: 1, 2: 4, 3: 1, 14: 4, 20: 1, 21: 1, 31: 1}
Did not match all atoms present	3703-84-2	C1CNCCN1.C(=S)(N)S	{32: 2, 39: 1, 11: 4, 30: 1, 7: 1}
Did not match all atoms present	37032-33-0	CCCCCCCCCCCCCCCCO[P+](=O)OCCCCCCCCCCCCCCCC	{1: 2, 2: 30, 29: 1, 22: 2}
Did not match all atoms present	37033-23-1	CCC1=C(C(=NC(=N1)N)N)C23CC4CC(C2)CC(C4)C3.CCS(=O)(=O)O	{1: 2, 2: 2, 35: 2, 11: 6, 12: 3, 13: 1, 20: 1, 29: 2, 30: 2}
Did not match all atoms present	37033-95-7	CCOC(=O)C1=CC2=C(N1)C=CC(=C2)OCC3=CC=CC=C3	{32: 1, 1: 1, 2: 2, 14: 9, 22: 1, 28: 1}
Did not match all atoms present	37035-32-8	C1CCCCCCC1.C(F)(F)F.[Pt]	{11: 8, 16: 3, 3: 1}
Did not match all atoms present	37037-03-9	C[As](C)[Si](Cl)(Cl)Cl	{1: 2, 17: 3}
Did not match all atoms present	3704-28-7	COC(=O)C1=CC=CC=C1SC	{40: 1, 1: 2, 28: 1, 14: 4}
Did not match all atoms present	3704-42-5	C1=CC(=CC=C1C2=CSC=N2)[N+](=O)[O-]	{41: 1, 35: 1, 38: 1, 14: 6}
Did not match all atoms present	3704-44-7	C[Si](C)(C)[Si](C)(C)[Si](C)(C)C	{1: 8}
Did not match all atoms present	3704-46-9	C[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)C	{1: 12}
Did not match all atoms present	3704-48-1	C[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)C	{1: 18}
Did not match all atoms present	37043-12-2	CCO[Si](CCCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCC)OCC	{1: 3, 2: 6, 4: 7, 16: 15, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	37045-16-2	C1=CC=C(C=C1)CC2=CC3=CC=CC=C3N=C2	{2: 1, 35: 1, 14: 11}
Did not match all atoms present	37045-40-2	C[NH2+]C1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42.[Br-]	{1: 1, 18: 1, 35: 1, 14: 12, 31: 1}
Did not match all atoms present	37048-03-6	[Be+2].[CH-]1C=CC=C1.[CH-]1C=CC=C1	{14: 10}
Did not match all atoms present	3705-62-2	C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC(=CC=C3)OC4=CC=CC(=C4)OC5=CC=CC(=C5)OC6=CC=CC=C6	{22: 5, 14: 26}
Did not match all atoms present	37051-42-6	C1=CC=C(C(=C1)C(=O)O)C(=O)OOC(=O)C2=CC=CC=C2C(=O)O	{27: 2, 28: 2, 14: 8}
Did not match all atoms present	37052-78-1	COC1=CC2=C(C=C1)NC(=S)N2	{32: 2, 1: 1, 22: 1, 14: 3}
Did not match all atoms present	37060-36-9	CCN(CC)C1=CC2=C(C=C1)N(C3=C(O2)C=C(C=C3)N(CC)CC)C(=O)C4=CC=CC=C4	{1: 4, 2: 4, 33: 3, 14: 11, 23: 1, 24: 1}
Did not match all atoms present	37062-63-8	CCCCCCCCOC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 7, 22: 1, 14: 4}
Did not match all atoms present	37065-29-5	CON1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)O	{1: 1, 33: 1, 11: 1, 14: 3, 22: 1, 23: 2, 25: 1, 27: 1}
Did not match all atoms present	37066-82-3	C(CCCC[O-])CCCO.C(CCCC[O-])CCCO.C(CCCC[O-])CCCO.C(CCCC[O-])CCCO.[Ti+4]	{2: 32, 20: 4, 29: 4}
Did not match all atoms present	37078-97-0	C1=CC=C(C(=C1)C(F)(F)F)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)O)C=CC2=N	{4: 1, 14: 8, 15: 5, 16: 3, 20: 1, 25: 1, 36: 1, 29: 2, 31: 2}
Did not match all atoms present	37081-76-8	C1CN(CCN1)C2=NC3=C(C=C(C=C3)O)OC4=C2C=C(C=C4)Cl	{32: 1, 33: 1, 35: 1, 11: 4, 14: 6, 15: 1, 17: 1, 21: 1, 23: 1}
Did not match all atoms present	37086-84-3	CC(COC(=O)C1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	3709-98-6	CCC1=NC(=CC(=O)N1)O	{32: 1, 1: 1, 2: 1, 35: 1, 14: 1, 21: 1, 25: 1}
Did not match all atoms present	37094-61-4	C1CCN(CC1)CC(C2=C3C(=C4C=C(C=CC4=C2)C(F)(F)F)C=CS3)O.Cl	{33: 1, 2: 1, 3: 1, 4: 1, 41: 1, 11: 5, 14: 6, 16: 3, 17: 1, 20: 1}
Did not match all atoms present	37099-12-0	C1C(O1)COC(=O)C2=CC=CC=C2C(=O)OCC3CO3	{2: 2, 11: 2, 12: 2, 14: 4, 23: 2, 28: 2}
Did not match all atoms present	371-15-3	CSC1=CC=C(C=C1)F	{16: 1, 1: 1, 14: 4, 40: 1}
Did not match all atoms present	371-40-4	C1=CC(=CC=C1N)F	{16: 1, 30: 1, 14: 4}
Did not match all atoms present	371-41-5	C1=CC(=CC=C1O)F	{16: 1, 21: 1, 14: 4}
Did not match all atoms present	371-42-6	C1=CC(=CC=C1F)S	{16: 1, 14: 4, 39: 1}
Did not match all atoms present	371-67-5	C(=[N+]=[N-])C(F)(F)F	{16: 3, 34: 1, 4: 1, 6: 1}
Did not match all atoms present	371-69-7	CCOS(=O)(=O)F	{16: 1, 1: 1, 2: 1, 29: 2, 22: 1}
Did not match all atoms present	371-86-8	CC(C)NP(=O)(NC(C)C)F	{16: 1, 1: 4, 3: 2, 29: 1, 31: 2}
Did not match all atoms present	3710-23-4	CC(=C)C1=CC2=CC=CC=C2C=C1	{1: 1, 5: 1, 14: 7, 7: 1}
Did not match all atoms present	3710-43-8	CC1=CC(=CO1)C	{1: 2, 14: 2, 23: 1}
Did not match all atoms present	37106-97-1	C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC3=CC=C(C=C3)C(=O)O	{2: 1, 3: 1, 14: 13, 21: 1, 24: 2, 27: 1, 31: 2}
Did not match all atoms present	37106-99-3	C[C@@]1([C@@H]2C[C@@H]3[C@H](C(=O)C(=C([C@@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)NCN5CCC[C@H]5C(=O)O)N(C)C)O	{1: 3, 2: 1, 33: 2, 11: 4, 12: 4, 13: 2, 14: 3, 15: 4, 20: 4, 21: 1, 24: 1, 25: 2, 27: 1, 31: 1}
Did not match all atoms present	37125-93-2	CC1=C(C2=CC=CC=C2N1)CC3CN(CCC3=O)CC4=CC=CC=C4	{32: 1, 1: 1, 2: 2, 33: 1, 11: 3, 12: 1, 14: 9, 25: 1}
Did not match all atoms present	3713-25-5	C1=CC=C(C=C1)NN=CC(C(C(C(CO)O)O)O)O	{2: 1, 3: 4, 6: 1, 34: 1, 14: 5, 20: 5, 31: 1}
Did not match all atoms present	37132-72-2	C1CN1P2(=NP(=NP(=N2)(N3CC3)N4CCOCC4)(N5CC5)N6CC6)N7CC7	{33: 6, 11: 14, 35: 3, 23: 1}
Did not match all atoms present	37138-23-1	C1=CC=C(C=C1)NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{35: 6, 6: 2, 14: 16, 17: 2, 29: 6, 31: 4}
Did not match all atoms present	37138-25-3	C1=CC(=CC(=C1)S(=O)(=O)[O-])NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC(=CC=C6)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{35: 6, 6: 2, 14: 14, 17: 2, 29: 12, 31: 4}
Did not match all atoms present	37138-26-4	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{35: 6, 6: 2, 14: 14, 17: 2, 29: 12, 31: 4}
Did not match all atoms present	37139-21-2	CCCCCCCCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 8, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	37139-99-4	CCCCCCCCC=CCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 16, 14: 5, 6: 2, 17: 1}
Did not match all atoms present	3714-62-3	C1=C(C(=C(C(=C1Cl)Cl)Cl)[N+](=O)[O-])Cl	{17: 4, 38: 1, 14: 1}
Did not match all atoms present	37140-08-2	CC1=NC2=NC=NN2C(=C1)NN	{1: 1, 35: 3, 33: 1, 14: 2, 30: 1, 31: 1}
Did not match all atoms present	37141-32-5	C1=CC(=CC=C1[C@@H]2[C@H](O2)CO)[N+](=O)[O-]	{2: 1, 38: 1, 12: 2, 14: 4, 20: 1, 23: 1}
Did not match all atoms present	37141-50-7	CC1=CC(=CC=C1)CSC#N	{40: 1, 1: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	37148-48-4	CC(=O)C1=CC(=C(C(=C1)Cl)N)Cl	{24: 1, 1: 1, 30: 1, 14: 2, 17: 2}
Did not match all atoms present	37148-62-2	C[Si](C)(C)OC1=C(C=C(C=C1)CC(=O)O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 2: 1, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	3715-29-5	CC(C)C(=O)C(=O)[O-].[Na+]	{24: 2, 1: 2, 3: 1}
Did not match all atoms present	3715-31-9	CCC(C)C(=O)C(=O)[O-].[Na+]	{24: 2, 1: 2, 2: 1, 3: 1}
Did not match all atoms present	3715-90-0	C1CCC2=C(C1)C=CC=C2NC3=NCCN3.Cl	{32: 1, 35: 1, 11: 6, 14: 3, 15: 1, 17: 1, 31: 1}
Did not match all atoms present	3715-92-2	C1CN(C(=S)N1)N=O	{32: 1, 33: 1, 34: 1, 11: 2, 15: 1, 29: 1}
Did not match all atoms present	37151-16-9	C1=CC(=CC=C1C2=NC3=C(C(=N2)N)N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)[N+](=O)[O-]	{33: 1, 2: 1, 35: 3, 38: 1, 12: 4, 14: 5, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	37159-60-7	C1(=NSC(=N1)Cl)Br	{17: 1, 18: 1, 35: 2, 41: 1}
Did not match all atoms present	37159-99-2	C1=CC2=NC=CC3=NC=NC(=C1)N23	{33: 1, 35: 3, 14: 6}
Did not match all atoms present	37168-42-6	CCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)OCC	{1: 2, 2: 5, 6: 1, 34: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	37169-10-1	CC(=O)OC1=C(C=C(C=C1[N+](=O)[O-])Cl)Cl	{1: 1, 28: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	3717-22-4	COC1=CC=C(C=C1)C=NO	{1: 1, 34: 1, 6: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	3717-28-0	C1=CC=C(C(=C1)C=NO)Cl	{17: 1, 34: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	3717-88-2	CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCN3CCCCC3)C4=CC=CC=C4.Cl	{1: 1, 2: 2, 33: 1, 11: 5, 14: 8, 17: 1, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	37170-96-0	CC(=O)NC1=C2C=CC=CC2=CC3=CC=CC=C31	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	37177-08-5	CCCOP(=O)(/C=C(\C)/O[C@H](C)CCl)OCCC	{1: 4, 2: 5, 3: 1, 6: 1, 7: 1, 17: 1, 22: 3, 29: 1}
Did not match all atoms present	37181-39-8	O=S(=O)([O-])C(F)(F)F	{16: 3, 4: 1, 29: 3}
Did not match all atoms present	37185-09-4	[O-][Nb](=O)=O.[O-][Nb](=O)=O.[O-][Nb](=O)=O.[O-][Nb](=O)=O.[Sr+2].[Ba+2]	{29: 12}
Did not match all atoms present	3719-37-7	C1=CC=C2C=C3C4=CC=CC=C4[C@@H]([C@H](C3=CC2=C1)O)O	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	37190-22-0	[Cu].[Cu]Br.[Cu](Br)Br	{18: 3}
Did not match all atoms present	372-16-7	C1=CC(=CC=C1N)SC(F)(F)F	{16: 3, 40: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	372-18-9	C1=CC(=CC(=C1)F)F	{16: 2, 14: 4}
Did not match all atoms present	372-19-0	C1=CC(=CC(=C1)F)N	{16: 1, 30: 1, 14: 4}
Did not match all atoms present	372-20-3	C1=CC(=CC(=C1)F)O	{16: 1, 21: 1, 14: 4}
Did not match all atoms present	372-38-3	C1=C(C=C(C=C1F)F)F	{16: 3, 14: 3}
Did not match all atoms present	372-39-4	C1=C(C=C(C=C1F)F)N	{16: 2, 30: 1, 14: 3}
Did not match all atoms present	372-47-4	C1=CC(=CN=C1)F	{16: 1, 35: 1, 14: 4}
Did not match all atoms present	372-48-5	C1=CC=NC(=C1)F	{16: 1, 35: 1, 14: 4}
Did not match all atoms present	372-70-3	C(CCCS(=O)(=O)F)CCF	{16: 2, 2: 6, 29: 2}
Did not match all atoms present	37209-31-7	C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)O	{1: 1, 2: 1, 12: 10, 20: 7, 22: 6, 23: 2, 29: 10}
Did not match all atoms present	3721-13-9	CN(C)P1(=NP(=NP(=N1)(N(C)C)Cl)(N(C)C)Cl)Cl	{1: 6, 35: 3, 33: 3, 17: 3}
Did not match all atoms present	372144-00-8	C1=C(C=C(C=C1Cl)Cl)C(CO)N	{2: 1, 3: 1, 14: 3, 17: 2, 20: 1, 30: 1}
Did not match all atoms present	372144-01-9	C1=CC(=CN=C1)C(CO)N	{2: 1, 35: 1, 14: 4, 3: 1, 20: 1, 30: 1}
Did not match all atoms present	372144-16-6	CC(C)(C)OC1=CC=CC(=C1)C(CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{1: 3, 2: 2, 3: 1, 4: 1, 12: 1, 14: 12, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	372144-18-8	CC(C)(C)OC1=CC=CC=C1C(CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{1: 3, 2: 2, 3: 1, 4: 1, 12: 1, 14: 12, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	3722-73-4	CC1=CC2=C(CCCO2)C=C1	{1: 1, 11: 3, 14: 3, 23: 1}
Did not match all atoms present	37220-90-9	[Li+].[Li+].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Mg+2].[Mg+2]	{29: 9}
Did not match all atoms present	37222-66-5	OS(=O)(=O)[O-].OS(=O)(=O)O[O-].[O-]S(=O)(=O)[O-].[K+].[K+].[K+].[K+]	{20: 2, 29: 10, 22: 1}
Did not match all atoms present	37224-32-1	[O-2].[O-2].[Na+].[Na+].[Zn+2]	{}
Did not match all atoms present	37224-61-6	CC(C)CCCCCC1=C(C=C(C=C1[N+](=O)[O-])O)[N+](=O)[O-]	{1: 2, 2: 5, 3: 1, 38: 2, 14: 2, 21: 1}
Did not match all atoms present	37228-07-2	B([O-])([O-])[O-].B([O-])([O-])[O-].[Sr+2].[Sr+2].[Sr+2]	{29: 6}
Did not match all atoms present	37235-82-8	[O-][Cr](=O)(=O)[O-].[O-][Cr](=O)(=O)[O-].[O-][Cr](=O)(=O)[O-].[Bi+3].[Bi+3]	{29: 12}
Did not match all atoms present	3724-19-4	C1=CC(=CN=C1)CCC(=O)O	{35: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	3724-89-8	C(CSP(=O)(O)[O-])N.[Na+]	{40: 1, 2: 2, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	37242-45-8	CCCCCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 5, 29: 3, 22: 1}
Did not match all atoms present	37243-97-3	[H-].[H-].[H-].[H-].[Ti+4]	{}
Did not match all atoms present	37244-86-3	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)NCCO)I.CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)NCCO)I.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.C(CO)N	{1: 3, 2: 8, 3: 4, 19: 6, 20: 8, 24: 4, 27: 2, 30: 1, 31: 5}
Did not match all atoms present	37245-77-5	[NH2-].[N-]=[Fe].[Fe].[Fe].[Fe].[Fe].[Fe]	{}
Did not match all atoms present	37247-91-9	[O-2].[O-2].[Mg+2].[Ca+2]	{}
Did not match all atoms present	37262-59-2	CC1(C2CCC1(C(=O)C2)C)C.C1=CC=C(C=C1)O	{1: 3, 11: 3, 12: 1, 13: 2, 14: 5, 21: 1, 25: 1}
Did not match all atoms present	37267-70-2	[SbH].[Sb]=[Sb]	{}
Did not match all atoms present	37267-86-0	OP(=O)=O	{20: 1, 29: 2}
Did not match all atoms present	37270-71-6	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)CC[C@H]34.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 2, 9: 2, 10: 2, 11: 14, 12: 7, 13: 4, 14: 4, 15: 1, 20: 2, 21: 1, 25: 1}
Did not match all atoms present	37271-15-1	CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.CCOC1=CC=C(C=C1)NC(=O)C.CC(=O)OC1=CC=CC=C1C(=O)O.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.CN1C=NC2=C1C(=O)N(C(=O)N2C)C.OP(=O)(O)O	{32: 2, 1: 9, 2: 2, 35: 1, 33: 4, 11: 3, 12: 4, 13: 2, 14: 18, 20: 4, 22: 2, 23: 1, 24: 1, 25: 5, 27: 1, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	37274-10-5	CCC1CCCCCCC1.[U]	{1: 1, 2: 1, 11: 7, 12: 1}
Did not match all atoms present	37274-12-7	CCCCC1CCCCCCC1.[U]	{1: 1, 2: 3, 11: 7, 12: 1}
Did not match all atoms present	37279-36-0	[Li+].[Li+].[I-].[I-]	{19: 2}
Did not match all atoms present	37279-53-1	C1=CC2=C(C=CC(=C2N=NC3=CC(=C(C=C3[O-])NC(=O)NC4=C(C=C(C(=C4)[O-])N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])C=C1S(=O)(=O)[O-].[NH4+].[NH4+].[NH4+].[NH4+].[Cu+2].[Cu+2]	{24: 1, 34: 4, 29: 12, 14: 14, 31: 2}
Did not match all atoms present	3728-43-6	CC1=CC=C(C=C1)[Si](C)(C)C	{1: 4, 14: 4}
Did not match all atoms present	3729-21-3	C1=CC(=CC=C1C(=O)Cl)N=C=O	{34: 1, 8: 1, 14: 4, 17: 1, 24: 1, 29: 1}
Did not match all atoms present	3729-34-8	C1=CC(=CC=C1C#[N+][O-])C#[N+][O-]	{34: 2, 29: 2, 14: 4}
Did not match all atoms present	37292-80-1	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Mg+2].[Fe+3]	{29: 6}
Did not match all atoms present	37295-14-0	P12SP3SP(=S)(S1)SP(=S)(S2)S3	{41: 6}
Did not match all atoms present	37297-57-7	C#C[AlH2]	{9: 1, 10: 1}
Did not match all atoms present	37299-12-0	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]#[Cr]	{1: 10, 29: 4}
Did not match all atoms present	37299-86-8	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=C(C=C(C=C4)C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Cl-]	{1: 4, 2: 4, 33: 2, 14: 9, 17: 1, 23: 1, 24: 2}
Did not match all atoms present	373-02-4	CC(=O)[O-].CC(=O)[O-].[Ni+2]	{24: 2, 1: 2}
Did not match all atoms present	373-64-8	B(C)(F)F	{16: 2, 1: 1}
Did not match all atoms present	373-74-0	C[Si](F)(F)F	{16: 3, 1: 1}
Did not match all atoms present	373-80-8	C(F)(F)(F)S(F)(F)(F)(F)F	{16: 8, 4: 1}
Did not match all atoms present	3730-54-9	CCOC(=O)C(C(=O)C)P(=O)(OCC)OCC	{1: 4, 2: 3, 3: 1, 22: 2, 24: 1, 28: 1, 29: 1}
Did not match all atoms present	37308-30-8	[SbH].[SbH].[Cs]	{}
Did not match all atoms present	3731-39-3	CC1=CC=CC=C1N=NC2=CC=C(C=C2)N(C)C	{1: 3, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	3731-51-9	C1=CC=NC(=C1)CN	{2: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	3731-52-0	C1=CC(=CN=C1)CN	{2: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	3731-53-1	C1=CN=CC=C1CN	{2: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	37317-82-1	CCOC1=CC=C(C=C1)NC(=O)C.CC(=O)OC1=CC=CC=C1C(=O)O.CN1C=NC2=C1C(=O)N(C(=O)N2C)C	{1: 6, 2: 1, 35: 1, 33: 3, 14: 9, 22: 1, 24: 1, 25: 2, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	3732-81-8	CN(C)P(=S)(N(C)C)Cl	{1: 4, 33: 2, 17: 1}
Did not match all atoms present	3732-82-9	CN(C)P(=S)(N(C)C)N(C)C	{1: 6, 33: 3}
Did not match all atoms present	3732-90-9	CC1=C(C=CC(=C1)N=NC2=CC=CC=C2)N(C)C	{1: 3, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	37321-15-6	[O-][Si](=O)[O-].[Ni+2]	{29: 3}
Did not match all atoms present	3733-63-9	C1CN(CCN1CCOCCO)C(C2=CC=CC=C2)C3=CC=CC=C3	{33: 2, 2: 4, 3: 1, 11: 4, 14: 10, 20: 1, 22: 1}
Did not match all atoms present	37333-40-7	CCC(CC)C(C)(CC)OP(=S)(OO)OP(=O)(O)O.CCOOP(=S)(OC(C)C)OP(=O)(OC(C)C)OC(C)C	{1: 11, 2: 4, 3: 4, 4: 1, 20: 3, 22: 9, 29: 2}
Did not match all atoms present	37339-32-5	CCCCCCCCCC1=C/C(=C(\C2=CC=CC=C2)/NO)/C(=O)C=C1	{1: 1, 2: 8, 7: 1, 14: 8, 15: 2, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	37339-97-2	C[N+]1=CC=C(C=C1)C2=CC=CC=C2.[Cl-]	{1: 1, 33: 1, 14: 9, 17: 1}
Did not match all atoms present	3734-17-6	CCC(=O)OC1(CCN(C1C)C)C2=CC=CC=C2	{1: 3, 2: 1, 33: 1, 11: 2, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	3734-33-6	CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.C1=CC=C(C=C1)C(=O)[O-]	{24: 2, 1: 4, 2: 4, 14: 13, 31: 1}
Did not match all atoms present	3734-52-9	CC1C2CC3=C(C1(CCN2C)C)C=C(C=C3)O	{1: 3, 33: 1, 11: 3, 12: 2, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	3734-67-6	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(/C(=N/NC3=CC=CC=C3)/C2=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	3734-95-0	CCOP(=O)(OCC)SCC(=O)NC(C)(C)C#N	{1: 4, 2: 3, 4: 1, 37: 1, 40: 1, 22: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	3734-97-2	CCN(CC)CCSP(=O)(OCC)OCC.C(=O)(C(=O)O)O	{1: 4, 2: 6, 33: 1, 40: 1, 22: 2, 27: 2, 29: 1}
Did not match all atoms present	37342-97-5	[H-].C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Zr+4]	{17: 1, 11: 2, 14: 6}
Did not match all atoms present	37343-05-8	CC.C1CCCC1.[Mo]	{1: 2, 11: 5}
Did not match all atoms present	37346-48-8	[Cl-].[Eu]	{17: 1}
Did not match all atoms present	3735-01-1	CCOP(=S)(OCC)OC1=CC=C(C=C1)N	{1: 2, 2: 2, 30: 1, 22: 3, 14: 4}
Did not match all atoms present	3735-23-7	COP(=S)(OC)SCSC1=C(C=CC(=C1)Cl)Cl	{1: 2, 2: 1, 40: 2, 14: 3, 17: 2, 22: 2}
Did not match all atoms present	3735-33-9	COP(=O)(OC)SCN1C(=O)C2=CC=CC=C2C1=O	{1: 2, 2: 1, 33: 1, 40: 1, 14: 4, 22: 2, 25: 2, 29: 1}
Did not match all atoms present	3735-81-7	COP(=O)(OC)OCC(Cl)(Cl)Cl	{1: 2, 2: 1, 4: 1, 17: 3, 22: 3, 29: 1}
Did not match all atoms present	3735-90-8	CCN(CC)CCSC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 4, 33: 2, 40: 1, 14: 10, 24: 1}
Did not match all atoms present	3735-92-0	CN(C)C(=S)SC	{40: 1, 1: 3, 33: 1, 7: 1}
Did not match all atoms present	3736-90-1	CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.C1=C(C(=O)C(=CN1CC(=O)O)I)I	{1: 1, 2: 3, 3: 4, 33: 1, 14: 2, 19: 2, 20: 5, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	3736-92-3	C1=CC=C(C=C1)N2C(=O)C(C(=O)N2C3=CC=CC=C3)CCSC4=CC=CC=C4	{33: 2, 2: 2, 40: 1, 12: 1, 14: 15, 25: 2}
Did not match all atoms present	37366-09-9	C1=CC=CC=C1.C1=CC=CC=C1.Cl[Ru]Cl.Cl[Ru]Cl	{17: 4, 14: 12}
Did not match all atoms present	37367-15-0	[Se].[SbH].[Sb].[Sb]	{}
Did not match all atoms present	37367-17-2	[Se].[Se].[Se].[Sb].[Sb].[Sb].[Sb]	{}
Did not match all atoms present	37367-90-1	B([O-])([O-])[O-].B([O-])([O-])[O-].[Co+2].[Co+2].[Co+2]	{29: 6}
Did not match all atoms present	3737-09-5	CC(C)N(CCC(C1=CC=CC=C1)(C2=CC=CC=N2)C(=O)N)C(C)C	{1: 4, 2: 2, 3: 2, 4: 1, 33: 1, 14: 9, 35: 1, 24: 1, 30: 1}
Did not match all atoms present	3737-22-2	CC(C)OC(=O)C1=CC(=CN=C1)C(=O)OC(C)C	{1: 4, 3: 2, 28: 2, 14: 3, 35: 1}
Did not match all atoms present	3737-35-7	CCN(CC)CCOC(=O)C(C1CCCC1)(C2=CC=CS2)O.Cl	{1: 2, 2: 4, 4: 1, 33: 1, 41: 1, 11: 4, 12: 1, 14: 3, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	3737-41-5	C1C(C(CS1(=O)=O)(Cl)Cl)(Cl)Cl	{17: 4, 11: 2, 13: 2, 29: 2}
Did not match all atoms present	3737-57-3	CCCCCCCCCCCC(=O)N(C)CCS(=O)(=O)O	{1: 2, 2: 12, 33: 1, 20: 1, 24: 1, 29: 2}
Did not match all atoms present	3737-66-4	CCCOC1=CC(=C(C(=C1)C)C(=O)OCC(C)[NH+]2CCCC2)C.[Cl-]	{1: 4, 2: 3, 3: 1, 11: 4, 14: 2, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	3737-72-2	CCCC(C[NH+](CC)CC)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC.[Cl-]	{1: 4, 2: 5, 3: 1, 14: 8, 17: 1, 22: 2, 28: 1}
Did not match all atoms present	3737-76-6	C1=CC=C2C(=C1)C=CC3=C2C(=O)C4=C(N3)C5=C(C=C4)C(=O)C6=CC=CC=C6C5=O	{32: 1, 25: 3, 14: 12}
Did not match all atoms present	3739-38-6	C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)O	{27: 1, 22: 1, 14: 9}
Did not match all atoms present	3739-67-1	CC(C)(C1=CC=C(C=C1)OCC=C)C2=CC=C(C=C2)OCC=C	{1: 2, 2: 2, 4: 1, 5: 2, 6: 2, 14: 8, 22: 2}
Did not match all atoms present	3739-94-4	C1=CC(=NC(=C1)C(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 35: 1, 14: 3}
Did not match all atoms present	3739-97-7	C[Si](C)(C)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 14: 15, 6: 1}
Did not match all atoms present	37395-76-9	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCO)CCO	{1: 2, 2: 4, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 20: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	3740-05-4	CC(C)(C)/C=C\C1=CC=CC=C1	{1: 3, 4: 1, 14: 5, 6: 2}
Did not match all atoms present	3740-18-9	C1=C(C(=CC(=C1S(=O)(=O)Cl)Cl)Cl)C(=O)O	{17: 3, 27: 1, 29: 2, 14: 2}
Did not match all atoms present	3740-52-1	C1=CC=C(C(=C1)CC(=O)O)[N+](=O)[O-]	{2: 1, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	37405-95-1	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)N=NC6=C(C=C(C=C6)N)N)S(=O)(=O)O)S(=O)(=O)O	{34: 5, 14: 18, 15: 2, 20: 2, 24: 1, 25: 1, 29: 4, 30: 3, 31: 2}
Did not match all atoms present	37405-99-5	CC\1=NN(C(=N)/C1=N/NC2=CC(=C(C=C2Cl)S(=O)(=O)[O-])Cl)C3=CC=C(C=C3)Cl.[Na+]	{1: 1, 34: 1, 35: 1, 36: 1, 33: 1, 14: 6, 15: 3, 17: 3, 29: 3, 31: 1}
Did not match all atoms present	37408-18-7	CC1=C(C=CC(=C1)Cl)N=C=O	{1: 1, 34: 1, 8: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	3741-12-6	C1=CC2=[N+](C=CC(=C2C=C1Cl)[N+](=O)[O-])[O-]	{17: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	3741-14-8	CCC1=[N+](C2=CC=CC=C2C(=C1)[N+](=O)[O-])[O-]	{1: 1, 2: 1, 38: 1, 33: 1, 14: 5, 29: 1}
Did not match all atoms present	3741-32-0	C1CS[As](S1)Cl	{17: 1, 11: 2, 41: 2}
Did not match all atoms present	3741-34-2	CCN(CC)P1OCCO1	{1: 2, 2: 2, 11: 2, 33: 1, 23: 2}
Did not match all atoms present	3741-36-4	COP1OCCO1	{1: 1, 11: 2, 22: 1, 23: 2}
Did not match all atoms present	3741-38-6	C1COS(=O)O1	{11: 2, 29: 1, 23: 2}
Did not match all atoms present	3741-77-3	C=CC(=O)OC1=C(C=C(C=C1Br)Br)Br	{14: 2, 18: 3, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	3741-80-8	CC(C)(C)N(SC1=NC2=CC=CC=C2S1)SC3=NC4=CC=CC=C4S3	{1: 3, 35: 2, 4: 1, 33: 1, 40: 2, 41: 2, 14: 8}
Did not match all atoms present	3741-90-0	CC(=NN(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 34: 1, 33: 1, 14: 15, 7: 1}
Did not match all atoms present	37415-47-7	CCCCCCCCC(C)C1=CC=C(C=C1)C(C)CCCCCCCC	{1: 4, 2: 14, 3: 2, 14: 4}
Did not match all atoms present	37415-62-6	CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CCC(=O)[O-])OC.[Na+]	{1: 3, 2: 3, 6: 1, 7: 1, 11: 1, 21: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	37425-13-1	CS(=O)(=O)O.CS(=O)(=O)O.C=CCN1C=NC2=CN=C(N=C21)N3CCN(CC3)CCC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{1: 2, 2: 3, 35: 3, 4: 1, 5: 1, 6: 1, 33: 3, 11: 4, 14: 17, 20: 2, 29: 4}
Did not match all atoms present	3743-07-5	COP(OC)Cl	{1: 2, 22: 2, 17: 1}
Did not match all atoms present	3743-22-4	CN(C)C1=CC=CC=C1O	{1: 2, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	3743-84-8	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N\NC3=CC=C(C=C3)N(C)S(=O)(=O)CCOS(=O)(=O)O)/C2=O)S(=O)(=O)O	{1: 2, 2: 2, 33: 1, 34: 1, 14: 7, 15: 2, 20: 3, 22: 1, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	37430-50-5	CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC(Cl)(Cl)Cl)C	{1: 3, 4: 1, 33: 1, 40: 1, 11: 1, 13: 1, 14: 3, 17: 3, 23: 1, 28: 1}
Did not match all atoms present	37434-59-6	COC(=O)C(C1=CC=CC=C1)C(=O)OC	{1: 2, 3: 1, 28: 2, 14: 5}
Did not match all atoms present	37437-20-0	C1CCC(CC1)N.C1=CC=C2C(=C1)NC(=S)S2	{32: 1, 41: 1, 11: 5, 12: 1, 14: 4, 30: 1}
Did not match all atoms present	37438-00-9	CC1=CC=CC=C1C2=CCCC2	{1: 1, 11: 3, 14: 5, 15: 1}
Did not match all atoms present	3746-01-8	C=CP(C=C)C=C	{5: 3, 6: 3}
Did not match all atoms present	3746-46-1	C1=CC(=CC(=C1)O)NC(=O)NC2=CC(=CC=C2)O	{24: 1, 21: 2, 14: 8, 31: 2}
Did not match all atoms present	3746-67-6	CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)Cl)OC	{1: 2, 14: 3, 17: 1, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	37460-43-8	CCOCCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	37463-94-8	C(C#N)S(=O)(=O)CC#N	{2: 2, 29: 2, 37: 2}
Did not match all atoms present	374633-33-7	CC1=CC=C(C(=O)N1)Br	{32: 1, 1: 1, 18: 1, 14: 2, 25: 1}
Did not match all atoms present	37466-21-0	CC(=O)OC1=CC=CC=C1C(=O)O.C(C[C@@H](C(=O)O)N)CN=C(N)N	{1: 1, 2: 3, 3: 1, 7: 1, 34: 1, 14: 4, 27: 2, 28: 1, 30: 3}
Did not match all atoms present	3747-06-6	CCN1C(=O)C(=CN(C2=CC=CC=C2)C(=O)C)SC1=S	{1: 2, 2: 1, 6: 1, 33: 2, 41: 1, 14: 5, 15: 2, 24: 1, 25: 1}
Did not match all atoms present	37470-46-5	C1=CC(=C(C=C1C(=O)O)I)O	{27: 1, 19: 1, 21: 1, 14: 3}
Did not match all atoms present	37471-00-4	CN1CN(C2=CC=CC3=C2C1=CC=C3)C	{1: 2, 11: 1, 14: 6, 33: 2}
Did not match all atoms present	37473-67-9	CC(=O)C=C(C(F)(F)F)[O-].[Nd+3]	{1: 1, 4: 1, 6: 1, 7: 1, 16: 3, 24: 1}
Did not match all atoms present	37475-01-7	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Tl+].[Tl+3]	{29: 8}
Did not match all atoms present	374791-02-3	C1CN([C@H]1C(=O)O)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{33: 1, 2: 1, 11: 2, 12: 2, 14: 8, 27: 1, 28: 1}
Did not match all atoms present	374791-03-4	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](C4=CC=C(C=C4)F)C(=O)[O-]	{2: 1, 3: 1, 12: 1, 14: 12, 16: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	3748-13-8	CC(=C)C1=CC(=CC=C1)C(=C)C	{1: 2, 5: 2, 14: 4, 7: 2}
Did not match all atoms present	3748-84-3	CC1=CC(=C(N=C1C)C)C	{1: 4, 35: 1, 14: 1}
Did not match all atoms present	37484-40-5	C1CCC(C1)N2C=NC3=C(C2=S)NC=N3	{32: 1, 33: 1, 35: 2, 11: 4, 12: 1, 14: 2}
Did not match all atoms present	37493-31-5	COC(=O)CCC1=CC=CO1	{1: 1, 2: 2, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	37494-03-4	[Li+].CCOC(C)OCC[CH2-]	{1: 2, 2: 3, 3: 1, 5: 1, 22: 2}
Did not match all atoms present	37496-06-3	CN1C=CC=C1C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 8, 33: 1}
Did not match all atoms present	375-63-3	C(C(C(C(F)(F)[Si](Cl)(Cl)Cl)(F)F)(F)F)(F)F	{16: 8, 17: 3, 3: 1, 4: 3}
Did not match all atoms present	375-72-4	C(C(C(F)(F)S(=O)(=O)F)(F)F)(C(F)(F)F)(F)F	{16: 10, 4: 4, 29: 2}
Did not match all atoms present	375-73-5	C(C(C(F)(F)S(=O)(=O)O)(F)F)(C(F)(F)F)(F)F	{16: 9, 20: 1, 4: 4, 29: 2}
Did not match all atoms present	375-81-5	C(C(C(F)(F)F)(F)F)(C(C(F)(F)S(=O)(=O)F)(F)F)(F)F	{16: 12, 4: 5, 29: 2}
Did not match all atoms present	375-92-8	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F	{16: 15, 20: 1, 4: 7, 29: 2}
Did not match all atoms present	3750-18-3	CC(C)C[Sn](CC(C)C)CC(C)C.CC(C)C[Sn](CC(C)C)CC(C)C	{1: 12, 2: 6, 3: 6}
Did not match all atoms present	37509-99-2	CCCCC[CH2-].CCCCC[CH2-].[Mg+2]	{1: 2, 2: 8, 5: 2}
Did not match all atoms present	3751-46-0	C1=CC=C(C=C1)N2C(=NN=N2)SCCC#N	{33: 1, 2: 2, 35: 3, 37: 1, 40: 1, 14: 5}
Did not match all atoms present	3751-48-2	CC1=CC(=CC=C1)CCC(=O)O	{1: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	3751-76-6	CC1=CC=CC2=C1SC(=C2)C=O	{1: 1, 26: 1, 14: 4, 41: 1}
Did not match all atoms present	37512-31-5	C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[Cr+3]	{1: 18, 34: 3}
Did not match all atoms present	37515-76-7	C1=CC(=CC=C1NC2=NC(=NC(=N2)N(CCC#N)CCO)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])N(CCC#N)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 8, 35: 6, 37: 2, 6: 2, 14: 14, 20: 2, 29: 12, 31: 4}
Did not match all atoms present	37517-30-9	CCCC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)C)O)C(=O)C	{1: 4, 2: 4, 3: 2, 14: 3, 20: 1, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	37519-65-6	COC1=CC=CC=C1OCCN=C(N)[NH+]2CCC3=CC(=C(C=C3C2)OC)OC.[Br-]	{1: 3, 2: 2, 7: 1, 11: 3, 34: 1, 14: 6, 18: 1, 22: 4, 30: 1}
Did not match all atoms present	3752-25-8	C1=CC=C(C(=C1)/C=C/C(=O)O)Cl	{17: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	3752-97-4	COC1=CC(=C(C=C1CCl)OC)CCl	{1: 2, 2: 2, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	37526-42-4	CC1=NN(C(=S)N1C)C	{1: 3, 35: 1, 33: 2}
Did not match all atoms present	37526-88-8	CC=C(C)C(=O)OCC1=CC=CC=C1	{1: 2, 2: 1, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	37528-00-0	CC1=C(OC(=S)O1)C	{1: 2, 23: 2}
Did not match all atoms present	37529-27-4	CCCCCCCC1=CC=C(C=C1)N	{1: 1, 2: 6, 30: 1, 14: 4}
Did not match all atoms present	37529-29-6	CCCCCCCCCC1=CC=C(C=C1)N	{1: 1, 2: 8, 30: 1, 14: 4}
Did not match all atoms present	37529-30-9	CCCCCCCCCCC1=CC=C(C=C1)N	{1: 1, 2: 9, 30: 1, 14: 4}
Did not match all atoms present	3753-05-7	C1=CC(=CC=C1C(=O)O)OCCOC2=CC=C(C=C2)C(=O)O	{2: 2, 27: 2, 22: 2, 14: 8}
Did not match all atoms present	3753-50-2	CC(=O)OC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)N)N	{1: 1, 14: 7, 21: 2, 25: 2, 28: 1, 30: 2}
Did not match all atoms present	3753-81-9	C1=CC(=CC=C1C(=O)O)OCCCOC2=CC=C(C=C2)C(=O)O	{2: 3, 27: 2, 22: 2, 14: 8}
Did not match all atoms present	37535-57-2	CC(C)(C)OC(=O)N[C@@H](CC1=CC=NC=C1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	3754-60-7	CC(C)(C1=CC=C(C=C1)OC=C)C2=CC=C(C=C2)OC=C	{1: 2, 4: 1, 5: 2, 6: 2, 14: 8, 22: 2}
Did not match all atoms present	37541-72-3	C(=O)(C(=O)O)O.C(=O)(C(=O)O)O.N.N.O	{27: 4}
Did not match all atoms present	37551-43-2	C1=CC(=C(C=C1Cl)C(=O)NO)O	{14: 3, 17: 1, 20: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	37557-89-4	CCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 20, 14: 5, 17: 1}
Did not match all atoms present	3757-31-1	CCCC(=O)N/N=C(/C1=CC=C(O1)[N+](=O)[O-])\N	{1: 1, 2: 2, 38: 1, 7: 1, 34: 1, 14: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	3757-76-4	C1=CC(=C(C=C1Cl)Cl)[O-].[Na+]	{17: 2, 14: 3}
Did not match all atoms present	3757-88-8	CCCC[Sn](CCCC)(CCCC)C#CC1=CC=CC=C1	{1: 3, 2: 9, 10: 2, 14: 5}
Did not match all atoms present	37571-88-3	C1=CC=C2C3=C4C(=CC2=C1)C(C(C5=CC=CC(=C54)C=C3)O)O	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	37574-47-3	C1=CC=C2C3=C4C(=CC2=C1)C5C(O5)C6=CC=CC(=C64)C=C3	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	37574-48-4	C1=CC=C2C3=C4C(=CC2=C1)C=C(C5=CC=CC(=C54)C=C3)O	{21: 1, 14: 11}
Did not match all atoms present	3758-54-1	CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CCO.OP(=O)(O)[O-]	{1: 3, 2: 21, 20: 3, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	3759-28-2	C1=CC=C(C(=C1)CC#N)C#N	{2: 1, 37: 2, 14: 4}
Did not match all atoms present	3759-61-3	C1=CC=C2C(=C1)C=CC=C2OC(=O)Cl	{17: 1, 28: 1, 14: 7}
Did not match all atoms present	3759-92-0	C1COCCN1CC2CN(C(=O)O2)N=CC3=CC=C(O3)[N+](=O)[O-].Cl	{33: 2, 2: 1, 38: 1, 6: 1, 11: 5, 12: 1, 34: 1, 14: 2, 17: 1, 23: 2, 28: 1}
Did not match all atoms present	37592-72-6	CCCCCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 5, 14: 4}
Did not match all atoms present	37592-87-3	CCCCCC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)CCCCC)[O-]	{1: 2, 2: 8, 33: 1, 34: 1, 14: 8, 29: 1}
Did not match all atoms present	37592-88-4	CCCCCCC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)CCCCCC)[O-]	{1: 2, 2: 10, 33: 1, 34: 1, 14: 8, 29: 1}
Did not match all atoms present	37592-89-5	CCCCCCCC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)CCCCCCC)[O-]	{1: 2, 2: 12, 33: 1, 34: 1, 14: 8, 29: 1}
Did not match all atoms present	37593-02-5	CCCCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 4, 14: 4}
Did not match all atoms present	37593-03-6	CCCCCCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 6, 14: 4}
Did not match all atoms present	37593-05-8	CCCCCCCCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 8, 14: 4}
Did not match all atoms present	37593-06-9	CCCCCCCCCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 9, 14: 4}
Did not match all atoms present	37595-74-7	C1=CC=C(C=C1)N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F	{16: 6, 33: 1, 4: 2, 29: 4, 14: 5}
Did not match all atoms present	37599-83-0	CCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)CCC	{1: 2, 34: 1, 6: 1, 2: 5, 14: 8, 22: 1}
Did not match all atoms present	376-14-7	CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 8, 5: 1, 7: 1, 16: 17, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	37608-29-0	C1=CC=C2C(=C1)C3C(C3(Cl)Cl)C4=CC=CC=C42	{17: 2, 12: 2, 13: 1, 14: 8}
Did not match all atoms present	3761-41-9	CC1=C(C=CC(=C1)OP(=S)(OC)OC)S(=O)C	{1: 4, 22: 3, 14: 3, 29: 1}
Did not match all atoms present	3761-42-0	CC1=C(C=CC(=C1)OP(=S)(OC)OC)S(=O)(=O)C	{1: 4, 22: 3, 14: 3, 29: 2}
Did not match all atoms present	3761-63-5	C1CCCC2=CC=C(CCC1)C=C2	{11: 7, 14: 4}
Did not match all atoms present	3761-92-0	CCCCC[CH2-].[Mg+2].[Br-]	{1: 1, 2: 4, 18: 1, 5: 1}
Did not match all atoms present	37612-52-5	CC(=O)C1=CC(=C(C=C1)OC)Cl	{24: 1, 1: 2, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	37619-24-2	CN1C=CC=C1C(=O)OC	{1: 2, 28: 1, 14: 3, 33: 1}
Did not match all atoms present	3762-25-2	CCOP(=O)(CC1=CC=C(C=C1)C)OCC	{1: 3, 2: 3, 22: 2, 14: 4, 29: 1}
Did not match all atoms present	3762-27-4	CCCCOP(=O)(CC1=CC=CC=C1)OCCCC	{1: 2, 2: 7, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	37620-20-5	C1CCN(C(C1)C2=CN=CC=C2)N=O	{33: 1, 34: 1, 35: 1, 11: 4, 12: 1, 14: 4, 29: 1}
Did not match all atoms present	37622-90-5	CCOC(=O)C1=CNN=C1	{32: 1, 1: 1, 2: 1, 35: 1, 14: 2, 28: 1}
Did not match all atoms present	37627-60-4	CCCCN1CCC(C1)(CC(C)C)C2=CC(=CC=C2)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 6, 3: 1, 4: 1, 33: 1, 11: 3, 13: 1, 14: 4, 20: 1, 21: 1, 27: 3}
Did not match all atoms present	3763-39-1	C=C[Si]1O[Si]O[Si]O[Si]O1.O1[Si]O[Si]O[Si]O[Si]1.O1[Si]O[Si]O[Si]O[Si]1.O1[Si]O[Si]O[Si]O[Si]1.O1[Si]O[Si]O[Si]O[Si]1.O1[Si]O[Si]O[Si]O[Si]1.O1[Si]O[Si]O[Si]O[Si]1	{5: 1, 6: 1, 23: 28}
Did not match all atoms present	3763-72-2	CC(=O)OCCS(=O)(=O)CCOC(=O)C	{1: 2, 2: 4, 28: 2, 29: 2}
Did not match all atoms present	37635-87-3	C1=COC(=S)O1	{14: 2, 23: 2}
Did not match all atoms present	3764-01-0	C1=C(N=C(N=C1Cl)Cl)Cl	{17: 3, 35: 2, 14: 1}
Did not match all atoms present	37640-57-6	C1(=NC(=NC(=N1)N)N)N.C1(=O)NC(=O)NC(=O)N1	{32: 3, 25: 3, 35: 3, 30: 3}
Did not match all atoms present	37640-71-4	CCN(CC)CCCN(C1CC2=CC=CC=C2C1)C3=CC=CC=C3	{1: 2, 2: 5, 33: 2, 11: 2, 12: 1, 14: 9}
Did not match all atoms present	37642-55-0	C1CCC(C1)N2C=NC(=C2N)C(=O)N	{33: 1, 35: 1, 11: 4, 12: 1, 14: 1, 24: 1, 30: 2}
Did not match all atoms present	3765-65-9	CCCCC[Sn](CCCCC)(CCCCC)CCCCC	{1: 4, 2: 16}
Did not match all atoms present	3766-55-0	C=CCNC(=S)NN	{2: 1, 5: 1, 6: 1, 7: 1, 30: 1, 31: 2}
Did not match all atoms present	3766-60-7	CC(C#C)N(C)C(=O)NC1=CC=C(C=C1)Cl	{1: 2, 3: 1, 33: 1, 9: 1, 10: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	3766-81-2	CCC(C)C1=CC=CC=C1OC(=O)NC	{1: 3, 2: 1, 3: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	37660-22-3	CCSC1=NC(=O)C=C(N1)N	{32: 1, 1: 1, 2: 1, 35: 1, 40: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	37661-32-8	C1=CC=C(C=C1)C(C(=O)[O-])N.[K+]	{24: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	3767-28-0	C1=CC(=CC=C1[N+](=O)[O-])O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	{2: 1, 38: 1, 12: 5, 14: 4, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	37672-70-1	C1=CC=C(C=C1)C(=O)OCCN(CCC#N)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl	{33: 1, 2: 4, 37: 1, 38: 1, 34: 2, 14: 11, 17: 2, 28: 1}
Did not match all atoms present	37672-74-5	C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)N(CCOC(=O)C3=CC=CC=C3)CCOC(=O)C4=CC=CC=C4)N=NC5=C(C=C(C=C5)[N+](=O)[O-])Cl	{33: 1, 2: 4, 38: 1, 34: 2, 14: 21, 17: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	37672-83-6	CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)[O-].CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)[O-].[Ba+2]	{1: 2, 34: 4, 35: 2, 33: 2, 12: 2, 14: 18, 15: 2, 25: 2, 29: 6}
Did not match all atoms present	37674-72-9	C1COC2=C(C1=O)C=C(C=C2)Cl	{17: 1, 11: 2, 25: 1, 14: 3, 23: 1}
Did not match all atoms present	37678-79-8	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)O	{34: 3, 14: 14, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	3768-18-1	CC(=O)NC1=NC(=O)N(C=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{1: 1, 2: 1, 35: 1, 33: 1, 12: 4, 14: 2, 20: 3, 23: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	3768-55-6	C[Si](C)(C)NC1=CC=CC=C1	{1: 3, 14: 5, 31: 1}
Did not match all atoms present	3768-56-7	C[Si](C)(C)N1CCCCC1	{1: 3, 11: 5, 33: 1}
Did not match all atoms present	3768-58-9	CN(C)[Si](C)(C)N(C)C	{1: 6, 33: 2}
Did not match all atoms present	3768-60-3	CN(C)S(=O)N(C)C	{1: 4, 29: 1, 33: 2}
Did not match all atoms present	3768-63-6	CN(C)S(=O)(=O)N(C)C	{1: 4, 29: 2, 33: 2}
Did not match all atoms present	37680-65-2	C1=CC=C(C(=C1)C2=C(C=CC(=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	37680-66-3	C1=CC=C(C(=C1)C2=C(C=C(C=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	37680-68-5	C1=CC=C(C(=C1)C2=CC(=CC(=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	37680-69-6	C1=CC(=CC(=C1)Cl)C2=CC(=C(C=C2)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	37680-73-2	C1=CC(=C(C=C1Cl)C2=CC(=C(C=C2Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	37682-29-4	CCCCCCCCOC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 7, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	37682-72-7	CC(C)[C@@H](C(=O)NC(CCCN=C(N)N)C=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)NC(CC1=CC=CC=C1)C(=O)O.Cl.Cl	{1: 2, 2: 7, 3: 5, 7: 2, 34: 2, 14: 5, 17: 2, 24: 3, 26: 1, 27: 1, 30: 4, 31: 4}
Did not match all atoms present	37682-92-1	C1=CC=C2C(=C1)C(=O)C=CS2=O	{25: 1, 29: 1, 14: 6}
Did not match all atoms present	37686-36-5	C1=C[Se]C(=C1)I	{19: 1, 14: 3}
Did not match all atoms present	37686-84-3	CCN(CC)C(=O)NC1CC2C(CC3=CNC4=CC=CC2=C34)N(C1)C	{32: 1, 1: 3, 2: 2, 33: 2, 11: 3, 12: 3, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	37686-85-4	CCN(CC)C(=O)NC1CC2[C@@H](CC3=CNC4=CC=CC2=C34)N(C1)C.C(=C\C(=O)O)\C(=O)O	{32: 1, 1: 3, 2: 2, 6: 2, 33: 2, 11: 3, 12: 3, 14: 4, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	37686-98-9	CC(=O)NC1=C2C(=C(C=C1)[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)[N+](=O)[O-])NC(=O)C	{1: 2, 38: 2, 14: 4, 24: 2, 25: 2, 31: 2}
Did not match all atoms present	37687-24-4	CCOC(=O)C1=CC(=NN1)C(=O)OCC	{32: 1, 1: 2, 2: 2, 35: 1, 14: 1, 28: 2}
Did not match all atoms present	37689-22-8	C1CC(C=C1)C2=CC=CC=C2	{11: 2, 12: 1, 14: 7}
Did not match all atoms present	3769-41-3	C1=CC=C(C=C1)COC2=CC=CC(=C2)O	{2: 1, 22: 1, 21: 1, 14: 9}
Did not match all atoms present	3769-57-1	CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 2: 4, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 20: 2}
Did not match all atoms present	3769-94-6	CCCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{24: 1, 1: 1, 2: 2, 38: 1, 14: 4}
Did not match all atoms present	37697-65-7	CCC(C)N[Si](C)(NC(C)CC)NC(C)CC	{1: 7, 2: 3, 3: 3, 31: 3}
Did not match all atoms present	37699-43-7	CC1=C(C=C[N+](=C1C)[O-])[N+](=O)[O-]	{1: 2, 38: 1, 29: 1, 14: 2, 33: 1}
Did not match all atoms present	3770-48-7	CC1=C2C3=CC=CC=C3NC2=CC=C1	{32: 1, 1: 1, 14: 7}
Did not match all atoms present	3770-50-1	CCOC(=O)C1=CC2=CC=CC=C2N1	{32: 1, 1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	3770-80-7	COC1=CC(=C(C(=C1)OC)C(=O)C2=CC=CC=C2)OC	{24: 1, 1: 3, 22: 3, 14: 7}
Did not match all atoms present	3770-82-9	C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)C3=CC=CC=C3	{24: 2, 14: 14}
Did not match all atoms present	3771-14-0	C1=CC=C2C(=C1)C=C(C=C2O)S(=O)(=O)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	3771-19-5	CC(C)(C(=O)O)OC1=CC=C(C=C1)C2CCCC3=CC=CC=C23	{1: 2, 4: 1, 11: 3, 12: 1, 14: 8, 22: 1, 27: 1}
Did not match all atoms present	3771-31-1	CN(C)C1=CC=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)OC	{1: 3, 34: 2, 35: 1, 33: 1, 41: 1, 14: 7, 22: 1}
Did not match all atoms present	3771-38-8	CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=CC=CC=C2	{1: 1, 2: 4, 33: 1, 34: 2, 14: 8, 20: 2}
Did not match all atoms present	37710-57-9	C1=C(C=C(C(=C1Br)N2C(=O)C3=C(C2=O)C(=C(C(=C3Br)Br)Br)Br)Br)Br	{25: 2, 18: 7, 14: 2, 33: 1}
Did not match all atoms present	37717-68-3	CCN(CCNS(=O)(=O)C)C1=CC=CC(=C1)C	{1: 3, 2: 3, 33: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	37717-82-1	C\1C([NH2+]C(=C/C1=C/C=[N+]2C3=CC(=C(C=C3C=C2C(=O)O)O)O)C(=O)O)C(=O)[O-].OS(=O)(=O)[O-]	{33: 1, 6: 2, 11: 1, 12: 1, 14: 4, 15: 3, 20: 1, 21: 2, 24: 1, 27: 2, 29: 3}
Did not match all atoms present	3772-23-4	CC1=CC(=C(C(=C1)CCCCC2=CC(=CC(=C2O)C)C)O)C	{1: 4, 2: 4, 21: 2, 14: 4}
Did not match all atoms present	3772-42-7	CCCCNC1=CC=C(C=C1)C(=O)OCCN(CC)CC	{1: 3, 2: 7, 33: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	3772-55-2	CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CO)C	{1: 4, 2: 1, 3: 1, 11: 5, 12: 1, 13: 2, 14: 3, 20: 1}
Did not match all atoms present	3772-76-7	CC1=NC(=CC(=N1)OC)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 2, 35: 2, 14: 5, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	3772-94-9	CCCCCCCCCCCC(=O)OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 1, 2: 10, 28: 1, 17: 5}
Did not match all atoms present	3772-95-0	CCCCCCCCCCCC(=O)OCCNC(=O)CS(=O)(=O)[O-].[K+]	{1: 1, 2: 13, 24: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	37721-75-8	CC1=C(C(=C(C(=C1Br)Br)O)Br)Br	{1: 1, 18: 4, 21: 1}
Did not match all atoms present	37723-78-7	CCC(COCCOC1=C(C=C(C(=C1I)NC(=O)C)I)I)C(=O)O	{1: 2, 2: 4, 3: 1, 14: 1, 19: 3, 22: 2, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	37724-43-9	C[NH+]1CCN(CC1)C2CCCC3=C2C4=CN=CN=C4S3.[Cl-]	{1: 1, 35: 2, 33: 1, 41: 1, 11: 7, 12: 1, 14: 2, 17: 1}
Did not match all atoms present	37724-45-1	CC1=CSC2=NC=NC(=C12)N3CCN(CC3)C.Cl	{1: 2, 35: 2, 33: 2, 41: 1, 11: 4, 14: 2, 17: 1}
Did not match all atoms present	37724-47-3	CN1CCN(CC1)C2=C3C=CSC3=NC=N2.Cl	{1: 1, 35: 2, 33: 2, 41: 1, 11: 4, 14: 3, 17: 1}
Did not match all atoms present	37729-44-5	[1H]C1=CCCC1	{11: 3, 14: 2}
Did not match all atoms present	3773-14-6	C1=C(C(=CC(=C1Cl)Cl)Cl)S	{17: 3, 14: 2, 39: 1}
Did not match all atoms present	3773-37-3	CN(C)S(=O)(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)S(=O)(=O)C	{1: 3, 2: 3, 33: 4, 41: 1, 11: 4, 14: 7, 29: 4}
Did not match all atoms present	37732-92-6	CN1C=CN2C1=CC(=C2)C3=CC=C(C=C3)Cl	{1: 1, 33: 2, 14: 8, 17: 1}
Did not match all atoms present	37734-45-5	C1=CC=C(C=C1)CSC(=O)Cl	{24: 1, 17: 1, 2: 1, 14: 5, 40: 1}
Did not match all atoms present	37739-98-3	CCCCP1C=CC=C1	{1: 1, 2: 3, 14: 4}
Did not match all atoms present	37739-99-4	CC1=CP(C=C1C)C	{1: 3, 14: 2}
Did not match all atoms present	3774-99-0	C1=CC=C(C=C1)/C=C/2\C(=O)NC(=O)S2	{32: 1, 6: 1, 41: 1, 14: 5, 15: 1, 25: 2}
Did not match all atoms present	37743-18-3	C[N+](=C1C(CCO1)(C2=CC=CC=C2)C3=CC=CC=C3)C.[Br-]	{1: 2, 33: 1, 11: 2, 13: 1, 14: 10, 15: 1, 18: 1, 23: 1}
Did not match all atoms present	37747-10-7	CCCCCCCCCCCCCC(=O)OCCS(=O)(=O)O	{1: 1, 2: 14, 20: 1, 29: 2, 28: 1}
Did not match all atoms present	3775-01-7	C1=CC=C(C=C1)C=C2C(=O)NC(=O)N2	{32: 2, 25: 2, 14: 5, 6: 1, 15: 1}
Did not match all atoms present	3775-55-1	C1=C(OC(=C1)[N+](=O)[O-])C2=NN=C(O2)N	{38: 1, 35: 2, 30: 1, 14: 2, 23: 2}
Did not match all atoms present	37750-86-0	CC1=C2C3=CC=CC=C3SC2=C(C4=C1SC5=CC=CC=C54)C	{1: 2, 14: 8, 41: 2}
Did not match all atoms present	37753-10-9	CS(=O)(=O)OCCNP1(=O)N(CCCO1)CCCl	{1: 1, 2: 4, 33: 1, 11: 3, 17: 1, 22: 1, 23: 1, 29: 3, 31: 1}
Did not match all atoms present	37755-10-5	CCC[N+](C)(C)C.[OH-]	{1: 4, 2: 2}
Did not match all atoms present	37755-92-3	CC(C)(C)[As]1[As]([As]([As]1C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 4: 4}
Did not match all atoms present	37762-06-4	CCCOC1=CC=CC=C1C2=NC(=O)C3=NNNC3=N2	{32: 2, 1: 1, 2: 2, 35: 3, 14: 4, 22: 1, 25: 1}
Did not match all atoms present	37764-44-6	C1C2CC3CC1CC(C2)(C3)CN=C(CSSCC(=NCC45CC6CC(C4)CC(C6)C5)N)N.C1C2CC3CC1CC(C2)(C3)CN=C(CSSCC(=NCC45CC6CC(C4)CC(C6)C5)N)N.O.Cl.Cl.Cl.Cl	{2: 8, 34: 4, 7: 4, 40: 4, 11: 24, 12: 12, 13: 4, 17: 4, 30: 4}
Did not match all atoms present	3777-12-6	CCC(=O)N/N=C(/C1=CC=C(O1)[N+](=O)[O-])\N	{1: 1, 2: 1, 38: 1, 7: 1, 34: 1, 14: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	3777-69-3	CCCCCC1=CC=CO1	{1: 1, 2: 4, 14: 3, 23: 1}
Did not match all atoms present	3777-70-6	CCCCCCC1=CC=CO1	{1: 1, 2: 5, 14: 3, 23: 1}
Did not match all atoms present	3777-71-7	CCCCCCCC1=CC=CO1	{1: 1, 2: 6, 14: 3, 23: 1}
Did not match all atoms present	37773-21-0	CC1=CC=CC=C1[Se]	{1: 1, 14: 4}
Did not match all atoms present	37773-42-5	CC[Se]C1=CC=CC=C1C	{1: 2, 2: 1, 14: 4}
Did not match all atoms present	37773-43-6	CC[Se]C1=CC=C(C=C1)C	{1: 2, 2: 1, 14: 4}
Did not match all atoms present	37773-49-2	CC(C)OP(OC(C)C)OC(C)C.CC(C)OP(OC(C)C)OC(C)C.C1=CC=NC=C1.C1=CC=NC=C1.[Cl-].[Cl-].[Cl-].[Cl-].[Pt+2].[Pt+2]	{1: 12, 3: 6, 14: 10, 17: 4, 35: 2, 22: 6}
Did not match all atoms present	37777-76-7	C1=CC(=C(C(=C1)Cl)CC(=O)O)F	{16: 1, 17: 1, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	37778-99-7	C[C@H](CO)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	3778-73-2	C1CN(P(=O)(OC1)NCCCl)CCCl	{33: 1, 2: 4, 11: 3, 17: 2, 23: 1, 29: 1, 31: 1}
Did not match all atoms present	3778-76-5	CCOC(=O)NNC1=NN=CC2=CC=CC=C21.Cl	{1: 1, 2: 1, 35: 2, 14: 5, 17: 1, 28: 1, 31: 2}
Did not match all atoms present	37780-79-3	C1=CC=C2C(=C1)C=C(O2)C=CC3=CC=C(C=C3)C#N	{37: 1, 14: 9, 6: 2, 23: 1}
Did not match all atoms present	37784-63-7	CCOC(=O)CC1=CSC=C1	{1: 1, 2: 2, 28: 1, 14: 3, 41: 1}
Did not match all atoms present	37789-64-3	CCOC(=O)C1=C(C(=C(N1)C)CCC(=O)O)C	{32: 1, 1: 3, 2: 3, 27: 1, 28: 1}
Did not match all atoms present	3779-03-1	COC1=C2C(=CC3=C1OCC3)C=CC(=O)O2	{1: 1, 11: 2, 14: 3, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	3779-45-1	CC[N+](CC)(CC)CCCN1C=CC(=C[NH+]=O)C=C1.[Br-].[Br-]	{1: 3, 2: 6, 6: 1, 33: 1, 14: 4, 15: 1, 18: 2, 29: 1, 31: 1}
Did not match all atoms present	37790-23-1	C1=CC=C(C=C1)N=NC2=CC=CC=C2[N+](=O)[O-]	{34: 2, 38: 1, 14: 9}
Did not match all atoms present	37795-69-0	C1CON2C1=NC3=CC=CC=C3C2=O	{33: 1, 35: 1, 11: 2, 14: 4, 23: 1, 25: 1}
Did not match all atoms present	37795-71-4	CC1CON2C1=NC3=CC=CC=C3C2=O	{1: 1, 35: 1, 33: 1, 11: 1, 12: 1, 14: 4, 23: 1, 25: 1}
Did not match all atoms present	378-76-7	C(=O)(C(C(F)(F)F)(F)F)[O-].[K+]	{16: 5, 24: 1, 4: 2}
Did not match all atoms present	378-77-8	C(=O)(C(C(F)(F)F)(F)F)[O-].[Na+]	{16: 5, 24: 1, 4: 2}
Did not match all atoms present	3780-50-5	CCCCCCCCOC1=CC=C(C=C1)O	{1: 1, 2: 7, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	37806-29-4	CCOC1=CC=CC=C1CN	{1: 1, 2: 2, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	37809-19-1	O.O.[O-]P(=O)([O-])F.[Ca+2]	{16: 1, 29: 3}
Did not match all atoms present	3781-28-0	CCC(=O)C1(CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F)N3CCCCC3	{1: 1, 2: 4, 33: 2, 11: 9, 13: 1, 14: 4, 16: 1, 24: 2}
Did not match all atoms present	3782-00-1	CC1=C(OC2=CC=CC=C12)C	{1: 2, 14: 4, 23: 1}
Did not match all atoms present	3782-84-1	C[Si](C)(C)OC1=CC=CC(=C1)C(=O)O[Si](C)(C)C	{1: 6, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	37820-01-2	CC1=C/C(=N/NC2=CC=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])/C(=O)C=C1.[Na+]	{1: 1, 34: 3, 14: 11, 15: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	37826-18-9	CC(C)[Se][Se]C(C)C	{1: 4, 3: 2}
Did not match all atoms present	37828-01-6	C1=C(C=C(C=C1S(=O)(=O)Cl)S(=O)(=O)Cl)C(=O)Cl	{24: 1, 17: 3, 29: 4, 14: 3}
Did not match all atoms present	3783-65-1	C1=CC=C(C=C1)/C=C/C2=CC=CS2	{41: 1, 14: 8, 6: 2}
Did not match all atoms present	37830-21-0	CN1CCC(CC1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O	{1: 1, 4: 1, 33: 1, 11: 8, 12: 2, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	37830-90-3	CC1=C(OC(=O)O1)C	{1: 2, 28: 2}
Did not match all atoms present	37831-57-5	CC1=CC(=O)OC2=C1C=CC(=O)O2	{1: 1, 28: 2, 14: 3}
Did not match all atoms present	37831-60-0	CC1=CC(=O)OC2=C1C(=CC(=O)O2)C	{1: 2, 28: 2, 14: 2}
Did not match all atoms present	37831-70-2	CC(=CCC1=C(C=CC2=C1O[C@@H]3[C@H]2COC4=C3C=CC(=C4)O)O)C	{1: 2, 2: 1, 6: 1, 7: 1, 11: 1, 12: 2, 14: 5, 21: 2, 23: 2}
Did not match all atoms present	37832-65-8	CC1CC(CC(C1)(C)C)OC(=O)C2=CC=CC=C2C(=O)OC3CC(CC(C3)(C)C)C	{1: 6, 11: 6, 12: 4, 13: 2, 14: 4, 28: 2}
Did not match all atoms present	3784-03-0	C1=C(C=C(C(=C1Cl)[O-])Cl)Cl.[Na+]	{17: 3, 14: 2}
Did not match all atoms present	37841-17-1	CC(C)CC[N+](CCC(C)C)(CCC(C)C)CCC(C)C	{1: 8, 2: 8, 3: 4}
Did not match all atoms present	37843-11-1	C1C2CC3CC1CC(C2)(C3)CC[Si](Cl)(Cl)Cl	{17: 3, 2: 2, 11: 6, 12: 3, 13: 1}
Did not match all atoms present	37843-12-2	C[Si](CCC12CC3CC(C1)CC(C3)C2)(Cl)Cl	{1: 1, 2: 2, 11: 6, 12: 3, 13: 1, 17: 2}
Did not match all atoms present	37845-14-0	C1CC2=C(C3=CC=CC=C31)C(=O)OC2=O	{11: 2, 28: 2, 14: 4, 15: 2}
Did not match all atoms present	37847-87-3	C1=CC=C(C=C1)N=C(N)SSC(=NC2=CC=CC=C2)N	{40: 2, 34: 2, 30: 2, 14: 10, 7: 2}
Did not match all atoms present	3785-01-1	CC[N+]1=CC=CC=C1C=CC2=CC=C(C=C2)N(C)C.[I-]	{1: 3, 2: 1, 6: 2, 33: 2, 14: 8, 19: 1}
Did not match all atoms present	3785-21-5	CCCCNCC(=O)NC1=C(C=CC=C1Cl)C	{1: 2, 2: 4, 14: 3, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	3785-90-8	C1=CC(=CC=C1C=C(C#N)C#N)O	{37: 2, 21: 1, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	37853-59-1	C1=C(C=C(C(=C1Br)OCCOC2=C(C=C(C=C2Br)Br)Br)Br)Br	{2: 2, 22: 2, 18: 6, 14: 4}
Did not match all atoms present	3786-08-1	CC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC(=C(C(=C2)I)O)I)C(=O)O	{1: 1, 2: 2, 3: 2, 14: 7, 19: 2, 21: 1, 24: 2, 27: 1, 31: 2}
Did not match all atoms present	37865-86-4	CCOC1=CC2=C(C=C1)C=CN2	{32: 1, 1: 1, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	37868-26-1	C1C(CC2=CC=CC=C21)CC(=O)O	{27: 1, 2: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	37872-12-1	CC(C)(C)C(C)(C)C1=CC=CC=C1	{1: 5, 4: 2, 14: 5}
Did not match all atoms present	37873-04-4	CC1=C(C=CC(=C1)N(CCC2=CC=CC=C2)CCOC(=O)NC3=CC(=C(C=C3)Cl)Cl)C=C(C#N)C#N	{1: 1, 2: 4, 33: 1, 6: 1, 7: 1, 14: 11, 17: 2, 28: 1, 37: 2, 31: 1}
Did not match all atoms present	37877-95-5	C1CC2=CN=C(CCC3=CC=C1C=C3)C=C2	{35: 1, 11: 4, 14: 7}
Did not match all atoms present	3788-61-2	CCCCCCCCCCCCC1=CC2=CC=CC=C2C3=CC=CC=C31	{1: 1, 2: 11, 14: 9}
Did not match all atoms present	37881-98-4	C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=CC=C3N4C(=O)C5=CC=CC=C5C4=O	{25: 4, 14: 12, 33: 2}
Did not match all atoms present	37885-41-9	CCC(=O)C1=C(C=C(C=C1)Cl)Cl	{24: 1, 1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	3789-74-0	C1=CC=C(C=C1)NN=C2C=CC(=O)C(=NNC3=CC=CC=C3)C2=O	{25: 2, 34: 2, 14: 12, 31: 2}
Did not match all atoms present	3789-77-3	CN(C)C1=CC=C(C=C1)N=NC2=CC(=CC=C2)Cl	{1: 2, 34: 2, 33: 1, 14: 8, 17: 1}
Did not match all atoms present	37893-02-0	C1=CC=C(C=C1)N=C2N(C(=NC(F)(F)F)C(=NC(F)(F)F)S2)C3=CC=CC=C3	{33: 1, 34: 3, 4: 2, 41: 1, 14: 10, 15: 3, 16: 6}
Did not match all atoms present	37894-46-5	COCCO[Si](CCCl)(OCCOC)OCCOC	{1: 3, 2: 8, 22: 6, 17: 1}
Did not match all atoms present	37895-73-1	COC1=CC(=C(C=C1OC)Br)Br	{1: 2, 18: 2, 22: 2, 14: 2}
Did not match all atoms present	37899-63-1	C[Si](C)C.C[Ge](C)C1=CC=CC=C1	{1: 5, 14: 5}
Did not match all atoms present	379-34-0	CCC1(C(=O)NC(=O)NC1=O)C2=CC=C(C=C2)O	{32: 2, 1: 1, 2: 1, 13: 1, 14: 4, 21: 1, 25: 3}
Did not match all atoms present	379-50-0	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)F	{16: 1, 14: 15}
Did not match all atoms present	379-52-2	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)F	{16: 1, 14: 15}
Did not match all atoms present	37902-58-2	C1=CC=C(C=C1)NC(=O)C=CC(=O)O	{24: 1, 27: 1, 14: 5, 6: 2, 31: 1}
Did not match all atoms present	37904-72-6	CN(C)C1=CC=C(C=C1)C(=O)CBr	{1: 2, 2: 1, 33: 1, 14: 4, 18: 1, 24: 1}
Did not match all atoms present	37905-22-9	CC1=CC=C(C=C1)[Si]23OCCN(CCO2)CCO3	{1: 1, 11: 6, 33: 1, 14: 4, 23: 3}
Did not match all atoms present	37908-98-8	COC1=C(C=C(C=C1)C(=O)OC)Cl	{1: 2, 28: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	37909-95-8	CCCCC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 2: 3, 14: 9}
Did not match all atoms present	37912-85-9	CC(C)(C)C1=CC(=P(C(=C1)C(C)(C)C)(OC)OC)C(C)(C)C	{1: 11, 4: 3, 22: 2, 14: 2, 15: 3}
Did not match all atoms present	3792-50-5	C([C@@H](C(=O)[O-])N)C(=O)[O-].[Na+].[Na+]	{24: 2, 2: 1, 3: 1, 30: 1}
Did not match all atoms present	3792-59-4	CCOP(=S)(C1=CC=CC=C1)OC2=C(C=C(C=C2)Cl)Cl	{1: 1, 2: 1, 22: 2, 14: 8, 17: 2}
Did not match all atoms present	37920-25-5	CCCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 3, 14: 4}
Did not match all atoms present	37921-74-7	CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC=CC2=C1NC=C2C3(C4=CC=CC5=C4C(=CC=C5)C(=O)O3)C6=CNC7=C6C=CC=C7C(=O)O	{32: 2, 1: 1, 2: 15, 13: 1, 14: 14, 27: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	37924-13-3	CC1=C(C=CC(=C1)S(=O)(=O)C2=CC=CC=C2)NS(=O)(=O)C(F)(F)F	{1: 1, 4: 1, 14: 8, 16: 3, 29: 4, 31: 1}
Did not match all atoms present	37936-41-7	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=NC4C(=O)NC(=O)NC4=O)S(=O)(=O)O	{32: 2, 1: 1, 34: 2, 35: 1, 41: 1, 12: 1, 14: 6, 20: 1, 25: 3, 29: 2}
Did not match all atoms present	3794-15-8	C1=CC=C(C=C1)CC2=CC=CC=C2F	{16: 1, 2: 1, 14: 9}
Did not match all atoms present	3794-64-7	C(=O)(C(C(C(F)(F)F)(F)F)(F)F)[O-].[Ag+]	{16: 7, 24: 1, 4: 3}
Did not match all atoms present	37940-57-1	CCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 14: 9}
Did not match all atoms present	37942-01-1	COC1=C(C=C(C=C1)Br)O	{1: 1, 18: 1, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	37942-55-5	C[C@@H](C1=C(C=CC(=C1OC)OC)[N+](=O)[O-])O	{1: 3, 3: 1, 38: 1, 14: 2, 20: 1, 22: 2}
Did not match all atoms present	37943-90-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=N3	{35: 1, 14: 14}
Did not match all atoms present	3795-76-4	CC1=C(C=CC(=C1)SC)O	{40: 1, 1: 2, 21: 1, 14: 3}
Did not match all atoms present	3795-79-7	COC(=O)C1=CC=C(C=C1)SC	{40: 1, 1: 2, 28: 1, 14: 4}
Did not match all atoms present	37951-49-8	CCC(=O)C1=CC(=CC=C1)OC	{24: 1, 1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	37953-21-2	CCCCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCC1CO1.C=CC1=CC=CC=C1	{1: 4, 2: 4, 5: 4, 6: 2, 7: 2, 11: 1, 12: 1, 14: 5, 23: 1, 28: 3}
Did not match all atoms present	37958-13-7	C1=CC=C2C(=C1)C3=C([Se]2)C=CS3	{41: 1, 14: 6}
Did not match all atoms present	3796-23-4	C1=CC(=CN=C1)C(F)(F)F	{16: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	3796-24-5	C1=CN=CC=C1C(F)(F)F	{16: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	37966-23-7	CCN(CC)CC.C/C(=C\C1=[N+](C2=CC=CC=C2S1)CCCCS(=O)(=O)[O-])/C=C/3\N(C4=CC=CC=C4S3)CCCCS(=O)(=O)O	{1: 4, 2: 11, 33: 3, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	37971-99-6	C[NH+](C)CC(=O)C1=CC2=C(C=C1)OC3=C(C2)C=C(C=C3)C(=O)C[NH+](C)C.[Cl-].[Cl-]	{1: 4, 2: 2, 11: 1, 14: 6, 17: 2, 23: 1, 24: 2}
Did not match all atoms present	3798-86-5	C1=CC=C(C(=C1)CSC2=NC=NC3=C2NC=N3)F	{32: 1, 2: 1, 35: 3, 40: 1, 14: 6, 16: 1}
Did not match all atoms present	37981-00-3	C1=CC=C(C=C1)NC=C2C=CC=CC2=O.[Co]	{25: 1, 31: 1, 14: 9, 6: 1, 15: 1}
Did not match all atoms present	37994-82-4	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC=C5O)C=C2	{21: 1, 14: 11}
Did not match all atoms present	38002-45-8	C[Si](C)(C)C#CCBr	{1: 3, 2: 1, 18: 1, 10: 2}
Did not match all atoms present	38003-95-1	C[Si](C)(C)[As](C1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 14: 10}
Did not match all atoms present	38010-72-9	CC(C)(C)[CH2-].CC(C)(C)[CH2-].CC(C)(C)[CH2-].CC(C)(C)[CH2-].[Zr+4]	{1: 12, 4: 4, 5: 4}
Did not match all atoms present	38011-25-5	C(CNCC(=O)[O-])NCC(=O)[O-].[Na+].[Na+]	{24: 2, 2: 4, 31: 2}
Did not match all atoms present	38020-69-8	CNCC1=CC=C(C=C1)N	{1: 1, 2: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	38026-46-9	CCOC(=O)C1=CNC(=S)NC1=O	{32: 2, 1: 1, 2: 1, 14: 1, 25: 1, 28: 1}
Did not match all atoms present	38028-67-0	CCOC1=NC=CN=C1	{1: 1, 2: 1, 35: 2, 22: 1, 14: 3}
Did not match all atoms present	38028-70-5	CCC1=NC=CN=C1CC(C)C	{1: 3, 2: 2, 3: 1, 14: 2, 35: 2}
Did not match all atoms present	38031-78-6	CC(C)(C)C1=CN=CC=C1	{1: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	38035-28-8	CC1=C(OC2=C(C1=O)C=CC(=C2C[NH+](C)C)OC)C.[Cl-]	{1: 5, 2: 1, 14: 2, 17: 1, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	3804-23-7	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Sc+3]	{24: 3, 1: 3}
Did not match all atoms present	3804-89-5	C1=CN=CC=C1C(=O)NNCS(=O)(=O)[O-].[Na+]	{2: 1, 35: 1, 14: 4, 24: 1, 29: 3, 31: 2}
Did not match all atoms present	38048-32-7	C1=CC(=CC=C1CSC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)[N+](=O)[O-]	{33: 1, 2: 2, 35: 3, 38: 1, 40: 1, 12: 4, 14: 6, 20: 3, 23: 1}
Did not match all atoms present	38048-87-2	CC1=C(C2=C(C=C1)C3=CC=CC4=C3C2=CC=C4)C	{1: 2, 14: 8}
Did not match all atoms present	3805-65-0	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)Br	{1: 2, 18: 1, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	38051-10-4	C(CCl)OP(=O)(OCCCl)OCC(COP(=O)(OCCCl)OCCCl)(CCl)CCl	{17: 6, 2: 12, 4: 1, 29: 2, 22: 6}
Did not match all atoms present	38051-57-9	CCCCCCCCCC[Si](C)(C)Cl	{1: 3, 2: 9, 17: 1}
Did not match all atoms present	38053-99-5	CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.CC1(C2CCC1(C(=O)C2=C(C(F)(F)F)O)C)C.[Pr]	{1: 9, 4: 3, 7: 3, 11: 6, 12: 3, 13: 6, 15: 3, 16: 9, 20: 3, 25: 3}
Did not match all atoms present	38054-03-4	CC1(C2(C(=O)/C(=C(/[O-])\C(F)(F)F)/C1CC2)C)C.CC1(C2(C(=O)/C(=C(/[O-])\C(F)(F)F)/C1CC2)C)C.CC1(C2(C(=O)/C(=C(/[O-])\C(F)(F)F)/C1CC2)C)C.[Yb+3]	{1: 9, 4: 3, 7: 3, 11: 6, 12: 3, 13: 6, 15: 3, 16: 9, 25: 3}
Did not match all atoms present	38056-88-1	C=CC(=O)OCCOC(=O)C1=CC=CC=C1C(=O)OCCO	{2: 4, 5: 1, 6: 1, 14: 4, 20: 1, 28: 3}
Did not match all atoms present	38063-40-0	CC=[SiH2]	{1: 1, 6: 1}
Did not match all atoms present	38064-90-3	CC1=C(C=C(C=C1)OC)OC	{1: 3, 22: 2, 14: 3}
Did not match all atoms present	38066-16-9	CCOP(=O)(CSC1=CC=CC=C1)OCC	{1: 2, 2: 3, 40: 1, 14: 5, 22: 2, 29: 1}
Did not match all atoms present	3807-38-3	C1=CSC=C1SC2=CSC=C2	{40: 1, 41: 2, 14: 6}
Did not match all atoms present	3807-53-2	C1=CSC2=C1S(=O)(=O)C3=C2SC=C3	{41: 2, 29: 2, 14: 4}
Did not match all atoms present	3807-77-0	C1CC2=C(C=CC3=C2C1=CC=C3)[N+](=O)[O-]	{11: 2, 38: 1, 14: 5}
Did not match all atoms present	38076-82-3	CC1=C(C(=NC=C1)N)C(=O)O	{1: 1, 27: 1, 30: 1, 14: 2, 35: 1}
Did not match all atoms present	38078-09-0	CCN(CC)S(F)(F)F	{16: 3, 1: 2, 2: 2, 33: 1}
Did not match all atoms present	3808-20-6	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C3=NC(=O)C4=CC=CC=C4O3	{1: 1, 35: 1, 14: 12, 23: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	3808-86-4	CC1=CC(=C(C=C1)C)SSC2=C(C=CC(=C2)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	3808-87-5	C1=C(C(=CC(=C1Cl)Cl)Cl)SSC2=CC(=C(C=C2Cl)Cl)Cl	{40: 2, 17: 6, 14: 4}
Did not match all atoms present	38082-88-1	C1=CC(=NC(=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{35: 1, 38: 6, 14: 7, 31: 2}
Did not match all atoms present	38082-89-2	C1=C(C=C(C(=C1[N+](=O)[O-])NC2=C(C=C(C(=N2)NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{35: 1, 38: 8, 14: 5, 31: 2}
Did not match all atoms present	38083-17-9	CC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl	{1: 3, 3: 1, 4: 1, 33: 1, 14: 7, 17: 1, 35: 1, 22: 1, 24: 1}
Did not match all atoms present	38087-02-4	CC(=O)C(=O)CC1=CC=CC=C1	{24: 2, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	38094-02-9	CCCCCCCCCCCC[N+](C)(C)CC=CO.[Cl-]	{1: 3, 2: 12, 20: 1, 6: 2, 17: 1}
Did not match all atoms present	381-59-9	B(OC)(F)F	{16: 2, 1: 1, 22: 1}
Did not match all atoms present	381-60-2	B(F)(F)SC	{16: 2, 1: 1, 40: 1}
Did not match all atoms present	3810-26-2	C1CC(=O)C=C1C2=CC=CC=C2	{25: 1, 11: 2, 14: 6, 15: 1}
Did not match all atoms present	3810-39-7	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)[O-])NN=C3C(=CC4=CC(=CC(=C4C3=O)NN=C5C(=CC6=CC(=CC(=C6C5=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 10, 15: 4, 21: 2, 25: 2, 29: 18, 31: 2}
Did not match all atoms present	3810-51-3	CC1=CC(=NNC2=CC=C(C=C2)C(=O)O)C(=O)C=C1C	{1: 2, 34: 1, 14: 6, 15: 3, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	3810-74-0	C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(C=O)O.C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(C=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O	{1: 4, 2: 2, 34: 4, 7: 4, 12: 28, 13: 2, 20: 20, 22: 4, 23: 4, 26: 2, 29: 6, 30: 8, 31: 2}
Did not match all atoms present	3810-81-9	C[Hg]OS(=O)(=O)O[Hg]C	{1: 2, 29: 2, 22: 2}
Did not match all atoms present	38103-05-8	CC(C)(C1=CC=C(C=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O)C3=CC=C(C=C3)OC4=CC(=C(C=C4)C(=O)O)C(=O)O	{1: 2, 27: 4, 4: 1, 22: 2, 14: 14}
Did not match all atoms present	38103-06-9	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)OC6=O	{1: 2, 4: 1, 22: 2, 14: 14, 28: 4}
Did not match all atoms present	38103-07-0	CC1=CC(=C(C(=C1C(=O)OC)O)Cl)O	{1: 2, 28: 1, 21: 2, 14: 1, 17: 1}
Did not match all atoms present	38105-25-8	CC(=O)N(C1=CC=CC2=CC=CC=C21)OC(=O)C	{24: 1, 1: 2, 28: 1, 14: 7, 33: 1}
Did not match all atoms present	3811-04-9	[O-]Cl(=O)=O.[K+]	{17: 1, 29: 3}
Did not match all atoms present	3811-06-1	CCOC(=O)NC1=CC=C(C=C1)C2=[N+](C3=C(C=C(C=C3)N)C4=CC=CC=C42)C.CCS(=O)(=O)[O-]	{1: 3, 2: 2, 33: 1, 14: 11, 28: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	3811-10-7	CC[N+](C)(CC)CCN(C)C(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-]	{1: 4, 2: 4, 4: 1, 33: 1, 14: 10, 18: 1, 20: 1, 24: 1}
Did not match all atoms present	3811-25-4	CC(C)NCC(C1=CC=CC=C1Cl)O	{1: 2, 2: 1, 3: 2, 14: 4, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	3811-49-2	COP1(=S)OCC2=CC=CC=C2O1	{1: 1, 11: 1, 22: 1, 14: 4, 23: 2}
Did not match all atoms present	3811-73-2	[H].[Na].[O-][n+]1ccccc1S	{33: 1, 29: 1, 14: 4, 39: 1}
Did not match all atoms present	38116-61-9	CC1=CC=C(C(=O)N1)C(=O)O	{32: 1, 1: 1, 27: 1, 14: 2, 25: 1}
Did not match all atoms present	38119-08-3	C1=CC=C(C=C1)C(=O)C2=CC3=CC=CC=C3C=C2C(=O)O	{24: 1, 27: 1, 14: 11}
Did not match all atoms present	3812-32-6	O=C([O-])[O-]	{24: 1}
Did not match all atoms present	38120-06-8	CC(C)CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 38: 1, 14: 4, 28: 1}
Did not match all atoms present	38122-80-4	CCCCCCCCCCCCCCCCCCOC1=CC2=C(C=C(C(=C2C=C1)O)C(=O)O)C3(C4=CC=CC5=C4C(=CC=C5)C(=O)O3)C6=CC(=C(C7=CC=CC=C76)O)C(=O)OC	{1: 2, 2: 17, 13: 1, 14: 15, 21: 2, 22: 1, 27: 1, 28: 2}
Did not match all atoms present	38122-81-5	CCCCCCCCCCCCCCCCCCOC1=CC2=C(C=C(C(=C2C=C1)O)C(=O)O)C3(C4=CC=CC5=C4C(=CC=C5)C(=O)O3)C6=CC(=C(C7=CC=CC=C76)O)C(=O)O	{1: 1, 2: 17, 13: 1, 14: 15, 21: 2, 22: 1, 27: 2, 28: 1}
Did not match all atoms present	38125-00-7	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 4, 29: 9, 14: 19, 31: 1}
Did not match all atoms present	3813-05-6	C1=CC2=C(C(=C1)Cl)N(C(=O)S2)CC(=O)O	{33: 1, 2: 1, 41: 1, 14: 3, 17: 1, 25: 1, 27: 1}
Did not match all atoms present	3813-08-9	C1=CC(=C(C(=C1)Cl)N)CC2=C(C(=CC=C2)Cl)N	{17: 2, 2: 1, 30: 2, 14: 6}
Did not match all atoms present	3813-13-6	C1=CC(=C(C(=C1)Cl)N)CC2=CC(=C(C=C2)N)Cl	{17: 2, 2: 1, 30: 2, 14: 6}
Did not match all atoms present	3813-69-2	CCCC(C)OS(=O)(=O)C1=CC=C(C=C1)C	{1: 3, 2: 2, 3: 1, 14: 4, 22: 1, 29: 2}
Did not match all atoms present	38133-90-3	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N\NC3=CC=CC=C3[N+](=O)[O-])C(=O)NC4=CC5=C(C=C4)NC(=O)N5	{32: 2, 34: 1, 38: 1, 14: 12, 15: 2, 24: 1, 25: 2, 31: 2}
Did not match all atoms present	38134-93-9	C1=CC2=C(C=CC(=C2O)C(=O)O)C=C1O	{27: 1, 21: 2, 14: 5}
Did not match all atoms present	38134-94-0	CCCCCCCCCCCCCCCCCCOC1=CC2=C(C=C1)C(=C(C=C2)C(=O)O)O	{1: 1, 2: 17, 14: 5, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	38135-31-8	CC(C)(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C(C)(C)C)Cl	{1: 6, 4: 2, 14: 8, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	3815-20-1	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N	{24: 1, 30: 1, 14: 9}
Did not match all atoms present	3815-31-4	CC(=O)/C=C/C1=CC=C(C=C1)Br	{24: 1, 1: 1, 18: 1, 14: 4, 6: 2}
Did not match all atoms present	3815-83-6	C1=CC=C(C=C1)C2=C(ON=[N+]2C3=CC=CC=C3)[O-]	{33: 1, 35: 1, 14: 10, 23: 1}
Did not match all atoms present	38151-26-7	[B]1N(CCN1C)C	{1: 2, 11: 2, 33: 2}
Did not match all atoms present	38151-74-5	CC1=CC=C(C=C1)N(C)N=CC2=[N+](C3=CC=CC=C3C2(C)C)C.[Cl-]	{1: 5, 34: 1, 6: 1, 33: 2, 13: 1, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	38157-00-5	C1=CC2=C(C=CC3=C2C(=C1)C(=O)C4=C3C=CC(=C4)[N+](=O)[O-])C5=C6C=CC=C7C6=C(C=C5)C8=C(C7=O)C=C(C=C8)[N+](=O)[O-]	{25: 2, 38: 2, 14: 16}
Did not match all atoms present	38157-01-6	C1=CC2=C(C=CC3=C2C(=C1)C(=O)C4=C3C=CC(=C4)N)C5=C6C=CC=C7C6=C(C=C5)C8=C(C7=O)C=C(C=C8)N	{25: 2, 30: 2, 14: 16}
Did not match all atoms present	38166-06-2	C[Si](C)(C)OCC1(CCOC1=O)O[Si](C)(C)C	{1: 6, 2: 1, 11: 2, 13: 1, 22: 2, 28: 1}
Did not match all atoms present	38170-80-8	C[Si](C)(C)C#CC1=CC(=CC=C1)C#C[Si](C)(C)C	{1: 6, 10: 4, 14: 4}
Did not match all atoms present	38177-07-0	C1=C(C=C(C=C1C(=O)N)[N+](=O)[O-])C(=O)N	{24: 2, 38: 1, 30: 2, 14: 3}
Did not match all atoms present	38178-38-0	C1=CC2=C(C(=C1)Cl)OC3=C(O2)C(=CC=C3)Cl	{17: 2, 14: 6, 23: 2}
Did not match all atoms present	38178-99-3	C1C2=C(C(=CC(=C2Cl)Cl)Cl)OC3=C1C(=C(C=C3Cl)Cl)Cl	{17: 6, 11: 1, 14: 2, 23: 1}
Did not match all atoms present	3818-37-9	CC(COC1=CC=CC=C1)NN	{1: 1, 2: 1, 3: 1, 14: 5, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	3818-54-0	CC1=CC(=CC(=C1SC2=C(C=C(C=C2C)O)C(C)(C)C)C(C)(C)C)O	{40: 1, 1: 8, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	3818-69-7	CCCCCCCCCCCCOC(=O)C[N+](C)(C)CCCCCC[N+](C)(C)CC(=O)OCCCCCCCCCCCC.[Cl-].[Cl-]	{1: 6, 2: 30, 28: 2, 17: 2}
Did not match all atoms present	3818-70-0	CCCNCCCCCNC1=C2C(=CC(=C1)OC)C=CC=N2.OP(=O)(O)O	{1: 2, 2: 7, 35: 1, 14: 5, 20: 3, 22: 1, 29: 1, 31: 2}
Did not match all atoms present	3818-88-0	C[N+]1(CCCC1)CCC(C2CCCCC2)(C3=CC=CC=C3)O.[Cl-]	{1: 1, 2: 2, 4: 1, 11: 9, 12: 1, 14: 5, 17: 1, 20: 1}
Did not match all atoms present	3818-90-4	C1=CC(=CC=C1CCCCCOC(=O)CCC(=O)O)Cl	{17: 1, 2: 7, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	38183-12-9	C1=CC=C(C=C1)C2=COC3(C2=O)C4=CC=CC=C4C(=O)O3	{13: 1, 14: 10, 15: 1, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	38185-06-7	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])S(=O)(=O)[O-].[K+]	{17: 1, 38: 2, 29: 3, 14: 2}
Did not match all atoms present	3819-00-9	CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCC(CC4)CCO	{1: 1, 2: 5, 33: 2, 41: 1, 11: 4, 12: 1, 14: 7, 20: 1, 24: 1}
Did not match all atoms present	3819-12-3	CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)[O-])C=C/C(=N/NC3=C(C(=CC(=C3Cl)Cl)Cl)O)/C2=O.[Na+]	{1: 1, 34: 1, 14: 5, 15: 1, 17: 3, 21: 1, 24: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	3819-88-3	C1=C(C=C(C=C1F)I)[N+](=O)[O-]	{16: 1, 19: 1, 38: 1, 14: 3}
Did not match all atoms present	38194-50-2	CC1=C(C2=C(C1=CC3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)O	{1: 2, 2: 1, 6: 1, 14: 7, 15: 3, 16: 1, 27: 1, 29: 1}
Did not match all atoms present	38198-35-5	CCCCCOC1=CC=CC(=C1)NC(=O)O[C@@H]2CCCC[C@H]2[NH+]3CCCC3.[Cl-]	{1: 1, 2: 4, 11: 8, 12: 2, 14: 4, 17: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	38198-81-1	C1CO[Si]2(OCCN1CCO2)F	{16: 1, 33: 1, 11: 6, 23: 3}
Did not match all atoms present	38199-50-7	COC(=O)CCCCCCCC1=CC=CO1	{1: 1, 2: 7, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	3820-53-9	COP(=O)(OC)SC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 38: 1, 40: 1, 14: 4, 22: 2, 29: 1}
Did not match all atoms present	3820-67-5	C1=CC=C(C(=C1)C(=O)OCC(CO)O)NC2=C3C=CC(=CC3=NC=C2)Cl	{2: 2, 3: 1, 14: 9, 17: 1, 35: 1, 20: 2, 28: 1, 31: 1}
Did not match all atoms present	3820-83-5	CCN(CCOP(=O)(O)O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 8, 33: 1, 16: 17, 20: 2, 22: 1, 29: 3}
Did not match all atoms present	38201-24-0	CC1=CC=C(C=C1)N2CC2	{1: 1, 11: 2, 14: 4, 33: 1}
Did not match all atoms present	38201-97-7	N.N.N.N.[OH-].[OH-].[Pt+2]	{}
Did not match all atoms present	38202-27-6	CCOC(=NOS(=O)(=O)C1=C(C=C(C=C1C)C)C)C	{1: 5, 2: 1, 7: 1, 34: 1, 14: 2, 22: 2, 29: 2}
Did not match all atoms present	38205-60-6	CC1=C(SC(=N1)C)C(=O)C	{24: 1, 1: 3, 35: 1, 41: 1}
Did not match all atoms present	38205-61-7	CCC1=C(N=C(S1)C)C	{1: 3, 2: 1, 35: 1, 41: 1}
Did not match all atoms present	38209-58-4	COC1=C(C=C(C=C1)C(=O)C(=O)OC)OC	{24: 1, 1: 3, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	38212-30-5	COC1=CC=C(C=C1)N2CCNCC2	{32: 1, 1: 1, 33: 1, 11: 4, 14: 4, 22: 1}
Did not match all atoms present	38212-33-8	C1CN(CCN1)C2=CC=C(C=C2)Cl	{32: 1, 17: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	38215-36-0	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4S3	{1: 2, 2: 2, 35: 1, 33: 1, 41: 1, 14: 8, 28: 1}
Did not match all atoms present	38219-91-9	CC1=CC=C(C=C1)N(CCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)CC(=O)C4=CC=CC=C4	{1: 1, 2: 4, 33: 1, 14: 18, 24: 2, 29: 2, 31: 1}
Did not match all atoms present	38222-83-2	CC1=CC(=NC(=C1)C(C)(C)C)C(C)(C)C	{1: 7, 35: 1, 4: 2, 14: 2}
Did not match all atoms present	3823-40-3	C1=CC(=CC(=C1)SC(F)(F)F)O	{16: 3, 40: 1, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	38232-63-2	[N-]=[N+]=N[Hg].[N-]=[N+]=N[Hg]	{34: 4}
Did not match all atoms present	38233-66-8	CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)N3CCCC3	{1: 1, 34: 2, 33: 1, 11: 4, 14: 7, 20: 1, 29: 2}
Did not match all atoms present	38235-77-7	C[C@H](C1=CC=CC=C1)NCC2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 14: 10, 31: 1}
Did not match all atoms present	38237-74-0	CCCCC(=O)C1=CC=C(C=C1)N	{24: 1, 1: 1, 2: 3, 30: 1, 14: 4}
Did not match all atoms present	38237-76-2	CCCCCC(=O)C1=CC=C(C=C1)N	{24: 1, 1: 1, 2: 4, 30: 1, 14: 4}
Did not match all atoms present	38240-21-0	C1=CNC(=S)C(=C1)N	{32: 1, 30: 1, 14: 3}
Did not match all atoms present	38241-20-2	C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)N=O	{34: 1, 29: 1, 14: 9}
Did not match all atoms present	38241-21-3	C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N=O	{34: 1, 14: 9, 6: 2, 29: 1}
Did not match all atoms present	38241-28-0	CC(C)(CC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)O)NS(=O)(=O)C)O.Cl	{1: 3, 2: 2, 3: 1, 4: 1, 14: 8, 17: 1, 20: 1, 21: 1, 29: 2, 31: 2}
Did not match all atoms present	38245-35-1	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.O.[Dy+3].[Dy+3]	{24: 3}
Did not match all atoms present	38246-95-6	CCOC1=CC=C(C=C1)NO	{1: 1, 2: 1, 14: 4, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	3825-26-1	C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-].[NH4+]	{16: 15, 24: 1, 4: 7}
Did not match all atoms present	38250-16-7	COC(=O)C(=O)C1=CC=C(C=C1)O	{24: 1, 1: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	38254-74-9	CC1C(=NN(C1=O)C2=CC=C(C=C2)S(=O)(=O)O)C	{1: 2, 35: 1, 33: 1, 12: 1, 14: 4, 15: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	38256-33-6	C1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)N3CCCCC3	{24: 2, 33: 2, 11: 10, 14: 4}
Did not match all atoms present	38258-26-3	CC1=CC=C(C=C1)[N+]#N.CC1=CC=C(C=C1)[N+]#N.[O-]S(=O)(=O)[O-]	{1: 2, 34: 2, 29: 4, 14: 8}
Did not match all atoms present	38260-54-7	CCC1=NC(=CC(=N1)OP(=S)(OC)OC)OCC	{1: 4, 2: 2, 35: 2, 22: 4, 14: 1}
Did not match all atoms present	38261-81-3	CC[C@H](C)COS(=O)(=O)C1=CC=C(C=C1)C	{1: 3, 2: 2, 3: 1, 14: 4, 22: 1, 29: 2}
Did not match all atoms present	3827-49-4	C1=CC(=C(C=C1F)O)Cl	{16: 1, 17: 1, 21: 1, 14: 3}
Did not match all atoms present	38274-16-7	C[Si](C)(C)C#CC1=CC=CC=C1Br	{1: 3, 10: 2, 18: 1, 14: 4}
Did not match all atoms present	38274-35-0	C1=CC=C(C=C1)C2C3=CC=CC=C3C(=C2C4=CC=CC=C4)C5=CC=CC=C5	{12: 1, 14: 19, 15: 2}
Did not match all atoms present	38274-75-8	C1=CC=C2C(=C1)C=CC=C2[Si]	{14: 7}
Did not match all atoms present	38279-20-8	C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)OC3=CC=CC=C3	{3: 1, 14: 15}
Did not match all atoms present	38299-08-0	CC1=NC2=NC=NN2C(=C1)[O-].[Na+]	{1: 1, 35: 3, 14: 2, 33: 1}
Did not match all atoms present	383-07-3	CCCCN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 5, 4: 8, 5: 1, 6: 1, 33: 1, 16: 17, 28: 1, 29: 2}
Did not match all atoms present	383-10-8	CC1=CC=C(C=C1)S(=O)(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 29: 2, 14: 4}
Did not match all atoms present	383-29-9	C1=CC(=CC=C1F)S(=O)(=O)C2=CC=C(C=C2)F	{16: 2, 29: 2, 14: 8}
Did not match all atoms present	383-50-6	CC1=CC=C(C=C1)S(=O)(=O)OCCF	{1: 1, 2: 2, 14: 4, 16: 1, 22: 1, 29: 2}
Did not match all atoms present	383-88-0	C(C(=O)[O-])(F)F.[Ag+]	{16: 2, 24: 1, 3: 1}
Did not match all atoms present	383-90-4	B(N(C)C)(N(C)C)F	{16: 1, 1: 4, 33: 2}
Did not match all atoms present	38304-91-5	C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O	{33: 2, 35: 1, 36: 1, 11: 5, 14: 1, 21: 1, 30: 1}
Did not match all atoms present	38321-18-5	CCCCOCCOCC[O-].[Na+]	{1: 1, 2: 7, 29: 1, 22: 2}
Did not match all atoms present	38330-80-2	COC(=O)CC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 1, 28: 1}
Did not match all atoms present	38337-62-1	CC(=NCCN=C(C)CC(=O)C)CC(=O)C.[Pd]	{24: 2, 1: 4, 2: 4, 34: 2, 7: 2}
Did not match all atoms present	3834-42-2	C[Si](C)(C)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 1: 3, 4: 3}
Did not match all atoms present	38344-88-6	CCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCOS(=O)(=O)[O-].[Mn+2]	{1: 2, 2: 22, 29: 6, 22: 2}
Did not match all atoms present	38346-22-4	C[Si](C)(C)C#CF	{16: 1, 1: 3, 10: 2}
Did not match all atoms present	3835-64-1	CC(C)(C)C(C1=CC=CC=C1)O	{1: 3, 3: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	38350-87-7	CCCCCCCC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 6, 27: 1, 14: 4}
Did not match all atoms present	38353-06-9	C1=C(C=NC(=O)N1)Br	{32: 1, 25: 1, 18: 1, 35: 1, 14: 2}
Did not match all atoms present	38353-81-0	CCC(COC(=O)NC1=CC(=C(C=C1)C)NC(=O)OC2=CC=CC=C2)(COC(=O)NC3=CC(=C(C=C3)C)NC(=O)OC4=CC=CC=C4)COC(=O)NC5=CC(=C(C=C5)C)NC(=O)OC6=CC=CC=C6	{1: 4, 2: 4, 4: 1, 14: 24, 28: 6, 31: 6}
Did not match all atoms present	38353-82-1	C1=CC=C(C=C1)OCC(CNC2=CC=CC(=C2)N)O	{2: 2, 3: 1, 14: 9, 20: 1, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	38355-75-8	CC1CO1.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C(=C\C(=O)O)\C(=O)O	{1: 3, 4: 1, 6: 2, 11: 1, 12: 1, 14: 8, 21: 2, 23: 1, 27: 2}
Did not match all atoms present	38357-93-6	C1CCCN(CC1)CCCOC2=NN(C3=C2C=CC=N3)C4=CC=CC(=C4)C(F)(F)F.Cl	{33: 2, 2: 3, 35: 2, 4: 1, 11: 6, 14: 7, 16: 3, 17: 1, 22: 1}
Did not match all atoms present	38359-09-0	C1CC(=O)N(C1=O)CNC2=CC=C(C=C2)Cl	{33: 1, 2: 1, 11: 2, 14: 4, 17: 1, 25: 2, 31: 1}
Did not match all atoms present	38359-10-3	CCOC1=CC=C(C=C1)NCN2C(=O)CCC2=O	{1: 1, 2: 2, 33: 1, 11: 2, 14: 4, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	38359-11-4	C1CC(=O)N(C1=O)CNC2=CC(=CC=C2)Br	{33: 1, 2: 1, 11: 2, 14: 4, 18: 1, 25: 2, 31: 1}
Did not match all atoms present	3836-78-0	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)O)NNC3=C(C=C(C=C3)Cl)C(F)(F)F	{4: 1, 14: 7, 15: 5, 16: 3, 17: 1, 20: 1, 25: 1, 36: 1, 29: 2, 31: 2}
Did not match all atoms present	38360-81-5	CC1=CC(=CC(=C1)S)C	{1: 2, 14: 3, 39: 1}
Did not match all atoms present	38361-37-4	C1=CC(=C(C(=C1)F)Cl)F	{16: 2, 17: 1, 14: 3}
Did not match all atoms present	38363-32-5	CC(C)(C)NC[C@@H](COC1=CC=CC=C1C2CCCC2)O.CC(C)(C)NC[C@@H](COC1=CC=CC=C1C2CCCC2)O.OS(=O)(=O)O	{1: 6, 2: 4, 3: 2, 4: 2, 11: 8, 12: 2, 14: 8, 20: 4, 22: 2, 29: 2, 31: 2}
Did not match all atoms present	38363-40-5	CC(C)(C)NC[C@@H](COC1=CC=CC=C1C2CCCC2)O	{1: 3, 2: 2, 3: 1, 4: 1, 11: 4, 12: 1, 14: 4, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	3837-38-5	CC1=CC2=C(C=C1)C(=O)C3=C(C2=O)C=CC(=C3)C	{1: 2, 14: 6, 25: 2}
Did not match all atoms present	3837-54-5	CCOC1=CC=CC(=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 2: 1, 33: 1, 34: 2, 14: 8, 22: 1}
Did not match all atoms present	3837-55-6	CN(C)C1=CC=C(C=C1)N=NC2=CC(=CC=C2)[N+](=O)[O-]	{1: 2, 34: 2, 38: 1, 14: 8, 33: 1}
Did not match all atoms present	38373-44-3	COC1=NC=C(C=N1)Cl	{1: 1, 35: 2, 22: 1, 14: 2, 17: 1}
Did not match all atoms present	38377-38-7	C1=CC(=CC=C1OC(=O)Cl)F	{16: 1, 17: 1, 28: 1, 14: 4}
Did not match all atoms present	38379-99-6	C1=CC(=C(C=C1Cl)C2=C(C=CC(=C2Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	38380-01-7	C1=CC(=C(C=C1Cl)Cl)C2=CC(=C(C=C2Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	38380-02-8	C1=CC(=C(C=C1Cl)C2=C(C(=C(C=C2)Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	38380-03-9	C1=CC(=C(C=C1C2=C(C=CC(=C2Cl)Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	38380-04-0	C1=CC(=C(C(=C1Cl)C2=CC(=C(C=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	38380-05-1	C1=CC(=C(C(=C1C2=C(C=CC(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	38380-07-3	C1=CC(=C(C(=C1C2=C(C(=C(C=C2)Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	38380-08-4	C1=CC(=C(C=C1C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	38381-24-7	C1CC1C(=S)C2CC2	{11: 4, 12: 2, 7: 1}
Did not match all atoms present	3839-22-3	C1=CC=C(C(=C1)C#N)C(=O)O	{27: 1, 37: 1, 14: 4}
Did not match all atoms present	38393-92-9	CC1(CC(C2=CC=CC=C21)O)C	{1: 2, 11: 1, 12: 1, 13: 1, 14: 4, 20: 1}
Did not match all atoms present	38394-53-5	CCN(C1=CC=C(C=C1)/C=C\2/C(=O)/C(=C/C3=CC=C(C=C3)N(CC)CC)/CC2)CC	{1: 4, 2: 4, 6: 2, 33: 2, 11: 2, 14: 8, 15: 2, 25: 1}
Did not match all atoms present	38399-10-9	C1CC2=C(C=C1)C=CC3=CC=CC=C23	{11: 2, 14: 8}
Did not match all atoms present	384-22-5	C1=CC=C(C(=C1)C(F)(F)F)[N+](=O)[O-]	{16: 3, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	384-46-3	CN1C2=CC=CC=C2N=C1C(F)(F)F	{1: 1, 35: 1, 4: 1, 33: 1, 14: 4, 16: 3}
Did not match all atoms present	384-64-5	C=C(C1=CC=CC=C1)C(F)(F)F	{16: 3, 4: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	384-67-8	C1=CC=C(C=C1)C(=O)C(F)(F)Cl	{16: 2, 17: 1, 4: 1, 14: 5, 24: 1}
Did not match all atoms present	3840-18-4	CC1=CC=CC=C1OC2=CC=CC=C2N	{1: 1, 30: 1, 22: 1, 14: 8}
Did not match all atoms present	3840-30-0	COC1=CC(=CC(=C1OC)OC)CCl	{1: 3, 2: 1, 22: 3, 14: 2, 17: 1}
Did not match all atoms present	3840-31-1	COC1=CC(=CC(=C1OC)OC)CO	{1: 3, 2: 1, 20: 1, 22: 3, 14: 2}
Did not match all atoms present	38402-02-7	C[N+](C)(CCO)CCO.[Cl-]	{1: 2, 2: 4, 20: 2, 17: 1}
Did not match all atoms present	38402-95-8	CN(C)C1=CC=C(C=C1)P(=O)(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C.CN(C)C1=CC=C(C=C1)P(=O)(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C.Cl[Sn](Cl)(Cl)Cl	{1: 12, 33: 6, 29: 2, 14: 24, 17: 4}
Did not match all atoms present	38404-42-1	CC1=C(C=C(C=C1)C(=O)OC)C	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	38409-63-1	CCCCCCC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 5, 28: 1, 14: 4}
Did not match all atoms present	3841-14-3	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C=CC4=C(C3=O)C(=C(C=C4S(=O)(=O)O)S(=O)(=O)O)N)OC)N/N=C/5\C=CC6=C(C5=O)C(=C(C=C6S(=O)(=O)O)S(=O)(=O)O)N	{1: 2, 34: 2, 14: 12, 15: 2, 20: 4, 22: 2, 25: 2, 29: 8, 30: 2, 31: 2}
Did not match all atoms present	38411-17-5	CC(=O)NC1=CC(=C(C=C1Cl)[N+](=O)[O-])Cl	{1: 1, 38: 1, 14: 2, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	38411-22-2	C1=CC(=C(C(=C1Cl)C2=C(C=CC(=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	38411-25-5	C1=CC(=C(C(=C1Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	38412-12-3	CC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)C5=CC=C(C=C5)OC6=CC=C(C=C6)NS(=O)(=O)C7=CC=CC8=C7C=CC(=C8[O-])[N+]#N	{1: 2, 34: 2, 4: 1, 14: 26, 22: 2, 29: 4, 31: 2}
Did not match all atoms present	38412-17-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=C5C(=C(C=C4)NC6=CC=CC7=C6C(=O)C8=CC=CC=C8C7=O)C(=O)C9=C(C=CC(=C9C5=O)NC1=CC=CC2=C1C(=O)C1=CC=CC=C1C2=O)NC1=CC=CC2=C1C(=O)C1=CC=CC=C1C2=O	{25: 10, 14: 32, 31: 4}
Did not match all atoms present	38418-10-9	CC1=CC=C(C=C1)COC(=O)C2=CC=CC=C2	{1: 1, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	3842-20-4	C1=CC=C2C(=C1)C(=O)N(C2=O)CC#N	{25: 2, 2: 1, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	38422-60-5	CC1=CC=C(C=C1)C2NN(C(N(N2)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C)C5=CC=C(C=C5)C	{32: 2, 1: 4, 12: 2, 14: 16, 33: 2}
Did not match all atoms present	38423-62-0	CCOC1=CC=CC=C1NC(=O)/C=N/O	{1: 1, 2: 1, 6: 1, 34: 1, 14: 4, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	38425-26-2	CC1=CC=C(C=C1)C(=O)CCCCl	{24: 1, 1: 1, 2: 3, 14: 4, 17: 1}
Did not match all atoms present	38425-47-7	C1C(=CC1=O)C2=CC=CC=C2	{25: 1, 11: 1, 14: 6, 15: 1}
Did not match all atoms present	38428-14-7	CC(C)COC1C=CC2=CC=CC=C2N1C(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 33: 1, 12: 1, 14: 6, 22: 1, 28: 1}
Did not match all atoms present	3843-41-2	CNS(=O)(=O)C1=CC=CC2=C1C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N	{1: 1, 34: 2, 38: 1, 14: 8, 17: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	3843-74-1	COC(=O)/C=C/C1=CC(=C(C=C1)O)O	{1: 1, 28: 1, 14: 3, 6: 2, 21: 2}
Did not match all atoms present	38435-04-0	C1C(C1(Cl)Cl)S(=O)(=O)C2=CC=CC=C2	{11: 1, 12: 1, 13: 1, 14: 5, 17: 2, 29: 2}
Did not match all atoms present	38435-09-5	CCOC(CCS(=O)(=O)C1=CC=CC=C1)(OCC)OCC	{1: 3, 2: 5, 4: 1, 14: 5, 22: 3, 29: 2}
Did not match all atoms present	3844-45-9	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 20, 15: 2, 29: 9}
Did not match all atoms present	3844-94-8	CCCCC#C[Si](C)(C)C	{1: 4, 2: 3, 10: 2}
Did not match all atoms present	38442-51-2	CC(C)(C)[Hg]Cl	{1: 3, 4: 1, 17: 1}
Did not match all atoms present	38444-08-5	CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCC	{1: 2, 2: 8, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	38444-13-2	CCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC	{1: 2, 2: 4, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	38444-15-4	CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCCC	{1: 2, 2: 9, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	38444-29-0	CCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC(=O)CCCCC	{1: 2, 2: 10, 28: 2, 14: 8}
Did not match all atoms present	38444-73-4	C1=CC=C(C(=C1)C2=C(C=CC=C2Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-78-9	C1=CC=C(C(=C1)C2=C(C(=CC=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-81-4	C1=CC(=CC(=C1)Cl)C2=C(C=CC(=C2)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-84-7	C1=CC(=CC(=C1)Cl)C2=C(C(=CC=C2)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-85-8	C1=CC(=C(C(=C1)Cl)Cl)C2=CC=C(C=C2)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-86-9	C1=CC=C(C(=C1)C2=CC(=C(C=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-87-0	C1=CC(=CC(=C1)Cl)C2=CC(=CC(=C2)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-88-1	C1=CC(=CC=C1C2=CC(=CC(=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-90-5	C1=CC(=CC=C1C2=CC(=C(C=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	38444-93-8	C1=CC(=C(C(=C1)Cl)Cl)C2=C(C(=CC=C2)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	38446-40-1	C[Si](C)(C)[Si](C)(C)C1=CC=CC2=CC=CC=C21	{1: 5, 14: 7}
Did not match all atoms present	38446-41-2	C[Si](C)(C1=CC=CC2=CC=CC=C21)[Si](C)(C)C3=CC=CC4=CC=CC=C43	{1: 4, 14: 14}
Did not match all atoms present	38446-42-3	C[Si](C)(C)[Si](C)(C)[Si](C)(C)C1=CC=CC2=CC=CC=C21	{1: 7, 14: 7}
Did not match all atoms present	38446-43-4	C[Si](C)(C)[Si](C)(C1=CC=CC2=CC=CC=C21)[Si](C)(C)C	{1: 7, 14: 7}
Did not match all atoms present	38448-58-7	O=[Os].F.F.F.F	{16: 4, 29: 1}
Did not match all atoms present	38449-49-9	CCOC(=O)CC1=CSC(=S)N1	{32: 1, 1: 1, 2: 2, 41: 1, 14: 1, 28: 1}
Did not match all atoms present	38449-92-2	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=C4C=C(/C(=N\NC5=CC=CC=C5)/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N=NC6=C(C=C(C=C6)N)N.[Na+].[Na+]	{1: 2, 34: 5, 14: 16, 15: 2, 22: 2, 25: 1, 29: 6, 30: 3, 31: 1}
Did not match all atoms present	38452-47-0	CS(=O)(=O)C1=CC(=C(C=C1)Cl)Cl	{1: 1, 29: 2, 14: 3, 17: 2}
Did not match all atoms present	38454-02-3	CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCC	{1: 2, 2: 6, 28: 2, 14: 12}
Did not match all atoms present	38454-28-3	CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCC	{1: 2, 2: 8, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	38455-12-8	CCC(C)[Hg]Cl	{1: 2, 2: 1, 3: 1, 17: 1}
Did not match all atoms present	38455-77-5	O[Cr](=O)(=O)[O-].O[Cr](=O)(=O)[O-].[Sn+2]	{20: 2, 29: 6}
Did not match all atoms present	38456-24-5	CC(=O)OCCCC1=CN=CC=C1	{1: 1, 2: 3, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	38457-67-9	C1=CC=C(C=C1)OP(=O)(C(C(Cl)(Cl)Cl)O)OC2=CC=CC=C2	{3: 1, 4: 1, 14: 10, 17: 3, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	3846-50-2	CCNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 2, 14: 3, 31: 1}
Did not match all atoms present	3846-66-0	CC(C)(C)/C=C/C1=CC=CC=C1	{1: 3, 4: 1, 14: 5, 6: 2}
Did not match all atoms present	38462-04-3	CC1=C(C(=C(C(=C1Cl)O)C/C=C(\C)/CC/C=C(\C)/[C@@H]2CC(=O)C(O2)(C)C)O)C=O	{1: 5, 2: 3, 6: 2, 7: 2, 11: 1, 12: 1, 13: 1, 17: 1, 21: 2, 23: 1, 25: 1, 26: 1}
Did not match all atoms present	38465-60-0	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Cu+2]	{16: 8}
Did not match all atoms present	38465-86-0	CP(C1=CC=CC=C1)C2=CC=CC=C2.CP(C1=CC=CC=C1)C2=CC=CC=C2.C1/C=C\CC/C=C\C1.F[P-](F)(F)(F)(F)F.[Ir]	{16: 6, 1: 2, 11: 4, 14: 24}
Did not match all atoms present	38469-73-7	C1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)O	{24: 2, 21: 1, 14: 9}
Did not match all atoms present	38479-86-6	[1H]CC1=C(C=C(C(=C1)C)C=O)C	{1: 3, 26: 1, 14: 2}
Did not match all atoms present	38479-87-7	[1H]CC1=C(C=C(C(=C1)C=O)C)C	{1: 3, 26: 1, 14: 2}
Did not match all atoms present	3848-51-9	C1=CC=C(C=C1)NP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{31: 1, 22: 2, 14: 15, 29: 1}
Did not match all atoms present	38481-06-0	B(OC)(F)Cl	{16: 1, 1: 1, 22: 1, 17: 1}
Did not match all atoms present	38481-07-1	B(N(C)C)(F)Cl	{16: 1, 1: 2, 33: 1, 17: 1}
Did not match all atoms present	38481-08-2	B(OC)(F)Br	{16: 1, 1: 1, 18: 1, 22: 1}
Did not match all atoms present	38481-09-3	B(N(C)C)(F)Br	{16: 1, 1: 2, 18: 1, 33: 1}
Did not match all atoms present	38481-11-7	B(OC)(Cl)Br	{1: 1, 18: 1, 22: 1, 17: 1}
Did not match all atoms present	38482-90-5	CCCCCCCCCCCCO[C@@H](C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{1: 1, 2: 11, 3: 1, 14: 10, 22: 1, 24: 1}
Did not match all atoms present	38483-28-2	C(O[N+](=O)[O-])O[N+](=O)[O-]	{2: 1, 22: 2}
Did not match all atoms present	38487-86-4	C1=CC(=C(C=C1Cl)N)C#N	{17: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	38489-19-9	CC(=O)C(C(=O)NC1=CC(=C(C=C1OC)Cl)OC)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 3, 34: 2, 3: 1, 38: 1, 14: 6, 17: 1, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	38490-24-3	B(=O)Br	{18: 1, 29: 1}
Did not match all atoms present	38490-99-2	CCCC[C@@H](CC)CO[C@@H](C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{1: 2, 2: 5, 3: 2, 14: 10, 22: 1, 24: 1}
Did not match all atoms present	385-00-2	C1=CC(=C(C(=C1)F)C(=O)O)F	{16: 2, 27: 1, 14: 3}
Did not match all atoms present	385-13-7	C1=CC2=C3C(=C1)C4=C(C5=CC=CC(=C53)C=C2)C6=CC=CC7=C6C8=C(C=CC=C84)C=C7	{14: 16}
Did not match all atoms present	385-14-8	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC6=C5C7=C(C=CC=C74)C=C6	{14: 16}
Did not match all atoms present	385-15-9	C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4C5=C3C6=CC=CC=C6C7=CC8=CC=CC=C8C=C75	{14: 20}
Did not match all atoms present	3851-22-7	CC[O-].CC[O-].[Zn+2]	{1: 2, 2: 2, 29: 2}
Did not match all atoms present	38514-71-5	C1=C(OC(=C1)[N+](=O)[O-])C2=CSC(=N2)N	{35: 1, 38: 1, 41: 1, 14: 3, 23: 1, 30: 1}
Did not match all atoms present	38517-23-6	CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)[O-])C(=O)O.[Na+]	{1: 1, 2: 18, 3: 1, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	38521-46-9	C1=CNC(=S)C(=C1)C(=O)O	{32: 1, 27: 1, 14: 3}
Did not match all atoms present	38521-49-2	C1=CC=C(C=C1)COC2=C(C(=C(C(=C2Br)Br)Br)Br)Br	{2: 1, 22: 1, 18: 5, 14: 5}
Did not match all atoms present	38527-91-2	CCCSP(=O)(OCC)OC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 3, 40: 1, 14: 3, 17: 2, 22: 2, 29: 1}
Did not match all atoms present	3853-74-5	CCNC(=O)OCCSCSP(=S)(OC)OC(C)C	{1: 4, 2: 4, 3: 1, 40: 2, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	38533-19-6	C1=CC=C(C=C1)C2C(=O)NC3=CC=CC=C3S2	{32: 1, 25: 1, 12: 1, 14: 9, 41: 1}
Did not match all atoms present	3854-90-8	CCC1=CC(=CC(=C1)C(=O)O)CC	{1: 2, 2: 2, 27: 1, 14: 3}
Did not match all atoms present	38542-94-8	C(F)(F)(F)S(=O)(=O)[O-].[NH4+]	{16: 3, 4: 1, 29: 3}
Did not match all atoms present	38549-81-4	CCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)C	{1: 2, 2: 3, 34: 1, 14: 8, 6: 1}
Did not match all atoms present	3855-26-3	CCC1=C(C=CC(=C1)C)O	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	3855-45-6	C(F)(F)(F)S(=O)(=O)N=[N+]=[N-]	{16: 3, 34: 2, 4: 1, 29: 2}
Did not match all atoms present	3855-82-1	[2H]C1=C(C(=C(C(=C1Cl)[2H])[2H])Cl)[2H]	{17: 2, 14: 4}
Did not match all atoms present	38550-83-3	CCCCCCCCCCCCCCCCCC1=[N+](C=CN1CC)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 20, 33: 2, 14: 2, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	38565-48-9	C1=CC(=O)C=CC1=NNC2=CC=C(C=C2)N=NC3=CC=C(C=C3)[N+](=O)[O-]	{34: 3, 38: 1, 14: 12, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	3857-03-2	B(C(C)C)(F)F	{16: 2, 1: 2, 3: 1}
Did not match all atoms present	3857-25-8	CC1=CC=C(O1)CO	{1: 1, 2: 1, 20: 1, 14: 2, 23: 1}
Did not match all atoms present	38573-88-5	C1=CC(=C(C(=C1)Br)F)F	{16: 2, 18: 1, 14: 3}
Did not match all atoms present	38573-92-1	C[Sn](C)(C)C1=CC2CCC1C2	{1: 3, 11: 3, 12: 2, 14: 1, 15: 1}
Did not match all atoms present	38577-24-1	CC1=CC=C(C=C1)NNC=O	{1: 1, 26: 1, 14: 4, 31: 2}
Did not match all atoms present	38577-97-8	C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)I)OC5=C3C=CC(=C5I)O	{13: 1, 14: 8, 19: 2, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	38578-24-4	C1C(COP(O1)Cl)(CBr)CBr	{2: 2, 11: 2, 13: 1, 17: 1, 18: 2, 23: 2}
Did not match all atoms present	3858-83-1	C1=CC(=CC=C1C(=N)N)N	{36: 1, 30: 2, 14: 4, 7: 1}
Did not match all atoms present	38580-43-7	C[Si](C)(C1=CC=CC2=CC=CC=C21)[Si](C)(C)[Si](C)(C)C3=CC=CC4=CC=CC=C43	{1: 6, 14: 14}
Did not match all atoms present	38580-79-9	CC(C)(C)C1=CC=CC(=C1)CCl	{1: 3, 2: 1, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	38582-17-1	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Co+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	38582-18-2	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Zn+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	38589-14-9	CC(CN)C1=CC=C(C=C1)N2CCCCC2.Cl.Cl	{1: 1, 2: 1, 3: 1, 33: 1, 11: 5, 14: 4, 17: 2, 30: 1}
Did not match all atoms present	38598-34-4	C1CCC(CC1)CCCC(=O)O[Al]OC(=O)CCCC2CCCCC2.O	{28: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	386-17-4	C1=CC=C2C(=C1)C(=O)OC2(C3=CC(=C(C(=C3)I)O)I)C4=CC(=C(C(=C4)I)O)I	{19: 4, 28: 1, 13: 1, 14: 8, 21: 2}
Did not match all atoms present	386-71-0	C1=CC(=C(C(=C1)N)[N+](=O)[O-])C(F)(F)F	{16: 3, 38: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	386-72-1	C1=CC(=C(C(=C1)O)[N+](=O)[O-])C(F)(F)F	{16: 3, 38: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	3861-47-0	CCCCCCCC(=O)OC1=C(C=C(C=C1I)C#N)I	{1: 1, 2: 6, 37: 1, 14: 2, 19: 2, 28: 1}
Did not match all atoms present	3861-72-1	CC(=O)O[C@H]1CC[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)OC)CCN3C	{1: 3, 33: 1, 11: 5, 12: 4, 13: 1, 14: 2, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	3861-73-2	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=C5C(=CC(=C4)S(=O)(=O)[O-])C=C(C=C5O)S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 31: 1, 21: 1, 14: 14, 29: 9}
Did not match all atoms present	3861-99-2	C1=C2C(=CC(=C1S(=O)(=O)N)Cl)C(=O)NC2=O	{32: 1, 14: 2, 17: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	38613-77-3	CC(C)(C)C1=CC(=C(C=C1)OP(C2=CC=C(C=C2)C3=CC=C(C=C3)P(OC4=C(C=C(C=C4)C(C)(C)C)C(C)(C)C)OC5=C(C=C(C=C5)C(C)(C)C)C(C)(C)C)OC6=C(C=C(C=C6)C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 24, 4: 8, 22: 4, 14: 20}
Did not match all atoms present	38615-38-2	CCCCCCCC(=O)NC1=C(C=C(C=C1)C(C2=C(C=C(C=C2)N(CC)CC)C)C3=C(C=C(C=C3)N(CC)CC)C)OC	{1: 8, 2: 10, 3: 1, 33: 2, 14: 9, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	38615-39-3	CCN(CC)C1=CC=C(C=C1)CC2C(C3=CC=CC=C3C2=O)O	{1: 2, 2: 3, 33: 1, 12: 2, 14: 8, 20: 1, 25: 1}
Did not match all atoms present	3862-11-1	CC1=C(C=C(C=C1)OP(=O)(OC2=CC(=C(C=C2)C)C)OC3=CC(=C(C=C3)C)C)C	{1: 6, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	3862-12-2	CC1=CC(=C(C=C1)OP(=O)(OC2=C(C=C(C=C2)C)C)OC3=C(C=C(C=C3)C)C)C	{1: 6, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	3862-21-3	COP(=O)(OC)OC(C(Cl)(Cl)Cl)Cl	{1: 2, 3: 1, 4: 1, 17: 4, 22: 3, 29: 1}
Did not match all atoms present	3862-73-5	C1=CC(=C(C(=C1N)F)F)F	{16: 3, 30: 1, 14: 2}
Did not match all atoms present	38625-54-6	CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].[Ru+3]	{24: 3, 1: 18, 4: 6, 6: 3, 7: 3}
Did not match all atoms present	38627-57-5	C1=CC=C2C=C3C(=CC2=C1)C(=O)C(C3=O)(O)O	{25: 2, 20: 2, 13: 1, 14: 6}
Did not match all atoms present	3863-11-4	C1=CC(=C(C=C1N)F)F	{16: 2, 30: 1, 14: 3}
Did not match all atoms present	3863-59-0	CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4(C(=O)COP(=O)(O)O)O)C)O	{1: 2, 2: 1, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 4, 22: 1, 24: 1, 25: 1, 29: 1}
Did not match all atoms present	38638-05-0	CC(C)CC(C)CC(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 4, 2: 2, 3: 3, 14: 14, 22: 3, 29: 1}
Did not match all atoms present	38641-06-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[K+]	{25: 2, 29: 3, 14: 7}
Did not match all atoms present	38641-16-6	CCCCCCCCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 11, 14: 7}
Did not match all atoms present	38641-18-8	CC1=CC=CC2=C1C=CC=C2C(C)C	{1: 3, 3: 1, 14: 6}
Did not match all atoms present	38641-94-0	CC(C)N.C(C(=O)O)NCP(=O)(O)O	{1: 2, 2: 2, 3: 1, 20: 2, 27: 1, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	38656-58-5	CCOC1=CC(=C(C=C1[N+]#N)OCC)NC(=O)C2=CC=C(C=C2)C.CCOC1=CC(=C(C=C1[N+]#N)OCC)NC(=O)C2=CC=C(C=C2)C.Cl[Zn-2](Cl)(Cl)Cl	{1: 6, 2: 4, 34: 2, 14: 12, 17: 4, 22: 4, 24: 2, 31: 2}
Did not match all atoms present	38660-35-4	CCN(CC)C1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)N(CC)CC)C5=CC=CC=C5C(=O)N3C6=CC=CC=C6	{1: 4, 2: 4, 33: 3, 13: 1, 14: 15, 23: 1, 25: 1}
Did not match all atoms present	38663-58-0	CCCCCCCCCCCCCCCCCCSCCC(=O)[O-].CCCCCCCCCCCCCCCCCCSCCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 38, 40: 2}
Did not match all atoms present	38663-85-3	COCCN=C=S	{8: 1, 1: 1, 2: 2, 34: 1, 22: 1}
Did not match all atoms present	3867-18-3	C=CC1=CC=CC=C1N	{14: 4, 30: 1, 5: 1, 6: 1}
Did not match all atoms present	3867-55-8	C1=CC(=C(C=C1C(=O)Cl)C(=O)Cl)C(=O)Cl	{24: 3, 17: 3, 14: 3}
Did not match all atoms present	38677-56-4	C1=CC=C(C=C1)CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{2: 1, 4: 1, 38: 3, 14: 5}
Did not match all atoms present	38677-81-5	CC(C)(C)NCC(C1=NC(=C(C=C1)O)CO)O	{1: 3, 2: 2, 3: 1, 4: 1, 14: 2, 35: 1, 20: 2, 21: 1, 31: 1}
Did not match all atoms present	3868-31-3	C([C@@H]1[C@H]([C@H]([C@@H](O1)N2C3=C(C(=O)N=C(N3)N)NC2=O)O)O)O	{32: 2, 33: 1, 2: 1, 35: 1, 12: 4, 20: 3, 23: 1, 25: 2, 30: 1}
Did not match all atoms present	38686-67-8	C1COCCN1C2=CC=C(C=C2)[N+]#N.F[P-](F)(F)(F)(F)F	{33: 1, 34: 1, 11: 4, 14: 4, 16: 6, 23: 1}
Did not match all atoms present	38686-70-3	CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C.F[P-](F)(F)(F)(F)F	{1: 3, 2: 2, 40: 1, 34: 1, 14: 6, 16: 6, 22: 2}
Did not match all atoms present	38690-76-5	CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 6, 28: 1, 37: 1, 14: 8}
Did not match all atoms present	38690-77-6	CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 3, 28: 1, 37: 1, 14: 8}
Did not match all atoms present	38690-78-7	CCCCCCC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N	{1: 1, 2: 5, 37: 1, 6: 1, 34: 1, 14: 8}
Did not match all atoms present	38690-79-8	CCCC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N	{1: 1, 2: 2, 37: 1, 6: 1, 34: 1, 14: 8}
Did not match all atoms present	38692-98-7	CCN1C=C(C2=CC=CC=C21)C(=O)CO	{1: 1, 2: 2, 33: 1, 14: 5, 20: 1, 24: 1}
Did not match all atoms present	38693-06-0	C1=CC2=C(C=CN2)C=C1C(=O)CO	{24: 1, 32: 1, 2: 1, 20: 1, 14: 5}
Did not match all atoms present	387-43-9	C1=CC2=C(C=CN2)C(=C1)F	{16: 1, 32: 1, 14: 5}
Did not match all atoms present	387-45-1	C1=CC(=C(C(=C1)Cl)C=O)F	{16: 1, 17: 1, 26: 1, 14: 3}
Did not match all atoms present	38700-88-8	C1=CC=C(C=C1)SC2=CC(=CC=C2)Cl	{40: 1, 17: 1, 14: 9}
Did not match all atoms present	38705-08-7	C1C2(CN3CC1(CN(C2)C3)C4=CC=CC=C4)C5=CC=CC=C5	{33: 2, 11: 6, 13: 2, 14: 10}
Did not match all atoms present	38705-20-3	COC1=CC=CC(=C1)C2=NC=C(O2)C3=CC=CC=C3	{1: 1, 35: 1, 22: 1, 14: 10, 23: 1}
Did not match all atoms present	3871-23-6	C1=CC=C(C=C1)C2=CC=C(C=C2)O.C1=CC=C(C=C1)C2=CC=C(C=C2)O.C1=CC=C(C=C1)C2=CC=C(C=C2)O.OP(=O)(O)O	{20: 3, 21: 3, 14: 27, 29: 1}
Did not match all atoms present	3871-31-6	C1=CC(=CC=C1OP(=O)(OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl)Cl	{17: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	3871-50-9	CCC.CCN(CC(=O)[O-])S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.C=O.C(C(=O)[O-])NS(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Na+].[Na+]	{1: 3, 2: 4, 4: 16, 5: 1, 33: 1, 16: 34, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	3871-82-7	CC1=CC=C(C=C1)C2(CC[NH+](CC2)CCCC(=O)C3=CC=C(C=C3)F)O.[Cl-]	{1: 1, 2: 3, 11: 4, 13: 1, 14: 8, 16: 1, 17: 1, 20: 1, 24: 1}
Did not match all atoms present	38713-41-6	CC(=C)C1=NC=CN=C1	{1: 1, 35: 2, 5: 1, 14: 3, 7: 1}
Did not match all atoms present	38713-72-3	CC1=NC2=CC=CC3=NC(=NC(=N1)N32)C	{1: 2, 35: 4, 14: 3, 33: 1}
Did not match all atoms present	38713-73-4	C1=CC2=NC=NC3=NC=NC(=C1)N23	{33: 1, 35: 4, 14: 5}
Did not match all atoms present	38717-96-3	C1=CC=C2C=CC(=C2C=C1)C(=O)C3=CC=CC=C3	{24: 1, 14: 12}
Did not match all atoms present	38726-90-8	CNC(=O)CN/C(=C/[N+]#N)/[O-]	{1: 1, 2: 1, 6: 1, 7: 1, 34: 1, 24: 1, 31: 2}
Did not match all atoms present	38726-91-9	CCNC(=O)CNC(=C[N+]#N)[O-]	{1: 1, 2: 2, 6: 1, 7: 1, 34: 1, 24: 1, 31: 2}
Did not match all atoms present	38727-55-8	CCC1=C(C(=CC=C1)CC)N(CC(=O)OCC)C(=O)CCl	{1: 3, 2: 5, 33: 1, 14: 3, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	38727-56-9	CCC1=C(C(=CC=C1)CC)NCC(=O)OCC	{1: 3, 2: 4, 28: 1, 14: 3, 31: 1}
Did not match all atoms present	3874-54-2	C1=CC(=CC=C1C(=O)CCCCl)F	{16: 1, 17: 1, 2: 3, 14: 4, 24: 1}
Did not match all atoms present	3874-84-8	C1=CC2=C(C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N)C(=C1)S(=O)(=O)N	{34: 2, 38: 1, 14: 8, 17: 1, 29: 2, 30: 2}
Did not match all atoms present	38746-93-9	CCCCOC1=CC=C(C=C1)CC#N	{1: 1, 2: 4, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	3875-68-1	C1=CC=C2C(=C1)C(=O)C3=C(C=C(C=C3O2)O)O	{25: 1, 21: 2, 14: 6, 23: 1}
Did not match all atoms present	38753-50-3	CC(C)OC1=CC=CC=C1[N+](=O)[O-]	{38: 1, 1: 2, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	38758-15-5	CC(C)NS(=O)(=O)NC1=CC=CC=C1C(=O)O	{1: 2, 3: 1, 14: 4, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	3876-97-9	CC1=C(C2=C(C=CC=C2C)C=C1)C	{1: 3, 14: 5}
Did not match all atoms present	38762-41-3	C1=CC(=C(C=C1Br)Cl)N	{17: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	3877-19-8	CC1CCC2=CC=CC=C2C1	{1: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	38775-38-1	CCCCCCCCCCCCCCCCS(=O)(=O)Cl	{1: 1, 2: 15, 29: 2, 17: 1}
Did not match all atoms present	38777-13-8	CC(C)OC1=CC=CC=C1OC(=O)N(C)N=O	{1: 3, 34: 1, 3: 1, 33: 1, 14: 4, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	3878-19-1	C1=CC=C2C(=C1)NC(=N2)C3=CC=CO3	{32: 1, 35: 1, 14: 7, 23: 1}
Did not match all atoms present	3878-44-2	C1=CC=C(C=C1)P(=[Se])(C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	3878-45-3	C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	3878-46-4	CCOC(=O)OC1=CC=CC=C1	{1: 1, 2: 1, 14: 5}
Did not match all atoms present	38780-35-7	C1CCC(CC1)N.C1CCC(CC1)N.[Cl-].[Cl-].[Pt+2]	{17: 2, 11: 10, 12: 2, 30: 2}
Did not match all atoms present	38780-36-8	C1CCC(C1)N.C1CCC(C1)N.[Cl-].[Cl-].[Pt+2]	{17: 2, 11: 8, 12: 2, 30: 2}
Did not match all atoms present	38780-37-9	C1CC(C1)N.C1CC(C1)N.[Cl-].[Cl-].[Pt+2]	{17: 2, 11: 6, 12: 2, 30: 2}
Did not match all atoms present	38780-39-1	C1=CC=C(C(=C1)N)N.[Cl-].[Cl-].[Pt+2]	{17: 2, 30: 2, 14: 4}
Did not match all atoms present	38780-42-6	C1CCNC1.C1CCNC1.[Cl-].[Cl-].[Pt+2]	{32: 2, 17: 2, 11: 8}
Did not match all atoms present	38780-43-7	C(C(=O)[O-])C(=O)[O-].N.N.[Pt+2]	{24: 2, 2: 1}
Did not match all atoms present	38780-90-4	C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ni+2]	{35: 6, 14: 48}
Did not match all atoms present	38782-42-2	[Na].[Ag]	{}
Did not match all atoms present	38788-38-4	CCCC[Te]CCCC	{1: 2, 2: 6}
Did not match all atoms present	3879-01-4	C(#N)[S-].[Cs+]	{37: 1}
Did not match all atoms present	3879-02-5	C(#N)[S-].[Rb+]	{37: 1}
Did not match all atoms present	388-11-4	CC(=O)NC1=C(C(=C(C=C1F)F)F)[N+](=O)[O-]	{1: 1, 38: 1, 14: 1, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	388-72-7	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=C4F	{16: 1, 14: 11}
Did not match all atoms present	388-82-9	C1=CC=C(C(=C1)C2=CC=CC=C2F)F	{16: 2, 14: 8}
Did not match all atoms present	3880-03-3	CN(C)S(F)(F)F	{16: 3, 1: 2, 33: 1}
Did not match all atoms present	3880-04-4	CN1P(N(P1(F)(F)F)C)(F)(F)F	{16: 6, 1: 2, 33: 2}
Did not match all atoms present	38802-82-3	CC(C)[Sn](C(C)C)(Cl)Cl	{1: 4, 3: 2, 17: 2}
Did not match all atoms present	38803-30-4	CN(C)C1=CC=CC(=C1)C#N	{1: 2, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	38815-39-3	CC(C)(C)C1=CC=C(C=C1)OP(=O)(Cl)Cl	{1: 3, 4: 1, 14: 4, 17: 2, 22: 1, 29: 1}
Did not match all atoms present	38818-50-7	C1=CC(=C(C=C1C(=O)Cl)[N+](=O)[O-])Cl	{24: 1, 17: 2, 38: 1, 14: 3}
Did not match all atoms present	38820-59-6	C(CCCN(CP(=O)(O)[O-])CP(=O)(O)[O-])CCN(CP(=O)(O)[O-])CP(=O)(O)[O-].[K+]	{33: 2, 2: 10, 20: 4, 29: 8}
Did not match all atoms present	3883-86-1	C1=C(C(=C(C(=C1F)F)C2=C(C(=CC(=C2F)F)F)F)F)F	{16: 8, 14: 2}
Did not match all atoms present	3883-95-2	C1=CC(=C(C(=C1)Br)O)C(=O)O	{18: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	38838-26-5	CC(=O)NC1CCC2=CC(=C(C(=C2C3=C1C=C(C=C3)O)OC)OC)OC	{1: 4, 11: 2, 12: 1, 14: 4, 21: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	38841-48-4	CCCCCCCCCCC(C(=O)[O-])S(=O)(=O)O.[Na+].[Na+]	{1: 1, 2: 9, 3: 1, 20: 1, 24: 1, 29: 2}
Did not match all atoms present	38841-88-2	CC1=CC(=NC(=C1C#N)NCCO)NCCO	{1: 1, 2: 4, 35: 1, 37: 1, 14: 1, 20: 2, 31: 2}
Did not match all atoms present	38841-98-4	CCCCCCC[CH2-].[Mg+2].[Cl-]	{1: 1, 2: 6, 5: 1, 17: 1}
Did not match all atoms present	38842-05-6	CCC1=CC(=C(C(=C1)CC)CC)CC	{1: 4, 2: 4, 14: 2}
Did not match all atoms present	38845-47-5	CN1C=NN(C1N=NC2=CC=C(C=C2)N(C)CC3=CC=CC=C3)C.Cl[Zn-](Cl)Cl	{1: 3, 2: 1, 35: 1, 33: 3, 12: 1, 34: 2, 14: 10, 17: 3}
Did not match all atoms present	38850-01-0	CC(=O)C(C(=O)NC1=CC=CC=C1)NN=C2C=C(C=C(C2=O)S(=O)(=O)O)[N+](=O)[O-]	{1: 1, 34: 1, 3: 1, 38: 1, 14: 7, 15: 3, 20: 1, 24: 2, 25: 1, 29: 2, 31: 2}
Did not match all atoms present	38850-52-1	C[N+](C)(C)CCCN(CC(=O)[O-])S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 3, 2: 4, 4: 6, 33: 1, 16: 13, 24: 1, 29: 2}
Did not match all atoms present	38850-60-1	CN(C)CCCN(CCCS(=O)(=O)O)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 6, 4: 6, 33: 2, 16: 13, 20: 1, 29: 4}
Did not match all atoms present	38857-76-0	CCCCC1CCCC2=CC=CC=C12	{1: 1, 2: 3, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	38858-89-8	C1=C(NN=C1[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 35: 1, 38: 2, 14: 1}
Did not match all atoms present	38859-90-4	CS[As](C)C	{40: 1, 1: 3}
Did not match all atoms present	3886-55-3	CC1=CC(=O)N2C=NNC2=N1	{32: 1, 1: 1, 35: 2, 33: 1, 14: 2, 25: 1}
Did not match all atoms present	3886-69-9	C[C@H](C1=CC=CC=C1)N	{1: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	3886-70-2	C[C@H](C1=CC=CC2=CC=CC=C21)N	{1: 1, 3: 1, 30: 1, 14: 7}
Did not match all atoms present	38861-78-8	CC(C)CC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	38869-19-1	[Li+].CCCCC(=O)[O-]	{24: 1, 1: 1, 2: 3}
Did not match all atoms present	38869-23-7	CCCC(=O)[O-].[Rb+]	{24: 1, 1: 1, 2: 2}
Did not match all atoms present	38869-24-8	CCC(=O)[O-].[Cs+]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	38869-25-9	CCCC(=O)[O-].[Cs+]	{24: 1, 1: 1, 2: 2}
Did not match all atoms present	38869-46-4	C1CN(CCN1)C2=CC=C(C=C2)Cl.Cl.Cl	{32: 1, 17: 3, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	3887-48-7	C1=CC(=CC(=C1)S(=O)(=O)F)N.Cl	{16: 1, 17: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	38875-53-5	C1=C(C(=NC=C1Br)N)N	{18: 1, 35: 1, 30: 2, 14: 2}
Did not match all atoms present	38879-42-4	C[N+]1=CC=CC(=C1)[NH-]	{1: 1, 36: 1, 14: 4, 33: 1}
Did not match all atoms present	3888-44-6	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)[O-])O)O)S(=O)(=O)O.[Na+]	{20: 1, 21: 2, 14: 4, 29: 5}
Did not match all atoms present	38880-06-7	CC(C)(C)C[Hg]C	{1: 4, 2: 1, 4: 1}
Did not match all atoms present	38883-84-0	CC1=C(C(=C(C1=O)C)C2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 25: 1, 14: 10, 15: 4}
Did not match all atoms present	38888-81-2	CC1=CN=C(C(=N1)C)CC(C)C	{1: 4, 2: 1, 3: 1, 14: 1, 35: 2}
Did not match all atoms present	38895-96-4	C1=CC=C(C=C1)C(=O)C(C(C2=CC=C(C=C2)[N+](=O)[O-])Br)Br	{24: 1, 18: 2, 3: 2, 38: 1, 14: 9}
Did not match all atoms present	38896-23-0	CC(=O)NC1=C(C=C(C=C1)C(C)(C)C)C(C)(C)C	{24: 1, 1: 7, 4: 2, 14: 3, 31: 1}
Did not match all atoms present	389-08-2	CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)O	{1: 2, 2: 1, 35: 1, 33: 1, 14: 3, 25: 1, 27: 1}
Did not match all atoms present	389-40-2	COC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 1, 22: 1}
Did not match all atoms present	389-58-2	C1C2=C(C3=C1C=CS3)SC=C2	{41: 2, 11: 1, 14: 4}
Did not match all atoms present	38906-58-0	CCOC(=O)C1(CCN(C1)C)C2=CC(=CC=C2)O	{1: 2, 2: 1, 33: 1, 11: 3, 13: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	3891-07-4	C1=CC=C2C(=C1)C(=O)N(C2=O)CCO	{25: 2, 2: 2, 20: 1, 14: 4, 33: 1}
Did not match all atoms present	3891-79-0	C(CC[NH2+]CCCN)C[NH2+]CCCN.OP(=O)(O)[O-].OP(=O)(O)[O-]	{2: 10, 20: 4, 29: 4, 30: 2}
Did not match all atoms present	38914-96-4	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCNCCCl.O.Cl.Cl	{17: 3, 2: 5, 35: 1, 14: 8, 31: 2}
Did not match all atoms present	38914-97-5	CCN(CCCNC1=C2C=CC=CC2=NC3=CC=CC=C31)CCCl.Cl.Cl	{1: 1, 2: 6, 35: 1, 33: 1, 14: 8, 17: 3, 31: 1}
Did not match all atoms present	38915-00-3	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCN(CCCl)CCCl.Cl.Cl	{33: 1, 2: 7, 35: 1, 14: 8, 17: 4, 31: 1}
Did not match all atoms present	38915-14-9	CC[NH+](CCC[NH2+]C1=C2C=CC=C(C2=NC3=CC=CC=C31)OC)CCCl.[Cl-].[Cl-]	{1: 2, 2: 6, 35: 1, 14: 7, 17: 3, 22: 1}
Did not match all atoms present	38915-22-9	CCN(CCCl)CC(=O)NCCCNC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC.Cl.Cl	{1: 2, 2: 7, 35: 1, 33: 1, 14: 6, 17: 4, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	38915-28-5	CC[NH+](CCCNC1=C2C(=NC3=C1C=CC(=C3)Cl)C=CC(=[NH+]2)OC)CCCl.[Cl-].[Cl-]	{32: 1, 1: 2, 2: 6, 35: 1, 14: 5, 17: 4, 22: 1, 31: 1}
Did not match all atoms present	38915-40-1	CCCCOC1=NC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCN(CC)CCCl.O.Cl.Cl	{1: 2, 2: 9, 35: 2, 33: 1, 14: 5, 17: 4, 22: 1, 31: 1}
Did not match all atoms present	38915-49-0	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)NCCNCCCl.O.Cl.Cl	{17: 3, 2: 4, 35: 1, 14: 10, 31: 2}
Did not match all atoms present	38915-59-2	CCC[NH+](CCCNC1=C2C=CC3=C(C2=[NH+]C4=CC=CC=C41)[NH+]=CC=C3)CCCl.[Cl-].[Cl-].[Cl-]	{32: 2, 1: 1, 2: 7, 14: 9, 17: 4, 31: 1}
Did not match all atoms present	38915-61-6	CC[C@H]1[C@@H]2CC3=C([C@]1(CCN2C)CC)C=C(C=C3)O	{1: 3, 2: 2, 33: 1, 11: 3, 12: 2, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	38924-53-7	C1=CC=C(C=C1)C(=O)C2=NON=C2N	{24: 1, 35: 2, 30: 1, 14: 5, 23: 1}
Did not match all atoms present	38925-90-5	COC1=CC2=C(C=CN=C2C=C1)NCCCNCCCl.Cl.Cl	{1: 1, 2: 5, 35: 1, 14: 5, 17: 3, 22: 1, 31: 2}
Did not match all atoms present	3893-23-0	C1CCC(CC1)C(C#N)C2=CC=CC=C2	{11: 5, 3: 1, 12: 1, 37: 1, 14: 5}
Did not match all atoms present	38939-88-7	CC1=CC(=C(C=C1)[N+](=O)[O-])Cl	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	3894-09-5	C1CCC(CC1)C(C2=CC=CC=C2)C(=O)O	{11: 5, 27: 1, 3: 1, 12: 1, 14: 5}
Did not match all atoms present	38940-46-4	C1CCN(CC1)CCC#CC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3	{33: 1, 2: 2, 3: 1, 10: 2, 11: 5, 14: 10, 24: 1}
Did not match all atoms present	38940-50-0	CC[N+](CC)(CC)CCCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2.[I-]	{1: 3, 2: 6, 3: 1, 14: 10, 19: 1, 24: 1}
Did not match all atoms present	38940-51-1	CC[N+](CC)(CC)CCCCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2.[I-]	{1: 3, 2: 7, 3: 1, 14: 10, 19: 1, 24: 1}
Did not match all atoms present	38942-51-7	CN1C(=NNC1=S)C2=CC=CC=C2	{32: 1, 1: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	38949-38-1	CCOC(=O)C1C(=O)C(C(=O)CC1(C)C)N=NC2=C(C=C(C=C2)C)[N+](=O)[O-]	{1: 4, 2: 1, 34: 2, 38: 1, 11: 1, 12: 2, 13: 1, 14: 3, 25: 2, 28: 1}
Did not match all atoms present	3895-25-8	C1=CC(=CC=C1F)S(=O)(=O)N=C=O	{8: 1, 16: 1, 34: 1, 29: 3, 14: 4}
Did not match all atoms present	38951-94-9	CC(=C(C)[S-])[S-].CC(=C(C)[S-])[S-].[Ni]	{1: 4, 7: 4}
Did not match all atoms present	38951-97-2	COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)[S-])[S-].COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)[S-])[S-].[Ni]	{1: 4, 22: 4, 14: 16, 7: 4}
Did not match all atoms present	38952-49-7	CCCCCCCCCCCCSCCC(=O)[O-].CCCCCCCCCCCCSCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 26, 40: 2}
Did not match all atoms present	38952-51-1	CCCCCCCCCCCCCCCCCCSCCC(=O)[O-].CCCCCCCCCCCCCCCCCCSCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 38, 40: 2}
Did not match all atoms present	38953-40-1	CC1=NC(=O)C(=C(N1)N)OS(=O)(=O)O	{32: 1, 1: 1, 35: 1, 20: 1, 22: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	38954-40-4	CCN(CCOC(=O)C)C1=CC=CC=C1	{1: 2, 2: 3, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	38957-41-4	CCOC1=C(C=NN(C1=O)C)N2CCOCC2	{1: 2, 2: 1, 35: 1, 33: 2, 11: 4, 14: 1, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	3896-29-5	CC(=O)NC1=C(C=CC=C1F)F	{16: 2, 1: 1, 31: 1, 14: 3, 24: 1}
Did not match all atoms present	38965-69-4	[C-]#[N+]/C(=C\C1=CC=C(C=C1)O)/C(=C/C2=CC(=C(C=C2)O)O)/[N+]#[C-]	{34: 2, 21: 3, 14: 7, 6: 2, 7: 2}
Did not match all atoms present	3897-15-2	CN1C(=O)COC(C2=CC=CC=C21)C3=CC=CC=C3	{1: 1, 33: 1, 11: 1, 12: 1, 14: 9, 23: 1, 25: 1}
Did not match all atoms present	38978-76-6	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC=C(C=C3)[N+](=O)[O-])N	{34: 2, 38: 1, 30: 1, 14: 10}
Did not match all atoms present	38978-80-2	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=CC=C(C=C3)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 33: 1, 34: 2, 14: 13, 28: 1}
Did not match all atoms present	3898-08-6	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=S)N	{33: 1, 30: 1, 14: 10, 7: 1}
Did not match all atoms present	3898-41-7	CCCOC1=CC=C(C=C1)OCCC	{1: 2, 2: 4, 22: 2, 14: 4}
Did not match all atoms present	3898-45-1	C1=CC=C(C=C1)CCNNC(=O)N	{24: 1, 2: 2, 30: 1, 14: 5, 31: 2}
Did not match all atoms present	38985-64-7	C1=CC=C(C(=C1)N=C=S)F	{8: 1, 16: 1, 34: 1, 14: 4}
Did not match all atoms present	38985-79-4	CC(=O)NC1=C(C=C(C=C1)Br)C(=O)O	{1: 1, 14: 3, 18: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	38989-37-6	CC1=C2C=C(C(=CC2=CC3=[N+]1C=CC4=CC(=C(C=C43)OC)OC)OC)OC.C(C(=O)O)S(=O)(=O)[O-]	{1: 5, 2: 1, 33: 1, 14: 7, 22: 4, 27: 1, 29: 3}
Did not match all atoms present	390-28-3	CC(C(C1=C(C=CC(=C1)OC)OC)O)N	{1: 3, 3: 2, 14: 3, 20: 1, 22: 2, 30: 1}
Did not match all atoms present	390-64-7	CC(CC1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 3, 3: 2, 14: 15, 31: 1}
Did not match all atoms present	3900-04-7	CCCCCCOP(=O)(O)O	{1: 1, 2: 5, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	3900-31-0	CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F	{1: 1, 35: 1, 33: 1, 11: 1, 14: 7, 15: 1, 16: 1, 17: 1, 25: 1}
Did not match all atoms present	3900-45-6	CC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC	{24: 1, 1: 2, 22: 1, 14: 6}
Did not match all atoms present	3900-46-7	CC(=O)NC1=CC2=C(C=C1)C=C(C=C2)OC	{24: 1, 1: 2, 22: 1, 14: 6, 31: 1}
Did not match all atoms present	3900-93-4	C1CCC(C1)C(C2=CC=CC=C2)C(=O)O	{11: 4, 27: 1, 3: 1, 12: 1, 14: 5}
Did not match all atoms present	39001-02-0	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)OC3=C2C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 8, 23: 1}
Did not match all atoms present	39002-10-3	CC(C1CN(CCC1(C#C)O)CC2=CC=CC=C2)C3=CNC4=CC=CC=C43	{32: 1, 1: 1, 2: 1, 3: 1, 33: 1, 9: 1, 10: 1, 11: 3, 12: 1, 13: 1, 14: 10, 20: 1}
Did not match all atoms present	39003-36-6	C1=CC(=C(C2=C1C(=O)C3=C(C=CC(=C3C2=O)O)[N+](=O)[O-])O)[N+](=O)[O-]	{25: 2, 38: 2, 21: 2, 14: 4}
Did not match all atoms present	3901-04-0	CC1=CC(=C(C(=C1)C)C(C2=CC=CC=C2)C(=O)O)C	{27: 1, 1: 3, 3: 1, 14: 7}
Did not match all atoms present	3901-30-2	CCCCCCCCSCC(C[N+](C)(C)C)O.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 9, 3: 1, 40: 1, 14: 4, 20: 1, 29: 3}
Did not match all atoms present	3901-77-7	C[Si]1(O[Si](O[Si](O1)(C)C=C)(C)C=C)C=C	{1: 3, 5: 3, 6: 3, 23: 3}
Did not match all atoms present	39013-93-9	CCN(CCCNC1=C2C=CC3=C(C2=NC4=CC=CC=C41)N=CC=C3)CCCl.Cl.Cl	{1: 1, 2: 6, 35: 2, 33: 1, 14: 9, 17: 3, 31: 1}
Did not match all atoms present	3902-71-4	CC1=CC(=O)OC2=C1C=C3C=C(OC3=C2C)C	{1: 3, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	39032-87-6	CC(C1CN(CCC1=O)CC2=CC=CC=C2)C3=CNC4=CC=CC=C43	{32: 1, 1: 1, 2: 1, 3: 1, 33: 1, 11: 3, 12: 1, 14: 10, 25: 1}
Did not match all atoms present	39036-65-2	CCCC1=C(C2=CC=CC=C2C=C1)C	{1: 2, 2: 2, 14: 6}
Did not match all atoms present	39049-04-2	CC(C)(C)CC(C)(C)CC(=O)[O-].CC(C)(C)CC(C)(C)CC(=O)[O-].CC(C)(C)CC(C)(C)CC(=O)[O-].[Zr+3]	{24: 3, 1: 15, 2: 6, 4: 6}
Did not match all atoms present	39049-05-3	CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Ti+4]	{24: 4, 1: 12, 2: 20, 4: 4}
Did not match all atoms present	3905-64-4	CC(C)(C)C1=CC2=C(C=C1)C=C(C=C2)C(C)(C)C	{1: 6, 4: 2, 14: 6}
Did not match all atoms present	39051-24-6	[O].[O].[Zn-2]	{}
Did not match all atoms present	39052-12-5	CCOC1=C(C=C(C=C1)N)OCC	{1: 2, 2: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	390525-45-8	O.[K]	{}
Did not match all atoms present	39054-97-2	C1C(=O)CC2=CC=CC3=C2C1=CC=C3	{25: 1, 11: 2, 14: 6}
Did not match all atoms present	3906-55-6	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Ni+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	39060-95-2	C1C(CC2=CC=CC=C21)C3CC4=CC=CC=C4C3	{11: 4, 12: 2, 14: 8}
Did not match all atoms present	39070-08-1	CN1C(=CN=C1[N+](=O)[O-])C=C	{1: 1, 35: 1, 5: 1, 6: 1, 33: 1, 14: 1, 38: 1}
Did not match all atoms present	39070-63-8	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)N)N	{24: 1, 30: 2, 14: 8}
Did not match all atoms present	39079-62-4	C1=CC=C2C(=C1)C(=O)C(=CO2)C(=O)O	{25: 1, 27: 1, 14: 5, 23: 1}
Did not match all atoms present	3908-55-2	C[Si](C)(C)SC	{40: 1, 1: 4}
Did not match all atoms present	39080-46-1	CC1=CC=CC2=NC=C(C(=O)N12)C	{1: 2, 35: 1, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	39082-00-3	C1=CC=C(C=C1)NC(=O)CC(=O)CCl	{24: 2, 17: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	39086-61-8	CCN(C1=CC=CC=C1)C(=O)CCl	{1: 1, 2: 2, 33: 1, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	39098-97-0	C1=CSC(=C1)CC(=O)Cl	{24: 1, 17: 1, 2: 1, 14: 3, 41: 1}
Did not match all atoms present	391-57-1	C1C2=C(C=CC(=C2)NC(=O)C(F)(F)F)C3=C1C=C(C=C3)NC(=O)C(F)(F)F	{4: 2, 11: 1, 14: 6, 16: 6, 24: 2, 31: 2}
Did not match all atoms present	391-70-8	CC[N+](CC)(CC)CCOC(=O)C1=C(C(=C(C=C1)OC)OC)OC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 7, 2: 5, 14: 6, 22: 3, 28: 1, 29: 3}
Did not match all atoms present	3910-35-8	CC1(CC(C2=CC=CC=C21)(C)C3=CC=CC=C3)C	{1: 3, 11: 1, 13: 2, 14: 9}
Did not match all atoms present	39101-54-7	CC1=CC(=CC(=C1)CC#N)C	{1: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	39106-10-0	CC1=CC(=C(C=C1)NC(=O)CCl)C	{1: 2, 2: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	39108-47-9	CCCCN1C(=O)C=C(C(=C1O)C#N)C	{1: 2, 2: 3, 37: 1, 33: 1, 14: 1, 21: 1, 25: 1}
Did not match all atoms present	3911-05-5	CCOP(=S)(OCC)[S-].CCOP(=S)(OCC)[S-].[Ni+2]	{1: 4, 2: 4, 22: 4}
Did not match all atoms present	39115-96-3	C1=CC(=CC(=C1)Br)C(=O)NN	{24: 1, 18: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	39118-50-8	CC(=O)OCCP(=O)(OC)OC	{1: 3, 2: 2, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	3912-37-6	C1=C(C=NS1)C#N	{41: 1, 35: 1, 37: 1, 14: 2}
Did not match all atoms present	39123-31-4	CCCN1C(=O)CSC1=S	{1: 1, 2: 2, 33: 1, 41: 1, 11: 1, 15: 1, 25: 1}
Did not match all atoms present	39128-27-3	CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)Br	{1: 1, 18: 1, 34: 1, 14: 8, 6: 1}
Did not match all atoms present	39133-31-8	CCC(COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)(C2=CC=CC=C2)N(C)C	{1: 6, 2: 2, 4: 1, 33: 1, 14: 7, 22: 3, 28: 1}
Did not match all atoms present	3914-19-0	C1=CC(=CC(=C1)OC(C(F)F)(F)F)OC(C(F)F)(F)F	{16: 8, 3: 2, 4: 2, 22: 2, 14: 4}
Did not match all atoms present	39142-28-4	COC(=O)NC(=S)OC	{1: 2, 31: 1, 28: 1, 22: 1, 7: 1}
Did not match all atoms present	3915-70-6	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=O)/C)/C.C1=CC(=CC=C1O)O	{1: 5, 6: 6, 7: 2, 11: 3, 13: 1, 14: 4, 15: 2, 21: 2, 26: 1}
Did not match all atoms present	39150-45-3	C1=C(C=C(C(=C1Br)N)Br)S(=O)(=O)N	{18: 2, 30: 2, 29: 2, 14: 2}
Did not match all atoms present	39151-19-4	CC(=O)C1=CC(=CC(=C1)OC)OC	{24: 1, 1: 3, 22: 2, 14: 3}
Did not match all atoms present	39153-73-6	C1=CC(=C(C(=C1F)F)Cl)F	{16: 3, 17: 1, 14: 2}
Did not match all atoms present	39156-41-7	COC1=C(C=C(C=C1)N)N.OS(=O)(=O)O	{1: 1, 14: 3, 20: 2, 22: 1, 29: 2, 30: 2}
Did not match all atoms present	39156-80-4	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Tm+3]	{24: 3, 1: 3}
Did not match all atoms present	3916-44-7	C1=CC(=CC=C1C2=CC=C(C=C2)O)[N+](=O)[O-]	{38: 1, 21: 1, 14: 8}
Did not match all atoms present	3916-45-8	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)[N+](=O)[O-]	{28: 1, 38: 1, 14: 13}
Did not match all atoms present	39161-60-9	CN1CCCCN(C2=CC=CC=C21)C	{1: 2, 11: 4, 14: 4, 33: 2}
Did not match all atoms present	39163-92-3	CCCCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C2=C(C3=CC=CC=C3C=C2)O	{1: 1, 2: 13, 14: 10, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	3918-73-8	C1=CC=[N+](C=C1)CC(CS(=O)(=O)[O-])O	{33: 1, 2: 2, 3: 1, 14: 5, 20: 1, 29: 3}
Did not match all atoms present	39182-88-2	CC1=C(C(=C(C=C1)NC(=O)C)C)[N+](=O)[O-]	{24: 1, 1: 3, 38: 1, 14: 2, 31: 1}
Did not match all atoms present	39184-82-2	CC(=S)NC1=CC=CC=C1F	{16: 1, 1: 1, 31: 1, 14: 4, 7: 1}
Did not match all atoms present	39184-83-3	CC(=S)NC1=CC=CC=C1Cl	{1: 1, 31: 1, 17: 1, 14: 4, 7: 1}
Did not match all atoms present	39184-84-4	CC(=S)NC1=CC=CC=C1I	{31: 1, 1: 1, 19: 1, 14: 4, 7: 1}
Did not match all atoms present	39186-58-8	C1=CC=C(C=C1)C(CCBr)(C#N)C2=CC=CC=C2	{2: 2, 4: 1, 18: 1, 14: 10, 37: 1}
Did not match all atoms present	3919-76-4	CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)O	{1: 1, 35: 1, 14: 3, 17: 2, 23: 1, 27: 1}
Did not match all atoms present	39191-07-6	CNCC1=CC(=CC=C1)Cl	{1: 1, 2: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	392-12-1	C1=CC=C2C(=C1)C(=CN2)CC(=O)C(=O)O	{24: 1, 32: 1, 2: 1, 27: 1, 14: 5}
Did not match all atoms present	392-56-3	C1(=C(C(=C(C(=C1F)F)F)F)F)F	{16: 6}
Did not match all atoms present	392-69-8	CC1=CC(=C(C(=C1)C)F)C	{16: 1, 1: 3, 14: 2}
Did not match all atoms present	392-71-2	C1=C(C=C(C(=C1Cl)O)Cl)F	{16: 1, 17: 2, 21: 1, 14: 2}
Did not match all atoms present	392-83-6	C1=CC=C(C(=C1)C(F)(F)F)Br	{16: 3, 18: 1, 4: 1, 14: 4}
Did not match all atoms present	392-85-8	C1=CC=C(C(=C1)C(F)(F)F)F	{16: 4, 4: 1, 14: 4}
Did not match all atoms present	392-95-0	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]	{16: 3, 17: 1, 4: 1, 38: 2, 14: 2}
Did not match all atoms present	39201-27-9	[O-]B(O)O	{20: 2, 29: 1}
Did not match all atoms present	39203-84-4	CCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)C#N	{1: 1, 2: 3, 37: 1, 6: 1, 34: 1, 14: 8}
Did not match all atoms present	39204-47-2	C1=CN=C(C=N1)CCl	{17: 1, 2: 1, 35: 2, 14: 3}
Did not match all atoms present	39205-62-4	C1=CC2=C(C(=C1)Cl)NC(=O)S2	{32: 1, 17: 1, 41: 1, 14: 3, 25: 1}
Did not match all atoms present	39208-00-9	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C=O	{1: 2, 26: 1, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	39211-93-3	C1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)C(Cl)(Cl)Cl	{17: 3, 18: 1, 3: 1, 4: 1, 14: 9}
Did not match all atoms present	3922-40-5	C1=CC2=C(C3=C1C(=O)C=CN3)NC=CC2=O	{32: 2, 25: 2, 14: 6}
Did not match all atoms present	39220-69-4	CCC(C)C1=CC=C(C=C1)Br	{1: 2, 2: 1, 3: 1, 18: 1, 14: 4}
Did not match all atoms present	39222-73-6	CC(C)(C)C1=NN=C(S1)N	{1: 3, 35: 2, 4: 1, 30: 1, 41: 1}
Did not match all atoms present	39225-17-7	CCOP(=O)(CC1=CC=C(C=C1)Cl)OCC	{1: 2, 2: 3, 14: 4, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	39227-28-6	C1=C2C(=CC(=C1Cl)Cl)OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 6, 14: 2, 23: 2}
Did not match all atoms present	39227-54-8	C1=CC=C2C(=C1)OC3=C(O2)C=C(C=C3)Cl	{17: 1, 14: 7, 23: 2}
Did not match all atoms present	39227-58-2	C1=CC=C2C(=C1)OC3=C(O2)C(=C(C=C3Cl)Cl)Cl	{17: 3, 14: 5, 23: 2}
Did not match all atoms present	39227-61-7	C1=CC2=C(C=C1Cl)OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 5, 14: 3, 23: 2}
Did not match all atoms present	39227-62-8	C1=C(C2=C(C(=C1Cl)Cl)OC3=C(O2)C(=C(C=C3Cl)Cl)Cl)Cl	{17: 6, 14: 2, 23: 2}
Did not match all atoms present	39228-29-0	COC(=O)C=CC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 38: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	3923-52-2	C#CC(C1=CC=CC=C1)(C2=CC=CC=C2)O	{9: 1, 10: 1, 4: 1, 14: 10, 20: 1}
Did not match all atoms present	39230-20-1	CC(=O)NC1=C(C=CC(=C1)N(CCC#N)CCOC(=O)C)N=NC2=CC=C(C=C2)N=NC3=CC=CC=C3	{1: 2, 2: 4, 37: 1, 33: 1, 34: 4, 14: 12, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	39230-37-0	[2H]C([2H])([2H])C(=O)[O-].[Na+]	{24: 1, 1: 1}
Did not match all atoms present	39232-03-6	C1=CC(=CC=C1CCBr)N	{2: 2, 30: 1, 18: 1, 14: 4}
Did not match all atoms present	39234-86-1	C1=C(C=C(C=C1C(F)(F)F)S(=O)(=O)Cl)C(F)(F)F	{16: 6, 17: 1, 4: 2, 29: 2, 14: 3}
Did not match all atoms present	39244-10-5	C1=COC=C1C=CC(=O)O	{27: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	39251-86-0	CCCCCCOC(=O)C1=CC=CO1	{1: 1, 2: 5, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	39251-88-2	CCCCCCCCOC(=O)C1=CC=CO1	{1: 1, 2: 7, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	39255-20-4	CCOCCOC1=CC=C(C=C1)Br	{1: 1, 2: 3, 22: 2, 18: 1, 14: 4}
Did not match all atoms present	3926-62-3	C(C(=O)[O-])Cl.[Na+]	{24: 1, 17: 1, 2: 1}
Did not match all atoms present	39263-32-6	C1=CC(=C(C=C1Br)C#N)N	{18: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	39273-52-4	CC[O+]=C1C=C(OC2=CC=CC=C21)C3=CC=C(C=C3)OC.[O-]Cl(=O)(=O)=O	{1: 2, 2: 1, 14: 9, 17: 1, 22: 2, 23: 1, 29: 4}
Did not match all atoms present	39274-39-0	C(F)(F)(F)S(=O)(=O)O.F[Xe]F	{16: 5, 20: 1, 4: 1, 29: 2}
Did not match all atoms present	39277-41-3	CC1=CCCC(C12CC3=C4C(C5(CC(=O)C(=C(C5(C(=O)C4=C(C6=C3C2=C(C=C6O)OC)O)O)O)C(=O)N)O)O)(C)C	{1: 4, 11: 4, 12: 1, 13: 4, 14: 2, 15: 3, 20: 4, 21: 2, 22: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	39277-47-9	CCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl.CCCCOC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 8, 14: 5, 17: 5, 22: 2, 28: 2}
Did not match all atoms present	3929-47-3	COC1=C(C=C(C=C1)CCCO)OC	{1: 2, 2: 3, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	39290-85-2	B([O-])([O-])[O-].B([O-])([O-])[O-].[Cu+2].[Cu+2].[Cu+2]	{29: 6}
Did not match all atoms present	39294-08-1	[Sr].[Sr].[Sr].[Sb].[Sb]	{}
Did not match all atoms present	39296-38-3	C1=CC(=CC=C1S(=O)(=O)NC[C@H](C(=O)N)Cl)Cl	{2: 1, 3: 1, 14: 4, 17: 2, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	393-01-1	C1=CC(=C(C(=C1C(F)(F)F)F)F)F	{16: 6, 4: 1, 14: 2}
Did not match all atoms present	393-02-2	C(F)(F)(F)P1P(P(P1C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 12, 4: 4}
Did not match all atoms present	393-05-5	C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 9, 4: 3, 14: 3}
Did not match all atoms present	393-09-9	C1=CC(=C(C=C1F)C(F)(F)F)[N+](=O)[O-]	{16: 4, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	393-11-3	C1=CC(=C(C=C1N)C(F)(F)F)[N+](=O)[O-]	{16: 3, 38: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	393-36-2	C1=CC(=C(C=C1N)C(F)(F)F)Br	{16: 3, 18: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	393-39-5	C1=CC(=C(C=C1F)C(F)(F)F)N	{16: 4, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	393-52-2	C1=CC=C(C(=C1)C(=O)Cl)F	{16: 1, 17: 1, 14: 4, 24: 1}
Did not match all atoms present	393-75-9	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(F)(F)F	{16: 3, 17: 1, 4: 1, 38: 2, 14: 2}
Did not match all atoms present	3930-19-6	CC\1=C(NC(=C(/C1=C\2/C=CC(=C(C2=O)OC)OC)N)C3=NC4=C(C=C3)C(=O)C(=C(C4=O)N)OC)C(=O)O	{32: 1, 1: 4, 35: 1, 14: 4, 15: 10, 22: 3, 25: 3, 27: 1, 30: 2}
Did not match all atoms present	3930-20-9	CC(C)NCC(C1=CC=C(C=C1)NS(=O)(=O)C)O	{1: 3, 2: 1, 3: 2, 14: 4, 20: 1, 29: 2, 31: 2}
Did not match all atoms present	39327-80-5	O=[Re](=O)=O.I	{19: 1, 29: 3}
Did not match all atoms present	3933-94-6	C1=CC=C(C=C1)C2=CC=C(C=C2)OC3=CC=CC=C3	{22: 1, 14: 14}
Did not match all atoms present	39330-74-0	[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Er+3]	{14: 15}
Did not match all atoms present	39333-53-4	[CH3-].[CH3-].[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[W]	{14: 10}
Did not match all atoms present	39336-08-8	C1=C(C=C(C(=C1O)[O-])O)C(=O)O.C1=C(C=C(C(=C1O)[O-])O)C(=O)O.[Mg+2]	{27: 2, 21: 4, 14: 4}
Did not match all atoms present	3934-20-1	C1=CN=C(N=C1Cl)Cl	{17: 2, 35: 2, 14: 2}
Did not match all atoms present	3934-76-7	C1=CC=C(C=C1)C2=C(C(=C(C=C2)O)O)O	{21: 3, 14: 7}
Did not match all atoms present	3934-77-8	CC(C)(C)C1=CC(=C(C(=C1O)O)O)C(C)(C)C	{1: 6, 4: 2, 21: 3, 14: 1}
Did not match all atoms present	3934-87-0	COC1=CC(=CC(=C1O)O)C=O	{1: 1, 22: 1, 26: 1, 21: 2, 14: 2}
Did not match all atoms present	39340-46-0	C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@]3(C[C@H]2O)O[C@@H]4[C@H](O[C@H](C[C@]4(O3)C)O[C@@H]5[C@H]([C@@H](O[C@@H]([C@@H]5OC)C)O[C@@H]6[C@H](O[C@H]([C@H]([C@H]6O)OC)O[C@H]7[C@@H]([C@H]8[C@H](CO7)O[C@@]9(O8)[C@H]1[C@H]([C@@](CO9)([C@H](C)OC)O)OCO1)OC)COC)O)C)C)O[C@H]1C[C@]([C@H]([C@@H](O1)C)OC)(C)[N+](=O)[O-])OC(=O)C1=C(C(=C(C(=C1OC)Cl)O)Cl)C	{1: 16, 2: 1, 3: 1, 38: 1, 11: 7, 12: 29, 13: 5, 17: 2, 20: 4, 21: 1, 22: 12, 23: 14, 28: 1}
Did not match all atoms present	39356-80-4	[Fe].[Fe].[Fe].[Sb].[Sb]	{}
Did not match all atoms present	39361-75-6	[O-][Zr](=O)[O-].[Co+2]	{29: 3}
Did not match all atoms present	39367-89-0	CCN(CC)CCN(C1=C(C=C(C=C1C)C)C)C(=O)C2=C(C=C(C=C2C)C)C.Cl	{1: 8, 2: 4, 33: 2, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	3937-30-2	C[Si](C)CC=C	{1: 2, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	3937-96-0	CC1=CC=C(C=C1)S(=O)(=O)CC(=O)O	{1: 1, 2: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	39377-45-2	[O-2].[O-2].[O-2].[Al+3].[Al+3]	{}
Did not match all atoms present	3938-45-2	CC(C)C1=CC(=CC=C1)OC(=O)N(C)C	{1: 4, 3: 1, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	3939-09-1	C1=CC(=C(C=C1F)F)C#N	{16: 2, 37: 1, 14: 3}
Did not match all atoms present	39391-39-4	C1[C@@H](C(=O)N1[C@H](C2=CC=C(C=C2)O)C(=O)O)NC(=O)/C(=N\O)/C3=CC=C(C=C3)OCC[C@H](C(=O)O)N	{33: 1, 2: 2, 3: 2, 7: 1, 11: 1, 12: 1, 34: 1, 14: 8, 20: 1, 21: 1, 22: 1, 24: 1, 25: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	394-25-2	COC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]	{1: 1, 4: 1, 38: 1, 14: 3, 16: 3, 22: 1}
Did not match all atoms present	394-31-0	C1=CC(=C(C=C1O)C(=O)O)N	{30: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	394-32-1	CC(=O)C1=C(C=CC(=C1)F)O	{16: 1, 1: 1, 21: 1, 14: 3, 24: 1}
Did not match all atoms present	394-33-2	C1=CC(=C(C=C1F)[N+](=O)[O-])O	{16: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	394-35-4	COC(=O)C1=CC=CC=C1F	{16: 1, 1: 1, 28: 1, 14: 4}
Did not match all atoms present	394-41-2	C1=CC(=C(C=C1O)F)[N+](=O)[O-]	{16: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	394-46-7	C=CC1=CC=CC=C1F	{16: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	394-47-8	C1=CC=C(C(=C1)C#N)F	{16: 1, 37: 1, 14: 4}
Did not match all atoms present	394-56-9	C1=CC(=CC=C1C(C(Cl)(Cl)Cl)O)F	{3: 1, 4: 1, 14: 4, 16: 1, 17: 3, 20: 1}
Did not match all atoms present	394-59-2	CC1=CC=C(C=C1)C(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4, 24: 1}
Did not match all atoms present	394-69-4	C1=CC2=C(C=CC=N2)C(=C1)F	{16: 1, 35: 1, 14: 6}
Did not match all atoms present	39416-48-3	[H+].C1=CC=NC=C1.[Br-].[Br-].[Br-]	{18: 3, 35: 1, 14: 5}
Did not match all atoms present	3942-54-9	CNC(=O)OC1=CC=CC=C1Cl	{1: 1, 31: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	39422-94-1	[CH-]1[CH-][C-]([CH-][CH-][C-]1F)F.C1=CC(=CC=C1F)F.[Cr]	{16: 4, 14: 8, 15: 2}
Did not match all atoms present	39426-77-2	CC(=O)C1CN(CCC1C2=CC=C(C=C2)Cl)CCCN3CCN(CC3)C.Cl.Cl.Cl	{1: 2, 2: 3, 33: 3, 11: 7, 12: 2, 14: 4, 17: 4, 24: 1}
Did not match all atoms present	3943-74-6	COC1=C(C=CC(=C1)C(=O)OC)O	{1: 2, 22: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	3943-77-9	CCOC(=O)C1=CC(=C(C=C1)OC)OC	{1: 3, 2: 1, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	3943-89-3	CCOC(=O)C1=CC(=C(C=C1)O)O	{1: 1, 2: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	3943-95-1	COC(=O)C=CC1=CC(=CC=C1)O	{1: 1, 28: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	3943-97-3	COC(=O)/C=C/C1=CC=C(C=C1)O	{1: 1, 28: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	39437-99-5	C[Si](C)(C)[Si](C)(Cl)Cl	{1: 4, 17: 2}
Did not match all atoms present	3944-08-9	C[Si]1(CCC1)C2=CC=CC=C2	{1: 1, 11: 3, 14: 5}
Did not match all atoms present	39444-67-2	C(=C\C(=O)[O-])\C(=O)[O-].[NH4+].[NH4+]	{24: 2, 6: 2}
Did not match all atoms present	3946-29-0	C1=CC(=CC=C1C(=O)CCCl)Cl	{24: 1, 17: 2, 2: 2, 14: 4}
Did not match all atoms present	39466-62-1	[15NH4+].[Cl-]	{17: 1}
Did not match all atoms present	3947-58-8	C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)CBr)O	{2: 1, 38: 1, 14: 3, 18: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	3947-97-5	C1=CC=C(C=C1)C2=CC(=O)C2=O	{25: 2, 14: 6}
Did not match all atoms present	39472-31-6	CC1C(C(CC(O1)OC2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5O)O)(C(=O)C)O)N)O	{1: 2, 11: 3, 12: 5, 13: 1, 14: 3, 20: 2, 21: 3, 22: 1, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	39478-78-9	CC1=C(C=C(C=C1)Br)N	{1: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	39479-71-5	CCOC(=O)C1=CNC2=C(C1=O)C=CC3=C2NC=C(C3=O)C(=O)OCC	{32: 2, 1: 2, 2: 2, 14: 4, 25: 2, 28: 2}
Did not match all atoms present	39482-21-8	C[Si](C)(C)CN(C(=O)N)N=O	{1: 3, 2: 1, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
Did not match all atoms present	39482-87-6	C[Si](C)(CCC(F)(F)F)N[Si](C)(C)CCC(F)(F)F	{16: 6, 1: 4, 2: 4, 4: 2, 31: 1}
Did not match all atoms present	39489-79-7	C1=C(C(=CC(=C1O)Cl)Cl)N	{17: 2, 30: 1, 21: 1, 14: 2}
Did not match all atoms present	3949-36-8	CC(=O)C1=CC2=CC=CC=C2OC1=O	{24: 1, 1: 1, 28: 1, 14: 5}
Did not match all atoms present	3949-47-1	CCCCN(CCCC)P(=S)(N(CCCC)CCCC)N(CCCC)CCCC	{1: 6, 2: 18, 33: 3}
Did not match all atoms present	395-23-3	C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(F)(F)F)O	{16: 3, 20: 1, 3: 1, 4: 1, 14: 9}
Did not match all atoms present	395-28-8	CC(COC1=CC=CC=C1)NC(C)C(C2=CC=C(C=C2)O)O	{1: 2, 2: 1, 3: 3, 14: 9, 20: 1, 21: 1, 22: 1, 31: 1}
Did not match all atoms present	395-35-7	C1=CC(=CC=C1C(C(=O)O)O)C(F)(F)F	{3: 1, 4: 1, 14: 4, 16: 3, 20: 1, 27: 1}
Did not match all atoms present	395-44-8	C1=CC=C(C(=C1)CBr)C(F)(F)F	{16: 3, 2: 1, 4: 1, 18: 1, 14: 4}
Did not match all atoms present	395-45-9	C=CC1=CC=CC=C1C(F)(F)F	{16: 3, 14: 4, 4: 1, 5: 1, 6: 1}
Did not match all atoms present	395-64-2	C1=CC(=C(C=C1C(F)(F)F)C=O)C(F)(F)F	{16: 6, 26: 1, 4: 2, 14: 3}
Did not match all atoms present	39508-23-1	C[Si](C)(C)N(CCCC(=O)O[Si](C)(C)C)[Si](C)(C)C	{1: 9, 2: 3, 28: 1, 33: 1}
Did not match all atoms present	39508-27-5	C[N+](C)(C)C1=CC(=C(C=C1)F)[N+](=O)[O-].[I-]	{16: 1, 1: 3, 19: 1, 38: 1, 14: 3}
Did not match all atoms present	39511-08-5	C1=COC(=C1)C=CC=O	{26: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	39512-49-7	C1CNCCC1(C2=CC=C(C=C2)Cl)O	{32: 1, 11: 4, 13: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	39513-75-2	CC1=CC2=C(C=C1)OCCC2=O	{1: 1, 11: 2, 25: 1, 14: 3, 23: 1}
Did not match all atoms present	39515-40-7	CC(=CC1C(C1(C)C)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C	{1: 4, 3: 1, 37: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 22: 1, 28: 1}
Did not match all atoms present	39515-41-8	CC1(C(C1(C)C)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C	{1: 4, 3: 1, 37: 1, 12: 1, 13: 2, 14: 9, 22: 1, 28: 1}
Did not match all atoms present	39515-47-4	C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C#N)O	{3: 1, 20: 1, 22: 1, 14: 9, 37: 1}
Did not match all atoms present	39515-51-0	C1=CC=C(C=C1)OC2=CC=CC(=C2)C=O	{26: 1, 22: 1, 14: 9}
Did not match all atoms present	3952-78-1	C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CC(=O)O)CC(=O)O	{33: 1, 2: 3, 14: 5, 21: 2, 25: 2, 27: 2}
Did not match all atoms present	3952-98-5	C=CC/C(=N\OS(=O)(=O)[O-])/SC1C(C(C(C(O1)CO)O)O)O.[K+]	{2: 2, 5: 1, 6: 1, 7: 1, 40: 1, 12: 5, 34: 1, 20: 4, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	39529-26-5	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O	{24: 10, 1: 10, 2: 180, 3: 10, 20: 30}
Did not match all atoms present	3953-65-9	CNCCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.Cl	{1: 1, 2: 3, 33: 1, 41: 1, 14: 7, 17: 2, 31: 1}
Did not match all atoms present	39538-11-9	C[Si](C)(C)NCCCC(=O)O[Si](C)(C)C	{1: 6, 2: 3, 28: 1, 31: 1}
Did not match all atoms present	39542-83-1	CCN1C(=O)/C(=C\NC2=CC=CC=C2)/SC1=S	{1: 1, 2: 1, 6: 1, 33: 1, 41: 1, 14: 5, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	39543-79-8	CC(C)[NH2+]CC(COC1=CC=CC2=C1OC(=C2)C(=O)C)O.[Cl-]	{1: 3, 2: 2, 3: 2, 14: 4, 17: 1, 20: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	39543-80-1	CC(=O)C1=CC2=C(O1)C(=CC=C2)OCC(CNC(C)(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 14: 4, 20: 1, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	39543-84-5	CC(=O)C1=CC2=C(O1)C=CC=C2OCC(CNC(C)(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 14: 4, 20: 1, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	39543-94-7	CCC(C)NCC(COC1=CC=CC2=C1OC(=C2)C(=O)C)O	{1: 3, 2: 3, 3: 2, 14: 4, 20: 1, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	39545-31-8	C1=CC=C(C(=C1)COC(=O)Cl)Cl	{17: 2, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	39549-27-4	CC1=C(C=C(C(=C1Cl)O)[N+](=O)[O-])Cl	{1: 1, 38: 1, 21: 1, 14: 1, 17: 2}
Did not match all atoms present	39549-31-0	CC1=C(C=C(C(=C1Cl)O)N)Cl.Cl	{1: 1, 30: 1, 21: 1, 14: 1, 17: 3}
Did not match all atoms present	3955-26-8	C1=C(C(=CC(=C1Cl)Cl)Cl)CCl	{17: 4, 2: 1, 14: 2}
Did not match all atoms present	3955-58-6	CCN(C1=CC=CC=C1)C(=S)N	{1: 1, 2: 1, 33: 1, 7: 1, 14: 5, 30: 1}
Did not match all atoms present	39552-01-7	CC(C)NCC(COC1=CC=CC2=C1OC(=C2)C(=O)C)O	{1: 3, 2: 2, 3: 2, 14: 4, 20: 1, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	39557-71-6	C=CC1=CC2=C(C=C1)OCCOCCOCCOCCOCCO2	{14: 3, 11: 10, 5: 1, 6: 1, 23: 6}
Did not match all atoms present	3956-63-6	C1=CC(=C(C=C1Cl)Cl)OCC#N	{17: 2, 2: 1, 22: 1, 14: 3, 37: 1}
Did not match all atoms present	3956-73-8	CCN(CC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(C4=CC=C(C=C4)N(CC)CC)C5=CC=C(C=C5)N(CC)CC	{1: 8, 2: 8, 14: 20, 33: 6}
Did not match all atoms present	39562-22-6	CC(=O)/C(=C\C1=CC(=CC=C1)[N+](=O)[O-])/C(=O)OCCOC	{1: 2, 2: 2, 38: 1, 6: 1, 7: 1, 14: 4, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	39562-70-4	CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)C	{32: 1, 1: 4, 2: 1, 38: 1, 12: 1, 14: 4, 15: 4, 28: 2}
Did not match all atoms present	39565-00-9	CC(=O)C1=CC=C(S1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 2, 41: 1}
Did not match all atoms present	39565-05-4	C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CN=C(S2)N	{35: 1, 38: 1, 41: 1, 14: 5, 29: 2, 30: 1}
Did not match all atoms present	3957-22-0	CC(C)(C1=CC(=C(C(=C1)CO)O)CO)C2=CC(=C(C(=C2)CO)O)CO	{1: 2, 2: 4, 4: 1, 14: 4, 20: 4, 21: 2}
Did not match all atoms present	39574-16-8	CCOC(=O)C(C)N=C=S	{1: 2, 2: 1, 3: 1, 8: 1, 34: 1, 28: 1}
Did not match all atoms present	3958-03-0	C1(=C(SC(=C1Br)Br)Br)Br	{41: 1, 18: 4}
Did not match all atoms present	3958-19-8	C1=CC=C(C=C1)[Sb](=S)(C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	3958-57-4	C1=CC(=CC(=C1)[N+](=O)[O-])CBr	{2: 1, 38: 1, 18: 1, 14: 4}
Did not match all atoms present	3958-60-9	C1=CC=C(C(=C1)CBr)[N+](=O)[O-]	{2: 1, 38: 1, 18: 1, 14: 4}
Did not match all atoms present	39582-26-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)S(=O)(=O)CCO)S(=O)(=O)O)N	{2: 2, 14: 9, 20: 2, 25: 2, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	3959-07-7	C1=CC(=CC=C1CN)Br	{2: 1, 30: 1, 18: 1, 14: 4}
Did not match all atoms present	39590-27-7	CCOC1=CC=CC=C1CCN	{1: 1, 2: 3, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	396-01-0	C1=CC=C(C=C1)C2=NC3=C(N=C2N)N=C(N=C3N)N	{35: 4, 30: 3, 14: 5}
Did not match all atoms present	396-32-7	C1=CC2=C(C=C(C=C2)F)N=C1	{16: 1, 35: 1, 14: 6}
Did not match all atoms present	396-64-5	C1=CC(=CC(=C1)F)C2=CC(=CC=C2)F	{16: 2, 14: 8}
Did not match all atoms present	396-86-1	C1=CC(=C(C=C1C2=CC(=C(C=C2)O)F)F)O	{16: 2, 21: 2, 14: 6}
Did not match all atoms present	39600-31-2	CC1=NC(=CC2=CC(=C(C=C2)OC(=O)C)OC)C(=O)O1	{1: 3, 35: 1, 6: 1, 14: 3, 15: 2, 22: 1, 28: 2}
Did not match all atoms present	39603-24-2	CC1=CC(=C2C(=C1)C(=O)C(=O)N2)C	{32: 1, 1: 2, 14: 2, 25: 2}
Did not match all atoms present	39603-48-0	C(NNC(=S)N)NNC(=S)N	{2: 1, 31: 4, 30: 2, 7: 2}
Did not match all atoms present	39608-31-6	CN(CC(=O)O)C(=O)OCC1=CC=CC=C1	{1: 1, 2: 2, 33: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	39608-47-4	C1=CC(=C(C=C1C(=O)O)Cl)[N+](=O)[O-]	{17: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	39614-78-3	CCOC1=NN=C(C=C1)N	{1: 1, 2: 1, 35: 2, 14: 2, 22: 1, 30: 1}
Did not match all atoms present	39616-93-8	C1=CC(=CC(=C1)S(=O)(=O)O)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)O	{20: 2, 29: 6, 14: 8}
Did not match all atoms present	39617-48-6	C1CC(CC1N)(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl.Cl	{11: 3, 12: 1, 13: 1, 14: 8, 17: 3, 30: 1}
Did not match all atoms present	3962-77-4	COC1=C(C=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 22: 1, 14: 3}
Did not match all atoms present	39622-79-2	C1=CC(=C(C(=C1)C(=O)O)N)C(=O)O	{27: 2, 30: 1, 14: 3}
Did not match all atoms present	39627-84-4	C1=CC=C2C=C(C=CC2=C1)C(=O)NN	{24: 1, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	39627-98-0	CC1=C(C(=CC=C1)C)NC(=O)C2=CC=CC=N2	{24: 1, 1: 2, 35: 1, 14: 7, 31: 1}
Did not match all atoms present	39629-27-1	CCC1C(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 33: 1, 12: 2, 14: 10, 25: 1}
Did not match all atoms present	3963-62-0	C1=CC=C(C=C1)C(CN)C2=CC=CC=C2	{2: 1, 3: 1, 30: 1, 14: 10}
Did not match all atoms present	3963-78-8	C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)N	{25: 2, 30: 1, 21: 2, 14: 5}
Did not match all atoms present	3963-79-9	CC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)C	{1: 2, 34: 2, 30: 1, 14: 7}
Did not match all atoms present	3963-80-2	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)[O-])N)O)S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 21: 1, 14: 4, 29: 6}
Did not match all atoms present	3963-95-9	CN(C)[C@H]1[C@@H]2[C@H]([C@@H]3C(=C)C4=C(C(=CC=C4)O)C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O.Cl	{1: 2, 5: 1, 33: 1, 12: 4, 13: 1, 14: 3, 15: 5, 17: 1, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	39634-42-9	C1=CC(=CC=C1C(F)(F)F)OC2=CC=C(C=C2)O	{16: 3, 22: 1, 4: 1, 21: 1, 14: 8}
Did not match all atoms present	39635-31-9	C1=C(C=C(C(=C1Cl)Cl)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	39635-79-5	C1=C(C=C(C(=C1Br)O)Br)S(=O)(=O)C2=CC(=C(C(=C2)Br)O)Br	{18: 4, 21: 2, 14: 4, 29: 2}
Did not match all atoms present	39637-16-6	CCCC[Sn](CCCC)(CCCC)OC1=C(C=C(C=C1)Cl)Cl	{1: 3, 2: 9, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	39637-99-5	CO[C@@](C1=CC=CC=C1)(C(=O)Cl)C(F)(F)F	{1: 1, 4: 2, 14: 5, 16: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	39638-73-8	C1=C(C(=NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)N)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 1, 20: 3, 21: 1, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	3964-56-5	C1=CC(=C(C=C1Br)Cl)O	{17: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	3964-58-7	C1=CC(=C(C=C1C(=O)O)Cl)O	{17: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	3964-81-6	CN1CCC(=C2C3=CC=CC=C3CCC4=C2N=CC=C4)CC1	{1: 1, 35: 1, 33: 1, 11: 6, 14: 7, 15: 2}
Did not match all atoms present	39642-65-4	C1=CC(=CN=C1)CNC(=O)NCC2=CN=CC=C2	{24: 1, 2: 2, 35: 2, 14: 8, 31: 2}
Did not match all atoms present	39643-31-7	C1CCN(CC1)C2=CC=CC=C2N	{33: 1, 11: 5, 30: 1, 14: 4}
Did not match all atoms present	39649-71-3	CCCCCCOC1=CC=C(C=C1)C(=O)Cl	{1: 1, 2: 5, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	3965-53-5	COC(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC	{1: 2, 28: 2, 29: 2, 14: 8}
Did not match all atoms present	3965-55-7	COC(=O)C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)OC.[Na+]	{1: 2, 28: 2, 29: 3, 14: 3}
Did not match all atoms present	3965-63-7	CC(C)(C)OO[Si](C)(C)C	{1: 6, 4: 1, 22: 2}
Did not match all atoms present	39652-32-9	CC1=C(C=C(C=C1)CO)Cl	{1: 1, 2: 1, 20: 1, 14: 3, 17: 1}
Did not match all atoms present	39652-40-9	C1=CC=C(C=C1)N(P(Cl)Cl)P(Cl)Cl	{17: 4, 14: 5, 33: 1}
Did not match all atoms present	3966-32-3	CO[C@H](C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	39663-84-8	[Li+].C(C(=O)[O-])O	{24: 1, 2: 1, 20: 1}
Did not match all atoms present	39669-95-9	C=CC=CCCC1=CC=CC=C1	{2: 2, 14: 5, 5: 1, 6: 3}
Did not match all atoms present	3967-54-2	C1C(OC(=O)O1)Cl	{17: 1, 11: 1, 12: 1}
Did not match all atoms present	3967-55-3	C1(C(OC(=O)O1)Cl)Cl	{17: 2, 12: 2}
Did not match all atoms present	3968-63-6	C1=CC2=C3C(=C1)SC3=CC=C2	{41: 1, 14: 6}
Did not match all atoms present	3968-85-2	CCC(C)CC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	3968-86-3	CCC(C)C(C1=CC=CC=C1)O	{1: 2, 2: 1, 3: 2, 20: 1, 14: 5}
Did not match all atoms present	39680-90-5	CNC(=S)[S-].[NH4+]	{1: 1, 31: 1, 7: 1}
Did not match all atoms present	39687-95-1	COC(=O)C[N+]#[C-]	{1: 1, 2: 1, 28: 1, 34: 1}
Did not match all atoms present	3969-54-8	CC1=CC=C(C=C1)[As](=O)(O)O	{1: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	39697-33-1	COC(=O)C1=CC=C[Se]1	{1: 1, 28: 1, 14: 3}
Did not match all atoms present	39699-08-6	C1=CC2=C(C(=C(C=C2C(=C1)S(=O)(=O)O)N)N)S(=O)(=O)O	{30: 2, 20: 2, 29: 4, 14: 4}
Did not match all atoms present	3970-28-3	CC1=CC=C(S1)S	{1: 1, 41: 1, 14: 2, 39: 1}
Did not match all atoms present	3970-35-2	C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)C(=O)O	{17: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	3970-40-9	CC1=C(C(=CC=C1)[N+](=O)[O-])Cl	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	39701-33-2	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OC.COS(=O)(=O)[O-]	{1: 6, 2: 4, 33: 2, 14: 10, 22: 1, 23: 1, 28: 1, 29: 3}
Did not match all atoms present	3971-35-5	CCCCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCCC	{1: 2, 2: 6, 28: 2, 29: 2, 14: 8}
Did not match all atoms present	39716-70-6	C1=CC=NC=C1.C1=CC=NC=C1.[N+](=O)([O-])[O-].[Ag+]	{35: 2, 14: 10}
Did not match all atoms present	39718-07-5	CC1=CC(=CC(=C1)C#N)C#N	{1: 1, 37: 2, 14: 3}
Did not match all atoms present	39718-32-6	C1=CC(=C(C=C1F)N=C=O)F	{8: 1, 16: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	39718-89-3	CC(C1=CC=C(C=C1)NCC(=C)C)C(=O)O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 14: 4, 27: 1, 31: 1}
Did not match all atoms present	39718-99-5	C1=CC=C(C=C1)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9, 31: 2}
Did not match all atoms present	3972-25-6	[2H]OC(C)(C)C	{1: 3, 4: 1, 20: 1}
Did not match all atoms present	3972-55-2	CC(C)(C)C1=CC(=CC=C1)Cl	{1: 3, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	3972-56-3	CC(C)(C)C1=CC=C(C=C1)Cl	{1: 3, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	3972-65-4	CC(C)(C)C1=CC=C(C=C1)Br	{1: 3, 18: 1, 4: 1, 14: 4}
Did not match all atoms present	39720-27-9	CC(=O)OC1=CC=C(C=C1)CCl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	3973-62-4	C1CC(CNC1)C2=CC=CC=C2	{32: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	39735-49-4	C1=CC(=CC=C1C(=O)NCC(=O)NO)[N+](=O)[O-]	{2: 1, 38: 1, 14: 4, 20: 1, 24: 2, 31: 2}
Did not match all atoms present	39742-60-4	C1CN(CCC1=O)CCC2=CC=CC=C2	{25: 1, 2: 2, 11: 4, 14: 5, 33: 1}
Did not match all atoms present	39745-39-6	CC1=CC=C(C(=O)N1)[N+](=O)[O-]	{32: 1, 1: 1, 38: 1, 14: 2, 25: 1}
Did not match all atoms present	39745-40-9	CC1=NC(=C(C=C1)N)Cl	{1: 1, 35: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	39746-00-4	C1[C@H]2[C@H](CC(=O)O2)[C@H]([C@@H]1OC(=O)C3=CC=CC=C3)CO	{2: 1, 11: 2, 12: 4, 14: 5, 20: 1, 28: 2}
Did not match all atoms present	3975-77-7	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)Br)C(C)(C)C	{1: 9, 18: 1, 4: 3, 14: 2}
Did not match all atoms present	39750-11-3	[2H]C1=C(C(=C(C(=C1N=[N+](C2=C(C(=C(C(=C2[2H])[2H])OC([2H])([2H])[2H])[2H])[2H])[O-])[2H])[2H])OC([2H])([2H])[2H])[2H]	{1: 2, 34: 1, 33: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	39753-42-9	CC1=C([N+](N=C1C)([O-])OC)C	{1: 4, 35: 1, 29: 1, 22: 1, 15: 3}
Did not match all atoms present	39754-64-8	C1CNC(=S)OC1COC2=CC=CC=C2	{32: 1, 2: 1, 11: 2, 12: 1, 14: 5, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	39755-03-8	C1=CC=C(C=C1)C(=O)CCCO	{24: 1, 2: 3, 20: 1, 14: 5}
Did not match all atoms present	3976-34-9	CC1=C(C(=CC=C1)C)C2=CC=CC=C2	{1: 2, 14: 8}
Did not match all atoms present	3976-35-0	CC1=CC(=C(C(=C1)C)C2=CC=CC=C2)C	{1: 3, 14: 7}
Did not match all atoms present	3976-36-1	CC1=CC(=C(C=C1)C2=C(C=C(C=C2)C)C)C	{1: 4, 14: 6}
Did not match all atoms present	39767-95-8	C1=CC=C(C=C1)CP2(=C3C=CC=CC3=CC=C2C4=CC=CC=C4)CC5=CC=CC=C5	{2: 2, 14: 21, 15: 1}
Did not match all atoms present	39768-04-2	C1=CC=C(C=C1)C2=PC3=CC=CC=C3C=C2	{14: 11}
Did not match all atoms present	3977-23-9	CC1=C(NC(=NC1=O)N)C	{32: 1, 1: 2, 35: 1, 30: 1, 25: 1}
Did not match all atoms present	3977-29-5	CC1=CC(=O)N=C(N1)N	{32: 1, 1: 1, 35: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	39774-73-7	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O	{1: 1, 31: 1, 30: 1, 14: 10, 25: 2}
Did not match all atoms present	39777-05-4	CCCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCCCC	{1: 2, 34: 1, 6: 1, 2: 7, 14: 8, 22: 1}
Did not match all atoms present	39777-13-4	CCCCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCCCCC	{1: 2, 34: 1, 6: 1, 2: 9, 14: 8, 22: 1}
Did not match all atoms present	39777-20-3	CCCCCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCCCCC	{1: 2, 34: 1, 6: 1, 2: 10, 14: 8, 22: 1}
Did not match all atoms present	39777-22-5	CCCCCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCCCCCCC	{1: 2, 34: 1, 6: 1, 2: 12, 14: 8, 22: 1}
Did not match all atoms present	3978-80-1	CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 21: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	3978-81-2	CC(C)(C)C1=CC=NC=C1	{1: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	3978-86-7	CN1CCC(=C2C3=C(C=CC=N3)CCC4=CC=CC=C24)CC1.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O	{1: 1, 35: 1, 6: 4, 33: 1, 11: 6, 14: 7, 15: 2, 27: 4}
Did not match all atoms present	39787-00-3	CC1=CC2=CC3=CC=CC=C3C=C2C=C(C1=O)C	{1: 2, 14: 8, 25: 1}
Did not match all atoms present	39788-53-9	[NH4+].N(O)S(=O)(=O)[O-]	{20: 1, 29: 3, 31: 1}
Did not match all atoms present	3979-51-9	[2H]OC(C)C	{1: 2, 3: 1, 20: 1}
Did not match all atoms present	398-14-1	C1=CC=C2C(=C1)C=C3C=CC=CC3=P2	{14: 9}
Did not match all atoms present	398-21-0	C1=CC(=CC=C1C2=CC=C(C=C2)Br)F	{16: 1, 18: 1, 14: 8}
Did not match all atoms present	398-23-2	C1=CC(=CC=C1C2=CC=C(C=C2)F)F	{16: 2, 14: 8}
Did not match all atoms present	398-32-3	CC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)F	{16: 1, 1: 1, 31: 1, 14: 8, 24: 1}
Did not match all atoms present	398-99-2	CC1=NC2=C(S1)C=CC(=C2)C(F)(F)F	{1: 1, 35: 1, 4: 1, 41: 1, 14: 3, 16: 3}
Did not match all atoms present	39807-15-3	CC(C)(C)C1=NN(C(=O)O1)C2=CC(=C(C=C2Cl)Cl)OCC#C	{1: 3, 2: 1, 35: 1, 4: 1, 33: 1, 9: 1, 10: 1, 14: 2, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	39811-17-1	COC1=C(C=C(C=C1)C2=CC=CC=C2)N	{1: 1, 30: 1, 22: 1, 14: 8}
Did not match all atoms present	39816-19-8	C1=CC=C(C=C1)C=CC2=CN=NC=C2	{35: 2, 14: 8, 6: 2}
Did not match all atoms present	3982-64-7	CCCC1=CC(=CC(=C1)C)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	3982-66-9	CCCC1=CC(=C(C=C1)C)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	3982-67-0	CCC1=C(C=C(C=C1C)C)C	{1: 4, 2: 1, 14: 2}
Did not match all atoms present	3982-91-0	P(=S)(Cl)(Cl)Cl	{17: 3}
Did not match all atoms present	39824-26-5	CC1(OC2C(OC(C2O1)N3C=NC4=C3N=CN=C4Cl)CO)C	{1: 2, 2: 1, 35: 3, 33: 1, 12: 4, 13: 1, 14: 2, 17: 1, 20: 1, 23: 3}
Did not match all atoms present	39827-11-7	C1=CC=C2C(=C1)C=C(S2)C(=O)Cl	{24: 1, 17: 1, 14: 5, 41: 1}
Did not match all atoms present	3983-39-9	CNC(=O)OC1=CC=CC(=C1)[N+](C)(C)C.[I-]	{1: 4, 19: 1, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	3983-40-2	CNC(=O)OC1=CC=C(C=C1)[N+](C)(C)C.[I-]	{1: 4, 19: 1, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	39830-66-5	COC(=O)C1=C2C=CNC2=CC=C1	{32: 1, 1: 1, 28: 1, 14: 5}
Did not match all atoms present	39831-55-5	C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1NC(=O)[C@H](CCN)O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)N)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N.OS(=O)(=O)O.OS(=O)(=O)O	{2: 4, 3: 1, 11: 1, 12: 15, 20: 12, 22: 2, 23: 2, 24: 1, 29: 4, 30: 4, 31: 1}
Did not match all atoms present	39834-38-3	CC1=C2C3C(O3)C4=CC=CC=C4C2=C(C5=CC=CC=C15)C	{1: 2, 12: 2, 14: 8, 23: 1}
Did not match all atoms present	39835-09-1	C1=CC(=C(C=C1[N+](=O)[O-])C#N)O	{38: 1, 21: 1, 14: 3, 37: 1}
Did not match all atoms present	39835-28-4	C1=CC2=C(C=C1[N+](=O)[O-])C=NO2	{35: 1, 38: 1, 14: 4, 23: 1}
Did not match all atoms present	3984-34-7	C1=CC(=CC=C1C(=O)CCC(=O)O)Cl	{24: 1, 17: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	39842-01-8	CC1=CC(=C(C=C1)N=C=S)C	{8: 1, 1: 2, 34: 1, 14: 3}
Did not match all atoms present	3985-81-7	CCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 51, 29: 3}
Did not match all atoms present	39853-28-6	CCCCOC(=O)C1=CC=C(C=C1)C(=O)Cl	{1: 1, 2: 3, 14: 4, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	3987-86-8	CCCCOC1=CC(=C(C=C1)N)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	3988-03-2	C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Br)Br	{24: 1, 18: 2, 14: 8}
Did not match all atoms present	3988-71-4	CCCCSC1=CC=CS1	{40: 1, 1: 1, 2: 3, 14: 3, 41: 1}
Did not match all atoms present	3988-99-6	C1=CSC(=C1)SC2=CC=CS2	{40: 1, 41: 2, 14: 6}
Did not match all atoms present	39885-50-2	C1=CC(=C(C=C1C(F)(F)F)Cl)N	{16: 3, 17: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	39889-77-5	CC1=CC=C(C=C1)N2C(=NN=N2)N	{1: 1, 35: 3, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	39889-97-9	C[N+]1=CSC2=CC=CC=C21.COS(=O)(=O)[O-]	{1: 2, 33: 1, 41: 1, 14: 5, 22: 1, 29: 3}
Did not match all atoms present	3989-48-8	CS(=O)(=O)N1CCCCC1	{1: 1, 11: 5, 29: 2, 33: 1}
Did not match all atoms present	3989-74-0	C1CC(=O)N(C1)C2=CC=C(C=C2)NC3=C4C(=C(C=C3)O)C(=O)C5=CC=CC=C5C4=O	{33: 1, 11: 3, 14: 10, 21: 1, 25: 3, 31: 1}
Did not match all atoms present	3989-75-1	C1=CC=C2C(=C1)C=CC3=C2C(=O)C(=C4C(=O)C5=C(S4)C=CC6=CC=CC=C65)S3	{25: 2, 41: 2, 14: 12, 15: 2}
Did not match all atoms present	39890-98-7	C1=C(C=C(N=C1Cl)Cl)C(F)(F)F	{16: 3, 17: 2, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	39898-48-1	CC1=CC(=C(C(=C1)C)N=S=O)C	{40: 1, 1: 3, 34: 1, 29: 1, 14: 2}
Did not match all atoms present	399-10-0	C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)F	{16: 1, 24: 1, 14: 9, 6: 2}
Did not match all atoms present	399-24-6	C1=CC=C(C=C1)C(=O)CCCCCCCCCF	{16: 1, 24: 1, 2: 9, 14: 5}
Did not match all atoms present	399-31-5	CC(=O)NC1=CC=CC=C1F	{16: 1, 1: 1, 31: 1, 14: 4, 24: 1}
Did not match all atoms present	399-35-9	CC(=O)NC1=C(C=C(C=C1)F)Cl	{1: 1, 14: 3, 16: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	399-36-0	CC(=O)NC1=C(C=C(C=C1)F)F	{16: 2, 1: 1, 31: 1, 14: 3, 24: 1}
Did not match all atoms present	399-51-9	C1=CC(=CC2=C1C=CN2)F	{16: 1, 32: 1, 14: 5}
Did not match all atoms present	399-52-0	C1=CC2=C(C=CN2)C=C1F	{16: 1, 32: 1, 14: 5}
Did not match all atoms present	399-54-2	CC1=C(C=CC(=C1)F)OC	{16: 1, 1: 2, 22: 1, 14: 3}
Did not match all atoms present	399-55-3	CC1=CC(=C(C=C1)OC)F	{16: 1, 1: 2, 22: 1, 14: 3}
Did not match all atoms present	399-66-6	C1=CN2C(=NC=N2)C=N1	{33: 1, 35: 3, 14: 4}
Did not match all atoms present	399-69-9	C1=CC2=C(C=C1C(F)(F)F)NC(=N2)C(F)(F)F	{16: 6, 32: 1, 35: 1, 4: 2, 14: 3}
Did not match all atoms present	399-75-7	CC1=NC2=C(S1)C=CC(=C2)F	{16: 1, 1: 1, 35: 1, 14: 3, 41: 1}
Did not match all atoms present	399-76-8	C1=CC2=C(C=C1F)C=C(N2)C(=O)O	{16: 1, 32: 1, 27: 1, 14: 4}
Did not match all atoms present	399-77-9	CC1=CC2=C(C=C1)N=C(N2)C(F)(F)F	{32: 1, 1: 1, 35: 1, 4: 1, 14: 3, 16: 3}
Did not match all atoms present	399-94-0	C1=CC(=C(C=C1F)Br)F	{16: 2, 18: 1, 14: 3}
Did not match all atoms present	39900-38-4	C[C@@H]1CC[C@@H]2[C@]13CC[C@@]([C@H](C3)C2(C)C)(C)OC=O	{1: 4, 26: 1, 11: 5, 12: 3, 13: 3}
Did not match all atoms present	39905-44-7	CCCCCCCOC1=CC=C(C=C1)N	{1: 1, 2: 6, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	39905-45-8	CCCCCCCCOC1=CC=C(C=C1)N	{1: 1, 2: 7, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	39905-47-0	CCCCCCCCCCOC1=CC=C(C=C1)N	{1: 1, 2: 9, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	39905-50-5	CCCCCOC1=CC=C(C=C1)N	{1: 1, 2: 4, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	39905-57-2	CCCCCCOC1=CC=C(C=C1)N	{1: 1, 2: 5, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	39909-74-5	CC1=CC(=CC(=C1)N=S=O)C	{40: 1, 1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	3991-61-5	CC1=CC=CC=C1OC2=CC=CC=C2	{1: 1, 22: 1, 14: 9}
Did not match all atoms present	3991-73-9	CCCCCCCCOP(=O)(O)O	{1: 1, 2: 7, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	39910-65-1	C1=CC=NC(=C1)N=[N+]=[N-]	{34: 2, 35: 1, 14: 4}
Did not match all atoms present	39910-98-0	CC(=O)C1=CC=C(C=C1)N2CCOCC2	{1: 1, 33: 1, 11: 4, 14: 4, 23: 1, 24: 1}
Did not match all atoms present	39916-61-5	CCCC(C)CC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5}
Did not match all atoms present	39920-37-1	C1=CC(=C(C(=C1)Cl)N=C=O)Cl	{8: 1, 17: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	39923-17-6	C1=CC2=C(C(=C1)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=C(C=CC(=C4C2=O)Cl)Cl	{38: 1, 14: 9, 17: 2, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	39923-22-3	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=C(C=C4)C)C(=O)C5=C(C3=O)C=CC=C5NC(=O)C6=CC=C(C=C6)[N+](=O)[O-]	{1: 2, 38: 1, 14: 17, 24: 1, 25: 2, 31: 3}
Did not match all atoms present	3993-43-9	CC1=CC(=O)OC2=C1C=CC(=C2C)OCC=C	{1: 2, 2: 1, 5: 1, 6: 1, 14: 3, 22: 1, 28: 1}
Did not match all atoms present	3993-45-1	CC1=CC(=O)OC2=C(C(=C(C=C12)CC=C)OC(=O)C)C	{1: 3, 2: 1, 5: 1, 6: 1, 14: 2, 28: 2}
Did not match all atoms present	3993-46-2	CC1=CC(=O)OC2=C(C(=C(C=C12)CC(CBr)Br)OC(=O)C)C	{1: 3, 2: 2, 3: 1, 14: 2, 18: 2, 28: 2}
Did not match all atoms present	3993-73-5	CC1=C(NC(=O)NC1=O)C(=O)O	{32: 2, 1: 1, 27: 1, 25: 2}
Did not match all atoms present	39931-77-6	CCOC(=O)CC1=CN=CC=C1	{1: 1, 2: 2, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	39943-70-9	CCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 15, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	3995-38-8	CCN(CC)C1=C(C=CC=C1C)C	{1: 4, 2: 2, 14: 3, 33: 1}
Did not match all atoms present	39951-80-9	C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=C/C(=C/4\NC5=CC=CC=C5S4)/C(=O)C(=C3)CN6C(=O)C7=CC=CC=C7C6=O	{32: 1, 33: 2, 2: 2, 41: 1, 14: 14, 15: 4, 25: 5}
Did not match all atoms present	39951-83-2	CC(=O)C(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N=NC3=C(C=C(C=C3)Cl)C(F)(F)F	{32: 2, 1: 1, 34: 2, 3: 1, 4: 1, 14: 6, 16: 3, 17: 1, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	3996-15-4	[2H]C(=O)[O-].[Na+]	{26: 1}
Did not match all atoms present	3996-30-3	CC1=CC(=CC=C1)SCC(=O)O	{40: 1, 1: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	39968-33-7	C1=CC2=C(N=C1)N(N=N2)O	{33: 1, 35: 3, 21: 1, 14: 3}
Did not match all atoms present	39969-56-7	CCCOC1=CC=C(C=C1)Br	{1: 1, 2: 2, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	39969-57-8	CCCCOC1=CC=C(C=C1)Br	{1: 1, 2: 3, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	39970-42-8	CC1=CC(=CC=C1)N(C)C=O	{1: 2, 26: 1, 14: 4, 33: 1}
Did not match all atoms present	39980-56-8	C[Si](C)(C=P(C)(C)C)[Si](C)(C)N=P(C)(C)C	{1: 10, 34: 1, 6: 1}
Did not match all atoms present	39989-39-4	COC1=CC2=C(C=C1)C=CN=C2	{1: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	39989-43-0	C1=C(C=C(C=C1Cl)Cl)CN	{17: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	3999-27-7	C[Si](C)(C)N[Si](C)(C)C.[Zn]	{1: 6, 31: 1}
Did not match all atoms present	3999-70-0	CCCCO.[K+]	{1: 1, 2: 3, 20: 1}
Did not match all atoms present	39998-25-9	COC(=O)CC1=CN=CC=C1	{1: 1, 2: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	39998-81-7	CC1=C(C=C(C=C1)I)F	{16: 1, 1: 1, 19: 1, 14: 3}
Did not match all atoms present	400-04-4	C1=C(C(=CC(=C1Cl)Cl)Cl)F	{16: 1, 17: 3, 14: 2}
Did not match all atoms present	400-05-5	C1=C(C(=CC(=C1Cl)F)Cl)F	{16: 2, 17: 2, 14: 2}
Did not match all atoms present	400-13-5	C1=CSC(=C1)F	{16: 1, 41: 1, 14: 3}
Did not match all atoms present	400-53-3	C[Si](C)(C)OC(=O)C(F)(F)F	{16: 3, 1: 3, 4: 1, 28: 1}
Did not match all atoms present	400-70-4	C1=C(C(=CC(=C1[N+](=O)[O-])Cl)Cl)C(F)(F)F	{16: 3, 17: 2, 4: 1, 38: 1, 14: 2}
Did not match all atoms present	400-74-8	C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)F	{16: 4, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	400-98-6	C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])N	{16: 3, 38: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	400-99-7	C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])O	{16: 3, 38: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	40000-20-2	C1=CC2=CC(=C3C=CC=NC3=C2N=C1)Br	{18: 1, 35: 2, 14: 7}
Did not match all atoms present	40004-84-0	[HH].[HH].[HH].[Th]	{}
Did not match all atoms present	4001-61-0	CC1=CC(=C(C=C1)C)S	{1: 2, 14: 3, 39: 1}
Did not match all atoms present	4001-73-4	C1=CC=C(C(=C1)C(=O)N)Br	{24: 1, 18: 1, 30: 1, 14: 4}
Did not match all atoms present	40016-70-4	CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C(=O)OC	{1: 2, 28: 1, 29: 2, 14: 4, 33: 2}
Did not match all atoms present	40018-25-5	C1=CC=C(C(=C1)C(=O)CC#N)Cl	{24: 1, 17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	4002-76-0	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)C=C(C5=CC=CC=C54)O	{21: 1, 14: 13}
Did not match all atoms present	40020-12-0	C1=CC2=COC=C21	{14: 4, 23: 1}
Did not match all atoms present	40024-74-6	C1CCC2=CC3=CSC=C3C=C(C2=O)CC1	{25: 1, 11: 5, 14: 4, 41: 1}
Did not match all atoms present	40024-76-8	C1CCCC2=CC3=CSC=C3C=C(C2=O)CC1	{25: 1, 11: 6, 14: 4, 41: 1}
Did not match all atoms present	40027-50-7	CC1=CC=CC=C1N(CC2CO2)CC3CO3	{1: 1, 2: 2, 33: 1, 11: 2, 12: 2, 14: 4, 23: 2}
Did not match all atoms present	4003-94-5	C1=CC=C(C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-]	{38: 1, 14: 9, 6: 2}
Did not match all atoms present	40032-73-3	C1=CSC(=C1Br)Cl	{17: 1, 18: 1, 14: 2, 41: 1}
Did not match all atoms present	4004-51-7	C1CC(C2=CC=CC3=C2C1C4=CC=CC=C34)O	{20: 1, 11: 2, 12: 2, 14: 7}
Did not match all atoms present	40040-65-1	CC1=NN(C(=O)C1CC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 35: 1, 33: 1, 12: 1, 14: 10, 15: 1, 25: 1}
Did not match all atoms present	40046-27-3	COC1=CC(=C(C=C1N=C=S)Cl)OC	{1: 2, 34: 1, 8: 1, 14: 2, 17: 1, 22: 2}
Did not match all atoms present	40046-28-4	CC1=C(C=CC(=C1)OC)N=C=S	{8: 1, 1: 2, 34: 1, 22: 1, 14: 3}
Did not match all atoms present	40046-30-8	CC1=CC(=CC(=C1)N=C=S)C	{8: 1, 1: 2, 34: 1, 14: 3}
Did not match all atoms present	4005-51-0	C1=NN=C(S1)N	{41: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	4005-68-9	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)O	{34: 2, 20: 1, 29: 2, 14: 13, 31: 1}
Did not match all atoms present	40054-69-1	CCC1=CC2=C(S1)N3C(=NN=C3CN=C2C4=CC=CC=C4Cl)C	{1: 2, 2: 1, 35: 3, 33: 1, 41: 1, 11: 1, 14: 5, 15: 1, 17: 1}
Did not match all atoms present	4006-38-6	CC(C)CPCC(C)C	{1: 4, 2: 2, 3: 2}
Did not match all atoms present	40061-45-8	C1=CC=C(C=C1)C(=O)CC2=NC=CN=C2	{24: 1, 2: 1, 35: 2, 14: 8}
Did not match all atoms present	40061-55-0	CCOC(=O)CC1=CC=CC(=C1)C	{1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	40067-41-2	C1CCC(C1)N(C=O)C2=C(N=CN=C2Cl)N	{33: 1, 35: 2, 11: 4, 12: 1, 14: 1, 17: 1, 26: 1, 30: 1}
Did not match all atoms present	40067-43-4	C1CCC(C1)N2C=NC3=C2C(=O)N=CN3	{32: 1, 33: 1, 35: 2, 11: 4, 12: 1, 14: 2, 25: 1}
Did not match all atoms present	40068-20-0	CCNC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl	{1: 1, 2: 6, 33: 1, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	4007-00-5	C1=CC(=C(C(=C1Cl)OCC(=O)O)Cl)Cl	{17: 3, 2: 1, 27: 1, 22: 1, 14: 2}
Did not match all atoms present	40070-84-6	C1=CC=C2C(=C1)C=CC(=N2)C(C=O)C=O	{35: 1, 26: 2, 3: 1, 14: 6}
Did not match all atoms present	40074-34-8	C=CC(=O)OCCOP(=O)(O)OCCOC(=O)C=C	{2: 4, 5: 2, 6: 2, 20: 1, 22: 2, 28: 2, 29: 1}
Did not match all atoms present	40074-68-8	CCCCCCCCN1C(=O)C2(CC(N(C(C2)(C)C)CC3=CC=CC=C3)(C)C)NC1=O	{32: 1, 1: 5, 2: 8, 33: 2, 11: 2, 13: 3, 14: 5, 25: 2}
Did not match all atoms present	4008-48-4	C1=CC2=C(C=CC(=C2N=C1)O)[N+](=O)[O-]	{38: 1, 35: 1, 21: 1, 14: 5}
Did not match all atoms present	4008-71-3	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=CC4=C3N=CC=C4	{34: 1, 35: 1, 14: 12, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	40088-47-9	C1=CC(=CC(=C1)Br)OC2=C(C(=C(C=C2)Br)Br)Br	{18: 4, 22: 1, 14: 6}
Did not match all atoms present	4009-98-7	COC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{1: 1, 2: 1, 22: 1, 14: 15, 17: 1}
Did not match all atoms present	401-78-5	C1=CC(=CC(=C1)Br)C(F)(F)F	{16: 3, 18: 1, 4: 1, 14: 4}
Did not match all atoms present	401-79-6	CC1=CC(=CC=C1)C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4}
Did not match all atoms present	401-80-9	C1=CC(=CC(=C1)F)C(F)(F)F	{16: 4, 4: 1, 14: 4}
Did not match all atoms present	401-81-0	C1=CC(=CC(=C1)I)C(F)(F)F	{16: 3, 19: 1, 4: 1, 14: 4}
Did not match all atoms present	401-95-6	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O	{16: 6, 26: 1, 4: 2, 14: 3}
Did not match all atoms present	401-99-0	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F	{16: 3, 4: 1, 38: 2, 14: 3}
Did not match all atoms present	4010-33-7	CC(=O)C1=CC=CC=C1OC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 28: 1, 14: 9}
Did not match all atoms present	40101-17-5	COC1=CC=CC(=C1)C(=O)C(=O)C2=CC(=CC=C2)OC	{24: 2, 1: 2, 22: 2, 14: 8}
Did not match all atoms present	40101-29-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O	{25: 4, 14: 11, 33: 1}
Did not match all atoms present	40101-31-3	C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)Br	{25: 2, 18: 1, 14: 8, 33: 1}
Did not match all atoms present	40106-13-6	CCOC(=O)C1=C(SC2=C1CCCCC2)N	{1: 1, 2: 1, 41: 1, 11: 5, 28: 1, 30: 1}
Did not match all atoms present	40108-12-1	CCOC(=O)C1=CC(=NC(=C1C#N)Cl)C	{1: 2, 2: 1, 35: 1, 37: 1, 14: 1, 17: 1, 28: 1}
Did not match all atoms present	40115-57-9	CC1=C(C(=C(C(=C1Cl)[N+](=O)[O-])C)Cl)[N+](=O)[O-]	{1: 2, 38: 2, 17: 2}
Did not match all atoms present	40119-17-3	COC1=C(C=C(C=C1)NN)OC.Cl	{1: 2, 14: 3, 17: 1, 22: 2, 30: 1, 31: 1}
Did not match all atoms present	40120-74-9	C(CCl)C(OP(=O)(OC(CCCl)Cl)OC(CCCl)Cl)Cl	{17: 6, 2: 6, 3: 3, 29: 1, 22: 3}
Did not match all atoms present	4013-34-7	CC(C1=CC=CC=C1)OC	{1: 2, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	4013-92-7	CC(C)CCCC(C)[NH2+]C(C)C.[Cl-]	{1: 5, 2: 3, 3: 3, 17: 1}
Did not match all atoms present	40130-25-4	CCOC1=C(C=CC(=C1)[N+](=O)[O-])O	{1: 1, 2: 1, 38: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	40136-65-0	CCCC(CN(C)C)C1=C(C=CC(=C1)Cl)OCC	{1: 4, 2: 4, 3: 1, 33: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	40146-87-0	CCCCCCCCCCC1CCCS(=O)(=O)O1	{1: 1, 2: 9, 11: 3, 12: 1, 23: 1, 29: 2}
Did not match all atoms present	40159-76-0	C1=COS2=C1C=CO2	{23: 2, 14: 4, 15: 1}
Did not match all atoms present	4016-01-7	CC1=C(C(=CC=C1)S(=O)(=O)O)O	{1: 1, 20: 1, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	4016-21-1	CCCCCCCCCCC(C(=O)OC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 9, 3: 1, 28: 1, 29: 3}
Did not match all atoms present	4016-22-2	CCCCCCCCCCCCC(C(=O)OC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 11, 3: 1, 28: 1, 29: 3}
Did not match all atoms present	40161-54-4	C1=CC(=C(C=C1C(F)(F)F)F)Br	{16: 4, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	40161-55-5	C1=CC(=C(C=C1F)C(F)(F)F)Br	{16: 4, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	40164-67-8	CCC1=C(C(=CC=C1)CC)N(CNC(=O)C)C(=O)CCl	{1: 3, 2: 4, 33: 1, 14: 3, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	40164-69-0	CCC1=C(C(=CC=C1)CC)N(CCl)C(=O)CCl	{1: 2, 2: 4, 33: 1, 14: 3, 17: 2, 24: 1}
Did not match all atoms present	40168-14-7	CC(C)N=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 34: 1, 3: 1, 14: 15}
Did not match all atoms present	40172-65-4	C1=CC=C2C(=C1)C=CC3=C2N=C(S3)N	{41: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	40172-95-0	C1CN(CCN1)C(=O)C2=CC=CO2	{32: 1, 33: 1, 11: 4, 14: 3, 23: 1, 24: 1}
Did not match all atoms present	4018-65-9	C1=CC(=C(C(=C1)Cl)O)O	{17: 1, 21: 2, 14: 3}
Did not match all atoms present	40180-04-9	C1=CSC(=C1)C(=O)C2=C(C(=C(C=C2)OCC(=O)O)Cl)Cl	{2: 1, 41: 1, 14: 5, 17: 2, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	40180-96-9	CC(CC1=C(C=CC(=C1)OC)OC)O	{1: 3, 2: 1, 3: 1, 14: 3, 20: 1, 22: 2}
Did not match all atoms present	40184-38-1	C1=CC(=CC=C1N)OCCOS(=O)(=O)O	{2: 2, 14: 4, 20: 1, 22: 2, 29: 2, 30: 1}
Did not match all atoms present	40186-70-7	C1=C(C=C(C(=C1Cl)Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	40186-71-8	C1=C(C(=C(C(=C1Cl)Cl)Cl)C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)Cl	{17: 8, 14: 2}
Did not match all atoms present	40186-72-9	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 9, 14: 1}
Did not match all atoms present	40187-51-7	CC(=O)C1=CC(=C(C=C1)O)C(=O)N	{24: 2, 1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	40188-83-8	COC(=O)C1=C(C=CC(=C1[N+](=O)[O-])Cl)Cl	{1: 1, 28: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	4019-40-3	C1=CC(=CC=C1C2=CC(=CC(=C2O)C(=O)NC3=CC=C(C=C3)Cl)Cl)Cl	{24: 1, 17: 3, 21: 1, 14: 10, 31: 1}
Did not match all atoms present	40193-47-3	CCN(CC)C1=CC=C(C=C1)C=CC2=CC=CC=C2	{1: 2, 2: 2, 14: 9, 6: 2, 33: 1}
Did not match all atoms present	402-14-2	C1=CC(=C(C=C1C(F)(F)F)N)[N+](=O)[O-]	{16: 3, 38: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	402-23-3	C1=CC(=CC(=C1)C(F)(F)F)CBr	{16: 3, 2: 1, 4: 1, 18: 1, 14: 4}
Did not match all atoms present	402-24-4	C=CC1=CC(=CC=C1)C(F)(F)F	{16: 3, 14: 4, 4: 1, 5: 1, 6: 1}
Did not match all atoms present	402-31-3	C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{16: 6, 4: 2, 14: 4}
Did not match all atoms present	402-42-6	C1=CC(=CC=C1C(Cl)(Cl)Cl)F	{16: 1, 17: 3, 4: 1, 14: 4}
Did not match all atoms present	402-43-7	C1=CC(=CC=C1C(F)(F)F)Br	{16: 3, 18: 1, 4: 1, 14: 4}
Did not match all atoms present	402-44-8	C1=CC(=CC=C1C(F)(F)F)F	{16: 4, 4: 1, 14: 4}
Did not match all atoms present	402-45-9	C1=CC(=CC=C1C(F)(F)F)O	{16: 3, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	402-46-0	C1=CC(=CC=C1F)S(=O)(=O)N	{16: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	402-49-3	C1=CC(=CC=C1CBr)C(F)(F)F	{16: 3, 2: 1, 4: 1, 18: 1, 14: 4}
Did not match all atoms present	402-50-6	C=CC1=CC=C(C=C1)C(F)(F)F	{16: 3, 14: 4, 4: 1, 5: 1, 6: 1}
Did not match all atoms present	402-54-0	C1=CC(=CC=C1C(F)(F)F)[N+](=O)[O-]	{16: 3, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	402-55-1	C1=CC(=CC=C1C(=O)Cl)S(=O)(=O)F	{16: 1, 17: 1, 29: 2, 14: 4, 24: 1}
Did not match all atoms present	402-63-1	CC(C1=CC(=CC=C1)F)O	{16: 1, 1: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	402-64-2	C1=CC(=CC(=C1)F)C(Cl)Cl	{16: 1, 17: 2, 3: 1, 14: 4}
Did not match all atoms present	402-67-5	C1=CC(=CC(=C1)F)[N+](=O)[O-]	{16: 1, 38: 1, 14: 4}
Did not match all atoms present	4020-99-9	COP(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 22: 1, 14: 10}
Did not match all atoms present	40200-66-6	CC1=C(C(=C(C(=C1Cl)N)C)Cl)N	{1: 2, 30: 2, 17: 2}
Did not match all atoms present	40200-67-7	CC1=C(C(=C(C(=C1Cl)[N+](=O)[O-])Cl)C)[N+](=O)[O-]	{1: 2, 38: 2, 17: 2}
Did not match all atoms present	40200-69-9	C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C=O	{26: 1, 14: 9, 6: 2}
Did not match all atoms present	40202-39-9	C1CCC(C1)C2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 11: 4, 12: 1, 21: 1, 14: 2}
Did not match all atoms present	40203-94-9	COC(=O)[C@H](CC1=CC=CC=C1)N=C=O	{1: 1, 2: 1, 3: 1, 8: 1, 34: 1, 14: 5, 28: 1, 29: 1}
Did not match all atoms present	40205-24-1	CC=CS(=O)(=O)C	{1: 2, 29: 2, 6: 2}
Did not match all atoms present	4021-50-5	C1=CC(=CC=C1C=O)SC(F)(F)F	{16: 3, 40: 1, 26: 1, 4: 1, 14: 4}
Did not match all atoms present	40218-49-3	B1(OC2=CC=CC=C2O1)CCC	{1: 1, 2: 2, 14: 4, 23: 2}
Did not match all atoms present	40220-90-4	CCCCCCCCCCCCCCCC(=O)N[N+](C)(C)CC=C.[Cl-]	{1: 3, 2: 15, 5: 1, 6: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	40228-74-8	C[C@H](CCCC(C)C)[C@@H]1CC[C@@H]2[C@@]1(CC[C@@H]3[C@@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)OCCOC)C)C	{1: 6, 2: 5, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 22: 1}
Did not match all atoms present	40228-90-8	C1=CC=C(C=C1)CCCCCCC(=O)O	{2: 6, 27: 1, 14: 5}
Did not match all atoms present	4023-49-8	C(CPCCC#N)C#N	{2: 4, 37: 2}
Did not match all atoms present	4023-53-4	C(CP(CCC#N)CCC#N)C#N	{2: 6, 37: 3}
Did not match all atoms present	40232-93-7	C1=CC(=CC=C1C(C2=CC=C(C=C2)O)C(=O)O)O	{27: 1, 3: 1, 21: 2, 14: 8}
Did not match all atoms present	40233-98-5	CCOC(=O)C(=O)C1=CC(=C(C=C1)OC)OC	{1: 3, 2: 1, 14: 3, 22: 2, 24: 1, 28: 1}
Did not match all atoms present	4024-14-0	CC1C(=O)CCC2=CC=CC=C12	{1: 1, 11: 2, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	4024-34-4	CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCC[NH+](C)C.[Cl-]	{1: 3, 2: 2, 3: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	40242-15-7	C1=CC2=C(C(=O)C=CC2=O)C(=C1)Cl	{17: 1, 14: 5, 25: 2}
Did not match all atoms present	40244-90-4	CC(C)P(C(C)C)Cl	{1: 4, 3: 2, 17: 1}
Did not match all atoms present	40248-84-8	C1=CC(=CC(=C1)S)O	{21: 1, 14: 4, 39: 1}
Did not match all atoms present	4025-64-3	C1=CC(=CC(=C1)S(=O)(=O)Cl)C(=O)O	{17: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	4025-77-8	C(C(=O)Cl)S(=O)(=O)Cl	{24: 1, 17: 2, 2: 1, 29: 2}
Did not match all atoms present	4025-80-3	CO[Si]12OCCN(CCO1)CCO2	{1: 1, 11: 6, 33: 1, 22: 1, 23: 3}
Did not match all atoms present	4026-23-7	C1=CC=C2C=CC2=C1	{14: 6}
Did not match all atoms present	4026-97-5	CC(=O)O[C@H]1CC[C@]2([C@@H](C1)CCC3C2CC[C@]4([C@]35[C@H](O5)[C@@H]([C@@H]4C6=COC(=O)C=C6)OC(=O)C)C)C	{1: 4, 11: 7, 12: 7, 13: 3, 14: 3, 23: 1, 28: 3}
Did not match all atoms present	40263-57-8	C1=CC(=C(N=C1)I)O	{35: 1, 19: 1, 21: 1, 14: 3}
Did not match all atoms present	4027-14-9	CCCCCCCCC(=O)O[Sn](CCCC)(CCCC)CCCC	{1: 4, 2: 16, 28: 1}
Did not match all atoms present	4027-17-2	CCCC[Sn](CCCC)(CCCC)OC#N	{1: 3, 2: 9, 37: 1, 22: 1}
Did not match all atoms present	4027-57-0	CCOC(=O)C1=NNC(=C1)C	{32: 1, 1: 2, 2: 1, 35: 1, 14: 1, 28: 1}
Did not match all atoms present	40276-11-7	COC1=CC(=C(C=C1)OC)/C=C/[N+](=O)[O-]	{1: 2, 22: 2, 38: 1, 14: 3, 6: 2}
Did not match all atoms present	4028-00-6	CCCCCCCCCCCCCCCCCC[N+](CC)(CC)CC.[I-]	{1: 4, 2: 20, 19: 1}
Did not match all atoms present	4028-23-3	C[Si](C)(CC=C)Cl	{1: 2, 2: 1, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	4028-32-4	C1=CC(=C(C=C1NC2=NC(=NC(=N2)Cl)N(CCO)CCO)S(=O)(=O)[O-])C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)Cl)N(CCO)CCO)S(=O)(=O)[O-].[Na+].[Na+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 6, 17: 2, 20: 4, 29: 6, 31: 2}
Did not match all atoms present	4028-63-1	CC1=CC(=C(C(=C1)C)I)C	{1: 3, 19: 1, 14: 2}
Did not match all atoms present	4028-66-4	CC1=CC(=C(C(=C1)C)OC)C	{1: 4, 22: 1, 14: 2}
Did not match all atoms present	4028-94-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)C4=CC=CC=C4C(=O)NC5=CC=CC6=C5C(=O)C7=CC=CC=C7C6=O	{24: 2, 25: 4, 14: 18, 31: 2}
Did not match all atoms present	40283-68-9	CC1(C2CCC1(C(C2)N=C(CSS(=O)(=O)O)N)C)C	{1: 3, 2: 1, 34: 1, 7: 1, 40: 1, 11: 3, 12: 2, 13: 2, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	40283-92-9	C1=CC=C(C=C1)COCCCN=C(CSS(=O)(=O)O)N	{2: 5, 7: 1, 40: 1, 34: 1, 14: 5, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	40291-39-2	CCOC(=O)CC1=CC=CC=C1C	{1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	40298-71-3	CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCC2=C(C=CC=C2Cl)Cl)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 14: 7, 17: 2, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	403-16-7	C1=CC(=C(C=C1C(=O)O)Cl)F	{16: 1, 17: 1, 27: 1, 14: 3}
Did not match all atoms present	403-19-0	C1=CC(=C(C=C1[N+](=O)[O-])F)O	{16: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	403-20-3	COC1=C(C=C(C=C1)C(=O)O)F	{16: 1, 1: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	403-21-4	C1=CC(=C(C=C1C(=O)O)F)[N+](=O)[O-]	{16: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	403-29-2	C1=CC(=CC=C1C(=O)CBr)F	{16: 1, 24: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	403-33-8	COC(=O)C1=CC=C(C=C1)F	{16: 1, 1: 1, 28: 1, 14: 4}
Did not match all atoms present	403-39-4	CC(C)C1=CC=C(C=C1)F	{16: 1, 1: 2, 3: 1, 14: 4}
Did not match all atoms present	403-40-7	CC(C1=CC=C(C=C1)F)N	{16: 1, 1: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	403-41-8	CC(C1=CC=C(C=C1)F)O	{16: 1, 1: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	403-42-9	CC(=O)C1=CC=C(C=C1)F	{16: 1, 1: 1, 14: 4, 24: 1}
Did not match all atoms present	403-43-0	C1=CC(=CC=C1C(=O)Cl)F	{16: 1, 17: 1, 14: 4, 24: 1}
Did not match all atoms present	403-46-3	CN(C)C1=CC=C(C=C1)F	{16: 1, 1: 2, 14: 4, 33: 1}
Did not match all atoms present	403-54-3	C1=CC(=CC(=C1)F)C#N	{16: 1, 37: 1, 14: 4}
Did not match all atoms present	403-90-7	C1=CC(=C(C=C1CC(C(=O)O)N)F)O	{2: 1, 3: 1, 14: 3, 16: 1, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	403-96-3	C1=CC(=CC(=C1)NC(=O)NC2=CC=CC(=C2)C(F)(F)F)C(F)(F)F	{16: 6, 24: 1, 4: 2, 14: 8, 31: 2}
Did not match all atoms present	4030-17-5	COC1=CC=C(C=C1)C2CC2	{1: 1, 11: 2, 12: 1, 22: 1, 14: 4}
Did not match all atoms present	4030-28-8	CCOC(=O)C1=C(NC(=C1C)O)C	{32: 1, 1: 3, 2: 1, 28: 1, 21: 1}
Did not match all atoms present	40306-75-0	CC(=O)NC1=C(C(=CC(=C1)S(=O)(=O)O)N)O	{1: 1, 14: 2, 20: 1, 21: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	40306-87-4	C1C2=C(C=CS2)C3=C(CN1C4=CC=CC=C4)SC=C3	{33: 1, 11: 2, 14: 9, 41: 2}
Did not match all atoms present	40306-97-6	C1=CN2C(=NN=N2)C(=C1)C#N	{33: 1, 35: 3, 37: 1, 14: 3}
Did not match all atoms present	40307-11-7	CCC1=CC=C(C=C1)C#C	{1: 1, 2: 1, 10: 1, 14: 4, 9: 1}
Did not match all atoms present	40309-57-7	C[Si](C)(C)OC(=O)CCC(=O)O[Si](C)(C)C	{1: 6, 2: 2, 28: 2}
Did not match all atoms present	4031-81-6	CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 1, 38: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	40316-56-1	C1=CC=C(C=C1)C#C/C=C/CCl	{17: 1, 2: 1, 14: 5, 10: 2, 6: 2}
Did not match all atoms present	40317-08-6	C1=CC=C(C=C1)C#C/C=C/CO	{2: 1, 14: 5, 20: 1, 10: 2, 6: 2}
Did not match all atoms present	4032-26-2	C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31.[Cl-].[Cl-]	{17: 2, 11: 2, 14: 8, 33: 2}
Did not match all atoms present	4032-80-8	CC1=CC=CC=C1SSC2=CC=CC=C2C	{40: 2, 1: 2, 14: 8}
Did not match all atoms present	4032-81-9	CCSSC1=CC=CC=C1	{40: 2, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	40321-76-4	C1=C2C(=CC(=C1Cl)Cl)OC3=C(C(=C(C=C3O2)Cl)Cl)Cl	{17: 5, 14: 3, 23: 2}
Did not match all atoms present	40323-88-4	CCC1=CC=C(S1)C	{1: 2, 2: 1, 14: 2, 41: 1}
Did not match all atoms present	40331-38-2	CC1=C(C(=C(C(=C1Cl)[N+](=O)[O-])C)Cl)N	{1: 2, 38: 1, 30: 1, 17: 2}
Did not match all atoms present	40333-07-1	CC(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	{1: 7, 3: 1, 28: 2}
Did not match all atoms present	40334-04-1	C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].[Hf+4]	{1: 12, 5: 4}
Did not match all atoms present	40334-69-8	C(=C/[As](Cl)/C=C/Cl)\Cl	{17: 3, 6: 4}
Did not match all atoms present	40334-96-1	CC1=NC(=CC(=C1)OC)OC	{1: 3, 35: 1, 22: 2, 14: 2}
Did not match all atoms present	40334-97-2	CC1=CC(=CC(=O)N1C)OC	{1: 3, 33: 1, 22: 1, 14: 2, 25: 1}
Did not match all atoms present	40334-98-3	CC1=CC(=O)C=C(N1C)OC	{1: 3, 33: 1, 22: 1, 14: 2, 25: 1}
Did not match all atoms present	40335-00-0	COC1=CC(=NC2=CC=CC=C21)OC	{1: 2, 35: 1, 22: 2, 14: 5}
Did not match all atoms present	40335-01-1	CN1C2=CC=CC=C2C(=O)C=C1OC	{1: 2, 33: 1, 22: 1, 14: 5, 25: 1}
Did not match all atoms present	40339-27-3	C1=CC=C2C(=C1)C=CC=C2CCCCCCCCCCC3=CC=CC4=CC=CC=C43	{2: 10, 14: 14}
Did not match all atoms present	40339-96-6	C1=CC=C(C=C1)OCCCCCOC2=CC=CC=C2	{2: 5, 22: 2, 14: 10}
Did not match all atoms present	40343-30-4	C1=CC(=CC=C1/C=[N+](/CCO)\[O-])[N+](=O)[O-]	{33: 1, 2: 2, 38: 1, 6: 1, 14: 4, 20: 1, 29: 1}
Did not match all atoms present	40343-32-6	C1=CC(=CC(=C1)[N+](=O)[O-])/C=[N+](/CCO)\[O-]	{33: 1, 2: 2, 38: 1, 6: 1, 14: 4, 20: 1, 29: 1}
Did not match all atoms present	40353-34-2	C1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C1	{25: 1, 11: 3, 38: 1, 14: 3}
Did not match all atoms present	40358-04-1	C1=C(SC=C1[N+](=O)[O-])S(=O)(=O)Cl	{17: 1, 38: 1, 29: 2, 14: 2, 41: 1}
Did not match all atoms present	40358-68-7	CC1CCC(P1C2=CC=CC=C2)C	{1: 2, 11: 2, 12: 2, 14: 5}
Did not match all atoms present	4036-43-5	CC1=C(C(=CC=C1)C)C2=C(C=CC=C2C)C	{1: 4, 14: 6}
Did not match all atoms present	40360-18-7	CC1=[N+](C2=C(S1)C=C(C=C2)OC)CCC(=O)O	{1: 2, 2: 2, 33: 1, 41: 1, 14: 3, 22: 1, 27: 1}
Did not match all atoms present	40360-28-9	C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=N)N=C2N	{17: 4, 35: 1, 36: 1, 30: 1, 15: 2}
Did not match all atoms present	40362-35-4	CCCCOC(=O)C1=CC(=C(C(=C1)N)Cl)N	{1: 1, 2: 3, 14: 2, 17: 1, 28: 1, 30: 2}
Did not match all atoms present	40367-32-6	COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)NC2=O)O	{32: 2, 1: 1, 6: 1, 14: 3, 15: 1, 21: 1, 22: 1, 25: 3}
Did not match all atoms present	40368-44-3	[Na+].[Al+3].[Al+3].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-]	{17: 7}
Did not match all atoms present	4037-12-1	CC(=C=CP(=O)(OC)OC)C	{1: 4, 6: 1, 7: 1, 8: 1, 22: 2, 29: 1}
Did not match all atoms present	40371-50-4	C1=CC=C(C=C1)COC(=O)NCC[C@@H](C(=O)O)O	{2: 3, 3: 1, 14: 5, 20: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	40372-72-3	CCO[Si](CCCSSSSCCC[Si](OCC)(OCC)OCC)(OCC)OCC	{40: 4, 1: 6, 2: 12, 22: 6}
Did not match all atoms present	40373-39-5	CC(=O)N(C)C(=O)OC1=CC=CC2=C1OCO2	{1: 2, 33: 1, 11: 1, 14: 3, 23: 2, 24: 1, 28: 1}
Did not match all atoms present	40373-42-0	CCC(=O)N(C)C(=O)OC1=CC=CC2=C1OC(O2)(C)C	{1: 4, 2: 1, 33: 1, 13: 1, 14: 3, 23: 2, 24: 1, 28: 1}
Did not match all atoms present	40373-43-1	CCCC(=O)N(C)C(=O)OC1=CC=CC2=C1OC(O2)(C)C	{1: 4, 2: 2, 33: 1, 13: 1, 14: 3, 23: 2, 24: 1, 28: 1}
Did not match all atoms present	40373-44-2	CCCCC(=O)N(C)C(=O)OC1=CC=CC2=C1OC(O2)(C)C	{1: 4, 2: 3, 33: 1, 13: 1, 14: 3, 23: 2, 24: 1, 28: 1}
Did not match all atoms present	40378-58-3	CN1CCC(CC1)OC(=O)C2=CC=CC=C2.Cl	{1: 1, 33: 1, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	40385-54-4	CC1=CC(=C(C=C1)[N+](=O)[O-])Br	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	40386-51-4	CC1=NC2=C(C=CC3=C2N=C(C=C3C4=CC=C(C=C4)S(=O)(=O)[O-])C)C(=C1)C5=CC=C(C=C5)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 35: 2, 29: 6, 14: 12}
Did not match all atoms present	4039-24-1	CC(C)(CSS(=O)(=O)O)N	{1: 2, 2: 1, 4: 1, 40: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	4039-32-1	[Li+].C[Si](C)(C)[N-][Si](C)(C)C	{1: 6, 34: 1}
Did not match all atoms present	4039-92-3	C1=CC=C(C=C1)OC2=CC=C(C=C2)CCl	{17: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	40392-34-5	B1(NN(B(N1C)C)C)C	{32: 1, 1: 4, 33: 2}
Did not match all atoms present	40392-35-6	B1(NB(N(N1)C)C)C	{32: 2, 1: 3, 33: 1}
Did not match all atoms present	40392-36-7	B1(N(B(N(N1C)C)SC)C)SC	{40: 2, 1: 5, 33: 3}
Did not match all atoms present	40392-37-8	B1(N(N(B(S1)C)C)C)C	{1: 4, 41: 1, 33: 2}
Did not match all atoms present	40392-38-9	B1(N(N(B(O1)C)C)C)C	{1: 4, 33: 2, 23: 1}
Did not match all atoms present	40397-90-8	CC1=C(C=CC=C1Cl)N=C=O	{1: 1, 34: 1, 8: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	40397-96-4	C1=CC(=C(C=C1N=C=O)[N+](=O)[O-])Cl	{34: 1, 38: 1, 8: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	40397-98-6	CC1=CC(=C(C=C1)C)N=C=O	{8: 1, 1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	40398-01-4	CC1=C(C(=CC=C1)Cl)N=C=O	{1: 1, 34: 1, 8: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	404-17-1	C1=CC=C(C=C1)NC(=O)C(F)F	{16: 2, 24: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	404-24-0	C1=CC=C(C=C1)NC(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 5, 31: 1}
Did not match all atoms present	404-42-2	C1=CC(=CC=C1NC(=O)CF)F	{16: 2, 24: 1, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	404-70-6	C1=CC(=CC(=C1)F)CCN	{16: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	404-71-7	C1=CC(=CC(=C1)F)N=C=O	{8: 1, 16: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	404-72-8	C1=CC(=CC(=C1)F)N=C=S	{8: 1, 16: 1, 34: 1, 14: 4}
Did not match all atoms present	404-86-4	CC(C)/C=C/CCCCC(=O)NCC1=CC(=C(C=C1)O)OC	{1: 3, 2: 5, 3: 1, 6: 2, 14: 3, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	404-90-0	COC1=C(C=C(C=C1)CC#N)F	{1: 1, 2: 1, 37: 1, 14: 3, 16: 1, 22: 1}
Did not match all atoms present	4040-74-8	C[Si]1(CCCCC1)C	{1: 2, 11: 5}
Did not match all atoms present	40400-15-5	C1=CC=C(C(=C1)CC#N)I	{2: 1, 19: 1, 37: 1, 14: 4}
Did not match all atoms present	40400-26-8	C[Se]C1=CC=C(C=C1)[Se]C	{1: 2, 14: 4}
Did not match all atoms present	40401-39-6	CC1=NN(C(=C1)N)C2=CC=C(C=C2)Cl	{1: 1, 35: 1, 33: 1, 14: 5, 17: 1, 30: 1}
Did not match all atoms present	40411-25-4	CCC1=CC=CC=C1N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	40411-27-6	CC1=C(C=C(C=C1)Cl)N=C=O	{1: 1, 34: 1, 8: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	40425-24-9	CCN(CC)P1(=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)F	{1: 2, 2: 2, 33: 1, 14: 17, 15: 3, 16: 1}
Did not match all atoms present	40425-71-6	C1=CC=C(C=C1)C2=CC(=P(C(=C2)C3=CC=CC=C3)(Cl)Cl)C4=CC=CC=C4	{17: 2, 14: 17, 15: 3}
Did not match all atoms present	40425-79-4	C1=CC=C(C=C1)C2=CC(=P(C(=C2)C3=CC=CC=C3)(F)F)C4=CC=CC=C4	{16: 2, 14: 17, 15: 3}
Did not match all atoms present	40432-84-6	C1=CC2=C(C=C1Br)C(=CN2)CC(=O)O	{32: 1, 2: 1, 27: 1, 18: 1, 14: 4}
Did not match all atoms present	40438-48-0	C[Si](CCO)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 2, 20: 1, 14: 10}
Did not match all atoms present	40438-56-0	C1CCC(CC1)P(C2CCCCC2)C3=CC=C(C=C3)[N+](=O)[O-]	{11: 10, 12: 2, 38: 1, 14: 4}
Did not match all atoms present	40438-59-3	CCOC(=O)C1=CC=C(C=C1)P(C2CCCCC2)C3CCCCC3	{1: 1, 2: 1, 11: 10, 12: 2, 14: 4, 28: 1}
Did not match all atoms present	40438-62-8	C1CCC(CC1)P(C2CCCCC2)C3=CC=C(C=C3)Cl	{17: 1, 11: 10, 12: 2, 14: 4}
Did not match all atoms present	40438-63-9	COC1=CC=C(C=C1)P(C2CCCCC2)C3CCCCC3	{1: 1, 11: 10, 12: 2, 22: 1, 14: 4}
Did not match all atoms present	40438-64-0	CN(C)C1=CC=C(C=C1)P(C2CCCCC2)C3CCCCC3	{1: 2, 11: 10, 12: 2, 14: 4, 33: 1}
Did not match all atoms present	4044-60-4	CC1=CC(=C(C=C1)C)C(=O)C2=CC=CC=C2	{24: 1, 1: 2, 14: 8}
Did not match all atoms present	4044-65-9	C1=CC(=CC=C1N=C=S)N=C=S	{8: 2, 34: 2, 14: 4}
Did not match all atoms present	40444-43-7	CC1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)O)O	{24: 1, 1: 1, 21: 2, 14: 7}
Did not match all atoms present	4046-02-0	CCOC(=O)/C=C/C1=CC(=C(C=C1)O)OC	{1: 2, 2: 1, 6: 2, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	4046-03-1	CC1=NN=C(O1)C2=CC=CC=C2	{1: 1, 35: 2, 14: 5, 23: 1}
Did not match all atoms present	4046-70-2	CN1C2=CC=CC=C2C3=NNC(=S)N=C31	{32: 1, 1: 1, 35: 2, 14: 4, 33: 1}
Did not match all atoms present	4046-86-0	CN1C2=CC=CC=C2C3=C1N=C(N=N3)NCCCO	{1: 1, 2: 3, 35: 3, 33: 1, 14: 4, 20: 1, 31: 1}
Did not match all atoms present	40463-09-0	CC(C)C(=O)CCC1=CC=CC=C1	{24: 1, 1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	40465-45-0	C1=CC(=CC=C1C#N)N=C=O	{8: 1, 34: 1, 29: 1, 14: 4, 37: 1}
Did not match all atoms present	40466-95-3	C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])Br	{18: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	4047-75-0	CC1=C(C=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=C(C=C(C=C4)OC)C	{1: 3, 34: 1, 14: 11, 15: 2, 22: 1, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	40470-68-6	COC1=CC=CC=C1C=CC2=CC=C(C=C2)C3=CC=C(C=C3)C=CC4=CC=CC=C4OC	{1: 2, 22: 2, 14: 16, 6: 4}
Did not match all atoms present	40477-45-0	C1(=C(SC(=C1Br)Cl)Cl)Br	{17: 2, 18: 2, 41: 1}
Did not match all atoms present	40480-63-5	C1=CC2=C3C(=C1)C4C5C4C5C3=CC=C2	{12: 4, 14: 6}
Did not match all atoms present	40484-82-0	CCC(=O)C1=C(NC(=C1C)C(=O)OCC)C	{24: 1, 1: 4, 2: 2, 28: 1, 32: 1}
Did not match all atoms present	40487-42-1	CCC(CC)NC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-]	{1: 4, 2: 2, 3: 1, 38: 2, 14: 1, 31: 1}
Did not match all atoms present	40495-69-0	C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)N)S(=O)(=O)Cl)Br	{14: 5, 17: 1, 18: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	40497-16-3	CC(=O)N(/C=C/C1=[N+](C2=CC=CC=C2C1(C)C)C)C3=CC=CC=C3.[I-]	{1: 4, 6: 2, 33: 2, 13: 1, 14: 9, 15: 1, 19: 1, 24: 1}
Did not match all atoms present	40497-30-1	CC1=NC(=CC(=O)N1)O	{32: 1, 1: 1, 35: 1, 14: 1, 21: 1, 25: 1}
Did not match all atoms present	40497-70-9	CCOC(=O)NC1=NC2=C(C(=C1)NC(C3=CC=CC=C3)C4=CC=CC=C4)NC=N2.Cl	{32: 1, 1: 1, 2: 1, 3: 1, 14: 12, 17: 1, 35: 2, 28: 1, 31: 2}
Did not match all atoms present	405-05-0	C1=CC(=C(C=C1C=O)F)O	{16: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	405-22-1	C1=C(OC(=C1)[N+](=O)[O-])C=NN(CCO)C(=O)N	{33: 1, 2: 2, 38: 1, 6: 1, 34: 1, 14: 2, 20: 1, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	405-31-2	C1=CC(=CC=C1F)SSC2=CC=C(C=C2)F	{16: 2, 40: 2, 14: 8}
Did not match all atoms present	405-50-5	C1=CC(=CC=C1CC(=O)O)F	{16: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	405-51-6	CC(=O)OC1=CC=C(C=C1)F	{16: 1, 1: 1, 28: 1, 14: 4}
Did not match all atoms present	405-79-8	C1=CC(=CC=C1OCC(=O)O)F	{16: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	405-86-7	CN(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)F	{16: 1, 1: 2, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	405-97-0	C1=CC=C(C=C1)OCCF	{16: 1, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	405-99-2	C=CC1=CC=C(C=C1)F	{16: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	40502-72-5	CN1CCN(CC1)CC(CC2=CC=CC=C2)C(C3CCCC3)(C4=CC=CC=C4)O.Cl.Cl	{1: 1, 2: 2, 3: 1, 4: 1, 33: 2, 11: 8, 12: 1, 14: 10, 17: 2, 20: 1}
Did not match all atoms present	40507-23-1	CC1=CC2=C(C=C1)C(=NC(=O)N2C(C)C)C3=CC=C(C=C3)F	{1: 3, 3: 1, 33: 1, 14: 7, 16: 1, 35: 1, 25: 1}
Did not match all atoms present	40507-78-6	C1CC2=C(C1)C(=CC=C2)NC3=NCCN3	{32: 1, 35: 1, 11: 5, 14: 3, 15: 1, 31: 1}
Did not match all atoms present	40512-57-0	CC(C)(C)OC(=O)NC(C1=CSC=C1)C(=O)O	{1: 3, 3: 1, 4: 1, 41: 1, 14: 3, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	40515-89-7	C1=CC=C(C=C1)CCOC2=CC=CC=C2	{2: 2, 22: 1, 14: 10}
Did not match all atoms present	4052-30-6	CS(=O)(=O)C1=CC=C(C=C1)C(=O)O	{1: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	4052-88-4	CC1=CC=C(C=C1)CN(C)C	{1: 3, 2: 1, 14: 4, 33: 1}
Did not match all atoms present	4052-92-0	C1=CC(=CC(=C1)S(=O)(=O)Cl)C(=O)Cl	{24: 1, 17: 2, 29: 2, 14: 4}
Did not match all atoms present	40527-42-2	CCOC(C1=CC2=C(C=C1)OCO2)OCC	{1: 2, 2: 2, 3: 1, 11: 1, 14: 3, 22: 2, 23: 2}
Did not match all atoms present	4053-08-1	C1=CC2=C(C=CC3=C2C(=C1)C(=O)OC3=O)Cl	{17: 1, 28: 2, 14: 5}
Did not match all atoms present	4053-34-3	CC1=CC2=C(C=C1)NC(=O)C=C2	{32: 1, 1: 1, 14: 5, 25: 1}
Did not match all atoms present	40532-06-7	COC1=CC(=C(C=C1)OC)N=C=S	{8: 1, 1: 2, 34: 1, 22: 2, 14: 3}
Did not match all atoms present	40537-72-2	CCOC1=C2C=CC3=C4C(=CC5=C(C6=CC=CC=C6C7=C5C4=C(C=C7)C8=C(C(=C(C2=C38)C9=CC=CC=C91)Cl)Cl)OCC)Cl	{1: 2, 2: 2, 22: 2, 14: 13, 17: 3}
Did not match all atoms present	40538-23-6	C1=CC=C2C(=C1)C=C(C(=N2)[C@H]3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O)O	{35: 1, 12: 1, 14: 8, 21: 1, 25: 2, 27: 1}
Did not match all atoms present	4055-94-1	CC(CO[N+](=O)[O-])(CO[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 4: 1, 38: 1, 22: 2}
Did not match all atoms present	40552-84-9	CC(C1=CC=CC=C1)OC(=O)CC(=O)C	{1: 2, 2: 1, 3: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	40560-63-2	C[Pb](C)(C)SC1=CC=CC=C1	{40: 1, 1: 3, 14: 5}
Did not match all atoms present	40560-76-7	CC1=CC=C(C=C1)S(=O)N=[N+]=[N-]	{1: 1, 34: 2, 29: 1, 14: 4}
Did not match all atoms present	40561-27-1	CC(C)(C#N)O[N+](=O)[O-]	{1: 2, 4: 1, 37: 1, 22: 1}
Did not match all atoms present	40562-09-2	C=C1CCCCC2=CC=CC=C12	{11: 4, 5: 1, 14: 4, 15: 1}
Did not match all atoms present	40567-16-6	CCC(C(=O)Cl)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 3, 3: 1, 4: 2, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	40567-18-8	C1C(=NN(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl)NC(=O)C3=CC(=CC=C3)N	{33: 1, 35: 1, 11: 1, 14: 6, 15: 1, 17: 3, 24: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	40571-86-6	C1CC[C@H]([C@@H](C1)NCC2=CC=CC=C2)O	{2: 1, 11: 4, 12: 2, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	40576-25-8	C1CCN(CC1)C(=O)C2CCCN(C2)CCC3=CC=CC=C3	{33: 2, 2: 2, 11: 9, 12: 1, 14: 5, 24: 1}
Did not match all atoms present	4058-26-8	CCOS(=O)(=O)C=C	{1: 1, 2: 1, 5: 1, 6: 1, 22: 1, 29: 2}
Did not match all atoms present	40580-75-4	CC1=CC(=C(C=C1C)N)N.[Cl-].[Cl-].[Pt+2]	{1: 2, 30: 2, 14: 2, 17: 2}
Did not match all atoms present	40583-17-3	C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)OCCCCO	{2: 5, 14: 2, 17: 3, 20: 1, 22: 1, 28: 1}
Did not match all atoms present	40585-51-1	C[C-]1C(=C(C(=C1C)C)C)C.[Na+]	{1: 5}
Did not match all atoms present	40587-64-2	CCOC(=O)C1=CC(=C(C(=C1)Br)[N+](=O)[O-])Br	{1: 1, 2: 1, 38: 1, 14: 2, 18: 2, 28: 1}
Did not match all atoms present	40595-34-4	C[Si](C)(C)C/C=C/C1=CC=CC=C1	{1: 3, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	40595-35-5	C[Si](C)(C)C/C=C\C1=CC=CC=C1	{1: 3, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	40595-36-6	C[Si](C)(C)[Si](C)(C)/C=C/C1=CC=CC=C1	{1: 5, 14: 5, 6: 2}
Did not match all atoms present	406-76-8	C[N+](C)(C)CC(CC(=O)O)O	{27: 1, 1: 3, 2: 2, 3: 1, 20: 1}
Did not match all atoms present	40603-46-1	[Cl-].[Nd]	{17: 1}
Did not match all atoms present	40604-49-7	C1=CC2=C(C=CC(=C2)Cl)C=C1O	{17: 1, 21: 1, 14: 6}
Did not match all atoms present	4061-29-4	CCN(CC)CC(=O)C1=CC=CC=C1	{24: 1, 1: 2, 2: 3, 14: 5, 33: 1}
Did not match all atoms present	40614-52-6	CC(=O)CC(=O)C1=CC=CC=N1	{24: 2, 1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	40615-36-9	COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)Cl	{1: 2, 4: 1, 22: 2, 14: 13, 17: 1}
Did not match all atoms present	40615-39-2	CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)O	{32: 1, 1: 3, 2: 1, 4: 1, 33: 1, 11: 1, 12: 3, 14: 14, 20: 1, 22: 3, 23: 1, 25: 2}
Did not match all atoms present	40618-18-6	C1(C(O1)C(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 12: 2, 23: 1}
Did not match all atoms present	4062-78-6	CCCCCCCCCCCCCCCCC(C(=O)OC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 15, 3: 1, 28: 1, 29: 3}
Did not match all atoms present	40620-33-5	CC(C)(C)C(C)(C#N)N=NC1=CC=C(C=C1)Br	{1: 4, 34: 2, 4: 2, 37: 1, 14: 4, 18: 1}
Did not match all atoms present	40620-35-7	CC(C)(C)C(C)(C#N)N=NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 4, 34: 2, 4: 2, 37: 1, 38: 1, 14: 4}
Did not match all atoms present	40620-38-0	CC(C#N)(C#N)N=NC1=CC=C(C=C1)OC	{1: 2, 34: 2, 4: 1, 37: 2, 14: 4, 22: 1}
Did not match all atoms present	40625-96-5	CC1=CC(=C(C=C1C(C)C)C(C)C)O	{1: 5, 3: 2, 21: 1, 14: 2}
Did not match all atoms present	40626-35-5	CCCSP(=O)(OCC)OC1=CC=CC=C1	{1: 2, 2: 3, 40: 1, 14: 5, 22: 2, 29: 1}
Did not match all atoms present	40628-77-1	CCCCC(CC1=CC=CC=C1)OC(=O)C	{1: 2, 2: 4, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	4063-41-6	CC1=CC(=O)OC2=C1C=CC3=C2C=C(O3)C	{1: 2, 28: 1, 14: 4, 23: 1}
Did not match all atoms present	40630-63-5	CCCCCCCCS(=O)(=O)F	{16: 1, 1: 1, 2: 7, 29: 2}
Did not match all atoms present	40630-65-7	C=CCNS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 4, 5: 1, 6: 1, 16: 9, 29: 2, 31: 1}
Did not match all atoms present	4064-09-9	CC(=O)O[C@H]1CC[C@@]2(C3CC[C@@]4([C@H](CC[C@@]4(C3CC[C@@]2(C1)O)O)C5=COC(=O)C=C5)C)C=O	{1: 2, 11: 9, 12: 4, 13: 4, 14: 3, 20: 2, 26: 1, 28: 2}
Did not match all atoms present	40648-96-2	CN1C=NC(=C1C#N)[N+](=O)[O-]	{1: 1, 35: 1, 37: 1, 38: 1, 33: 1, 14: 1}
Did not match all atoms present	40649-26-1	C1CCC(C1)NC2=CC=CC=C2	{11: 4, 12: 1, 14: 5, 31: 1}
Did not match all atoms present	4065-45-6	COC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O	{1: 1, 14: 7, 20: 1, 21: 1, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	40650-41-7	CC1=CC2=C(C=C1)C(CC2)(C)C	{1: 3, 11: 2, 13: 1, 14: 3}
Did not match all atoms present	40663-68-1	C=CCOC1=CC=C(C=C1)C=O	{2: 1, 5: 1, 6: 1, 14: 4, 22: 1, 26: 1}
Did not match all atoms present	40665-92-7	C1[C@H]([C@H]([C@@H]([C@H]1O)/C=C/[C@@H](COC2=CC(=CC=C2)Cl)O)C/C=C\CCCC(=O)O)O	{2: 5, 3: 1, 6: 4, 11: 1, 12: 4, 14: 4, 17: 1, 20: 3, 22: 1, 27: 1}
Did not match all atoms present	40666-04-4	C1C([C@@H](C(C1O)C/C=C\CCCC(=O)O)/C=C/[C@H](COC2=CC=C(C=C2)F)O)O	{2: 5, 3: 1, 6: 4, 11: 1, 12: 4, 14: 4, 16: 1, 20: 3, 22: 1, 27: 1}
Did not match all atoms present	4067-14-5	CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].[Al+3]	{24: 3, 1: 9, 4: 3, 14: 12}
Did not match all atoms present	40672-07-9	C[C-]1[CH-][CH-][CH-][CH-]1.C[C-]1C=CC=C1.[Os]	{1: 2, 14: 8}
Did not match all atoms present	40673-57-2	CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)C(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C	{1: 4, 3: 2, 14: 16}
Did not match all atoms present	40677-44-9	CC1=C(C=C(C(=C1Cl)O)N)Cl	{1: 1, 30: 1, 21: 1, 14: 1, 17: 2}
Did not match all atoms present	40677-64-3	CC1=CC=C(C=C1)NC2=CC(=C3C4=C2C(=O)C5=CC=CC=C5C4=NC(=N3)C6=CC=CC=C6)Br	{1: 1, 35: 2, 14: 14, 18: 1, 25: 1, 31: 1}
Did not match all atoms present	4068-78-4	COC(=O)C1=C(C=CC(=C1)Cl)O	{1: 1, 28: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	40682-56-2	CCOC(=O)[C@H](C(C1=CC=CC=C1)O)N	{1: 1, 2: 1, 3: 2, 14: 5, 20: 1, 28: 1, 30: 1}
Did not match all atoms present	40694-53-9	CCCCCCCCCCCCCCC=C(S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 13, 29: 6, 6: 1, 7: 1}
Did not match all atoms present	40696-22-8	COC1=C(C2=CC=CC=C2C=C1)CO	{1: 1, 2: 1, 20: 1, 22: 1, 14: 6}
Did not match all atoms present	40698-67-7	CC1CC(OC(O1)C)C2=CC=CC=C2	{1: 2, 11: 1, 12: 3, 14: 5, 23: 2}
Did not match all atoms present	407-14-7	C1=CC(=CC=C1OC(F)(F)F)Br	{16: 3, 18: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	407-22-7	CC1=NC(=CC=C1)F	{16: 1, 1: 1, 35: 1, 14: 3}
Did not match all atoms present	407-41-0	C([C@@H](C(=O)O)N)OP(=O)(O)O	{2: 1, 3: 1, 20: 2, 22: 1, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	40703-79-5	C1C2C3C(C1C(C2Br)Br)C(=O)N(C3=O)C4=CC=CC=C4	{33: 1, 11: 1, 12: 6, 14: 5, 18: 2, 25: 2}
Did not match all atoms present	40703-84-2	CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)C)OC3=NC(=NC(=N3)OC4=C(C=C(C=C4C(C)(C)C)C)CC5=C(C(=CC(=C5)C)C(C)(C)C)O)OC6=C(C=C(C=C6C(C)(C)C)C)CC7=C(C(=CC(=C7)C)C(C)(C)C)O	{1: 24, 2: 3, 35: 3, 4: 6, 14: 12, 21: 3, 22: 3}
Did not match all atoms present	40704-04-9	CC1=CC(=C2C(=C1)N=C(O2)C3=CC=C(C=C3)C=CC4=CC=C(C=C4)C5=CC=CC=C5)C	{1: 2, 35: 1, 14: 15, 6: 2, 23: 1}
Did not match all atoms present	40707-59-3	C1(=C(C(=C(C(=C1Cl)I)I)Cl)Cl)Cl	{17: 4, 19: 2}
Did not match all atoms present	40709-23-7	CC[NH+](CC)CCOC1=C2C(=C(C3=C1OC(=C3)C)O)C(=O)C=CO2.[Cl-]	{1: 3, 2: 4, 14: 3, 17: 1, 21: 1, 22: 1, 23: 2, 25: 1}
Did not match all atoms present	4071-85-6	C[Si](C)(C)C=C=O	{8: 1, 1: 3, 29: 1, 6: 1}
Did not match all atoms present	4071-88-9	CCOC(=O)C[Si](C)(C)C	{1: 4, 2: 2, 28: 1}
Did not match all atoms present	40712-39-8	[2H]N=N[2H]	{36: 2}
Did not match all atoms present	40715-68-2	COC1=CC=C(C=C1)CCCC2=CC=CC=C2	{1: 1, 2: 3, 22: 1, 14: 9}
Did not match all atoms present	4072-67-7	C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)CBr)C(=O)CBr	{24: 2, 2: 2, 18: 2, 14: 8}
Did not match all atoms present	40720-27-2	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Mn+2].[Mn+2]	{29: 6, 22: 1}
Did not match all atoms present	40733-27-5	CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O[Si](C)(C)C(C)(C)C	{32: 1, 1: 6, 2: 1, 4: 1, 33: 1, 11: 1, 12: 3, 14: 1, 20: 1, 22: 1, 23: 1, 25: 2}
Did not match all atoms present	40736-26-3	CS(=O)(=O)N1C=CN=C1	{1: 1, 35: 1, 29: 2, 14: 3, 33: 1}
Did not match all atoms present	40739-43-3	CCCCCCCC[N+](CCC)(CCCCCCCC)CCCCCCCC.[Cl-]	{1: 4, 2: 23, 17: 1}
Did not match all atoms present	4074-25-3	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)[N+](=O)[O-])C(C)(C)C	{1: 9, 4: 3, 38: 1, 14: 2}
Did not match all atoms present	4074-43-5	CCCCC1=CC(=CC=C1)O	{1: 1, 2: 3, 21: 1, 14: 4}
Did not match all atoms present	4074-46-8	CCCC1=C(C=CC(=C1)C)O	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	4074-59-3	CN1C2=CC=CC=C2N=C3C1=NC(=O)N(C3=O)C	{1: 2, 35: 2, 33: 2, 14: 4, 25: 2}
Did not match all atoms present	40745-44-6	C1C(C2=CC=CC3=C2C1=CC=C3)N	{11: 1, 12: 1, 30: 1, 14: 6}
Did not match all atoms present	4075-58-5	CCOC(=O)C(=O)C1=CC=CS1	{1: 1, 2: 1, 41: 1, 14: 3, 24: 1, 28: 1}
Did not match all atoms present	4075-59-6	C1=CSC(=C1)C(=O)C(=O)O	{24: 1, 41: 1, 27: 1, 14: 3}
Did not match all atoms present	4075-79-0	CC(=O)NC1=CC=C(C=C1)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	4075-81-4	CCC(=O)[O-].CCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	4075-96-1	CC(CC1=CC=CC=C1)N(C)C	{1: 3, 2: 1, 3: 1, 14: 5, 33: 1}
Did not match all atoms present	4076-02-2	C(C(CS(=O)(=O)[O-])S)S.[Na+]	{2: 2, 3: 1, 29: 3, 39: 2}
Did not match all atoms present	4076-36-2	CC1=NNN=N1	{32: 1, 1: 1, 35: 3}
Did not match all atoms present	4076-40-8	CC1=CC=CC2=C1C=CC3=C2C4=CC=CC=C4C=C3	{1: 1, 14: 11}
Did not match all atoms present	4076-43-1	CC1=CC=CC2=C1C3=C(C=C2)C=CC4=C3C(=CC=C4)C	{1: 2, 14: 10}
Did not match all atoms present	40762-15-0	C1=CC=C(C(=C1)C2=NC(C(=O)N(C3=C2C=C(C=C3)Cl)CCO)O)F	{33: 1, 2: 2, 35: 1, 12: 1, 14: 7, 15: 1, 16: 1, 17: 1, 20: 2, 25: 1}
Did not match all atoms present	40763-98-2	C1=CC(=CC=C1N)OC2=CC(=C(C=C2)N)C(=O)N	{24: 1, 30: 3, 22: 1, 14: 7}
Did not match all atoms present	40771-26-4	C1CC(C2=C(C1)C(=CC=C2)O)O	{20: 1, 11: 3, 12: 1, 21: 1, 14: 3}
Did not match all atoms present	40775-09-5	CCCCCCCCCCC(CCCCCCCCCC)C1=CC=CC=C1	{1: 2, 2: 18, 3: 1, 14: 5}
Did not match all atoms present	40775-34-6	CCCCCCCCCC1=CC=C(C=C1)CCCCCCCCC	{1: 2, 2: 16, 14: 4}
Did not match all atoms present	40775-78-8	CC1=CC(=O)N2C(=N1)N=C(N2)SC	{32: 1, 1: 2, 35: 2, 33: 1, 40: 1, 14: 1, 25: 1}
Did not match all atoms present	40775-79-9	CC1=CC(=O)N2C(=N1)N=C(N2)N	{32: 1, 1: 1, 35: 2, 33: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	40775-86-8	CC1=CC(=O)N2C(=N1)N=C(N2)C(=O)O	{32: 1, 1: 1, 35: 2, 33: 1, 14: 1, 25: 1, 27: 1}
Did not match all atoms present	40778-40-3	CC1=CC=CC=C1OCC(CNCCN2C=C(C(=O)NC2=O)C)O.Cl	{32: 1, 1: 2, 2: 4, 3: 1, 33: 1, 14: 5, 17: 1, 20: 1, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	40780-82-3	CN=C(C1=CC=CC=C1)SC	{40: 1, 1: 2, 34: 1, 14: 5, 7: 1}
Did not match all atoms present	40782-54-5	CCCCCCCOC1=CC=C(C=C1)C(=O)Cl	{1: 1, 2: 6, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	4079-52-1	COCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	408-35-5	CCCCCCCCCCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 14}
Did not match all atoms present	4080-28-8	CCC[S-].CCC[S-].[Hg+2]	{1: 2, 2: 4}
Did not match all atoms present	4080-31-3	C1N2CN3CN1C[N+](C2)(C3)C/C=C/Cl	{17: 1, 2: 1, 11: 6, 6: 2, 33: 3}
Did not match all atoms present	40805-50-3	C1=CC(=CC=C1C#N)C(=O)CCl	{24: 1, 17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	40806-93-7	CS(=O)(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	4081-23-6	C1C2=CC=CC=C2OP(=O)(O1)OC3=CC=CC=C3	{11: 1, 29: 1, 22: 1, 14: 9, 23: 2}
Did not match all atoms present	40813-98-7	CCC1=CC(=CC(=C1N)C)C	{1: 3, 2: 1, 30: 1, 14: 2}
Did not match all atoms present	40817-08-1	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 4, 37: 1, 14: 8}
Did not match all atoms present	40828-00-0	CCN(CC)CC1=CC=C(C=C1)CN(CC)CC	{1: 4, 2: 6, 14: 4, 33: 2}
Did not match all atoms present	40828-46-4	CC(C1=CC=C(C=C1)C(=O)C2=CC=CS2)C(=O)O	{1: 1, 3: 1, 41: 1, 14: 7, 24: 1, 27: 1}
Did not match all atoms present	40828-54-4	C1=CC=C2C(=C1)NC(=N2)S(=O)(=O)O	{32: 1, 35: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	4083-64-1	CC1=CC=C(C=C1)S(=O)(=O)N=C=O	{8: 1, 1: 1, 34: 1, 29: 3, 14: 4}
Did not match all atoms present	40832-99-3	C1CCCN(CC1)C2=CC=CC=C2	{33: 1, 11: 6, 14: 5}
Did not match all atoms present	40835-65-2	O.O.O.OS(=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	40836-01-9	C1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=CC=CC=C3)C4=CC=CC=C4	{14: 17, 23: 1}
Did not match all atoms present	40837-23-8	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CN=C2Cl	{1: 1, 35: 2, 14: 6, 17: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	4084-34-8	C[Si](CCCC(=O)Cl)(Cl)Cl	{24: 1, 1: 1, 2: 3, 17: 3}
Did not match all atoms present	4084-36-0	B(F)(F)F.CCOCCO	{16: 3, 1: 1, 2: 3, 20: 1, 22: 1}
Did not match all atoms present	4084-38-2	C1=C(C(=C(C(=C1F)F)CO)F)F	{16: 4, 2: 1, 20: 1, 14: 1}
Did not match all atoms present	40842-68-0	CC1(C2=CC=CC=C2N(C1=CN=NC3=CC=C(C=C3)OC)C)C	{1: 4, 34: 2, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1, 22: 1}
Did not match all atoms present	40843-73-0	C1=CC(=CC=C1O)OC2=C(C=C(C=C2)Cl)Cl	{17: 2, 22: 1, 21: 1, 14: 7}
Did not match all atoms present	40847-64-1	CC1=C(C=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)NCCO.[Na+]	{1: 1, 2: 2, 14: 8, 20: 1, 25: 2, 29: 5, 30: 1, 31: 2}
Did not match all atoms present	4085-18-1	C1=CC=C(C=C1)C2=CC(=C(C=C2)N)[N+](=O)[O-]	{38: 1, 30: 1, 14: 8}
Did not match all atoms present	40861-08-3	C1=CC(=CC=C1CN(CC2=CC=C(C=C2)Cl)O)Cl	{17: 2, 2: 2, 20: 1, 14: 8, 33: 1}
Did not match all atoms present	40870-59-5	CC1=C(C=C(C=C1)CO)[N+](=O)[O-]	{1: 1, 2: 1, 20: 1, 38: 1, 14: 3}
Did not match all atoms present	40876-94-6	CCN1C(=CC2=CC=CC=C21)C	{1: 2, 2: 1, 14: 5, 33: 1}
Did not match all atoms present	40876-98-0	CCOC(=O)/C=C(/C(=O)OCC)\[O-].[Na+]	{1: 2, 2: 2, 28: 2, 6: 1, 7: 1}
Did not match all atoms present	40877-09-6	C1=CC(=CC=C1C(=O)CCCCl)Cl	{24: 1, 17: 2, 2: 3, 14: 4}
Did not match all atoms present	40877-19-8	COC1=CC=C(C=C1)C(=O)CCCCl	{1: 1, 2: 3, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	4088-63-5	CN1C=CC=CC1=N	{1: 1, 36: 1, 14: 4, 33: 1}
Did not match all atoms present	4088-81-7	C1=CC=C2C(=C1)C3=C(C=C(C=C3)O)C(=O)C2=O	{25: 2, 21: 1, 14: 7}
Did not match all atoms present	4088-84-0	C1=CC(=C(C=C1C(F)(F)F)C#N)F	{16: 4, 4: 1, 37: 1, 14: 3}
Did not match all atoms present	40882-83-5	C1=CC(=CN=C1)C2=C3C=CC(=N3)C=C4C=CC(=CC5=NC(=CC6=C(C(=C2N6C7=CN=CC=C7)C8=CN=CC=C8)C9=CN=CC=C9)C=C5)N4	{32: 1, 33: 1, 35: 6, 14: 25}
Did not match all atoms present	40889-91-6	C1=CC(=C(C=C1C(F)(F)F)O)Cl	{16: 3, 17: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	4089-57-0	C(=O)(C(C(F)(F)F)(OC(C(F)(F)S(=O)(=O)F)(F)F)F)F	{16: 10, 24: 1, 4: 4, 29: 2, 22: 1}
Did not match all atoms present	4089-58-1	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(F)(F)S(=O)(=O)F)(F)F)F)(F)F)F)F	{16: 16, 24: 1, 4: 7, 29: 2, 22: 2}
Did not match all atoms present	40893-99-0	C1=CC=C(C=C1)CC(CBr)O	{2: 2, 3: 1, 20: 1, 18: 1, 14: 5}
Did not match all atoms present	409-21-2	[C-]#[Si+]	{}
Did not match all atoms present	4090-51-1	CC1(COP(=S)(OC1)OP2(=S)OCC(CO2)(C)C)C	{1: 4, 11: 4, 13: 2, 22: 1, 23: 4}
Did not match all atoms present	4090-55-5	CC1(COP(=O)(OC1)Cl)C	{1: 2, 11: 2, 13: 1, 17: 1, 23: 2, 29: 1}
Did not match all atoms present	4090-60-2	CC1(CO[P+](=O)OC1)C	{1: 2, 11: 2, 29: 1, 13: 1, 23: 2}
Did not match all atoms present	40906-82-9	C1=CC=C(C=C1)C(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F	{16: 6, 3: 1, 4: 2, 29: 4, 14: 5}
Did not match all atoms present	4091-14-9	CC(=O)N(C=C)C1=CC=CC=C1	{1: 1, 5: 1, 6: 1, 33: 1, 14: 5, 24: 1}
Did not match all atoms present	4091-50-3	CNCCC1=CC=C(C=C1)OC	{1: 2, 2: 2, 22: 1, 14: 4, 31: 1}
Did not match all atoms present	40926-86-1	C1=CC=C(C=C1)C=CC=CC(=O)Cl	{24: 1, 17: 1, 14: 5, 6: 4}
Did not match all atoms present	40928-00-5	CC(C)OP1OCCO1	{11: 2, 1: 2, 3: 1, 22: 1, 23: 2}
Did not match all atoms present	4093-31-6	CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)OC)Cl	{1: 3, 14: 2, 17: 1, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	4093-35-0	CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Br	{1: 3, 2: 4, 33: 1, 14: 2, 18: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	40932-60-3	C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)O)Cl	{17: 3, 27: 1, 21: 1, 14: 1}
Did not match all atoms present	40932-63-6	CC1=C(C=C(S1)C2=CC=CC=C2)C(=O)C	{24: 1, 1: 2, 14: 6, 41: 1}
Did not match all atoms present	40941-53-5	CC1=C2C=CC(=CC2=NC=C1)Cl	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	40941-54-6	CC1=CC2=NC=CC(=C2C=C1)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	40947-69-1	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)OC)N	{1: 2, 34: 2, 14: 6, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	40948-32-1	C[N+](CCCNC=O)(CCCNC=O)CC1=CC(=C(C=C1)OC)N.[Cl-]	{1: 2, 2: 7, 14: 3, 17: 1, 22: 1, 26: 2, 30: 1, 31: 2}
Did not match all atoms present	40948-38-7	CCN(CC[N+](C)(C)CCCNC=O)C1=CC=CC=C1	{1: 3, 2: 6, 33: 1, 14: 5, 26: 1, 31: 1}
Did not match all atoms present	40948-42-3	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)C(C(=O)C)N=NC3=C(C=CC(=C3)C[N+](C)(CCCN)CCCN)OC)C)NC(=O)C(C(=O)C)N=NC4=C(C=CC(=C4)C[N+](C)(CCCN)CCCN)OC.[Cl-].[Cl-]	{1: 8, 2: 14, 3: 2, 34: 4, 14: 12, 17: 2, 22: 2, 24: 4, 30: 4, 31: 2}
Did not match all atoms present	40948-95-6	C[N+](CCCN)(CCCN)CC1=CC(=C(C=C1)OC)NN=C2C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4OC.[Cl-]	{1: 3, 2: 7, 34: 1, 14: 12, 15: 2, 17: 1, 22: 2, 24: 1, 25: 1, 30: 2, 31: 2}
Did not match all atoms present	40949-94-8	C[Si](C)(C)[N-][Si](C)(C)C.[K+]	{1: 6, 34: 1}
Did not match all atoms present	4095-09-4	C([SiH3])(Br)(Br)Br	{18: 3, 4: 1}
Did not match all atoms present	4095-22-1	CC(C)C1=CC=CS1	{1: 2, 3: 1, 14: 3, 41: 1}
Did not match all atoms present	4095-45-8	C1=CC=C2C(=C1)NC3=CC=CC=C3[As]2O[As]4C5=CC=CC=C5NC6=CC=CC=C64	{32: 2, 22: 1, 14: 16}
Did not match all atoms present	40951-13-1	CC1=C2C(=C3CCC(C3=C1)O)C=CC4=CC=CC=C42	{1: 1, 11: 2, 12: 1, 14: 7, 20: 1}
Did not match all atoms present	40953-14-8	CCC1=CN=C(O1)CC	{1: 2, 2: 2, 35: 1, 14: 1, 23: 1}
Did not match all atoms present	40953-34-2	C(#N)C1=C(N=C(N1)N)C#N	{32: 1, 35: 1, 37: 2, 30: 1}
Did not match all atoms present	4096-20-2	C1CCN(CC1)C2=CC=CC=C2	{33: 1, 11: 5, 14: 5}
Did not match all atoms present	4096-21-3	C1CCN(C1)C2=CC=CC=C2	{33: 1, 11: 4, 14: 5}
Did not match all atoms present	40968-70-5	C[N+]1(CCOCC1)C.[Br-]	{1: 2, 18: 1, 11: 4, 23: 1}
Did not match all atoms present	4097-22-7	C1C[C@@H](O[C@@H]1CO)N2C=NC3=C2N=CN=C3N	{33: 1, 2: 1, 35: 3, 11: 2, 12: 2, 14: 2, 20: 1, 23: 1, 30: 1}
Did not match all atoms present	4097-47-6	CC(C)C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]	{38: 2, 1: 2, 3: 1, 21: 1, 14: 2}
Did not match all atoms present	4098-30-0	C[Si]1([Si]([Si]([Si]([Si]([Si]1(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 12}
Did not match all atoms present	4098-98-0	C[Si](C)(C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C	{1: 12}
Did not match all atoms present	40989-37-5	C[Si](=O)C.C[Si](=O)C1=CC=CC=C1	{1: 3, 29: 2, 14: 5}
Did not match all atoms present	4099-63-2	CCC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]	{1: 1, 2: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	4099-81-4	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CI)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 19: 1, 20: 2, 23: 1, 30: 1}
Did not match all atoms present	40990-29-2	CC1=CC=C(S1)SC	{40: 1, 1: 2, 14: 2, 41: 1}
Did not match all atoms present	41003-94-5	CCOP(=O)(C[N+]#[C-])OCC	{1: 2, 2: 3, 34: 1, 29: 1, 22: 2}
Did not match all atoms present	41008-10-0	CCN(CCOS(=O)(=O)O)C1=CC=CC(=C1)C	{1: 2, 2: 3, 33: 1, 14: 4, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	41011-48-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)OS(=O)(=O)C5=CC=CC(=C5)C(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{14: 13, 22: 1, 24: 1, 25: 2, 29: 5, 30: 1, 31: 1}
Did not match all atoms present	41018-86-4	CC1=C(NC2=C1C=CC=C2[N+](=O)[O-])C	{32: 1, 1: 2, 38: 1, 14: 3}
Did not match all atoms present	41025-67-6	CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)N=NC4=[N+](C=NN4C)C.[Cl-]	{1: 3, 34: 2, 35: 1, 33: 3, 14: 10, 17: 1}
Did not match all atoms present	41029-46-3	C#CCOS(=O)(=O)C(F)(F)F	{2: 1, 4: 1, 9: 1, 10: 1, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	41037-26-7	CC1=C2C=C(C=CC2=NC=C1)OC	{1: 2, 35: 1, 22: 1, 14: 5}
Did not match all atoms present	4104-12-5	CC(=O)CC(=O)NC1=C(C=C(C=C1)C2=CC(=C(C=C2)NC(=O)CC(=O)C)OC)OC	{1: 4, 2: 2, 14: 6, 22: 2, 24: 4, 31: 2}
Did not match all atoms present	4104-14-7	CC(=NP(=S)(OC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)Cl)N	{1: 1, 34: 1, 7: 1, 14: 8, 17: 2, 22: 2, 30: 1}
Did not match all atoms present	4104-49-8	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC(=C4C(=C3O)C(=O)C5=C(C=CC(=C5C4=O)O)N)N	{25: 2, 30: 2, 28: 1, 21: 2, 14: 12}
Did not match all atoms present	4104-75-0	CN(C1=CC=CC=C1)C(=S)N	{1: 1, 33: 1, 30: 1, 14: 5, 7: 1}
Did not match all atoms present	4104-81-8	C[Si](C)(C)N([Si](C)(C)C)[Hg]N([Si](C)(C)C)[Si](C)(C)C	{1: 12, 33: 2}
Did not match all atoms present	41044-12-6	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4N3C	{1: 3, 2: 2, 35: 1, 33: 2, 14: 8, 28: 1}
Did not match all atoms present	41047-48-7	CC(C1=CC=CC=C1)(C(C)(C2=CC=CC=C2)OC)OC	{1: 4, 4: 2, 22: 2, 14: 10}
Did not match all atoms present	4105-90-2	CCOC1=NN(C(=O)C1)C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 11: 1, 14: 4, 15: 1, 22: 1, 25: 1}
Did not match all atoms present	4105-91-3	CCOC1=NN(C(=O)C1)C2=CC=C(C=C2)N	{1: 1, 2: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 22: 1, 25: 1, 30: 1}
Did not match all atoms present	4105-92-4	CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC)C(=O)OCC	{1: 3, 2: 3, 28: 3, 14: 3}
Did not match all atoms present	41051-80-3	CCN(CC)CCC[Si](OC)(OC)OC	{1: 5, 2: 5, 22: 3, 33: 1}
Did not match all atoms present	41051-88-1	[2H]C1=C(C(=C(C(=C1C([2H])([2H])[2H])[2H])[2H])C([2H])([2H])[2H])[2H]	{1: 2, 14: 4}
Did not match all atoms present	4106-66-5	C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)N	{30: 1, 14: 7, 23: 1}
Did not match all atoms present	4106-67-6	CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=CC=CC=C2[N+](=O)[O-]	{1: 1, 34: 2, 3: 1, 38: 1, 14: 9, 24: 2, 31: 1}
Did not match all atoms present	41062-71-9	CC1=C(C2=CC=CC=C2N1)/C=C/C3=[N+](C4=CC=CC=C4C3(C)C)C.CC1=C(C2=CC=CC=C2N1)/C=C/C3=[N+](C4=CC=CC=C4C3(C)C)C.[O-]S(=O)(=O)[O-]	{32: 2, 1: 8, 6: 4, 33: 2, 13: 2, 14: 16, 15: 2, 29: 4}
Did not match all atoms present	41068-60-4	C1=CC=C(C=C1)C2=CC(=O)C=C(S2(=O)=O)C3=CC=CC=C3	{25: 1, 29: 2, 14: 12, 15: 2}
Did not match all atoms present	4107-65-7	COC1=CC(=C(C=C1)C#N)OC	{1: 2, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	4107-98-6	CC(C)N(C1=CC=CC=C1)C(C)C	{1: 4, 3: 2, 14: 5, 33: 1}
Did not match all atoms present	4108-61-6	C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N)OC2=O	{28: 1, 30: 1, 14: 9}
Did not match all atoms present	41083-11-8	C1CCC(CC1)[Sn](C2CCCCC2)(C3CCCCC3)N4C=NC=N4	{33: 1, 11: 15, 12: 3, 14: 2, 35: 2}
Did not match all atoms present	41085-43-2	CC1=C(C(=CC=C1)[N+](=O)[O-])Br	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	4109-96-0	[Si](Cl)Cl	{17: 2}
Did not match all atoms present	41098-56-0	CCN(CC)C1=NC(=NC(=N1)NC2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)N(CC)CC)NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 4, 2: 4, 35: 6, 6: 2, 33: 2, 14: 12, 29: 18, 31: 4}
Did not match all atoms present	4110-35-4	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C#N	{38: 2, 37: 1, 14: 3}
Did not match all atoms present	4110-66-1	C1CN1P(=O)(NC(=O)C2=CC=CC=C2)N3CC3	{33: 2, 11: 4, 14: 5, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	41105-35-5	C1=CC=C(C=C1)C#CC2=C3C=CC=C(C3=C(C4=CC=CC=C42)C#CC5=CC=CC=C5)Cl	{17: 1, 10: 4, 14: 17}
Did not match all atoms present	41105-36-6	C1=CC=C(C=C1)C#CC2=C3C=CC(=CC3=C(C4=CC=CC=C42)C#CC5=CC=CC=C5)Cl	{17: 1, 10: 4, 14: 17}
Did not match all atoms present	41106-03-0	CC1=CC(=C(C(=C1)C)C=[N+](C)[O-])C	{1: 4, 33: 1, 14: 2, 6: 1, 29: 1}
Did not match all atoms present	4111-54-0	[Li+].CC(C)[N-]C(C)C	{1: 4, 34: 1, 3: 2}
Did not match all atoms present	41115-75-7	CC1=CC(=CC=C1)[O]	{1: 1, 14: 4}
Did not match all atoms present	41119-18-0	CN(C)CC[O-].CN(C)CC[O-].[Cu+2]	{1: 4, 2: 4, 29: 2, 33: 2}
Did not match all atoms present	41119-53-3	C[PH+](C)C1=CC=CC=C1.C[PH+](C)C1=CC=CC=C1.I[Pt]I	{1: 4, 19: 2, 14: 10}
Did not match all atoms present	4112-03-2	CNS(=O)(=O)O	{1: 1, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	4112-23-6	C[Si](=C)C	{1: 2, 5: 1}
Did not match all atoms present	4112-92-9	CCCC(=O)OC1=CC=CC=C1OC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	41122-70-7	CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 5, 37: 1, 14: 8}
Did not match all atoms present	41122-71-8	CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 6, 37: 1, 14: 8}
Did not match all atoms present	41123-59-5	C(CCl)S(=O)(=O)CS(=O)(=O)CCCl	{17: 2, 2: 5, 29: 4}
Did not match all atoms present	41123-69-7	C(CS(=O)(=O)CS(=O)(=O)CCO)O	{2: 5, 20: 2, 29: 4}
Did not match all atoms present	4113-57-9	C1=C(SN=N1)Cl	{17: 1, 35: 2, 14: 1, 41: 1}
Did not match all atoms present	4113-72-8	CC1=CC(=CC=C1)N=[N+]=[N-]	{1: 1, 34: 2, 14: 4}
Did not match all atoms present	41136-03-2	C1C(OC(=N1)N)CSC2=CC=CC=C2	{2: 1, 35: 1, 40: 1, 11: 1, 12: 1, 14: 5, 15: 1, 23: 1, 30: 1}
Did not match all atoms present	41136-22-5	C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CN3C=NN=N3)C(=O)[O-])CSC4=NN=CS4.[Na+]	{33: 2, 2: 2, 35: 5, 40: 1, 41: 2, 11: 1, 12: 2, 14: 2, 15: 2, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	41138-69-6	CC(C)(C)[Si](C)(C)O[C@@H]1CC(=O)C(=C1)CCCCCCC(=O)OC	{1: 6, 2: 6, 4: 1, 11: 1, 12: 1, 14: 1, 15: 1, 22: 1, 25: 1, 28: 1}
Did not match all atoms present	4114-21-0	CC1=NC(=O)N(N1)C	{32: 1, 1: 2, 35: 1, 33: 1, 25: 1}
Did not match all atoms present	41141-95-1	CC1=CC=C(C=C1)S(=O)(=O)C(C(=O)O)NC(=O)OC	{1: 2, 3: 1, 14: 4, 27: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	4115-76-8	CC1=CC(=O)OC2=C1C=CC(=C2C)O	{1: 2, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	41153-30-4	CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)F)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	4116-00-1	C(CP(=O)(CCC(=O)N)CCC(=O)N)C(=O)N	{24: 3, 2: 6, 29: 1, 30: 3}
Did not match all atoms present	4116-90-9	CN1C(=O)C2=C3C(=C(C=C2)Br)C=CC=C3C1=O	{1: 1, 18: 1, 33: 1, 14: 5, 25: 2}
Did not match all atoms present	41161-53-9	CCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCC)Cl	{1: 2, 2: 8, 28: 2, 14: 11, 17: 1}
Did not match all atoms present	41161-54-0	CCCCCC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC)Cl	{1: 2, 2: 8, 28: 2, 14: 11, 17: 1}
Did not match all atoms present	41161-57-3	CCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCC)Cl	{1: 2, 2: 13, 28: 2, 14: 11, 17: 1}
Did not match all atoms present	41163-25-1	C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C7=C8C9=C(C=CC1=C9C4=C(C=C1)C=CC1=C(C3=C6C8=C14)C=C2)C=C7	{14: 16}
Did not match all atoms present	41168-96-1	CN(C)C(=S)C(=O)N	{24: 1, 1: 2, 33: 1, 30: 1, 7: 1}
Did not match all atoms present	41169-42-0	CC(C)(C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{24: 2, 1: 2, 4: 1, 14: 10}
Did not match all atoms present	41175-50-2	C1CC2=C3C(=C(C=C2)O)CCCN3C1	{33: 1, 11: 6, 21: 1, 14: 2}
Did not match all atoms present	4118-51-8	CC(C)OC(=O)C(C1=CC=CC=C1)O	{1: 2, 3: 2, 20: 1, 14: 5, 28: 1}
Did not match all atoms present	41186-03-2	CC1=CC(=CC=C1)N2CCNCC2	{32: 1, 1: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	4119-41-9	C1=CC=C(C=C1)CCCI	{2: 3, 19: 1, 14: 5}
Did not match all atoms present	4119-52-2	C(#N)[S-].C(#N)[S-].C(#N)[S-].[Fe+3]	{37: 3}
Did not match all atoms present	4119-81-7	C1CN1P(=O)(NC(=O)C2=CC=CC=C2I)N3CC3	{33: 2, 11: 4, 14: 4, 19: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	4119-82-8	C1CN1P(=O)(NC(=O)C2=CC(=CC=C2)I)N3CC3	{33: 2, 11: 4, 14: 4, 19: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	41191-04-2	CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC(=C(C=C2)OCC3=CC=CC(=C3)C(=O)N(C)C)Cl)N)N)C	{1: 5, 2: 2, 35: 2, 33: 2, 13: 1, 14: 7, 15: 2, 17: 1, 20: 1, 22: 1, 24: 1, 29: 2, 30: 2}
Did not match all atoms present	41195-90-8	C1=CC(=C(C(=C1)Cl)Cl)N=C=O	{8: 1, 17: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	41197-29-9	C(S(=O)(=O)Cl)(Cl)Cl	{17: 3, 3: 1, 29: 2}
Did not match all atoms present	41198-08-7	CCCSP(=O)(OCC)OC1=C(C=C(C=C1)Br)Cl	{1: 2, 2: 3, 40: 1, 14: 3, 17: 1, 18: 1, 22: 2, 29: 1}
Did not match all atoms present	4120-64-3	C1=CC(=CC=C1/C=C/2\C(=O)NC(=S)S2)[N+](=O)[O-]	{32: 1, 6: 1, 38: 1, 41: 1, 14: 4, 15: 2, 25: 1}
Did not match all atoms present	4120-77-8	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	4120-78-9	CC(=O)NC1=CC2=C(C=CC3=CC=CC=C32)C=C1	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	41208-07-5	CC1=CC(NC2=C1C=C(C=C2)CC3=CC4=C(C=C3)NC(C=C4C)(C)C)(C)C	{32: 2, 1: 6, 2: 1, 13: 2, 14: 8, 15: 2}
Did not match all atoms present	41217-05-4	CC1=C2C=CC3=C4C2=C5C(=C(C4=CC=C3)C)C=CC6=C5C1=CC=C6	{1: 2, 14: 10}
Did not match all atoms present	41219-25-4	COP(=S)(OC)SC1CCSC2=CC=CC=C12	{1: 2, 40: 1, 41: 1, 11: 2, 12: 1, 14: 4, 22: 2}
Did not match all atoms present	41219-30-1	COP(=S)(OC)SC1CCSC2=C1C=C(C=C2)Cl	{1: 2, 40: 1, 41: 1, 11: 2, 12: 1, 14: 3, 17: 1, 22: 2}
Did not match all atoms present	41219-31-2	CCOP(=S)(OCC)SC1CCSC2=C1C=C(C=C2)Cl	{1: 2, 2: 2, 40: 1, 41: 1, 11: 2, 12: 1, 14: 3, 17: 1, 22: 2}
Did not match all atoms present	4122-04-7	C1=NC=NC(=N1)N	{35: 3, 30: 1, 14: 2}
Did not match all atoms present	4122-13-8	[2H]C(=O)C	{1: 1, 26: 1}
Did not match all atoms present	4122-45-6	C1CO[N+](=C1[N+](=O)[O-])[O-]	{23: 1, 11: 2, 38: 1, 15: 1}
Did not match all atoms present	4122-68-3	C1=CC(=CC=C1OCC(=O)Cl)Cl	{24: 1, 17: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	41221-47-0	COC(=O)C1=CC(=CC=C1)N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	41222-49-5	CC(CCO)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 6, 3: 1, 14: 4, 20: 2, 27: 4}
Did not match all atoms present	41226-18-0	CC[NH+](CC)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=C(C=C3)OC)OC)OC.C(=O)(C(=O)[O-])O	{1: 5, 2: 4, 6: 2, 14: 6, 22: 4, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	41226-20-4	CC(C)[NH+](CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=C(C=C3)OC)OC)OC)C(C)C.C(=O)(C(=O)[O-])O	{1: 7, 2: 2, 3: 2, 6: 2, 14: 6, 22: 4, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	41230-50-6	[As]#[Eu]	{}
Did not match all atoms present	41233-93-6	CCC(C)(C)[O-].[K+]	{1: 3, 2: 1, 4: 1, 29: 1}
Did not match all atoms present	41238-51-1	CCC(CO)(CO)CO.CC(C)(CO)COC(=O)C(C)(C)CO.C1CCC(=O)OCC1.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 5, 2: 7, 4: 3, 11: 5, 14: 4, 20: 5, 27: 2, 28: 2}
Did not match all atoms present	41240-76-0	CCCCCOC1=CC=C(C=C1)NC(=O)C	{1: 2, 2: 4, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	41240-77-1	CCCCCCOC1=CC=C(C=C1)NC(=O)C	{1: 2, 2: 5, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	41240-93-1	CCCOC1=CC=CC=C1NC(=O)C[NH+](CC)CC.[Cl-]	{1: 3, 2: 5, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	4125-25-1	CC(C)CP(CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 3}
Did not match all atoms present	41251-37-0	[2H][C-]([2H])[2H].[Mg+2].[I-]	{19: 1}
Did not match all atoms present	41252-97-5	CC1=C(C=C(C=C1)I)[N+](=O)[O-]	{1: 1, 19: 1, 38: 1, 14: 3}
Did not match all atoms present	41253-21-8	C1=NC=N[N-]1.[Na+]	{35: 3, 14: 2}
Did not match all atoms present	41253-36-5	CC1=CC2=C(C=C1)[N-]N=N2.[Na+]	{1: 1, 35: 3, 14: 3}
Did not match all atoms present	41259-36-3	CC(C)(C1=CC=C(C=C1)OCCO)C2=CC=C(C=C2)OCCO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CO)O	{1: 2, 2: 6, 4: 1, 14: 16, 20: 4, 22: 2, 27: 4}
Did not match all atoms present	41259-67-0	CCCCNC1=C(C(=NC=N1)Cl)N	{1: 1, 2: 3, 35: 2, 14: 1, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	41262-21-9	C[As](=[Se])(C)C	{1: 3}
Did not match all atoms present	41264-06-6	CC1=CC(=O)OC(=C1C(=O)OC)C	{1: 3, 28: 2, 14: 1}
Did not match all atoms present	41267-76-9	CC1=CC(=O)OC2=C3CCCN4C3=C(CCC4)C=C12	{1: 1, 11: 6, 28: 1, 14: 2, 33: 1}
Did not match all atoms present	41273-53-4	CCO[Si](C)(C)C1CCC2=CC=CC=C12	{1: 3, 2: 1, 11: 2, 12: 1, 14: 4, 22: 1}
Did not match all atoms present	41273-54-5	C[Si](C)(C1CCC2=CC=CC=C12)C3=CC=CC=C3	{1: 2, 11: 2, 12: 1, 14: 9}
Did not match all atoms present	41273-55-6	C[Sn](C)(C)C1CCC2=CC=CC=C12	{1: 3, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	41273-57-8	CCO[Si](C)(C)C1C=CC2=CC=CC=C12	{1: 3, 2: 1, 12: 1, 22: 1, 14: 6}
Did not match all atoms present	4128-71-6	CC(=O)NC1=CC=C(C=C1)N=NC2=CC=CC=C2	{24: 1, 1: 1, 34: 2, 14: 9, 31: 1}
Did not match all atoms present	4128-73-8	C1=CC(=CC=C1N=C=O)OC2=CC=C(C=C2)N=C=O	{8: 2, 34: 2, 22: 1, 14: 8, 29: 2}
Did not match all atoms present	41287-56-3	C1=CC(=NC=C1Br)OCCCCCCNCCS.Cl	{2: 8, 35: 1, 39: 1, 14: 3, 17: 1, 18: 1, 22: 1, 31: 1}
Did not match all atoms present	41287-72-3	C1CSCN1CCOC2=NC=C(C=C2)Br.Cl	{33: 1, 2: 2, 35: 1, 41: 1, 11: 3, 14: 3, 17: 1, 18: 1, 22: 1}
Did not match all atoms present	41288-00-0	CC1=CN=C(C=C1)OCCCCCCN2CCSC2.Cl.Cl	{1: 1, 2: 6, 35: 1, 33: 1, 41: 1, 11: 3, 14: 3, 17: 2, 22: 1}
Did not match all atoms present	41295-98-1	C1=C(C(=CC(=C1Cl)S(=O)(=O)[O-])Cl)N.[Na+]	{17: 2, 30: 1, 29: 3, 14: 2}
Did not match all atoms present	41296-95-1	CCCCOC1=CC=C(C=C1)NC(=O)C[NH+](CC)CC.[Cl-]	{1: 3, 2: 6, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	4130-08-9	CC(=O)O[Si](C=C)(OC(=O)C)OC(=O)C	{1: 3, 28: 3, 5: 1, 6: 1}
Did not match all atoms present	4130-35-2	CCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCCCC)C(=O)OCCCCCCCCCC	{1: 3, 2: 27, 28: 3, 14: 3}
Did not match all atoms present	4130-42-1	CCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 7, 2: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	41309-43-7	C[Si](C)(C)C=CBr	{1: 3, 18: 1, 6: 2}
Did not match all atoms present	4131-47-9	C[Ge](C)(C)C#CC1=CC=CC=C1	{1: 3, 10: 2, 14: 5}
Did not match all atoms present	41311-17-5	CC1(C(=[N+](C2=CC=CC=C12)C)/C=C/NC3=C(C=C(C=C3)OC)OC)C.CC1(C(=[N+](C2=CC=CC=C12)C)/C=C/NC3=C(C=C(C=C3)OC)OC)C.[O-]S(=O)(=O)[O-]	{1: 10, 6: 4, 33: 2, 13: 2, 14: 14, 15: 2, 22: 4, 29: 4, 31: 2}
Did not match all atoms present	41312-86-1	C1=CC=C(C=C1)OCCOC2=C(C3=C(C(=C2Cl)N)C(=O)C4=CC=CC=C4C3=O)N	{2: 2, 14: 9, 17: 1, 22: 2, 25: 2, 30: 2}
Did not match all atoms present	41313-77-3	CC(=O)OCCN(CCOC(=O)C)C1=CC=C(C=C1)C=O	{1: 2, 2: 4, 33: 1, 14: 4, 26: 1, 28: 2}
Did not match all atoms present	41314-13-0	CC1=CC(=C(C(=C1)C(C)C)C)C	{1: 5, 3: 1, 14: 2}
Did not match all atoms present	41315-87-1	COC(=O)C1=CC=C(C=C1)C(=O)OC.C(CCCCC(=O)O)CCCC(=O)O.C(CO)O	{1: 2, 2: 10, 14: 4, 20: 2, 27: 2, 28: 2}
Did not match all atoms present	41319-88-4	CCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)NN=C(C#N)C#N)Cl	{1: 1, 2: 17, 37: 2, 7: 1, 34: 1, 14: 3, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	4132-48-3	CC(C)C1=CC=C(C=C1)OC	{1: 3, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	4132-49-4	CC(C)C1=CC=C(C=C1)C(C)(C)C	{1: 5, 3: 1, 4: 1, 14: 4}
Did not match all atoms present	4132-72-3	CC1=CC(=C(C=C1)C)C(C)C	{1: 4, 3: 1, 14: 3}
Did not match all atoms present	4132-77-8	CC1=C(C=C(C=C1)C(C)C)C	{1: 4, 3: 1, 14: 3}
Did not match all atoms present	4132-86-9	CC(C(=O)O)NC(=O)OCC1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	4133-34-0	COC1=CC2=C(CCC(=O)C2)C=C1	{1: 1, 11: 3, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	4133-35-1	C1CC2=C(CC1=O)C=CC(=C2)Br	{25: 1, 18: 1, 11: 3, 14: 3}
Did not match all atoms present	41333-49-7	COC1=CC(=C(C=C1[N+]#N)OC)N2CCOCC2.F[P-](F)(F)(F)(F)F	{1: 2, 34: 1, 33: 1, 11: 4, 14: 2, 16: 6, 22: 2, 23: 1}
Did not match all atoms present	41335-35-7	CCCCCCCCOC1=CC=C(C=C1)N=CC2=CC=C(C=C2)C#N	{1: 1, 34: 1, 37: 1, 6: 1, 2: 7, 14: 8, 22: 1}
Did not match all atoms present	4135-11-9	CC[C@@H](C)CCCCC(=O)N[C@@H](CCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCN)C(=O)N[C@H]1CCNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)CCN)CC2=CC=CC=C2)CC(C)C)CCN)CCN)[C@@H](C)O	{32: 7, 1: 6, 2: 17, 3: 7, 11: 2, 12: 7, 14: 5, 20: 2, 24: 4, 25: 7, 30: 5, 31: 4}
Did not match all atoms present	4135-93-7	CC1=NN(N=N1)C	{1: 2, 35: 3, 33: 1}
Did not match all atoms present	4136-26-9	CC1(CC(=O)C2=CC(=C(C=C21)OC)OC)C	{1: 4, 11: 1, 13: 1, 14: 2, 22: 2, 25: 1}
Did not match all atoms present	4136-95-2	C1=C(C=C(C(=C1Cl)C(=O)Cl)Cl)Cl	{24: 1, 17: 4, 14: 2}
Did not match all atoms present	41363-16-0	C1=C(C=C(C(=C1Cl)C2=C(C=C(C=C2Cl)O)Cl)Cl)O	{17: 4, 21: 2, 14: 4}
Did not match all atoms present	41363-50-2	CC(C1=CC=C(C=C1)C2=CC=CC=C2)C(=O)OCCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 3, 3: 1, 14: 9, 28: 1, 29: 3}
Did not match all atoms present	41366-44-3	C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CCO)CO.C(COCCO)O	{2: 13, 8: 2, 11: 5, 34: 2, 14: 8, 20: 4, 22: 1, 27: 2, 28: 1, 29: 2}
Did not match all atoms present	41366-45-4	C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 9, 8: 2, 11: 5, 34: 2, 14: 8, 20: 2, 27: 2, 28: 1, 29: 2}
Did not match all atoms present	41372-08-1	C[C@](CC1=CC(=C(C=C1)O)O)(C(=O)O)N.C[C@](CC1=CC(=C(C=C1)O)O)(C(=O)O)N.O.O.O	{1: 2, 2: 2, 4: 2, 14: 6, 21: 4, 27: 2, 30: 2}
Did not match all atoms present	41376-33-4	CC(CO)O.CC(=C)C(=O)OC.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1, 14: 6, 20: 2, 28: 5}
Did not match all atoms present	41378-27-2	CCNC1=CC=CC(=C1)NC(=O)C	{24: 1, 1: 2, 2: 1, 14: 4, 31: 2}
Did not match all atoms present	41378-30-7	CC1=CC=CC=C1N2CCCC2	{1: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	41378-51-2	CCN(CCOC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 3, 22: 1, 14: 10, 33: 1}
Did not match all atoms present	41382-35-8	C1=CC=C(C(=C1)N)SC2=C3C=CC=C4C3=C(C=C2)C(=O)OC4=O	{40: 1, 28: 2, 30: 1, 14: 9}
Did not match all atoms present	41382-37-0	CCNC1=C(C=C2C(=C1)OC3=CC(=C(C=C3C24C5=CC=CC=C5C(=O)O4)C)NCC)C	{1: 4, 2: 2, 13: 1, 14: 8, 23: 1, 28: 1, 31: 2}
Did not match all atoms present	41383-01-1	CCN1C(=O)C(=CNC2=CC=CC=C2)C(=O)N(C1=S)CC	{1: 2, 2: 2, 6: 1, 33: 2, 14: 5, 15: 2, 25: 2, 31: 1}
Did not match all atoms present	41385-07-3	CC1CO1.COC(=O)C1=CC=C(C=C1)C(=O)OC.C1CO1.C(CN)N	{1: 3, 2: 2, 11: 3, 12: 1, 14: 4, 23: 2, 28: 2, 30: 2}
Did not match all atoms present	4139-78-0	CC(C)C1=CC=C(C=C1)N(C)C	{1: 4, 3: 1, 14: 4, 33: 1}
Did not match all atoms present	41391-49-5	CCP(=S)=S	{1: 1, 2: 1}
Did not match all atoms present	41394-05-2	CC1=NN=C(C(=O)N1N)C2=CC=CC=C2	{1: 1, 35: 2, 33: 1, 14: 5, 25: 1, 30: 1}
Did not match all atoms present	4140-72-1	CC(=O)NC1=C(C=C(C2=NNN=C12)F)F	{32: 1, 1: 1, 35: 2, 14: 1, 16: 2, 24: 1, 31: 1}
Did not match all atoms present	4140-83-4	C1=CC(=C(C=C1Cl)N)S(=O)(=O)N	{17: 1, 30: 2, 29: 2, 14: 3}
Did not match all atoms present	4141-08-6	CNC(=O)C1=CC=CC=C1N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	4141-19-9	C1C(COC(O1)C2=CC=CC=C2)O	{20: 1, 11: 2, 12: 2, 14: 5, 23: 2}
Did not match all atoms present	4141-48-4	C=CCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2	{2: 1, 14: 10, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	4141-67-7	CCP1P(P(P(P1CC)CC)CC)CC	{1: 5, 2: 5}
Did not match all atoms present	4142-74-9	CCCCCCCCCC1=C(C(=CC(=C1)C)CSCCOCCSCC2=CC(=CC(=C2O)CCCCCCCCC)C)O	{1: 4, 2: 22, 40: 2, 14: 4, 21: 2, 22: 1}
Did not match all atoms present	4142-85-2	C([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl	{17: 6, 2: 1}
Did not match all atoms present	41422-89-3	B1(N(C=CN1C)C)C2=CC=CC=C2	{1: 2, 14: 7, 33: 2}
Did not match all atoms present	41424-11-7	CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 5, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	41426-06-6	CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)/C=C(/C)\Cl.[Cl-]	{1: 2, 2: 1, 33: 1, 6: 1, 7: 1, 41: 1, 14: 6, 17: 2}
Did not match all atoms present	41426-11-3	CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)SCC.CCOS(=O)(=O)[O-]	{1: 3, 2: 3, 33: 1, 40: 1, 41: 1, 14: 6, 22: 1, 29: 3}
Did not match all atoms present	41426-37-3	CC(C)OC1=CC=C(C2=CC=CC=C21)O	{1: 2, 22: 1, 3: 1, 21: 1, 14: 6}
Did not match all atoms present	41427-13-8	C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)N)S(=O)(=O)[O-].[Na+]	{30: 1, 14: 8, 6: 2, 29: 3}
Did not match all atoms present	41427-34-3	C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)N)C#N	{30: 1, 14: 8, 6: 2, 37: 1}
Did not match all atoms present	4143-72-0	COC1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2O	{1: 1, 2: 1, 14: 8, 21: 1, 22: 1, 24: 2}
Did not match all atoms present	4143-74-2	COC1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2	{1: 1, 25: 1, 22: 1, 14: 9, 23: 1}
Did not match all atoms present	41432-19-3	C=O.C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N.OS(=O)(=O)[O-]	{34: 1, 5: 1, 14: 9, 20: 1, 29: 3, 31: 1}
Did not match all atoms present	41434-28-0	CC1(C(=O)NC(=S)S1)C	{32: 1, 1: 2, 41: 1, 13: 1, 15: 1, 25: 1}
Did not match all atoms present	41443-28-1	C1=CC=C2C(=C1)N=CC3=NOC(=O)N23	{33: 1, 35: 2, 28: 1, 14: 5}
Did not match all atoms present	41444-33-1	CC(=O)CSC1=CC=CS1	{1: 1, 2: 1, 40: 1, 41: 1, 14: 3, 24: 1}
Did not match all atoms present	41450-77-5	C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2CCC#N)C=O	{33: 1, 2: 2, 26: 1, 14: 9, 37: 1}
Did not match all atoms present	41450-85-5	CC1(C(=C)N(C2=C1C=CC=N2)C)C	{1: 3, 35: 1, 5: 1, 33: 1, 13: 1, 14: 3, 15: 1}
Did not match all atoms present	41450-96-8	CCCCC(CC)CC1=CC(=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)O	{1: 2, 2: 5, 3: 1, 14: 5, 21: 2, 25: 2}
Did not match all atoms present	41453-50-3	C1=CC(=C(C=C1O)[O-])C(=O)O.C1=CC(=C(C=C1O)[O-])C(=O)O.[Pb+2]	{27: 2, 21: 2, 14: 6}
Did not match all atoms present	41458-65-5	CC1=CC(=C(C(=C1)N)O)C	{1: 2, 30: 1, 21: 1, 14: 2}
Did not match all atoms present	4146-24-1	CC1=NC2=C(S1)C=C(C=C2)Cl	{1: 1, 35: 1, 41: 1, 14: 3, 17: 1}
Did not match all atoms present	41463-67-6	C1=CC=C(C=C1)N2C(=NN=N2)N=NC3=NN=NN3C4=CC=CC=C4	{33: 2, 34: 2, 35: 6, 14: 10}
Did not match all atoms present	41463-68-7	CN1C(=NN=N1)N=NC2=NN=NN2C	{1: 2, 34: 2, 35: 6, 33: 2}
Did not match all atoms present	41463-69-8	CN1C(=NN=N1)/N=N\C2=NN=NN2C	{1: 2, 34: 2, 35: 6, 33: 2}
Did not match all atoms present	41464-39-5	C1=CC(=C(C(=C1)Cl)Cl)C2=C(C=CC(=C2)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-40-8	C1=CC(=C(C=C1Cl)Cl)C2=C(C=CC(=C2)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-41-9	C1=CC(=C(C(=C1)Cl)C2=C(C=CC(=C2)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-42-0	C1=CC(=C(C=C1Cl)C2=CC(=CC(=C2)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-43-1	C1=CC(=C(C(=C1)Cl)Cl)C2=CC(=C(C=C2)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-46-4	C1=CC(=C(C(=C1)Cl)C2=CC(=C(C=C2)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-47-5	C1=CC(=C(C(=C1)Cl)Cl)C2=C(C=CC=C2Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-48-6	C1=CC(=C(C=C1C2=CC(=CC(=C2)Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-49-7	C1=CC(=C(C(=C1)Cl)Cl)C2=CC(=CC(=C2)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	41464-51-1	C1=CC(=C(C(=C1)Cl)Cl)C2=CC(=C(C=C2Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	4147-05-1	CC12CCC3C(C1CC[C@@H]2O)CCC4=CC(=CC(=C34)O)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 2, 20: 1, 21: 2}
Did not match all atoms present	4147-51-7	CCSC1=NC(=NC(=N1)NC(C)C)NC(C)C	{1: 5, 2: 1, 3: 2, 40: 1, 35: 3, 31: 2}
Did not match all atoms present	4147-89-1	C[Si](C)(C)N(C1=CC=CC=C1)[Si](C)(C)C	{1: 6, 14: 5, 33: 1}
Did not match all atoms present	41476-39-5	C1C(O1)CCl.C1=CC(=CC=C1C(=O)O)O	{2: 1, 11: 1, 12: 1, 14: 4, 17: 1, 21: 1, 23: 1, 27: 1}
Did not match all atoms present	4148-16-7	CS(=O)(=O)OCCNCC(C(CNCCOS(=O)(=O)C)O)O	{1: 2, 2: 6, 3: 2, 20: 2, 22: 2, 29: 4, 31: 2}
Did not match all atoms present	41480-04-0	C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]	{38: 1, 22: 1, 14: 9, 29: 2}
Did not match all atoms present	41481-66-7	C=CCC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)O)CC=C)O	{2: 2, 5: 2, 6: 2, 14: 6, 21: 2, 29: 2}
Did not match all atoms present	41483-43-6	CCCCC1=C(N=C(N=C1OS(=O)(=O)N(C)C)NCC)C	{1: 5, 2: 4, 35: 2, 33: 1, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	4149-06-8	C1C(=NN(C1=O)C2=CC=CC=C2)N	{33: 1, 35: 1, 11: 1, 14: 5, 15: 1, 25: 1, 30: 1}
Did not match all atoms present	4149-60-4	C(=O)(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-].[NH4+]	{16: 17, 24: 1, 4: 8}
Did not match all atoms present	41492-05-1	CCCCC1=CC=C(C=C1)Br	{1: 1, 2: 3, 18: 1, 14: 4}
Did not match all atoms present	41494-34-2	CCN(CC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC.[F-].[F-].[F-].[F-].[F-].[F-].[Sb]	{16: 6, 1: 6, 2: 6, 14: 12, 33: 4}
Did not match all atoms present	41494-35-3	CCCCN(CCCC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CCCC)CCCC)C3=CC=C(C=C3)N(CCCC)CCCC.[F-].[F-].[F-].[F-].[F-].[F-].[Sb]	{16: 6, 1: 6, 2: 18, 14: 12, 33: 4}
Did not match all atoms present	41494-71-7	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=CC(=C2)C.[Na+]	{1: 2, 2: 2, 29: 3, 14: 8, 33: 1}
Did not match all atoms present	41498-71-9	C1CC2CC1CC2OC=O	{26: 1, 11: 4, 12: 3}
Did not match all atoms present	4150-37-2	CCC1=CC=C(C=C1)N(C)C	{1: 3, 2: 1, 14: 4, 33: 1}
Did not match all atoms present	41503-32-6	CCN1C2=C3C(=C(C=C2)Br)C=CC=C3C1=O	{1: 1, 2: 1, 33: 1, 14: 5, 18: 1, 25: 1}
Did not match all atoms present	41503-58-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C2=CC=CC=C2OC1=CC=CC3=[N+](C4=CC=CC=C4O3)C	{1: 3, 6: 3, 33: 2, 14: 12, 15: 1, 23: 2, 29: 3}
Did not match all atoms present	41503-61-1	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CC)C=C4N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CC.CCOS(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 6: 2, 7: 1, 14: 16, 15: 1, 22: 1, 23: 2, 29: 3}
Did not match all atoms present	41504-19-2	CN1C2=CC=CC=C2SC1=C3C(=O)N(C(=S)S3)CC(=O)O	{1: 1, 2: 1, 33: 2, 41: 2, 14: 4, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	41504-42-1	CCN1C2=CC=CC=C2OC1=CC=C3C(=O)N(C(=S)N3C)CC=C	{1: 2, 2: 2, 5: 1, 6: 3, 33: 3, 14: 4, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	41506-62-1	CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O	{24: 2, 1: 1, 21: 1, 14: 10, 31: 2}
Did not match all atoms present	4151-25-1	C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)OCCCCOP(=O)(C3=CC=CC=C3)C4=CC=CC=C4	{2: 4, 22: 2, 14: 20, 29: 2}
Did not match all atoms present	4151-33-1	CC(=O)C(=O)[O-].[K+]	{24: 2, 1: 1}
Did not match all atoms present	4151-34-2	C(=C\C(=O)[O-])\C(=O)[O-].[K+].[K+]	{24: 2, 6: 2}
Did not match all atoms present	4151-50-2	CCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 1, 4: 8, 16: 17, 29: 2, 31: 1}
Did not match all atoms present	4151-60-4	CC(C)C1=CC(=C(C=C1)C(C)(C)C)O	{1: 5, 3: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	41510-23-0	C1CN2CC3=C(CC2CN1CCCC(=O)C4=CC=C(C=C4)F)C5=CC=CC=C5N3	{32: 1, 33: 2, 2: 3, 11: 5, 12: 1, 14: 8, 16: 1, 24: 1}
Did not match all atoms present	41512-62-3	CN(C)C1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F	{1: 2, 4: 1, 38: 1, 33: 1, 14: 3, 16: 3}
Did not match all atoms present	41513-04-6	C1=CC(=C(C=C1Cl)[N+](=O)[O-])Br	{17: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	41515-04-2	CN(C)C(=S)[S+](CCCS(=O)(=O)[O-])C(=S)N(C)C	{1: 4, 2: 3, 33: 2, 29: 3, 7: 2}
Did not match all atoms present	4152-09-4	C1=CC=C(C=C1)CNCCN	{2: 3, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	4152-90-3	C1=CC(=CC(=C1)Cl)CN	{17: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	41526-42-5	C1=CC=C2C(=C1)N(C(=S)S2)CCl	{17: 1, 2: 1, 41: 1, 14: 4, 33: 1}
Did not match all atoms present	41529-32-2	CC(=C)C(=O)OC.C=CC1=CC=CC=C1.C=CC(=O)OCCO	{1: 2, 2: 2, 5: 3, 6: 2, 7: 1, 14: 5, 20: 1, 28: 2}
Did not match all atoms present	41529-43-5	CC(=C)C(=O)OC.C=CC=C.C=CC1=CC=CC=C1.C1=CC(=O)OC1=O	{1: 2, 5: 4, 6: 3, 7: 1, 14: 7, 28: 3}
Did not match all atoms present	41532-81-4	COCCOC1=CC=CC=C1	{1: 1, 2: 2, 22: 2, 14: 5}
Did not match all atoms present	41532-84-7	CC1=NC2=C(C1(C)C)C3=CC=CC=C3C=C2	{1: 3, 35: 1, 13: 1, 14: 6, 15: 1}
Did not match all atoms present	41536-18-9	C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl[Fe]Cl	{17: 2, 2: 2, 14: 20}
Did not match all atoms present	41538-78-7	C1=C(C(=CC(=C1Cl)S(=O)(=O)NCCS(=O)(=O)O)Cl)N	{2: 2, 14: 2, 17: 2, 20: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	4154-63-6	COC1=CC(=C(C=C1)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 14: 13, 15: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	41541-13-3	CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 4, 38: 2, 33: 1, 34: 2, 14: 6, 20: 2}
Did not match all atoms present	41542-50-1	CCN(CC)CCS/C(=N\O)/C1=CC=C(C=C1)Br.Cl	{1: 2, 2: 4, 33: 1, 7: 1, 40: 1, 34: 1, 14: 4, 17: 1, 18: 1, 20: 1}
Did not match all atoms present	41554-11-4	CCN(CC)C1=CC(=C(C=C1)C(C2=CC(=C(C=C2)N)OC)NC(=O)N)C	{1: 4, 2: 2, 3: 1, 33: 1, 14: 6, 22: 1, 24: 1, 30: 2, 31: 1}
Did not match all atoms present	4156-16-5	CC[N+]1=CC=C(O1)C2=CC(=CC=C2)S(=O)(=O)[O-]	{1: 1, 2: 1, 33: 1, 14: 6, 23: 1, 29: 3}
Did not match all atoms present	41563-69-3	C1=CC(=CC(=C1)CS)CS	{2: 2, 14: 4, 39: 2}
Did not match all atoms present	4157-77-1	CCCCOC(C)C1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	41570-56-3	CCOC1=CC(=C(C=C1)NC2=CC=CC=C2)C	{1: 2, 2: 1, 22: 1, 14: 8, 31: 1}
Did not match all atoms present	41572-20-7	CCCCCCCC[N+](C)(CCO)CCO.[Cl-]	{1: 2, 2: 11, 20: 2, 17: 1}
Did not match all atoms present	41572-59-2	CC[NH+](CC)CCN1C2=CC(=C(C=C2N=C3C1=NC(=O)NC3=O)Cl)Cl.[Cl-]	{32: 1, 1: 2, 2: 4, 35: 2, 33: 1, 14: 2, 17: 3, 25: 2}
Did not match all atoms present	41573-36-8	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=CC=C3Cl	{1: 4, 3: 1, 33: 2, 14: 12, 17: 1}
Did not match all atoms present	41575-93-3	CCC(C(=O)[O-])C(=O)[O-].N.N.[Pt+2]	{24: 2, 1: 1, 2: 1, 3: 1}
Did not match all atoms present	41575-94-4	C1CC(C1)(C(=O)O)C(=O)O.[Pt]	{27: 2, 11: 3, 13: 1}
Did not match all atoms present	41585-11-9	CCCCC(CC)COC(=O)C=C.CC(=C)C(=O)OC.C=CC=C.C=CC#N.C=CC1=CC=CC=C1	{1: 4, 2: 5, 3: 1, 5: 6, 6: 5, 7: 1, 14: 5, 28: 2, 37: 1}
Did not match all atoms present	41587-84-2	C(C(=O)[O-])O.C(C(=O)[O-])O.[Ni+2]	{24: 2, 2: 2, 20: 2}
Did not match all atoms present	4159-77-7	C1=C2C(=C(C(=C1I)O)I)OC3=C(C(=C(C=C3C24C5=C(C(=C(C(=C5Cl)Cl)Cl)Cl)C(=O)O4)I)O)I	{13: 1, 14: 2, 17: 4, 19: 4, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	41591-87-1	CCCCCCCCCCCCCC[N+](C)(C)CCC[Si](OC)(OC)OC.[Cl-]	{1: 6, 2: 16, 22: 3, 17: 1}
Did not match all atoms present	41593-58-2	[B].C1=CC=C(C=C1)PC2=CC=CC=C2	{14: 10}
Did not match all atoms present	41595-29-3	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C	{1: 2, 29: 4, 14: 12, 31: 2}
Did not match all atoms present	41597-55-1	C1C(C(CC2=CC=CC=C21)O)O	{20: 2, 11: 2, 12: 2, 14: 4}
Did not match all atoms present	4160-51-4	CCCC(=O)C1=CC=C(C=C1)OC	{24: 1, 1: 2, 2: 2, 22: 1, 14: 4}
Did not match all atoms present	4160-52-5	CCCC(=O)C1=CC=C(C=C1)C	{24: 1, 1: 2, 2: 2, 14: 4}
Did not match all atoms present	4160-63-8	COC1=CC=C(C=C1)C(=O)C2=CC=CS2	{24: 1, 1: 1, 22: 1, 14: 7, 41: 1}
Did not match all atoms present	4160-72-9	CC1=CN(C(=O)NC1=O)C	{32: 1, 1: 2, 33: 1, 14: 1, 25: 2}
Did not match all atoms present	4160-77-4	CC1=CNC(=O)N(C1=O)C	{32: 1, 1: 2, 33: 1, 14: 1, 25: 2}
Did not match all atoms present	4160-80-9	C1C(CC(=O)OC1=O)C2=CC=CC=C2	{28: 2, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	41604-19-7	C1=CC=C(C=C1)C2=C(C=C(C=C2)Br)F	{16: 1, 18: 1, 14: 8}
Did not match all atoms present	41605-93-0	CNC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)N)N/N=C/3\C=CC(=CC3=O)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 14: 8, 15: 2, 25: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	41606-65-9	C1=C(C(=CC(=C1Cl)S(=O)(=O)N)O)N	{17: 1, 30: 2, 21: 1, 14: 2, 29: 2}
Did not match all atoms present	41611-98-7	COC1=CC2=CC(=C(C=C2C=C1)O)C(=O)NC3=CC=CC=C3	{1: 1, 14: 10, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	41614-16-8	C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]	{24: 1, 17: 1, 38: 1, 14: 8, 31: 1}
Did not match all atoms present	41618-72-8	[Bi+3].[OH-]	{}
Did not match all atoms present	4162-45-2	CC(C)(C1=CC(=C(C(=C1)Br)OCCO)Br)C2=CC(=C(C(=C2)Br)OCCO)Br	{1: 2, 2: 4, 4: 1, 14: 4, 18: 4, 20: 2, 22: 2}
Did not match all atoms present	41621-49-2	CC1=CC(=O)N(C(=C1)C2CCCCC2)O.C(CO)N	{1: 1, 2: 2, 33: 1, 11: 5, 12: 1, 14: 2, 20: 1, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	41622-04-2	CC(=O)NC1=C(C=CC(=C1)N(CCOC)CCOC)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])Br	{1: 3, 2: 4, 37: 1, 38: 1, 33: 1, 34: 2, 14: 5, 18: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	4163-15-9	C1CC[C@@]23CCN([C@@H]([C@@H]2C1)CC4=C3C=C(C=C4)O)CC5CC5	{33: 1, 2: 1, 11: 9, 12: 3, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	4163-78-4	CSC1=CC(=C(C=C1Cl)Cl)Cl	{40: 1, 1: 1, 14: 2, 17: 3}
Did not match all atoms present	41636-35-5	CCC1=C(C2CC3=C(C(=C([N-]3)CC4C(=C(C(N4)CC5=C(C(=C([N-]5)CC1N2)CC)CC)CC)CC)CC)CC)CC.[C-]#[O+].[Ru+2]	{32: 2, 1: 8, 2: 8, 35: 2, 11: 4, 12: 4, 15: 4, 29: 1}
Did not match all atoms present	41637-86-9	CCC1=CC=CC2=CC3=CC=CC=C3C=C21	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	4164-06-1	CCN(CC)C1=CC=C(C=C1)[As]=O	{1: 2, 2: 2, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	4164-07-2	C1=CC(=CC=C1N(CCCl)CCCl)[As]=O	{17: 2, 2: 4, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	4164-43-6	C1=CC(=CC(=C1)[N+](=O)[O-])CC2=CC(=CC=C2)[N+](=O)[O-]	{2: 1, 38: 2, 14: 8}
Did not match all atoms present	41642-52-8	CC1=CC(=C(C(=C1CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C)CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C	{1: 15, 2: 2, 4: 4, 21: 2, 14: 5}
Did not match all atoms present	41642-95-9	C1=CC(=C(C=C1NC2=NC(=NC(=N2)Cl)Cl)N)S(=O)(=O)[O-].[Na+]	{35: 3, 14: 3, 17: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	41643-22-5	CCCCCCCCCCCCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)Cl	{1: 1, 2: 14, 35: 1, 7: 1, 40: 2, 34: 1, 14: 8, 17: 1}
Did not match all atoms present	41643-23-6	CCCCCCCCCCCCCCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)Cl	{1: 1, 2: 16, 35: 1, 7: 1, 40: 2, 34: 1, 14: 8, 17: 1}
Did not match all atoms present	41643-24-7	CCCCCCCCCCCCCCCCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)Cl	{1: 1, 2: 18, 35: 1, 7: 1, 40: 2, 34: 1, 14: 8, 17: 1}
Did not match all atoms present	4165-60-0	[2H]C1=C(C(=C(C(=C1[2H])[2H])[N+](=O)[O-])[2H])[2H]	{38: 1, 14: 5}
Did not match all atoms present	4165-61-1	[2H]C1=C(C(=C(C(=C1[2H])[2H])N)[2H])[2H]	{30: 1, 14: 5}
Did not match all atoms present	4165-96-2	C1=CC=C(C=C1)C(CC(=O)O)CC(=O)O	{27: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	41650-26-4	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ru+]	{}
Did not match all atoms present	4166-00-1	C1CC(=S)NC1=O	{32: 1, 25: 1, 11: 2, 15: 1}
Did not match all atoms present	4166-09-0	C1CC(=S)N(C1=O)C2=CC=CC=C2	{25: 1, 11: 2, 33: 1, 14: 5, 15: 1}
Did not match all atoms present	41663-73-4	C1=C(SC(=N1)N)Cl	{17: 1, 35: 1, 30: 1, 14: 1, 41: 1}
Did not match all atoms present	41663-84-7	CN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]	{1: 1, 38: 1, 33: 1, 14: 3, 25: 2}
Did not match all atoms present	4167-75-3	CC(C)CC1=CC=CC=C1O	{1: 2, 2: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	41672-54-2	CC[N+]1=C(OC2=C1C=CC3=CC=CC=C32)C=CN(C4=CC=CC=C4)C(=O)C.[I-]	{1: 2, 2: 1, 6: 2, 33: 2, 14: 11, 19: 1, 23: 1, 24: 1}
Did not match all atoms present	41680-34-6	C1=NNC(=C1C(=O)O)N	{32: 1, 35: 1, 27: 1, 30: 1, 14: 1}
Did not match all atoms present	41680-75-5	COC1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=C(C=C3)OC)C(=O)O	{1: 2, 27: 2, 22: 2, 14: 10, 31: 2}
Did not match all atoms present	41680-76-6	C1=CC(=CC=C1NC2=CC(=C(C=C2C(=O)O)NC3=CC=C(C=C3)Cl)C(=O)O)Cl	{17: 2, 27: 2, 14: 10, 31: 2}
Did not match all atoms present	41682-04-6	CC[N+]1=C(SCC1)C=CN(C2=CC=CC=C2)C(=O)C.[I-]	{1: 2, 2: 1, 6: 2, 33: 2, 41: 1, 11: 2, 14: 5, 15: 1, 19: 1, 24: 1}
Did not match all atoms present	41682-73-9	CCCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N	{1: 1, 34: 1, 37: 1, 6: 1, 2: 7, 14: 8, 22: 1}
Did not match all atoms present	41682-84-2	CC(C)(CO)C(=O)NNC1=CC=CC=C1	{1: 2, 2: 1, 4: 1, 14: 5, 20: 1, 24: 1, 31: 2}
Did not match all atoms present	41687-30-3	C1=CC(=CC(=C1)S(=O)(=O)CCO)[N+](=O)[O-]	{2: 2, 38: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	4169-04-4	CC(CO)OC1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	41699-00-7	CC1=CC(=C(C(=C1)C2CCC3C2C4CC3C(C4)C5=CC(=CC(=C5O)C(C)(C)C)C)O)C(C)(C)C	{1: 8, 4: 2, 11: 4, 12: 6, 14: 4, 21: 2}
Did not match all atoms present	41699-09-6	CC1=C2C=CC3=C4C2=C5C(=C1)C=CC6=C5C(=CC=C6)C4=CC=C3	{1: 1, 14: 11}
Did not match all atoms present	4170-07-4	CCC(CC)(CC)C1=CC=CC=C1	{1: 3, 2: 3, 4: 1, 14: 5}
Did not match all atoms present	4170-46-1	CC(C)[Si](Cl)(Cl)Cl	{1: 2, 3: 1, 17: 3}
Did not match all atoms present	4170-50-7	C(C([Si](Cl)(Cl)Cl)Br)Br	{17: 3, 2: 1, 3: 1, 18: 2}
Did not match all atoms present	4170-71-2	CC(C)(C)S(=O)C1=CC=CC=C1	{1: 3, 4: 1, 29: 1, 14: 5}
Did not match all atoms present	4170-72-3	CC(C)(C)S(=O)(=O)C1=CC=CC=C1	{1: 3, 4: 1, 29: 2, 14: 5}
Did not match all atoms present	4170-80-3	CCS(=O)C1=CC=CC=C1	{1: 1, 2: 1, 29: 1, 14: 5}
Did not match all atoms present	4170-90-5	CC1=CC(=C(C(=C1)C)CO)C	{1: 3, 2: 1, 20: 1, 14: 2}
Did not match all atoms present	41701-84-2	CC1=CC=C(C=C1)O.CC1=CC(=CC=C1)O.CC1=CC=CC=C1O.C=O.C1=CC=C(C=C1)O	{1: 3, 5: 1, 14: 17, 21: 4}
Did not match all atoms present	41706-15-4	CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C/C(=O)C(C)(C)C)/O)(C)C.[Nb]	{1: 24, 4: 8, 6: 4, 7: 4, 20: 4, 24: 4}
Did not match all atoms present	41708-72-9	CC1=C(C(=CC=C1)C)NC(=O)C(C)N	{1: 3, 3: 1, 14: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	41708-76-3	C[C@@H]([C@](C(C)C)(C(=O)OCC1=CC[N+]2([C@H]1[C@@H](CC2)O)[O-])O)O	{1: 3, 2: 1, 3: 2, 4: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 3, 28: 1, 29: 1}
Did not match all atoms present	41709-76-6	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=C(C=C(C=C4)C5=CC(=C(C=C5)NN=C6C7=CC=CC=C7C=C(C6=O)C(=O)NC8=CC=CC=C8)Cl)Cl)C2=O	{34: 2, 14: 26, 15: 4, 17: 2, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	4171-11-3	C1=CC=C(C=C1)C2(C(=O)NC(=O)O2)C3=CC=CC=C3	{32: 1, 25: 1, 28: 1, 13: 1, 14: 10}
Did not match all atoms present	4171-83-9	C1=CC=C(C=C1)SC2=CC=CC=C2[N+](=O)[O-]	{40: 1, 38: 1, 14: 9}
Did not match all atoms present	41710-89-8	CCCCCCCCCCCCCCOC1=CC=CC=C1N	{1: 1, 2: 13, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	41715-24-6	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2OCC3(CO2)COC(OC3)C4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C	{1: 12, 4: 4, 11: 4, 12: 2, 13: 1, 14: 4, 21: 2, 23: 4}
Did not match all atoms present	41717-60-6	CCC(C(=O)Cl)OC1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	4172-91-2	CN=C=NC1=CC=CC=C1	{8: 1, 1: 1, 34: 2, 14: 5}
Did not match all atoms present	41727-47-3	COC(=O)C1=CC(=C(C(=C1)Br)O)Br	{1: 1, 18: 2, 28: 1, 21: 1, 14: 2}
Did not match all atoms present	41729-43-5	CC[N+]1=C(OC2=C1C=C(C(=C2)C)C)C=CN(C3=CC=CC=C3)C(=O)C.[I-]	{1: 4, 2: 1, 6: 2, 33: 2, 14: 7, 19: 1, 23: 1, 24: 1}
Did not match all atoms present	4173-44-8	CC(=O)C=CC=CC1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 6: 4}
Did not match all atoms present	4173-73-3	CC1=NN(C(=O)C1=CNC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 35: 1, 6: 1, 33: 1, 14: 10, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	41735-28-8	CN(C1=NNC(=N1)C2=CC=C(O2)[N+](=O)[O-])N=O	{32: 1, 1: 1, 34: 1, 35: 2, 38: 1, 33: 1, 14: 2, 23: 1, 29: 1}
Did not match all atoms present	41735-29-9	CCN(C1=NNC(=N1)C2=CC=C(O2)[N+](=O)[O-])N=O	{32: 1, 1: 1, 2: 1, 35: 2, 38: 1, 33: 1, 34: 1, 14: 2, 23: 1, 29: 1}
Did not match all atoms present	41735-30-2	CCN(C1=NNC(=N1)C2=CC=C(O2)[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 1: 1, 2: 1, 35: 2, 38: 2, 33: 1, 14: 2, 23: 1}
Did not match all atoms present	41737-77-3	CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)/C=C/NC4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 2, 2: 1, 6: 2, 33: 1, 41: 1, 14: 15, 29: 3, 31: 1}
Did not match all atoms present	41749-18-2	[B-](F)(F)(F)F.CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C	{1: 3, 2: 2, 40: 1, 34: 1, 14: 6, 16: 4, 22: 2}
Did not match all atoms present	4175-38-6	C1CCC(CC1)NC2=CC=C(C=C2)NC3CCCCC3	{11: 10, 12: 2, 14: 4, 31: 2}
Did not match all atoms present	4175-53-5	CC1CC(C2=CC=CC=C12)C	{1: 2, 11: 1, 12: 2, 14: 4}
Did not match all atoms present	4175-54-6	CC1CCC(C2=CC=CC=C12)C	{1: 2, 11: 2, 12: 2, 14: 4}
Did not match all atoms present	4175-66-0	CC1=CN=C(S1)C	{1: 2, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	41755-60-6	CCCCCCCCCCCCCCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 15, 28: 1, 14: 5}
Did not match all atoms present	4176-53-8	C1=CC=C2C(=C1)C=CC3=C2C=CC=C3N	{30: 1, 14: 9}
Did not match all atoms present	41760-84-3	CCOP(=O)(C(=O)OC)OCC	{1: 3, 2: 2, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	41761-00-6	COP(=O)(C1=CC=CC=C1)Cl	{1: 1, 29: 1, 22: 1, 14: 5, 17: 1}
Did not match all atoms present	4177-16-6	C=CC1=NC=CN=C1	{14: 3, 35: 2, 5: 1, 6: 1}
Did not match all atoms present	4177-31-5	CN1C2=CC=CC=C2NC3=C(C=C(C=C31)[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 1: 1, 38: 2, 14: 6, 33: 1}
Did not match all atoms present	41772-23-0	C1=CC=C2C(=C1)C=CC(=C2O)N.Cl	{17: 1, 30: 1, 21: 1, 14: 6}
Did not match all atoms present	4178-93-2	CC(C)CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N	{1: 2, 2: 1, 3: 2, 38: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	4179-19-5	CC1=CC(=CC(=C1)OC)OC	{1: 3, 22: 2, 14: 3}
Did not match all atoms present	4179-38-8	CCCCCCCCC1=CC=CO1	{1: 1, 2: 7, 14: 3, 23: 1}
Did not match all atoms present	4180-23-8	C/C=C/C1=CC=C(C=C1)OC	{1: 2, 22: 1, 14: 4, 6: 2}
Did not match all atoms present	4181-05-9	C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C=O	{33: 1, 26: 1, 14: 14}
Did not match all atoms present	4181-97-9	COC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2	{1: 1, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	41814-78-2	CC1=C2C(=CC=C1)SC3=NN=CN23	{1: 1, 35: 2, 41: 1, 14: 4, 33: 1}
Did not match all atoms present	4182-80-3	CCCCN(CCCC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CCCC)CCCC)C3=CC=C(C=C3)N(C4=CC=C(C=C4)N(CCCC)CCCC)C5=CC=C(C=C5)N(CCCC)CCCC	{1: 8, 2: 24, 14: 20, 33: 6}
Did not match all atoms present	41820-22-8	CCC(=S)OCC=C	{1: 1, 2: 2, 5: 1, 6: 1, 7: 1, 22: 1}
Did not match all atoms present	41821-91-4	CC1CC(OP(O1)OC)C	{1: 3, 11: 1, 12: 2, 22: 1, 23: 2}
Did not match all atoms present	41823-72-7	C[Si](C)(C)C([Si](C)(C)C)[SnH2]C([Si](C)(C)C)[Si](C)(C)C	{1: 12, 3: 2}
Did not match all atoms present	41823-73-8	C[Si](C)(C)C([Si](C)(C)C)[Pb]C([Si](C)(C)C)[Si](C)(C)C	{1: 12, 3: 2}
Did not match all atoms present	41825-28-9	C1=CC=C(C=C1)[Pb](C2=CC=CC=C2)(O[N+](=O)[O-])O[N+](=O)[O-]	{22: 2, 14: 10}
Did not match all atoms present	41825-73-4	CC1=CC(=C(C(=C1)Br)N)C	{1: 2, 18: 1, 30: 1, 14: 2}
Did not match all atoms present	41826-92-0	CCOC1=CC(=C(C=C1C(=O)CCC(=O)O)OCC)OCC	{1: 3, 2: 5, 14: 2, 22: 3, 24: 1, 27: 1}
Did not match all atoms present	41830-80-2	C1=CC=C2C(=C1)C(=[NH2+])C=C3C2=NC4=C(O3)C=C(C=C4)N.[O-]Cl(=O)(=O)=O	{35: 1, 14: 8, 17: 1, 23: 1, 29: 4, 30: 2}
Did not match all atoms present	41830-81-3	CCNC1=CC2=C(C=C1C)N=C3C=C(C(=NCC)C=C3O2)C	{1: 4, 2: 2, 35: 1, 34: 1, 14: 4, 23: 1, 31: 1}
Did not match all atoms present	41831-78-1	F[W](=S)F	{16: 2}
Did not match all atoms present	41831-79-2	F[W](=S)(F)F	{16: 3}
Did not match all atoms present	41831-80-5	F[W](=S)(F)(F)F	{16: 4}
Did not match all atoms present	41831-81-6	F[W](=S)(=S)F	{16: 2}
Did not match all atoms present	41833-13-0	C1=CC(=C(C=C1CO)[N+](=O)[O-])O	{2: 1, 38: 1, 20: 1, 21: 1, 14: 3}
Did not match all atoms present	41836-28-6	C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[Y+3]	{1: 18, 34: 3}
Did not match all atoms present	4184-79-6	CC1=CC2=NNN=C2C=C1C.O	{32: 1, 1: 2, 35: 2, 14: 2}
Did not match all atoms present	4185-47-1	C(CO[N+](=O)[O-])N(CCO[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 2: 4, 38: 1, 22: 2}
Did not match all atoms present	4185-80-2	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)OC)CN(C)C.Cl	{1: 4, 2: 2, 3: 1, 33: 2, 41: 1, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	4186-30-5	CCNC(=O)C1CC1C2=CC=CC=C2	{1: 1, 2: 1, 11: 1, 12: 2, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	4186-64-5	CC[N+](CC)(CC)CC=C.[I-]	{1: 3, 2: 4, 19: 1, 5: 1, 6: 1}
Did not match all atoms present	4186-67-8	CCC[N+](CC)(CC)CC.[I-]	{1: 4, 2: 5, 19: 1}
Did not match all atoms present	4187-38-6	CC1=CC=C(C=C1)[C@@H](C)N	{1: 2, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	4187-57-9	C[C@@H](CCC1=CC=CC=C1)N	{1: 1, 2: 2, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	4187-71-7	C(/C=C(/CO)\S(=O)(=O)[O-])O.[Na+]	{2: 2, 20: 2, 29: 3, 6: 1, 7: 1}
Did not match all atoms present	4187-87-5	C#CC(C1=CC=CC=C1)O	{9: 1, 10: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	41873-65-8	CCOC(=O)CC1=CC=CC=C1O	{1: 1, 2: 2, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	41879-39-4	CC(C)(C)[Si](C)(C)ON	{1: 5, 4: 1, 30: 1, 22: 1}
Did not match all atoms present	41880-36-8	[2H]C([2H])([2H])SCC	{40: 1, 1: 2, 2: 1}
Did not match all atoms present	41892-01-7	CCCCCCCCCCCC[N+](C)(C)CC(CCl)O.[Cl-]	{1: 3, 2: 13, 3: 1, 20: 1, 17: 2}
Did not match all atoms present	41892-71-1	CCOC(=O)C(=O)CC(=O)[O-].[Na+]	{24: 2, 1: 1, 2: 2, 28: 1}
Did not match all atoms present	4190-05-0	C1=CC(=CC(=C1)O)C2=C(C=C(C=C2)O)O	{21: 3, 14: 7}
Did not match all atoms present	4190-14-1	C1=CC=C(C=C1)C(=O)CNC(=O)C2=CC=CC=C2	{24: 2, 2: 1, 14: 10, 31: 1}
Did not match all atoms present	41901-72-8	CCOC1=CC(=C(C=C1)OCC)C	{1: 3, 2: 2, 22: 2, 14: 3}
Did not match all atoms present	41903-41-7	CCC1=C(C(=C(C=C1)C)C)C	{1: 4, 2: 1, 14: 2}
Did not match all atoms present	41906-71-2	CC1(CC(C2=CC=CC=C21)(C)C3=CC=CC=C3)CC(C)(C)C4=CC=CC=C4	{1: 4, 2: 1, 4: 1, 11: 1, 13: 2, 14: 14}
Did not match all atoms present	4191-73-5	CC(C)OC(=O)C1=CC=C(C=C1)O	{1: 2, 3: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	41916-72-7	P=P	{}
Did not match all atoms present	41924-81-6	CCCCSP(=O)(C=C)C=C	{1: 1, 2: 3, 5: 2, 6: 2, 40: 1, 29: 1}
Did not match all atoms present	41927-01-9	CC1=C(C(=C(C=C1)N)N)C	{1: 2, 30: 2, 14: 2}
Did not match all atoms present	41927-14-4	CC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2	{1: 1, 2: 1, 14: 9, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	41927-50-8	CN1C(=O)CC(=N1)C2=CC=CC=C2	{1: 1, 35: 1, 33: 1, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	4193-55-9	C1=CC=C(C=C1)NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 16, 20: 4, 29: 6, 31: 4}
Did not match all atoms present	41934-47-8	CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F	{1: 2, 2: 2, 4: 1, 33: 1, 14: 4, 16: 3, 28: 1}
Did not match all atoms present	41938-28-7	CCOP(=O)(OC1=CC(=C(C=C1)SC)C)Cl	{1: 3, 2: 1, 40: 1, 14: 3, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	4194-69-8	C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.[In+3]	{24: 3, 20: 3, 2: 6, 27: 6, 4: 3}
Did not match all atoms present	41944-01-8	[K+].[I-].[I-].[I-].[I-].[Bi+3]	{19: 4}
Did not match all atoms present	41948-17-8	CCCCCCCCCCCCCCCC(=O)O[C@H]1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)N)CO)O	{1: 1, 2: 15, 35: 1, 33: 1, 12: 4, 14: 2, 20: 2, 23: 1, 25: 1, 28: 1, 30: 1}
Did not match all atoms present	4195-17-9	CC(C)(C)C(=O)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 4: 1, 38: 1, 14: 4, 28: 1}
Did not match all atoms present	4196-86-5	C1=CC=C(C=C1)C(=O)OCC(COC(=O)C2=CC=CC=C2)(COC(=O)C3=CC=CC=C3)COC(=O)C4=CC=CC=C4	{28: 4, 2: 4, 4: 1, 14: 20}
Did not match all atoms present	4196-87-6	CC(COC(=O)C1=CC=CC=C1)(COC(=O)C2=CC=CC=C2)COC(=O)C3=CC=CC=C3	{1: 1, 2: 3, 4: 1, 14: 15, 28: 3}
Did not match all atoms present	4196-89-8	CC(C)(COC(=O)C1=CC=CC=C1)COC(=O)C2=CC=CC=C2	{1: 2, 2: 2, 4: 1, 14: 10, 28: 2}
Did not match all atoms present	4197-09-5	CC(=O)NC1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 7, 15: 2, 21: 1, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	4197-25-5	CC1(NC2=C3C(=C(C=C2)N=NC4=CC=C(C5=CC=CC=C54)N=NC6=CC=CC=C6)C=CC=C3N1)C	{32: 2, 1: 2, 34: 4, 13: 1, 14: 16}
Did not match all atoms present	41973-82-4	CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2S(=O)(=O)[O-])NC3=NC(=NC(=N3)Cl)OC)S(=O)(=O)[O-])C4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 35: 4, 33: 1, 12: 1, 14: 6, 15: 1, 17: 1, 22: 1, 25: 1, 29: 9, 31: 1}
Did not match all atoms present	4198-90-7	CC1=CC(=CC(=C1O)C)C#N	{1: 2, 21: 1, 14: 2, 37: 1}
Did not match all atoms present	41981-63-9	CCCC1=CSC(=N1)C	{1: 2, 2: 2, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	41981-72-0	CCCC1=NC(=C(S1)C)C	{1: 3, 2: 2, 35: 1, 41: 1}
Did not match all atoms present	41981-75-3	CCCC1=C(N=C(S1)C)CC	{1: 3, 2: 3, 35: 1, 41: 1}
Did not match all atoms present	41989-08-6	CCCCCCCCOP(=O)(O)[O-].[K+]	{1: 1, 2: 7, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	4199-03-5	COC1=CC=C(C=C1)[Si](C)(C)[Si](C)(C)C	{1: 6, 22: 1, 14: 4}
Did not match all atoms present	4199-88-6	C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-]	{35: 2, 38: 1, 14: 7}
Did not match all atoms present	4199-89-7	C1=CC2=CC(=C3C=CC=NC3=C2N=C1)Cl	{17: 1, 35: 2, 14: 7}
Did not match all atoms present	41992-22-7	CC[Ge]1(CCC2(CCN(C2)CCCN(C)C)CC1)CC.Cl.Cl	{33: 2, 2: 5, 1: 4, 11: 7, 13: 1, 17: 2}
Did not match all atoms present	41994-80-3	CC(CC(C)(C)O)[O-].[Ti]	{1: 3, 2: 1, 3: 1, 4: 1, 20: 1, 29: 1}
Did not match all atoms present	41996-78-5	CCOC(C1=CC=CC=C1)(C(=O)C2=CC=CC=C2)OCC	{1: 2, 2: 2, 4: 1, 14: 10, 22: 2, 24: 1}
Did not match all atoms present	41998-16-7	C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2Cl	{17: 1, 28: 1, 14: 9}
Did not match all atoms present	41999-41-1	CCCCCCCCC=CS(=O)(=O)O	{1: 1, 2: 7, 20: 1, 29: 2, 6: 2}
Did not match all atoms present	41999-58-0	C(C(=O)[O-])OC(C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]	{24: 3, 2: 1, 3: 1, 22: 1}
Did not match all atoms present	420-24-6	C[As](F)F	{16: 2, 1: 1}
Did not match all atoms present	420-32-6	C(=S)(F)F	{16: 2, 7: 1}
Did not match all atoms present	420-37-1	[B-](F)(F)(F)F.C[O+](C)C	{16: 4, 1: 3}
Did not match all atoms present	420-52-0	C(F)(F)(F)P	{16: 3, 4: 1}
Did not match all atoms present	420-56-4	C[Si](C)(C)F	{16: 1, 1: 3}
Did not match all atoms present	420-87-1	C(C(F)(F)F)[O-].[Na+]	{16: 3, 2: 1, 4: 1, 29: 1}
Did not match all atoms present	42003-39-4	C1CO[Si]2(OCCN1CCO2)CCl	{17: 1, 2: 1, 11: 6, 33: 1, 23: 3}
Did not match all atoms present	42011-48-3	C1=C(OC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC(=O)C(F)(F)F	{35: 1, 4: 1, 38: 1, 41: 1, 14: 3, 16: 3, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	42013-20-7	CC1=CC=CC=C1C(=O)NCC(=O)O	{1: 1, 2: 1, 14: 4, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	42013-48-9	CC1(COC(CN1)C2=CC=CC=C2)C	{32: 1, 1: 2, 11: 2, 12: 1, 13: 1, 14: 5, 23: 1}
Did not match all atoms present	42013-69-4	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)CC)N.[Br-].[Br-]	{1: 2, 2: 2, 33: 2, 14: 17, 18: 2, 24: 1, 30: 1, 31: 3}
Did not match all atoms present	42016-93-3	C1=CC(=C(C=C1I)Cl)N	{17: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	42019-78-3	C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)O	{24: 1, 17: 1, 21: 1, 14: 8}
Did not match all atoms present	4202-14-6	CC(=O)CP(=O)(OC)OC	{24: 1, 1: 3, 2: 1, 29: 1, 22: 2}
Did not match all atoms present	42028-27-3	CCC1=C2C(=C3CCC(=O)C3=C1)C=CC4=CC=CC=C42	{1: 1, 2: 1, 11: 2, 14: 7, 25: 1}
Did not match all atoms present	42028-33-1	C12=NNN=C1N(C(=O)NC2=O)O	{32: 2, 25: 2, 35: 2, 21: 1, 33: 1}
Did not match all atoms present	42029-30-1	COCP(=O)(OC)OC	{1: 3, 2: 1, 29: 1, 22: 3}
Did not match all atoms present	4203-50-3	C1CCOC(C1)OC2=CC=CC=C2	{11: 4, 12: 1, 22: 1, 14: 5, 23: 1}
Did not match all atoms present	42032-30-4	CCCCCCCCCCN1C=CN=C1C	{1: 2, 2: 9, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	42033-46-5	C=CC#N.C=CC(=O)O.OS(=O)[O-].[Na+]	{37: 1, 6: 2, 20: 1, 27: 1, 29: 2, 5: 2}
Did not match all atoms present	42039-81-6	CCC1C(=O)NC(=S)NC1=O	{32: 2, 1: 1, 2: 1, 12: 1, 15: 1, 25: 2}
Did not match all atoms present	42039-84-9	CC[C@H]1C[C@]2([C@@H](CC[C@]2(C#C)O)[C@H]3[C@H]1C4=C(CC3)C=C(C=C4)O)C	{1: 2, 2: 1, 9: 1, 10: 1, 11: 5, 12: 4, 13: 2, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	42044-20-2	CC(C)(C)C1CCCC2=CC=CC=C12	{1: 3, 11: 3, 4: 1, 14: 4, 12: 1}
Did not match all atoms present	42044-22-4	CC(C)(C)C1CCC2=CC=CC=C2C1	{1: 3, 11: 3, 4: 1, 14: 4, 12: 1}
Did not match all atoms present	42044-26-8	CC(C)(C)C1=CC2=C(CCCC2)C=C1	{1: 3, 11: 4, 4: 1, 14: 3}
Did not match all atoms present	42045-86-3	CCC(=O)N(C1CCN(CC1C)CCC2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 2: 3, 33: 2, 11: 3, 12: 2, 14: 10, 24: 1}
Did not match all atoms present	4205-90-7	C1CN=C(N1)NC2=C(C=CC=C2Cl)Cl	{32: 1, 35: 1, 11: 2, 14: 3, 15: 1, 17: 2, 31: 1}
Did not match all atoms present	4205-91-8	C1CN=C(N1)NC2=C(C=CC=C2Cl)Cl.Cl	{32: 1, 35: 1, 11: 2, 14: 3, 15: 1, 17: 3, 31: 1}
Did not match all atoms present	42058-59-3	COC(=O)CC1=CC(=CC=C1)O	{1: 1, 2: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	4206-58-0	COC1=CC(=CC(=C1O)OC)C=CC=O	{1: 2, 6: 2, 14: 2, 21: 1, 22: 2, 26: 1}
Did not match all atoms present	4206-67-1	C[Si](C)(C)CI	{1: 3, 2: 1, 19: 1}
Did not match all atoms present	4206-75-1	C1=CC=C(C=C1)[Si]Cl	{17: 1, 14: 5}
Did not match all atoms present	42065-76-9	CC(C)NS(=O)(=O)O	{1: 2, 3: 1, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	42069-01-2	CCCSP(=S)(OCC)Cl	{40: 1, 1: 2, 2: 3, 22: 1, 17: 1}
Did not match all atoms present	42069-72-7	CCOC(C(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-])NC2=CC=C(C=C2)SC	{1: 2, 2: 1, 3: 1, 38: 1, 40: 1, 14: 7, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	4207-42-5	C1=CC(=CC=C1C(=O)O)N.C1(C(=O)NC(=O)N1)NC(=O)N	{32: 2, 12: 1, 14: 4, 24: 1, 25: 2, 27: 1, 30: 2, 31: 1}
Did not match all atoms present	42073-03-0	C1=CC2=C3C(=C1)C=CC4=CC=CC(=C4O3)C=C2	{14: 10, 23: 1}
Did not match all atoms present	4208-49-5	C=CCOC(=O)C1=CC=CO1	{2: 1, 5: 1, 6: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	4208-61-1	CCC(C1=CC=CO1)O	{1: 1, 2: 1, 3: 1, 14: 3, 20: 1, 23: 1}
Did not match all atoms present	4208-64-4	CC(C1=CC=CO1)O	{1: 1, 3: 1, 20: 1, 14: 3, 23: 1}
Did not match all atoms present	4208-80-4	CC1(C2=CC=CC=C2[N+](=C1C=CNC3=C(C=C(C=C3)OC)OC)C)C.[Cl-]	{1: 5, 6: 2, 33: 1, 13: 1, 14: 7, 15: 1, 17: 1, 22: 2, 31: 1}
Did not match all atoms present	42082-72-4	C1CC2=NC(=CC=C2)CCC3=CC=C1C=C3	{35: 1, 11: 4, 14: 7}
Did not match all atoms present	42087-89-8	[CH-]1[CH-][CH-][C-]([CH-][CH-]1)Cl.C1=CC=C(C=C1)Cl.[Cr]	{17: 2, 14: 10, 15: 1}
Did not match all atoms present	42087-90-1	[CH-]1[CH-][CH-][C-]([CH-][CH-]1)F.C1=CC=C(C=C1)F.[Cr]	{16: 2, 14: 10, 15: 1}
Did not match all atoms present	4209-24-9	CC1=CC=C(C=C1)C(=O)CCl	{24: 1, 1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	42097-42-7	CC1=NC(=C(C=C1)O)CO	{1: 1, 2: 1, 35: 1, 14: 2, 20: 1, 21: 1}
Did not match all atoms present	421-11-4	C(F)(F)(F)[Hg]I	{16: 3, 19: 1, 4: 1}
Did not match all atoms present	421-20-5	COS(=O)(=O)F	{16: 1, 1: 1, 29: 2, 22: 1}
Did not match all atoms present	421-31-8	C[As](C)C(F)(F)F	{16: 3, 1: 2, 4: 1}
Did not match all atoms present	421-57-8	CP(C)C(F)(F)F	{16: 3, 1: 2, 4: 1}
Did not match all atoms present	421-58-9	C(F)(F)(F)P(Cl)Cl	{16: 3, 17: 2, 4: 1}
Did not match all atoms present	421-62-5	C[Sb](C)C(F)(F)F	{16: 3, 1: 2, 4: 1}
Did not match all atoms present	421-82-9	CS(=O)(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 29: 2}
Did not match all atoms present	421-83-0	C(F)(F)(F)S(=O)(=O)Cl	{16: 3, 17: 1, 4: 1, 29: 2}
Did not match all atoms present	421-85-2	C(F)(F)(F)S(=O)(=O)N	{16: 3, 4: 1, 29: 2, 30: 1}
Did not match all atoms present	4210-32-6	CC(C)(C)C1=CC=C(C=C1)C#N	{1: 3, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	4210-90-6	CCCN(CCC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CCC)CCC)C3=CC=C(C=C3)N(C4=CC=C(C=C4)N(CCC)CCC)C5=CC=C(C=C5)N(CCC)CCC	{1: 8, 2: 16, 14: 20, 33: 6}
Did not match all atoms present	4211-67-0	CC(C)(C)C1=C(C=C(C(=C1)C(=O)C2=CC=CC=C2)O)O	{24: 1, 1: 3, 4: 1, 21: 2, 14: 7}
Did not match all atoms present	4212-74-2	CC1=CC(=C(C=C1)S(=O)(=O)C2=CC=CC=C2)C	{1: 2, 29: 2, 14: 8}
Did not match all atoms present	4212-94-6	CC(C)OC(=O)N(C1=CC=CC=C1)OC(=O)C	{1: 3, 3: 1, 28: 2, 14: 5, 33: 1}
Did not match all atoms present	4213-30-3	C1=CC(=CC=C1C=C(C#N)C#N)N(CCCl)CCCl	{33: 1, 2: 4, 37: 2, 6: 1, 7: 1, 14: 4, 17: 2}
Did not match all atoms present	4213-34-7	C1=CC(=CC(=C1)N(CCCl)CCCl)CC(C(=O)O)[NH3+].[Cl-]	{33: 1, 2: 5, 3: 1, 14: 4, 17: 3, 27: 1}
Did not match all atoms present	4213-40-5	CC1=C(C=CC(=C1)N(CCCl)CCCl)N=NC2=CC=CC=C2C(=O)O	{1: 1, 2: 4, 33: 1, 34: 2, 14: 7, 17: 2, 27: 1}
Did not match all atoms present	4213-41-6	COC1=CC=CC(=C1OC)N(CCCl)CCCl	{1: 2, 2: 4, 33: 1, 14: 3, 17: 2, 22: 2}
Did not match all atoms present	4213-44-9	CC(CCCN(CCCl)CCCl)NC1=C2C=CC(=CC2=NC=C1)Cl.Cl.Cl	{1: 1, 2: 7, 3: 1, 33: 1, 14: 5, 17: 5, 35: 1, 31: 1}
Did not match all atoms present	4213-45-0	CC(CCCN(CCCl)CCCl)NC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC.Cl.Cl	{1: 2, 2: 7, 3: 1, 33: 1, 14: 6, 17: 5, 35: 1, 22: 1, 31: 1}
Did not match all atoms present	42133-45-9	CC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O.C(CO)O	{1: 2, 2: 4, 4: 1, 14: 6, 20: 4, 28: 4}
Did not match all atoms present	42133-48-2	CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(CCCO)CCO	{1: 1, 2: 7, 3: 1, 14: 6, 20: 4, 27: 2, 28: 2}
Did not match all atoms present	42134-49-6	C[Si](C)(C)C#CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 3, 2: 1, 18: 1, 10: 2, 14: 15}
Did not match all atoms present	42135-22-8	C1=CC=C2C(=C1)C3=C(C2=O)C=CC(=C3)[N+](=O)[O-]	{25: 1, 38: 1, 14: 7}
Did not match all atoms present	42135-35-3	CC(=O)NC1=CC=CC2=C1C3=CC=CC=C3C2=O	{24: 1, 1: 1, 31: 1, 14: 7, 25: 1}
Did not match all atoms present	42137-24-6	C1=C(SC=C1[N+](=O)[O-])C#N	{41: 1, 38: 1, 37: 1, 14: 2}
Did not match all atoms present	42137-88-2	CC1=CC=C(C=C1)S(=O)(=O)N(CCCl)CCCl	{1: 1, 2: 4, 33: 1, 14: 4, 17: 2, 29: 2}
Did not match all atoms present	4214-28-2	CC1=CC(=C(C=C1)I)C	{1: 2, 19: 1, 14: 3}
Did not match all atoms present	4214-74-8	C1=C(C=NC(=C1Cl)N)Cl	{17: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	4214-75-9	C1=CC(=C(N=C1)N)[N+](=O)[O-]	{38: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	4214-76-0	C1=CC(=NC=C1[N+](=O)[O-])N	{38: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	4214-79-3	C1=CC(=O)NC=C1Cl	{32: 1, 17: 1, 14: 3, 25: 1}
Did not match all atoms present	42144-78-5	CCOC1=NC(=CC=C1)Cl	{1: 1, 2: 1, 35: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	42145-91-5	CC[NH2+]CC(C1=CC(=CC=C1)O)OC(=O)C(C)(C)C.[Cl-]	{1: 4, 2: 2, 3: 1, 4: 1, 14: 4, 17: 1, 21: 1, 28: 1}
Did not match all atoms present	42148-23-2	C(S(=O)(=O)F)S(=O)(=O)F	{16: 2, 2: 1, 29: 4}
Did not match all atoms present	4215-80-9	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)N	{30: 1, 14: 15}
Did not match all atoms present	4215-86-5	CC(C)CCCC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5}
Did not match all atoms present	4215-95-6	CC1=CC2=C(C3=CC(=C(C=C3N=C2C=C1N)N)C)C.Cl	{1: 3, 35: 1, 30: 2, 14: 4, 17: 1}
Did not match all atoms present	42151-56-4	CC(C(C1=CC=CC=C1)O)N(C)C	{1: 3, 3: 2, 20: 1, 14: 5, 33: 1}
Did not match all atoms present	42152-37-4	C1CC1C2=C(C2=O)C3CC3	{25: 1, 11: 4, 12: 2}
Did not match all atoms present	42165-79-7	CCN1C2=C(C=CC(=C2)C)SC1=CC(=CC3=[N+](C4=C(S3)C=CC(=C4)C)CC)C.[I-]	{1: 5, 2: 2, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 19: 1}
Did not match all atoms present	4217-66-7	CC(CO)(C1=CC=CC=C1)O	{1: 1, 2: 1, 4: 1, 14: 5, 20: 2}
Did not match all atoms present	42175-48-4	C1=CC(=C(C(=C1)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 9, 4: 3, 14: 3}
Did not match all atoms present	4218-48-8	CCC1=CC=C(C=C1)C(C)C	{1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	4218-87-5	C=CCOC1=CC=CC=C1OCC=C	{22: 2, 2: 2, 14: 4, 5: 2, 6: 2}
Did not match all atoms present	42182-84-3	C1CC2=CC=CC=C2C3C1C4C3C5=CC=CC=C5CC4	{11: 4, 12: 4, 14: 8}
Did not match all atoms present	42189-56-0	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)N5C(=O)C=CC5=O	{25: 2, 14: 11, 33: 1}
Did not match all atoms present	42196-31-6	C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Pd+2]	{16: 6, 24: 2, 4: 2}
Did not match all atoms present	422-69-5	C[Si](C(C(F)F)(F)F)(Cl)Cl	{16: 4, 1: 1, 3: 1, 4: 1, 17: 2}
Did not match all atoms present	42200-33-9	CC(C)(C)NCC(COC1=CC=CC2=C1C[C@@H]([C@@H](C2)O)O)O	{1: 3, 2: 2, 3: 1, 4: 1, 11: 2, 12: 2, 14: 3, 20: 3, 22: 1, 31: 1}
Did not match all atoms present	42204-14-8	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Rh+3]	{24: 3, 1: 3}
Did not match all atoms present	42205-08-3	CCC1=C(C(=CC=C1)CC)CC	{1: 3, 2: 3, 14: 3}
Did not match all atoms present	42217-97-0	[CH3-].[Cd]	{}
Did not match all atoms present	42217-98-1	[CH3-].[Zn]	{}
Did not match all atoms present	4222-20-2	C1=CC=C(C=C1)C2(C=CC3=C(O2)C=CC4=CC=CC=C43)C5=CC=CC=C5	{13: 1, 14: 18, 23: 1}
Did not match all atoms present	4222-26-8	COC1=CC=C(C=C1)C2=NN2Cl	{1: 1, 35: 1, 33: 1, 14: 4, 15: 1, 17: 1, 22: 1}
Did not match all atoms present	42220-47-3	CC(O)(P(=O)(O)O)P(=O)(O)O.C(CO)N	{1: 1, 2: 2, 4: 1, 20: 6, 29: 2, 30: 1}
Did not match all atoms present	42222-36-6	COC(=O)C1=C(C=C(C=C1)Cl)N/N=C\2/C(=O)C(=CC3=CC=CC=C23)C(=O)NC4=CC=C(C=C4)NC(=O)C5=CC6=CC=CC=C6/C(=N\NC7=C(C=CC(=C7)Cl)C(=O)OC)/C5=O	{1: 2, 34: 2, 14: 20, 15: 4, 17: 2, 24: 2, 25: 2, 28: 2, 31: 4}
Did not match all atoms present	42228-16-0	COC(C1=CC=C(C=C1)C(=O)OC)OC	{1: 3, 3: 1, 28: 1, 22: 2, 14: 4}
Did not match all atoms present	42228-32-0	CCN(C1=CC=C(C=C1)C)C2=CC3=C(C=C2)C4(C5=CC=CC=C5C(=O)O4)C6=C(O3)C=CC(=C6)C	{1: 3, 2: 1, 33: 1, 13: 1, 14: 14, 23: 1, 28: 1}
Did not match all atoms present	42228-65-9	CCN(CCC(=O)OCCOC)C1=C(C=CC(=C1)NC(=O)C)OC	{1: 4, 2: 5, 33: 1, 14: 3, 22: 2, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	42237-97-8	CC(C)C(=C)OC1=CC=CC=C1	{1: 2, 3: 1, 5: 1, 7: 1, 14: 5, 22: 1}
Did not match all atoms present	4224-87-7	CC1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 6: 2}
Did not match all atoms present	42242-58-0	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC3=C2OC=C3	{1: 2, 34: 2, 33: 1, 14: 9, 23: 1}
Did not match all atoms present	42242-59-1	CN(C)C1=CC=C(C=C1)N=NC2=CC3=C(C=C2)OC=C3	{1: 2, 34: 2, 33: 1, 14: 9, 23: 1}
Did not match all atoms present	42242-72-8	C1=CC=C(C=C1)C(=O)NC(CCCN(C#N)N=O)C(=O)N	{33: 1, 2: 3, 3: 1, 37: 1, 34: 1, 14: 5, 24: 2, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	42248-76-0	CCC(CO)(COCC=C)COCC=C.CC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O	{1: 2, 2: 7, 3: 1, 4: 1, 5: 2, 6: 2, 14: 6, 20: 3, 22: 2, 28: 4}
Did not match all atoms present	4225-42-7	CC1=CC(=O)C=C(O1)OC	{1: 2, 25: 1, 22: 1, 14: 2, 23: 1}
Did not match all atoms present	4225-85-8	CC1=CC=CC2=C1N=C(C=C2)Cl	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	42251-12-7	COC(=O)/C=C(/C1=CC=CC=C1)\[N+](=O)[O-]	{1: 1, 6: 1, 38: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	42265-58-7	CCNC1=CC=C(C=C1)C(=O)OCC	{1: 2, 2: 2, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	42265-67-8	CC(C)(C)C1=CC(=C(C=C1)N)Cl	{1: 3, 4: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	42271-88-5	CC(=O)OC(C)(C)C1C=CC2=CC=CC=C12	{1: 3, 4: 1, 14: 6, 12: 1, 28: 1}
Did not match all atoms present	42279-29-8	C1=CC=C(C=C1)OC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 5, 22: 1, 14: 5}
Did not match all atoms present	4228-00-6	CCCCCCCCCCCC(=O)OC1=CC=CC=C1	{1: 1, 2: 10, 28: 1, 14: 5}
Did not match all atoms present	4228-10-8	CC(=O)C1=CC2=C(CCC2)C=C1	{24: 1, 1: 1, 11: 3, 14: 3}
Did not match all atoms present	4228-88-0	C1=C(C=C2C(=C1Cl)N=C(N2)C(F)(F)F)Cl	{32: 1, 35: 1, 4: 1, 14: 2, 16: 3, 17: 2}
Did not match all atoms present	4228-89-1	C1=CC(=C2C(=C1Cl)NC(=N2)C(F)(F)F)Cl	{32: 1, 35: 1, 4: 1, 14: 2, 16: 3, 17: 2}
Did not match all atoms present	4228-91-5	C1=C(C=C2C(=C1Cl)N=C(N2)C(F)(F)F)[N+](=O)[O-]	{32: 1, 35: 1, 4: 1, 38: 1, 14: 2, 16: 3, 17: 1}
Did not match all atoms present	4228-97-1	C1=CC(=C2C(=C1Br)NC(=N2)C(F)(F)F)Br	{32: 1, 35: 1, 4: 1, 14: 2, 16: 3, 18: 2}
Did not match all atoms present	42281-59-4	C1CC[C@]2([C@H]3CC4=C([C@]2(C1)CCN3CC5CC5)C=C(C=C4)O)O	{33: 1, 2: 1, 11: 9, 12: 2, 13: 2, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	42282-82-6	CCC1(C(=O)NC1=O)C2=CC=CC=C2	{32: 1, 1: 1, 2: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	42286-84-0	CC1=C2C=CC(=O)OC2=CC=C1	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	4229-35-0	CCCCCCCCCCCCOC(=O)CC(C(=O)OCCCCCCCCCCCC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 23, 3: 1, 28: 2, 29: 3}
Did not match all atoms present	4229-91-8	CCCC1=CC=CO1	{1: 1, 2: 2, 14: 3, 23: 1}
Did not match all atoms present	42293-27-6	C1=CC(=C(C=C1Cl)N)OC2=C(C=C(C=C2)Cl)S(=O)(=O)O	{14: 6, 17: 2, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	42299-62-7	C1=CC=C(C=C1)N2C3C2C(=O)C4=CC=CC=C34	{25: 1, 12: 2, 14: 9, 33: 1}
Did not match all atoms present	423-50-7	C(C(C(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 14, 4: 6, 29: 2}
Did not match all atoms present	423-82-5	CCN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 8, 5: 1, 6: 1, 33: 1, 16: 17, 28: 1, 29: 2}
Did not match all atoms present	423-86-9	C=CCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 8, 5: 1, 6: 1, 16: 17, 29: 2, 31: 1}
Did not match all atoms present	4230-21-1	C1=CC=C(C=C1)OCCN[NH3+].[Cl-]	{17: 1, 2: 2, 22: 1, 14: 5, 31: 1}
Did not match all atoms present	4230-93-7	COC1=C(C=C(C=C1)C=C[N+](=O)[O-])OC	{1: 2, 22: 2, 38: 1, 14: 3, 6: 2}
Did not match all atoms present	4231-74-7	CN(C1=CC=CC=N1)N	{1: 1, 35: 1, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	42310-84-9	O(S(F)(F)(F)(F)F)S(F)(F)(F)(F)F	{16: 10, 22: 1}
Did not match all atoms present	42313-79-1	CN(C)CC1=C(C=CC(=C1)Br)O	{1: 2, 2: 1, 33: 1, 14: 3, 18: 1, 21: 1}
Did not match all atoms present	4232-27-3	CC(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	4232-84-2	C1=CC(=CC=C1N)OP(=O)(OC2=CC=C(C=C2)N)OC3=CC=C(C=C3)N	{30: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	4234-72-4	C1=CC(=CC=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])N(CCC#N)CCC#N	{33: 1, 2: 4, 37: 2, 38: 1, 34: 2, 14: 8}
Did not match all atoms present	42340-98-7	C[C@H](C1=CC=CC2=CC=CC=C21)N=C=O	{1: 1, 34: 1, 3: 1, 8: 1, 14: 7, 29: 1}
Did not match all atoms present	42342-18-7	CC(C)(CCCC(=O)O)C(=O)O.COC(=O)C1=CC=C(C=C1)C(=O)OC.C(CO)O	{1: 4, 2: 5, 4: 1, 14: 4, 20: 2, 27: 2, 28: 2}
Did not match all atoms present	42344-05-8	CN(C)C1=CC=C(C=C1)N=O.Cl	{1: 2, 34: 1, 33: 1, 14: 4, 17: 1, 29: 1}
Did not match all atoms present	42348-86-7	C1CC(=O)C2=C1C=C(C=C2)Cl	{17: 1, 11: 2, 14: 3, 25: 1}
Did not match all atoms present	4235-09-0	CC(=O)NC1=CC2=CC=CC=C2C3=CC=CC=C31	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	4235-94-3	C1CCC(CC1)N2C=NC3=C2N=CN=C3N	{33: 1, 35: 3, 11: 5, 12: 1, 14: 2, 30: 1}
Did not match all atoms present	42358-38-3	COCCCN1C(=O)C2=CC=CC3=C2C(=CC(=NNC4=CC(=CC=C4)Cl)C3=O)C1=O	{1: 1, 2: 3, 33: 1, 34: 1, 14: 8, 17: 1, 22: 1, 25: 3, 31: 1}
Did not match all atoms present	42358-39-4	COCCCN1C(=O)C2=CC=CC3=C2C(=C/C(=N/NC4=CC=C(C=C4)Cl)/C3=O)C1=O	{1: 1, 2: 3, 33: 1, 34: 1, 14: 8, 17: 1, 22: 1, 25: 3, 31: 1}
Did not match all atoms present	42358-42-9	COCCCN1C(=O)C2=CC=CC3=C2C(=C/C(=N/NC4=CC=C(C=C4)[N+](=O)[O-])/C3=O)C1=O	{1: 1, 2: 3, 38: 1, 33: 1, 34: 1, 14: 8, 22: 1, 25: 3, 31: 1}
Did not match all atoms present	42360-29-2	CC(=O)NC1=CC2=CC(=CC(=C2C=C1)O)S(=O)(=O)[O-].[Na+]	{1: 1, 14: 5, 21: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	42365-62-8	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CN.Cl	{2: 1, 4: 2, 14: 3, 16: 6, 17: 1, 30: 1}
Did not match all atoms present	4237-07-4	C[N+](C)(C)CC=CCCl.[Cl-]	{1: 3, 2: 2, 6: 2, 17: 2}
Did not match all atoms present	4237-25-6	CCC1=CC(=C(C=C1)C(C)(C)C)O	{1: 4, 2: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	4237-37-0	CC(C)(C)C1=C(C(=CC=C1)Cl)O	{1: 3, 4: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	4237-44-9	CC(C1=CC=CC=C1)C2=CC=CC=C2O	{1: 1, 3: 1, 21: 1, 14: 9}
Did not match all atoms present	4237-48-3	C1=CC=C(C=C1)C(C2=CC=CC=C2)S	{3: 1, 14: 10, 39: 1}
Did not match all atoms present	4237-70-1	CCC(C)(C)C1=CC=C(C=C1)C	{1: 4, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	4237-73-4	CC(C)(CCC1=CC=C(C=C1)O)O	{1: 2, 2: 2, 4: 1, 14: 4, 20: 1, 21: 1}
Did not match all atoms present	42371-63-1	B1(C2CCCC1CCC2)[C@H]3C[C@H]4C[C@@H]([C@@H]3C)C4(C)C	{1: 3, 11: 8, 12: 6, 13: 1}
Did not match all atoms present	42371-86-8	C[Sn]1(C2=CC=CC=C2SC3=CC=CC=C31)C	{1: 2, 14: 8, 41: 1}
Did not match all atoms present	42372-00-9	CC1=CC(=C(C=C1CN(C)C)C)O.Cl	{1: 4, 2: 1, 33: 1, 14: 2, 17: 1, 21: 1}
Did not match all atoms present	42372-33-8	COCCOS(=O)(=O)C1=CC=CC2=C1C=CC(=C2[O-])[N+]#N	{1: 1, 2: 2, 34: 1, 14: 5, 22: 2, 29: 2}
Did not match all atoms present	42372-37-2	C1=CC2=C(C=CC(=C2[O-])[N+]#N)C(=C1)S(=O)(=O)OCC(CBr)Br	{2: 2, 3: 1, 34: 1, 14: 5, 18: 2, 22: 1, 29: 2}
Did not match all atoms present	42373-04-6	CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)N=NC4=[N+](C=CS4)C.[Cl-]	{1: 2, 34: 2, 33: 2, 41: 1, 14: 11, 17: 1}
Did not match all atoms present	42379-68-0	CC[N+]1=C(SC2=C1C=C(C=C2)OC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 1, 33: 1, 41: 1, 14: 7, 22: 1, 29: 3}
Did not match all atoms present	4238-71-5	C1=CC=C(C=C1)CN2C=CN=C2	{33: 1, 2: 1, 35: 1, 14: 8}
Did not match all atoms present	4238-84-0	CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)N(C)C	{32: 1, 1: 3, 33: 2, 11: 2, 12: 2, 14: 5, 15: 1, 24: 1}
Did not match all atoms present	42380-62-1	C1=CC(=CC=C1C=CC2=CC(=C(C=C2)Cl)S(=O)(=O)[O-])C3=CC=C(C=C3)C=CC4=CC(=C(C=C4)Cl)S(=O)(=O)[O-].[Na+].[Na+]	{17: 2, 14: 14, 6: 4, 29: 6}
Did not match all atoms present	42389-30-0	C1=C(C=C(C(=C1[N+](=O)[O-])N)N)Cl	{17: 1, 38: 1, 30: 2, 14: 2}
Did not match all atoms present	42397-64-8	C1=CC2=C(C=CC3=C2C4=C1C=CC(=C4C=C3)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	42397-65-9	C1=CC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC4=C(C=CC1=C43)[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	42398-73-2	CC1=CC2=C(C=C1)C=NC=C2	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	42399-41-7	CC(=O)O[C@@H]1[C@@H](SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC	{1: 4, 2: 2, 33: 2, 41: 1, 12: 2, 14: 8, 22: 1, 25: 1, 28: 1}
Did not match all atoms present	42399-49-5	COC1=CC=C(C=C1)[C@H]2[C@H](C(=O)NC3=CC=CC=C3S2)O	{32: 1, 1: 1, 41: 1, 12: 2, 14: 8, 20: 1, 22: 1, 25: 1}
Did not match all atoms present	42402-37-9	CC1CO1.C1CO1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(C(CO)O)O	{1: 1, 2: 3, 3: 1, 8: 2, 11: 3, 12: 1, 34: 2, 14: 8, 20: 3, 23: 2, 29: 2}
Did not match all atoms present	42408-13-9	CC(C)(OC(=O)C=C)[Si]OC(=O)C=C	{1: 2, 4: 1, 5: 2, 6: 2, 28: 2}
Did not match all atoms present	42408-82-2	C1CC[C@]2([C@H]3CC4=C([C@]2(C1)CCN3CC5CCC5)C=C(C=C4)O)O	{33: 1, 2: 1, 11: 10, 12: 2, 13: 2, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	4241-27-4	CC1=CC=C(C(=O)N1)C#N	{32: 1, 1: 1, 37: 1, 14: 2, 25: 1}
Did not match all atoms present	4241-73-0	C1=CC=NC(=C1)C(=O)N/N=C/[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O	{2: 1, 3: 4, 6: 1, 34: 1, 14: 4, 35: 1, 20: 5, 24: 1, 31: 1}
Did not match all atoms present	42413-23-0	C1=CC=C(C=C1)COC(=O)CCCCCCC(=O)OCC2=CC=CC=C2	{2: 8, 28: 2, 14: 10}
Did not match all atoms present	4242-46-0	C1=CC=C(C=C1)C(C#N)OC(=O)C2=CC=CC=C2	{3: 1, 28: 1, 37: 1, 14: 10}
Did not match all atoms present	42423-89-2	CC[N+]1=C([Se]C2=CC=CC=C21)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 29: 3, 14: 8, 33: 1}
Did not match all atoms present	42425-45-6	C=CCO.C1=CC(=CC(=C1)O)O	{2: 1, 5: 1, 6: 1, 14: 4, 20: 1, 21: 2}
Did not match all atoms present	42433-61-4	CCCCCC(C)C1=CC(=C(C=C1)O)C	{1: 3, 2: 4, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	42436-07-7	CCC=CCCOC(=O)CC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	42437-75-2	CN=P(C)(C)C	{1: 4, 34: 1}
Did not match all atoms present	42447-90-5	CC(=O)OC(C)(C)C1=CCC2=CC=CC=C21	{1: 3, 4: 1, 11: 1, 14: 5, 15: 1, 28: 1}
Did not match all atoms present	42452-55-1	CCCN(CCO)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]	{1: 1, 2: 4, 4: 1, 38: 2, 33: 1, 14: 2, 16: 3, 20: 1}
Did not match all atoms present	42454-06-8	C1=CC(=C(C=C1O)C=O)[N+](=O)[O-]	{26: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	42454-94-4	C1=CC=C(C=C1)C2=C(C(C3=CC=CC=C32)(C4=CC=CC=C4)O)C5=CC=CC=C5	{20: 1, 13: 1, 14: 19, 15: 2}
Did not match all atoms present	42456-75-7	CC(=O)C1=CC(=C(S1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 41: 1, 14: 1, 17: 1, 24: 1}
Did not match all atoms present	42461-89-2	C1OC2=C(O1)C=C(C=C2)/C=C/CBr	{2: 1, 6: 2, 11: 1, 14: 3, 18: 1, 23: 2}
Did not match all atoms present	42462-61-3	C1=CC2=C3C(=C1)C4=CC=CC5=C4C(=CC=C5)C3=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 21: 1, 14: 14}
Did not match all atoms present	42471-28-3	CC1=NC=C(C(=N1)N)CNC(=O)N(CCCl)N=O	{1: 1, 2: 3, 35: 2, 33: 1, 34: 1, 14: 1, 17: 1, 24: 1, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	42472-93-5	CN1C(=O)CCC(C1=O)N2C(=O)C3=CC=CC=C3C2=O	{1: 1, 33: 2, 11: 2, 12: 1, 14: 4, 25: 4}
Did not match all atoms present	42472-96-8	C1CC(C(=O)NC1)N2C(=O)C3=CC=CC=C3C2=O	{32: 1, 33: 1, 11: 3, 12: 1, 14: 4, 25: 3}
Did not match all atoms present	42474-60-2	CC1=NC2=C(S1)C=C(C=C2)C#N	{1: 1, 35: 1, 37: 1, 14: 3, 41: 1}
Did not match all atoms present	4248-04-8	COC1=CC2=C(C=C1)[C@H]3CC[C@@H]4[C@H]([C@@H]3CC2)CCC4=O	{1: 1, 11: 6, 12: 4, 14: 3, 22: 1, 25: 1}
Did not match all atoms present	4248-77-5	CS(=O)(=O)OCCCCCCCCCOS(=O)(=O)C	{1: 2, 2: 9, 29: 4, 22: 2}
Did not match all atoms present	42481-10-7	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C/C(=N\NC3=CC=C(C=C3)OC)/C4=CC=CC=C4C2=O)C(C)(C)CC	{1: 7, 2: 6, 4: 2, 34: 1, 14: 12, 15: 2, 22: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	42481-11-8	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)N)O)C(C)(C)CC	{1: 6, 2: 6, 4: 2, 14: 8, 21: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	42481-45-8	CCOC(=O)C(=CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC=C3)C#N	{1: 1, 2: 1, 33: 1, 6: 1, 7: 1, 14: 14, 28: 1, 37: 1}
Did not match all atoms present	42484-34-4	CN1C=NC2=C1N=C(N(C2=O)C)N	{1: 2, 35: 2, 33: 2, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	42485-89-2	COC1=CC(=C(C=C1N)OC)S(=O)(=O)O	{1: 2, 14: 2, 20: 1, 22: 2, 29: 2, 30: 1}
Did not match all atoms present	42486-53-3	C1=C(C=C(C(=C1Cl)O)Cl)N.Cl	{17: 3, 30: 1, 21: 1, 14: 2}
Did not match all atoms present	42487-09-2	CC(=O)CC(=O)NC1=CC(=C(C=C1Cl)NC(=O)CC(=O)C)Cl	{1: 2, 2: 2, 14: 2, 17: 2, 24: 4, 31: 2}
Did not match all atoms present	42499-21-8	O=P([O-])([O-])OP(=O)([O-])O	{20: 1, 29: 5, 22: 1}
Did not match all atoms present	425-32-1	C1=CC=C(C=C1)C(C(C2=CC=CC=C2)(F)F)(F)F	{16: 4, 4: 2, 14: 10}
Did not match all atoms present	425-75-2	CCOS(=O)(=O)C(F)(F)F	{1: 1, 2: 1, 4: 1, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	4250-81-1	CCCC#CC1=CC=CC=C1	{1: 1, 2: 2, 10: 2, 14: 5}
Did not match all atoms present	4250-82-2	CC(C)(C)C#CC1=CC=CC=C1	{1: 3, 10: 2, 4: 1, 14: 5}
Did not match all atoms present	42506-57-0	C1=CC=C(C=C1)C2=CC(=C3C=C(OC(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C=C(O2)C6=CC=CC=C6	{23: 2, 14: 24, 15: 6}
Did not match all atoms present	42506-60-5	C1=CC=C(C=C1)C2=CC(=C3C=C(SC(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C=C(S2)C6=CC=CC=C6	{41: 2, 14: 24, 15: 6}
Did not match all atoms present	42509-62-6	CC(C)N1C(=NC(=O)N1)Cl	{32: 1, 1: 2, 3: 1, 33: 1, 17: 1, 35: 1, 25: 1}
Did not match all atoms present	42509-80-8	CCOP(=S)(OCC)OC1=NN(C(=N1)Cl)C(C)C	{1: 4, 2: 2, 3: 1, 33: 1, 17: 1, 35: 2, 22: 3}
Did not match all atoms present	4251-21-2	C1=CC(=CC=C1CCC(=O)O)CCC(=O)O	{2: 4, 27: 2, 14: 4}
Did not match all atoms present	4251-89-2	CCN(CCCNC1=C2C=CC3=CC=CC=C3C2=NC4=CC=CC=C41)CCCl.Cl.Cl	{1: 1, 2: 6, 35: 1, 33: 1, 14: 10, 17: 3, 31: 1}
Did not match all atoms present	4252-78-2	C1=CC(=C(C=C1Cl)Cl)C(=O)CCl	{24: 1, 17: 3, 2: 1, 14: 3}
Did not match all atoms present	42520-76-3	C1=C(SC(=C1)Cl)C(=NO)C#N	{34: 1, 37: 1, 7: 1, 41: 1, 14: 2, 17: 1, 20: 1}
Did not match all atoms present	42521-82-4	C1=CC=C2C(=C1)C=CC(=C2SSC3=C(C=CC4=CC=CC=C43)O)O	{40: 2, 21: 2, 14: 12}
Did not match all atoms present	42525-64-4	C[Si](C)(C)CCN1CCC1	{1: 3, 2: 2, 11: 3, 33: 1}
Did not match all atoms present	42525-65-5	C1CN(C1)CCC2=CC=CC=C2	{33: 1, 2: 2, 11: 3, 14: 5}
Did not match all atoms present	4253-22-9	CCCC[Sn](=S)CCCC	{1: 2, 2: 6}
Did not match all atoms present	4253-34-3	CC(=O)O[Si](C)(OC(=O)C)OC(=O)C	{1: 4, 28: 3}
Did not match all atoms present	4253-91-2	CCCS(=O)CCC	{1: 2, 2: 4, 29: 1}
Did not match all atoms present	42530-35-8	CCN(C1=CC=C(C=C1)C)C2=CC3=C(C=C2)C4(C5=CC=CC=C5C(=O)O4)C6=C(O3)C=CC(=C6)N(C)C7=CC=CC=C7	{1: 3, 2: 1, 33: 2, 13: 1, 14: 19, 23: 1, 28: 1}
Did not match all atoms present	42530-53-0	C1=CC2=C3C(=C1)C4=C(C=CC(=C4C(=O)C3=CC=C2)Cl)Cl	{17: 2, 14: 8, 25: 1}
Did not match all atoms present	4254-29-9	C1C(CC2=CC=CC=C21)O	{20: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	42540-40-9	CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)[C@@H](C4=CC=CC=C4)OC=O)SC2)C(=O)[O-].[Na+]	{1: 1, 2: 1, 3: 1, 33: 2, 40: 1, 41: 1, 11: 1, 12: 2, 14: 5, 15: 2, 35: 3, 24: 2, 25: 1, 26: 1, 31: 1}
Did not match all atoms present	42542-07-4	CCC(CC1=CC2=C(C=C1)OCO2)N	{1: 1, 2: 2, 3: 1, 11: 1, 14: 3, 23: 2, 30: 1}
Did not match all atoms present	42542-10-9	CC(CC1=CC2=C(C=C1)OCO2)NC	{1: 2, 2: 1, 3: 1, 11: 1, 14: 3, 23: 2, 31: 1}
Did not match all atoms present	4255-23-6	C=CCC(CC1=CC=CC=C1)N	{2: 2, 3: 1, 5: 1, 6: 1, 14: 5, 30: 1}
Did not match all atoms present	4255-24-7	C=CCC(CC1=CC=CC=C1)N.Cl	{2: 2, 3: 1, 5: 1, 6: 1, 14: 5, 17: 1, 30: 1}
Did not match all atoms present	4255-94-1	CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCOCC2.F[P-](F)(F)(F)(F)F	{1: 2, 2: 2, 33: 1, 11: 4, 34: 1, 14: 2, 16: 6, 22: 2, 23: 1}
Did not match all atoms present	42553-22-0	C1CCC(=O)NCC1.C1CC(CCC1CC2CCC(CC2)N)N.C1=CC(=CC=C1C(=O)O)C(=O)O	{32: 1, 2: 1, 11: 13, 12: 4, 14: 4, 25: 1, 27: 2, 30: 2}
Did not match all atoms present	42565-93-5	[Mg+2].[Mg+2].[Cl-].[Cl-].[Cl-].[Cl-]	{17: 4}
Did not match all atoms present	42567-04-4	CCC1(COC1)COP(OCC2(COC2)CC)OC3=CC=CC=C3	{1: 2, 2: 4, 11: 4, 13: 2, 14: 5, 22: 3, 23: 2}
Did not match all atoms present	42573-57-9	COC1=CC=C(C=C1)C=CC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{1: 1, 35: 3, 4: 2, 6: 2, 14: 4, 17: 6, 22: 1}
Did not match all atoms present	42576-02-3	COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 6, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	42579-89-5	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Ba+2].[Pb+2]	{29: 8}
Did not match all atoms present	42597-49-9	CCCCOC(=O)C1=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)O	{1: 1, 2: 3, 27: 1, 28: 1, 18: 4}
Did not match all atoms present	426-50-6	C(C(F)(F)F)(C(F)(F)[Si](Cl)(Cl)Cl)F	{16: 6, 17: 3, 3: 1, 4: 2}
Did not match all atoms present	426-59-5	C1=CC(=CC(=C1)S(=O)(=O)C(F)(F)F)N	{16: 3, 30: 1, 4: 1, 29: 2, 14: 4}
Did not match all atoms present	42601-04-7	C1=CC(=C(C=C1N=C=O)F)F	{8: 1, 16: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	42607-21-6	C1C(NC(S1)C2=CC=CC=C2)C(=O)O	{32: 1, 41: 1, 11: 1, 12: 2, 14: 5, 27: 1}
Did not match all atoms present	42609-52-9	CC1=CC=C(C=C1)NC(=O)NC(C)(C)C2=CC=CC=C2	{24: 1, 1: 3, 4: 1, 14: 9, 31: 2}
Did not match all atoms present	4261-14-7	C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3N	{33: 1, 2: 1, 35: 3, 30: 1, 14: 7}
Did not match all atoms present	4261-70-5	COCNC1=NC(=NC(=N1)N)N	{1: 1, 2: 1, 35: 3, 22: 1, 30: 2, 31: 1}
Did not match all atoms present	42612-73-7	C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Yb+3]	{17: 1, 11: 2, 14: 6}
Did not match all atoms present	4262-06-0	C1=CC=NC(=C1)SC2=CC=CC=N2	{40: 1, 35: 2, 14: 8}
Did not match all atoms present	4263-38-1	CCN(CC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(C4=CC=C(C=C4)N(CC)CC)C5=CC=C(C=C5)N(CC)CC.[F-].[F-].[F-].[F-].[F-].[F-].[Sb]	{16: 6, 1: 8, 2: 8, 14: 20, 33: 6}
Did not match all atoms present	4263-52-9	C(CBr)S(=O)(=O)[O-].[Na+]	{2: 2, 18: 1, 29: 3}
Did not match all atoms present	4265-07-0	C=C(C(=O)O)OP(=O)(O)[O-].[K+]	{5: 1, 7: 1, 20: 1, 22: 1, 27: 1, 29: 2}
Did not match all atoms present	4265-16-1	C1=CC=C2C(=C1)C=C(O2)C=O	{26: 1, 14: 5, 23: 1}
Did not match all atoms present	4265-25-2	CC1=CC2=CC=CC=C2O1	{1: 1, 14: 5, 23: 1}
Did not match all atoms present	4268-35-3	B=[P+](C)C	{1: 2}
Did not match all atoms present	4269-15-2	C1=CC=C2C(=C1)C3=C(C2=O)C=CC=C3N	{25: 1, 30: 1, 14: 7}
Did not match all atoms present	4269-20-9	C1=CC=C2C(=C1)C3=C(C=CC=C3C2=O)C#N	{25: 1, 37: 1, 14: 7}
Did not match all atoms present	4269-88-9	C[N+]1(CCCCC1)CCN(C2CCCCC2)C3CCCCC3.[Br-]	{1: 1, 2: 2, 33: 1, 11: 15, 12: 2, 18: 1}
Did not match all atoms present	427-00-9	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3CCC4	{1: 1, 33: 1, 11: 6, 12: 3, 13: 1, 14: 2, 21: 1, 23: 1}
Did not match all atoms present	427-01-0	CC[C@@H]1CN2CC[C@@]34[C@@H]2C[C@@H]1[C@H]5[C@@H]3N([C@@H](OC5)[C@@H]([C@H]\6C[C@H]7C8=C(CCN7C/C6=C/C)C9=CC=CC=C9N8)C(=O)OC)C1=CC=CC=C41	{32: 1, 1: 3, 2: 1, 3: 1, 6: 1, 33: 3, 11: 9, 12: 8, 13: 1, 14: 8, 15: 1, 23: 1, 28: 1}
Did not match all atoms present	427-36-1	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)F	{16: 1, 4: 1, 14: 15}
Did not match all atoms present	427-45-2	C1=CC(=CC=C1Cl)[Sn](C2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)Cl)F	{16: 1, 17: 3, 14: 12}
Did not match all atoms present	427-49-6	C1CCC(C1)C(C2=CC=CC=C2)(C(=O)O)O	{4: 1, 11: 4, 12: 1, 14: 5, 20: 1, 27: 1}
Did not match all atoms present	4270-27-3	C1=C(NC(=O)NC1=O)Cl	{32: 2, 17: 1, 14: 1, 25: 2}
Did not match all atoms present	4271-30-1	C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)O)C(=O)O)N	{2: 2, 3: 1, 14: 4, 24: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	42712-64-1	C1=CC=C2C(=C1)C(=O)C=C(N2)N	{32: 1, 25: 1, 30: 1, 14: 5}
Did not match all atoms present	42714-96-5	CCCCCCCCCCCCCCCCCCCCOP(=O)(O)O	{1: 1, 2: 19, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	42714-98-7	CCCCCCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 38, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	42714-99-8	CCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 42, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	42715-25-3	C1=CC=[N+]2C(=C1)SC=C2[O-]	{33: 1, 14: 5, 41: 1}
Did not match all atoms present	42715-30-0	CC(=O)OC1=C(N=CC=C1)SC	{40: 1, 1: 2, 35: 1, 28: 1, 14: 3}
Did not match all atoms present	4272-77-9	CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)O	{1: 2, 20: 1, 29: 2, 14: 6, 33: 1}
Did not match all atoms present	42721-99-3	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)[C-]3C(=O)C4=CC=CC=C4C3=O.[Na+]	{24: 1, 25: 2, 3: 1, 14: 14, 15: 1}
Did not match all atoms present	42723-79-5	CC1CCCC(C1)C2=C(C=CC=N2)NC(=O)SCC3=CC=C(C=C3)C(C)(C)C	{1: 4, 2: 1, 35: 1, 4: 1, 40: 1, 11: 4, 12: 2, 14: 7, 24: 1, 31: 1}
Did not match all atoms present	4273-88-5	CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CC(=O)C	{1: 2, 2: 2, 35: 1, 41: 1, 14: 3, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	4273-98-7	C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2N	{30: 1, 29: 2, 14: 9}
Did not match all atoms present	42739-38-8	CCCCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 3}
Did not match all atoms present	4274-03-7	COC1=C(C=C(C=C1)Cl)N.Cl	{1: 1, 30: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	4274-06-0	CC1=CC(=C(C=C1OC)N)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 2, 34: 2, 38: 1, 14: 5, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	42740-50-1	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl	{17: 8, 14: 2}
Did not match all atoms present	4275-07-4	CCCC=NC1=CC=CC=C1	{1: 1, 2: 2, 34: 1, 14: 5, 6: 1}
Did not match all atoms present	42753-71-9	CC1=C(C=CC(=N1)N)Br	{1: 1, 18: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	42754-17-6	CC1CCCCC1C2=C(C=CC=N2)NC(=O)SCC3=CC=C(C=C3)C(C)(C)C	{1: 4, 2: 1, 35: 1, 4: 1, 40: 1, 11: 4, 12: 2, 14: 7, 24: 1, 31: 1}
Did not match all atoms present	42754-18-7	CC1CCC(CC1)C2=C(C=CC=N2)NC(=O)SCC3=CC=C(C=C3)C(C)(C)C	{1: 4, 2: 1, 35: 1, 4: 1, 40: 1, 11: 4, 12: 2, 14: 7, 24: 1, 31: 1}
Did not match all atoms present	42754-19-8	CC1CCC(C(C1)C2=C(C=CC=N2)NC(=O)SCC3=CC=C(C=C3)C(C)(C)C)C	{1: 5, 2: 1, 35: 1, 4: 1, 40: 1, 11: 3, 12: 3, 14: 7, 24: 1, 31: 1}
Did not match all atoms present	42754-20-1	CC1CCC(CC1C)C2=C(C=CC=N2)NC(=O)SCC3=CC=C(C=C3)C(C)(C)C	{1: 5, 2: 1, 35: 1, 4: 1, 40: 1, 11: 3, 12: 3, 14: 7, 24: 1, 31: 1}
Did not match all atoms present	42754-21-2	CC1CC(CC(C1)C2=C(C=CC=N2)NC(=O)SCC3=CC=C(C=C3)C(C)(C)C)C	{1: 5, 2: 1, 35: 1, 4: 1, 40: 1, 11: 3, 12: 3, 14: 7, 24: 1, 31: 1}
Did not match all atoms present	42754-23-4	CC(C)(C)C1=CC=C(C=C1)CSC(=NC2=CN=CC=C2)SC3CCCCC3	{1: 3, 2: 1, 35: 1, 4: 1, 7: 1, 40: 2, 11: 5, 12: 1, 34: 1, 14: 8}
Did not match all atoms present	42767-90-8	C1=CC=C2C(=C1)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O.C(=C/C(=O)O)\C(=O)O	{2: 8, 6: 2, 14: 4, 20: 2, 22: 1, 27: 4, 28: 2}
Did not match all atoms present	42775-75-7	CCC1=CC=CC2=C1CCCC2	{1: 1, 2: 1, 11: 4, 14: 3}
Did not match all atoms present	42775-77-9	CCCC1=CC2=C(CCCC2)C=C1	{1: 1, 2: 2, 11: 4, 14: 3}
Did not match all atoms present	42783-78-8	CCOC(COCC1=CC=CC=C1)OCC	{1: 2, 2: 4, 3: 1, 22: 3, 14: 5}
Did not match all atoms present	42786-04-9	CCN1C=NC(=N1)N	{1: 1, 2: 1, 35: 2, 33: 1, 14: 1, 30: 1}
Did not match all atoms present	42786-06-1	CCN1C=NN=C1N	{1: 1, 2: 1, 35: 2, 33: 1, 14: 1, 30: 1}
Did not match all atoms present	42786-59-4	C1=NC(=C(C(=N1)Cl)N)NN	{17: 1, 35: 2, 30: 2, 14: 1, 31: 1}
Did not match all atoms present	4279-76-9	C#COC1=CC=CC=C1	{9: 1, 10: 1, 22: 1, 14: 5}
Did not match all atoms present	42790-35-2	CCC1=CC=C(C=C1)/[N+](=C/C2=CC=CC=C2)/[O-]	{1: 1, 2: 1, 6: 1, 33: 1, 14: 9, 29: 1}
Did not match all atoms present	42794-63-8	COC1=CC=C(C=C1)OCC(CNCCNCC(COC2=CC=C(C=C2)OC)O)O.CS(=O)(=O)O.CS(=O)(=O)O	{1: 4, 2: 6, 3: 2, 14: 8, 20: 4, 22: 4, 29: 4, 31: 2}
Did not match all atoms present	42794-87-6	C1=C(C=C(C(=C1F)N)F)C2=CC(=C(C(=C2)F)N)F	{16: 4, 30: 2, 14: 4}
Did not match all atoms present	42797-32-0	CC1=CC=C(C=C1)SC(=O)C2=CC=CC=C2C(=O)OC	{24: 1, 1: 2, 28: 1, 14: 8, 40: 1}
Did not match all atoms present	42797-33-1	C1=CC=C(C=C1)SC(=O)C2=CC=CC=C2C(=O)SC3=CC=CC=C3	{24: 2, 40: 2, 14: 14}
Did not match all atoms present	42797-34-2	CC1=CC=C(C=C1)SC(=O)C2=CC=CC=C2C(=O)SC3=CC=C(C=C3)C	{24: 2, 1: 2, 14: 12, 40: 2}
Did not match all atoms present	42797-36-4	CC1=CC=C(C=C1)SC2(C3=CC=CC=C3C(=O)O2)SC4=CC=C(C=C4)C	{40: 2, 1: 2, 28: 1, 13: 1, 14: 12}
Did not match all atoms present	42798-98-1	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)[N+](=O)[O-])OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=C(C=C8)[N+](=O)[O-].[Cl-].[Cl-]	{1: 2, 35: 4, 38: 4, 33: 4, 14: 22, 17: 2, 22: 2}
Did not match all atoms present	428-37-5	CCCC1(CCN(C1)C)C2=CC(=CC=C2)O	{1: 2, 2: 2, 33: 1, 11: 3, 13: 1, 14: 4, 21: 1}
Did not match all atoms present	428-76-2	C(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F	{16: 6, 2: 1, 4: 2, 29: 4}
Did not match all atoms present	4280-30-2	C1CCN(C1)C2=CC=C(C=C2)Cl	{17: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	42803-77-0	CC1=CC=C(C=C1)[C@H](CC2=CC(=CC=C2)S(=O)(=O)O)N	{1: 1, 2: 1, 3: 1, 14: 8, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	4281-16-7	C1=CC=C(C(=C1)CC(=O)C2=CC=CC=C2C(=O)O)C(=O)O	{24: 1, 2: 1, 27: 2, 14: 8}
Did not match all atoms present	42810-33-3	C1C2C=CC1C3=C2C=CC(=C3)[N+](=O)[O-]	{11: 1, 12: 2, 38: 1, 14: 5}
Did not match all atoms present	42816-33-1	CCN(CCNC(=O)C)C1=CC=CC(=C1)C	{1: 3, 2: 3, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	4282-05-7	CC[Sn](C)(C)CC	{1: 4, 2: 2}
Did not match all atoms present	4282-24-0	C1=COC(=C1C(=O)O)C(=O)O	{27: 2, 14: 2, 23: 1}
Did not match all atoms present	4282-28-4	C1=C(OC=C1C(=O)O)C(=O)O	{27: 2, 14: 2, 23: 1}
Did not match all atoms present	4282-29-5	C1=C(C(=CS1)C(=O)O)C(=O)O	{41: 1, 27: 2, 14: 2}
Did not match all atoms present	4282-31-9	C1=C(SC(=C1)C(=O)O)C(=O)O	{41: 1, 27: 2, 14: 2}
Did not match all atoms present	4282-32-0	COC(=O)C1=CC=C(O1)C(=O)OC	{1: 2, 28: 2, 14: 2, 23: 1}
Did not match all atoms present	4282-33-1	COC(=O)C1=COC=C1C(=O)OC	{1: 2, 28: 2, 14: 2, 23: 1}
Did not match all atoms present	4282-47-7	C1=CC=NC(=C1)C2=CC=C(C=C2)[N+](=O)[O-]	{35: 1, 38: 1, 14: 8}
Did not match all atoms present	42824-34-0	CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN(CC)CC)/C3=CC=C(C=C3)OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 4, 2: 7, 4: 1, 33: 1, 7: 2, 14: 13, 20: 1, 22: 2, 27: 3}
Did not match all atoms present	42825-73-0	C1CSC(=[N+]1CCCS(=O)(=O)[O-])C=CNC2=CC=CC=C2	{33: 1, 2: 3, 6: 2, 41: 1, 11: 2, 14: 5, 15: 1, 29: 3, 31: 1}
Did not match all atoms present	42829-14-1	C1CS(=O)(=O)C(C1(Cl)Cl)Cl	{17: 3, 11: 2, 12: 1, 13: 1, 29: 2}
Did not match all atoms present	42835-89-2	CC1CCC2=C(N1)C=CC(=C2)F	{32: 1, 1: 1, 11: 2, 12: 1, 14: 3, 16: 1}
Did not match all atoms present	42835-92-7	CC1CCC2=C(N1)C=C(C=C2)C	{32: 1, 1: 2, 11: 2, 12: 1, 14: 3}
Did not match all atoms present	42837-65-0	C1=CC=C(C=C1)C(=O)C2=NC(=O)NO2	{32: 1, 35: 1, 14: 5, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	42839-36-1	C1CCCNC(CC1)CN=C(N)N.OS(=O)(=O)O	{32: 1, 2: 1, 7: 1, 11: 6, 12: 1, 34: 1, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	42840-17-5	COC1=C(C2=C(C=C1)C3=CC=CC=C3O2)CN4CCCC4	{1: 1, 2: 1, 33: 1, 11: 4, 14: 6, 22: 1, 23: 1}
Did not match all atoms present	42844-93-9	C1=CC=C2C(=C1)C=CC(=C2C=NC3=CC4=C(C=C3N=CC5=C(C=CC6=CC=CC=C65)[O-])NC(=O)N4)[O-].[Ni+2]	{32: 2, 25: 1, 34: 2, 14: 14, 6: 2}
Did not match all atoms present	4285-42-1	CN(C1=CC=CC=C1)C(=O)Cl	{24: 1, 1: 1, 33: 1, 14: 5, 17: 1}
Did not match all atoms present	42850-82-8	C1C2=CSC=C2C3=CSC=C3CS1	{41: 3, 11: 2, 14: 4}
Did not match all atoms present	4286-15-1	CC[C@@H](C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	4286-23-1	CC(=C)C1=CC=C(C=C1)O	{1: 1, 21: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	42861-47-2	CCN(CCC(=O)OCCOC)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC	{1: 4, 2: 5, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 2, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	42861-95-0	CO[Si](CCC1=CC=CC=C1CCl)(OC)OC	{1: 3, 2: 3, 22: 3, 14: 4, 17: 1}
Did not match all atoms present	42864-78-8	CC1=CC(=CC=C1)OCC(CNCCC2=CC(=C(C=C2)OC)OC)O.Cl	{1: 3, 2: 4, 3: 1, 14: 7, 17: 1, 20: 1, 22: 3, 31: 1}
Did not match all atoms present	42867-30-1	C1=CC(=O)N=C1[O-].[Ag+]	{25: 1, 35: 1, 14: 2, 15: 1}
Did not match all atoms present	4287-20-1	C1=CC=C(C=C1)OCC(CN)O.Cl	{2: 2, 3: 1, 14: 5, 17: 1, 20: 1, 22: 1, 30: 1}
Did not match all atoms present	42873-80-3	C#CCCCOC1=CC=C(C=C1)OC2=CC=CC=C2	{9: 1, 2: 3, 22: 2, 10: 1, 14: 9}
Did not match all atoms present	42874-01-1	C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=C(C=C2)C(F)(F)F)Cl	{4: 1, 38: 1, 14: 7, 16: 3, 17: 1, 22: 1}
Did not match all atoms present	42874-03-3	CCOC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]	{1: 1, 2: 1, 4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 22: 2}
Did not match all atoms present	42874-63-5	C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)[N+](=O)[O-])O	{4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 21: 1, 22: 1}
Did not match all atoms present	42875-41-2	CCCCCCCCCCCCCOC=O	{1: 1, 2: 12, 26: 1}
Did not match all atoms present	42880-17-1	CC[N+]1=C(OC2=CC=CC=C21)C=CN(C3=CC=CC=C3)C(=O)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 6: 2, 33: 2, 14: 13, 23: 1, 24: 1, 29: 3}
Did not match all atoms present	42882-31-5	CC(C1=CC=CC2=CC=CC=C21)N	{1: 1, 3: 1, 30: 1, 14: 7}
Did not match all atoms present	42887-24-1	CCCCC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)CCCC	{1: 2, 2: 6, 31: 2, 14: 14, 25: 2}
Did not match all atoms present	42887-27-4	CCCCC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O	{1: 1, 2: 3, 31: 1, 14: 11, 25: 2}
Did not match all atoms present	42896-18-4	C1=CC=C2C3C(C2=C1)OC4=CC=CC=C4O3	{12: 2, 14: 8, 23: 2}
Did not match all atoms present	429-30-1	CC[Sn](CC)(CC)OC(=O)C(F)(F)F	{16: 3, 1: 3, 2: 3, 4: 1, 28: 1}
Did not match all atoms present	429-41-4	CCCC[N+](CCCC)(CCCC)CCCC.[F-]	{16: 1, 1: 4, 2: 12}
Did not match all atoms present	429-42-5	[B-](F)(F)(F)F.CCCC[N+](CCCC)(CCCC)CCCC	{16: 4, 1: 4, 2: 12}
Did not match all atoms present	429-67-4	C[Si]1(O[Si](O[Si](O[Si](O1)(C)CCC(F)(F)F)(C)CCC(F)(F)F)(C)CCC(F)(F)F)CCC(F)(F)F	{16: 12, 1: 4, 2: 8, 4: 4, 23: 4}
Did not match all atoms present	429-72-1	C[Si](OC(=O)C(F)(F)F)(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F	{16: 9, 1: 1, 4: 3, 28: 3}
Did not match all atoms present	42900-95-8	CC1=CC(=CC(=C1O)C)CN(C)C	{1: 4, 2: 1, 21: 1, 14: 2, 33: 1}
Did not match all atoms present	42903-59-3	CCC(COCC=C)(COCC=C)COC(=O)NC1=CC(=C(C=C1)C)NC(=O)OCC(CC)(COCC=C)COCC=C	{1: 3, 2: 12, 4: 2, 5: 4, 6: 4, 14: 3, 22: 4, 28: 2, 31: 2}
Did not match all atoms present	42905-20-4	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=CC(=C4)S(=O)(=O)NC5=CC=CC6=C5/C(=N/NC7=C(C=C(C=C7)[N+](=O)[O-])S(=O)(=O)C)/C=CC6=O)O)C(C)(C)CC	{1: 7, 2: 6, 4: 2, 38: 1, 34: 1, 14: 20, 15: 1, 21: 1, 22: 1, 24: 1, 25: 1, 29: 6, 31: 4}
Did not match all atoms present	42906-19-4	CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C=O	{1: 2, 26: 1, 14: 12, 33: 1}
Did not match all atoms present	42908-15-6	CCCCC(CC)COC(=O)C1=CC(=C(C(=C1)N)C)N	{1: 3, 2: 5, 3: 1, 14: 2, 28: 1, 30: 2}
Did not match all atoms present	42908-73-6	C1=CC(=CC=C1OC(=S)Cl)F	{16: 1, 17: 1, 22: 1, 14: 4, 7: 1}
Did not match all atoms present	42916-36-9	CC(C)(C)C[Al](CC(C)(C)C)CC(C)(C)C	{1: 9, 2: 3, 4: 3}
Did not match all atoms present	42916-73-4	CCCCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2	{24: 1, 1: 1, 2: 3, 14: 9}
Did not match all atoms present	42919-37-9	C1C=CCC2CC1C3=CC=CC=C23	{11: 3, 12: 2, 14: 6}
Did not match all atoms present	42919-38-0	C1CC2CC(C=C1)C3=CC=CC=C23	{11: 3, 12: 2, 14: 6}
Did not match all atoms present	4292-10-8	CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]	{24: 2, 1: 3, 2: 14, 31: 1}
Did not match all atoms present	42920-39-8	CC/C(=C(\C1=CC=C(C=C1)OC)/C2=CC=C(C=C2)OCCN(CC)CC)/C3=CC=C(C=C3)OC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 5, 2: 7, 4: 1, 33: 1, 7: 2, 14: 12, 20: 1, 22: 3, 27: 3}
Did not match all atoms present	42924-53-8	CC(=O)CCC1=CC2=C(C=C1)C=C(C=C2)OC	{24: 1, 1: 2, 2: 2, 22: 1, 14: 6}
Did not match all atoms present	42933-52-8	C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)NN)S(=O)(=O)NN	{30: 2, 29: 4, 14: 8, 31: 2}
Did not match all atoms present	42939-86-6	CC1=C(C=CC(=C1)[N+](=O)[O-])N/N=C/2\C(=C(C(=O)NC2=O)C#N)C	{32: 1, 1: 2, 34: 1, 37: 1, 38: 1, 14: 3, 15: 3, 25: 2, 31: 1}
Did not match all atoms present	4294-16-0	C1=CC=C(C=C1)CNC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O	{33: 1, 2: 2, 35: 3, 12: 4, 14: 7, 20: 3, 23: 1, 31: 1}
Did not match all atoms present	4294-57-9	CC1=CC=[C-]C=C1.[Mg+2].[Br-]	{1: 1, 18: 1, 14: 4}
Did not match all atoms present	4295-06-1	CC1=NC2=CC=CC=C2C(=C1)Cl	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	4295-11-8	CC1=CC2=C(C=C1)N=C(C=C2)Cl	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	42951-35-9	CCCCN1C(=CC2=CC=CC=C21)C	{1: 2, 2: 3, 14: 5, 33: 1}
Did not match all atoms present	42951-39-3	CCCCCCCCN1C(=CC2=CC=CC=C21)C	{1: 2, 2: 7, 14: 5, 33: 1}
Did not match all atoms present	42952-29-4	CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 33: 1, 41: 1, 14: 10, 29: 3}
Did not match all atoms present	42959-18-2	C[Si]1(OCCN(CCO1)CCO)C	{1: 2, 2: 2, 33: 1, 11: 4, 20: 1, 23: 2}
Did not match all atoms present	42965-91-3	CO[Si](CCCNCCNCC1=CC=CC=C1)(OC)OC.Cl	{1: 3, 2: 6, 14: 5, 17: 1, 22: 3, 31: 2}
Did not match all atoms present	42966-30-3	CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 16}
Did not match all atoms present	42967-55-5	COC(=O)C1=CC=C(C=C1)C(=O)[O-].[K+]	{24: 1, 1: 1, 28: 1, 14: 4}
Did not match all atoms present	4297-99-8	CCCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 10, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	42971-09-5	CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4C(=C2)C(=O)OCC	{1: 2, 2: 2, 33: 2, 11: 5, 12: 1, 13: 1, 14: 5, 15: 1, 28: 1}
Did not match all atoms present	42972-46-3	CC1=CN=CC(=C1)C(=O)C	{24: 1, 1: 2, 35: 1, 14: 3}
Did not match all atoms present	42973-56-8	COC1=CC=CC(=C1O)CC#N	{1: 1, 2: 1, 37: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	42978-42-7	C1=CC=C(C=C1)C(=O)OCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C6=CC=CC=C62	{2: 1, 28: 1, 14: 16}
Did not match all atoms present	42978-43-8	CC(=O)OCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C5=CC=CC=C51	{1: 1, 2: 1, 28: 1, 14: 11}
Did not match all atoms present	42978-77-8	CC1=CC=CC=C1C(=O)[O-].[Co]	{24: 1, 1: 1, 14: 4}
Did not match all atoms present	4298-10-6	C1=C(C(=NC(=O)N1[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O)N)F	{33: 1, 2: 1, 35: 1, 12: 4, 14: 1, 16: 1, 20: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	42986-15-2	CNC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O	{1: 1, 34: 2, 38: 1, 6: 2, 14: 10, 20: 2, 29: 4, 31: 1}
Did not match all atoms present	42986-19-6	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)O)NNC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O	{2: 2, 36: 1, 14: 7, 15: 5, 20: 3, 22: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	42986-22-1	C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)N	{2: 2, 14: 3, 20: 2, 22: 1, 29: 6, 30: 1}
Did not match all atoms present	42987-34-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC4=CC=C(C=C4)Cl)N	{14: 9, 17: 1, 21: 1, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	4299-49-4	CP1(=NP(=NP(=NP(=N1)(C)C)(C)C)(C)C)C	{1: 8, 35: 4}
Did not match all atoms present	4299-70-1	COC(=O)[C@H](CC1=CNC2=CC=CC=C21)N	{32: 1, 1: 1, 2: 1, 3: 1, 14: 5, 28: 1, 30: 1}
Did not match all atoms present	42998-51-6	CCOC(=O)CC(=O)OCC1=CC=CC=C1	{1: 1, 2: 3, 28: 2, 14: 5}
Did not match all atoms present	430-41-1	B(CC)(F)F	{16: 2, 1: 1, 2: 1}
Did not match all atoms present	4300-43-0	C1=CC(=C(C=C1NC(=O)NC2=CC(=C(C=C2)Cl)Cl)Cl)Cl	{24: 1, 17: 4, 14: 6, 31: 2}
Did not match all atoms present	43000-19-7	COC(=O)C1=C(C2=CC=CC=C2C(=C1)C3(C4=CC=CC5=C4C(=CC=C5)C(=O)O3)O)O	{1: 1, 13: 1, 14: 11, 20: 1, 21: 1, 28: 2}
Did not match all atoms present	43001-55-4	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2	{1: 1, 14: 9, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	43001-81-6	C1=CC2=C(C=C(C=C2)N)C(=C1)S(=O)(=O)CCO	{2: 2, 30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	4301-50-2	C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OCCF	{16: 1, 2: 3, 28: 1, 14: 9}
Did not match all atoms present	43012-17-5	C1=CC2=CC3=C(C=C2)C=C(C=CC4=CC5=C(C=C4)C=C1C=C5)C=C3	{14: 16}
Did not match all atoms present	4302-87-8	CC(CC1=CC=C(C=C1)N)NC	{1: 2, 2: 1, 3: 1, 14: 4, 30: 1, 31: 1}
Did not match all atoms present	43020-38-8	COC1=C(C(=C(C=C1)C#N)OC)OC	{1: 3, 22: 3, 14: 2, 37: 1}
Did not match all atoms present	43022-36-2	[1H]CC1=C(C(=C(C(=C1C)C)C=O)C)C	{1: 5, 26: 1}
Did not match all atoms present	4303-88-2	C[N+]1(CCOC(C1)(C2=CC=CC=C2)O)C.[Br-]	{1: 2, 11: 3, 13: 1, 14: 5, 18: 1, 20: 1, 23: 1}
Did not match all atoms present	43033-72-3	CC[C@@H](C(C[C@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C.Cl	{1: 5, 2: 2, 3: 2, 4: 1, 33: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	43035-23-0	C1=CC(=CC(=C1)N)C(=O)NC2=CC=C(C=C2)S(=O)(=O)O	{14: 8, 20: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	43035-67-2	CC1=CC(=C(C=C1)NC(=O)C(C(=O)C)N=NC2=C(C=C(C(=C2)OC)C3=CC(=C(C=C3OC)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)C)C)Cl)Cl)C	{1: 8, 34: 4, 3: 2, 14: 10, 17: 2, 22: 2, 24: 4, 31: 2}
Did not match all atoms present	43036-07-3	CC(=O)NC1=CC=C(C=C1)N.Cl	{1: 1, 14: 4, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	43038-37-5	C1=CC=C(C=C1)OC2=CC=CC=C2C(=O)NN	{24: 1, 30: 1, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	43038-45-5	C1=CC=C2C(=C1)C=CC=C2C(=O)NN	{24: 1, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	43039-98-1	CCC(=O)C1=NC=CS1	{1: 1, 2: 1, 35: 1, 41: 1, 14: 2, 24: 1}
Did not match all atoms present	43042-08-6	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl	{1: 1, 2: 3, 38: 1, 33: 1, 34: 2, 14: 12, 17: 1, 28: 1}
Did not match all atoms present	43043-76-1	C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)[O-].[NH4+]	{23: 1, 28: 1, 13: 1, 14: 10, 21: 1}
Did not match all atoms present	43043-77-2	CC(=O)[O-].CC(=O)[O-].[NH4+].[Cu+]	{24: 2, 1: 2}
Did not match all atoms present	43047-59-2	CC[NH+](CC)CCN1C2=C3C(=C(C=C2)CO)SC4=C(C3=N1)C=CC(=C4)Cl.CS(=O)(=O)[O-]	{1: 3, 2: 5, 35: 1, 33: 1, 41: 1, 14: 5, 17: 1, 20: 1, 29: 3}
Did not match all atoms present	43047-95-6	C1=CC=C(C=C1)CCOC(=O)C2=CC=C(C=C2)Cl	{17: 1, 2: 2, 28: 1, 14: 9}
Did not match all atoms present	43050-28-8	COC1=CC=C(C=C1)C2(CCCC2)C(=O)O	{1: 1, 11: 4, 13: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	43051-43-0	CC(=O)OCCN(CCOC(=O)C)C1=CC=CC(=C1)NC(=O)C2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 14: 9, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	43051-46-3	C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)N(CCO)CCO	{33: 1, 2: 4, 14: 9, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	4306-88-1	CCCCCCCCCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 7, 2: 8, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	43061-75-2	CC[N+]1=C(SC2=CC=CC=C21)C=CN(C3=CC=CC=C3)C(=O)C	{1: 2, 2: 1, 6: 2, 33: 2, 41: 1, 14: 9, 24: 1}
Did not match all atoms present	43069-64-3	C1C=CCC2C1C(=O)N(C2=O)C3=CC=C(C=C3)Cl	{33: 1, 11: 2, 12: 2, 14: 6, 17: 1, 25: 2}
Did not match all atoms present	43071-52-9	CC(=O)C1=CC2=C(O1)C(=CC=C2)OC	{24: 1, 1: 2, 22: 1, 14: 4, 23: 1}
Did not match all atoms present	43072-20-4	CC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N(C)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 4, 14: 1, 33: 1}
Did not match all atoms present	43076-59-1	C1=CSC(=C1)C(=O)CCCCl	{24: 1, 17: 1, 2: 3, 14: 3, 41: 1}
Did not match all atoms present	43076-61-5	CC(C)(C)C1=CC=C(C=C1)C(=O)CCCCl	{1: 3, 2: 3, 4: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	43077-29-8	C[C@@H]1CC[C@H]([C@H](C1)P(C2=CC=CC=C2)C3=CC=CC=C3)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 14: 10}
Did not match all atoms present	43085-16-1	CC12CCC3C(C1CC[C@@H]2OC(=O)NC4=CC=CC=C4)CCC5=C3C=CC(=C5)OC	{1: 2, 11: 6, 12: 4, 13: 1, 14: 8, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	43086-58-4	[15NH3].[15NH3].OS(=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	43086-60-8	[15NH3].[15N+](=O)(O)[O-]	{20: 1}
Did not match all atoms present	43087-91-8	C1=CC=C(C=C1)C2=NC3=C(S2)C=CC(=C3)N	{41: 1, 35: 1, 30: 1, 14: 8}
Did not match all atoms present	43088-42-2	CCOC(=O)C1=C(SC=C1C)N	{1: 2, 2: 1, 41: 1, 14: 1, 28: 1, 30: 1}
Did not match all atoms present	4309-66-4	C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N	{30: 1, 14: 9, 6: 2}
Did not match all atoms present	43095-70-1	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC(=O)C4=CC=CC=C4)C(=O)C5=C(C3=O)C(=CC=C5)NC6=CC=C(C=C6)C	{24: 1, 1: 2, 31: 3, 14: 18, 25: 2}
Did not match all atoms present	43095-98-3	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC4=CC(=CC=C4)Cl)C(=O)C5=CC=CC=C5C3=O	{24: 1, 17: 1, 31: 2, 14: 15, 25: 2}
Did not match all atoms present	43096-12-4	CCCCC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O	{1: 1, 2: 3, 14: 15, 24: 1, 25: 2, 31: 2}
Did not match all atoms present	431-76-5	C[As](C(F)(F)F)C(F)(F)F	{16: 6, 1: 1, 4: 2}
Did not match all atoms present	431-97-0	C(#N)P(C(F)(F)F)C(F)(F)F	{16: 6, 4: 2, 37: 1}
Did not match all atoms present	4310-69-4	CC[NH+](CC[NH2+]C1=C2C=CC3=CC=CC=C3C2=NC4=CC=CC=C41)CCCl.[Cl-].[Cl-]	{1: 1, 2: 5, 35: 1, 14: 10, 17: 3}
Did not match all atoms present	43100-38-5	CC(C)(C)C1=CC=C(C=C1)C(=O)NN	{1: 3, 4: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	43109-72-4	CC1=CC(=C(C=C1)OC)C(C)(C)C	{1: 5, 4: 1, 22: 1, 14: 3}
Did not match all atoms present	43111-31-5	C1=CC=C(C(=C1)OCC#N)Cl	{17: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	43111-32-6	C1=CC(=CC(=C1)Cl)OCC#N	{17: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	43112-38-5	C[Si](C)(C)N1CCOC1=O	{1: 3, 11: 2, 28: 1, 33: 1}
Did not match all atoms present	43115-21-5	CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C4=CC=CC=C43)C5=NC6=C(O5)C=CC(=C6)S(=O)(=O)CC	{1: 2, 2: 2, 35: 2, 14: 12, 23: 2, 29: 4}
Did not match all atoms present	4312-01-0	C1CS[Sn](S1)(C2=CC=CC=C2)C3=CC=CC=C3	{41: 2, 11: 2, 14: 10}
Did not match all atoms present	4312-62-3	CCCCCCC[N+](CCCCCC)(CCCCCC)CCCCCCC.[I-]	{1: 4, 2: 22, 19: 1}
Did not match all atoms present	4312-63-4	CCCCCCC[N+](CCCCCC)(CCCCCC)CCCCCCC.[O-]Cl(=O)(=O)=O	{1: 4, 2: 22, 29: 4, 17: 1}
Did not match all atoms present	4312-65-6	CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[O-]Cl(=O)(=O)=O	{1: 4, 2: 24, 29: 4, 17: 1}
Did not match all atoms present	4312-97-4	C(=CCl)C(=O)O.[Na+]	{17: 1, 27: 1, 6: 2}
Did not match all atoms present	43120-22-5	CCN1C2=CC=CC=C2C=N1	{1: 1, 2: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	43121-43-3	CC(C)(C)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl	{1: 3, 3: 1, 4: 1, 33: 1, 14: 6, 17: 1, 35: 2, 22: 1, 24: 1}
Did not match all atoms present	4313-13-7	CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-])N(C)C	{1: 3, 34: 2, 38: 1, 14: 7, 33: 1}
Did not match all atoms present	43130-12-7	CCN(CC)C1=CC=C(C=C1)C(=N)C2=CC=C(C=C2)N(CC)CC.[N+](=O)(O)[O-]	{1: 4, 2: 4, 36: 1, 33: 2, 7: 1, 14: 8, 20: 1}
Did not match all atoms present	43134-64-1	CCCCCCCCCCCCCCCCCC(=O)O[Al](OC(C)CC)OC(C)CC	{1: 5, 2: 18, 3: 2, 28: 1, 22: 2}
Did not match all atoms present	4314-63-0	CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)N5CCOCC5	{32: 1, 1: 1, 33: 2, 11: 6, 12: 2, 14: 5, 15: 1, 23: 1, 24: 1}
Did not match all atoms present	4314-94-7	C[Sn](C)(C)CC1=CC=CC=C1	{1: 3, 2: 1, 14: 5}
Did not match all atoms present	43143-11-9	C1C=CC=C([N+]1([O-])[O-])SSC2=CC=CC[N+]2([O-])[O-]	{40: 2, 11: 2, 29: 4, 14: 6, 15: 2}
Did not match all atoms present	43145-07-9	C1=CC(=CC(=C1)N=CC2=CN=CC=C2)C(F)(F)F	{34: 1, 35: 1, 4: 1, 6: 1, 14: 8, 16: 3}
Did not match all atoms present	43156-47-4	C1=CC=C(C=C1)SC2=CC(=C(C=C2)[N+](=O)[O-])N	{40: 1, 38: 1, 30: 1, 14: 8}
Did not match all atoms present	4316-23-8	CC1=CC(=C(C=C1)C(=O)O)C(=O)O	{1: 1, 27: 2, 14: 3}
Did not match all atoms present	4316-35-2	CC(C1=CC=CC=C1)(OC)OC	{1: 3, 4: 1, 22: 2, 14: 5}
Did not match all atoms present	4316-37-4	CCOC(C)(C1=CC=CC=C1)OCC	{1: 3, 2: 2, 4: 1, 22: 2, 14: 5}
Did not match all atoms present	4316-58-9	C1=CC(=CC=C1N(C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br)Br	{33: 1, 18: 3, 14: 12}
Did not match all atoms present	4316-66-9	CC[N+](C)(CC)CCOC(=O)C(=C)C.COS(=O)(=O)[O-]	{1: 5, 2: 4, 5: 1, 7: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	4316-73-8	CNCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 1, 31: 1}
Did not match all atoms present	4316-74-9	CNCCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 2, 29: 3, 31: 1}
Did not match all atoms present	4316-93-2	C1=NC(=C(C(=N1)Cl)[N+](=O)[O-])Cl	{17: 2, 35: 2, 38: 1, 14: 1}
Did not match all atoms present	4316-94-3	C1=NC(=C(C(=N1)Cl)[N+](=O)[O-])N	{38: 1, 17: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	4316-98-7	C1=NC(=C(C(=N1)Cl)N)N	{17: 1, 35: 2, 30: 2, 14: 1}
Did not match all atoms present	43165-51-1	C1=CC=C(C=C1)C(=O)C(=O)[O-].[Na+]	{24: 2, 14: 5}
Did not match all atoms present	4317-06-0	CC[P+](CC)(CC)CC.[I-]	{1: 4, 2: 4, 19: 1}
Did not match all atoms present	4317-14-0	C[N+](C)(CCC=C1C2=CC=CC=C2CCC3=CC=CC=C31)[O-]	{1: 2, 2: 2, 6: 1, 11: 2, 14: 8, 15: 1, 29: 1}
Did not match all atoms present	4317-65-1	C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)O)NN=C3C=CC(=O)C=C3O)S(=O)(=O)O	{34: 1, 14: 8, 15: 2, 20: 3, 25: 1, 29: 4, 31: 1}
Did not match all atoms present	4318-68-7	C1=C(C(=C(C=N1)[N+](=O)[O-])N)N	{38: 1, 35: 1, 30: 2, 14: 2}
Did not match all atoms present	4318-76-7	C1=CC(=NC=C1N)N	{35: 1, 30: 2, 14: 3}
Did not match all atoms present	43182-10-1	C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2N	{33: 1, 2: 1, 35: 1, 30: 1, 14: 9}
Did not match all atoms present	43183-36-4	C[Si](C)(C)N1C2=CC=CC=C2N=N1	{1: 3, 35: 2, 14: 4, 33: 1}
Did not match all atoms present	43184-66-3	CC([O-])C.C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Ti+4]	{1: 8, 3: 1, 6: 3, 7: 3, 24: 3, 29: 1}
Did not match all atoms present	4319-02-2	COC1=C(C=C(C=C1O)C(=O)O)O	{1: 1, 22: 1, 27: 1, 21: 2, 14: 2}
Did not match all atoms present	43192-03-6	CC1=C(C=C(C=C1)NO)[N+](=O)[O-]	{1: 1, 20: 1, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	432-01-9	CN(C)P(C(F)(F)F)C(F)(F)F	{16: 6, 1: 2, 4: 2, 33: 1}
Did not match all atoms present	432-02-0	C(F)(F)(F)[As](C(F)(F)F)C(F)(F)F	{16: 9, 4: 3}
Did not match all atoms present	432-04-2	C(F)(F)(F)P(C(F)(F)F)C(F)(F)F	{16: 9, 4: 3}
Did not match all atoms present	432-05-3	C(F)(F)(F)[Sb](C(F)(F)F)C(F)(F)F	{16: 9, 4: 3}
Did not match all atoms present	432-84-8	C1=CC(=CC=C1O)S(=O)(=O)C(F)(F)F	{16: 3, 4: 1, 21: 1, 14: 4, 29: 2}
Did not match all atoms present	43200-80-2	CN1CCN(CC1)C(=O)OC2C3=NC=CN=C3C(=O)N2C4=NC=C(C=C4)Cl	{1: 1, 35: 3, 33: 3, 11: 4, 12: 1, 14: 5, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	4321-69-1	CC(=O)NC1=CC=C(C=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 1, 14: 7, 15: 2, 24: 2, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	43210-67-9	COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC=C3	{32: 1, 1: 1, 35: 1, 40: 1, 14: 8, 28: 1, 31: 1}
Did not match all atoms present	43218-58-2	C(CN(CC(=O)[O-])CC(=O)[O-])N(CCO)CC(=O)[O-].[Fe+2]	{24: 3, 33: 2, 2: 7, 20: 1}
Did not match all atoms present	43222-48-6	CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3=CC=CC=C3.COS(=O)(=O)[O-]	{1: 3, 33: 2, 22: 1, 14: 11, 29: 3}
Did not match all atoms present	43229-80-7	CC(CC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)NC=O)O.CC(CC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)NC=O)O.C(=CC(=O)O)C(=O)O	{1: 4, 2: 4, 3: 4, 6: 2, 14: 14, 20: 2, 21: 2, 22: 2, 26: 2, 27: 2, 31: 4}
Did not match all atoms present	43238-07-9	[H-].[H-].[H-].[Sc+3]	{}
Did not match all atoms present	4325-74-0	C1=CC=C2C=C(C=CC2=C1)C3=CC=CC4=CC=CC=C43	{14: 14}
Did not match all atoms present	4325-85-3	B(O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 22: 3}
Did not match all atoms present	4325-96-6	CC(=O)NC1=CC=CC2=C1/C(=N/NC3=C(C=C(C=C3)[N+](=O)[O-])O)/C(=O)C=C2	{1: 1, 34: 1, 38: 1, 14: 8, 15: 1, 21: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	4328-04-5	C(CO)[N+](CCO)(CCO)CCO	{2: 8, 20: 4}
Did not match all atoms present	4328-13-6	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[Br-]	{1: 4, 2: 20, 18: 1}
Did not match all atoms present	4328-14-7	CCCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[I-]	{1: 4, 2: 21, 19: 1}
Did not match all atoms present	4328-15-8	CCCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[Br-]	{1: 4, 2: 21, 18: 1}
Did not match all atoms present	4328-17-0	C1(=C(C(=C(C(=C1O)[N+](=O)[O-])O)[N+](=O)[O-])O)[N+](=O)[O-]	{21: 3, 38: 3}
Did not match all atoms present	4329-81-1	C1=CC=C(C=C1)NCC2=CC=CC=N2	{2: 1, 35: 1, 14: 9, 31: 1}
Did not match all atoms present	4329-91-3	CC[N+]1=C(C=CC2=CC=CC=C21)S(=O)(=O)[O-]	{1: 1, 2: 1, 29: 3, 14: 6, 33: 1}
Did not match all atoms present	433-06-7	CC1=CC=C(C=C1)S(=O)(=O)OCC(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	433-19-2	C1=CC(=CC=C1C(F)(F)F)C(F)(F)F	{16: 6, 4: 2, 14: 4}
Did not match all atoms present	433-95-4	C1=CC=C(C(=C1)C(F)(F)F)C(F)(F)F	{16: 6, 4: 2, 14: 4}
Did not match all atoms present	433-97-6	C1=CC=C(C(=C1)C(=O)O)C(F)(F)F	{16: 3, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	433-98-7	C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)F	{16: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	4331-22-0	C1CO[C@H]2[C@@H]1C3=C(O2)C=C4C(=C3O)C(=O)C5=C(C=C(C=C5C4=O)O)O	{11: 2, 12: 2, 14: 3, 21: 3, 23: 2, 25: 2}
Did not match all atoms present	4331-29-7	C1=CC2=C(C(=C1)N)N=CN2	{32: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	4331-98-0	[C-](=[C+]N=O)N=O	{34: 2, 29: 2}
Did not match all atoms present	4332-51-8	C1=CC=C(C=C1)CSCCCl	{40: 1, 17: 1, 2: 3, 14: 5}
Did not match all atoms present	4335-09-5	C1=CC(=O)C=CC1=NNC2=CC=C(C=C2)C3=CC=C(C=C3)N/N=C/4\C(=CC5=CC(=C(C(=C5C4=O)N)N=NC6=CC=C(C=C6)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 4, 38: 1, 14: 18, 15: 3, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	4335-90-4	CC(=O)C(=CC1=CC=CC=C1)C(=O)C	{24: 2, 1: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	4336-70-3	C1=CC=C(C=C1)[P+](CC#N)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{17: 1, 2: 1, 37: 1, 14: 15}
Did not match all atoms present	4337-66-0	C1=CC=C(C=C1)C(=O)[O-].C(CO)[NH3+]	{24: 1, 2: 2, 20: 1, 14: 5}
Did not match all atoms present	4338-06-1	C1=CC(=CC=C1N2C(=O)C=CC2=O)[N+](=O)[O-]	{25: 2, 38: 1, 14: 6, 33: 1}
Did not match all atoms present	4339-69-9	C1=COC(=C1)/C(=N\O)/C(=O)C2=CC=CO2	{34: 1, 7: 1, 14: 6, 20: 1, 23: 2, 24: 1}
Did not match all atoms present	434-43-5	CC(C1=CC=CC=C1)C(C)(C)N	{1: 3, 3: 1, 4: 1, 30: 1, 14: 5}
Did not match all atoms present	434-45-7	C1=CC=C(C=C1)C(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 5}
Did not match all atoms present	434-64-0	C1(=C(C(=C(C(=C1F)F)F)F)F)C(F)(F)F	{16: 8, 4: 1}
Did not match all atoms present	434-75-3	C1=CC(=C(C(=C1)Cl)C(=O)O)F	{16: 1, 17: 1, 27: 1, 14: 3}
Did not match all atoms present	434-76-4	C1=CC(=C(C(=C1)F)C(=O)O)N	{16: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	434-85-5	C1=CC=C2C(=C1)C(=C3C4=CC=CC=C4C(=O)C5=CC=CC=C53)C6=CC=CC=C6C2=O	{25: 2, 14: 16, 15: 2}
Did not match all atoms present	434-90-2	C1(=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F	{16: 10}
Did not match all atoms present	4340-77-6	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)Cl	{17: 1, 34: 2, 14: 9}
Did not match all atoms present	4341-27-9	C(CCC1=NC(=NC(=N1)N)N)CC2=NC(=NC(=N2)N)N	{2: 4, 35: 6, 30: 4}
Did not match all atoms present	4341-34-8	C1=CSC(=C1)CC2=CC=CS2	{41: 2, 2: 1, 14: 6}
Did not match all atoms present	4342-08-9	C1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)N)N	{33: 1, 2: 1, 35: 2, 14: 5, 24: 1, 30: 2}
Did not match all atoms present	4342-30-7	CCCC[Sn](CCCC)(CCCC)OC(=O)C1=CC=CC=C1O	{1: 3, 2: 9, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	4342-36-3	CCCC[Sn](CCCC)(CCCC)OC(=O)C1=CC=CC=C1	{1: 3, 2: 9, 28: 1, 14: 5}
Did not match all atoms present	4342-61-4	C[Si](C)([Si](C)(C)Cl)Cl	{1: 4, 17: 2}
Did not match all atoms present	434336-76-2	C.[Fe].[Fe].[Fe]	{}
Did not match all atoms present	43435-60-5	C[SiH]=O	{1: 1, 29: 1}
Did not match all atoms present	4344-55-2	CCCCOC1=CC=C(C=C1)N	{1: 1, 2: 3, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	4345-03-3	CC1=C2C(=C(C(=C1C)OC(=O)CCC(=O)O)C)CC[C@@](O2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C	{1: 8, 2: 11, 3: 3, 11: 2, 13: 1, 23: 1, 27: 1, 28: 1}
Did not match all atoms present	4346-15-0	CCCC(=O)OC1=CNC2=CC=CC=C21	{32: 1, 1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	4346-18-3	CCCC(=O)OC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	4346-51-4	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)N.N	{30: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	4346-64-9	C[Se]C1=CC=CC=C1	{1: 1, 14: 5}
Did not match all atoms present	4348-19-0	CCNC1=CC=CC=C1.Cl	{1: 1, 2: 1, 31: 1, 14: 5, 17: 1}
Did not match all atoms present	435-02-9	C1=CC=C2C=C3C4=C5C(=CC3=CC2=C1)C6=C(C7=CC=CC8=C7C9=C(C=CC=C96)C=C8)C1=CC=CC(=C15)C=C4	{14: 20}
Did not match all atoms present	435-97-2	CCC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O	{1: 1, 2: 1, 3: 1, 14: 9, 21: 1, 28: 1}
Did not match all atoms present	4350-09-8	C1=CC2=C(C=C1O)C(=CN2)C[C@@H](C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	4350-41-8	C1=CC=NC(=C1)CC2=CC=C(C=C2)Cl	{17: 1, 2: 1, 35: 1, 14: 8}
Did not match all atoms present	4351-54-6	C1CCC(CC1)OC=O	{26: 1, 11: 5, 12: 1}
Did not match all atoms present	4351-55-7	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC=O)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 26: 1}
Did not match all atoms present	4351-70-6	CC(OP(=O)(C(C)OP(=O)(CCCl)OCCCl)OCCCl)P(=O)(OCCCl)OCCCl	{1: 2, 2: 10, 3: 2, 17: 5, 22: 6, 29: 3}
Did not match all atoms present	4353-77-9	C[Si](C)(C)OS(=O)(=O)Cl	{1: 3, 29: 2, 22: 1, 17: 1}
Did not match all atoms present	4354-45-4	CN1CCCC(C1)OC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O	{1: 1, 4: 1, 33: 1, 11: 9, 12: 2, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	4354-76-1	COC1=CC(=CC(=C1OC)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O	{1: 3, 11: 2, 12: 4, 14: 4, 20: 1, 22: 3, 23: 2, 28: 1}
Did not match all atoms present	4356-47-2	COC1=C(C=C2C(NCCC2=C1)CO)OC	{32: 1, 1: 2, 2: 1, 11: 2, 12: 1, 14: 2, 20: 1, 22: 2}
Did not match all atoms present	4358-26-3	c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1	{14: 20}
Did not match all atoms present	4358-87-6	COC(=O)C(C1=CC=CC=C1)O	{1: 1, 3: 1, 20: 1, 14: 5, 28: 1}
Did not match all atoms present	4358-88-7	CCOC(=O)C(C1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	436-05-5	CN1CCC2=CC(=C3C=C2[C@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)O)O3)N(CCC6=CC(=C5O)OC)C)OC	{1: 4, 33: 2, 11: 6, 12: 2, 14: 10, 21: 2, 22: 2, 23: 2}
Did not match all atoms present	436-30-6	CC1=C2C=C(C=CC2=NC3=C1C4=CC=CC=C4C=C3)F	{16: 1, 1: 1, 35: 1, 14: 9}
Did not match all atoms present	4360-12-7	CCC1C2CC3C4C5(CC(C2C5O)N3C1O)C6=CC=CC=C6N4C	{1: 2, 2: 1, 33: 2, 11: 2, 12: 8, 13: 1, 14: 4, 20: 2}
Did not match all atoms present	4360-47-8	C1=CC=C(C=C1)C=CC#N	{14: 5, 6: 2, 37: 1}
Did not match all atoms present	4361-80-2	CCN(CC)CCCOC(=O)C=CC1=CC=CC=C1	{1: 2, 2: 5, 6: 2, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	4361-84-6	CCCCN(CCCl)C1=CC=C(C=C1)C=C(C#N)C(=O)OCC	{1: 2, 2: 6, 33: 1, 6: 1, 7: 1, 14: 4, 17: 1, 28: 1, 37: 1}
Did not match all atoms present	4362-20-3	C1C(OC(O1)CC2=CC=CC=C2)C3=CC=CC=C3	{2: 1, 11: 1, 12: 2, 14: 10, 23: 2}
Did not match all atoms present	4363-03-5	C1=CC=C(C=C1)C2=CC(=C(C=C2)N)O	{30: 1, 21: 1, 14: 8}
Did not match all atoms present	4363-04-6	C1=CC2=C(C=CC(=C2)O)C=C1N	{30: 1, 21: 1, 14: 6}
Did not match all atoms present	4363-25-1	C1CN2CCC1C3=CC=CC=C32	{33: 1, 11: 4, 12: 1, 14: 4}
Did not match all atoms present	4363-93-3	C1=CC=C2C(=C1)C(=CC=N2)C=O	{26: 1, 35: 1, 14: 6}
Did not match all atoms present	4364-06-1	COC(/C=C/C1=CC=CC=C1)OC	{1: 2, 22: 2, 3: 1, 14: 5, 6: 2}
Did not match all atoms present	4365-04-2	C1=CC=C(C=C1)C=CO	{20: 1, 14: 5, 6: 2}
Did not match all atoms present	4366-50-1	CCN(C1=CC=CC2=CC=CC=C21)C(=S)N	{1: 1, 2: 1, 33: 1, 7: 1, 14: 7, 30: 1}
Did not match all atoms present	4368-51-8	CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC.[Br-]	{1: 4, 2: 24, 18: 1}
Did not match all atoms present	4368-56-3	C1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+]	{11: 5, 12: 1, 14: 5, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	4368-68-7	C1=CC=C(C=C1)CN2C=CN=N2	{33: 1, 2: 1, 35: 2, 14: 7}
Did not match all atoms present	4368-83-6	CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O	{1: 1, 38: 1, 14: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	4369-14-6	CO[Si](CCCOC(=O)C=C)(OC)OC	{1: 3, 2: 3, 5: 1, 6: 1, 22: 3, 28: 1}
Did not match all atoms present	437-17-2	C1=CC=C(C=C1)[C+](C2=CC=CC=C2)C3=CC=CC=C3.F[P-](F)(F)(F)(F)F	{16: 6, 14: 15, 7: 1}
Did not match all atoms present	437-38-7	CCC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 3, 33: 2, 11: 4, 12: 1, 14: 10, 24: 1}
Did not match all atoms present	437-50-3	COC1=CC(=C2C(=C1)OC3=C(C2=O)C=C(C=C3)O)O	{1: 1, 14: 5, 21: 2, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	437-74-1	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CN(C)CCO)O.C1=CC(=CN=C1)C(=O)O	{1: 3, 2: 4, 3: 1, 33: 4, 14: 5, 35: 2, 20: 2, 25: 2, 27: 1}
Did not match all atoms present	437-81-0	C1=CC(=C(C(=C1)F)C=O)F	{16: 2, 26: 1, 14: 3}
Did not match all atoms present	437-83-2	COC1=C(C=CC=C1F)N	{16: 1, 1: 1, 30: 1, 22: 1, 14: 3}
Did not match all atoms present	4370-81-4	CC(CO)(C1=CC=CC=C1)C(=O)O	{1: 1, 2: 1, 4: 1, 14: 5, 20: 1, 27: 1}
Did not match all atoms present	4371-23-7	C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N	{30: 1, 29: 2, 14: 9}
Did not match all atoms present	4371-31-7	C1=CC(=C(C=C1O)O)C2=C(C=C(C=C2)O)O	{21: 4, 14: 6}
Did not match all atoms present	4371-46-4	CC1=C(C=C(C=C1)O)C(C)C	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	4371-48-6	CC1=C(C=CC=C1O)C(C)C	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	4371-50-0	CC1=CC=C(C=C1)C(C)CO	{1: 2, 2: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	4372-46-7	CCCCCCCCCCCCCCCC(=O)OCC1=CN=C(C(=C1COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)C	{1: 4, 2: 44, 35: 1, 28: 3, 14: 1}
Did not match all atoms present	4373-13-1	CC1=CCCC2=CC=CC=C12	{1: 1, 11: 2, 14: 5, 15: 1}
Did not match all atoms present	4375-83-1	B(N(C)C)(N(C)C)N(C)C	{1: 6, 33: 3}
Did not match all atoms present	4376-18-5	COC(=O)C1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	4376-20-9	CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)O	{1: 2, 2: 5, 3: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	4377-37-1	C1=CC=NC(=C1)C(Cl)(Cl)Cl	{17: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	4378-36-3	CCC(C1=CC=CC=C1)C(=O)OCCN2CCOC(C2C)C3=CC=CC=C3	{1: 2, 2: 3, 3: 1, 33: 1, 11: 2, 12: 2, 14: 10, 23: 1, 28: 1}
Did not match all atoms present	4378-73-8	C1CS(O1)([O-])[O-]	{11: 2, 29: 2, 23: 1}
Did not match all atoms present	4379-85-5	CCCCN(CCCC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CCCC)CCCC)C3=CC=C(C=C3)N(C4=CC=C(C=C4)N(CCCC)CCCC)C5=CC=C(C=C5)N(CCCC)CCCC.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sb]	{1: 8, 2: 24, 33: 6, 14: 20, 17: 6}
Did not match all atoms present	438-60-8	CNCCCC1C2=CC=CC=C2C=CC3=CC=CC=C13	{1: 1, 2: 3, 12: 1, 14: 10, 31: 1}
Did not match all atoms present	4381-02-6	C1=CC(=CC=C1CCC2=CC=C(C=C2)C#N)C#N	{2: 2, 37: 2, 14: 8}
Did not match all atoms present	4381-25-3	CS(=N)(=O)C1=CC=CC=C1	{1: 1, 36: 1, 29: 1, 14: 5}
Did not match all atoms present	4382-54-1	COC1=CC2=C(C=C1)NC(=C2)C(=O)O	{32: 1, 1: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	4382-75-6	COCOC=O	{1: 1, 2: 1, 26: 1, 22: 1}
Did not match all atoms present	4383-05-5	COC1=CC=CC(=C1O)CO	{1: 1, 2: 1, 14: 3, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	4383-06-6	COC1=C(C=C(C=C1)CO)O	{1: 1, 2: 1, 14: 3, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	4383-08-8	CC(=C)C(C1=CC=CC=C1)O	{1: 1, 3: 1, 5: 1, 7: 1, 14: 5, 20: 1}
Did not match all atoms present	4383-11-3	CC(C)C(C)(C1=CC=CC=C1)O	{1: 3, 3: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	4383-15-7	C=C(C1=CC=CC=C1)O	{20: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	4383-18-0	CCCC(C)(C1=CC=CC=C1)O	{1: 2, 2: 2, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	4383-22-6	C=CCNCC1=CC=CC=C1	{2: 2, 14: 5, 5: 1, 6: 1, 31: 1}
Did not match all atoms present	4384-23-0	C1CCCC2=CC=C(CCCCCCC3=CC=C(CC1)C=C3)C=C2	{11: 12, 14: 8}
Did not match all atoms present	4384-81-0	C(=S)(N)[S-].[Na+]	{30: 1, 7: 1}
Did not match all atoms present	4384-92-3	C1=CC2=C(C=C(C=C2)N)C(=C1)O	{30: 1, 21: 1, 14: 6}
Did not match all atoms present	4385-56-2	COC1=CC(=CC(=C1O)OC)CC(=O)O	{1: 2, 2: 1, 14: 2, 21: 1, 22: 2, 27: 1}
Did not match all atoms present	4386-79-2	CC1OCC(O1)C[N+](C)(C)C.[I-]	{1: 4, 2: 1, 11: 1, 12: 2, 19: 1, 23: 2}
Did not match all atoms present	4387-13-7	C(C=O)[Hg]CC=O	{2: 2, 26: 2}
Did not match all atoms present	4388-22-1	C1=CC=C(C=C1)S(=O)(=O)SS(=O)(=O)C2=CC=CC=C2	{40: 1, 29: 4, 14: 10}
Did not match all atoms present	4388-82-3	CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.C[C@@H](CC1CCCCC1)NC	{32: 2, 1: 3, 2: 2, 3: 1, 11: 5, 12: 1, 13: 1, 14: 5, 25: 3, 31: 1}
Did not match all atoms present	4389-09-7	C1CC2=CC=CC3=C2C(=CC4=CC=CC=C34)C1	{11: 3, 14: 8}
Did not match all atoms present	4389-45-1	CC1=CC=CC(=C1N)C(=O)O	{1: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	4389-50-8	CC1=C(C(=CC=C1)N)C(=O)O	{1: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	4389-53-1	CC1=C(C(=C(C=C1)C(C)C)C(=O)O)O	{27: 1, 1: 3, 3: 1, 21: 1, 14: 2}
Did not match all atoms present	439-14-5	CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3	{1: 1, 35: 1, 33: 1, 11: 1, 14: 8, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	439-25-8	CC1=C2C=CC=C(C2=NC3=C1C=CC4=CC=CC=C43)F	{16: 1, 1: 1, 35: 1, 14: 9}
Did not match all atoms present	4390-16-3	C1C(=O)NC(=O)[N-]C1=O.[Na+]	{32: 1, 25: 3, 11: 1, 35: 1}
Did not match all atoms present	4392-24-9	C1=CC=C(C=C1)C=CCBr	{2: 1, 18: 1, 14: 5, 6: 2}
Did not match all atoms present	4392-30-7	C1CC(C1)C2=CC=CC=C2	{11: 3, 12: 1, 14: 5}
Did not match all atoms present	4393-05-9	CC1=CC(=C(C=C1C)CO)C	{1: 3, 2: 1, 20: 1, 14: 2}
Did not match all atoms present	4393-06-0	C=CC(C1=CC=CC=C1)O	{14: 5, 3: 1, 20: 1, 5: 1, 6: 1}
Did not match all atoms present	4393-09-3	COC1=CC=CC(=C1OC)CN	{1: 2, 2: 1, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	4394-00-7	C1=CC(=CC(=C1)NC2=C(C=CC=N2)C(=O)O)C(F)(F)F	{35: 1, 4: 1, 14: 7, 16: 3, 27: 1, 31: 1}
Did not match all atoms present	4394-11-0	C1=CC(=CN=C1)C2=CC=NC=C2	{35: 2, 14: 8}
Did not match all atoms present	4395-65-7	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O	{25: 2, 30: 1, 14: 11, 31: 1}
Did not match all atoms present	4395-73-7	CC(C)C1=CC=C(C=C1)CN	{1: 2, 2: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	4395-79-3	CC1=C(C=C(C=C1)C(C)C)Cl	{1: 3, 3: 1, 14: 3, 17: 1}
Did not match all atoms present	4395-80-6	CC1=CC(=C(C=C1)C(C)C)Cl	{1: 3, 3: 1, 14: 3, 17: 1}
Did not match all atoms present	4395-87-3	CC(C)C1=CC=C(C=C1)CC#N	{1: 2, 2: 1, 3: 1, 37: 1, 14: 4}
Did not match all atoms present	4395-92-0	CC(C)C1=CC=C(C=C1)CC=O	{1: 2, 2: 1, 3: 1, 26: 1, 14: 4}
Did not match all atoms present	4396-06-9	CCCCCCCCOP(=O)(O)OCCC(C)C	{1: 3, 2: 9, 3: 1, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	4396-98-9	CCCCC(C)(C1=CC=CC=C1)O	{1: 2, 2: 3, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	4397-53-9	C1=CC=C(C=C1)COC2=CC=C(C=C2)C=O	{2: 1, 26: 1, 22: 1, 14: 9}
Did not match all atoms present	4399-55-7	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC5=C6C=CC(=CC6=C(C=C5)N/N=C\7/C(=CC8=C(C7=O)C=CC(=C8)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 5, 14: 20, 15: 2, 25: 1, 29: 12, 30: 1, 31: 1}
Did not match all atoms present	440-17-5	CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.Cl.Cl	{1: 1, 2: 3, 4: 1, 33: 3, 41: 1, 11: 4, 14: 7, 16: 3, 17: 2}
Did not match all atoms present	440-29-9	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)C(F)(F)F)Cl)/C2=O	{34: 1, 4: 1, 14: 13, 15: 2, 16: 3, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	440-58-4	CC(=O)NCC1=C(C(=C(C(=C1I)C(=O)O)I)NC(=O)C)I	{1: 2, 2: 1, 19: 3, 24: 2, 27: 1, 31: 2}
Did not match all atoms present	440-60-8	C(C1=C(C(=C(C(=C1F)F)F)F)F)O	{16: 5, 2: 1, 20: 1}
Did not match all atoms present	4400-01-5	C=C[O]	{5: 1, 6: 1}
Did not match all atoms present	4401-71-2	CC1=CN(C(=O)N(C1=O)C)C	{1: 3, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	4403-69-4	C1=CC=C(C(=C1)CN)N	{2: 1, 30: 2, 14: 4}
Did not match all atoms present	4403-71-8	C1=CC(=CC=C1CN)N	{2: 1, 30: 2, 14: 4}
Did not match all atoms present	4403-89-8	CC1=CC(=C(C=C1)NC2=C3C(=C(C(=C2)C)N)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)[O-].[Na+]	{1: 2, 14: 8, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	4403-90-1	CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)C)S(=O)(=O)[O-])C(=O)C5=CC=CC=C5C3=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 31: 2, 29: 6, 14: 12, 25: 2}
Did not match all atoms present	44030-61-7	O=P([O-])(O)F	{16: 1, 20: 1, 29: 2}
Did not match all atoms present	4404-39-1	CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N.[Na+]	{1: 2, 36: 1, 14: 11, 15: 5, 24: 1, 25: 1, 29: 5, 31: 3}
Did not match all atoms present	4404-45-9	CCCCCCN=C=S	{8: 1, 1: 1, 2: 5, 34: 1}
Did not match all atoms present	4404-51-7	CCC(C)CN=C=S	{8: 1, 1: 2, 2: 2, 3: 1, 34: 1}
Did not match all atoms present	4405-18-9	C1COC(O1)C2=CC3=C(C=C2)OCO3	{11: 3, 12: 1, 14: 3, 23: 4}
Did not match all atoms present	4405-33-8	C[Si](C)(C)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 38: 1, 14: 4}
Did not match all atoms present	4406-41-1	CC(C)C(=O)NC1=CC=CC=C1	{24: 1, 1: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	4406-77-3	B1(OCCCO1)C2=CC=CC=C2	{11: 3, 14: 5, 23: 2}
Did not match all atoms present	4406-87-5	C1CC2=CC=C(C3=C(C=CC1=C23)[N+](=O)[O-])[N+](=O)[O-]	{11: 2, 38: 2, 14: 4}
Did not match all atoms present	4408-60-0	CC1=CC(=C(C(=C1)C)CC(=O)O)C	{1: 3, 2: 1, 27: 1, 14: 2}
Did not match all atoms present	4408-78-0	C(C(=O)O)P(=O)(O)O	{2: 1, 27: 1, 20: 2, 29: 1}
Did not match all atoms present	4409-11-4	C1=CC(=CC=C1CC2=CC=NC=C2)Cl	{17: 1, 2: 1, 35: 1, 14: 8}
Did not match all atoms present	4409-98-7	C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].[K+].[K+]	{24: 2, 14: 4}
Did not match all atoms present	441-30-5	CC(=O)NC1=C(C=C(C=C1[N+](=O)[O-])F)F	{1: 1, 38: 1, 14: 2, 16: 2, 24: 1, 31: 1}
Did not match all atoms present	441-38-3	C1=CC=C(C=C1)C(/C(=N/O)/C2=CC=CC=C2)O	{34: 1, 3: 1, 20: 2, 14: 10, 7: 1}
Did not match all atoms present	441-61-2	CCN(C)C(C)C=C(C1=CC=CS1)C2=CC=CS2	{1: 3, 2: 1, 3: 1, 33: 1, 6: 1, 7: 1, 41: 2, 14: 6}
Did not match all atoms present	4410-31-5	C1=CC=C(C=C1)C(C(=O)N)O	{24: 1, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	4410-48-4	CC[C@@H]1[C@H](N2[C@H]3CC1C4[C@@H]2CC5([C@H]3N(C6=CC=CC=C65)C)[C@@H]4O)O.Cl	{1: 2, 2: 1, 33: 2, 11: 2, 12: 8, 13: 1, 14: 4, 17: 1, 20: 2}
Did not match all atoms present	4410-99-5	C1=CC=C(C=C1)CCS	{2: 2, 14: 5, 39: 1}
Did not match all atoms present	441044-14-0	CC(C)(C)OC(=O)N1CC[C@@H](C[C@H]1C(=O)[O-])O	{1: 3, 4: 1, 33: 1, 11: 3, 12: 2, 20: 1, 24: 1, 28: 1}
Did not match all atoms present	4411-26-1	C1C2CC3CC1CC(C2)(C3)N=C=S	{8: 1, 34: 1, 11: 6, 12: 3, 13: 1}
Did not match all atoms present	4411-89-6	CC=C(C=O)C1=CC=CC=C1	{1: 1, 26: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	4412-91-3	C1=COC=C1CO	{2: 1, 20: 1, 14: 3, 23: 1}
Did not match all atoms present	4412-96-8	CC1=C(OC=C1)C(=O)O	{1: 1, 27: 1, 14: 2, 23: 1}
Did not match all atoms present	4413-16-5	CC(C1CCCCC1)C2=CC=CC=C2	{11: 5, 1: 1, 3: 1, 12: 1, 14: 5}
Did not match all atoms present	4413-31-4	CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)C(Cl)(Cl)Cl	{1: 2, 3: 1, 4: 1, 14: 8, 17: 3}
Did not match all atoms present	4413-48-3	COC1=CC2=NON=C2C=C1	{1: 1, 35: 2, 22: 1, 14: 3, 23: 1}
Did not match all atoms present	4414-79-3	C1=CC=C2C(=C1)C=CN2CCC#N	{33: 1, 2: 2, 37: 1, 14: 6}
Did not match all atoms present	4414-88-4	C1=CC=C2C(=C1)NC(=N2)CC#N	{32: 1, 2: 1, 35: 1, 37: 1, 14: 4}
Did not match all atoms present	4415-51-4	C1CN(CCN1CCOC(=O)/C=C/C2=CC=CC=N2)C3=CC=C(C=C3)Cl	{33: 2, 2: 2, 35: 1, 6: 2, 11: 4, 14: 8, 17: 1, 28: 1}
Did not match all atoms present	4418-26-2	CC1=CC(=O)/C(=C(/C)\[O-])/C(=O)O1.[Na+]	{1: 2, 7: 1, 14: 1, 15: 2, 25: 1, 28: 1}
Did not match all atoms present	4418-61-5	C1(=NNN=N1)N	{32: 1, 35: 3, 30: 1}
Did not match all atoms present	4418-66-0	CC1=CC(=CC(=C1SC2=C(C=C(C=C2C)Cl)O)O)Cl	{40: 1, 1: 2, 21: 2, 14: 4, 17: 2}
Did not match all atoms present	4419-47-0	CC[N-]CC.CC[N-]CC.CC[N-]CC.CC[N-]CC.[Ti+4]	{1: 8, 2: 8, 34: 4}
Did not match all atoms present	442-16-0	CCOC1=CC2=C(C3=C(C=C(C=C3)N)N=C2C=C1)N	{1: 1, 2: 1, 35: 1, 14: 6, 22: 1, 30: 2}
Did not match all atoms present	442-51-3	CC1=NC=CC2=C1NC3=C2C=CC(=C3)OC	{32: 1, 1: 2, 35: 1, 22: 1, 14: 5}
Did not match all atoms present	442-52-4	C1CCN(C1)CC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl	{33: 2, 2: 2, 35: 1, 11: 4, 14: 8, 17: 1}
Did not match all atoms present	4420-74-0	CO[Si](CCCS)(OC)OC	{1: 3, 2: 3, 22: 3, 39: 1}
Did not match all atoms present	4420-79-5	C1=C(C(=CC(=C1O)CN(CCCl)CCCl)O)CN(CCCl)CCCl	{17: 4, 2: 10, 21: 2, 14: 2, 33: 2}
Did not match all atoms present	4421-04-9	CNC1=NC(=NC2=C1NC=N2)N	{32: 1, 1: 1, 35: 3, 14: 1, 30: 1, 31: 1}
Did not match all atoms present	4421-09-4	C1OC2=C(O1)C=C(C=C2)C#N	{11: 1, 37: 1, 14: 3, 23: 2}
Did not match all atoms present	4421-21-0	CCOC1=CC=C(C=C1)N(C)C2=CC=C(C=C2)C=C(C#N)C(=O)OCC	{1: 3, 2: 2, 33: 1, 6: 1, 7: 1, 14: 8, 22: 1, 28: 1, 37: 1}
Did not match all atoms present	4422-95-1	C1=C(C=C(C=C1C(=O)Cl)C(=O)Cl)C(=O)Cl	{24: 3, 17: 3, 14: 3}
Did not match all atoms present	4423-49-8	C1=CC=C2C(=C1)C3C4=CC=CC=C4C2(C5=CC=CC=C35)C(=O)O	{27: 1, 12: 1, 13: 1, 14: 12}
Did not match all atoms present	4424-00-4	C1=CC=C(C=C1)CO[Si](OCC2=CC=CC=C2)(OCC3=CC=CC=C3)OCC4=CC=CC=C4	{2: 4, 22: 4, 14: 20}
Did not match all atoms present	4424-06-0	C1=CC=C2C(=C1)N=C3N2C(=O)C4=CC=C5C6=C(C=CC3=C46)C(=O)N7C5=NC8=CC=CC=C87	{25: 2, 35: 2, 14: 12, 33: 2}
Did not match all atoms present	4424-17-3	C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2N	{24: 1, 30: 1, 14: 9, 31: 1}
Did not match all atoms present	4425-78-9	CCN(CC)CCC(=O)OC1C2=CC=CC=C2C3=CC=CC=C13	{1: 2, 2: 4, 33: 1, 12: 1, 14: 8, 28: 1}
Did not match all atoms present	4425-97-2	C1=CC=C2C(=C1)C3=CC=CC=C3C2(CCC#N)CCC#N	{2: 4, 13: 1, 14: 8, 37: 2}
Did not match all atoms present	4426-47-5	B(CCCC)(O)O	{1: 1, 2: 3, 20: 2}
Did not match all atoms present	4426-51-1	CC1CCOS(=O)O1	{1: 1, 11: 2, 12: 1, 29: 1, 23: 2}
Did not match all atoms present	4426-70-4	CN=C=[Se]	{8: 1, 1: 1, 34: 1}
Did not match all atoms present	4426-75-9	C1CSCC2=CC=CC=C21	{41: 1, 11: 3, 14: 4}
Did not match all atoms present	4426-79-3	CCC(C)N=C=S	{8: 1, 1: 2, 2: 1, 3: 1, 34: 1}
Did not match all atoms present	4426-83-9	CCCCCCCN=C=S	{8: 1, 1: 1, 2: 6, 34: 1}
Did not match all atoms present	4426-87-3	CCCCCCCCCCCCCCCCN=C=S	{8: 1, 1: 1, 2: 15, 34: 1}
Did not match all atoms present	4427-56-9	CC1=CC(=C(C=C1)O)C(C)C	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	4427-96-7	C=CC1COC(=O)O1	{11: 1, 12: 1, 5: 1, 6: 1}
Did not match all atoms present	4427-97-8	C1CCC(CC1)OC(=O)OC2CCCCC2	{11: 10, 12: 2}
Did not match all atoms present	4428-13-1	C1=CC=C(C=C1)CC(C2=CC=CC=C2)(C3=CC=CC=C3)O	{20: 1, 2: 1, 4: 1, 14: 15}
Did not match all atoms present	4428-95-9	C(=O)(O)P(=O)(O)O	{27: 1, 20: 2, 29: 1}
Did not match all atoms present	443-26-5	CCOC(=O)C1=CC=CC=C1F	{16: 1, 1: 1, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	443-30-1	CN(C)C1=CC=C(C=C1)C=C2C=CC3=CC=CC=C32	{1: 2, 33: 1, 14: 10, 6: 1, 15: 1}
Did not match all atoms present	443-48-1	CC1=NC=C(N1CCO)[N+](=O)[O-]	{1: 1, 2: 2, 35: 1, 38: 1, 33: 1, 14: 1, 20: 1}
Did not match all atoms present	443-72-1	CNC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 35: 3, 14: 2, 31: 1}
Did not match all atoms present	443-82-3	CC1=C(C(=CC=C1)F)C	{16: 1, 1: 2, 14: 3}
Did not match all atoms present	443-83-4	CC1=C(C=CC=C1Cl)F	{16: 1, 1: 1, 14: 3, 17: 1}
Did not match all atoms present	443-84-5	CC1=C(C=CC=C1F)F	{16: 2, 1: 1, 14: 3}
Did not match all atoms present	443-86-7	CC1=C(C=CC=C1F)N	{16: 1, 1: 1, 30: 1, 14: 3}
Did not match all atoms present	443-88-9	CC1=C(C(=CC=C1)C)F	{16: 1, 1: 2, 14: 3}
Did not match all atoms present	4430-09-5	CCCCCCN(CCCCCC)C1=CC=CC=C1	{1: 2, 2: 10, 14: 5, 33: 1}
Did not match all atoms present	4430-20-0	C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC(=C(C=C3)O)Cl)C4=CC(=C(C=C4)O)Cl	{13: 1, 14: 10, 17: 2, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	4430-25-5	C1=C(C=C(C(=C1Br)O)Br)C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)S(=O)(=O)O2)C4=CC(=C(C(=C4)Br)O)Br	{13: 1, 14: 4, 18: 8, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	4430-29-9	C1C2=CC=CC=C2C3=C4C1=CC=C5C4=C(C=C3)C6=CC=C7CC8=CC=CC=C8C9=C7C6=C5C=C9	{11: 2, 14: 16}
Did not match all atoms present	4430-43-7	CCCCCCCCCN=C=S	{8: 1, 1: 1, 2: 8, 34: 1}
Did not match all atoms present	4430-47-1	C1OC2=C(O1)C=C(C=C2)CN=C=S	{2: 1, 8: 1, 11: 1, 34: 1, 14: 3, 23: 2}
Did not match all atoms present	4430-51-7	C(CCN=C=S)CN=C=S	{8: 2, 2: 4, 34: 2}
Did not match all atoms present	4430-55-1	COC1=C2C3=C4C(=C(C=C5C4=C(C=C3)C(=O)C6=CC=CC=C65)OC)C7=C2C8=C(C=C7)C(=O)C9=CC=CC=C9C8=C1	{1: 2, 22: 2, 14: 14, 25: 2}
Did not match all atoms present	4431-00-9	C1=CC(=C(C=C1C(=C2C=CC(=O)C(=C2)C(=O)O)C3=CC(=C(C=C3)O)C(=O)O)C(=O)O)O	{7: 1, 14: 9, 15: 2, 21: 2, 25: 1, 27: 3}
Did not match all atoms present	4431-24-7	C1=CC=C(C=C1)[As](CC[As](C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 2, 14: 20}
Did not match all atoms present	4431-47-4	COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=CC=C3)O	{1: 1, 14: 7, 21: 2, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	4432-31-9	C1COCCN1CCS(=O)(=O)O	{33: 1, 2: 2, 11: 4, 20: 1, 23: 1, 29: 2}
Did not match all atoms present	4432-34-2	C1COCCN1CC(C2=CC=CC=C2)O	{33: 1, 2: 1, 3: 1, 11: 4, 14: 5, 20: 1, 23: 1}
Did not match all atoms present	4432-72-8	C1CC2=CC=C(CCC3=CC=C1C=C3)C4=CC=CC=C24	{11: 4, 14: 10}
Did not match all atoms present	4433-10-7	CC1=CC(=C(C=C1)C2=CC=CC=C2)C	{1: 2, 14: 8}
Did not match all atoms present	4433-11-8	CC1=C(C=C(C=C1)C2=CC=CC=C2)C	{1: 2, 14: 8}
Did not match all atoms present	4433-16-3	C1=C(C=C(C(=C1[N+](=O)[O-])C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 6, 14: 4}
Did not match all atoms present	4433-30-1	CCCCCCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 9, 14: 5}
Did not match all atoms present	4433-40-3	C1=C(C(=O)NC(=O)N1)CO	{32: 2, 25: 2, 2: 1, 20: 1, 14: 1}
Did not match all atoms present	4433-63-0	B(CC)(O)O	{1: 1, 2: 1, 20: 2}
Did not match all atoms present	4433-78-7	CC(=O)CC(=O)NC1=CC=C(C=C1)NC(=O)C	{24: 3, 1: 2, 2: 1, 14: 4, 31: 2}
Did not match all atoms present	4433-79-8	CC(=O)CC(=O)NC1=CC(=C(C=C1OC)Cl)OC	{1: 3, 2: 1, 14: 2, 17: 1, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	4433-80-1	CC(=O)CC(=O)NC1=CC=C(C=C1)N2CCOCC2	{1: 1, 2: 1, 33: 1, 11: 4, 14: 4, 23: 1, 24: 2, 31: 1}
Did not match all atoms present	4434-05-3	CC1=CC=C(N1)C(=O)O[C@H]2[C@H]([C@@H](OC([C@@H]2OC)(C)C)OC3=C(C4=C(C=C3)C(=C(C(=O)O4)NC(=O)C5=CNC(=C5C)C(=O)NC6=C(C7=C(C(=C(C=C7)O[C@H]8[C@@H]([C@@H]([C@H](C(O8)(C)C)OC)OC(=O)C9=CC=C(N9)C)O)C)OC6=O)O)O)C)O	{32: 3, 1: 11, 12: 8, 13: 2, 14: 9, 20: 2, 21: 2, 22: 4, 23: 2, 24: 2, 28: 4, 31: 2}
Did not match all atoms present	4436-24-2	C1C(O1)CC2=CC=CC=C2	{2: 1, 11: 1, 12: 1, 14: 5, 23: 1}
Did not match all atoms present	4436-30-0	CCCCCC1(OC2=CC=CC=C2O1)C	{1: 2, 2: 4, 13: 1, 14: 4, 23: 2}
Did not match all atoms present	4437-18-7	C1=COC(=C1)CBr	{2: 1, 18: 1, 14: 3, 23: 1}
Did not match all atoms present	4437-20-1	C1=COC(=C1)CSSCC2=CC=CO2	{40: 2, 2: 2, 14: 6, 23: 2}
Did not match all atoms present	4437-22-3	C1=COC(=C1)COCC2=CC=CO2	{2: 2, 22: 1, 14: 6, 23: 2}
Did not match all atoms present	4437-23-4	C1=CC=C(C=C1)OCC2=CC=CO2	{2: 1, 22: 1, 14: 8, 23: 1}
Did not match all atoms present	4437-69-8	CC1(COC(=O)O1)C	{1: 2, 11: 1, 13: 1}
Did not match all atoms present	4437-80-3	CC1(C(=C)OC(=O)O1)C	{1: 2, 15: 1, 5: 1, 13: 1}
Did not match all atoms present	4437-85-8	CCC1COC(=O)O1	{1: 1, 2: 1, 11: 1, 12: 1}
Did not match all atoms present	4438-16-8	CC1=CC(=C(C=C1N)N)N=NC2=CC=CC=C2.Cl	{1: 1, 34: 2, 30: 2, 14: 7, 17: 1}
Did not match all atoms present	4438-47-5	C[Si](C)(C)CN(C[Si](C)(C)C)C[Si](C)(C)C	{1: 9, 2: 3, 33: 1}
Did not match all atoms present	4439-02-5	C1OC2=C(O1)C=C(C=C2)CC#N	{2: 1, 11: 1, 37: 1, 14: 3, 23: 2}
Did not match all atoms present	444-14-4	C1=C(C=C(C(=C1F)N)Br)F	{16: 2, 18: 1, 30: 1, 14: 2}
Did not match all atoms present	444-29-1	C1=CC=C(C(=C1)C(F)(F)F)I	{16: 3, 19: 1, 4: 1, 14: 4}
Did not match all atoms present	444-30-4	C1=CC=C(C(=C1)C(F)(F)F)O	{16: 3, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	4441-01-4	C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3	{24: 2, 2: 1, 3: 1, 14: 15}
Did not match all atoms present	4441-17-2	C1CCN(CC1)P(=O)(N2CCCCC2)N3CCCCC3	{33: 3, 11: 15, 29: 1}
Did not match all atoms present	4443-43-0	B(C)(C)OC	{1: 3, 22: 1}
Did not match all atoms present	4443-46-3	B(CCC)(CCC)SC1=CC=CC=C1	{40: 1, 1: 2, 2: 4, 14: 5}
Did not match all atoms present	4443-91-8	C1=CC=C2C=CC(=O)C=CC2=C1	{25: 1, 14: 8}
Did not match all atoms present	4444-23-9	C1=C(C(=CC(=C1S(=O)(=O)O)O)S(=O)(=O)O)O	{20: 2, 21: 2, 14: 2, 29: 4}
Did not match all atoms present	4444-43-3	C1=CC=C2C(=C1)C=CC(=O)C3=CC=CC=C23	{25: 1, 14: 10}
Did not match all atoms present	4444-59-1	CCC(C)O[Si](OC(C)CC)(OC(C)CC)O[Si](OC(C)CC)(OC(C)CC)OC(C)CC	{1: 12, 2: 6, 3: 6, 22: 7}
Did not match all atoms present	4445-07-2	CCCCCCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 17, 14: 5}
Did not match all atoms present	4445-09-4	B(CCCCCCCCCCCCCCCCCC)(O)O	{1: 1, 2: 17, 20: 2}
Did not match all atoms present	4445-67-4	CCCCCCCCCCCCCCP(=O)(CC)CC	{1: 3, 2: 15, 29: 1}
Did not match all atoms present	445-01-2	C1=CC(=C(C=C1Br)C(F)(F)F)Cl	{16: 3, 17: 1, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	445-02-3	C1=CC(=C(C=C1Br)C(F)(F)F)N	{16: 3, 18: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	445-03-4	C1=CC(=C(C=C1Cl)C(F)(F)F)N	{16: 3, 17: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	445-05-6	CC1=C(C=C(C=C1)F)S(=O)(=O)Cl	{16: 1, 1: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	445-26-1	CC(C1=CC=CC=C1F)O	{16: 1, 1: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	445-27-2	CC(=O)C1=CC=CC=C1F	{16: 1, 1: 1, 14: 4, 24: 1}
Did not match all atoms present	445-28-3	C1=CC=C(C(=C1)C(=O)N)F	{16: 1, 24: 1, 30: 1, 14: 4}
Did not match all atoms present	445-29-4	C1=CC=C(C(=C1)C(=O)O)F	{16: 1, 27: 1, 14: 4}
Did not match all atoms present	445-69-2	C1=CC=C(C(=C1)C(=O)F)C(=O)F	{16: 2, 24: 2, 14: 4}
Did not match all atoms present	4450-68-4	CC1=CC=C(C=C1)S(=O)(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 8, 22: 1, 29: 2}
Did not match all atoms present	4453-90-1	C1C2C=CC1C3=CC=CC=C23	{11: 1, 12: 2, 14: 6}
Did not match all atoms present	4454-16-4	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ni+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	4455-15-6	CCOC(=O)CS(=O)(=O)C	{1: 2, 2: 2, 28: 1, 29: 2}
Did not match all atoms present	4455-77-0	COCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 10, 29: 1}
Did not match all atoms present	4457-32-3	C1=CC(=CC=C1COC(=O)Cl)[N+](=O)[O-]	{17: 1, 2: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	4459-06-7	CN([SiH3])[SiH3]	{1: 1, 33: 1}
Did not match all atoms present	446-08-2	C1=CC(=C(C=C1F)C(=O)O)N	{16: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	446-10-6	CC1=C(C=C(C=C1)F)[N+](=O)[O-]	{16: 1, 1: 1, 38: 1, 14: 3}
Did not match all atoms present	446-11-7	CC1=CC(=C(C=C1)F)[N+](=O)[O-]	{16: 1, 1: 1, 38: 1, 14: 3}
Did not match all atoms present	446-17-3	C1=C(C(=CC(=C1F)F)F)C(=O)O	{16: 3, 27: 1, 14: 2}
Did not match all atoms present	446-22-0	CCC(=O)C1=CC=CC=C1F	{16: 1, 1: 1, 2: 1, 14: 4, 24: 1}
Did not match all atoms present	446-24-2	C1=CC=C(C(=C1)C(=O)NN)F	{16: 1, 24: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	446-30-0	C1=CC(=C(C=C1Cl)F)C(=O)O	{16: 1, 17: 1, 27: 1, 14: 3}
Did not match all atoms present	446-32-2	C1=CC(=C(C=C1F)N)C(=O)O	{16: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	446-33-3	CC1=C(C=CC(=C1)F)[N+](=O)[O-]	{16: 1, 1: 1, 38: 1, 14: 3}
Did not match all atoms present	446-34-4	CC1=CC(=C(C=C1)[N+](=O)[O-])F	{16: 1, 1: 1, 38: 1, 14: 3}
Did not match all atoms present	446-35-5	C1=CC(=C(C=C1F)F)[N+](=O)[O-]	{16: 2, 38: 1, 14: 3}
Did not match all atoms present	446-36-6	C1=CC(=C(C=C1F)O)[N+](=O)[O-]	{16: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	446-48-0	C1=CC=C(C(=C1)CBr)F	{16: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	446-51-5	C1=CC=C(C(=C1)CO)F	{16: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	446-52-6	C1=CC=C(C(=C1)C=O)F	{16: 1, 26: 1, 14: 4}
Did not match all atoms present	446-72-0	C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O	{25: 1, 21: 3, 14: 7, 23: 1}
Did not match all atoms present	446-86-6	CN1C=NC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-]	{32: 1, 1: 1, 35: 4, 38: 1, 33: 1, 40: 1, 14: 3}
Did not match all atoms present	4460-32-6	C1CN1P(=O)(NC(=O)C2=C(C=CC(=C2)I)I)N3CC3	{33: 2, 11: 4, 14: 3, 19: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	4460-86-0	COC1=CC(=C(C=C1C=O)OC)OC	{1: 3, 26: 1, 22: 3, 14: 2}
Did not match all atoms present	4461-33-0	C1=CC=C(C=C1)C(=O)N=C=O	{8: 1, 24: 1, 34: 1, 29: 1, 14: 5}
Did not match all atoms present	4462-55-9	CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)Cl	{1: 1, 35: 1, 14: 3, 17: 3, 23: 1, 24: 1}
Did not match all atoms present	4463-22-3	CC(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2)O	{24: 1, 1: 1, 20: 1, 14: 9, 33: 1}
Did not match all atoms present	4463-33-6	CC1=C(C(=CC=C1)OC)OC	{1: 3, 22: 2, 14: 3}
Did not match all atoms present	4464-23-7	C(=O)[O-].C(=O)[O-].[Cd+2]	{26: 2}
Did not match all atoms present	4465-58-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NCCO	{25: 2, 2: 2, 20: 1, 14: 7, 31: 1}
Did not match all atoms present	4465-92-3	C1=CC(=CC=C1CCNC2=C3C=CC(=CC3=NC=C2)Cl)N(CCCl)CCCl.Cl	{33: 1, 2: 6, 35: 1, 14: 9, 17: 4, 31: 1}
Did not match all atoms present	4465-94-5	C1CCC(CC1)N.C(CNP(=O)(N(CCCl)CCCl)O)CO	{33: 1, 2: 7, 11: 5, 12: 1, 17: 2, 20: 2, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	4466-24-4	CCCCC1=CC=CO1	{1: 1, 2: 3, 14: 3, 23: 1}
Did not match all atoms present	4466-59-5	C1=CC(=C2C(=C1Cl)C(=O)OC2=O)Cl	{17: 2, 28: 2, 14: 2}
Did not match all atoms present	4466-76-6	C1=CC=C2C(=C1)C=CC3=C2C4=CC=CC=C4C(=C3)C=O	{26: 1, 14: 11}
Did not match all atoms present	4466-77-7	CC1=C(C2=C(C(=C1C)C)C3=CC=CC=C3C=C2)C	{1: 4, 14: 6}
Did not match all atoms present	4467-06-5	CC1=CC=C(C=C1)C2=CC=CC=N2	{1: 1, 35: 1, 14: 8}
Did not match all atoms present	4467-88-3	C1=CC=C(C=C1)C2C=C(C3=CC=CC=C23)C4=CC=CC=C4	{12: 1, 14: 15, 15: 1}
Did not match all atoms present	4468-02-4	C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O.[Zn]	{27: 2, 2: 2, 3: 8, 20: 10}
Did not match all atoms present	4468-39-7	CCC(CC1=CC=C(C=C1)OC)C(CC)C2=CC=C(C=C2)OC	{1: 4, 2: 3, 3: 2, 22: 2, 14: 8}
Did not match all atoms present	4468-42-2	CCCC(CC)C1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5}
Did not match all atoms present	4468-48-8	CC(=O)C(C#N)C1=CC=CC=C1	{24: 1, 1: 1, 3: 1, 37: 1, 14: 5}
Did not match all atoms present	4468-57-9	COC1=CC=CC(=C1OC)CC#N	{1: 2, 2: 1, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	4468-59-1	COC1=C(C=CC(=C1)CC#N)O	{1: 1, 2: 1, 37: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	4469-80-1	CCCOC1=CC=C(C=C1)N	{1: 1, 2: 2, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	4469-81-2	CCCCOC1=CC=CC=C1N	{1: 1, 2: 3, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	447-05-2	CC1=NC=C(C(=C1O)CO)COP(=O)(O)O	{1: 1, 2: 2, 35: 1, 14: 1, 20: 3, 21: 1, 22: 1, 29: 1}
Did not match all atoms present	447-14-3	C1=CC=C(C=C1)C(=C(F)F)F	{16: 3, 14: 5, 7: 2}
Did not match all atoms present	447-31-4	C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)Cl	{24: 1, 17: 1, 3: 1, 14: 10}
Did not match all atoms present	447-41-6	CC(CCC1=CC=CC=C1)NC(C)C(C2=CC=C(C=C2)O)O	{1: 2, 2: 2, 3: 3, 14: 9, 20: 1, 21: 1, 31: 1}
Did not match all atoms present	447-53-0	C1CC2=CC=CC=C2C=C1	{11: 2, 14: 6}
Did not match all atoms present	447-60-9	C1=CC=C(C(=C1)C#N)C(F)(F)F	{16: 3, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	447-61-0	C1=CC=C(C(=C1)C=O)C(F)(F)F	{16: 3, 26: 1, 4: 1, 14: 4}
Did not match all atoms present	4470-72-8	COC1=NC(=NC(=N1)N(CCO)CCO)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)OC)N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 8, 35: 6, 6: 2, 33: 2, 14: 6, 20: 4, 22: 2, 29: 6, 31: 2}
Did not match all atoms present	4471-05-0	CCCCCC(C1=CC=CC=C1)O	{1: 1, 2: 4, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	4471-17-4	C1=CC=C(C=C1)[CH]C2=CC=CC=C2	{14: 10, 6: 1}
Did not match all atoms present	4471-22-1	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=CC=CC=C4	{4: 1, 14: 20, 31: 1}
Did not match all atoms present	4471-41-4	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCO)NCCO	{25: 2, 2: 4, 20: 2, 14: 6, 31: 2}
Did not match all atoms present	4472-41-7	[2H]C(=O)N(C([2H])([2H])[2H])C([2H])([2H])[2H]	{1: 2, 26: 1, 33: 1}
Did not match all atoms present	4472-44-0	CC1=CC(=NC(=N1)Cl)C	{1: 2, 35: 2, 14: 1, 17: 1}
Did not match all atoms present	4472-49-5	CC(=O)NC1=CC=CC2=C1C(=NNC3=C(C=CC(=C3)S(=O)(=O)N)O)C(=O)C=C2	{1: 1, 34: 1, 14: 8, 15: 1, 21: 1, 24: 1, 25: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	4472-73-5	COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)OC)OC	{1: 5, 25: 1, 22: 5, 14: 5, 23: 1}
Did not match all atoms present	4474-03-7	CCN(C1=CC=CC=C1)C(=O)N(C)C2=CC=CC=C2	{24: 1, 1: 2, 2: 1, 14: 10, 33: 2}
Did not match all atoms present	4474-91-3	CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CN=CN1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)N	{32: 1, 1: 4, 2: 8, 3: 9, 33: 1, 7: 1, 11: 3, 12: 1, 34: 1, 14: 11, 35: 1, 21: 1, 24: 7, 27: 2, 30: 3, 31: 6}
Did not match all atoms present	4476-04-4	C(CCCCC(=O)[O-])CCCC(=O)O.[Cd]	{24: 1, 2: 8, 27: 1}
Did not match all atoms present	4476-28-2	CC(C)C1=CC=C(C=C1)CC(=O)O	{27: 1, 1: 2, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	4478-10-8	CC1=CC(=C(C=C1)C(C)C)Br	{1: 3, 18: 1, 3: 1, 14: 3}
Did not match all atoms present	448-39-5	CC(=O)NC1=C(C=C(C=C1)F)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	448-65-7	CC1=CC2=CC3=C(C=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)O)CCC(=O)O)C)C	{32: 2, 1: 4, 2: 4, 35: 2, 14: 6, 27: 2}
Did not match all atoms present	448-70-4	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)CC)C)C)CC)CC)C)C	{32: 2, 1: 8, 2: 4, 35: 2, 14: 4}
Did not match all atoms present	448-71-5	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CC)C)CC)C)CC)C	{32: 2, 1: 8, 2: 4, 35: 2, 14: 4}
Did not match all atoms present	4481-30-5	CC(C)C(C)C1=CC=CC=C1	{1: 3, 3: 2, 14: 5}
Did not match all atoms present	4482-55-7	C[NH+](C)C(=O)NC1=CC=CC=C1.C(=O)(C(Cl)(Cl)Cl)[O-]	{1: 2, 4: 1, 14: 5, 17: 3, 24: 2, 31: 1}
Did not match all atoms present	4484-72-4	CCCCCCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 11, 17: 3}
Did not match all atoms present	4485-12-5	[Li+].CCCCCCCCCCCCCCCCCC(=O)[O-]	{24: 1, 1: 1, 2: 16}
Did not match all atoms present	4485-25-0	C1=CC(=CC=C1C(C2=CC=C(C=C2)N)C(Cl)(Cl)Cl)N	{17: 3, 3: 1, 4: 1, 30: 2, 14: 8}
Did not match all atoms present	4485-89-6	C1=CC=C(C=C1)NC=CC=NC2=CC=CC=C2	{34: 1, 14: 10, 6: 3, 31: 1}
Did not match all atoms present	4486-29-7	C1CC2CC1C3=CC=CC=C23	{11: 3, 12: 2, 14: 4}
Did not match all atoms present	4486-44-6	CC(C)OP(=S)(O)OC(C)C	{1: 4, 3: 2, 20: 1, 22: 2}
Did not match all atoms present	4487-59-6	C1=CC(=NC=C1[N+](=O)[O-])Br	{18: 1, 35: 1, 38: 1, 14: 3}
Did not match all atoms present	4488-22-6	C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)N)N	{30: 2, 14: 12}
Did not match all atoms present	4489-23-0	C/C=C/C1=CC=C(C=C1)Br	{1: 1, 18: 1, 14: 4, 6: 2}
Did not match all atoms present	4489-84-3	CC(=CCC1=CC=CC=C1)C	{1: 2, 2: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	449-55-8	C1C2=CC=CC=C2CNC3=CC=CC=C31	{32: 1, 11: 2, 14: 8}
Did not match all atoms present	4491-19-4	CCN1CC2([C@H]3C(C4[C@@H]1C3([C@@H]5C[C@@]6(C(C[C@]4([C@H]5C6OC(=O)C7=CC=CC=C7)OC(=O)C)OC)O)C(CC2O)OC)OC)COC	{1: 6, 2: 2, 33: 1, 11: 4, 12: 10, 13: 4, 14: 5, 20: 2, 22: 4, 28: 2}
Did not match all atoms present	449146-65-0	O=S(=O)([O-])[O-].[Mn+2]	{29: 4}
Did not match all atoms present	4492-01-7	C1=CC=C(C=C1)C2=NN(C=C2)C3=CC=CC=C3	{33: 1, 35: 1, 14: 12}
Did not match all atoms present	4492-75-5	C(CC(=O)[O-])C(=O)[O-].C1(C(=O)NC(=O)N1)NC(=O)N.[Na+].[Na+]	{32: 2, 2: 2, 12: 1, 24: 3, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	4492-79-9	CCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 21, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	4492-96-0	CCC(C)(C)C1=CC(=C(C=C1)OP(=O)(NC)OC)Cl	{1: 5, 2: 1, 4: 1, 14: 3, 17: 1, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	4493-37-2	C(=O)[O-].C(=O)[O-].[Cr+2]	{26: 2}
Did not match all atoms present	4494-26-2	C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C=O)CO)O	{32: 1, 33: 1, 2: 1, 11: 1, 12: 3, 14: 1, 20: 2, 23: 1, 25: 2, 26: 1}
Did not match all atoms present	4495-66-3	CCC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2	{24: 1, 1: 1, 2: 2, 22: 1, 14: 9}
Did not match all atoms present	4496-47-3	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C=C2	{1: 5, 2: 1, 4: 2, 14: 11, 31: 1}
Did not match all atoms present	4497-05-6	CCCCCCCCCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 12, 14: 5}
Did not match all atoms present	4497-58-9	CC1CC(NC2=CC=CC=C12)(C)C	{32: 1, 1: 3, 11: 1, 12: 1, 13: 1, 14: 4}
Did not match all atoms present	4497-72-7	CCN(C1=C(C(=O)C2=CC=CC=C2C1=O)Cl)C(=O)C	{1: 2, 2: 1, 33: 1, 14: 4, 15: 2, 17: 1, 24: 1, 25: 2}
Did not match all atoms present	4498-32-2	CN1C2=CC=CC=C2C(=O)N(C3=CC=CC=C31)CCN(C)C	{1: 3, 2: 2, 33: 3, 14: 8, 25: 1}
Did not match all atoms present	4498-39-9	CC1=CSC(=S)N1	{32: 1, 1: 1, 14: 1, 41: 1}
Did not match all atoms present	4498-99-1	CC1=CC=C(C=C1)CS	{1: 1, 2: 1, 14: 4, 39: 1}
Did not match all atoms present	4499-01-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)S(=O)(=O)[O-])NC5=NC(=NC(=N5)Cl)Cl)S(=O)(=O)[O-])N.[Na+].[Na+]	{35: 3, 14: 8, 17: 2, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	4499-40-5	CN1C(=C2C(=NC=N2)N(C1=O)C)[O-].C[N+](C)(C)CCO	{1: 5, 2: 2, 35: 2, 33: 2, 14: 1, 20: 1, 25: 1}
Did not match all atoms present	4499-83-6	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)C5=CC=C(C=C5)C6=CC=CC=C6	{14: 26}
Did not match all atoms present	4499-86-9	CCC[N+](CCC)(CCC)CCC.[OH-]	{1: 4, 2: 8}
Did not match all atoms present	44992-01-0	C[N+](C)(C)CCOC(=O)C=C.[Cl-]	{1: 3, 2: 2, 5: 1, 6: 1, 17: 1, 28: 1}
Did not match all atoms present	450-89-5	COC1=C(C=CC(=C1)F)Cl	{16: 1, 1: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	450-95-3	C1=CC=C(C=C1)C(=O)CF	{16: 1, 24: 1, 2: 1, 14: 5}
Did not match all atoms present	4500-58-7	CCC1=CC=CC=C1S	{1: 1, 2: 1, 14: 4, 39: 1}
Did not match all atoms present	4501-31-9	C1=CC(=CC=C1/C=C\C(=O)O)O	{27: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	4502-10-7	CC(=O)C1=C(C(=CC=C1)O)N	{24: 1, 1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	45021-77-0	C[N+](C)(C)CCCNC(=O)C=C.[Cl-]	{1: 3, 2: 3, 5: 1, 6: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	4503-12-2	CC[C@H]1C[C@@H]2C[C@@]3([C@H]1N(C2O)CCC4=C3NC5=CC=CC=C45)C(=O)OC.Cl	{32: 1, 1: 2, 2: 1, 33: 1, 11: 4, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	4504-87-4	C1C2=CC=CC=C2C(=O)C3=CC=CC=C3O1	{25: 1, 11: 1, 14: 8, 23: 1}
Did not match all atoms present	4509-11-9	C1C2C(O2)CS1(=O)=O	{11: 2, 12: 2, 29: 2, 23: 1}
Did not match all atoms present	451-02-5	CCOC(=O)C1=CC(=CC=C1)F	{16: 1, 1: 1, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	451-13-8	C1=CC(=C(C=C1O)CC(=O)O)O	{2: 1, 27: 1, 21: 2, 14: 3}
Did not match all atoms present	451-40-1	C1=CC=C(C=C1)CC(=O)C2=CC=CC=C2	{24: 1, 2: 1, 14: 10}
Did not match all atoms present	451-46-7	CCOC(=O)C1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	451-69-4	C1=CC=C(C(=C1)/C=C/C(=O)O)F	{16: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	451-77-4	CNCCC1=CC2=C(C=C1)OCO2	{1: 1, 2: 2, 11: 1, 14: 3, 23: 2, 31: 1}
Did not match all atoms present	451-80-9	CCOC1=CC=CC=C1F	{16: 1, 1: 1, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	451-82-1	C1=CC=C(C(=C1)CC(=O)O)F	{16: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	4510-34-3	C1=CC=C(C=C1)C=CCO	{2: 1, 20: 1, 14: 5, 6: 2}
Did not match all atoms present	4510-76-3	C1=CC=C2C(=C1)C(=CC(=O)N2)[O-].[Na+]	{32: 1, 25: 1, 14: 5}
Did not match all atoms present	4511-19-7	C1=C(C=C(C(=C1Cl)OC(=O)Cl)Cl)Cl	{17: 4, 28: 1, 14: 2}
Did not match all atoms present	4511-39-1	CCC(C)(C)OOC(=O)C1=CC=CC=C1	{1: 3, 2: 1, 4: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	45117-69-9	COCCO[Si](C)(C=C)OCCOC	{1: 3, 2: 4, 22: 4, 5: 1, 6: 1}
Did not match all atoms present	4512-00-9	C1=CC=C(C=C1)C2=NC(=O)NN=C2C3=CC=CC=C3	{32: 1, 25: 1, 35: 2, 14: 10}
Did not match all atoms present	4513-19-3	CCN(CC)C1=C(C=CC(=C1)[N+](=O)[O-])OC	{1: 3, 2: 2, 38: 1, 33: 1, 14: 3, 22: 1}
Did not match all atoms present	4513-41-1	C1=CC=C(C(=C1)C=CC(=O)O)Cl	{17: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	4513-73-9	CC1=C(C=CC(=C1)CC(=O)O)OC	{1: 2, 2: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	4513-94-4	C1=CNC(=C1)C#N	{32: 1, 37: 1, 14: 3}
Did not match all atoms present	4514-19-6	CC1=CC2=C3C(=CC4=CC=CC=C42)C=CC5=C3C1=CC=C5	{1: 1, 14: 11}
Did not match all atoms present	4515-30-4	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]	{17: 1, 38: 2, 29: 3, 14: 2}
Did not match all atoms present	4518-10-9	COC(=O)C1=CC(=CC=C1)N	{1: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	4518-94-9	CCC[Si](C)(Cl)Cl	{1: 2, 2: 2, 17: 2}
Did not match all atoms present	4518-98-3	C[Si]([Si](C)(Cl)Cl)(Cl)Cl	{1: 2, 17: 4}
Did not match all atoms present	4519-28-2	C[P+](C)(C)C.[Br-]	{1: 4, 18: 1}
Did not match all atoms present	4519-35-1	CCN(CC)P(=O)(C1=CC=CC=C1)N(CC)CC	{1: 4, 2: 4, 29: 1, 14: 5, 33: 2}
Did not match all atoms present	4519-39-5	C1=CC(=C(C(=C1)F)F)C(=O)O	{16: 2, 27: 1, 14: 3}
Did not match all atoms present	4519-40-8	C1=CC(=C(C(=C1)F)F)N	{16: 2, 30: 1, 14: 3}
Did not match all atoms present	452-06-2	C1=C2C(=NC(=N1)N)N=CN2	{32: 1, 35: 3, 30: 1, 14: 2}
Did not match all atoms present	452-08-4	COC1=C(C=C(C=C1)F)Br	{16: 1, 1: 1, 18: 1, 22: 1, 14: 3}
Did not match all atoms present	452-09-5	COC1=C(C=C(C=C1)Cl)F	{16: 1, 1: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	452-10-8	COC1=C(C=C(C=C1)F)F	{16: 2, 1: 1, 22: 1, 14: 3}
Did not match all atoms present	452-14-2	COC1=C(C=C(C=C1)CC(=O)O)F	{1: 1, 2: 1, 14: 3, 16: 1, 22: 1, 27: 1}
Did not match all atoms present	452-35-7	CCOC1=CC2=C(C=C1)N=C(S2)S(=O)(=O)N	{1: 1, 2: 1, 35: 1, 41: 1, 14: 3, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	452-58-4	C1=CC(=C(N=C1)N)N	{35: 1, 30: 2, 14: 3}
Did not match all atoms present	452-62-0	CC1=CC(=C(C=C1)F)Br	{16: 1, 1: 1, 18: 1, 14: 3}
Did not match all atoms present	452-63-1	CC1=C(C=CC(=C1)F)Br	{16: 1, 1: 1, 18: 1, 14: 3}
Did not match all atoms present	452-64-2	CC1=C(C=C(C=C1)F)C	{16: 1, 1: 2, 14: 3}
Did not match all atoms present	452-66-4	CC1=C(C=CC(=C1)Cl)F	{16: 1, 1: 1, 14: 3, 17: 1}
Did not match all atoms present	452-67-5	CC1=C(C=CC(=C1)F)F	{16: 2, 1: 1, 14: 3}
Did not match all atoms present	452-68-6	CC1=C(C=CC(=C1)I)F	{16: 1, 1: 1, 19: 1, 14: 3}
Did not match all atoms present	452-69-7	CC1=C(C=CC(=C1)N)F	{16: 1, 1: 1, 30: 1, 14: 3}
Did not match all atoms present	452-70-0	CC1=C(C=CC(=C1)O)F	{16: 1, 1: 1, 21: 1, 14: 3}
Did not match all atoms present	452-71-1	CC1=C(C=CC(=C1)F)N	{16: 1, 1: 1, 30: 1, 14: 3}
Did not match all atoms present	452-72-2	CC1=C(C=CC(=C1)F)O	{16: 1, 1: 1, 21: 1, 14: 3}
Did not match all atoms present	452-73-3	CC1=C(C=C(C=C1)F)Cl	{16: 1, 1: 1, 14: 3, 17: 1}
Did not match all atoms present	452-74-4	CC1=CC(=C(C=C1)Br)F	{16: 1, 1: 1, 18: 1, 14: 3}
Did not match all atoms present	452-75-5	CC1=C(C=C(C=C1)Cl)F	{16: 1, 1: 1, 14: 3, 17: 1}
Did not match all atoms present	452-76-6	CC1=C(C=C(C=C1)F)F	{16: 2, 1: 1, 14: 3}
Did not match all atoms present	452-77-7	CC1=C(C=C(C=C1)N)F	{16: 1, 1: 1, 30: 1, 14: 3}
Did not match all atoms present	452-80-2	CC1=CC(=C(C=C1)N)F	{16: 1, 1: 1, 30: 1, 14: 3}
Did not match all atoms present	452-84-6	CC1=CC(=C(C=C1)F)N	{16: 1, 1: 1, 30: 1, 14: 3}
Did not match all atoms present	452-86-8	CC1=CC(=C(C=C1)O)O	{1: 1, 21: 2, 14: 3}
Did not match all atoms present	4520-29-0	C[Si](C)(C)OC1=CC(=CC=C1)O[Si](C)(C)C	{1: 6, 22: 2, 14: 4}
Did not match all atoms present	4521-22-6	CC1=CC=C(C=C1)CCCC(=O)O	{1: 1, 2: 3, 27: 1, 14: 4}
Did not match all atoms present	4521-28-2	COC1=CC=C(C=C1)CCCC(=O)O	{1: 1, 2: 3, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	4521-31-7	C1=CC=C(C(=C1)CO)S	{2: 1, 20: 1, 14: 4, 39: 1}
Did not match all atoms present	4521-33-9	C1=C(SC(=C1)[N+](=O)[O-])C=O	{41: 1, 26: 1, 38: 1, 14: 2}
Did not match all atoms present	4521-61-3	COC1=CC(=CC(=C1OC)OC)C(=O)Cl	{24: 1, 1: 3, 22: 3, 14: 2, 17: 1}
Did not match all atoms present	4521-94-2	CCO[Si](OCC)(OCC)O[Si](OCC)(OCC)O[Si](OCC)(OCC)OCC	{1: 8, 2: 8, 22: 10}
Did not match all atoms present	4522-93-4	CCOC(=O)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 1, 2: 1, 28: 1}
Did not match all atoms present	4523-45-9	CC1=CC=C(C2=CC=CC=C12)N	{1: 1, 30: 1, 14: 6}
Did not match all atoms present	4524-77-0	C1=C(C=C(C(=C1Cl)O)Br)Cl	{17: 2, 18: 1, 21: 1, 14: 2}
Did not match all atoms present	45247-34-5	CCCCCCCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 14, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	4525-33-1	COC(=O)OC(=O)OC	{1: 2}
Did not match all atoms present	4525-44-4	CC[Si](C)(Cl)Cl	{1: 2, 2: 1, 17: 2}
Did not match all atoms present	4525-46-6	C[N+](C)(C)CC1=CC=CC=C1.[I-]	{1: 3, 2: 1, 19: 1, 14: 5}
Did not match all atoms present	4525-48-8	CC1=CC=CC=C1CN(C)C	{1: 3, 2: 1, 14: 4, 33: 1}
Did not match all atoms present	4525-75-1	CC(=O)OC1=CC=CC=C1Cl	{1: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	4526-07-2	C[Si](C)(C)C#CC#C[Si](C)(C)C	{1: 6, 10: 4}
Did not match all atoms present	4526-20-9	CCOP(=O)(OCC)OC(=O)C	{1: 3, 2: 2, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	4528-34-1	C(CO[N+](=O)[O-])[N+](=O)[O-]	{2: 2, 38: 1, 22: 1}
Did not match all atoms present	4528-52-3	C[C@@H](CC1=CC=CC=C1)N(C)CC#C.Cl	{1: 2, 2: 2, 3: 1, 33: 1, 9: 1, 10: 1, 14: 5, 17: 1}
Did not match all atoms present	4528-64-7	C1CC(C=CC1=O)(C2=CC=CC=C2)C3=CC=CC=C3	{25: 1, 11: 2, 13: 1, 14: 12}
Did not match all atoms present	4528-68-1	C1CC(CCC1=O)(C2=CC=CC=C2)C3=CC=CC=C3	{25: 1, 11: 4, 13: 1, 14: 10}
Did not match all atoms present	453-71-4	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])F	{16: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	453-72-5	CS(=O)(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]	{16: 1, 1: 1, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	45300-87-6	CCCCCCCCCCCCOCCOCCOCCOCCOP(=O)(O)O	{1: 1, 2: 19, 20: 2, 29: 1, 22: 5}
Did not match all atoms present	4531-35-5	C#C[Ge](C#C)(C#C)C#C	{9: 4, 10: 4}
Did not match all atoms present	4531-45-7	CCN(CC[N+](C)(C)N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl.[Cl-]	{1: 3, 2: 3, 38: 1, 33: 1, 34: 2, 14: 7, 17: 2, 30: 1}
Did not match all atoms present	4532-06-3	CCOP(=O)(OCC)OC1=CC=CC(=C1)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 14: 4, 22: 3, 29: 1}
Did not match all atoms present	4533-39-5	CN(C)CCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-]	{1: 2, 2: 3, 35: 1, 38: 1, 33: 1, 14: 7, 31: 1}
Did not match all atoms present	4533-95-3	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)Cl)Cl	{17: 2, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	4534-49-0	CCCCCCCC(CCCCC)C1=CC=CC=C1	{1: 2, 2: 10, 3: 1, 14: 5}
Did not match all atoms present	4534-50-3	CCCCCCCCC(CCCC)C1=CC=CC=C1	{1: 2, 2: 10, 3: 1, 14: 5}
Did not match all atoms present	4534-51-4	CCCCCCCCCC(CCC)C1=CC=CC=C1	{1: 2, 2: 10, 3: 1, 14: 5}
Did not match all atoms present	4534-52-5	CCCCCCCCCCC(CC)C1=CC=CC=C1	{1: 2, 2: 10, 3: 1, 14: 5}
Did not match all atoms present	4534-53-6	CCCCCCCCCCCC(C)C1=CC=CC=C1	{1: 2, 2: 10, 3: 1, 14: 5}
Did not match all atoms present	4534-59-2	CCCCCCCCCCCCC(C)C1=CC=CC=C1	{1: 2, 2: 11, 3: 1, 14: 5}
Did not match all atoms present	4536-86-1	CCCCCCCC(CCC)C1=CC=CC=C1	{1: 2, 2: 8, 3: 1, 14: 5}
Did not match all atoms present	4536-87-2	CCCCCCCCC(CC)C1=CC=CC=C1	{1: 2, 2: 8, 3: 1, 14: 5}
Did not match all atoms present	4536-88-3	CCCCCCCCCC(C)C1=CC=CC=C1	{1: 2, 2: 8, 3: 1, 14: 5}
Did not match all atoms present	4537-00-2	C1=CC2=C(C(=C1)C(=O)O)C(=CC=C2)Cl	{17: 1, 27: 1, 14: 6}
Did not match all atoms present	4537-11-5	CCCCCC(CCCC)C1=CC=CC=C1	{1: 2, 2: 7, 3: 1, 14: 5}
Did not match all atoms present	4537-12-6	CCCCCCC(CCC)C1=CC=CC=C1	{1: 2, 2: 7, 3: 1, 14: 5}
Did not match all atoms present	4537-13-7	CCCCCCCCC(C)C1=CC=CC=C1	{1: 2, 2: 7, 3: 1, 14: 5}
Did not match all atoms present	4537-14-8	CCCCCC(CCCCC)C1=CC=CC=C1	{1: 2, 2: 8, 3: 1, 14: 5}
Did not match all atoms present	4537-15-9	CCCCCCC(CCCC)C1=CC=CC=C1	{1: 2, 2: 8, 3: 1, 14: 5}
Did not match all atoms present	454-41-1	CS(=O)CCC(C(=O)O)N	{1: 1, 2: 2, 3: 1, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	454-78-4	C1=CC(=C(C=C1C(F)(F)F)Br)Cl	{16: 3, 17: 1, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	454-79-5	C1=CC(=C(C=C1C(F)(F)F)N)Br	{16: 3, 18: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	454-89-7	C1=CC(=CC(=C1)C(F)(F)F)C=O	{16: 3, 26: 1, 4: 1, 14: 4}
Did not match all atoms present	454-90-0	COC1=CC=CC(=C1)C(F)(F)F	{16: 3, 1: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	454-91-1	CC(C1=CC(=CC=C1)C(F)(F)F)O	{1: 1, 3: 1, 4: 1, 14: 4, 16: 3, 20: 1}
Did not match all atoms present	454-92-2	C1=CC(=CC(=C1)C(F)(F)F)C(=O)O	{16: 3, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	454-93-3	C1=CC(=CC(=C1)S(=O)(=O)F)C(=O)Cl	{16: 1, 17: 1, 29: 2, 14: 4, 24: 1}
Did not match all atoms present	454-95-5	C1=CC(=CC(=C1)S(=O)(=O)F)C(=O)O	{16: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	4540-00-5	C1=CC(=CC=C1N=NC2=C(C=C(C=C2)N(CCO)CCO)Cl)[N+](=O)[O-]	{33: 1, 2: 4, 38: 1, 34: 2, 14: 7, 17: 1, 20: 2}
Did not match all atoms present	4540-66-3	C1=CC=C(C(=C1)C(=O)OCOC(=O)C2=CC=CC=C2O)O	{2: 1, 28: 2, 21: 2, 14: 8}
Did not match all atoms present	4541-14-4	C1=CC=C(C=C1)COCCCCO	{2: 5, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	4541-15-5	C1=CC=C(C=C1)COCCCCCO	{2: 6, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	4541-89-3	C1=CC=C(C=C1)C(=CCl)C2=CC=CC=C2	{17: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	4542-61-4	[B](OC)OC	{1: 2, 22: 2}
Did not match all atoms present	4543-32-2	C1=CC=C(C=C1)CC(=O)NCC(=O)NO	{24: 2, 2: 2, 20: 1, 14: 5, 31: 2}
Did not match all atoms present	4543-33-3	C1=C(C=C2C3=CC(=CC(=C3NC2=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 38: 4, 14: 4}
Did not match all atoms present	4544-15-4	C1CCN(CC1)CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.Cl	{33: 1, 2: 2, 4: 1, 11: 5, 14: 10, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	4544-23-4	CC(=C=C1CC1C2=CC=CC=C2)C	{1: 2, 7: 1, 8: 1, 11: 1, 12: 1, 14: 5, 15: 1}
Did not match all atoms present	4546-04-7	CCOP(=O)(CC1=CC=C(C=C1)CP(=O)(OCC)OCC)OCC	{1: 4, 2: 6, 22: 4, 14: 4, 29: 2}
Did not match all atoms present	4546-39-8	C1CCN(CC1)CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{33: 1, 2: 2, 4: 1, 11: 5, 14: 10, 20: 1, 28: 1}
Did not match all atoms present	4547-57-3	CCCCOC1=CC=C(C=C1)CC(=O)O	{1: 1, 2: 4, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	4547-70-0	C1=CC(=CC(=C1)S(=O)(=O)NN)S(=O)(=O)NN	{30: 2, 29: 4, 14: 4, 31: 2}
Did not match all atoms present	4548-45-2	C1=CC(=NC=C1[N+](=O)[O-])Cl	{17: 1, 35: 1, 38: 1, 14: 3}
Did not match all atoms present	4548-53-2	CC1=CC(=C(C=C1NN=C2C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 34: 1, 14: 7, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	455-01-6	C1=CC(=CC(=C1)C(F)(F)F)CCO	{16: 3, 20: 1, 2: 2, 4: 1, 14: 4}
Did not match all atoms present	455-13-0	C1=CC(=CC=C1C(F)(F)F)I	{16: 3, 19: 1, 4: 1, 14: 4}
Did not match all atoms present	455-14-1	C1=CC(=CC=C1C(F)(F)F)N	{16: 3, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	455-15-2	CS(=O)(=O)C1=CC=C(C=C1)F	{16: 1, 1: 1, 29: 2, 14: 4}
Did not match all atoms present	455-16-3	CC1=CC=C(C=C1)S(=O)(=O)F	{16: 1, 1: 1, 29: 2, 14: 4}
Did not match all atoms present	455-17-4	C[Si](C)(C)C1=CC=C(C=C1)F	{16: 1, 1: 3, 14: 4}
Did not match all atoms present	455-18-5	C1=CC(=CC=C1C#N)C(F)(F)F	{16: 3, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	455-19-6	C1=CC(=CC=C1C=O)C(F)(F)F	{16: 3, 26: 1, 4: 1, 14: 4}
Did not match all atoms present	455-20-9	CCC1=CC=C(C=C1)S(=O)(=O)F	{16: 1, 1: 1, 2: 1, 29: 2, 14: 4}
Did not match all atoms present	455-24-3	C1=CC(=CC=C1C(=O)O)C(F)(F)F	{16: 3, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	455-31-2	C1=CC=C(C=C1)C(F)F	{16: 2, 3: 1, 14: 5}
Did not match all atoms present	455-32-3	C1=CC=C(C=C1)C(=O)F	{16: 1, 24: 1, 14: 5}
Did not match all atoms present	455-34-5	C1=CC(=CC(=C1)F)C(Br)Br	{16: 1, 18: 2, 3: 1, 14: 4}
Did not match all atoms present	455-36-7	CC(=O)C1=CC(=CC=C1)F	{16: 1, 1: 1, 14: 4, 24: 1}
Did not match all atoms present	455-37-8	C1=CC(=CC(=C1)F)C(=O)N	{16: 1, 24: 1, 30: 1, 14: 4}
Did not match all atoms present	455-38-9	C1=CC(=CC(=C1)F)C(=O)O	{16: 1, 27: 1, 14: 4}
Did not match all atoms present	455-40-3	C1=C(C=C(C=C1F)F)C(=O)O	{16: 2, 27: 1, 14: 3}
Did not match all atoms present	455-67-4	CCC(=O)C1=CC(=CC=C1)F	{16: 1, 1: 1, 2: 1, 14: 4, 24: 1}
Did not match all atoms present	455-68-5	COC(=O)C1=CC(=CC=C1)F	{16: 1, 1: 1, 28: 1, 14: 4}
Did not match all atoms present	455-80-1	CCCCN(CCCC)CCCOC(=O)C1=CC(=C(C=C1)F)I.Cl	{1: 2, 2: 9, 33: 1, 14: 3, 16: 1, 17: 1, 19: 1, 28: 1}
Did not match all atoms present	455-86-7	C1=CC(=C(C=C1C(=O)O)F)F	{16: 2, 27: 1, 14: 3}
Did not match all atoms present	455-87-8	C1=CC(=C(C=C1C(=O)O)F)N	{16: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	455-88-9	CC1=C(C=CC(=C1)[N+](=O)[O-])F	{16: 1, 1: 1, 38: 1, 14: 3}
Did not match all atoms present	455-91-4	CC(=O)C1=CC(=C(C=C1)OC)F	{16: 1, 1: 2, 22: 1, 14: 3, 24: 1}
Did not match all atoms present	4550-36-1	CCN(CC)C1=CC(=C(C=C1)C(C2=CC(=C(C=C2)OC)OC)C3=C(C=C(C=C3)N(CC)CC)C)C	{1: 8, 2: 4, 3: 1, 33: 2, 14: 9, 22: 2}
Did not match all atoms present	4551-03-5	C1OC2=C(O1)C=C(C=C2)C=C3C(=O)NC(=O)NC3=O	{32: 2, 6: 1, 11: 1, 14: 3, 15: 1, 23: 2, 25: 3}
Did not match all atoms present	4551-15-9	C[Si](C)(C)SC1=CC=CC=C1	{40: 1, 1: 3, 14: 5}
Did not match all atoms present	4551-59-1	CCC(C1=CC=CC=C1)(C(=O)NCCN(CC)CC)C(=O)OCC	{1: 4, 2: 6, 4: 1, 33: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	4552-64-1	C1=CSC(=C1)C(=CC(=O)C(F)(F)F)S	{4: 1, 6: 1, 7: 1, 41: 1, 39: 1, 14: 3, 16: 3, 24: 1}
Did not match all atoms present	4553-07-5	CCOC(=O)C(C#N)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 37: 1, 14: 5, 28: 1}
Did not match all atoms present	4553-89-3	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C\3/C=C(C(=O)/C(=N\NC4=CC=C(C5=CC=CC=C54)S(=O)(=O)[O-])/C3=O)CO.[Na+].[Na+]	{2: 1, 34: 2, 14: 13, 20: 1, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	45534-08-5	CSC1=NNC(=N1)N	{32: 1, 1: 1, 35: 2, 30: 1, 40: 1}
Did not match all atoms present	4554-22-7	CP(=C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 5: 1, 14: 10}
Did not match all atoms present	4556-23-4	C1=CNC=CC1=S	{32: 1, 14: 4}
Did not match all atoms present	45579-94-0	[2H]N([2H])CC1=CC=CC=C1	{2: 1, 30: 1, 14: 5}
Did not match all atoms present	4559-70-0	C1=CC=C(C=C1)[P+](=O)C2=CC=CC=C2	{29: 1, 14: 10}
Did not match all atoms present	4559-96-0	C1=CC(=CC=C1C(=O)CCCCl)Br	{24: 1, 17: 1, 2: 3, 18: 1, 14: 4}
Did not match all atoms present	456-03-1	CCC(=O)C1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 1, 14: 4, 24: 1}
Did not match all atoms present	456-04-2	C1=CC(=CC=C1C(=O)CCl)F	{16: 1, 17: 1, 2: 1, 14: 4, 24: 1}
Did not match all atoms present	456-07-5	C1=CC(=CC=C1C(=O)NO)F	{16: 1, 24: 1, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	456-19-9	C1=CC(=CC=C1C(Cl)Cl)F	{16: 1, 17: 2, 3: 1, 14: 4}
Did not match all atoms present	456-22-4	C1=CC(=CC=C1C(=O)O)F	{16: 1, 27: 1, 14: 4}
Did not match all atoms present	456-39-3	[B-](F)(F)(F)F.C1=CC(=CC(=C1)Cl)[N+]#N	{16: 4, 17: 1, 34: 1, 14: 4}
Did not match all atoms present	456-41-7	C1=CC(=CC(=C1)F)CBr	{16: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	456-42-8	C1=CC(=CC(=C1)F)CCl	{16: 1, 17: 1, 2: 1, 14: 4}
Did not match all atoms present	456-47-3	C1=CC(=CC(=C1)F)CO	{16: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	456-48-4	C1=CC(=CC(=C1)F)C=O	{16: 1, 26: 1, 14: 4}
Did not match all atoms present	456-49-5	COC1=CC(=CC=C1)F	{16: 1, 1: 1, 22: 1, 14: 4}
Did not match all atoms present	456-55-3	C1=CC=C(C=C1)OC(F)(F)F	{16: 3, 4: 1, 22: 1, 14: 5}
Did not match all atoms present	456-56-4	C1=CC=C(C=C1)SC(F)(F)F	{16: 3, 40: 1, 4: 1, 14: 5}
Did not match all atoms present	456-59-7	CC1CC(CC(C1)(C)C)OC(=O)C(C2=CC=CC=C2)O	{1: 3, 3: 1, 11: 3, 12: 2, 13: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	456-64-4	C1=CC=C(C=C1)NS(=O)(=O)C(F)(F)F	{16: 3, 4: 1, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	456-71-3	C1=CC(=CC=C1C(=O)N)OC(F)(F)F	{4: 1, 14: 4, 16: 3, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	4561-43-7	C1=CC=C(C=C1)C(C[NH3+])O.[Cl-]	{17: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	4563-33-1	C1=CC=C(C=C1)CS(=O)(=O)N	{2: 1, 30: 1, 29: 2, 14: 5}
Did not match all atoms present	4563-56-8	CCCCCCCCCCCCOP(=S)(OCCCCCCCCCCCC)[S-].CCCCCCCCCCCCOP(=S)(OCCCCCCCCCCCC)[S-].[Zn+2]	{1: 4, 2: 44, 22: 4}
Did not match all atoms present	4565-32-6	c1ccc2c(c1)CCS2	{41: 1, 11: 2, 14: 4}
Did not match all atoms present	4567-41-3	CC1=CC=CC2=C1C3=C(C=C2)C4=CC=CC=C4S3	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	4568-81-4	CC1=CC(=C(O1)C)C(=O)C2=CC=C(C=C2)O	{24: 1, 1: 2, 21: 1, 14: 5, 23: 1}
Did not match all atoms present	4568-82-5	C1=COC=C1C(=O)C2=CC(=C(C(=C2)I)O)I	{24: 1, 19: 2, 21: 1, 14: 5, 23: 1}
Did not match all atoms present	4568-83-6	CCC1=CC=C(O1)C(=O)C2=CC(=C(C(=C2)I)O)I	{1: 1, 2: 1, 14: 4, 19: 2, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	4569-45-3	CC1(C2=CC=CC=C2C3=CC=CC=C31)C	{1: 2, 13: 1, 14: 8}
Did not match all atoms present	4569-77-1	C1=CC=C2C(=C1)NC3=CC(=O)C(=CC3=N2)N	{32: 1, 25: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	4569-88-4	CC1=CC2=C(C=C1N)[N+](=C3C=C(C(=CC3=N2)C)NN=C4C(=O)C=CC5=CC=CC=C54)C6=CC=CC=C6.[Cl-]	{1: 2, 34: 1, 35: 1, 33: 1, 14: 15, 15: 1, 17: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	457-60-3	C1=CC(=C(C=C1[As]=[As]C2=CC(=C(C=C2)O)NCS(=O)[O-])N)O.[Na+]	{2: 1, 14: 6, 21: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	457-68-1	C1=CC(=CC=C1CC2=CC=C(C=C2)F)F	{16: 2, 2: 1, 14: 8}
Did not match all atoms present	457-87-4	CCNC(C)CC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	4570-11-0	CC(=C)C1=CC(=O)C(=CC=C1)O	{1: 1, 5: 1, 7: 1, 14: 4, 21: 1, 25: 1}
Did not match all atoms present	4570-41-6	C1=CC=C2C(=C1)N=C(O2)N	{35: 1, 30: 1, 14: 4, 23: 1}
Did not match all atoms present	4574-04-3	CCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 13, 17: 1}
Did not match all atoms present	45762-41-2	CCC1=C(C=CC(=C1)Br)N	{1: 1, 2: 1, 30: 1, 18: 1, 14: 3}
Did not match all atoms present	45767-66-6	C1=CC(=C(C=C1F)Cl)CBr	{16: 1, 17: 1, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	4578-87-4	C1=CC2=C3C(=C1)N=C4C5=C6C(=CC=C7C6=C(C=C5)C(=O)N8C7=NC9=CC=CC1=C9C8=CC=C1)C(=O)N4C3=CC=C2	{25: 2, 35: 2, 14: 16, 33: 2}
Did not match all atoms present	4579-03-7	C1OP2OCP1CO2	{11: 3, 23: 3}
Did not match all atoms present	45791-36-4	C[C@H](C1=CC=C(C=C1)Br)N	{1: 1, 18: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	458-03-7	CCOC1=CC(=CC=C1)F	{16: 1, 1: 1, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	458-24-2	CCNC(C)CC1=CC(=CC=C1)C(F)(F)F	{1: 2, 2: 2, 3: 1, 4: 1, 14: 4, 16: 3, 31: 1}
Did not match all atoms present	458-35-5	COC1=C(C=CC(=C1)C=CCO)O	{1: 1, 2: 1, 6: 2, 14: 3, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	458-36-6	COC1=C(C=CC(=C1)/C=C/C=O)O	{1: 1, 6: 2, 14: 3, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	458-37-7	COC1=C(C=CC(=C1)/C=C/C(=O)CC(=O)/C=C/C2=CC(=C(C=C2)O)OC)O	{1: 2, 2: 1, 6: 4, 14: 6, 21: 2, 22: 2, 24: 2}
Did not match all atoms present	458-46-8	C1=CC(=CC(=C1)F)/C=C/C(=O)[O-]	{16: 1, 24: 1, 14: 4, 6: 2}
Did not match all atoms present	4584-57-0	CN(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-]	{1: 2, 38: 1, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	45867-11-6	C1=C(C(=NC(=N1)N)C(=O)O)Cl	{17: 1, 27: 1, 30: 1, 14: 1, 35: 2}
Did not match all atoms present	4587-15-9	C1COCCN1C(=O)C2=CC(=CC=C2)N(CCCl)CCCl	{33: 2, 2: 4, 11: 4, 14: 4, 17: 2, 23: 1, 24: 1}
Did not match all atoms present	4587-33-1	CC(C)(C)OC(=O)N[C@H](CC(=O)N)C(=O)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 2: 1, 3: 1, 4: 1, 38: 1, 14: 4, 24: 1, 28: 2, 30: 1, 31: 1}
Did not match all atoms present	4589-12-2	C1=CC=C(C=C1)C(=O)NC2=CC=CC=N2	{24: 1, 35: 1, 14: 9, 31: 1}
Did not match all atoms present	4589-97-3	C1=CC=C(C=C1)C(=CN=O)NO	{34: 1, 6: 1, 7: 1, 14: 5, 20: 1, 29: 1, 31: 1}
Did not match all atoms present	459-02-9	CC(CC1=CC=C(C=C1)F)N	{1: 1, 2: 1, 3: 1, 14: 4, 16: 1, 30: 1}
Did not match all atoms present	459-03-0	CC(=O)CC1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 1, 14: 4, 24: 1}
Did not match all atoms present	459-04-1	C1=CC(=CC=C1CC(=O)Cl)F	{16: 1, 17: 1, 2: 1, 14: 4, 24: 1}
Did not match all atoms present	459-22-3	C1=CC(=CC=C1CC#N)F	{16: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	459-26-7	CCOC1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	459-31-4	C1=CC(=CC=C1CCC(=O)O)F	{16: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	459-32-5	C1=CC(=CC=C1/C=C/C(=O)O)F	{16: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	459-44-9	[B-](F)(F)(F)F.CC1=CC=C(C=C1)[N+]#N	{16: 4, 1: 1, 34: 1, 14: 4}
Did not match all atoms present	459-46-1	C1=CC(=CC=C1CBr)F	{16: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	459-47-2	CCC1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 1, 14: 4}
Did not match all atoms present	459-56-3	C1=CC(=CC=C1CO)F	{16: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	459-57-4	C1=CC(=CC=C1C=O)F	{16: 1, 26: 1, 14: 4}
Did not match all atoms present	459-59-6	CNC1=CC=C(C=C1)F	{16: 1, 1: 1, 14: 4, 31: 1}
Did not match all atoms present	459-60-9	COC1=CC=C(C=C1)F	{16: 1, 1: 1, 22: 1, 14: 4}
Did not match all atoms present	4590-52-7	C1CC(=O)NC2=C1C=CC(=C2)F	{16: 1, 25: 1, 11: 2, 14: 3, 32: 1}
Did not match all atoms present	4591-46-2	C1=C(C=C(C(=C1[N+](=O)[O-])N[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 4, 14: 2, 31: 1}
Did not match all atoms present	4593-81-1	CCCC[Ge](CCCC)(Cl)Cl	{1: 2, 2: 6, 17: 2}
Did not match all atoms present	4593-82-2	CC(C)[Ge](C(C)C)(C(C)C)C(C)C	{1: 8, 3: 4}
Did not match all atoms present	4593-90-2	CC(CC(=O)O)C1=CC=CC=C1	{27: 1, 1: 1, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	4594-71-2	CN1C=CC2=CC=CC=C2C1=O	{1: 1, 33: 1, 14: 6, 25: 1}
Did not match all atoms present	4595-59-9	C1=C(C=NC=N1)Br	{18: 1, 35: 2, 14: 3}
Did not match all atoms present	4595-60-2	C1=CN=C(N=C1)Br	{18: 1, 35: 2, 14: 3}
Did not match all atoms present	4597-87-9	CNC1=CC=CC=N1	{1: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	4599-60-4	C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)NCN5CCN(CC5)CCO)N(C)C)O.CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)C	{1: 5, 2: 4, 33: 4, 41: 1, 11: 5, 12: 6, 13: 3, 14: 8, 15: 4, 20: 5, 21: 1, 22: 1, 24: 2, 25: 3, 27: 1, 31: 2}
Did not match all atoms present	4599-94-4	C1=CC=C2C(=C1)C=CC3=C2C(=O)C4=CC5=CC=CC=C5C=C34	{25: 1, 14: 12}
Did not match all atoms present	4599-99-9	C1CC2=CC=CC3=C2C1=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 11: 2, 21: 1, 14: 8}
Did not match all atoms present	460-00-4	C1=CC(=CC=C1F)Br	{16: 1, 18: 1, 14: 4}
Did not match all atoms present	460-55-9	CCO[Si](F)(F)F	{16: 3, 1: 1, 2: 1, 22: 1}
Did not match all atoms present	460-96-8	C(F)(F)(F)PC(F)(F)F	{16: 6, 4: 2}
Did not match all atoms present	4602-70-4	CC1=NCCC2=CC(=C(C=C12)O)OC	{1: 2, 35: 1, 11: 2, 14: 2, 15: 1, 21: 1, 22: 1}
Did not match all atoms present	46030-99-3	CC1=CC=C(C2=CC=CC2=C1)C	{1: 2, 14: 6}
Did not match all atoms present	46032-98-8	C1=CC=C(C=C1)[C@H]([C@@H](CO)N)O	{2: 1, 3: 2, 20: 2, 30: 1, 14: 5}
Did not match all atoms present	4605-17-8	[C](=C(F)F)F	{16: 3, 7: 1}
Did not match all atoms present	4605-91-8	CC1=CC2=C(C=C1)C3C(C4C2C5(C(=C(C4(C5(Cl)Cl)Cl)Cl)Cl)Cl)C6(C(=C(C3(C6(Cl)Cl)Cl)Cl)Cl)Cl	{1: 1, 12: 4, 13: 6, 14: 3, 15: 4, 17: 12}
Did not match all atoms present	4606-15-9	CCCOC(=O)CC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	461-05-2	C[N+](C)(C)CC(CC(=O)O)O.[Cl-]	{1: 3, 2: 2, 3: 1, 17: 1, 20: 1, 27: 1}
Did not match all atoms present	461-08-5	C(=S)(SC(F)(F)F)SC(F)(F)F	{16: 6, 40: 2, 4: 2, 7: 1}
Did not match all atoms present	461-55-2	CCCC(=O)[O-]	{24: 1, 1: 1, 2: 2}
Did not match all atoms present	461-59-6	C(=NP(F)F)=O	{8: 1, 16: 2, 34: 1, 29: 1}
Did not match all atoms present	461-60-9	C(=NP(F)F)=S	{8: 1, 16: 2, 34: 1}
Did not match all atoms present	461-78-9	CC(C)(CC1=CC=C(C=C1)Cl)N	{1: 2, 2: 1, 4: 1, 14: 4, 17: 1, 30: 1}
Did not match all atoms present	461-82-5	C1=CC(=CC=C1N)OC(F)(F)F	{16: 3, 30: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	461-84-7	C1=CC(=CC=C1O)SC(F)(F)F	{16: 3, 40: 1, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	461-87-0	CC1=CC(=NC=C1)F	{16: 1, 1: 1, 35: 1, 14: 3}
Did not match all atoms present	461-96-1	C1=C(C=C(C=C1F)Br)F	{16: 2, 18: 1, 14: 3}
Did not match all atoms present	461-97-2	CC1=CC(=CC(=C1)F)C	{16: 1, 1: 2, 14: 3}
Did not match all atoms present	461-98-3	CC1=CC(=NC(=N1)C)N	{1: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	4611-02-3	CCN(CC)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.Cl	{1: 2, 2: 5, 33: 2, 41: 1, 14: 7, 17: 2}
Did not match all atoms present	46118-95-0	CC1=NC(=NC=C1)SCC(=O)O	{1: 1, 2: 1, 35: 2, 40: 1, 14: 2, 27: 1}
Did not match all atoms present	4612-26-4	B(C1=CC=C(C=C1)B(O)O)(O)O	{20: 4, 14: 4}
Did not match all atoms present	4612-63-9	CC1=C(C=C2C(=C1)CC3=CC=CC=C32)C	{1: 2, 11: 1, 14: 6}
Did not match all atoms present	4613-05-2	CCN(CC[N+](C)(C)N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N.[Cl-]	{1: 3, 2: 3, 37: 1, 38: 1, 33: 1, 34: 2, 14: 7, 17: 1, 30: 1}
Did not match all atoms present	4613-11-0	CC(C1=CC=CC=C1)C(C)C2=CC=CC=C2	{1: 2, 3: 2, 14: 10}
Did not match all atoms present	4614-03-3	CCC(C)C1=CC2=CC=CC=C2C=C1	{1: 2, 2: 1, 3: 1, 14: 7}
Did not match all atoms present	4615-13-8	CCCCCCCCCCCCCCC=CS(=O)(=O)[O-].[Na+]	{1: 1, 2: 13, 29: 3, 6: 2}
Did not match all atoms present	4615-31-0	CCCCCCCCCCCCCCCCCCOP(=O)([O-])[O-].[Zn+2]	{1: 1, 2: 17, 29: 3, 22: 1}
Did not match all atoms present	4615-78-5	C1=CC=C2C(=C1)C=CC3=C2C(C4=CC=CC=C4C3O)O	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	4615-85-4	C1(=C(C(=C(C(=C1F)F)F)F)F)[O-].[K+]	{16: 5}
Did not match all atoms present	4616-63-1	C#CCON1C(=O)C2=CC=CC=C2C1=O	{33: 1, 2: 1, 9: 1, 10: 1, 14: 4, 22: 1, 25: 2}
Did not match all atoms present	46170-85-8	CC1=C(C(=C(C=C1)C(C)(C)C)O)C	{1: 5, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	4618-24-0	CCCCNCC(COC1=CC=CC2=CC=CC=C21)O	{1: 1, 2: 5, 3: 1, 14: 7, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	46185-83-5	CCOC1=NC2=CC=CC=C2C=C1	{1: 1, 2: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	46187-37-5	CC1=C(N=C(C(=N1)C)CC(C)C)C	{1: 5, 2: 1, 3: 1, 35: 2}
Did not match all atoms present	4619-20-9	CC1=CC=C(C=C1)C(=O)CCC(=O)O	{24: 1, 1: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	4619-74-3	CC1=C(C(=C(C=C1Br)Br)O)Br	{1: 1, 18: 3, 21: 1, 14: 1}
Did not match all atoms present	462-02-2	C1(=N)OC(=N)OC(=N)O1	{36: 3, 23: 3}
Did not match all atoms present	462-06-6	C1=CC=C(C=C1)F	{16: 1, 14: 5}
Did not match all atoms present	462-08-8	C1=CC(=CN=C1)N	{35: 1, 30: 1, 14: 4}
Did not match all atoms present	462-34-0	B(F)(F)F.C1CCOC1	{16: 3, 11: 4, 23: 1}
Did not match all atoms present	462-80-6	C1=CC#CC=C1	{14: 4}
Did not match all atoms present	4621-36-7	CCCCCCCC(CC)C1=CC=CC=C1	{1: 2, 2: 7, 3: 1, 14: 5}
Did not match all atoms present	4621-66-3	C1=CC(=CN=C1)C(=S)N	{35: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	4622-66-6	CC/C(=C\C1=[N+](C2=C(S1)C=CC3=CC=CC=C32)CCCS(=O)(=O)O)/C=C\4/N(C5=C(S4)C=CC6=CC=CC=C65)CCCS(=O)(=O)[O-]	{1: 1, 2: 7, 33: 2, 6: 2, 7: 1, 41: 2, 14: 12, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	4623-24-9	C1=CC(=CC(=C1)N)CC#N	{2: 1, 30: 1, 14: 4, 37: 1}
Did not match all atoms present	46231-41-8	C1=CC=C(C=C1)OCCN=C(N)N	{34: 1, 7: 1, 2: 2, 14: 5, 22: 1, 30: 2}
Did not match all atoms present	4628-39-1	C1=C(NC(=O)NC1=O)CC(=O)O	{32: 2, 25: 2, 2: 1, 27: 1, 14: 1}
Did not match all atoms present	4628-94-8	C1(=NN=C(S1)[S-])[S-].[K+].[K+]	{41: 1, 35: 2}
Did not match all atoms present	4629-58-7	C1=CC(=CC=C1C=CC2=CC=C(C=C2)[N+](=O)[O-])N	{30: 1, 38: 1, 14: 8, 6: 2}
Did not match all atoms present	46292-93-7	C1=CC=C(C=C1)[C@@H](CC(=O)O)C(=O)O	{27: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	463-58-1	C(=O)=S	{8: 1, 29: 1}
Did not match all atoms present	463-71-8	C(=S)(Cl)Cl	{17: 2, 7: 1}
Did not match all atoms present	463-88-7	C[N+](C)(C)C=C.[OH-]	{1: 3, 5: 1, 6: 1}
Did not match all atoms present	4630-20-0	CC1=CC2=C(C=C1)NC3=CC=CC=C32	{32: 1, 1: 1, 14: 7}
Did not match all atoms present	4630-95-9	CC[N+]1(CCC(=C(C2=CC=CC=C2)C3=CC=CC=C3)C1C)CC.[Br-]	{1: 3, 2: 2, 7: 1, 11: 2, 12: 1, 14: 10, 15: 1, 18: 1}
Did not match all atoms present	46300-01-0	COC1=CC(=C(C=C1C#N)OC)[N+]#N	{1: 2, 34: 1, 22: 2, 14: 2, 37: 1}
Did not match all atoms present	4634-47-3	COCCN1C(=O)C2C\3C=C(C(C2C1=O)/C3=C(/C4=CC=CC=C4)\C5=CC=CC=N5)C(C6=CC=CC=C6)(C7=CC=CC=N7)O	{1: 1, 2: 2, 35: 2, 4: 1, 33: 1, 7: 1, 12: 4, 14: 19, 15: 2, 20: 1, 22: 1, 25: 2}
Did not match all atoms present	46345-86-2	C1=CC=C(C=C1)CC[N+]2=CC=CC=C2	{33: 1, 2: 2, 14: 10}
Did not match all atoms present	46355-07-1	CC(C)OP(=O)(O)OC1=CC=CC=C1	{1: 2, 3: 1, 14: 5, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	4636-16-2	C1=CC=C(C=C1)C(=O)CI	{24: 1, 2: 1, 19: 1, 14: 5}
Did not match all atoms present	4637-56-3	C1=CC=C2C(=C1)C(=NO)C=CN2O	{33: 1, 34: 1, 20: 1, 21: 1, 14: 6}
Did not match all atoms present	4638-25-9	C[Sn](C)(C)SC#N	{40: 1, 1: 3, 37: 1}
Did not match all atoms present	4638-44-2	C1CN1C(=O)C2=CC(=CC=C2)N(CCCl)CCCl	{33: 2, 2: 4, 11: 2, 14: 4, 17: 2, 24: 1}
Did not match all atoms present	46397-90-4	CCN(CC)CC1=CNC2=CC=CC=C21	{32: 1, 1: 2, 2: 3, 14: 5, 33: 1}
Did not match all atoms present	464-72-2	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O	{20: 2, 4: 2, 14: 20}
Did not match all atoms present	464-85-7	C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@@]34[C@@](CCO3)(C5=CC=CC=C5N4)O	{32: 1, 33: 1, 5: 1, 6: 1, 11: 6, 12: 3, 13: 2, 14: 4, 20: 1, 23: 1}
Did not match all atoms present	4640-66-8	C1=CC(=CC=C1C(=O)CC#N)Cl	{24: 1, 17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	4640-68-0	C1=CC(=C(C=C1C(=O)CC#N)Cl)Cl	{24: 1, 17: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	4641-57-0	C1CC(=O)N(C1)C2=CC=CC=C2	{25: 1, 11: 3, 14: 5, 33: 1}
Did not match all atoms present	46427-20-7	C1=C(C=C(C(=C1O)Br)O)C(=O)NCCO	{2: 2, 14: 2, 18: 1, 20: 1, 21: 2, 24: 1, 31: 1}
Did not match all atoms present	46441-13-8	COC1=CC=C(C=C1)C[N+]2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 9, 33: 1}
Did not match all atoms present	4645-32-3	COP(=O)(C=C)OC	{1: 2, 22: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	4646-69-9	C1C2=CC=CC=C21	{11: 1, 14: 4}
Did not match all atoms present	4647-42-1	C1[C@@H]([C@@H](C2=CC=CC=C21)O)O	{20: 2, 11: 1, 12: 2, 14: 4}
Did not match all atoms present	4647-43-2	C1[C@@H]([C@H](C2=CC=CC=C21)O)O	{20: 2, 11: 1, 12: 2, 14: 4}
Did not match all atoms present	4648-33-3	COC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 22: 1, 38: 1, 14: 8, 6: 2}
Did not match all atoms present	4648-54-8	C[Si](C)(C)N=[N+]=[N-]	{1: 3, 34: 2}
Did not match all atoms present	4648-63-9	C[As](C)/C(=C\C(F)(F)F)/C(F)(F)F	{16: 6, 1: 2, 4: 2, 6: 1, 7: 1}
Did not match all atoms present	4648-64-0	C[As](C)/C(=C/C(F)(F)F)/C(F)(F)F	{16: 6, 1: 2, 4: 2, 6: 1, 7: 1}
Did not match all atoms present	4649-06-3	C1C(=O)N(C(=S)S1)CCCCCC(=O)O	{33: 1, 2: 5, 41: 1, 11: 1, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	4649-32-5	C1=CC(=CC=C1CC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O)N5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)O	{25: 4, 2: 1, 27: 2, 14: 14, 33: 2}
Did not match all atoms present	46492-07-3	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2[O-])[O-].[Na+].[Na+]	{14: 8}
Did not match all atoms present	465-11-2	C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2[C@@H](C[C@]4([C@@]3(CC[C@@H]4C5=COC(=O)C=C5)O)C)O)O	{1: 2, 11: 8, 12: 6, 13: 3, 14: 3, 20: 3, 28: 1}
Did not match all atoms present	465-39-4	C[C@]12CC[C@@H](C[C@H]1CCC3C2CC[C@]4([C@]35[C@H](O5)C[C@@H]4C6=COC(=O)C=C6)C)O	{1: 2, 11: 8, 12: 6, 13: 3, 14: 3, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	465-65-6	C=CCN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O	{33: 1, 2: 1, 5: 1, 6: 1, 11: 5, 12: 2, 13: 2, 14: 2, 20: 1, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	46506-88-1	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])C(=O)O)[N+](=O)[O-].[Na+]	{27: 1, 38: 2, 14: 2}
Did not match all atoms present	4653-11-6	C1=CSC(=C1)CCCC(=O)O	{41: 1, 2: 3, 27: 1, 14: 3}
Did not match all atoms present	4653-73-0	CCCCC1=CC=C(C=C1)N2C(=NC(=NC2(C)C)N)N	{1: 3, 2: 3, 35: 2, 33: 1, 13: 1, 14: 4, 15: 2, 30: 2}
Did not match all atoms present	4654-26-6	CCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCCCCCC	{1: 2, 2: 14, 28: 2, 14: 4}
Did not match all atoms present	4654-29-9	CCC(C)COC(=O)C=CC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 6: 2, 14: 5, 28: 1}
Did not match all atoms present	4654-39-1	C1=CC(=CC=C1CCO)Br	{2: 2, 20: 1, 18: 1, 14: 4}
Did not match all atoms present	4656-04-6	C[Si](C)C.C[Si](C)C.[Hg]	{1: 6}
Did not match all atoms present	4656-81-9	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[O-]Cl(=O)(=O)=O	{1: 4, 2: 20, 29: 4, 17: 1}
Did not match all atoms present	4657-12-9	C1=CC=C(C=C1)C(O)S(=O)(=O)O	{3: 1, 20: 2, 29: 2, 14: 5}
Did not match all atoms present	4657-20-9	C[Si]1(O[Si](O[Si](O[Si](O1)(C)C2=CC=CC=C2)(C)C)(C)C3=CC=CC=C3)C	{1: 6, 14: 10, 23: 4}
Did not match all atoms present	4657-93-6	C1CC2=CC=CC3=C(C=CC1=C23)N	{11: 2, 30: 1, 14: 5}
Did not match all atoms present	4657-95-8	C1CC2=CC(=C(C3=C2C1=CC=C3)N)[N+](=O)[O-]	{38: 1, 11: 2, 30: 1, 14: 4}
Did not match all atoms present	4658-28-0	CC(C)NC1=NC(=NC(=N1)N=[N+]=[N-])SC	{1: 3, 34: 2, 3: 1, 40: 1, 35: 3, 31: 1}
Did not match all atoms present	4659-45-4	C1=CC(=C(C(=C1)Cl)C(=O)Cl)Cl	{24: 1, 17: 3, 14: 3}
Did not match all atoms present	4659-47-6	C1=CC(=C(C(=C1Cl)C=O)Cl)Cl	{17: 3, 26: 1, 14: 2}
Did not match all atoms present	4659-48-7	CC1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)C)C)C	{24: 1, 1: 4, 14: 6}
Did not match all atoms present	466-06-8	CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3=C2)O)C6=COC(=O)C=C6)C)C)O)O)O	{1: 3, 11: 8, 12: 9, 13: 3, 14: 4, 15: 1, 20: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	466-11-5	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COS(=O)(=O)[O-])O)C)O)F)C.[Na+]	{1: 3, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 22: 1, 24: 1, 25: 1, 29: 3}
Did not match all atoms present	466-24-0	CCN1C[C@@]2([C@@H](C[C@@H]([C@]34[C@H]1C([C@@H](C23)OC)[C@@]5([C@@H]6C4CC([C@@H]6OC(=O)C7=CC=CC=C7)([C@H]([C@@H]5O)OC)O)O)OC)O)COC	{1: 5, 2: 2, 33: 1, 11: 3, 12: 11, 13: 4, 14: 5, 20: 4, 22: 4, 28: 1}
Did not match all atoms present	466-37-5	C1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{24: 1, 4: 1, 14: 20}
Did not match all atoms present	466-40-0	CCC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 10, 24: 1}
Did not match all atoms present	466-49-9	CC[C@]12CCCN3[C@H]1[C@@]4(CC3)[C@@H](CC2)N(C5=C4C=CC=C5OC)C(=O)C	{1: 3, 2: 1, 33: 2, 11: 7, 12: 2, 13: 2, 14: 3, 22: 1, 24: 1}
Did not match all atoms present	466-90-0	CC(=O)OC1=CCC2C3CC4=C5C2(C1OC5=C(C=C4)OC)CCN3C	{1: 3, 33: 1, 11: 4, 12: 3, 13: 1, 14: 3, 15: 1, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	466-96-6	CN1CC[C@]23[C@@H]4C=C[C@@H]([C@H]2[C@H]1CC5=C3C(=C(C=C5)OC)O4)O	{1: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	466-97-7	C1CNC2CC3=C4C15C2C=CC(C5OC4=C(C=C3)O)O	{32: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	466-99-9	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3C(=O)CC4	{1: 1, 33: 1, 11: 5, 12: 3, 13: 1, 14: 2, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	4662-17-3	CC1=CC(=C(O1)C)C(=O)C2=CC(=C(C(=C2)I)O)I	{1: 2, 14: 3, 19: 2, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	4664-00-0	C1=CC2=C(C(=O)NC2=O)N=C1	{32: 1, 25: 2, 35: 1, 14: 3}
Did not match all atoms present	4664-01-1	C1=CN=CC2=C1C(=O)NC2=O	{32: 1, 25: 2, 35: 1, 14: 3}
Did not match all atoms present	4665-48-9	C1=CC=C2C(=C1)C=CC3=C2C4C(C(C3C5=C4C=CC6=CC=CC=C65)C(=O)O)C(=O)O	{27: 2, 12: 4, 14: 12}
Did not match all atoms present	4667-38-3	CCO[Si](OCC)(Cl)Cl	{1: 2, 2: 2, 22: 2, 17: 2}
Did not match all atoms present	4667-99-6	CCO[Si](OCC)(OCC)Cl	{1: 3, 2: 3, 22: 3, 17: 1}
Did not match all atoms present	4669-59-4	CCN(CC)[Si](C)(C)N(CC)CC	{1: 6, 2: 4, 33: 2}
Did not match all atoms present	4669-92-5	CC[Sb]CC.CC[Sb]CC	{1: 4, 2: 4}
Did not match all atoms present	467-14-1	CN1CC[C@]23[C@@H]4[C@H](CC=C2[C@H]1CC5=C3C(=C(C=C5)OC)O4)O	{1: 2, 33: 1, 11: 4, 12: 3, 13: 1, 14: 3, 15: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	467-15-2	COC1=C2C3=C(C[C@@H]4C5[C@]3(CCN4)C(O2)C(C=C5)O)C=C1	{32: 1, 1: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	467-22-1	CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N(C)CCN(C)CCC3=CC=CC=C3.Cl	{1: 3, 2: 5, 4: 1, 33: 2, 14: 15, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	467-36-7	C=CCC1(C(=O)NC(=S)NC1=O)C2CCCC=C2	{32: 2, 2: 1, 5: 1, 6: 1, 11: 3, 12: 1, 13: 1, 14: 2, 15: 1, 25: 2}
Did not match all atoms present	467-43-6	CCCC(C)C1(C(=O)NC(=S)NC1=O)CCSC	{32: 2, 1: 3, 2: 4, 3: 1, 40: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	467-60-7	C1CCNC(C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{32: 1, 4: 1, 11: 4, 12: 1, 14: 10, 20: 1}
Did not match all atoms present	467-62-9	C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C3=CC=C(C=C3)N)O)N	{20: 1, 4: 1, 30: 3, 14: 12}
Did not match all atoms present	467-63-0	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)(C3=CC=C(C=C3)N(C)C)O	{1: 6, 4: 1, 33: 3, 14: 12, 20: 1}
Did not match all atoms present	467-83-4	CCC(=O)C(CC(C)N1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 2: 2, 3: 1, 4: 1, 33: 1, 11: 5, 14: 10, 24: 1}
Did not match all atoms present	467-84-5	CCC(=O)C(CC(C)N1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 2: 2, 3: 1, 4: 1, 33: 1, 11: 4, 14: 10, 23: 1, 24: 1}
Did not match all atoms present	467-85-6	CCC(=O)C(CCN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 2: 3, 4: 1, 33: 1, 14: 10, 24: 1}
Did not match all atoms present	467-86-7	CCOC(=O)C(CCN1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 3, 4: 1, 33: 1, 11: 4, 14: 10, 23: 1, 28: 1}
Did not match all atoms present	467-98-1	CN1CC[C@]23CC(=O)C=CC2[C@H]1CC4=C3C(=C(C=C4)OC)O	{1: 2, 33: 1, 11: 4, 12: 2, 13: 1, 14: 4, 21: 1, 22: 1, 25: 1}
Did not match all atoms present	4670-10-4	COC1=CC(=CC(=C1)CC(=O)O)OC	{1: 2, 2: 1, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	4670-56-8	CC1=CC(=C(C=C1)C(=O)OC)O	{1: 2, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	4670-86-4	C1=CC=C2C(=C1)C3=CC=CC=C4C3=C2C5=CC=CC=C54	{14: 12}
Did not match all atoms present	4671-03-8	CCC1=NN=CN1C2CCCCC2	{1: 1, 2: 1, 35: 2, 33: 1, 11: 5, 12: 1, 14: 1}
Did not match all atoms present	4671-75-4	CCCCCCCCCCCCCCP(=O)(O)O	{1: 1, 2: 13, 20: 2, 29: 1}
Did not match all atoms present	4671-77-6	C(CCP(=O)(O)O)CP(=O)(O)O	{2: 4, 20: 4, 29: 2}
Did not match all atoms present	4672-38-2	CCCP(=O)(O)O	{1: 1, 2: 2, 20: 2, 29: 1}
Did not match all atoms present	4672-49-5	CS(=O)(=O)OCCOS(=O)(=O)C	{1: 2, 2: 2, 29: 4, 22: 2}
Did not match all atoms present	4673-31-8	CCCC1=CN=CC=C1	{1: 1, 2: 2, 35: 1, 14: 4}
Did not match all atoms present	4674-22-0	CC1=C(C(=C(C(=C1C)[N+](=O)[O-])C)[N+](=O)[O-])C	{1: 4, 38: 2}
Did not match all atoms present	4675-18-7	C1=CC=C(C=C1)C2=C(OC=N2)C3=CC=CC=C3	{35: 1, 14: 11, 23: 1}
Did not match all atoms present	4676-39-5	CC(=O)CC1=CC2=C(C=C1)OCO2	{1: 1, 2: 1, 11: 1, 14: 3, 23: 2, 24: 1}
Did not match all atoms present	4677-09-2	CC1(C2=CC=CC=C2N(C1=CN=NC3=CC=CC=C3)C)C	{1: 3, 34: 2, 6: 1, 33: 1, 13: 1, 14: 9, 15: 1}
Did not match all atoms present	468-07-5	C1CC[C@@]23CCN([C@@H]([C@@H]2C1)CC4=C3C=C(C=C4)O)CCC5=CC=CC=C5	{33: 1, 2: 2, 11: 7, 12: 2, 13: 1, 14: 8, 21: 1}
Did not match all atoms present	468-50-8	CCC1CN(CCC1(C2=CC=CC=C2)OC(=O)CC)C	{1: 3, 2: 2, 33: 1, 11: 3, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	468-51-9	CC[C@H]1CN(CC[C@@]1(C2=CC=CC=C2)OC(=O)CC)C	{1: 3, 2: 2, 33: 1, 11: 3, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	468-56-4	CCOC(=O)C1(CCN(CC1)C)C2=CC(=CC=C2)O	{1: 2, 2: 1, 33: 1, 11: 4, 13: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	468-59-7	CCC(=O)OC1(CCN(CC1C)C)C2=CC=CC=C2	{1: 3, 2: 1, 33: 1, 11: 3, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	468-61-1	CCC(CC)(C1=CC=CC=C1)C(=O)OCCOCCN(CC)CC	{1: 4, 2: 8, 4: 1, 33: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	4680-78-8	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5.[Na+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 21, 15: 2, 29: 6}
Did not match all atoms present	4681-17-8	C1=C(C=C(C(=C1Cl)Cl)CO)Cl	{17: 3, 2: 1, 20: 1, 14: 2}
Did not match all atoms present	4681-22-5	C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)O)N)S(=O)(=O)[O-].[Na+]	{30: 1, 20: 1, 29: 5, 14: 5}
Did not match all atoms present	4681-36-1	CCOP(=S)(OCC)SC(C1=CC=CC=C1)C(=O)OCCF	{1: 2, 2: 4, 3: 1, 40: 1, 14: 5, 16: 1, 22: 2, 28: 1}
Did not match all atoms present	46813-44-9	C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)[N+]#N)Cl	{17: 2, 34: 1, 22: 1, 14: 7}
Did not match all atoms present	46814-61-3	CN(C)CCN(CCN(C)C)C1=CC=CC=C1	{1: 4, 2: 4, 14: 5, 33: 3}
Did not match all atoms present	46815-10-5	CCSC1=CC2=C(C=C1)SC3=CC=CC=C3N2	{32: 1, 1: 1, 2: 1, 40: 1, 41: 1, 14: 7}
Did not match all atoms present	46817-91-8	CCOC1=CC=CC=C1OCC2CNCCO2	{32: 1, 1: 1, 2: 2, 11: 3, 12: 1, 14: 4, 22: 2, 23: 1}
Did not match all atoms present	4682-94-4	C1=COC(=C1)C(=O)C2=CC=C(C=C2)O	{24: 1, 21: 1, 14: 7, 23: 1}
Did not match all atoms present	46830-22-2	C[N+](C)(CCOC(=O)C=C)CC1=CC=CC=C1.[Cl-]	{1: 2, 2: 3, 5: 1, 6: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	4684-94-0	C1=CC(=NC(=C1)Cl)C(=O)O	{17: 1, 27: 1, 14: 3, 35: 1}
Did not match all atoms present	46841-90-1	C1=CC=C(C=C1)OCCOC(=O)C=CC(=O)O	{2: 2, 6: 2, 14: 5, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	4685-14-7	C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C	{1: 2, 14: 8, 33: 2}
Did not match all atoms present	4685-47-6	CC1=C(C=C(C=C1)OC)C	{1: 3, 22: 1, 14: 3}
Did not match all atoms present	4685-74-9	C1CCCCC2=CC=C(CCC1)C=C2	{11: 8, 14: 4}
Did not match all atoms present	46874-41-3	CC(=O)NC1=CC=CC2=C1C=CC=C2OC(=O)C	{24: 1, 1: 2, 28: 1, 14: 6, 31: 1}
Did not match all atoms present	46878-66-4	CN(C)C(=O)C1=CC=CC(=C1O)C2=CC=CC=C2	{24: 1, 1: 2, 21: 1, 14: 8, 33: 1}
Did not match all atoms present	4688-40-8	C1=CC=C(C=C1)COS(=O)(=O)[O-].[Na+]	{2: 1, 22: 1, 14: 5, 29: 3}
Did not match all atoms present	469-21-6	CC(C1=CC=CC=C1)(C2=CC=CC=N2)OCCN(C)C	{1: 3, 2: 2, 35: 1, 4: 1, 33: 1, 14: 9, 22: 1}
Did not match all atoms present	469-62-5	CCC(=O)O[C@](CC1=CC=CC=C1)(C2=CC=CC=C2)[C@H](C)CN(C)C	{1: 4, 2: 3, 3: 1, 4: 1, 33: 1, 14: 10, 28: 1}
Did not match all atoms present	469-79-4	CCC(=O)C1(CCN(CC1)C)C2=CC(=CC=C2)O	{1: 2, 2: 1, 33: 1, 11: 4, 13: 1, 14: 4, 21: 1, 24: 1}
Did not match all atoms present	469-81-8	CCOC(=O)C1(CCN(CC1)CCN2CCOCC2)C3=CC=CC=C3	{1: 1, 2: 3, 33: 2, 11: 8, 13: 1, 14: 5, 23: 1, 28: 1}
Did not match all atoms present	469-82-9	CCOC(=O)C1(CCN(CC1)CCOCCO)C2=CC=CC=C2	{1: 1, 2: 5, 33: 1, 11: 4, 13: 1, 14: 5, 20: 1, 22: 1, 28: 1}
Did not match all atoms present	46917-07-1	CC(=C)C(=O)OCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 3, 5: 1, 7: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	4692-52-8	CCCCCCCCCCCCCCCC/C=C\S(=O)(=O)[O-].[Na+]	{1: 1, 2: 15, 29: 3, 6: 2}
Did not match all atoms present	4692-94-8	CC(=O)CC(=O)NC1=NC2=CC=CC=C2S1	{1: 1, 2: 1, 35: 1, 41: 1, 14: 4, 24: 2, 31: 1}
Did not match all atoms present	4693-01-0	CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC1=O	{1: 1, 28: 2, 38: 1, 14: 3, 33: 1}
Did not match all atoms present	4693-02-1	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)OC(=O)N2	{32: 1, 28: 2, 38: 1, 14: 3}
Did not match all atoms present	4693-19-0	CCCCCCCC(=O)C1=C(C=CC(=C1)O)O	{24: 1, 1: 1, 2: 6, 21: 2, 14: 3}
Did not match all atoms present	46957-56-6	C1=CC=C(C=C1)CC2=CC=CC=C2C[N+]3=CC=CC=C3	{33: 1, 2: 2, 14: 14}
Did not match all atoms present	4696-54-2	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 12}
Did not match all atoms present	4697-14-7	CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CSC=C3)C(=O)[O-])C(=O)[O-])C.[Na+].[Na+]	{1: 2, 3: 1, 33: 1, 41: 2, 12: 3, 13: 1, 14: 3, 24: 3, 25: 1, 31: 1}
Did not match all atoms present	4697-62-5	COC1=C(C=C(C(=C1)CC(=O)O)Br)OC	{1: 2, 2: 1, 14: 2, 18: 1, 22: 2, 27: 1}
Did not match all atoms present	4698-96-8	C1C(O1)COC2=CC=C(C=C2)C3=CC=CC=C3	{2: 1, 11: 1, 12: 1, 14: 9, 22: 1, 23: 1}
Did not match all atoms present	4699-26-7	CC1=C2C3=CC=CC=C3SC2=C(C4=C1C5=CC=CC=C5S4)C	{1: 2, 14: 8, 41: 2}
Did not match all atoms present	470-90-6	CCOP(=O)(OCC)OC(=CCl)C1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 2, 6: 1, 7: 1, 14: 3, 17: 3, 22: 3, 29: 1}
Did not match all atoms present	4700-56-5	C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)OC(=O)CCC(=O)O	{32: 1, 2: 2, 35: 1, 12: 1, 14: 8, 15: 1, 17: 1, 25: 1, 27: 1, 28: 1}
Did not match all atoms present	47000-92-0	CC1=C(C=C(C=C1)NC(=O)C)NS(=O)(=O)C(F)(F)F	{1: 2, 4: 1, 14: 3, 16: 3, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	4701-17-1	C1=C(SC(=C1)Br)C=O	{41: 1, 18: 1, 26: 1, 14: 2}
Did not match all atoms present	4701-36-4	CCC(=CC)C1=CC=CC=C1	{1: 2, 2: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	4702-13-0	C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)O	{25: 2, 2: 1, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	4702-34-5	C1COC(=O)C2=CC=CC=C21	{11: 2, 28: 1, 14: 4}
Did not match all atoms present	4702-64-1	COC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)N)N	{1: 1, 14: 7, 21: 2, 22: 1, 25: 2, 30: 2}
Did not match all atoms present	4703-33-7	CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)O	{1: 2, 2: 2, 3: 1, 40: 1, 14: 4, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	4703-38-2	CSCCC(C(=O)O)NC(=O)C1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 40: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	4703-96-2	C1=COC(=C1)/C=C/2\C(=O)NC(=S)S2	{32: 1, 6: 1, 41: 1, 14: 3, 15: 2, 23: 1, 25: 1}
Did not match all atoms present	4705-94-6	CC1=CC(=C(C2=CC=CC=C12)C)O	{1: 2, 21: 1, 14: 5}
Did not match all atoms present	4706-43-8	C1=CC=C(C=C1)CN2C3=CC=CC=C3N=N2	{33: 1, 2: 1, 35: 2, 14: 9}
Did not match all atoms present	4706-89-2	CC1=CC(=C(C=C1)C(C)C)C	{1: 4, 3: 1, 14: 3}
Did not match all atoms present	4706-90-5	CC1=CC(=CC(=C1)C(C)C)C	{1: 4, 3: 1, 14: 3}
Did not match all atoms present	4707-32-8	CC1(CCC2=C(O1)C3=CC=CC=C3C(=O)C2=O)C	{1: 2, 11: 2, 13: 1, 14: 4, 15: 2, 23: 1, 25: 2}
Did not match all atoms present	4707-47-5	CC1=CC(=C(C(=C1C(=O)OC)O)C)O	{1: 3, 28: 1, 21: 2, 14: 1}
Did not match all atoms present	4707-49-7	CC1=C(C=CC(=C1O)C(=O)O)O	{1: 1, 27: 1, 21: 2, 14: 2}
Did not match all atoms present	4707-56-6	CN(C)C1=CC=CC=C1CO	{1: 2, 2: 1, 20: 1, 14: 4, 33: 1}
Did not match all atoms present	4707-71-5	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C=O	{26: 1, 14: 9}
Did not match all atoms present	4707-95-3	CC(C)(C)P(=O)(Cl)Cl	{1: 3, 4: 1, 29: 1, 17: 2}
Did not match all atoms present	47073-92-7	CC(C1=CC=C(C=C1)OC#N)C2=CC=C(C=C2)OC#N	{1: 1, 3: 1, 22: 2, 14: 8, 37: 2}
Did not match all atoms present	4708-04-7	CCCP(=O)(Cl)Cl	{1: 1, 2: 2, 29: 1, 17: 2}
Did not match all atoms present	4709-20-0	CC1=CC(=C(C2=CC=CC=C12)O)C	{1: 2, 21: 1, 14: 5}
Did not match all atoms present	4709-94-8	CC\1=NN(C(=O)/C1=N\NC2=NC(=NS2)C3=CC=CC=C3)C4=CC=CC=C4	{1: 1, 34: 1, 35: 3, 33: 1, 41: 1, 14: 10, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	471-03-4	C(CCl)S(=O)(=O)CCCl	{17: 2, 2: 4, 29: 2}
Did not match all atoms present	471-34-1	C(=O)([O-])[O-].[Ca+2]	{24: 1}
Did not match all atoms present	471-35-2	C[As](C)[As](C)C	{1: 4}
Did not match all atoms present	471-87-4	C[N+]1(CCC[C@H]1C(=O)[O-])C	{24: 1, 1: 2, 11: 3, 12: 1}
Did not match all atoms present	471-95-4	CC(=O)O[C@H]1C[C@@]2(C3CC[C@@H]4C[C@H](CC[C@@]4(C3CC[C@@]2([C@H]1C5=COC(=O)C=C5)C)C)O)O	{1: 3, 11: 8, 12: 6, 13: 3, 14: 3, 20: 2, 28: 2}
Did not match all atoms present	4711-67-5	CCOC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2	{1: 1, 2: 1, 14: 11, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	4711-68-6	CCOC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O	{1: 1, 2: 1, 14: 10, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	4712-51-0	C[Si](C)(C)CSC[Si](C)(C)C	{40: 1, 1: 6, 2: 2}
Did not match all atoms present	4712-55-4	C1=CC=C(C=C1)O[P+](=O)OC2=CC=CC=C2	{22: 2, 14: 10, 29: 1}
Did not match all atoms present	4713-59-1	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(Br)Br	{18: 2, 14: 10}
Did not match all atoms present	4714-25-4	C1=CC=C(C=C1)C=CC2=CC=CC=C2[N+](=O)[O-]	{38: 1, 14: 9, 6: 2}
Did not match all atoms present	47163-83-7	C1=CC(=CC=C1C(=O)Cl)N=[N+](C2=CC=C(C=C2)C(=O)Cl)[O-]	{33: 1, 34: 1, 14: 8, 17: 2, 24: 2, 29: 1}
Did not match all atoms present	47172-89-4	C1=CC=C(C=C1)OC(=O)CCCC(=O)OC2=CC=CC=C2	{2: 3, 28: 2, 14: 10}
Did not match all atoms present	47173-80-8	CC(C)(C)OC(=O)N[C@H](COCC1=CC=CC=C1)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 14: 5, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	47182-04-7	CCN=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 34: 1, 14: 15}
Did not match all atoms present	47189-08-2	CCOC(C)(C1=CC=C(C=C1)C(C)(OCC)OCC)OCC	{1: 6, 2: 4, 4: 2, 22: 4, 14: 4}
Did not match all atoms present	4719-75-9	CC/C(=C(/CC)\C1=CC=C(C=C1)OP(=O)([O-])[O-])/C2=CC=C(C=C2)OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 2: 2, 7: 2, 14: 8, 22: 2, 29: 6}
Did not match all atoms present	472-41-3	CC1(CC(C2=CC=CC=C2O1)(C)C3=CC=C(C=C3)O)C	{1: 3, 11: 1, 13: 2, 14: 8, 21: 1, 23: 1}
Did not match all atoms present	4720-61-0	C1=CC=C2C(=C1)N=C(S2)SCCCS(=O)(=O)O	{2: 3, 35: 1, 40: 1, 41: 1, 14: 4, 20: 1, 29: 2}
Did not match all atoms present	4721-36-2	CC(=C)P(=O)(O)O	{1: 1, 29: 1, 20: 2, 5: 1, 7: 1}
Did not match all atoms present	4721-37-3	CC(C)P(=O)(O)O	{1: 2, 3: 1, 20: 2, 29: 1}
Did not match all atoms present	4721-98-6	CC1=NCCC2=CC(=C(C=C12)OC)OC	{1: 3, 35: 1, 11: 2, 14: 2, 15: 1, 22: 2}
Did not match all atoms present	4722-99-0	CCCCCCC(CC=CCCCCCCCC(=O)[O-])O.CCCCCCC(CC=CCCCCCCCC(=O)[O-])O.[Ba+2]	{1: 2, 2: 26, 3: 2, 6: 4, 20: 2, 24: 2}
Did not match all atoms present	4723-64-2	C1=C[SiH2]C=C1	{14: 4}
Did not match all atoms present	47230-38-6	CCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC	{1: 2, 2: 2, 28: 2, 14: 8}
Did not match all atoms present	4724-47-4	CCCCCCCCCCCCCCCCCCP(=O)(O)O	{1: 1, 2: 17, 20: 2, 29: 1}
Did not match all atoms present	4724-48-5	CCCCCCCCP(=O)(O)O	{1: 1, 2: 7, 20: 2, 29: 1}
Did not match all atoms present	4724-58-7	CC1=CC=CC=C1C(C2=CC=CC=C2)OCC[NH+](C)C.C(C(=O)O)C(CC(=O)[O-])(C(=O)O)O	{1: 3, 2: 4, 3: 1, 4: 1, 14: 9, 20: 1, 22: 1, 24: 1, 27: 2}
Did not match all atoms present	4726-14-1	CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-]	{1: 3, 2: 4, 38: 2, 33: 1, 14: 2, 29: 2}
Did not match all atoms present	4726-18-5	C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)O)O)N	{2: 2, 14: 3, 20: 1, 21: 1, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	4726-22-1	C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)O)N)O	{2: 2, 14: 3, 20: 1, 21: 1, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	4726-96-9	C1=CC=C(C=C1)COC[C@@H](C(=O)O)N	{2: 2, 3: 1, 14: 5, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	4727-29-1	C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)O	{24: 1, 27: 1, 14: 9, 31: 1}
Did not match all atoms present	4727-50-8	CCN1C=CC(=CC=CC2=CC=[N+](C3=CC=CC=C23)CC)C4=CC=CC=C41.[I-]	{1: 2, 2: 2, 6: 3, 33: 2, 14: 12, 15: 1, 19: 1}
Did not match all atoms present	4727-62-2	CC[N+]1(CCCCC1)CCN2CCN(CC2)CC[N+]3(CCCCC3)CC.[I-].[I-]	{19: 2, 1: 2, 2: 6, 11: 14, 33: 2}
Did not match all atoms present	4727-72-4	C1CN(CCC1O)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 4, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	4728-04-5	CC(=O)C(=CC1=CC=CO1)C(=O)C	{1: 2, 6: 1, 7: 1, 14: 3, 23: 1, 24: 2}
Did not match all atoms present	473-27-8	C1=CC(=CC=C1N)S(=O)(=O)C(F)(F)F	{16: 3, 30: 1, 4: 1, 29: 2, 14: 4}
Did not match all atoms present	473-29-0	C1=CC=C(C=C1)S(=O)(=O)N(Cl)Cl	{17: 2, 29: 2, 14: 5, 33: 1}
Did not match all atoms present	473-30-3	C1=CC(=CC=C1N)S(=O)(=O)C2=CN=C(S2)N	{41: 1, 30: 2, 35: 1, 29: 2, 14: 5}
Did not match all atoms present	473-34-7	CC1=CC=C(C=C1)S(=O)(=O)N(Cl)Cl	{1: 1, 33: 1, 29: 2, 14: 4, 17: 2}
Did not match all atoms present	473-41-6	CCCCNC(=O)[N-]S(=O)(=O)C1=CC=C(C=C1)C.[Na+]	{1: 2, 2: 3, 34: 1, 14: 4, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	4730-53-4	C12=NN=NC1=NNNC2=O	{32: 2, 25: 1, 35: 4}
Did not match all atoms present	47300-91-4	CC1=CC(=C(C=C1)N=NC2=CC(=C(C=C2C)[N+]#N)OC)[N+](=O)[O-]	{1: 3, 34: 3, 38: 1, 22: 1, 14: 5}
Did not match all atoms present	47309-20-6	C1=CC=C(C=C1)C(=O)OCCNCCOC(=O)C2=CC=CC=C2	{2: 4, 28: 2, 14: 10, 31: 1}
Did not match all atoms present	4731-34-4	CC1=CC=CC=C1OC2=CC=CC=C2C	{1: 2, 22: 1, 14: 8}
Did not match all atoms present	4731-53-7	CCCCCCCCP(CCCCCCCC)CCCCCCCC	{1: 3, 2: 21}
Did not match all atoms present	4731-65-1	COC1=CC=CC=C1P(C2=CC=CC=C2OC)C3=CC=CC=C3OC	{1: 3, 22: 3, 14: 12}
Did not match all atoms present	4731-84-4	CCCC(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 1, 2: 2, 3: 1, 21: 2, 14: 8}
Did not match all atoms present	4732-12-1	CCOC1=C(C=CC(=C1)C)C(C)C	{1: 4, 2: 1, 3: 1, 22: 1, 14: 3}
Did not match all atoms present	4732-14-3	CCOC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 3, 22: 1, 14: 2}
Did not match all atoms present	4732-72-3	C1=CC=C2C(=C1)C(=O)C(=O)O2	{25: 1, 28: 1, 14: 4}
Did not match all atoms present	4733-39-5	CC1=NC2=C(C=CC3=C2N=C(C=C3C4=CC=CC=C4)C)C(=C1)C5=CC=CC=C5	{1: 2, 35: 2, 14: 14}
Did not match all atoms present	4733-50-0	C1=CC(=C(C(=C1O)C#N)C#N)O	{21: 2, 14: 2, 37: 2}
Did not match all atoms present	4733-52-2	C1=CC=C2C(=C1)C(=O)OOC2=O	{28: 2, 14: 4}
Did not match all atoms present	4734-27-4	CC1=C(C(=O)N2C(=N1)N=C(N2)SC)CCO.CSC1=NNC(=N1)N	{32: 2, 1: 3, 2: 2, 35: 4, 33: 1, 40: 2, 20: 1, 25: 1, 30: 1}
Did not match all atoms present	4736-60-1	CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]	{1: 1, 2: 1, 19: 1, 14: 15}
Did not match all atoms present	4737-21-7	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N=C=O	{8: 1, 34: 1, 4: 1, 29: 1, 14: 15}
Did not match all atoms present	47377-16-2	CCCCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O	{1: 1, 2: 13, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	474-07-7	C1C2=CC(=C(C=C2[C@H]3[C@@]1(COC4=C3C=CC(=C4)O)O)O)O	{11: 2, 12: 1, 13: 1, 14: 5, 20: 1, 21: 3, 23: 1}
Did not match all atoms present	474-86-2	C[C@]12CC[C@H]3C(=CCC4=C3C=CC(=C4)O)[C@@H]1CCC2=O	{1: 1, 11: 5, 12: 2, 13: 1, 14: 4, 15: 1, 21: 1, 25: 1}
Did not match all atoms present	4740-11-8	CCN(CC)C(=S)SCC	{40: 1, 1: 3, 2: 3, 33: 1, 7: 1}
Did not match all atoms present	4740-47-0	C1=CC=C(C=C1)CC(CO)(C(=O)O)N	{2: 2, 4: 1, 14: 5, 20: 1, 27: 1, 30: 1}
Did not match all atoms present	4741-53-1	C1=CC=C(C=C1)C2=C(C(=C3C(=C2C4=CC=CC=C4)C(=O)OC3=O)C5=CC=CC=C5)C6=CC=CC=C6	{28: 2, 14: 20}
Did not match all atoms present	4743-17-3	C1=CC2=C(C=C1Cl)C(=O)OC(=O)N2	{32: 1, 17: 1, 28: 2, 14: 3}
Did not match all atoms present	4743-40-2	C1CCPCC1	{11: 5}
Did not match all atoms present	4743-57-1	C1=CC=C2C(=C1)C(=CC(=O)O)OC2=O	{27: 1, 28: 1, 14: 4, 6: 1, 15: 1}
Did not match all atoms present	4743-74-2	CC(CC=C)(C1=CC=CC=C1)O	{1: 1, 2: 1, 4: 1, 5: 1, 6: 1, 14: 5, 20: 1}
Did not match all atoms present	4746-32-1	CCCCCCNC1=CC=CC=C1	{1: 1, 2: 5, 14: 5, 31: 1}
Did not match all atoms present	4747-13-1	COC(=C)C1=CC=CC=C1	{1: 1, 22: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	4747-15-3	COC=CC1=CC=CC=C1	{1: 1, 22: 1, 14: 5, 6: 2}
Did not match all atoms present	4748-78-1	CCC1=CC=C(C=C1)C=O	{1: 1, 2: 1, 26: 1, 14: 4}
Did not match all atoms present	4749-68-2	C1CN=C(N1)NC2=CC=CC=C2Cl	{32: 1, 35: 1, 11: 2, 14: 4, 15: 1, 17: 1, 31: 1}
Did not match all atoms present	475-03-6	CC1=CC2=C(C=C1)C(CCC2)(C)C	{1: 3, 11: 3, 13: 1, 14: 3}
Did not match all atoms present	475-25-2	C1C2=CC(=O)C(=CC2=C3C1(COC4=C3C=CC(=C4O)O)O)O	{11: 2, 13: 1, 14: 4, 15: 4, 20: 2, 21: 2, 23: 1, 25: 1}
Did not match all atoms present	475-26-3	C1=CC(=CC=C1C(C2=CC=C(C=C2)F)C(Cl)(Cl)Cl)F	{16: 2, 17: 3, 3: 1, 4: 1, 14: 8}
Did not match all atoms present	475-38-7	C1=CC(=C2C(=O)C=CC(=O)C2=C1O)O	{25: 2, 21: 2, 14: 4}
Did not match all atoms present	475-63-8	C1=CC=C2C(=C1)C3=C4C(=C5C=CC=C6C5=C3C7=CC=CC=C7C6=O)C=CC=C4C2=O	{25: 2, 14: 14}
Did not match all atoms present	475-67-2	CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)OC)OC	{1: 4, 33: 1, 11: 3, 12: 1, 14: 3, 21: 1, 22: 3}
Did not match all atoms present	475-80-9	C1OC2=C(O1)C3=C(C(=C2)C(=O)O)C(=CC4=CC=CC=C43)[N+](=O)[O-]	{27: 1, 11: 1, 38: 1, 14: 6, 23: 2}
Did not match all atoms present	475-81-0	CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)OC)OC)OC	{1: 5, 33: 1, 11: 3, 12: 1, 14: 3, 22: 4}
Did not match all atoms present	475-83-2	CN1CCC2=CC(=C(C3=C2[C@H]1CC4=CC=CC=C43)OC)OC	{1: 3, 33: 1, 11: 3, 12: 1, 14: 5, 22: 2}
Did not match all atoms present	475-91-2	CN1C2=CC=CC=C2C(=O)C3=C1C(=C4C(=C3OC)OCO4)OC	{1: 3, 33: 1, 11: 1, 14: 4, 22: 2, 23: 2, 25: 1}
Did not match all atoms present	4750-57-6	CN1C(=CN=C1C=O)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 33: 1, 14: 1, 26: 1}
Did not match all atoms present	4751-23-9	CCN1C2=CC(=C(C=C2[N+](=C1C=CNC3=CC=CC=C3)CC)Cl)Cl.[I-]	{1: 2, 2: 2, 6: 2, 33: 2, 14: 7, 17: 2, 19: 1, 31: 1}
Did not match all atoms present	4752-02-7	C1=CC(=CC=C1N=C(N)/N=C(\[NH3+])/N)[N+](=O)[O-].[Cl-]	{34: 2, 38: 1, 7: 2, 14: 4, 17: 1, 30: 2}
Did not match all atoms present	4752-12-9	[2H]C([2H])([2H])SC	{40: 1, 1: 2}
Did not match all atoms present	4753-75-7	CNCC1=CC=CO1	{1: 1, 2: 1, 31: 1, 14: 3, 23: 1}
Did not match all atoms present	4754-27-2	CC(C1=CN=CC=C1)O	{1: 1, 3: 1, 20: 1, 14: 4, 35: 1}
Did not match all atoms present	4754-44-3	CCCCCCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 13, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	4755-59-3	CN(C)CCCN1C2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3	{1: 2, 2: 3, 33: 3, 14: 8, 17: 1, 25: 1}
Did not match all atoms present	4756-45-0	COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O	{1: 1, 14: 7, 21: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	4756-75-6	C1=CC=C(C=C1)[Sb](=O)(C2=CC=CC=C2)C3=CC=CC=C3	{29: 1, 14: 15}
Did not match all atoms present	4757-55-5	CC1(C2=CC=CC=C2N(C3=CC=CC=C31)CCCN(C)C)C	{1: 4, 2: 3, 13: 1, 14: 8, 33: 2}
Did not match all atoms present	4758-64-9	CCCC1=C(NC(=C1C)C(=O)OCC)C	{32: 1, 1: 4, 2: 3, 28: 1}
Did not match all atoms present	476-28-8	C1CN2CC3=CC4=C(C=C3[C@H]5[C@H]2C1=C[C@@H]([C@H]5O)O)OCO4	{33: 1, 11: 4, 12: 4, 14: 3, 15: 1, 20: 2, 23: 2}
Did not match all atoms present	476-32-4	CN1CC2=C(C=CC3=C2OCO3)[C@@H]4[C@H]1C5=CC6=C(C=C5C[C@@H]4O)OCO6	{1: 1, 33: 1, 11: 4, 12: 3, 14: 4, 20: 1, 23: 4}
Did not match all atoms present	476-45-9	CC1=C(C2=C(C(=C1CC(=O)C)O)C(=O)C(=CC2=O)OC)O	{1: 3, 2: 1, 14: 1, 15: 1, 21: 2, 22: 1, 24: 1, 25: 2}
Did not match all atoms present	476-56-2	CC1=CC(=C2C(=C1O)C(=O)C3=C(C2=O)C(=CC=C3)O)O	{1: 1, 21: 3, 14: 4, 25: 2}
Did not match all atoms present	476-60-8	C1=CC=C2C(=C1)C(=C3C(=CC=C(C3=C2O)O)O)O	{21: 4, 14: 6}
Did not match all atoms present	476-66-4	C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O	{28: 2, 21: 4, 14: 2}
Did not match all atoms present	476-69-7	CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)OC)O)OC	{1: 4, 33: 1, 11: 3, 12: 1, 14: 3, 21: 1, 22: 3}
Did not match all atoms present	476-70-0	CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)OC)O	{1: 3, 33: 1, 11: 3, 12: 1, 14: 3, 21: 2, 22: 2}
Did not match all atoms present	476-73-3	C1=CC(=C(C(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 14: 2}
Did not match all atoms present	4760-34-3	CNC1=CC=CC=C1N	{1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	4760-53-6	C1=CC=C(C=C1)C(C#N)C2=C(C=C(C=C2)N)Cl	{17: 1, 3: 1, 30: 1, 14: 8, 37: 1}
Did not match all atoms present	4762-26-9	CCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 2: 5, 18: 1, 14: 15}
Did not match all atoms present	4763-79-5	C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)C=CC4=CC=C(C=C4)C(=O)O	{35: 1, 27: 1, 14: 12, 6: 2, 23: 1}
Did not match all atoms present	4764-17-4	CC(CC1=CC2=C(C=C1)OCO2)N	{1: 1, 2: 1, 3: 1, 11: 1, 14: 3, 23: 2, 30: 1}
Did not match all atoms present	4766-33-0	C1=CC2=C(C=CC=C2Br)C(=C1)N	{18: 1, 30: 1, 14: 6}
Did not match all atoms present	4766-57-8	CCCCO[Si](OCCCC)(OCCCC)OCCCC	{1: 4, 2: 12, 22: 4}
Did not match all atoms present	4769-96-4	C1=CC(=CC2=C1C=CN2)[N+](=O)[O-]	{32: 1, 38: 1, 14: 5}
Did not match all atoms present	4769-97-5	C1=CC2=C(C=CN2)C(=C1)[N+](=O)[O-]	{32: 1, 38: 1, 14: 5}
Did not match all atoms present	477-29-2	CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O	{1: 4, 2: 1, 11: 2, 12: 6, 14: 4, 20: 4, 22: 4, 23: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	477-30-5	CNC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC	{1: 5, 11: 2, 12: 1, 14: 4, 22: 4, 25: 1, 31: 1}
Did not match all atoms present	477-32-7	CCC(C)C(=O)OC1C(C2=C(C=CC3=C2OC(=O)C=C3)OC1(C)C)OC(=O)C	{1: 5, 2: 1, 3: 1, 12: 2, 13: 1, 14: 4, 23: 1, 28: 3}
Did not match all atoms present	477-47-4	COC1=CC(=CC(=C1OC)OC)[C@H]2[C@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O	{1: 3, 11: 2, 12: 4, 14: 4, 20: 1, 22: 3, 23: 2, 28: 1}
Did not match all atoms present	477-73-6	CC1=CC2=C(C=C1N)[N+](=C3C=C(C(=CC3=N2)C)N)C4=CC=CC=C4.[Cl-]	{1: 2, 35: 1, 33: 1, 14: 9, 17: 1, 30: 2}
Did not match all atoms present	477-75-8	C1=CC=C2C3C4=CC=CC=C4C(C2=C1)C5=CC=CC=C35	{12: 2, 14: 12}
Did not match all atoms present	477-89-4	CN1C(=O)C=C(C2=C1C3=C(C=C2)OCO3)OC	{1: 2, 33: 1, 11: 1, 14: 3, 22: 1, 23: 2, 25: 1}
Did not match all atoms present	477-90-7	COC1=C(C=C2C(=C1O)C3C(C(C(C(O3)CO)O)O)OC2=O)O	{1: 1, 2: 1, 12: 5, 14: 1, 20: 3, 21: 2, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	4771-08-8	C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9, 31: 1}
Did not match all atoms present	4771-47-5	C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C(=O)O	{17: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	4771-50-0	CC1=CC=CC2=C1NC=C2C=O	{32: 1, 1: 1, 26: 1, 14: 4}
Did not match all atoms present	47724-48-1	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C	{1: 5, 2: 3, 14: 8, 23: 1, 28: 1, 31: 2}
Did not match all atoms present	4773-82-4	CC1=C(C2=CC=CC=C2C1)C	{1: 2, 11: 1, 14: 4, 15: 2}
Did not match all atoms present	4773-83-5	CC1C(=C(C2=CC=CC=C12)C)C	{1: 3, 12: 1, 14: 4, 15: 2}
Did not match all atoms present	4774-14-5	C1=C(N=C(C=N1)Cl)Cl	{17: 2, 35: 2, 14: 2}
Did not match all atoms present	4774-73-6	C[Si](C)(N=[N+]=[N-])N=[N+]=[N-]	{1: 2, 34: 4}
Did not match all atoms present	47743-68-0	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=C(C=C3)N(CC)CC	{1: 6, 2: 6, 33: 3, 7: 1, 14: 12, 15: 2}
Did not match all atoms present	47743-70-4	CCN(CC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC	{1: 6, 2: 6, 14: 12, 33: 4}
Did not match all atoms present	4775-09-1	CCOP(=O)(CC)CC	{1: 3, 2: 3, 29: 1, 22: 1}
Did not match all atoms present	4776-06-1	C1=CC(=CC(=C1)NC(=O)C2=CC(=CC(=C2O)Br)Br)C(F)(F)F	{4: 1, 14: 6, 16: 3, 18: 2, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	478-01-3	COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC)OC	{1: 6, 25: 1, 22: 6, 14: 4, 23: 1}
Did not match all atoms present	478-08-0	C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)CO)O	{25: 2, 2: 1, 20: 1, 21: 2, 14: 5}
Did not match all atoms present	478-15-9	COC1=C(C2=C(CC3C4=C(C(=C(C=C4CCN3C2)OC)OC)O)C=C1)OC	{1: 4, 33: 1, 11: 4, 12: 1, 14: 3, 21: 1, 22: 4}
Did not match all atoms present	478-40-0	CC1=C(C2=C(C(=CC=C2)O)C(=O)C1=O)O	{1: 1, 14: 3, 15: 2, 20: 1, 21: 1, 25: 2}
Did not match all atoms present	478-43-3	C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3C2=O)C(=O)O)O	{25: 2, 27: 1, 21: 2, 14: 5}
Did not match all atoms present	478-61-5	CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)O)OC	{1: 5, 33: 2, 11: 6, 12: 2, 14: 10, 21: 1, 22: 3, 23: 2}
Did not match all atoms present	478-71-7	C1=CC=C2C(=C1)C=CC3=C2C(=C(C=C3)O)O	{21: 2, 14: 8}
Did not match all atoms present	478-73-9	CN1[C@H]2CC[C@@H]1[C@@H]([C@H](C2)OC(=O)C3=CC=CC=C3)C(=O)OC	{1: 2, 33: 1, 11: 3, 12: 4, 14: 5, 28: 2}
Did not match all atoms present	478-94-4	CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)N	{32: 1, 1: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 24: 1, 30: 1}
Did not match all atoms present	478-95-5	CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)C(=O)O	{32: 1, 1: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 27: 1}
Did not match all atoms present	4780-60-3	C1(=C(C(=C(C(=C1F)F)F)F)F)C(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F	{16: 15, 3: 1}
Did not match all atoms present	4780-79-4	C1=CC=C2C(=C1)C=CC=C2CO	{2: 1, 20: 1, 14: 7}
Did not match all atoms present	47812-48-6	CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(S4)C5=CC6=C(C=C5)N=C(S6)C7=CC=C(C=C7)N)S(=O)(=O)O	{1: 1, 35: 3, 41: 3, 14: 12, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	47814-20-0	C(=C(\O)/C(F)(F)F)\C(=O)C(F)(F)F.C(=C(\O)/C(F)(F)F)\C(=O)C(F)(F)F.C(=C(\O)/C(F)(F)F)\C(=O)C(F)(F)F.[Pr]	{4: 6, 6: 3, 7: 3, 16: 18, 20: 3, 24: 3}
Did not match all atoms present	4782-00-7	CCCC[Si](CCCC)(CCCC)OCC	{1: 4, 2: 10, 22: 1}
Did not match all atoms present	47834-75-3	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)NC(=O)NC3=CC=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)O	{1: 1, 34: 3, 14: 14, 15: 2, 20: 1, 22: 1, 24: 1, 25: 1, 27: 1, 29: 2, 31: 3}
Did not match all atoms present	4785-62-0	CCOC(=O)C(C1CCS(=O)(=O)C1)C(=O)OCC	{1: 2, 2: 2, 3: 1, 11: 3, 12: 1, 28: 2, 29: 2}
Did not match all atoms present	47862-55-5	CCCCN(CCCC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CCCC)CCCC)C3=CC=C(C=C3)N(CCCC)CCCC	{1: 6, 2: 18, 14: 12, 33: 4}
Did not match all atoms present	4789-21-3	[2H]C(=C=O)[2H]	{8: 1, 5: 1, 29: 1}
Did not match all atoms present	4789-40-6	CC(C)(C)C1=CC=C(O1)C(C)(C)C	{1: 6, 4: 2, 14: 2, 23: 1}
Did not match all atoms present	47897-65-4	C1=CC(=C(C=C1C2=CC(=C(C=C2)N/N=C/3\C(=CC(=O)C4=C(C=C(C=C34)S(=O)(=O)[O-])N)S(=O)(=O)[O-])Cl)Cl)N/N=C/5\C(=CC(=O)C6=C(C=C(C=C56)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 12, 15: 4, 17: 2, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	479-00-5	C[C@@H](CO)NC(=O)[C@@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C	{32: 1, 1: 2, 2: 1, 3: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	479-13-0	C1=CC2=C(C=C1O)OC3=C2C(=O)OC4=C3C=CC(=C4)O	{28: 1, 21: 2, 14: 6, 23: 1}
Did not match all atoms present	479-18-5	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CO)O	{1: 2, 2: 2, 3: 1, 33: 3, 14: 1, 35: 1, 20: 2, 25: 2}
Did not match all atoms present	479-20-9	CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2)C)C(=O)OC)O)C)O)C=O)O	{1: 4, 26: 1, 28: 2, 21: 3, 14: 2}
Did not match all atoms present	479-21-0	COC1=CC(=C(C(=C1)O)C(=O)C2=CC=CC=C2)O	{24: 1, 1: 1, 22: 1, 21: 2, 14: 7}
Did not match all atoms present	479-23-2	C1CC2=C3C1=CC=CC3=CC4=C2C=CC5=CC=CC=C54	{11: 2, 14: 10}
Did not match all atoms present	479-27-6	C1=CC2=C(C(=C1)N)C(=CC=C2)N	{30: 2, 14: 6}
Did not match all atoms present	479-33-4	C1=CC=C(C=C1)C2=C(C(=O)C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5	{25: 1, 14: 20, 15: 4}
Did not match all atoms present	479-45-8	CN(C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 4, 14: 2, 33: 1}
Did not match all atoms present	479-47-0	C1=C(C=C(C(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 14: 2}
Did not match all atoms present	479-50-5	CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O	{1: 3, 2: 4, 33: 1, 41: 1, 14: 6, 25: 1, 31: 1}
Did not match all atoms present	479-59-4	C1CC2=C3C(=CC=C2)CCCN3C1	{33: 1, 11: 6, 14: 3}
Did not match all atoms present	479-79-8	C1=CC=C2C(=C1)C=CC3=C2C(=O)C4=CC=CC=C34	{25: 1, 14: 10}
Did not match all atoms present	479-92-5	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C)C	{1: 4, 3: 1, 33: 2, 14: 5, 25: 1}
Did not match all atoms present	4790-79-8	COC1=CC=CC2=C1OC(=C2)C(=O)O	{1: 1, 27: 1, 22: 1, 14: 4, 23: 1}
Did not match all atoms present	479064-87-4	CC1=CC=C(C=C1)[C@@H](CC(=O)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 27: 1, 30: 1}
Did not match all atoms present	4792-30-7	CC1=CC=CC2=C1C(=O)OC2=O	{1: 1, 28: 2, 14: 3}
Did not match all atoms present	4792-31-8	C1=CC=C(C=C1)SC2(C3=CC=CC=C3C(=O)O2)SC4=CC=CC=C4	{40: 2, 28: 1, 13: 1, 14: 14}
Did not match all atoms present	4792-67-0	CCOC(=O)C1=CC2=C(N1)C=CC(=C2)Cl	{32: 1, 1: 1, 2: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	4792-78-3	C1=CC=C(C(=C1)O)OCCO	{2: 2, 22: 1, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	4792-83-0	CCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OCC)[O-]	{1: 2, 2: 2, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	4793-98-0	C1=CC(=C2C(=CC=C(C2=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 4, 14: 4}
Did not match all atoms present	47931-85-1	CC(C)CC1C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)N1)CC(=O)N)CO)N)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CO)C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)O)C(=O)NC(CC(C)C)C(=O)NC(CC2=CN=CN2)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)N)C(=O)NC(C(C)O)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)N4CCCC4C(=O)NC(CCCNC(=N)N)C(=O)NC(C(C)O)C(=O)NC(CC(=O)N)C(=O)NC(C(C)O)C(=O)NCC(=O)NC(CO)C(=O)NCC(=O)NC(C(C)O)C(=O)N5CCCC5C(=O)N)C(C)O)CO	{32: 7, 1: 17, 2: 33, 3: 31, 36: 1, 33: 2, 7: 1, 41: 2, 11: 8, 12: 9, 14: 6, 35: 1, 20: 9, 21: 1, 24: 30, 25: 6, 27: 1, 30: 9, 31: 24}
Did not match all atoms present	47956-45-6	C[Si](=O)C	{1: 2, 29: 1}
Did not match all atoms present	4796-68-3	C1=CC=C(C=C1)C(=O)OC2C3C=CC2C=C3	{28: 1, 12: 3, 14: 9}
Did not match all atoms present	4799-68-2	C1=CC=C(C=C1)COCCCO	{2: 4, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	480-11-5	COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=CC=C3)O	{1: 1, 14: 7, 21: 2, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	480-15-9	C1=CC=C(C(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	{25: 1, 21: 4, 14: 6, 23: 1}
Did not match all atoms present	480-16-0	C1=CC(=C(C=C1O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	{25: 1, 21: 5, 14: 5, 23: 1}
Did not match all atoms present	480-18-2	C1=CC(=C(C=C1[C@@H]2[C@H](C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	{12: 2, 14: 5, 20: 1, 21: 4, 23: 1, 25: 1}
Did not match all atoms present	480-22-8	C1=CC2=CC3=C(C(=CC=C3)O)C(=C2C(=C1)O)O	{21: 3, 14: 7}
Did not match all atoms present	480-30-8	CC1=CC(=O)N(N1C)C2=CC=CC=C2.C(C(Cl)(Cl)Cl)(O)O.C(C(Cl)(Cl)Cl)(O)O	{1: 2, 3: 2, 4: 2, 33: 2, 14: 6, 17: 6, 20: 4, 25: 1}
Did not match all atoms present	480-40-0	C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O	{25: 1, 21: 2, 14: 8, 23: 1}
Did not match all atoms present	480-41-1	C1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O	{11: 1, 12: 1, 14: 6, 21: 3, 23: 1, 25: 1}
Did not match all atoms present	480-44-4	COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O	{1: 1, 14: 7, 21: 2, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	480-63-7	CC1=CC(=C(C(=C1)C)C(=O)O)C	{1: 3, 27: 1, 14: 2}
Did not match all atoms present	480-64-8	CC1=CC(=CC(=C1C(=O)O)O)O	{1: 1, 27: 1, 21: 2, 14: 2}
Did not match all atoms present	480-65-9	CC1=CC(=O)OC(=C1C(=O)O)C	{1: 2, 27: 1, 28: 1, 14: 1}
Did not match all atoms present	480-66-0	CC(=O)C1=C(C=C(C=C1O)O)O	{24: 1, 1: 1, 21: 3, 14: 2}
Did not match all atoms present	480-67-1	CC1=CC(=C(C(=C1)O)C(=O)O)O	{1: 1, 27: 1, 21: 2, 14: 2}
Did not match all atoms present	480-91-1	C1C2=CC=CC=C2C(=O)N1	{32: 1, 25: 1, 11: 1, 14: 4}
Did not match all atoms present	480-93-3	C1=CC=C2C(=C1)C(=CN2)O	{32: 1, 21: 1, 14: 5}
Did not match all atoms present	480-96-6	C1=CC2=NO[N+](=C2C=C1)[O-]	{33: 1, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	4800-34-4	C1=CC=C2C=C(C=CC2=C1)NC3=CC=CC=C3C(=O)O	{27: 1, 14: 11, 31: 1}
Did not match all atoms present	4800-58-2	CC[N+]1=C(C=CC2=CC=CC=C21)I.[I-]	{1: 1, 2: 1, 19: 2, 14: 6, 33: 1}
Did not match all atoms present	4800-94-6	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)C(=O)[O-])C(=O)[O-])C.[Na+].[Na+]	{1: 2, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 24: 3, 25: 1, 31: 1}
Did not match all atoms present	4801-57-4	CC[N+]1(CCCCC1)[O-]	{1: 1, 2: 1, 11: 5, 29: 1}
Did not match all atoms present	4803-27-4	CC1=C(C2=C(C=C1)C(=O)N3C=C(CC3C(N2)O)/C=C/C(=O)N)O	{32: 1, 1: 1, 6: 2, 33: 1, 11: 1, 12: 2, 14: 3, 15: 1, 20: 1, 21: 1, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	48042-08-6	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ni+2]	{}
Did not match all atoms present	48052-66-0	C[N+](C)(C)CNC(=O)C=C.[Cl-]	{1: 3, 2: 1, 5: 1, 6: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	4807-55-0	CN1C(=O)CSC1=S	{1: 1, 33: 1, 41: 1, 11: 1, 15: 1, 25: 1}
Did not match all atoms present	48074-47-1	CC(C)OP(=O)(C(=C)P(=O)(OC(C)C)OC(C)C)OC(C)C	{1: 8, 3: 4, 5: 1, 7: 1, 22: 4, 29: 2}
Did not match all atoms present	4808-30-4	CCCC[Sn](CCCC)(CCCC)S[Sn](CCCC)(CCCC)CCCC	{40: 1, 1: 6, 2: 18}
Did not match all atoms present	481-39-0	C1=CC2=C(C(=O)C=CC2=O)C(=C1)O	{25: 2, 21: 1, 14: 5}
Did not match all atoms present	481-42-5	CC1=CC(=O)C2=C(C1=O)C=CC=C2O	{1: 1, 25: 2, 21: 1, 14: 4, 15: 1}
Did not match all atoms present	481-49-2	CN1CCC2=CC3=C(C4=C2[C@@H]1CC5=CC=C(C=C5)OC6=C(C=CC(=C6)C[C@@H]7C8=CC(=C(C=C8CCN7C)OC)O4)OC)OCO3	{1: 4, 33: 2, 11: 7, 12: 2, 14: 10, 22: 2, 23: 4}
Did not match all atoms present	481-53-8	COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC	{1: 5, 25: 1, 22: 5, 14: 5, 23: 1}
Did not match all atoms present	481-72-1	C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3C2=O)CO)O	{25: 2, 2: 1, 20: 1, 21: 2, 14: 5}
Did not match all atoms present	481-74-3	CC1=CC(=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O)O	{1: 1, 21: 2, 14: 5, 25: 2}
Did not match all atoms present	481-85-6	CC1=C(C2=CC=CC=C2C(=C1)O)O	{1: 1, 21: 2, 14: 5}
Did not match all atoms present	481-97-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)OS(=O)(=O)O	{1: 1, 11: 6, 12: 3, 13: 1, 14: 3, 20: 1, 22: 1, 25: 1, 29: 2}
Did not match all atoms present	4810-05-3	CC1=CC(=C(C(=C1)C)CC=C)C	{1: 3, 2: 1, 14: 2, 5: 1, 6: 1}
Did not match all atoms present	4812-20-8	CC(C)OC1=CC=CC=C1O	{1: 2, 22: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	4812-40-2	C1=C(N(C(=N1)CO)CCO)[N+](=O)[O-]	{33: 1, 2: 3, 35: 1, 38: 1, 14: 1, 20: 2}
Did not match all atoms present	48134-75-4	C[N+]1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 14: 9, 33: 1}
Did not match all atoms present	48144-15-6	CC(C)(C)C1=CC=C(C=C1)OCC#C	{1: 3, 2: 1, 4: 1, 9: 1, 10: 1, 14: 4, 22: 1}
Did not match all atoms present	48145-04-6	C=CC(=O)OCCOC1=CC=CC=C1	{2: 2, 5: 1, 6: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	4815-29-6	CCOC(=O)C1=C(SC2=C1CCC2)N	{1: 1, 2: 1, 41: 1, 11: 3, 28: 1, 30: 1}
Did not match all atoms present	4815-30-9	CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)N	{1: 3, 2: 2, 28: 2, 30: 1, 41: 1}
Did not match all atoms present	4815-44-5	CCOC(=O)C1=C(N(C(=C1C(=O)OCC)C)N)C	{1: 4, 2: 2, 28: 2, 30: 1, 33: 1}
Did not match all atoms present	4815-57-0	CCCC1=CC=C(C=C1)CCC	{1: 2, 2: 4, 14: 4}
Did not match all atoms present	4816-80-2	CC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)O)C(=O)O	{1: 1, 2: 2, 3: 1, 14: 4, 27: 2, 29: 2, 31: 1}
Did not match all atoms present	48169-70-6	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[W].[W]	{24: 4, 1: 4}
Did not match all atoms present	48172-10-7	C1=CC=C2C(=C1)C(=O)N(C2=O)CC[C@@H](C(=O)O)O	{33: 1, 2: 2, 3: 1, 14: 4, 20: 1, 25: 2, 27: 1}
Did not match all atoms present	482-05-3	C1=CC=C(C(=C1)C2=CC=CC=C2C(=O)O)C(=O)O	{27: 2, 14: 8}
Did not match all atoms present	482-15-5	CC(CN1C2=CC=CC=C2SC3=C1N=CC=C3)N(C)C	{1: 3, 2: 1, 3: 1, 33: 2, 41: 1, 14: 7, 35: 1}
Did not match all atoms present	482-27-9	COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)OC	{1: 2, 28: 1, 22: 2, 14: 4, 23: 1}
Did not match all atoms present	482-28-0	C=C[C@H]1CN2CC[C@H]1C[C@H]2C3=C(C4=CC=CC=C4N3)CCO	{32: 1, 33: 1, 2: 2, 5: 1, 6: 1, 11: 4, 12: 3, 14: 4, 20: 1}
Did not match all atoms present	482-44-0	CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C	{1: 2, 2: 1, 6: 1, 7: 1, 14: 5, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	482-66-6	C1CC2=C(C1)C3=C(C=C2)C4=CC=CC=C4C=C3	{11: 3, 14: 8}
Did not match all atoms present	482-68-8	C/C=C\1/CN2[C@H]3C[C@@H]1[C@H]([C@@H]2CC4=C3NC5=C4C=C(C=C5)O)CO	{32: 1, 1: 1, 2: 1, 6: 1, 33: 1, 11: 3, 12: 4, 14: 3, 15: 1, 20: 1, 21: 1}
Did not match all atoms present	482-74-6	CN1CCC2=CC(=C(C=C2C(=O)CC3=C(C1)C4=C(C=C3)OCO4)OC)OC	{1: 3, 33: 1, 11: 5, 14: 4, 22: 2, 23: 2, 25: 1}
Did not match all atoms present	482-89-3	C1=CC=C2C(=C1)C(=O)/C(=C\3/C(=O)C4=CC=CC=C4N3)/N2	{32: 2, 25: 2, 14: 8, 15: 2}
Did not match all atoms present	4822-44-0	C1=CC=C(C=C1)NC(=O)CS	{24: 1, 2: 1, 39: 1, 14: 5, 31: 1}
Did not match all atoms present	4824-78-6	CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)Br)Cl	{1: 2, 2: 2, 14: 2, 17: 2, 18: 1, 22: 3}
Did not match all atoms present	4828-44-8	CCCCCC[Ge](CCCCCC)(CCCCCC)CCCCCC	{1: 4, 2: 20}
Did not match all atoms present	483-04-5	C[C@H]1[C@H]2CN3CCC4=C([C@@H]3C[C@@H]2C(=CO1)C(=O)OC)NC5=CC=CC=C45.Cl	{32: 1, 1: 2, 33: 1, 11: 4, 12: 4, 14: 5, 15: 1, 17: 1, 23: 1, 28: 1}
Did not match all atoms present	483-17-0	CCC1CN2CCC3=CC(=C(C=C3C2CC1CC4C5=CC(=C(C=C5CCN4)O)OC)OC)OC	{32: 1, 1: 4, 2: 2, 33: 1, 11: 6, 12: 4, 14: 4, 21: 1, 22: 3}
Did not match all atoms present	483-18-1	CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1C[C@@H]4C5=CC(=C(C=C5CCN4)OC)OC)OC)OC	{32: 1, 1: 5, 2: 2, 33: 1, 11: 6, 12: 4, 14: 4, 22: 4}
Did not match all atoms present	483-55-6	CC1=C(C2=CC=CC=C2C(=O)C1=O)O	{1: 1, 20: 1, 25: 2, 14: 4, 15: 2}
Did not match all atoms present	483-57-8	CN1C2=C(C(=O)N(C1=O)C)N=CN=N2	{1: 2, 35: 3, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	483-63-6	CCN(C1=CC=CC=C1C)C(=O)/C=C/C	{1: 3, 2: 1, 6: 2, 33: 1, 14: 4, 24: 1}
Did not match all atoms present	483-64-7	CNC1=C(C=CC=C1OC)C(=O)OC	{1: 3, 28: 1, 22: 1, 14: 3, 31: 1}
Did not match all atoms present	483-65-8	CC1=CC=CC2=C1C=CC3=C2C=CC(=C3)C(C)C	{1: 3, 3: 1, 14: 8}
Did not match all atoms present	483-77-2	CC1CCC(C2=C1C=CC(=C2)C)C(C)C	{11: 2, 1: 4, 3: 1, 12: 2, 14: 3}
Did not match all atoms present	483-78-3	CC1=CC2=C(C=CC(=C2C=C1)C)C(C)C	{1: 4, 3: 1, 14: 5}
Did not match all atoms present	483-84-1	C1=CC2=C(C=C1S(=O)(=O)O)C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])O	{38: 2, 20: 1, 21: 1, 14: 4, 29: 2}
Did not match all atoms present	483-87-4	CC1=CC2=C(C=C1)C3=C(C=C2)C(=CC=C3)C	{1: 2, 14: 8}
Did not match all atoms present	4830-93-7	C1=CC=C(C=C1)CCCCCl	{17: 1, 2: 4, 14: 5}
Did not match all atoms present	4830-95-9	CC(C)CCC1=CC(=CC=C1)Cl	{1: 2, 2: 2, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	4830-99-3	CCC1CCC2=CC=CC=C12	{1: 1, 2: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	4831-62-3	CC1=[N+](C2=CC=CC=C2C(=C1)[N+](=O)[O-])[O-]	{1: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	4834-28-0	CC1C(C2=C(C1(C)C)C=C(C=C2)C)(C)C	{1: 6, 12: 1, 13: 2, 14: 3}
Did not match all atoms present	4837-88-1	CC1=C(C=CC=C1OC)[N+](=O)[O-]	{1: 2, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	4837-90-5	COC1=CC=CC2=C1C=CN2	{32: 1, 1: 1, 22: 1, 14: 5}
Did not match all atoms present	4838-00-0	CN1C=C2C=CC=CC2=N1	{1: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	4838-96-4	CNCCC1=CC(=C(C(=C1)OC)OC)OC	{1: 4, 2: 2, 22: 3, 14: 2, 31: 1}
Did not match all atoms present	484-11-7	CC1=NC2=C(C=C1)C=CC3=C2N=C(C=C3)C	{1: 2, 35: 2, 14: 6}
Did not match all atoms present	484-12-8	CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C	{1: 3, 2: 1, 6: 1, 7: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	484-17-3	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)O	{21: 1, 14: 9}
Did not match all atoms present	484-18-4	CC(=O)C1=C(C=C(C2=C1OC(C=C2)(C)C)OC)O	{1: 4, 13: 1, 14: 3, 21: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	484-20-8	COC1=C2C=CC(=O)OC2=CC3=C1C=CO3	{1: 1, 28: 1, 22: 1, 14: 5, 23: 1}
Did not match all atoms present	484-23-1	C1=CC=C2C(=C1)C(=NN=C2NN)NN	{35: 2, 30: 2, 14: 4, 31: 2}
Did not match all atoms present	484-29-7	COC1=C2C=COC2=NC3=CC=CC=C31	{1: 1, 35: 1, 22: 1, 14: 6, 23: 1}
Did not match all atoms present	484-31-1	COC1=C(C2=C(C=C1CC=C)OCO2)OC	{1: 2, 2: 1, 5: 1, 6: 1, 11: 1, 14: 1, 22: 2, 23: 2}
Did not match all atoms present	484-47-9	C1=CC=C(C=C1)C2=C(N=C(N2)C3=CC=CC=C3)C4=CC=CC=C4	{32: 1, 35: 1, 14: 15}
Did not match all atoms present	484-65-1	CC1=C(C(=C(C(=C1C)C)CCl)C)C	{1: 5, 2: 1, 17: 1}
Did not match all atoms present	484-66-2	CC1=C(C(=C(C(=C1C)C)CO)C)C	{1: 5, 2: 1, 20: 1}
Did not match all atoms present	484-67-3	COC1=C(C(=C(C(=C1Cl)Cl)O)Cl)Cl	{1: 1, 21: 1, 22: 1, 17: 4}
Did not match all atoms present	4840-75-9	CN(C)[Si](C1=CC=CC=C1)(N(C)C)N(C)C	{1: 6, 14: 5, 33: 3}
Did not match all atoms present	4840-81-7	[2H]C([2H])([2H])C(=O)C([2H])([2H])C(C)C	{24: 1, 1: 3, 2: 1, 3: 1}
Did not match all atoms present	4840-82-8	[2H]C([2H])([2H])C(=O)C([2H])([2H])CCC	{24: 1, 1: 2, 2: 3}
Did not match all atoms present	4841-20-7	CC(C(=O)OC)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 3: 1, 14: 2, 17: 3, 22: 1, 28: 1}
Did not match all atoms present	4842-11-9	CCOCCOC(=O)C1=C(C=C(C=C1)C(=O)OC)I	{1: 2, 2: 3, 14: 3, 19: 1, 22: 1, 28: 2}
Did not match all atoms present	4842-89-1	CC1=NC=C(C=C1)OC(=O)C	{1: 2, 35: 1, 28: 1, 14: 3}
Did not match all atoms present	4844-38-6	CCCCCCCCCCCCP(=O)(OCC)OCC	{1: 3, 2: 13, 29: 1, 22: 2}
Did not match all atoms present	4845-14-1	CN(C=O)C1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 1, 26: 1, 34: 2, 14: 9, 33: 1}
Did not match all atoms present	4845-49-2	C1C(=NN(C1=O)C2=CC=CC=C2)C3=CC=CC=C3	{33: 1, 35: 1, 11: 1, 14: 10, 15: 1, 25: 1}
Did not match all atoms present	4845-58-3	C1=CC2=C(C=C1[N+](=O)[O-])SC(=S)N2	{32: 1, 41: 1, 38: 1, 14: 3}
Did not match all atoms present	4845-64-1	C1=CC=C2C(=C1)C=CC3=C2NC(=S)S3	{32: 1, 41: 1, 14: 6}
Did not match all atoms present	4846-07-5	CC(CC1=CC=CC=C1)NC	{1: 2, 2: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	4846-34-8	CCN1C=CC(=CC=C(C=CC2=CC=[N+](C3=CC=CC=C23)CC)C4=CC=[N+](C5=CC=CC=C45)CC)C6=CC=CC=C61.[I-].[I-]	{1: 3, 2: 3, 33: 3, 6: 4, 7: 1, 14: 18, 15: 1, 19: 2}
Did not match all atoms present	4848-62-8	C[Ge](C)(C)SC1=CC=CC=C1	{40: 1, 1: 3, 14: 5}
Did not match all atoms present	4848-63-9	C[Sn](C)(SC1=CC=CC=C1)SC2=CC=CC=C2	{40: 2, 1: 2, 14: 10}
Did not match all atoms present	485-19-8	CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)O)O)OC	{1: 3, 2: 1, 33: 1, 11: 2, 12: 1, 14: 5, 21: 2, 22: 2}
Did not match all atoms present	485-31-4	CCC(C)C1=CC(=CC(=C1OC(=O)C=C(C)C)[N+](=O)[O-])[N+](=O)[O-]	{1: 4, 2: 1, 3: 1, 38: 2, 6: 1, 7: 1, 14: 2, 28: 1}
Did not match all atoms present	485-34-7	CCOC(=O)C1=CC(=NC2=C1C=C(C=C2)C)C3=CC=CC=C3	{1: 2, 2: 1, 35: 1, 28: 1, 14: 9}
Did not match all atoms present	485-35-8	C1[C@H]2CNC[C@@H]1C3=CC=CC(=O)N3C2	{32: 1, 33: 1, 11: 4, 12: 2, 14: 3, 25: 1}
Did not match all atoms present	485-47-2	C1=CC=C2C(=C1)C(=O)C(C2=O)(O)O	{25: 2, 20: 2, 13: 1, 14: 4}
Did not match all atoms present	485-49-4	CN1CCC2=CC3=C(C=C2[C@H]1[C@H]4C5=C(C6=C(C=C5)OCO6)C(=O)O4)OCO3	{1: 1, 33: 1, 11: 4, 12: 2, 14: 4, 23: 4, 28: 1}
Did not match all atoms present	485-50-7	CN1CCC2=CC3=C(C=C2[C@@H]1[C@H]4C5=C(C6=C(C=C5)OCO6)C(=O)O4)OCO3	{1: 1, 33: 1, 11: 4, 12: 2, 14: 4, 23: 4, 28: 1}
Did not match all atoms present	485-51-8	CN1CCC2=CC(=C(C=C2C1C3C4=C(C5=C(C=C4)OCO5)C(=O)O3)OC)OC	{1: 3, 33: 1, 11: 3, 12: 2, 14: 4, 22: 2, 23: 2, 28: 1}
Did not match all atoms present	485-64-3	CCC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 6, 35: 1, 20: 1}
Did not match all atoms present	485-72-3	COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O	{1: 1, 14: 8, 21: 1, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	485-89-2	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2O)C(=O)O	{35: 1, 27: 1, 21: 1, 14: 9}
Did not match all atoms present	4850-82-2	CCOC(=O)C(C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 14: 10, 24: 2, 28: 1}
Did not match all atoms present	4851-89-2	C(P(=O)(CCl)CCl)Cl	{17: 3, 2: 3, 29: 1}
Did not match all atoms present	4853-74-1	CC(C)S(=O)(=O)C	{1: 3, 3: 1, 29: 2}
Did not match all atoms present	4853-75-2	CCS(=O)(=O)C(C)C	{1: 3, 2: 1, 3: 1, 29: 2}
Did not match all atoms present	4854-84-6	C1=CC(=CC=C1C#N)C2=CC=C(C=C2)N	{30: 1, 14: 8, 37: 1}
Did not match all atoms present	4856-95-5	[B].C1COCCN1	{32: 1, 11: 4, 23: 1}
Did not match all atoms present	4856-97-7	C1=CC=C2C(=C1)NC(=N2)CO	{32: 1, 2: 1, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	4857-01-6	C1=CC=C2C(=C1)NC(=N2)CCO	{32: 1, 2: 2, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	4857-04-9	C1=CC=C2C(=C1)NC(=N2)CCl	{32: 1, 17: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	4857-06-1	C1=CC=C2C(=C1)NC(=N2)Cl	{32: 1, 17: 1, 35: 1, 14: 4}
Did not match all atoms present	4858-85-9	C1=CN=C(C(=N1)Cl)Cl	{17: 2, 35: 2, 14: 2}
Did not match all atoms present	486-12-4	CC1=CC=C(C=C1)/C(=C\CN2CCCC2)/C3=CC=CC=N3	{1: 1, 2: 1, 35: 1, 33: 1, 6: 1, 7: 1, 11: 4, 14: 8}
Did not match all atoms present	486-16-8	CN(C)CCOC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2	{1: 2, 2: 2, 3: 1, 33: 1, 14: 8, 17: 1, 35: 1, 22: 1}
Did not match all atoms present	486-17-9	CCCCSC1=CC=C(C=C1)C(C2=CC=CC=C2)SCCN(C)C	{1: 3, 2: 5, 3: 1, 33: 1, 40: 2, 14: 9}
Did not match all atoms present	486-25-9	C1=CC=C2C(=C1)C3=CC=CC=C3C2=O	{25: 1, 14: 8}
Did not match all atoms present	486-34-0	CC1=CC2=C(C=C1)C=CC(=C2C)C	{1: 3, 14: 5}
Did not match all atoms present	486-35-1	C1=CC(=C(C2=C1C=CC(=O)O2)O)O	{28: 1, 21: 2, 14: 4}
Did not match all atoms present	486-39-5	COC1=C(C=C2[C@@H](NCCC2=C1)CC3=CC=C(C=C3)O)O	{32: 1, 1: 1, 2: 1, 11: 2, 12: 1, 14: 6, 21: 2, 22: 1}
Did not match all atoms present	486-47-5	CCOC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OCC)OCC)OCC	{1: 4, 2: 5, 35: 1, 22: 4, 14: 7}
Did not match all atoms present	486-66-8	C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O	{25: 1, 21: 2, 14: 8, 23: 1}
Did not match all atoms present	486-73-7	C1=CC=C2C(=C1)C=CN=C2C(=O)O	{35: 1, 27: 1, 14: 6}
Did not match all atoms present	486-84-0	CC1=NC=CC2=C1NC3=CC=CC=C23	{32: 1, 1: 1, 35: 1, 14: 6}
Did not match all atoms present	486-89-5	C1CCN2CC3CC([C@H]2C1)CN4C3=CC=CC4=O	{25: 1, 11: 7, 12: 3, 14: 3, 33: 2}
Did not match all atoms present	486-90-8	C1CCN2C[C@@H]3C[C@@H]([C@@H]2C1)CN4C3=CC=CC4=O	{25: 1, 11: 7, 12: 3, 14: 3, 33: 2}
Did not match all atoms present	4860-18-8	CCCC[S-].[Cu+]	{1: 1, 2: 3}
Did not match all atoms present	4861-19-2	C(=O)(N)N.OP(=O)(O)O	{24: 1, 20: 3, 29: 1, 30: 2}
Did not match all atoms present	4861-58-9	CCCCCC1=CC=CS1	{1: 1, 2: 4, 14: 3, 41: 1}
Did not match all atoms present	4861-85-2	CC(C)OC(=O)CC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	4867-01-0	C1=CC(=C(C=C1Cl)NN=C2C=CC(=O)C=C2O)O	{34: 1, 14: 6, 15: 2, 17: 1, 20: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	4867-37-2	CSC1=CC(=CC=C1)Cl	{40: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	487-03-6	CC1=C2C(=C3C=CC(=O)C=C3N2)C=CN1	{32: 2, 1: 1, 14: 5, 25: 1}
Did not match all atoms present	487-06-9	COC1=CC(=C2C=CC(=O)OC2=C1)OC	{1: 2, 28: 1, 22: 2, 14: 4}
Did not match all atoms present	487-10-5	C1=CC=C2C(=C1)C=CC=C2N=NC3=CC=CC4=CC=CC=C43	{34: 2, 14: 14}
Did not match all atoms present	487-11-6	COC1=CC(=CC(=C1OC)OC)CC=C	{1: 3, 2: 1, 5: 1, 6: 1, 14: 2, 22: 3}
Did not match all atoms present	487-16-1	C1=CC2=C(C(=O)N=C2C=C1)NNC(=S)N	{35: 1, 7: 1, 14: 4, 15: 1, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	487-19-4	CN1C=CC=C1C2=CN=CC=C2	{1: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	487-21-8	C1=CN=C2C(=N1)C(=O)NC(=O)N2	{32: 2, 25: 2, 35: 2, 14: 2}
Did not match all atoms present	487-26-3	C1C(OC2=CC=CC=C2C1=O)C3=CC=CC=C3	{25: 1, 11: 1, 12: 1, 14: 9, 23: 1}
Did not match all atoms present	487-48-9	CC(=O)NC(=O)C1=CC=CC=C1O	{24: 2, 1: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	487-49-0	COC1=CC=C(C=C1)CC(=O)C2=C(C=C(C=C2)O)O	{1: 1, 2: 1, 14: 7, 21: 2, 22: 1, 24: 1}
Did not match all atoms present	487-53-6	CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)O	{1: 2, 2: 4, 33: 1, 14: 3, 21: 1, 28: 1, 30: 1}
Did not match all atoms present	487-54-7	C1=CC=C(C(=C1)C(=O)NCC(=O)O)O	{2: 1, 14: 4, 21: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	487-68-3	CC1=CC(=C(C(=C1)C)C=O)C	{1: 3, 26: 1, 14: 2}
Did not match all atoms present	487-70-7	C1=C(C=C(C(=C1O)C=O)O)O	{26: 1, 21: 3, 14: 2}
Did not match all atoms present	487-89-8	C1=CC=C2C(=C1)C(=CN2)C=O	{32: 1, 26: 1, 14: 5}
Did not match all atoms present	487-90-1	C1=C(C(=C(N1)CN)CC(=O)O)CCC(=O)O	{32: 1, 2: 4, 27: 2, 30: 1, 14: 1}
Did not match all atoms present	487-93-4	CN(C)CCC1=CNC2=C1C=C(C=C2)O	{32: 1, 1: 2, 2: 2, 33: 1, 14: 4, 21: 1}
Did not match all atoms present	4870-65-9	C1=CC=C(C=C1)C(C(=O)O)Br	{27: 1, 18: 1, 3: 1, 14: 5}
Did not match all atoms present	4872-26-8	CCCC[Ge](Cl)(Cl)Cl	{1: 1, 2: 3, 17: 3}
Did not match all atoms present	4874-14-0	C1CNC(=O)NC1=S	{32: 2, 25: 1, 11: 2, 15: 1}
Did not match all atoms present	4877-93-4	COC1=CC=CC=C1C2=CC=CC=C2OC	{1: 2, 22: 2, 14: 8}
Did not match all atoms present	488-05-1	CC1=C(OC=C1)C(=O)CC(C)C	{1: 3, 2: 1, 3: 1, 14: 2, 23: 1, 24: 1}
Did not match all atoms present	488-17-5	CC1=C(C(=CC=C1)O)O	{1: 1, 21: 2, 14: 3}
Did not match all atoms present	488-23-3	CC1=C(C(=C(C=C1)C)C)C	{1: 4, 14: 2}
Did not match all atoms present	488-70-0	CC1=CC(=C(C(=C1C)C)C)O	{1: 4, 21: 1, 14: 1}
Did not match all atoms present	488-71-1	CC1=CC(=C(C(=C1C)C)N)C	{1: 4, 30: 1, 14: 1}
Did not match all atoms present	488-86-8	C1(=C(C(=O)C(=O)C1=O)O)O	{25: 3, 21: 2}
Did not match all atoms present	488-87-9	CC1=CC(=C(C(=C1)O)C)O	{1: 2, 21: 2, 14: 2}
Did not match all atoms present	488-93-7	C1=COC=C1C(=O)O	{27: 1, 14: 3, 23: 1}
Did not match all atoms present	488-98-2	C1=CC=C(C(=C1)C(Cl)(Cl)Cl)F	{16: 1, 17: 3, 4: 1, 14: 4}
Did not match all atoms present	4880-88-0	CCC12CCCN3C1C4=C(CC3)C5=CC=CC=C5N4C(=O)C2	{1: 1, 2: 1, 33: 2, 11: 6, 12: 1, 13: 1, 14: 4, 25: 1}
Did not match all atoms present	4881-17-8	C1COCCN1P(=O)(N2CCOCC2)OC3=CC=CC=C3	{33: 2, 11: 8, 14: 5, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	4882-68-2	CCN(CC[N+](C)(C)N)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)N(C)C)Cl.[Cl-]	{1: 5, 2: 3, 33: 2, 34: 2, 14: 6, 17: 3, 29: 2, 30: 1}
Did not match all atoms present	4882-90-0	CCOC1=CC2=C(C=C1)N=C(S2)N=NC(C(=O)C)C(=O)C	{1: 3, 2: 1, 3: 1, 41: 1, 34: 2, 14: 3, 35: 1, 22: 1, 24: 2}
Did not match all atoms present	4883-96-9	CC1=CC1=O	{1: 1, 14: 1, 25: 1}
Did not match all atoms present	4885-47-6	CCP(=O)(CC)SCC	{40: 1, 1: 3, 2: 3, 29: 1}
Did not match all atoms present	4886-77-5	CC1=CC(=CC=C1)SC	{40: 1, 1: 2, 14: 4}
Did not match all atoms present	4889-45-6	CCCCCCCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCC	{1: 3, 2: 51, 29: 1, 22: 3}
Did not match all atoms present	489-01-0	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)OC	{1: 7, 22: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	489-84-9	CC1=C2C=CC(=C2C=C(C=C1)C(C)C)C	{1: 4, 3: 1, 14: 5}
Did not match all atoms present	489-98-5	C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 30: 1, 14: 2}
Did not match all atoms present	4890-85-1	C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)O	{2: 2, 27: 1, 14: 9}
Did not match all atoms present	4891-38-7	COC(=O)C#CC1=CC=CC=C1	{1: 1, 10: 2, 28: 1, 14: 5}
Did not match all atoms present	4891-54-7	CCOP(=S)(OCC)OCCS(=O)(=O)CC	{1: 3, 2: 5, 29: 2, 22: 3}
Did not match all atoms present	4892-02-8	COC(=O)C1=CC=CC=C1S	{1: 1, 28: 1, 14: 4, 39: 1}
Did not match all atoms present	4894-75-1	C1CC(=O)CCC1C2=CC=CC=C2	{25: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	4897-21-6	CN1C=C(N=C1)Cl	{1: 1, 35: 1, 33: 1, 14: 2, 17: 1}
Did not match all atoms present	4897-22-7	CCN1C(=NC=C1Cl)C	{1: 2, 2: 1, 35: 1, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	4897-25-0	CN1C=NC(=C1Cl)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	4897-71-6	COC1=CC2=C(C=C1)C3CC2C=C3	{1: 1, 11: 1, 12: 2, 22: 1, 14: 5}
Did not match all atoms present	4897-73-8	CC1=CC2=C(C=C1)C3CC2C=C3	{1: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	4898-56-0	CCOC(=O)C1=C(CC(=C(C1)NC2=CC=CC=C2)C(=O)OCC)NC3=CC=CC=C3	{1: 2, 2: 2, 11: 2, 14: 10, 15: 4, 28: 2, 31: 2}
Did not match all atoms present	4898-57-1	CCOC(=O)C1=C(CC(=C(C1)NC2=CC=C(C=C2)C)C(=O)OCC)NC3=CC=C(C=C3)C	{1: 4, 2: 2, 11: 2, 14: 8, 15: 4, 28: 2, 31: 2}
Did not match all atoms present	4898-58-2	COC(=O)C1=C(CC(=C(C1)NC2=CC=CC=C2)C(=O)OC)NC3=CC=CC=C3	{1: 2, 11: 2, 14: 10, 15: 4, 28: 2, 31: 2}
Did not match all atoms present	490-02-8	CCC(C)C1=CN=C(C(=O)N1O)CC(C)C	{1: 4, 2: 2, 3: 2, 33: 1, 14: 1, 35: 1, 21: 1, 25: 1}
Did not match all atoms present	490-06-2	CC1=C(C(=C(C=C1)C(C)C)O)O	{1: 3, 3: 1, 21: 2, 14: 2}
Did not match all atoms present	490-11-9	C1=CN=CC(=C1C(=O)O)C(=O)O	{35: 1, 27: 2, 14: 3}
Did not match all atoms present	490-17-5	CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)C3C(C(C3C4=CC=CC=C4)C(=O)O[C@H]5C[C@@H]6CC[C@H]([C@H]5C(=O)OC)N6C)C7=CC=CC=C7)C(=O)OC	{1: 4, 33: 2, 11: 6, 12: 12, 14: 10, 28: 4}
Did not match all atoms present	490-23-3	CC1=CC(=C(C2=C1O[C@](CC2)(C)CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)C)O	{1: 7, 2: 6, 6: 3, 7: 3, 11: 2, 13: 1, 14: 1, 21: 1, 23: 1}
Did not match all atoms present	490-31-3	C1=CC2=C(C=C1O)OC(=C(C2=O)O)C3=CC(=C(C(=C3)O)O)O	{25: 1, 21: 5, 14: 5, 23: 1}
Did not match all atoms present	490-55-1	C1=CC=C(C=C1)C2=C(N=C(S2)N)N	{41: 1, 35: 1, 30: 2, 14: 5}
Did not match all atoms present	490-59-5	C1=CC=C2C(=C1)N=C3C(=N2)NC(=O)NC3=O	{32: 2, 25: 2, 35: 2, 14: 4}
Did not match all atoms present	490-64-2	COC1=CC(=C(C=C1C(=O)O)OC)OC	{1: 3, 27: 1, 22: 3, 14: 2}
Did not match all atoms present	490-65-3	CC1=CC=CC2=C1C=C(C=C2)C(C)C	{1: 3, 3: 1, 14: 6}
Did not match all atoms present	490-78-8	CC(=O)C1=C(C=CC(=C1)O)O	{24: 1, 1: 1, 21: 2, 14: 3}
Did not match all atoms present	490-79-9	C1=CC(=C(C=C1O)C(=O)O)O	{27: 1, 21: 2, 14: 3}
Did not match all atoms present	490-97-1	C1=CC=C(C(=C1)C(=O)[O-])F.[Na+]	{16: 1, 24: 1, 14: 4}
Did not match all atoms present	4900-63-4	COC1=CC=C(C2=CC=CC=C21)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 6}
Did not match all atoms present	4900-73-6	CC1=CC2=CC=CC=C2C=CC1=O	{1: 1, 14: 7, 25: 1}
Did not match all atoms present	4901-51-3	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)O	{17: 4, 21: 1, 14: 1}
Did not match all atoms present	4906-25-6	CCCCOC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 3, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	491-18-9	CCC1=CNC(=C1C)C	{32: 1, 1: 3, 2: 1, 14: 1}
Did not match all atoms present	491-31-6	C1=CC=C2C(=C1)C=COC2=O	{28: 1, 14: 6}
Did not match all atoms present	491-34-9	CN1CCCC2=CC=CC=C21	{1: 1, 11: 3, 14: 4, 33: 1}
Did not match all atoms present	491-35-0	CC1=CC=NC2=CC=CC=C12	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	491-36-1	C1=CC=C2C(=C1)C(=O)N=CN2	{32: 1, 25: 1, 35: 1, 14: 5}
Did not match all atoms present	491-37-2	C1COC2=CC=CC=C2C1=O	{25: 1, 11: 2, 14: 4, 23: 1}
Did not match all atoms present	491-38-3	C1=CC=C2C(=C1)C(=O)C=CO2	{25: 1, 14: 6, 23: 1}
Did not match all atoms present	491-39-4	C1=CC=C2C(=C1)C(=O)C=CS2	{25: 1, 14: 6, 41: 1}
Did not match all atoms present	491-59-8	CC1=CC(=C2C(=C1)C=C3C=CC=C(C3=C2O)O)O	{1: 1, 21: 3, 14: 6}
Did not match all atoms present	491-67-8	C1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)O)O)O	{25: 1, 21: 3, 14: 7, 23: 1}
Did not match all atoms present	491-70-3	C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O	{25: 1, 21: 4, 14: 6, 23: 1}
Did not match all atoms present	491-80-5	COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)O	{1: 1, 14: 7, 21: 2, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	491-88-3	CN1C=NC=C1C[C@H]2COC(=O)[C@@H]2[C@H](C3=CC=CC=C3)O	{1: 1, 2: 1, 3: 1, 33: 1, 11: 1, 12: 2, 14: 7, 35: 1, 20: 1, 28: 1}
Did not match all atoms present	491-92-9	CCN(CC)CCCC(C)NC1=C2C(=CC(=C1)OC)C=CC=N2	{1: 4, 2: 5, 3: 1, 33: 1, 14: 5, 35: 1, 22: 1, 31: 1}
Did not match all atoms present	4911-65-3	C1=CC=C(C=C1)SCCCCl	{40: 1, 17: 1, 2: 3, 14: 5}
Did not match all atoms present	4912-92-9	CC1(CCC2=CC=CC=C21)C	{1: 2, 11: 2, 13: 1, 14: 4}
Did not match all atoms present	4913-13-7	CC1=CC(=CC(=C1)N(C)C)C	{1: 4, 14: 3, 33: 1}
Did not match all atoms present	4913-28-4	C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)NC3=CC(=C(C4=C3C(=O)C5=CC=CC=C5C4=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{14: 13, 24: 1, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	4915-22-4	COC(=O)CC1=CC=CO1	{1: 1, 2: 1, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	4916-57-8	C1=CN=CC=C1CCC2=CC=NC=C2	{2: 2, 35: 2, 14: 8}
Did not match all atoms present	4919-33-9	CCOC1=CC=C(C=C1)CC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	4919-37-3	CC1=CC(=CC(=C1O)C)C(=O)O	{1: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	492-17-1	C1=CC=C(C(=C1)C2=CC=C(C=C2)N)N	{30: 2, 14: 8}
Did not match all atoms present	492-18-2	COC(CNC(=O)C1=CC=CC=C1OCC(=O)[O-])C[Hg].O.[Na+]	{1: 1, 2: 3, 3: 1, 14: 4, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	492-22-8	C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3S2	{25: 1, 14: 8, 41: 1}
Did not match all atoms present	492-27-3	C1=CC=C2C(=C1)C(=O)C=C(N2)C(=O)O	{32: 1, 25: 1, 27: 1, 14: 5}
Did not match all atoms present	492-37-5	CC(C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 3: 1, 14: 5}
Did not match all atoms present	492-38-6	C=C(C1=CC=CC=C1)C(=O)O	{27: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	492-41-1	C[C@@H]([C@@H](C1=CC=CC=C1)O)N	{1: 1, 3: 2, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	492-80-8	CN(C)C1=CC=C(C=C1)C(=N)C2=CC=C(C=C2)N(C)C	{1: 4, 36: 1, 33: 2, 14: 8, 7: 1}
Did not match all atoms present	492-86-4	C1=CC(=CC=C1C(C(=O)O)O)Cl	{27: 1, 17: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	492-88-6	CCOC1=CC=CC(=C1O)C=O	{1: 1, 2: 1, 14: 3, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	492-89-7	CCCCCCCCCCCCCCCC1=C(C(=CC=C1)O)O	{1: 1, 2: 14, 21: 2, 14: 3}
Did not match all atoms present	492-94-4	C1=COC(=C1)C(=O)C(=O)C2=CC=CO2	{24: 2, 14: 6, 23: 2}
Did not match all atoms present	492-97-7	C1=CSC(=C1)C2=CC=CS2	{41: 2, 14: 6}
Did not match all atoms present	4920-77-8	CC1=C(C(=CC=C1)O)[N+](=O)[O-]	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	4920-79-0	COC1=C(C=C(C=C1)[N+](=O)[O-])Cl	{1: 1, 38: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	4920-80-3	COC1=CC=CC(=C1[N+](=O)[O-])C(=O)O	{38: 1, 1: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	4920-84-7	COC1=CC(=C(C=C1)[N+](=O)[O-])OC	{1: 2, 38: 1, 22: 2, 14: 3}
Did not match all atoms present	4920-95-0	CC1=C(C=C(C=C1)C2=CC(=C(C=C2)C)C)C	{1: 4, 14: 6}
Did not match all atoms present	4920-99-4	CCC1=CC(=CC=C1)C(C)C	{1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	4921-49-7	CN1C2=C(N=C1Cl)N(C(=O)N(C2=O)C)C	{1: 3, 35: 1, 25: 2, 33: 3, 17: 1}
Did not match all atoms present	4922-98-9	C1=CC=C(C=C1)C2=NC(=NN2)N	{32: 1, 35: 2, 30: 1, 14: 5}
Did not match all atoms present	4923-61-9	COC1=CC=CC2=C1C(=O)C=CC2=O	{1: 1, 22: 1, 14: 5, 25: 2}
Did not match all atoms present	4923-84-6	CC(C)(C)P(=O)(O)O	{1: 3, 4: 1, 29: 1, 20: 2}
Did not match all atoms present	4923-91-5	CC1=C(SC2=CC=CC=C12)C	{1: 2, 14: 4, 41: 1}
Did not match all atoms present	4926-28-7	CC1=CC(=NC=C1)Br	{1: 1, 18: 1, 35: 1, 14: 3}
Did not match all atoms present	4928-02-3	C1C(=O)NC2=C(C=C(C=C2)N)C(=N1)C3=CC=CC=C3	{32: 1, 35: 1, 11: 1, 14: 8, 15: 1, 25: 1, 30: 1}
Did not match all atoms present	4928-41-0	CCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(CC)CC	{1: 3, 2: 3, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	4928-58-9	CC(=O)C1=CC=C(C=C1)NN=C2C(=O)C=CC3=CC=CC=C32	{1: 1, 34: 1, 14: 10, 15: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	4929-77-5	CC[NH+](CC)CCN1C2=CC=CC=C2N=C1SC3=CC=C(C=C3)OCC.[Cl-]	{1: 3, 2: 5, 35: 1, 33: 1, 40: 1, 14: 8, 17: 1, 22: 1}
Did not match all atoms present	493-05-0	C1COCC2=CC=CC=C21	{11: 3, 14: 4, 23: 1}
Did not match all atoms present	493-08-3	C1CC2=CC=CC=C2OC1	{11: 3, 14: 4, 23: 1}
Did not match all atoms present	493-09-4	C1COC2=CC=CC=C2O1	{11: 2, 14: 4, 23: 2}
Did not match all atoms present	493-49-2	COC1=C(C=C2C(=C1)CCNC2=O)OC	{32: 1, 1: 2, 11: 2, 14: 2, 22: 2, 25: 1}
Did not match all atoms present	493-52-7	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)O	{1: 2, 34: 2, 27: 1, 14: 8, 33: 1}
Did not match all atoms present	493-53-8	CC(=O)OC1=CC=CC=C1C(=O)[O-].[Na+]	{24: 1, 1: 1, 28: 1, 14: 4}
Did not match all atoms present	493-57-2	C1=CC=C2C(=C1)C(=O)C(=O)S2	{25: 2, 14: 4, 41: 1}
Did not match all atoms present	493-72-1	C1C(CC(=O)CC1=O)C2=CC=CC=C2	{25: 2, 11: 3, 12: 1, 14: 5}
Did not match all atoms present	493-75-4	CCN(CC)CC1=CC(=CC(=C1O)CC=C)C2=CC(=C(C(=C2)CN(CC)CC)O)CC=C	{1: 4, 2: 8, 5: 2, 6: 2, 33: 2, 14: 4, 21: 2}
Did not match all atoms present	493-77-6	C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=CC=C3)C4=CC=CC=C4	{35: 3, 14: 15}
Did not match all atoms present	493-78-7	CN(C)CCN(CC1=CC=CS1)C2=CC=CC=C2	{1: 2, 2: 3, 41: 1, 14: 8, 33: 2}
Did not match all atoms present	493-90-3	CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)O)CCC(=O)O)C)C)CC)C	{32: 2, 1: 6, 2: 6, 35: 2, 14: 4, 27: 2}
Did not match all atoms present	493-92-5	CCCC(CC1=CC=CC=C1)N2CCCC2	{1: 1, 2: 3, 3: 1, 33: 1, 11: 4, 14: 5}
Did not match all atoms present	4930-98-7	C1=CC=NC(=C1)NN	{35: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	4931-20-8	CC1=CC=CN2C1=NC(=N2)C3=CC=CC=C3	{1: 1, 35: 2, 14: 8, 33: 1}
Did not match all atoms present	4933-19-1	C1=CN=C2C(=N1)C(=O)NC2=O	{32: 1, 25: 2, 35: 2, 14: 2}
Did not match all atoms present	4935-68-6	CCO[Si](OCC)(OCC)O[Si](OCC)(OCC)O[Si](OCC)(OCC)O[Si](OCC)(OCC)O[Si](OCC)(OCC)OCC	{1: 12, 2: 12, 22: 16}
Did not match all atoms present	4935-80-2	C1CC2CC1CC2NCCC3=CC=CC=C3	{2: 2, 11: 4, 12: 3, 14: 5, 31: 1}
Did not match all atoms present	4936-47-4	CSCC1CN(C(=O)O1)N=CC2=CC=C(O2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 6: 1, 33: 1, 40: 1, 11: 1, 12: 1, 34: 1, 14: 2, 23: 1, 28: 1}
Did not match all atoms present	4937-86-4	CC(=C(C1=CC=CC=C1)N=O)NO	{1: 1, 34: 1, 7: 2, 14: 5, 20: 1, 29: 1, 31: 1}
Did not match all atoms present	494-03-1	C1=CC=C2C=C(C=CC2=C1)N(CCCl)CCCl	{17: 2, 2: 4, 14: 7, 33: 1}
Did not match all atoms present	494-12-2	C1CC2=CC=CC=C2OC1C3=CC=CC=C3	{11: 2, 12: 1, 14: 9, 23: 1}
Did not match all atoms present	494-19-9	C1CC2=CC=CC=C2NC3=CC=CC=C31	{32: 1, 11: 2, 14: 8}
Did not match all atoms present	494-38-2	CN(C)C1=CC2=C(C=C1)C=C3C=CC(=CC3=N2)N(C)C	{1: 4, 35: 1, 14: 7, 33: 2}
Did not match all atoms present	494-47-3	C1=COC(=C1)/C=N/C(/N=C/C2=CC=CO2)C3=CC=CO3	{34: 2, 3: 1, 14: 9, 6: 2, 23: 3}
Did not match all atoms present	494-55-3	CN1CCC2=CC3=C(C=C2C1)OCO3	{1: 1, 11: 4, 33: 1, 14: 2, 23: 2}
Did not match all atoms present	494-90-6	CC1CCC2=C(C1)OC=C2C	{1: 2, 11: 3, 12: 1, 14: 1, 23: 1}
Did not match all atoms present	494-98-4	C1=CC(=CN=C1)C2=CC=CN2	{32: 1, 35: 1, 14: 7}
Did not match all atoms present	494-99-5	CC1=CC(=C(C=C1)OC)OC	{1: 3, 22: 2, 14: 3}
Did not match all atoms present	4940-11-8	CCC1=C(C(=O)C=CO1)O	{1: 1, 2: 1, 14: 2, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	4940-39-0	C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)O	{25: 1, 27: 1, 14: 5, 23: 1}
Did not match all atoms present	4940-45-8	COCC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3	{24: 1, 1: 1, 2: 3, 22: 3, 14: 13}
Did not match all atoms present	494210-67-2	CC(C)(C)OC(=O)N[C@H](CC1CCSCC1)C(=O)[O-]	{1: 3, 2: 1, 3: 1, 4: 1, 41: 1, 11: 4, 12: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	494210-69-4	CC(C)(C)OC(=O)NC(CC1CCS(=O)(=O)CC1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 11: 4, 12: 1, 27: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	4944-94-9	C1CC2=C(C1)C3=CC=CC=C3C=C2	{11: 3, 14: 6}
Did not match all atoms present	4945-47-5	CN1CCC(CC1)N(CC2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 33: 2, 11: 4, 12: 1, 14: 10}
Did not match all atoms present	4946-13-8	CCC1=CC=C(C=C1)S	{1: 1, 2: 1, 14: 4, 39: 1}
Did not match all atoms present	4946-14-9	CC(C)C1=CC=C(C=C1)S	{1: 2, 3: 1, 14: 4, 39: 1}
Did not match all atoms present	4946-22-9	CN(C)C1=CC=C(C=C1)S	{1: 2, 39: 1, 14: 4, 33: 1}
Did not match all atoms present	4949-69-3	CC1=C(C=CC(=C1)N)I	{1: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	495-08-9	C1=CC(=C(C=C1O)CO)O	{2: 1, 20: 1, 21: 2, 14: 3}
Did not match all atoms present	495-18-1	C1=CC=C(C=C1)C(=O)NO	{24: 1, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	495-40-9	CCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 14: 5}
Did not match all atoms present	495-41-0	CC=CC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 6: 2}
Did not match all atoms present	495-45-4	CC(=CC(=O)C1=CC=CC=C1)C2=CC=CC=C2	{24: 1, 1: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	495-48-7	C1=CC=C(C=C1)N=[N+](C2=CC=CC=C2)[O-]	{33: 1, 34: 1, 29: 1, 14: 10}
Did not match all atoms present	495-52-3	C1CC2=CC3=C(CCC3)C=C2C1	{11: 6, 14: 2}
Did not match all atoms present	495-54-5	C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N	{34: 2, 30: 2, 14: 8}
Did not match all atoms present	495-69-2	C1=CC=C(C=C1)C(=O)NCC(=O)O	{24: 1, 2: 1, 27: 1, 14: 5, 31: 1}
Did not match all atoms present	495-71-6	C1=CC=C(C=C1)C(=O)CCC(=O)C2=CC=CC=C2	{24: 2, 2: 2, 14: 10}
Did not match all atoms present	495-73-8	C1=CC=C(C=C1)C(=O)NNC2=CC=C(C=C2)N=O	{24: 1, 34: 1, 29: 1, 14: 9, 31: 2}
Did not match all atoms present	495-74-9	CC#CC#CC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 10: 4, 14: 5}
Did not match all atoms present	495-76-1	C1OC2=C(O1)C=C(C=C2)CO	{2: 1, 11: 1, 20: 1, 14: 3, 23: 2}
Did not match all atoms present	495-78-3	C1=CC=C(C(=C1)CCC(=O)O)O	{2: 2, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	495-85-2	COC1=CC(=O)O[C@H](C1)/C=C/C2=CC3=C(C=C2)OCO3	{1: 1, 6: 2, 11: 2, 12: 1, 14: 4, 15: 1, 22: 1, 23: 2, 28: 1}
Did not match all atoms present	495-91-0	C1CCN(CC1)C(=O)/C=C\C=C/C2=CC3=C(C=C2)OCO3	{33: 1, 6: 4, 11: 6, 14: 3, 23: 2, 24: 1}
Did not match all atoms present	49538-98-9	CC(C)OP(=S)(OC(C)C)S[Sn](C1CCCCC1)(C2CCCCC2)C3CCCCC3	{1: 4, 3: 2, 40: 1, 11: 15, 12: 3, 22: 2}
Did not match all atoms present	49539-88-0	CO[Si](CCC1=CC=CC=C1)(OC)OC	{1: 3, 2: 2, 22: 3, 14: 5}
Did not match all atoms present	49540-00-3	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Hg+2]	{16: 6, 4: 2, 29: 6}
Did not match all atoms present	4955-82-2	C1=CC=C(C=C1)NC(=S)C#N	{31: 1, 37: 1, 14: 5, 7: 1}
Did not match all atoms present	4955-90-2	C1=CC(=C(C=C1O)C(=O)[O-])O.[Na+]	{24: 1, 21: 2, 14: 3}
Did not match all atoms present	49556-16-3	CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Sn+2]	{24: 2, 1: 6, 2: 10, 4: 2}
Did not match all atoms present	49558-02-3	CC1=[N+](ON=C1[N+](=O)[O-])[O-]	{1: 1, 35: 1, 33: 1, 38: 1, 23: 1}
Did not match all atoms present	49558-46-5	C1=CC=C(C(=C1)C(=[N+]=[N-])S(=O)[O-])[N+](=O)[O-]	{34: 1, 38: 1, 29: 2, 14: 4, 7: 1}
Did not match all atoms present	4956-14-3	CCC(=O)OC1(CC[N+](CC1)(C)[O-])C2=CC=CC=C2.Cl	{1: 2, 2: 1, 11: 4, 13: 1, 14: 5, 17: 1, 28: 1, 29: 1}
Did not match all atoms present	4956-15-4	CCOC(=O)C1(CC[N+](CC1)(C)[O-])C2=CC=CC=C2.[Cl-]	{1: 2, 2: 1, 11: 4, 13: 1, 14: 5, 17: 1, 28: 1, 29: 1}
Did not match all atoms present	49561-54-8	CC(CC1=CC=CC=C1)[NH2+]CCN2CON=C2C3=CC=CC=C3.[Cl-]	{1: 1, 2: 3, 3: 1, 33: 1, 11: 1, 14: 10, 15: 1, 17: 1, 35: 1, 23: 1}
Did not match all atoms present	49561-96-8	C1=CC(=CC=C1CC#N)OC(F)(F)F	{2: 1, 4: 1, 37: 1, 14: 4, 16: 3, 22: 1}
Did not match all atoms present	49562-76-7	CCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 7, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	49564-57-0	CC1=CC(=C(C=C1S(=O)(=O)NC)OC)N	{1: 3, 14: 2, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	4957-14-6	CC1=CC=C(C=C1)CC2=CC=C(C=C2)C	{1: 2, 2: 1, 14: 8}
Did not match all atoms present	4957-16-8	CC1=CC(=C(C=C1C)CC2=C(C=C(C(=C2)C)C)C)C	{1: 6, 2: 1, 14: 4}
Did not match all atoms present	49575-13-5	CC1=NC=C(C(=N1)N)CN(/C(=C(\SS/C(=C(\N(C=O)CC2=CN=C(N=C2N)C)/C)/CCS(=O)C)/CCS(=O)C)/C)C=O	{1: 6, 2: 6, 35: 4, 33: 2, 7: 4, 40: 2, 14: 2, 26: 2, 29: 2, 30: 2}
Did not match all atoms present	49577-56-2	CCCCCCCCCCCC1=NC=CN1CCC#N.C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O	{1: 1, 2: 12, 35: 1, 37: 1, 33: 1, 14: 5, 27: 3}
Did not match all atoms present	4958-56-9	CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 38: 1, 14: 8, 31: 1}
Did not match all atoms present	49580-44-1	C1=CC=C(C=C1)CN.[N+](=O)(O)[O-]	{2: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	49583-83-7	CCOC(=O)[C-]1C(=O)C2=CC=CC=C2C1=O.[Na+]	{1: 1, 2: 1, 14: 4, 15: 1, 25: 2, 28: 1}
Did not match all atoms present	49594-30-1	C(CS)CS(=O)(=O)O	{2: 3, 20: 1, 29: 2, 39: 1}
Did not match all atoms present	49596-04-5	[CH3-].[CH3-].[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Zr+4]	{14: 14}
Did not match all atoms present	496-06-0	CC(=O)CCC(=O)C1=COC=C1	{24: 2, 1: 1, 2: 2, 14: 3, 23: 1}
Did not match all atoms present	496-11-7	C1CC2=CC=CC=C2C1	{11: 3, 14: 4}
Did not match all atoms present	496-14-0	C1C2=CC=CC=C2CO1	{11: 2, 14: 4, 23: 1}
Did not match all atoms present	496-15-1	C1CNC2=CC=CC=C21	{32: 1, 11: 2, 14: 4}
Did not match all atoms present	496-16-2	C1COC2=CC=CC=C21	{11: 2, 14: 4, 23: 1}
Did not match all atoms present	496-41-3	C1=CC=C2C(=C1)C=C(O2)C(=O)O	{27: 1, 14: 5, 23: 1}
Did not match all atoms present	496-63-9	C1=COC=C(C1=O)O	{25: 1, 21: 1, 14: 3, 23: 1}
Did not match all atoms present	496-64-0	C1=COC(=O)C(=C1)O	{28: 1, 21: 1, 14: 3}
Did not match all atoms present	496-69-5	C1=CC(=C(C=C1F)Br)O	{16: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	496-72-0	CC1=CC(=C(C=C1)N)N	{1: 1, 30: 2, 14: 3}
Did not match all atoms present	496-73-1	CC1=C(C=C(C=C1)O)O	{1: 1, 21: 2, 14: 3}
Did not match all atoms present	496-74-2	CC1=CC(=C(C=C1)S)S	{1: 1, 14: 3, 39: 2}
Did not match all atoms present	496-78-6	CC1=CC(=C(C=C1C)O)C	{1: 3, 21: 1, 14: 2}
Did not match all atoms present	4960-86-5	[2H]CCl	{1: 1, 17: 1}
Did not match all atoms present	49608-01-7	CCOC(=O)C1=CN=C(C=C1)Cl	{1: 1, 2: 1, 35: 1, 14: 3, 17: 1, 28: 1}
Did not match all atoms present	49609-84-9	C1=CC(=C(N=C1)Cl)C(=O)Cl	{24: 1, 17: 2, 35: 1, 14: 3}
Did not match all atoms present	49619-82-1	C1=CC=C2C(=C1)C(=O)C(=CO2)Br	{25: 1, 18: 1, 14: 5, 23: 1}
Did not match all atoms present	49622-63-1	CC1=CC2=CC=CC=C2C=P1	{1: 1, 14: 6}
Did not match all atoms present	49623-71-4	CC(C)C1=CC(=C(C(=C1)C(C)C)C(=O)O)C(C)C	{27: 1, 1: 6, 3: 3, 14: 2}
Did not match all atoms present	4963-30-8	C1CN(CCN1C2=CC=C(C=C2)N=O)C3=CC=C(C=C3)N=O	{33: 2, 34: 2, 11: 4, 29: 2, 14: 8}
Did not match all atoms present	49630-05-9	CC1=CC=C(C=C1)S(=O)(=O)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C	{1: 5, 3: 1, 29: 2, 14: 12, 33: 2}
Did not match all atoms present	49631-88-1	CC1COCC(N1C(=O)C[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CC(=O)N4C(COCC4C)C)C.[Cl-].[Cl-]	{1: 4, 2: 2, 33: 4, 11: 4, 12: 4, 14: 8, 17: 2, 23: 2, 24: 2}
Did not match all atoms present	49637-59-4	CCCCCC(C)COP(=O)(C1=CC=CC=C1)OCC(C)CCCCC	{1: 4, 2: 10, 3: 2, 14: 5, 22: 2, 29: 1}
Did not match all atoms present	4964-14-1	C[As](=O)(C)C	{1: 3, 29: 1}
Did not match all atoms present	4964-27-6	CC[As](=O)(CC)O	{1: 2, 2: 2, 20: 1, 29: 1}
Did not match all atoms present	4964-30-1	CCCCC[As](=O)(CCCCC)O	{1: 2, 2: 8, 20: 1, 29: 1}
Did not match all atoms present	4964-71-0	C1=CC2=C(C=CC=N2)C(=C1)Br	{18: 1, 35: 1, 14: 6}
Did not match all atoms present	49642-61-7	CCN(C1=C(C(=C(C=C1I)I)OCCOC(C)C(=O)[O-])I)C(=O)C.[Na+]	{1: 3, 2: 3, 3: 1, 33: 1, 14: 1, 19: 3, 22: 2, 24: 2}
Did not match all atoms present	49647-20-3	CC(=O)C1=CC=C(C=C1)N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 24: 1, 29: 1}
Did not match all atoms present	4965-17-7	CCCCC[N+](CCCCC)(CCCCC)CCCCC.[Cl-]	{1: 4, 2: 16, 17: 1}
Did not match all atoms present	4965-33-7	CC1=NC2=C(C=C1)C=CC(=C2)Cl	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	4965-36-0	C1=CC2=C(C=C(C=C2)Br)N=C1	{18: 1, 35: 1, 14: 6}
Did not match all atoms present	49650-84-2	C1=CC2=C(C=CC=C2S(=O)(=O)N)C(=C1)S(=O)(=O)N	{30: 2, 29: 4, 14: 6}
Did not match all atoms present	49650-88-6	C1=CC(=CC(=C1)OCCO)O	{2: 2, 22: 1, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	49651-10-7	CC1=CC(=CC=C1)P(C2=CC=CC(=C2)C)C3=CC=CC(=C3)C.CC1=CC(=CC=C1)P(C2=CC=CC(=C2)C)C3=CC=CC(=C3)C.[Co+2].[Br-].[Br-]	{1: 6, 18: 2, 14: 24}
Did not match all atoms present	49658-24-4	C1=CC=C(C=C1)CC2=CC=C(C=C2)CC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O	{25: 2, 2: 2, 14: 16}
Did not match all atoms present	49669-45-6	CCOC(=O)CC1=CC=CN1C	{1: 2, 2: 2, 28: 1, 14: 3, 33: 1}
Did not match all atoms present	49675-88-9	CC1=C(SC(=O)S1)C	{1: 2, 41: 2, 25: 1}
Did not match all atoms present	49676-83-7	CC(CC(=O)[O-])CC(C)(C)C.CC(CC(=O)[O-])CC(C)(C)C.[Co+2]	{24: 2, 1: 8, 2: 4, 3: 2, 4: 2}
Did not match all atoms present	4969-02-2	CN1CCCC(C1)CC2C3=CC=CC=C3SC4=CC=CC=C24	{1: 1, 2: 1, 33: 1, 41: 1, 11: 4, 12: 2, 14: 8}
Did not match all atoms present	49690-12-2	CC(C)(C)N(C)C(=O)C1=CC=CC=C1	{24: 1, 1: 4, 4: 1, 14: 5, 33: 1}
Did not match all atoms present	49690-94-0	C1=CC=C(C(=C1)OC2=CC(=C(C=C2)Br)Br)Br	{18: 3, 22: 1, 14: 7}
Did not match all atoms present	49693-09-6	C=CCOC(=O)C1=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)OCC=C	{2: 2, 18: 4, 28: 2, 5: 2, 6: 2}
Did not match all atoms present	497-19-8	C(=O)([O-])[O-].[Na+].[Na+]	{24: 1}
Did not match all atoms present	497-30-3	C[N+](C)(C)C(CC1=CNC(=S)N1)C(=O)[O-]	{32: 2, 1: 3, 2: 1, 3: 1, 14: 1, 24: 1}
Did not match all atoms present	497-39-2	CC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O	{1: 7, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	497-56-3	CC1=C(C=C(C=C1O)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	497-59-6	C1=C(OC(=C(C1=O)O)C(=O)O)C(=O)O	{25: 1, 27: 2, 21: 1, 14: 1, 23: 1}
Did not match all atoms present	497-76-7	C1=CC(=CC=C1O)OC2C(C(C(C(O2)CO)O)O)O	{2: 1, 12: 5, 14: 4, 20: 4, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	49701-24-8	CNS(=O)(=O)C1=C(C=C(C(=C1)OC)N)OC	{1: 3, 14: 2, 22: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	49715-04-0	C(OS(=O)(=O)Cl)Cl	{17: 2, 2: 1, 29: 2, 22: 1}
Did not match all atoms present	49716-81-6	C=CC=C.C=CC1=CC=CC=C1.C=C(CC(=O)O)C(=O)O.C(=C/C(=O)O)\C(=O)O	{2: 1, 5: 4, 6: 5, 7: 1, 14: 5, 27: 4}
Did not match all atoms present	4972-29-6	C1=CC=C(C=C1)S(=O)Cl	{17: 1, 29: 1, 14: 5}
Did not match all atoms present	49720-59-4	CC(=C)C(=O)OCC(C[N+](C)(C)C)O.C=CC(=O)O.[Cl-]	{1: 4, 2: 2, 3: 1, 5: 2, 6: 1, 7: 1, 17: 1, 20: 1, 27: 1, 28: 1}
Did not match all atoms present	49720-72-1	COC1=CC=C2C(=CC1=O)[C@H](CCC3=CC(=C(C(=C32)OC)OC)OC)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 4, 3: 2, 11: 2, 12: 1, 14: 4, 20: 2, 22: 4, 25: 1, 27: 2, 30: 1}
Did not match all atoms present	49720-83-4	[H+].[H+].CCOC1=CC=CC=C1N.CCOC1=CC=CC=C1N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{1: 2, 2: 2, 3: 4, 14: 8, 22: 2, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	49721-45-1	C1=NC(=C(C(=N1)N)N)N.OS(=O)(=O)O	{30: 3, 35: 2, 20: 2, 29: 2, 14: 1}
Did not match all atoms present	49722-97-6	C1=NC2=NC(=S)NC(=C2N1)N.OS(=O)(=O)O	{32: 2, 35: 2, 14: 1, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	49723-69-5	C1=CC=C(C=C1)[I+]C2=CC=CC=C2.OS(=O)(=O)[O-]	{19: 1, 20: 1, 29: 3, 14: 10}
Did not match all atoms present	4973-29-9	C=CC1=CC=C(C=C1)OC2=CC=CC=C2	{14: 9, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	49742-56-5	CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC	{1: 2, 28: 1, 14: 8}
Did not match all atoms present	49744-35-6	COCCOCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 4, 14: 4, 22: 2, 28: 1, 30: 1}
Did not match all atoms present	49744-39-0	C1=CC(=C(C=C1C2=CC(=C(C=C2)[N+]#N)Cl)Cl)[N+]#N.[Cl-].[Cl-]	{17: 4, 34: 2, 14: 6}
Did not match all atoms present	49745-95-1	CC(CCC1=CC=C(C=C1)O)NCCC2=CC(=C(C=C2)O)O.Cl	{1: 1, 2: 4, 3: 1, 14: 7, 17: 1, 21: 3, 31: 1}
Did not match all atoms present	4975-21-7	CC1=NON=C1C	{1: 2, 35: 2, 23: 1}
Did not match all atoms present	49759-21-9	CCOC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC(=O)C=CC	{1: 2, 2: 1, 6: 2, 34: 2, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	49762-08-5	CC1=CSC(=S)N1O	{1: 1, 41: 1, 21: 1, 14: 1, 33: 1}
Did not match all atoms present	49763-60-2	CCCCCC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C#N	{1: 1, 2: 4, 37: 1, 6: 1, 34: 1, 14: 8}
Did not match all atoms present	49763-64-6	CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 4, 28: 1, 37: 1, 14: 8}
Did not match all atoms present	49763-65-7	CCCCCC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 2: 4, 14: 4, 17: 1}
Did not match all atoms present	49763-66-8	CCCCCCCCC1=CC=C(C=C1)C=O	{1: 1, 2: 7, 26: 1, 14: 4}
Did not match all atoms present	49763-69-1	CCCCCCC1=CC=C(C=C1)C=O	{1: 1, 2: 5, 26: 1, 14: 4}
Did not match all atoms present	49764-17-2	COC1=CC=C(C=C1)OC23CC4CC(C2)CC(C4)C3	{1: 1, 11: 6, 12: 3, 13: 1, 14: 4, 22: 2}
Did not match all atoms present	49773-64-0	COC1=C(C=C(C=C1)C2=NN=C(S2)C3=CC(=C(C=C3)OC)OC)OC	{1: 4, 35: 2, 22: 4, 14: 6, 41: 1}
Did not match all atoms present	49780-10-1	C1CC2CN(CCN2C1)CCC(=O)N3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl.Cl.Cl	{33: 3, 2: 2, 41: 1, 11: 6, 12: 1, 14: 7, 17: 3, 24: 1}
Did not match all atoms present	4979-46-8	CC1=CC(=C(C=C1)O)C(C)(C)CC(C)(C)C	{1: 6, 2: 1, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	4979-72-0	[B-](F)(F)(F)F.CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCOCC2	{1: 2, 2: 2, 33: 1, 11: 4, 34: 1, 14: 2, 16: 4, 22: 2, 23: 1}
Did not match all atoms present	498-00-0	COC1=C(C=CC(=C1)CO)O	{1: 1, 2: 1, 14: 3, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	498-02-2	CC(=O)C1=CC(=C(C=C1)O)OC	{24: 1, 1: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	498-60-2	C1=COC=C1C=O	{26: 1, 14: 3, 23: 1}
Did not match all atoms present	498-62-4	C1=CSC=C1C=O	{41: 1, 26: 1, 14: 3}
Did not match all atoms present	498-74-8	COC1=C(C=C(C=C1)S(=O)(=O)F)N	{1: 1, 14: 3, 16: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	49800-23-9	C1CC(C2=CC=CC=C2C1)N.Cl	{17: 1, 11: 3, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	4981-24-2	CCCC[Sn]1(OC(=O)CCSCCC(=O)O1)CCCC	{1: 2, 2: 6, 11: 4, 28: 2, 41: 1}
Did not match all atoms present	4981-63-9	CCCC(=O)C1=CC=C(C=C1)Cl	{24: 1, 1: 1, 2: 2, 14: 4, 17: 1}
Did not match all atoms present	4981-64-0	CCCC(=O)C1=CC=C(C=C1)Br	{24: 1, 1: 1, 2: 2, 18: 1, 14: 4}
Did not match all atoms present	4981-66-2	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2O)O	{21: 2, 14: 8}
Did not match all atoms present	4982-34-7	C1C(=CC=C1C2=CC=CC=C2)C3=CC=CC=C3	{11: 1, 14: 12, 15: 2}
Did not match all atoms present	49828-25-3	CCCSC1=C(C=CC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 2: 2, 38: 1, 40: 1, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	49830-98-0	C1CC[NH+](CC1)CC(=O)N2CCOC3=CC=CC=C32.[Cl-]	{33: 1, 2: 1, 11: 7, 14: 4, 17: 1, 23: 1, 24: 1}
Did not match all atoms present	49833-12-7	C1=CC2=C3C(=C1)SS(=O)C3=CC=C2	{41: 1, 29: 1, 14: 6}
Did not match all atoms present	49833-45-6	CC1=CC=C(C=C1)S(=O)C(C)(C)C	{1: 4, 4: 1, 29: 1, 14: 4}
Did not match all atoms present	4984-82-1	[CH-]1C=CC=C1.[Na+]	{14: 5}
Did not match all atoms present	49841-53-4	CC(C)C1=CC(=C(C=C1)C(C)C)Cl	{1: 4, 3: 2, 14: 3, 17: 1}
Did not match all atoms present	49842-07-1	C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)N)O)O)O[C@@H]3[C@@H](C[C@@H]([C@H](O3)CN)O)N)N.OS(=O)(=O)O	{2: 2, 11: 2, 12: 14, 20: 7, 22: 2, 23: 2, 29: 2, 30: 5}
Did not match all atoms present	49844-90-8	CSC1=NC=CC(=N1)Cl	{40: 1, 1: 1, 35: 2, 14: 2, 17: 1}
Did not match all atoms present	49845-33-2	C1=C(C(=NC(=N1)Cl)Cl)[N+](=O)[O-]	{17: 2, 35: 2, 38: 1, 14: 1}
Did not match all atoms present	4985-15-3	C[NH+](C)CCON=C1C2=CC=CC=C2CCC3=CC=CC=C31.[Cl-]	{1: 2, 2: 2, 11: 2, 34: 1, 14: 8, 15: 1, 17: 1, 22: 1}
Did not match all atoms present	4985-46-0	C1=CC(=CC=C1C[C@@H](C(=O)N)N)O	{2: 1, 3: 1, 14: 4, 21: 1, 24: 1, 30: 2}
Did not match all atoms present	4985-58-4	CCC[S]	{1: 1, 2: 2}
Did not match all atoms present	4985-62-0	C1=CC=C(C=C1)[S]	{14: 5}
Did not match all atoms present	4985-70-0	C1=CC=C2C=C3C(=CC2=C1)C=CC=C3Cl	{17: 1, 14: 9}
Did not match all atoms present	49850-29-5	CC(C)OC(=O)NC1=CC2=C(C=C1)N(C(=N2)C3=CSC=N3)N	{1: 2, 3: 1, 33: 1, 41: 1, 14: 5, 35: 2, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	49852-85-9	C1=CC=C2C(=C1)C3=C4C(=C2CBr)C=CC5=CC=CC(=C54)C=C3	{2: 1, 18: 1, 14: 11}
Did not match all atoms present	49859-70-3	CN(CCOC(=O)C=C)S(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 6, 5: 1, 6: 1, 33: 1, 16: 13, 28: 1, 29: 2}
Did not match all atoms present	4986-70-3	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]	{33: 1, 2: 2, 29: 3, 14: 14}
Did not match all atoms present	49860-08-4	C1=CC(=C(C=C1N)C(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+]	{24: 1, 30: 1, 22: 1, 14: 3, 29: 3}
Did not match all atoms present	4988-33-4	C1CCS(=O)(=O)CC1	{11: 5, 29: 2}
Did not match all atoms present	499-06-9	CC1=CC(=CC(=C1)C(=O)O)C	{1: 2, 27: 1, 14: 3}
Did not match all atoms present	499-30-9	C1=CC=C(C=C1)CCC(=NOS(=O)(=O)O)S[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	{2: 3, 7: 1, 40: 1, 12: 5, 34: 1, 14: 5, 20: 5, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	499-44-5	CC(C)C1=CC(=O)C(=CC=C1)O	{1: 2, 3: 1, 21: 1, 14: 4, 25: 1}
Did not match all atoms present	499-55-8	C1=CC(=CC(=C1)F)C(=O)NN	{16: 1, 24: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	499-75-2	CC1=C(C=C(C=C1)C(C)C)O	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	499-78-5	C1=C(OC=C(C1=O)O)C(=O)O	{25: 1, 27: 1, 21: 1, 14: 2, 23: 1}
Did not match all atoms present	499-80-9	C1=CN=C(C=C1C(=O)O)C(=O)O	{35: 1, 27: 2, 14: 3}
Did not match all atoms present	499-81-0	C1=C(C=NC=C1C(=O)O)C(=O)O	{35: 1, 27: 2, 14: 3}
Did not match all atoms present	499-83-2	C1=CC(=NC(=C1)C(=O)O)C(=O)O	{35: 1, 27: 2, 14: 3}
Did not match all atoms present	4991-47-3	CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 28}
Did not match all atoms present	4991-65-5	C1=CC2=C(C=C1O)OC(=O)S2	{41: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	4992-28-3	C1C(=O)N(C(=S)S1)/N=C/C2=CC=CC=C2	{33: 1, 34: 1, 6: 1, 41: 1, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	4992-29-4	C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)N	{33: 1, 6: 1, 41: 1, 14: 5, 15: 2, 25: 1, 30: 1}
Did not match all atoms present	4992-30-7	C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)N=CC3=CC=CC=C3	{33: 1, 34: 1, 6: 2, 41: 1, 14: 10, 15: 2, 25: 1}
Did not match all atoms present	4994-16-5	C1CC(CC=C1)C2=CC=CC=C2	{11: 3, 12: 1, 14: 7}
Did not match all atoms present	4995-43-1	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OP(=O)(O)O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 3, 20: 2, 21: 1, 22: 1, 29: 1}
Did not match all atoms present	4997-62-0	C1=CC=C(C=C1)C2=C(C2(C3=CC=CC=C3)C4(C(=C4C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8	{13: 2, 14: 30, 15: 4}
Did not match all atoms present	4998-07-6	COC1=C(C=C(C(=C1)C(=O)O)[N+](=O)[O-])OC	{38: 1, 1: 2, 27: 1, 22: 2, 14: 2}
Did not match all atoms present	4998-23-6	CC1=C/C(=N\NC2=CC(=C(C=C2)N/N=C\3/C=CC(=O)C(=C3)C)Cl)/C=CC1=O	{1: 2, 34: 2, 14: 9, 15: 4, 17: 1, 25: 2, 31: 2}
Did not match all atoms present	4998-57-6	C1=C(NC=N1)CC(C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 2, 35: 1, 27: 1, 30: 1}
Did not match all atoms present	4998-82-7	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC(=CC(=C3O)[N+](=O)[O-])[N+](=O)[O-]	{34: 1, 38: 2, 14: 8, 15: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	50-00-0	C=O	{5: 1}
Did not match all atoms present	50-06-6	CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2	{32: 2, 1: 1, 2: 1, 13: 1, 14: 5, 25: 3}
Did not match all atoms present	50-09-9	CC1(C(=O)NC(=O)N(C1=O)C)C2=CCCCC2.[Na+]	{32: 1, 1: 2, 33: 1, 11: 4, 13: 1, 14: 1, 15: 1, 25: 3}
Did not match all atoms present	50-10-2	CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.[Br-]	{1: 3, 2: 4, 4: 1, 11: 5, 12: 1, 14: 5, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	50-12-4	CCC1(C(=O)N(C(=O)N1)C)C2=CC=CC=C2	{32: 1, 1: 2, 2: 1, 33: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	50-13-5	CCOC(=O)C1(CCN(CC1)C)C2=CC=CC=C2.Cl	{1: 2, 2: 1, 33: 1, 11: 4, 13: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	50-18-0	C1CNP(=O)(OC1)N(CCCl)CCCl	{32: 1, 33: 1, 2: 4, 11: 3, 17: 2, 23: 1, 29: 1}
Did not match all atoms present	50-19-1	CCC(COC(=O)N)(C1=CC=CC=C1)O	{1: 1, 2: 2, 4: 1, 14: 5, 20: 1, 28: 1, 30: 1}
Did not match all atoms present	50-27-1	C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2O)O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 5, 12: 5, 13: 1, 14: 3, 20: 2, 21: 1}
Did not match all atoms present	50-28-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	50-29-3	C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl)Cl	{17: 5, 3: 1, 4: 1, 14: 8}
Did not match all atoms present	50-30-6	C1=CC(=C(C(=C1)Cl)C(=O)O)Cl	{17: 2, 27: 1, 14: 3}
Did not match all atoms present	50-31-7	C1=CC(=C(C(=C1Cl)C(=O)O)Cl)Cl	{17: 3, 27: 1, 14: 2}
Did not match all atoms present	50-32-8	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC=C5)C=C3	{14: 12}
Did not match all atoms present	50-33-9	CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 3, 33: 2, 12: 1, 14: 10, 25: 2}
Did not match all atoms present	50-34-0	CC(C)[N+](C)(CCOC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13)C(C)C.[Br-]	{1: 5, 2: 2, 3: 2, 12: 1, 14: 8, 18: 1, 23: 1, 28: 1}
Did not match all atoms present	50-35-1	C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=O	{32: 1, 33: 1, 11: 2, 12: 1, 14: 4, 25: 4}
Did not match all atoms present	50-36-2	CN1C2CCC1C(C(C2)OC(=O)C3=CC=CC=C3)C(=O)OC	{1: 2, 33: 1, 11: 3, 12: 4, 14: 5, 28: 2}
Did not match all atoms present	50-37-3	CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C	{32: 1, 1: 3, 2: 2, 33: 2, 11: 2, 12: 2, 14: 5, 15: 1, 24: 1}
Did not match all atoms present	50-39-5	CC(CN1C(=O)C2=C(N=CN2C)N(C1=O)C)O	{1: 3, 2: 1, 3: 1, 33: 3, 14: 1, 35: 1, 20: 1, 25: 2}
Did not match all atoms present	50-41-9	CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 6, 4: 1, 33: 1, 7: 2, 14: 14, 17: 1, 20: 1, 22: 1, 27: 3}
Did not match all atoms present	50-42-0	CCN(CC)CCOC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 2, 2: 4, 3: 1, 33: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	50-43-1	C1=C(C=C(C(=C1Cl)C(=O)O)Cl)Cl	{17: 3, 27: 1, 14: 2}
Did not match all atoms present	50-44-2	C1=NC2=C(N1)C(=S)N=CN2	{32: 2, 35: 2, 14: 2}
Did not match all atoms present	50-45-3	C1=CC(=C(C(=C1)Cl)Cl)C(=O)O	{17: 2, 27: 1, 14: 3}
Did not match all atoms present	50-47-5	CNCCCN1C2=CC=CC=C2CCC3=CC=CC=C31	{1: 1, 2: 3, 33: 1, 11: 2, 14: 8, 31: 1}
Did not match all atoms present	50-48-6	CN(C)CCC=C1C2=CC=CC=C2CCC3=CC=CC=C31	{1: 2, 2: 2, 6: 1, 33: 1, 11: 2, 14: 8, 15: 1}
Did not match all atoms present	50-49-7	CN(C)CCCN1C2=CC=CC=C2CCC3=CC=CC=C31	{1: 2, 2: 3, 11: 2, 14: 8, 33: 2}
Did not match all atoms present	50-50-0	CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5	{1: 1, 11: 6, 12: 4, 13: 1, 14: 8, 20: 1, 28: 1}
Did not match all atoms present	50-52-2	CN1CCCCC1CCN2C3=CC=CC=C3SC4=C2C=C(C=C4)SC	{1: 2, 2: 2, 33: 2, 40: 1, 41: 1, 11: 4, 12: 1, 14: 7}
Did not match all atoms present	50-53-3	CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl	{1: 2, 2: 3, 33: 2, 41: 1, 14: 7, 17: 1}
Did not match all atoms present	50-54-4	COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O.COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O.OS(=O)(=O)O	{1: 2, 3: 2, 5: 2, 6: 2, 33: 2, 11: 8, 12: 6, 14: 10, 35: 2, 20: 4, 22: 2, 29: 2}
Did not match all atoms present	50-55-5	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC	{32: 1, 1: 6, 33: 1, 11: 5, 12: 6, 14: 5, 22: 5, 28: 2}
Did not match all atoms present	50-56-6	CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)N1)CC2=CC=C(C=C2)O)N)C(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N	{32: 5, 1: 4, 2: 7, 3: 3, 33: 1, 41: 2, 11: 5, 12: 7, 14: 4, 21: 1, 24: 6, 25: 5, 30: 4, 31: 2}
Did not match all atoms present	50-57-7	C1CC(N(C1)C(=O)C2CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)N)C(=O)NC(CCCCN)C(=O)NCC(=O)N	{32: 5, 33: 1, 2: 10, 3: 1, 41: 2, 11: 5, 12: 7, 14: 9, 21: 1, 24: 6, 25: 5, 30: 5, 31: 2}
Did not match all atoms present	50-59-9	C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CS3)C(=O)[O-])C[N+]4=CC=CC=C4	{33: 2, 2: 2, 41: 2, 11: 1, 12: 2, 14: 8, 15: 2, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	50-60-2	CC1=CC=C(C=C1)N(CC2=NCCN2)C3=CC(=CC=C3)O	{32: 1, 1: 1, 2: 1, 35: 1, 33: 1, 11: 2, 14: 8, 15: 1, 21: 1}
Did not match all atoms present	50-62-4	CN(CCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)CCN(C)CCCOC(=O)C2=CC(=C(C(=C2)OC)OC)OC.Cl.Cl	{1: 8, 2: 8, 33: 2, 14: 4, 17: 2, 22: 6, 28: 2}
Did not match all atoms present	50-63-5	CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl.OP(=O)(O)O.OP(=O)(O)O	{1: 3, 2: 5, 3: 1, 33: 1, 14: 5, 17: 1, 35: 1, 20: 6, 29: 2, 31: 1}
Did not match all atoms present	50-65-7	C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC(=O)C2=C(C=CC(=C2)Cl)O	{38: 1, 14: 6, 17: 2, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	50-66-8	CSC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 35: 3, 14: 2, 40: 1}
Did not match all atoms present	50-67-9	C1=CC2=C(C=C1O)C(=CN2)CCN	{32: 1, 2: 2, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	50-73-7	C1=C(C=C(C(=C1Cl)Cl)C(=O)O)Cl	{17: 3, 27: 1, 14: 2}
Did not match all atoms present	50-76-0	CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C(=C(C5=N4)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)C7CCCN7C(=O)C(NC6=O)C(C)C)C)C)C(C)C)C)N)C	{32: 2, 1: 16, 3: 4, 33: 6, 11: 8, 12: 10, 14: 2, 35: 1, 23: 1, 24: 2, 25: 9, 28: 2, 30: 1, 31: 2}
Did not match all atoms present	50-78-2	CC(=O)OC1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	50-79-3	C1=CC(=C(C=C1Cl)C(=O)O)Cl	{17: 2, 27: 1, 14: 3}
Did not match all atoms present	50-82-8	C1=C(C(=CC(=C1Cl)Cl)Cl)C(=O)O	{17: 3, 27: 1, 14: 2}
Did not match all atoms present	50-84-0	C1=CC(=C(C=C1Cl)Cl)C(=O)O	{17: 2, 27: 1, 14: 3}
Did not match all atoms present	50-85-1	CC1=CC(=C(C=C1)C(=O)O)O	{1: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	50-89-5	CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O	{32: 1, 1: 1, 2: 1, 33: 1, 11: 1, 12: 3, 14: 1, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	50-90-8	C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)Cl)CO)O	{32: 1, 33: 1, 2: 1, 11: 1, 12: 3, 14: 1, 17: 1, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	50-91-9	C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)F)CO)O	{32: 1, 33: 1, 2: 1, 11: 1, 12: 3, 14: 1, 16: 1, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	500-05-0	C1=CC(=O)OC=C1C(=O)O	{27: 1, 28: 1, 14: 3}
Did not match all atoms present	500-22-1	C1=CC(=CN=C1)C=O	{26: 1, 35: 1, 14: 4}
Did not match all atoms present	500-28-7	COP(=S)(OC)OC1=CC(=C(C=C1)[N+](=O)[O-])Cl	{1: 2, 38: 1, 22: 3, 14: 3, 17: 1}
Did not match all atoms present	500-34-5	CC1CC(CC(N1)(C)C)OC(=O)C2=CC=CC=C2	{32: 1, 1: 3, 11: 2, 12: 2, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	500-38-9	CC(CC1=CC(=C(C=C1)O)O)C(C)CC2=CC(=C(C=C2)O)O	{1: 2, 2: 2, 3: 2, 21: 4, 14: 6}
Did not match all atoms present	500-44-7	C1=CN(C=C(C1=O)O)C[C@@H](C(=O)O)N	{33: 1, 2: 1, 3: 1, 14: 3, 21: 1, 25: 1, 27: 1, 30: 1}
Did not match all atoms present	500-49-2	CCCC1=CC(=CC(=C1)O)O	{1: 1, 2: 2, 21: 2, 14: 3}
Did not match all atoms present	500-55-0	CN1C2CCC1CC(C2)OC(=O)C(=C)C3=CC=CC=C3	{1: 1, 5: 1, 7: 1, 11: 4, 12: 3, 14: 5, 33: 1, 28: 1}
Did not match all atoms present	500-64-1	COC1=CC(=O)OC(C1)C=CC2=CC=CC=C2	{1: 1, 6: 2, 11: 1, 12: 1, 14: 6, 15: 1, 22: 1, 28: 1}
Did not match all atoms present	500-67-4	CCCCCCCC1=CC(=CC(=C1)O)O	{1: 1, 2: 6, 21: 2, 14: 3}
Did not match all atoms present	500-72-1	C1=CC=C(C=C1)NC(=O)C(=O)O	{24: 1, 27: 1, 14: 5, 31: 1}
Did not match all atoms present	500-73-2	C1=CC=C(C=C1)OC(=O)C(F)(F)F	{16: 3, 28: 1, 4: 1, 14: 5}
Did not match all atoms present	500-92-5	CC(C)N=C(N)/N=C(\N)/NC1=CC=C(C=C1)Cl	{1: 2, 34: 2, 3: 1, 7: 2, 14: 4, 17: 1, 30: 2, 31: 1}
Did not match all atoms present	500-99-2	COC1=CC(=CC(=C1)O)OC	{1: 2, 22: 2, 21: 1, 14: 3}
Did not match all atoms present	5000-44-2	CC(=O)CS(=O)(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 29: 2, 14: 5}
Did not match all atoms present	5000-48-6	CC(=O)CS(=O)(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 1, 29: 2}
Did not match all atoms present	5000-65-7	COC1=CC=CC(=C1)C(=O)CBr	{1: 1, 2: 1, 14: 4, 18: 1, 22: 1, 24: 1}
Did not match all atoms present	500013-99-0	C1=CC=C2C(=C1)C=C3C=CC=CC3=N2.O	{35: 1, 14: 9}
Did not match all atoms present	500021-17-0	CCC1=CC=CC(=C1CC)C(=O)C(CC)(CC)CC	{24: 1, 1: 5, 2: 5, 4: 1, 14: 3}
Did not match all atoms present	500026-38-0	CCCCCCCCCCS(=O)(=O)CCCCCCCCCC	{1: 2, 2: 18, 29: 2}
Did not match all atoms present	500041-11-2	CCCCCCCCCSC1=CC=CC=C1	{40: 1, 1: 1, 2: 8, 14: 5}
Did not match all atoms present	5003-48-5	CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2OC(=O)C	{24: 1, 1: 2, 28: 2, 14: 8, 31: 1}
Did not match all atoms present	5005-36-7	C1=CC=C(C=C1)C(C#N)C2=CC=CC=N2	{35: 1, 3: 1, 37: 1, 14: 9}
Did not match all atoms present	5005-46-9	CC(C)N(CCC(C#N)(C1=CC=CC=C1)C2=CC=CC=N2)C(C)C	{1: 4, 2: 2, 3: 2, 4: 1, 37: 1, 33: 1, 14: 9, 35: 1}
Did not match all atoms present	5005-62-9	C1(=C(C(=NC(=C1Cl)Cl)C(Cl)(Cl)Cl)Cl)N	{17: 6, 35: 1, 4: 1, 30: 1}
Did not match all atoms present	5006-66-6	C1=CC(=O)NC=C1C(=O)O	{32: 1, 25: 1, 27: 1, 14: 3}
Did not match all atoms present	5007-67-0	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)N)N)N)N	{24: 1, 30: 4, 14: 6}
Did not match all atoms present	5008-87-7	CCCCC(CCCC)C1=NC=CN=C1OC2=CC=CC=C2	{1: 2, 2: 6, 3: 1, 14: 7, 35: 2, 22: 1}
Did not match all atoms present	501-00-8	C1=CC(=CC(=C1)F)CC#N	{16: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	501-15-5	CNCCC1=CC(=C(C=C1)O)O	{1: 1, 2: 2, 21: 2, 14: 3, 31: 1}
Did not match all atoms present	501-19-9	COC1=C(C=C(C=C1)CC=C)O	{1: 1, 2: 1, 5: 1, 6: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	501-24-6	CCCCCCCCCCCCCCCC1=CC(=CC=C1)O	{1: 1, 2: 14, 21: 1, 14: 4}
Did not match all atoms present	501-29-1	COC1=CC(=C(C=C1)Cl)F	{16: 1, 1: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	501-30-4	C1=C(OC=C(C1=O)O)CO	{2: 1, 14: 2, 20: 1, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	501-36-0	C1=CC(=CC=C1/C=C/C2=CC(=CC(=C2)O)O)O	{14: 7, 6: 2, 21: 3}
Did not match all atoms present	501-52-0	C1=CC=C(C=C1)CCC(=O)O	{2: 2, 27: 1, 14: 5}
Did not match all atoms present	501-53-1	C1=CC=C(C=C1)COC(=O)Cl	{17: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	501-58-6	COC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC	{1: 2, 34: 2, 22: 2, 14: 8}
Did not match all atoms present	501-65-5	C1=CC=C(C=C1)C#CC2=CC=CC=C2	{10: 2, 14: 10}
Did not match all atoms present	501-68-8	C1=CC=C(C=C1)CNC(=O)CCCl	{24: 1, 17: 1, 2: 3, 14: 5, 31: 1}
Did not match all atoms present	501-81-5	C1=CC(=CN=C1)CC(=O)O	{35: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	501-92-8	C=CCC1=CC=C(C=C1)O	{2: 1, 14: 4, 5: 1, 6: 1, 21: 1}
Did not match all atoms present	501-94-0	C1=CC(=CC=C1CCO)O	{2: 2, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	501-97-3	C1=CC(=CC=C1CCC(=O)O)O	{2: 2, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	5012-62-4	CCCCCCCCCCCCCCCCC(C)C1=CC(=CC(=C1O)C(C)CCCCCCCCCCCCCCCC)C	{1: 5, 2: 30, 3: 2, 21: 1, 14: 2}
Did not match all atoms present	5012-80-6	CC(=C(C)N=O)NNC(=S)N	{1: 2, 34: 1, 7: 3, 29: 1, 30: 1, 31: 2}
Did not match all atoms present	5013-77-4	CNCC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 1, 31: 1, 14: 3, 17: 2}
Did not match all atoms present	5014-35-7	CCN(CC)CCOC1=C(C=C(C=C1)Br)C(=O)NC2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 14: 8, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5015-38-3	C(COP(=O)([O-])[O-])C#N.[Ba+2]	{2: 2, 29: 3, 22: 1, 37: 1}
Did not match all atoms present	5015-75-8	C1=CC(=CC=C1S(=O)(=O)[O-])Br.[Na+]	{18: 1, 29: 3, 14: 4}
Did not match all atoms present	5016-18-2	CN1C(=O)C2=C(NC1=O)N=NC=N2	{32: 1, 1: 1, 35: 3, 33: 1, 14: 1, 25: 2}
Did not match all atoms present	5018-87-1	C1=CC=C2C(=C1)C=CC=C2C(=O)C3=CC=CC=C3C(=O)O	{24: 1, 27: 1, 14: 11}
Did not match all atoms present	502-02-3	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O	{1: 2, 34: 2, 33: 1, 14: 8, 20: 1, 29: 2}
Did not match all atoms present	502-39-6	C[Hg]/N=C(\N)/NC#N	{1: 1, 34: 1, 37: 1, 7: 1, 30: 1, 31: 1}
Did not match all atoms present	502-55-6	CCOC(=S)SSC(=S)OCC	{40: 2, 1: 2, 2: 2, 22: 2, 7: 2}
Did not match all atoms present	502-86-3	C=C1C=CC(=C)C=C1	{5: 2, 14: 4}
Did not match all atoms present	5020-41-7	COC1=CC=CC(=C1)CCO	{1: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	5021-93-2	CCO[Si](CC)(CC)OCC	{1: 4, 2: 4, 22: 2}
Did not match all atoms present	5022-29-7	CCN1C(=O)C2=CC=CC=C2C1=O	{1: 1, 2: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	5024-31-7	COC1=CC(=NC(=C1OC)OC)CO	{1: 3, 2: 1, 35: 1, 14: 1, 20: 1, 22: 3}
Did not match all atoms present	50257-39-1	CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=CN=C2)C	{1: 3, 35: 1, 29: 2, 14: 5, 33: 1}
Did not match all atoms present	50257-40-4	CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N2C=CN=C2)C(C)C	{1: 6, 3: 3, 33: 1, 14: 5, 35: 1, 29: 2}
Did not match all atoms present	50258-68-9	CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO	{1: 1, 2: 7, 3: 1, 14: 4, 20: 4, 27: 2}
Did not match all atoms present	5026-74-4	C1C(O1)CN(CC2CO2)C3=CC=C(C=C3)OCC4CO4	{33: 1, 2: 3, 11: 3, 12: 3, 14: 4, 22: 1, 23: 3}
Did not match all atoms present	50261-16-0	CCCCCOC(=O)OC1=CC=C(C=C1)C=NC2=CC=C(C=C2)OC	{1: 2, 34: 1, 6: 1, 2: 4, 14: 8, 22: 1}
Did not match all atoms present	50261-59-1	CCCCCOC(=O)OC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC(=O)CCCC	{1: 2, 2: 7, 6: 1, 34: 1, 14: 8, 28: 1}
Did not match all atoms present	50261-99-9	CCCCCOC(=O)OC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)CCCC	{1: 2, 2: 7, 6: 1, 34: 1, 14: 8, 24: 1}
Did not match all atoms present	50262-46-9	CCCCCCCCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 8, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	50262-48-1	CCC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 1, 28: 1, 26: 1, 14: 4}
Did not match all atoms present	50262-49-2	CCCC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 2, 28: 1, 26: 1, 14: 4}
Did not match all atoms present	50262-50-5	CCCCC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 3, 28: 1, 26: 1, 14: 4}
Did not match all atoms present	50262-51-6	CCCCCC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 4, 28: 1, 26: 1, 14: 4}
Did not match all atoms present	50262-54-9	CCOC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 1, 26: 1, 14: 4}
Did not match all atoms present	50262-55-0	CCCOC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 2, 26: 1, 14: 4}
Did not match all atoms present	50262-56-1	CCCCOC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 3, 26: 1, 14: 4}
Did not match all atoms present	50262-57-2	CCCCCOC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 4, 26: 1, 14: 4}
Did not match all atoms present	50262-58-3	CCCCCCOC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 5, 26: 1, 14: 4}
Did not match all atoms present	50262-67-4	CCCCCCCCCOC1=CC=C(C=C1)N	{1: 1, 2: 8, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	50262-77-6	CCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)O	{1: 1, 2: 5, 6: 1, 34: 1, 14: 8, 21: 1, 22: 1}
Did not match all atoms present	50264-69-2	C1=CC=C2C(=C1)C(=NN2CC3=C(C=C(C=C3)Cl)Cl)C(=O)O	{33: 1, 2: 1, 35: 1, 14: 7, 17: 2, 27: 1}
Did not match all atoms present	50264-86-3	C1=CC=C2C(=C1)C(=NN2CC3=CC=C(C=C3)Cl)C(=O)O	{33: 1, 2: 1, 35: 1, 14: 8, 17: 1, 27: 1}
Did not match all atoms present	50264-96-5	C1=CC=C2C(=C1)C(=NN2CC3=CC=C(C=C3)Cl)C(=O)OC(CO)CO	{33: 1, 2: 3, 3: 1, 14: 8, 17: 1, 35: 1, 20: 2, 28: 1}
Did not match all atoms present	5027-65-6	COC(=O)C1=CN=CC(=C1)C(=O)O	{1: 1, 27: 1, 28: 1, 14: 3, 35: 1}
Did not match all atoms present	50271-92-6	C[Si](C)(C)NC1=NC(=NC=C1Br)O[Si](C)(C)C	{1: 6, 35: 2, 14: 1, 18: 1, 22: 1, 31: 1}
Did not match all atoms present	50274-95-8	C1=CC(=C(C=C1[N+](=O)[O-])Cl)CCl	{17: 2, 2: 1, 38: 1, 14: 3}
Did not match all atoms present	50275-57-5	CC(C1(CCC(=O)NC1=O)C2=CC=CC=C2)O	{32: 1, 1: 1, 3: 1, 11: 2, 13: 1, 14: 5, 20: 1, 25: 2}
Did not match all atoms present	50286-76-5	CCC1=CC(=NC(=C1)CC)CC	{1: 3, 2: 3, 35: 1, 14: 2}
Did not match all atoms present	5029-05-0	C[S+](C)CCC(C(=O)O)N	{27: 1, 1: 2, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	5029-61-8	C1=CC(=C(C=C1C(=O)CBr)[N+](=O)[O-])O	{2: 1, 38: 1, 14: 3, 18: 1, 21: 1, 24: 1}
Did not match all atoms present	5029-67-4	C1=CC=NC(=C1)I	{35: 1, 19: 1, 14: 4}
Did not match all atoms present	50290-51-2	CC1=CC(=O)N2C3=CC=CC=C3N=C2N1	{32: 1, 1: 1, 35: 1, 33: 1, 14: 5, 25: 1}
Did not match all atoms present	50293-19-1	CCCCCCCCN1C(=C(C2=CC=CC=C21)C3(C4=C(C(=C(C(=C4Cl)Cl)Cl)Cl)C(=O)O3)C5=C(N(C6=CC=CC=C65)CCCCCCCC)C)C	{1: 4, 2: 14, 33: 2, 13: 1, 14: 8, 17: 4, 28: 1}
Did not match all atoms present	50293-29-3	CCN1C(=C(C2=CC=CC=C21)C3(C4=C(C=CC=N4)C(=O)O3)C5=C(N(C6=CC=CC=C65)CC)C)C	{1: 4, 2: 2, 35: 1, 33: 2, 13: 1, 14: 11, 28: 1}
Did not match all atoms present	50296-60-1	CC1=C(NC(=C1C(=O)OC)C)C(=O)O	{32: 1, 1: 3, 27: 1, 28: 1}
Did not match all atoms present	503-40-2	C(S(=O)(=O)O)S(=O)(=O)O	{2: 1, 20: 2, 29: 4}
Did not match all atoms present	503-41-3	C1CS(=O)(=O)OS(=O)(=O)O1	{11: 2, 29: 4, 23: 2}
Did not match all atoms present	503-80-0	C[As](C)O[As](C)C	{1: 4, 22: 1}
Did not match all atoms present	503-87-7	C1C(=O)NC(=S)N1	{32: 2, 25: 1, 11: 1, 15: 1}
Did not match all atoms present	50308-82-2	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)C)Cl	{1: 4, 33: 2, 14: 25, 17: 1, 24: 1, 29: 6, 31: 3}
Did not match all atoms present	50308-83-3	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=[N+](C=C4)C)Cl.[Br-].[Br-]	{1: 2, 33: 2, 14: 17, 17: 1, 18: 2, 24: 1, 31: 3}
Did not match all atoms present	50308-84-4	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=CC=C(C5=[N+](C=C4)C)Cl	{1: 4, 33: 2, 14: 25, 17: 1, 24: 1, 29: 6, 31: 3}
Did not match all atoms present	50308-86-6	CC1=C(C2=CC=CC=C2[N+](=C1)C)NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=CC=[N+](C=C5)C.[Br-].[Br-]	{1: 3, 33: 2, 14: 17, 18: 2, 24: 1, 31: 3}
Did not match all atoms present	50308-87-7	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC2=C(C=C[N+](=C2C=C1)C)NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=CC=[N+](C=C5)C	{1: 5, 33: 2, 14: 25, 24: 1, 29: 6, 31: 3}
Did not match all atoms present	50308-88-8	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)C)OC	{1: 5, 33: 2, 14: 25, 22: 1, 24: 1, 29: 6, 31: 3}
Did not match all atoms present	50308-89-9	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=CC=C(C5=[N+](C=C4)C)OC.[Br-].[Br-]	{1: 3, 33: 2, 14: 17, 18: 2, 22: 1, 24: 1, 31: 3}
Did not match all atoms present	50308-94-6	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)C)N.[Br-].[Br-]	{1: 2, 33: 2, 14: 17, 18: 2, 24: 1, 30: 1, 31: 3}
Did not match all atoms present	50309-03-0	CCCN1C=CC(=NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=C[N+](=C(N=C4N)N)CCC)C5=CC=CC=C51.I.[I-]	{1: 2, 2: 4, 35: 1, 33: 2, 34: 1, 14: 15, 19: 2, 24: 1, 30: 2, 31: 1}
Did not match all atoms present	50309-11-0	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)C	{24: 1, 1: 2, 33: 2, 14: 18, 31: 3}
Did not match all atoms present	50309-16-5	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)CC)N.[I-].[I-]	{1: 2, 2: 2, 33: 2, 14: 17, 19: 2, 24: 1, 30: 1, 31: 3}
Did not match all atoms present	50309-17-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC4=C5C=CC(=CC5=[N+](C=C4)C)[N+](=O)[O-]	{1: 4, 38: 1, 33: 2, 14: 25, 24: 1, 29: 6, 31: 3}
Did not match all atoms present	50309-20-1	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(=O)NC1=CC2=[N+](C=CC(=C2C=C1)NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=CC=[N+](C=C5)C)C	{1: 5, 33: 2, 14: 25, 24: 2, 29: 6, 31: 4}
Did not match all atoms present	5031-74-3	C1=CC2=C(C=C1S(=O)(=O)CCO)OC(=O)N2	{32: 1, 2: 2, 14: 3, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	5031-78-7	CC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9}
Did not match all atoms present	50311-48-3	C(OO[N+](=O)[O-])(F)(F)F	{16: 3, 4: 1, 22: 2}
Did not match all atoms present	50314-37-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)O)S(=O)(=O)[O-])N.[Na+]	{14: 9, 21: 1, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	50315-14-5	CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Cu+2]	{24: 2, 1: 6, 2: 10, 4: 2}
Did not match all atoms present	50318-32-6	COC=[O+]C.F[P-](F)(F)(F)(F)F	{16: 6, 1: 2, 26: 1, 22: 1}
Did not match all atoms present	50326-33-5	CC1=CC(=C(C=C1Cl)N/N=C/2\C(=O)C(=CC3=CC=CC=C23)C(=O)NC4=CC=CC=C4OC)S(=O)(=O)[O-].CC1=CC(=C(C=C1Cl)N/N=C/2\C(=O)C(=CC3=CC=CC=C23)C(=O)NC4=CC=CC=C4OC)S(=O)(=O)[O-].[Ba+2]	{1: 4, 34: 2, 14: 22, 15: 4, 17: 2, 22: 2, 24: 2, 25: 2, 29: 6, 31: 4}
Did not match all atoms present	50329-18-5	C1(C(C(C(C(C1C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)O.[Na+].[Na+].[Na+].[Na+].[Na+]	{24: 5, 27: 1, 12: 6}
Did not match all atoms present	50335-03-0	C[C@H]\1C/C=C/C2[C@H]3[C@](O3)([C@H]([C@@H]4[C@@]2(C(=O)/C=C/C(=O)[C@@H](/C(=C1)/C)O)C(=O)N[C@H]4CC5=CNC6=CC=CC=C65)C)C	{32: 2, 1: 4, 2: 1, 11: 1, 12: 7, 13: 2, 14: 10, 15: 1, 20: 1, 23: 1, 25: 3}
Did not match all atoms present	50335-09-6	CCN(CC)CC1=CC(=CC(=C1OP(=S)(CC)O)Cl)Cl	{1: 3, 2: 4, 33: 1, 14: 2, 17: 2, 20: 1, 22: 1}
Did not match all atoms present	50337-75-2	CC(C)(C)OC1=CC=CC2=CC=CC=C21	{1: 3, 4: 1, 22: 1, 14: 7}
Did not match all atoms present	5034-74-2	COC1=C(C(=CC(=C1)Br)C=O)O	{1: 1, 14: 2, 18: 1, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	5035-67-6	CCCCC(CC)C(=O)O[Sn](CCCC)(CCCC)CCCC	{1: 5, 2: 13, 3: 1, 28: 1}
Did not match all atoms present	5035-82-5	COC1=C(C(=C(C(=C1)C(=O)OC)N)OC)OC	{1: 4, 30: 1, 28: 1, 22: 3, 14: 1}
Did not match all atoms present	50353-00-9	C1=CC=C(C(=C1)[N+](=O)[O-])OC(=O)Cl	{17: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	50355-74-3	CN(C)N=NC1=C(C=C(C=C1Cl)Cl)Cl	{1: 2, 34: 2, 33: 1, 14: 2, 17: 3}
Did not match all atoms present	50355-75-4	CN(C)N=NC1=C(C=C(C=C1Br)Br)Br	{1: 2, 18: 3, 34: 2, 14: 2, 33: 1}
Did not match all atoms present	50357-45-4	C1=CC(=CC=C1C(=[NH2+])N)OCCCCCOC2=CC=C(C=C2)C(=[NH2+])N.[Cl-].[Cl-]	{2: 5, 7: 2, 14: 8, 17: 2, 22: 2, 30: 4}
Did not match all atoms present	5036-02-2	C1CSC2=NC(CN21)C3=CC=CC=C3	{33: 1, 35: 1, 41: 1, 11: 3, 12: 1, 14: 5, 15: 1}
Did not match all atoms present	5036-03-3	C1CN(C(=O)N1CCO)/N=C/C2=CC=C(O2)[N+](=O)[O-]	{33: 2, 2: 2, 38: 1, 6: 1, 11: 2, 34: 1, 14: 2, 20: 1, 23: 1, 25: 1}
Did not match all atoms present	5037-63-8	CC1=C2CCCC(=O)C2=C(C=C1)C	{1: 2, 11: 3, 14: 2, 25: 1}
Did not match all atoms present	5037-65-0	CC(C)(C)[Si](C)(C)C	{1: 6, 4: 1}
Did not match all atoms present	5037-75-2	C1C(=O)NC(C(=O)N1)CC2=CC=CC=C2	{32: 2, 2: 1, 11: 1, 12: 1, 14: 5, 25: 2}
Did not match all atoms present	50370-12-2	CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)SC1)C(=O)O	{1: 1, 3: 1, 33: 1, 41: 1, 11: 1, 12: 2, 14: 4, 15: 2, 21: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	50375-10-5	COC1=C(C=CC(=C1Cl)Cl)Cl	{1: 1, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	50375-15-0	CC(=O)NC1=CC=C(C=C1)OCCO	{1: 1, 2: 2, 14: 4, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	50378-14-8	CCCC[Sn](=O)O[Sn](=O)CCCC	{1: 2, 2: 6, 29: 2, 22: 1}
Did not match all atoms present	50378-83-1	CCN1C2=C(C=CC(=C2)OC)[Se]C1=CC3=[N+](C4=C(C=C3)C=C(C=C4)OC)CC.[I-]	{1: 4, 2: 2, 6: 1, 33: 2, 14: 8, 15: 1, 19: 1, 22: 2}
Did not match all atoms present	50378-93-3	CCC(C)(C)C1=CC(=C(C(=C1)C(C)(C)CC)O)CC2=C(C(=CC(=C2)C(C)(C)CC)C(C)(C)CC)O	{1: 12, 2: 5, 4: 4, 21: 2, 14: 4}
Did not match all atoms present	50380-74-0	C1=CC=C2C(=C1)C(=CC(=C2N)O)C#N	{30: 1, 21: 1, 14: 5, 37: 1}
Did not match all atoms present	50385-24-5	C1=CC=C(C(=C1)C=CC2=CC=CC=N2)[N+](=O)[O-]	{38: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	50390-78-8	CC1=C(C=CC(=C1)SC)OC	{40: 1, 1: 3, 22: 1, 14: 3}
Did not match all atoms present	50397-74-5	C1=CC(=C(C=C1C#N)Br)N	{18: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	504-15-4	CC1=CC(=CC(=C1)O)O	{1: 1, 21: 2, 14: 3}
Did not match all atoms present	504-17-6	C1C(=O)NC(=S)NC1=O	{32: 2, 25: 2, 11: 1, 15: 1}
Did not match all atoms present	504-24-5	C1=CN=CC=C1N	{35: 1, 30: 1, 14: 4}
Did not match all atoms present	504-29-0	C1=CC=NC(=C1)N	{35: 1, 30: 1, 14: 4}
Did not match all atoms present	504-33-6	C(CS(=O)(=O)O)C(C(=O)O)N	{2: 2, 3: 1, 20: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	504-90-5	C(=S)(N)SSC(=S)N	{40: 2, 30: 2, 7: 2}
Did not match all atoms present	5040-51-7	C1CC2=CC=C(O2)CCC3=CC=C1C=C3	{11: 4, 14: 6, 23: 1}
Did not match all atoms present	50402-70-5	COCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 1, 22: 1}
Did not match all atoms present	50407-18-6	CC1=C2C=CC=CC2=NN1C	{1: 2, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	50416-18-7	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH3+].[Cl-]	{1: 1, 2: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	5042-33-1	C1=CC(=C(C=C1S(=O)(=O)[O-])[N+](=O)[O-])N.[Na+]	{30: 1, 38: 1, 29: 3, 14: 3}
Did not match all atoms present	5042-54-6	CC1=CC(=C(C=C1N)N)N=NC2=CC=CC=C2	{1: 1, 34: 2, 30: 2, 14: 7}
Did not match all atoms present	5042-55-7	C1=C(C=C(C=C1N)[N+](=O)[O-])N	{38: 1, 30: 2, 14: 3}
Did not match all atoms present	50424-93-6	CC1=CC=CC(=C1[N+](=O)[O-])C(=O)Cl	{24: 1, 1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	50425-34-8	CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=CC2=C(C=C[N+](=C12)C)NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NC5=CC=[N+](C=C5)C	{1: 5, 33: 2, 14: 25, 20: 2, 24: 1, 29: 4, 31: 3}
Did not match all atoms present	50425-35-9	CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.C[N+]1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)C	{1: 4, 33: 2, 14: 26, 20: 2, 24: 1, 29: 4, 31: 2}
Did not match all atoms present	50427-77-5	C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N)N	{24: 1, 33: 1, 35: 1, 30: 2, 14: 6}
Did not match all atoms present	50433-83-5	CCCCCCCC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 2: 6, 28: 1, 26: 1, 14: 4}
Did not match all atoms present	5044-19-9	CCN1C(=CC=C1C)C	{1: 3, 2: 1, 14: 2, 33: 1}
Did not match all atoms present	5044-38-2	C1=CN(C=C1)C2=CC=C(C=C2)Cl	{17: 1, 14: 8, 33: 1}
Did not match all atoms present	5044-52-0	C=C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{14: 15, 18: 1, 5: 1, 6: 1}
Did not match all atoms present	5045-23-8	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 14: 9, 15: 2, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	5045-43-2	C1=CC=C2C(=C1)N=C(O2)C=CC3=CC=C(C=C3)C=CC4=NC5=CC=CC=C5O4	{35: 2, 14: 12, 6: 4, 23: 2}
Did not match all atoms present	50454-68-7	CC1=C(C=CC(=C1)Cl)CN2C3=CC=CC=C3C(=N2)C(=O)O	{1: 1, 2: 1, 35: 1, 33: 1, 14: 7, 17: 1, 27: 1}
Did not match all atoms present	50462-84-5	CCC1(CC1)C2=CC=CC=C2	{1: 1, 2: 1, 11: 2, 13: 1, 14: 5}
Did not match all atoms present	50465-39-9	CC1=C2C(=C(C(=C1C)OC(=O)C(C)(C)OC3=CC=C(C=C3)Cl)C)CC[C@@](O2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C	{1: 10, 2: 9, 3: 3, 4: 1, 11: 2, 13: 1, 14: 4, 17: 1, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	5047-01-8	C1=CC2=C(C=CC3=C2C=CC(=C3)[N+](=O)[O-])C=C1[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	50471-44-8	CC1(C(=O)N(C(=O)O1)C2=CC(=CC(=C2)Cl)Cl)C=C	{1: 1, 5: 1, 6: 1, 33: 1, 13: 1, 14: 3, 17: 2, 25: 1, 28: 1}
Did not match all atoms present	5048-82-8	CCOC(=O)C=CC1=CC=C(C=C1)N	{1: 1, 2: 1, 6: 2, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	50485-03-5	CCNC(=O)[C@H]1CN([C@@H]2CC3=CN(C4=CC=CC(=C34)C2=C1)C(=O)C)C	{1: 3, 2: 1, 33: 2, 11: 2, 12: 2, 14: 5, 15: 1, 24: 2, 31: 1}
Did not match all atoms present	5049-61-6	C1=CN=C(C=N1)N	{35: 2, 30: 1, 14: 3}
Did not match all atoms present	50495-13-1	[Na+].[Na+].[Br-].[Br-].[Br-].[Br-].[Pd+2]	{18: 4}
Did not match all atoms present	50497-83-1	[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=C(C=CC3=O)N([O-])[O-].[Cr+3]	{25: 2, 34: 4, 38: 1, 14: 18, 15: 3}
Did not match all atoms present	50498-74-3	CC[N+]1=C(SC=C1C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 1, 33: 1, 41: 1, 14: 5, 29: 3}
Did not match all atoms present	505-34-0	CS(=O)(=O)CCCN=C=S	{8: 1, 1: 1, 2: 3, 34: 1, 29: 2}
Did not match all atoms present	505-44-2	CS(=O)CCCN=C=S	{8: 1, 1: 1, 2: 3, 34: 1, 29: 1}
Did not match all atoms present	505-79-3	CSCCCN=C=S	{8: 1, 1: 1, 2: 3, 34: 1, 40: 1}
Did not match all atoms present	50507-31-8	CC(CCCCN)CCCCN.C1=CC(=CC=C1C(=O)O)C(=O)O	{1: 1, 2: 8, 3: 1, 14: 4, 27: 2, 30: 2}
Did not match all atoms present	5051-16-1	CC(C1=CC=CC2=CC=CC=C21)C(=O)OCCN3CCN(CC3)CCOC(=O)C(C)C4=CC=CC5=CC=CC=C54.Cl.Cl	{1: 2, 2: 4, 3: 2, 33: 2, 11: 4, 14: 14, 17: 2, 28: 2}
Did not match all atoms present	50510-11-7	C1C(OC(=N1)N)CSC2=CC=C(C=C2)Cl	{2: 1, 35: 1, 40: 1, 11: 1, 12: 1, 14: 4, 15: 1, 17: 1, 23: 1, 30: 1}
Did not match all atoms present	50510-12-8	C1C(OC(=N1)N)CSC2=CC(=C(C=C2)Cl)Cl	{2: 1, 35: 1, 40: 1, 11: 1, 12: 1, 14: 3, 15: 1, 17: 2, 23: 1, 30: 1}
Did not match all atoms present	50525-57-0	[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-])[O-].[Co+3]	{30: 2, 34: 4, 29: 4, 14: 18}
Did not match all atoms present	50528-73-9	C1=CC=C(C=C1)COC2=CC=C(C=C2)N=C=O	{2: 1, 8: 1, 34: 1, 14: 9, 22: 1, 29: 1}
Did not match all atoms present	50528-86-4	C1=CC(=C(C=C1C(F)(F)F)N=C=O)Cl	{34: 1, 4: 1, 8: 1, 14: 3, 16: 3, 17: 1, 29: 1}
Did not match all atoms present	50528-97-7	CC1=C(C(=CC=C1)C)NC(=O)/N=C/2\CCCN2C	{1: 3, 34: 1, 33: 1, 11: 3, 14: 3, 15: 1, 24: 1, 31: 1}
Did not match all atoms present	50529-33-4	C1=CC(=C(C=C1N=C=O)Cl)F	{34: 1, 8: 1, 14: 3, 16: 1, 17: 1, 29: 1}
Did not match all atoms present	5053-08-7	C1CN(CCC12CNC(=O)O2)CCC3=CC=CC=C3.Cl	{32: 1, 33: 1, 2: 2, 11: 5, 13: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	5053-43-0	CC1=NC=CC=N1	{1: 1, 35: 2, 14: 3}
Did not match all atoms present	50530-45-5	C1(=S)N[N-]C(=S)S1.[Na+]	{32: 1, 41: 1, 35: 1}
Did not match all atoms present	50539-45-2	C1=CC=C(C=C1)NC2=CC=C(C3=CC=CC=C32)N4C(=O)C=CC4=O	{25: 2, 33: 1, 14: 13, 31: 1}
Did not match all atoms present	50539-65-6	C1=CC=C2C(=C1)C=CC=C2NN=C3C=C(C4=C(C3=O)N=CC=C4)S(=O)(=O)O	{34: 1, 35: 1, 14: 11, 15: 2, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	50539-74-7	CC1(CC2=C(O1)C(=CC=C2)OC(=O)NCSC3=CC=C(C=C3)Br)C	{1: 2, 2: 1, 40: 1, 11: 1, 13: 1, 14: 7, 18: 1, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	50541-93-0	C1CN(CCC1N)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 4, 12: 1, 14: 5, 30: 1}
Did not match all atoms present	50543-78-7	[B-](F)(F)(F)F.CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCOCC2	{1: 2, 2: 6, 33: 1, 11: 4, 34: 1, 14: 2, 16: 4, 22: 2, 23: 1}
Did not match all atoms present	50546-29-7	CC1=CC=C(C=C1)N2C(N(CCO2)C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4	{1: 1, 38: 2, 33: 2, 11: 2, 12: 1, 14: 12, 23: 1, 24: 1}
Did not match all atoms present	5055-20-9	C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(O3)[N+](=O)[O-])N(CCO)CCO	{33: 1, 2: 4, 35: 2, 38: 1, 14: 6, 20: 2, 23: 1}
Did not match all atoms present	5055-42-5	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O[Si](C)(C)C)CCC4=CC(=O)CC[C@]34C	{1: 5, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 22: 1, 25: 1}
Did not match all atoms present	50551-56-9	CCOC(=O)C1=CC2=C(O1)C=CC(=C2)OC	{1: 2, 2: 1, 14: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	50551-58-1	CCOC(=O)C1=CC2=C(O1)C(=CC=C2)OC	{1: 2, 2: 1, 14: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	50552-30-2	CC(=O)CC(C=C)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 14: 5, 24: 1}
Did not match all atoms present	50556-36-0	C1=CC(=C(C=C1NC2=NC(=NC(=N2)NCCCOCCOCCO)NCCCOCCOCCO)S(=O)(=O)[O-])/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NCCCOCCOCCO)NCCCOCCOCCO)S(=O)(=O)[O-].[Na+].[Na+]	{2: 28, 35: 6, 6: 2, 14: 6, 20: 4, 22: 8, 29: 6, 31: 6}
Did not match all atoms present	50561-99-4	CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)O)OC)OC)OC	{1: 4, 11: 2, 12: 1, 14: 4, 21: 1, 22: 3, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	50563-36-5	CC1=C(C(=CC=C1)C)N(CCOC)C(=O)CCl	{1: 3, 2: 3, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	50563-55-8	CC1=C(C(=CC=C1)C)NCCOC	{1: 3, 2: 2, 22: 1, 14: 3, 31: 1}
Did not match all atoms present	50570-59-7	C1=CC(=C(C=C1NC2=NC(=NC(=N2)Cl)N(CCO)CCO)S(=O)(=O)O)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)Cl)N(CCO)CCO)S(=O)(=O)O	{33: 2, 2: 8, 35: 6, 6: 2, 14: 6, 17: 2, 20: 6, 29: 4, 31: 2}
Did not match all atoms present	5058-19-5	CCCCC1=CC=CC=N1	{1: 1, 2: 3, 35: 1, 14: 4}
Did not match all atoms present	50585-39-2	C1=CC=C2C(=C1)OC3=CC(=CC(=C3O2)Cl)Cl	{17: 2, 14: 6, 23: 2}
Did not match all atoms present	50588-13-1	CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1[N+]4(CCCCC4)C)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5[N+]6(CCCCC6)C)OC(=O)C)C.[Br-].[Br-]	{1: 6, 11: 17, 12: 8, 13: 2, 18: 2, 28: 2}
Did not match all atoms present	5059-60-9	COC1=CC(=C(C=C1[N+]#N)OC)N2CCOCC2.[Cl-].Cl[Zn]Cl	{1: 2, 34: 1, 33: 1, 11: 4, 14: 2, 17: 3, 22: 2, 23: 1}
Did not match all atoms present	50592-47-7	CC1(CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3)O	{1: 1, 11: 4, 20: 1, 13: 2, 14: 10}
Did not match all atoms present	50592-48-8	CC1=CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 11: 3, 13: 1, 14: 11, 15: 1}
Did not match all atoms present	50592-49-9	CC1CCC(CC1=O)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 11: 3, 12: 1, 13: 1, 14: 10, 25: 1}
Did not match all atoms present	50592-50-2	CC12CCCC=C1CC(CC2)(C3=CC=CC=C3)C4=CC=CC=C4	{1: 1, 11: 6, 13: 2, 14: 11, 15: 1}
Did not match all atoms present	50592-51-3	CCCCS/C=C\1/CCCC(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 3, 6: 1, 40: 1, 11: 3, 13: 1, 14: 10, 15: 1, 25: 1}
Did not match all atoms present	50592-52-4	CC1CCCC(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 11: 3, 12: 1, 13: 1, 14: 10, 25: 1}
Did not match all atoms present	50592-53-5	CC1(CCCC(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)C	{1: 2, 11: 3, 13: 2, 14: 10, 25: 1}
Did not match all atoms present	50592-54-6	C/C(=C\CC1(CCCC(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)C)/Cl	{1: 2, 2: 1, 6: 1, 7: 1, 11: 3, 13: 2, 14: 10, 17: 1, 25: 1}
Did not match all atoms present	50592-55-7	CC(=O)CCC1(CCCC(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)C	{1: 2, 2: 2, 11: 3, 13: 2, 14: 10, 24: 1, 25: 1}
Did not match all atoms present	50592-56-8	CC1(CCCC(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)CCC=O	{1: 1, 2: 2, 11: 3, 13: 2, 14: 10, 25: 1, 26: 1}
Did not match all atoms present	50594-44-0	CC(=O)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]	{1: 1, 4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	50594-66-6	C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O	{4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	50594-77-9	CC(=O)OC1=CC=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl	{1: 1, 4: 1, 14: 7, 16: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	50594-82-6	C1=C(C=C(C(=C1Cl)Cl)Cl)C(F)(F)F	{16: 3, 17: 3, 4: 1, 14: 2}
Did not match all atoms present	50597-88-1	CC1=CC(=C(C=C1)OC)I	{1: 2, 19: 1, 22: 1, 14: 3}
Did not match all atoms present	50598-28-2	CN(C)CCCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 6, 33: 1, 16: 13, 29: 2, 31: 1}
Did not match all atoms present	50598-29-3	C1=CC=C(C=C1)CNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 8, 14: 5, 16: 17, 29: 2, 31: 1}
Did not match all atoms present	506-63-8	[Be+2].[CH3-].[CH3-]	{}
Did not match all atoms present	506-64-9	[Ag].[C]#N	{}
Did not match all atoms present	506-65-0	[C-]#N.[Au+]	{}
Did not match all atoms present	506-66-1	[Be]=C=[Be]	{8: 1}
Did not match all atoms present	506-80-9	C(=[Se])=[Se]	{8: 1}
Did not match all atoms present	506-82-1	[CH3-].[CH3-].[Cd+2]	{}
Did not match all atoms present	506-83-2	C[Hg]Br	{1: 1, 18: 1}
Did not match all atoms present	506-87-6	C(=O)([O-])[O-].[NH4+].[NH4+]	{24: 1}
Did not match all atoms present	506-93-4	C(=N)(N)N.[N+](=O)(O)[O-]	{36: 1, 20: 1, 30: 2, 7: 1}
Did not match all atoms present	5060-49-1	CC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)CO	{1: 1, 2: 1, 35: 1, 33: 1, 14: 8, 20: 1, 25: 1}
Did not match all atoms present	5060-52-6	CC1=C(C=CC(=C1)O)N2C(=NC3=CC=CC=C3C2=O)C	{1: 2, 35: 1, 33: 1, 14: 7, 21: 1, 25: 1}
Did not match all atoms present	50603-25-3	CC\1=C(C(=O)NC(=O)/C1=N\NC2=CC=C(C=C2)C3=NC(=O)C4=CC=CC=C4N3)C#N	{32: 2, 1: 1, 34: 1, 35: 1, 37: 1, 14: 8, 15: 3, 25: 3, 31: 1}
Did not match all atoms present	50606-95-6	CCCCCCC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 2: 5, 14: 4, 17: 1}
Did not match all atoms present	50606-96-7	CCCCCCCC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 2: 6, 14: 4, 17: 1}
Did not match all atoms present	50606-97-8	CCCCCCCCC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 2: 7, 14: 4, 17: 1}
Did not match all atoms present	50608-12-3	CC(C)(C)C1=NN=C(S1)NC	{1: 4, 35: 2, 4: 1, 41: 1, 31: 1}
Did not match all atoms present	50609-15-9	CC(=O)NC1=C(NC=NC1=O)N	{32: 1, 1: 1, 35: 1, 14: 1, 24: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	5061-27-8	C[Ge](=O)C	{1: 2, 29: 1}
Did not match all atoms present	50614-82-9	CC(=CCN1C=CC2=CC=CC=C21)C	{1: 2, 2: 1, 6: 1, 33: 1, 7: 1, 14: 6}
Did not match all atoms present	50618-92-3	C1=CC(=C(C=C1F)[N+](=O)[O-])CCC2=C(C=C(C=C2)F)[N+](=O)[O-]	{16: 2, 2: 2, 38: 2, 14: 6}
Did not match all atoms present	50622-42-9	CCCCCCCCCCCCC(C(=O)Cl)OC1=CC(=C(C=C1)OC(=O)C)C(C)(C)C	{1: 5, 2: 11, 3: 1, 4: 1, 14: 3, 17: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	50636-22-1	CCOC1=CC=CC=C1C=CC(=O)OCC	{1: 2, 2: 2, 6: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	50638-54-5	CC1=CC(=CC(=C1N(C)C)C)Br	{1: 4, 18: 1, 14: 2, 33: 1}
Did not match all atoms present	5064-31-3	C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+]	{24: 3, 33: 1, 2: 3}
Did not match all atoms present	50643-39-5	C1=CC(=CC(=C1)OC2=NC(=NC(=N2)N)Cl)O	{35: 3, 14: 4, 17: 1, 21: 1, 22: 1, 30: 1}
Did not match all atoms present	50644-69-4	[Li+].[Li+].[F-]	{16: 1}
Did not match all atoms present	50645-41-5	[Te]1[Te][Te]1	{}
Did not match all atoms present	50645-42-6	[Te]1[Te][Te][Te][Te]1	{}
Did not match all atoms present	50648-02-7	C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Cd+2].[Cd+2].[Cd+2]	{24: 6, 33: 2, 2: 6}
Did not match all atoms present	50649-28-0	CCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	50649-49-5	CCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCC	{1: 2, 2: 8, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	50649-60-0	CCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCC	{1: 2, 2: 6, 28: 1, 14: 8}
Did not match all atoms present	50649-73-5	CCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 4, 37: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	50650-74-3	CC1=CC=C(C=C1)CC(C)N.OS(=O)(=O)O	{1: 2, 2: 1, 3: 1, 14: 4, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	50651-39-3	CC(=O)NC1=CC(=C(C=C1)OC)[N+](=O)[O-]	{1: 2, 38: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	50654-35-8	CC(C)(C)[CH2-].CC(C)(C)[CH2-].CC(C)(C)[CH2-].CC(C)(C)[CH2-].[Hf+4]	{1: 12, 4: 4, 5: 4}
Did not match all atoms present	50654-36-9	CC(C)(C)C[Ge](CC(C)(C)C)(CC(C)(C)C)CC(C)(C)C	{1: 12, 2: 4, 4: 4}
Did not match all atoms present	5066-34-2	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Dy+3].[Dy+3]	{24: 3}
Did not match all atoms present	50663-05-3	CN(C)P(=O)(C)C	{1: 4, 29: 1, 33: 1}
Did not match all atoms present	50663-21-3	C1=CC(=CC=C1C=CC(=O)O)Br	{18: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	50667-33-9	C1=CC(=C(C=C1S(=O)(=O)[O-])[N+](=O)[O-])N.[NH4+]	{30: 1, 38: 1, 29: 3, 14: 3}
Did not match all atoms present	50668-46-7	CCN1C(=C(C2=CC=CC=C21)C3(C4=C(C(=O)O3)N=CC=C4)C5=C(N(C6=CC=CC=C65)CC)C)C	{1: 4, 2: 2, 35: 1, 33: 2, 13: 1, 14: 11, 28: 1}
Did not match all atoms present	5067-90-3	C1=CC=C(C(=C1)C(=O)N=C=S)Cl	{8: 1, 17: 1, 34: 1, 14: 4, 24: 1}
Did not match all atoms present	50670-49-0	CC1=CC=C(C=C1)C2=CC=C(C=C2)Br	{1: 1, 18: 1, 14: 8}
Did not match all atoms present	50670-50-3	CC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 37: 1, 14: 8}
Did not match all atoms present	50670-64-9	CC1=C(C=C(C=C1)N)C#N	{1: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	50670-83-2	CC(=O)NC1=CC(=C(C=C1)N)C(=O)O	{1: 1, 14: 3, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	50673-06-8	CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC(C(Cl)Cl)(Cl)Cl)C	{1: 3, 3: 1, 4: 1, 33: 1, 40: 1, 11: 1, 13: 1, 14: 3, 17: 4, 23: 1, 28: 1}
Did not match all atoms present	50673-08-0	CCCCSN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C	{1: 4, 2: 3, 33: 1, 40: 1, 11: 1, 13: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	50673-09-1	CCCCCCCCCCCCSN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C	{1: 4, 2: 11, 33: 1, 40: 1, 11: 1, 13: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	50673-10-4	CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC3=CC(=C(C=C3)Cl)Cl)C	{1: 3, 33: 1, 40: 1, 11: 1, 13: 1, 14: 6, 17: 2, 23: 1, 28: 1}
Did not match all atoms present	50673-11-5	CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC3=C(C=CC(=C3)Cl)Cl)C	{1: 3, 33: 1, 40: 1, 11: 1, 13: 1, 14: 6, 17: 2, 23: 1, 28: 1}
Did not match all atoms present	50677-27-5	C1=CC(=CC=C1C(=O)NNC(=O)CCl)Cl	{24: 2, 17: 2, 2: 1, 14: 4, 31: 2}
Did not match all atoms present	50679-08-8	CC(C)(C)C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O	{1: 3, 2: 3, 3: 1, 4: 2, 33: 1, 11: 4, 12: 1, 14: 14, 20: 2}
Did not match all atoms present	5068-28-0	CC(C)(C)OC(=O)N[C@@H](CSCC1=CC=CC=C1)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 40: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	50687-70-2	CCCCCC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)O)Cl	{1: 1, 2: 4, 14: 7, 17: 1, 21: 1, 28: 1}
Did not match all atoms present	50687-71-3	CCCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)O)Cl	{1: 1, 2: 4, 14: 7, 17: 1, 21: 1, 28: 1}
Did not match all atoms present	50687-74-6	CCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C=C(C=C2)O)Cl	{1: 1, 2: 7, 14: 7, 17: 1, 21: 1, 28: 1}
Did not match all atoms present	50689-17-3	C1=COC=C1Cl	{17: 1, 14: 3, 23: 1}
Did not match all atoms present	5069-23-8	CCC1=CC=C(S1)CC	{1: 2, 2: 2, 14: 2, 41: 1}
Did not match all atoms present	5069-26-1	CC1=CC=C(S1)C2=CC=CC=C2	{1: 1, 14: 7, 41: 1}
Did not match all atoms present	5069-68-1	C1=CC=C(C(=C1)CSC2=NC=NC3=C2NC=N3)Cl	{32: 1, 2: 1, 35: 3, 40: 1, 14: 6, 17: 1}
Did not match all atoms present	50690-12-5	CC1=CC(=C(C(=C1)C)C(=O)CCl)C	{24: 1, 1: 3, 2: 1, 14: 2, 17: 1}
Did not match all atoms present	50698-69-6	CCCCC(CC)COC(=O)C(=C)C.CC(C)COC(=O)C(=C)C.C=CC1=CC=CC=C1	{1: 6, 2: 6, 3: 2, 5: 3, 6: 1, 7: 2, 14: 5, 28: 2}
Did not match all atoms present	507-15-3	CP(C)F	{16: 1, 1: 2}
Did not match all atoms present	507-16-4	O=S(Br)Br	{18: 2, 29: 1}
Did not match all atoms present	507-28-8	C1=CC=C(C=C1)[As+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{17: 1, 14: 20}
Did not match all atoms present	507-32-4	CC[As](=O)(O)O	{1: 1, 2: 1, 20: 2, 29: 1}
Did not match all atoms present	507-60-8	CC(=O)O[C@@H]1C[C@@]2([C@H](CC[C@]3([C@@]2(CC[C@@H]3C4=COC(=O)C=C4)O)C)[C@@]5(C1=C[C@H](CC5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)O	{1: 3, 2: 1, 11: 7, 12: 9, 13: 4, 14: 4, 15: 1, 20: 6, 22: 1, 23: 1, 28: 2}
Did not match all atoms present	50700-72-6	CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N4CCCCC4)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-]	{1: 5, 33: 1, 11: 17, 12: 8, 13: 2, 18: 1, 28: 2}
Did not match all atoms present	50703-41-8	C1C/C=C\CCCC2=CC=C(C1)C=C2	{11: 6, 14: 6}
Did not match all atoms present	50707-40-9	CCN=NNC1=CC=C(C=C1)C	{1: 2, 2: 1, 34: 2, 14: 4, 31: 1}
Did not match all atoms present	50709-36-9	C1=CC(=C(C(=C1)Cl)NN)Cl.Cl	{17: 3, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	5071-96-5	COC1=CC=CC(=C1)CN	{1: 1, 2: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	50712-68-0	CC1=C(C=CC(=C1)Cl)C#N	{1: 1, 37: 1, 14: 3, 17: 1}
Did not match all atoms present	50712-70-4	CC1=C(C=C(C=C1)Cl)C#N	{1: 1, 37: 1, 14: 3, 17: 1}
Did not match all atoms present	50714-97-1	C1CC(C(=O)C1)C(=O)CCC2=C(C=CC(=C2)O)O	{2: 2, 11: 3, 12: 1, 14: 3, 21: 2, 24: 1, 25: 1}
Did not match all atoms present	5072-26-4	CCCCS(=N)(=O)CCC(C(=O)O)N	{1: 1, 2: 5, 3: 1, 36: 1, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	50729-10-7	C1=CC=C2C(=C1)C=CC(=C2O)C(=O)NC3=CC=CC=C3Cl	{24: 1, 17: 1, 21: 1, 14: 10, 31: 1}
Did not match all atoms present	5074-71-5	C1=CC=C(C=C1)P(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F	{16: 10, 14: 5}
Did not match all atoms present	50743-17-4	C1=CC=C2C(=C1)C(=O)C(=CO2)C#N	{25: 1, 37: 1, 14: 5, 23: 1}
Did not match all atoms present	50745-64-7	CC[N+]1=C(C=CC2=CC=CC=C21)SCC.[I-]	{1: 2, 2: 2, 33: 1, 40: 1, 14: 6, 19: 1}
Did not match all atoms present	50746-10-6	CC(C)(CCOC=O)S	{1: 2, 2: 2, 4: 1, 26: 1, 39: 1}
Did not match all atoms present	5075-13-8	CCOP(=S)(C1=CC=CC=C1)Cl	{1: 1, 2: 1, 22: 1, 14: 5, 17: 1}
Did not match all atoms present	5075-52-5	C[Si](C)(C)OC1=CC=CC=C1O[Si](C)(C)C	{1: 6, 22: 2, 14: 4}
Did not match all atoms present	5076-63-1	CCOP(=O)(OCC)OC1=CC=C(C=C1)Cl	{1: 2, 2: 2, 14: 4, 17: 1, 22: 3, 29: 1}
Did not match all atoms present	5076-72-2	CCOC1=CC=C(C=C1)OC	{1: 2, 2: 1, 22: 2, 14: 4}
Did not match all atoms present	50765-87-2	CC(=CCC(CCN(C)C)(C1=CC=CC2=CC=CC=C21)C(=O)N)C	{1: 4, 2: 3, 4: 1, 33: 1, 6: 1, 7: 1, 14: 7, 24: 1, 30: 1}
Did not match all atoms present	50766-86-4	CCCC(=O)C1=CC(=CC=C1)[N+](=O)[O-]	{24: 1, 1: 1, 2: 2, 38: 1, 14: 4}
Did not match all atoms present	50772-35-5	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)O)C(C)(C)CC	{1: 6, 2: 5, 4: 2, 14: 3, 22: 1, 27: 1}
Did not match all atoms present	50774-65-7	CC[N+]1=C(SC2=C1C=C(C=C2)C)C.[I-]	{1: 3, 2: 1, 33: 1, 41: 1, 14: 3, 19: 1}
Did not match all atoms present	50777-76-9	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C=O	{26: 1, 14: 14}
Did not match all atoms present	50782-69-9	CCOP(=O)(C)SCCN(C(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 33: 1, 40: 1, 22: 1, 29: 1}
Did not match all atoms present	50786-03-3	CC12CCC(=O)C=C1CC(CC2)(C3=CC=CC=C3)C4=CC=CC=C4	{1: 1, 11: 5, 13: 2, 14: 11, 15: 1, 25: 1}
Did not match all atoms present	50789-44-1	CC(=O)OCC1=CC(=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 1, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	50793-85-6	CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 5, 28: 1, 37: 1, 14: 8}
Did not match all atoms present	50793-86-7	CCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 7, 28: 1, 37: 1, 14: 8}
Did not match all atoms present	50793-89-0	CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 7, 37: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	50795-24-9	C(C(=O)O)OCC(=O)[O-].[Na+]	{24: 1, 2: 2, 27: 1, 22: 1}
Did not match all atoms present	50796-71-9	C1=CC=C(C(=C1)C(=O)NNC(=O)C2=CC=CC=C2Br)Br	{24: 2, 18: 2, 14: 8, 31: 2}
Did not match all atoms present	508-54-3	CN1CC[C@]23C4C(=O)C=C[C@]2([C@H]1CC5=C3C(=C(C=C5)OC)O4)O	{1: 2, 33: 1, 11: 3, 12: 2, 13: 2, 14: 4, 20: 1, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	50802-28-3	C1=CC=C(C(=C1)N/N=C/2\C(=CC3=C(C=CC(=C3C2=O)NC4=C(C(=NC(=N4)Cl)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 35: 2, 14: 7, 15: 2, 17: 3, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	50802-52-3	CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCC	{1: 2, 2: 9, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	50802-53-4	CCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCC	{1: 2, 2: 10, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	50802-69-2	CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC3=CC=C(C=C3)F)C	{1: 3, 33: 1, 40: 1, 11: 1, 13: 1, 14: 7, 16: 1, 23: 1, 28: 1}
Did not match all atoms present	50802-70-5	CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC3=CC=C(C=C3)[N+](=O)[O-])C	{1: 3, 38: 1, 33: 1, 40: 1, 11: 1, 13: 1, 14: 7, 23: 1, 28: 1}
Did not match all atoms present	5081-36-7	COC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]	{38: 1, 1: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	5081-37-8	COC1=C(C=CC(=C1)C(=O)OC)[N+](=O)[O-]	{1: 2, 38: 1, 28: 1, 22: 1, 14: 3}
Did not match all atoms present	5081-42-5	COC1=C(C(=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC)OC	{1: 4, 38: 1, 28: 1, 22: 3, 14: 1}
Did not match all atoms present	5081-87-8	C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CCCl	{32: 1, 33: 1, 2: 2, 14: 4, 17: 1, 25: 2}
Did not match all atoms present	50814-28-3	C1=CC=C(C=C1)C\2=NC3=CC=CC=C3/C2=N\NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-].[Na+]	{34: 3, 35: 1, 14: 17, 15: 2, 29: 3, 31: 1}
Did not match all atoms present	50814-29-4	CC\1=CC(=O)C=C/C1=N\NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N/N=C\4/C=CC(=O)C=C4C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 6: 2, 14: 12, 15: 4, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	50818-84-3	CC[N+]1=C(SC2=CC=CC=C21)S(=O)(=O)[O-]	{1: 1, 2: 1, 33: 1, 41: 1, 14: 4, 29: 3}
Did not match all atoms present	50823-90-0	C1=CC(=CC(=C1)OC(F)(F)F)CO	{2: 1, 4: 1, 14: 4, 16: 3, 20: 1, 22: 1}
Did not match all atoms present	50824-04-9	C1=CC(=C(C=C1Br)C(F)(F)F)O	{16: 3, 18: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	50824-05-0	C1=CC(=CC=C1CBr)OC(F)(F)F	{2: 1, 4: 1, 14: 4, 16: 3, 18: 1, 22: 1}
Did not match all atoms present	50825-29-1	C1CCC(CC1)C(=O)[O-].C1CCC(CC1)C(=O)[O-].[Pb+2]	{24: 2, 11: 10, 12: 2}
Did not match all atoms present	50838-24-9	C1CC=CN(C1)C(=O)C2=CC=CC=C2	{24: 1, 33: 1, 11: 3, 14: 7}
Did not match all atoms present	50838-36-3	CC1=CC(=CC=C1)N(C)C(=S)OC2=CC3=C(C=C2)C4CCC3C4	{1: 2, 33: 1, 7: 1, 11: 3, 12: 2, 14: 7, 22: 1}
Did not match all atoms present	5084-12-8	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)SC4=NN=NN4C5=CC=CC=C5)O)C(C)(C)CC	{1: 6, 2: 6, 35: 3, 4: 2, 33: 1, 40: 1, 14: 13, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	50840-23-8	CC1=CN=C(N=C1)N	{1: 1, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	50843-73-7	CCC(C)(CC#N)C1=CC=CC=C1	{1: 2, 2: 2, 4: 1, 37: 1, 14: 5}
Did not match all atoms present	50846-45-2	CCOC(=O)OC(C)OC(=O)[C@H]1C(S[C@H]2N1C(=O)[C@H]2N=CN3CCCCCC3)(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 33: 2, 41: 1, 11: 6, 12: 3, 13: 1, 34: 1, 25: 1, 28: 1}
Did not match all atoms present	50847-11-5	CC(C)C1=NN2C=CC=CC2=C1C(=O)C(C)C	{1: 4, 3: 2, 33: 1, 14: 4, 35: 1, 24: 1}
Did not match all atoms present	50850-92-5	CSC1=CC2=C(C=C1)N=C(S2)N	{1: 1, 35: 1, 40: 1, 41: 1, 14: 3, 30: 1}
Did not match all atoms present	50856-85-4	CC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)C)N	{1: 2, 34: 1, 7: 1, 14: 8, 30: 1, 31: 1}
Did not match all atoms present	5086-74-8	C1CSC2=NC(CN21)C3=CC=CC=C3.Cl	{33: 1, 35: 1, 41: 1, 11: 3, 12: 1, 14: 5, 15: 1, 17: 1}
Did not match all atoms present	5086-79-3	C1=CC=C(C=C1)C2=NN=C(O2)C(C(C(C3=NN=C(O3)C4=CC=CC=C4)(F)F)(F)F)(F)F	{16: 6, 35: 4, 4: 3, 14: 10, 23: 2}
Did not match all atoms present	50863-05-3	C1CCC(CC1)SN(C2=CC=CC=C2)C(=O)C(=O)N(C3=CC=CC=C3)SC4CCCCC4	{33: 2, 40: 2, 11: 10, 12: 2, 14: 10, 24: 2}
Did not match all atoms present	50864-67-0	[S-2].[Ba+2]	{}
Did not match all atoms present	50868-72-9	CC1=C(C=C(C=C1)OC)N	{1: 2, 30: 1, 22: 1, 14: 3}
Did not match all atoms present	50868-73-0	CC1=C(C(=CC=C1)OC)N	{1: 2, 30: 1, 22: 1, 14: 3}
Did not match all atoms present	50869-79-9	CN(C1=CC=CC=C1)P(=O)(N(C)C2=CC=CC=C2)N(C)C3=CC=CC=C3	{1: 3, 29: 1, 14: 15, 33: 3}
Did not match all atoms present	50878-39-2	CSC(=S)NN(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 33: 1, 40: 1, 7: 1, 14: 10, 31: 1}
Did not match all atoms present	50878-65-4	CC(C)SC1=CC=CS1	{40: 1, 1: 2, 3: 1, 14: 3, 41: 1}
Did not match all atoms present	50878-84-7	C1=CC=C(C(=C1)C(=C[N+]#N)[O-])Cl	{17: 1, 34: 1, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	5088-46-0	C1CC2=CC=C(O2)CCC3=CC=C1O3	{11: 4, 14: 4, 23: 2}
Did not match all atoms present	50880-65-4	C1=CC(=CC=C1N/N=C\2/C3=C(C=C(C=C3)S(=O)(=O)[O-])C=C(C2=O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 14: 8, 15: 2, 25: 1, 29: 9, 31: 1}
Did not match all atoms present	50884-30-5	C1=CC(=C(C=C1Cl)Cl)[O-].[K+]	{17: 2, 14: 3}
Did not match all atoms present	50885-98-8	CCC(CO)(CO)CO.CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O	{1: 3, 2: 4, 4: 1, 8: 2, 11: 1, 12: 1, 34: 2, 14: 3, 20: 3, 23: 1, 29: 2}
Did not match all atoms present	50886-62-9	C1=CC=C\2C(=C1)C=CC(=O)/C2=C\NNC(=O)C3=CC=CC=C3N	{6: 1, 14: 10, 15: 1, 24: 1, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	50888-63-6	CCCCC1=NC=C(N=C1C)C	{1: 3, 2: 3, 35: 2, 14: 1}
Did not match all atoms present	5089-16-7	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)Cl)Cl)S(=O)(=O)[O-])C4=CC(=C(C=C4Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 1, 34: 2, 35: 4, 33: 1, 12: 1, 14: 5, 15: 1, 17: 4, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	5089-25-8	C[Si](C)(CCC1CCC=CC1)Cl	{1: 2, 2: 2, 11: 3, 12: 1, 14: 2, 17: 1}
Did not match all atoms present	5089-32-7	C[Si](C)(C)[SiH2][Si](C)(C)C	{1: 6}
Did not match all atoms present	5089-33-8	C[Si](C)(C)N(C1=CC=C(C=C1)Br)[Si](C)(C)C	{1: 6, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	5089-70-3	CCO[Si](CCCCl)(OCC)OCC	{1: 3, 2: 6, 22: 3, 17: 1}
Did not match all atoms present	50892-23-4	CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SCC(=O)O)Cl)C	{1: 2, 2: 1, 35: 2, 40: 1, 14: 4, 17: 1, 27: 1, 31: 1}
Did not match all atoms present	50892-90-5	C1=C(C=C2C(=C1[N+](=O)[O-])N(N=N2)C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 35: 2, 38: 5, 14: 4}
Did not match all atoms present	50893-36-2	CCOC(=O)OC(C)Cl	{1: 2, 2: 1, 3: 1, 17: 1}
Did not match all atoms present	509-09-1	C(=O)(C(C(F)(F)F)(F)F)[O-].[Ag+]	{16: 5, 24: 1, 4: 2}
Did not match all atoms present	509-15-9	CN1CC2(C3CC4C5(C2C1C3CO4)C6=CC=CC=C6NC5=O)C=C	{32: 1, 1: 1, 5: 1, 6: 1, 33: 1, 11: 3, 12: 5, 13: 2, 14: 4, 23: 1, 25: 1}
Did not match all atoms present	509-56-8	C[C@@]1(CC[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3C)O	{1: 2, 33: 1, 11: 5, 12: 3, 13: 2, 14: 2, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	509-60-4	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](CC4)O	{1: 1, 33: 1, 11: 5, 12: 4, 13: 1, 14: 2, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	509-64-8	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@@H](C=C4)O	{1: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	509-67-1	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OCCN6CCOCC6)O[C@H]3[C@H](C=C4)O	{1: 1, 2: 2, 33: 2, 11: 7, 12: 4, 13: 1, 14: 4, 20: 1, 22: 1, 23: 2}
Did not match all atoms present	509-77-3	C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)N)C4=CC=C(C=C4)N	{30: 2, 28: 1, 13: 1, 14: 12}
Did not match all atoms present	5090-37-9	CC1=C(C2=CC=CC=C2S1)CC3=NCCN3.Cl	{32: 1, 1: 1, 2: 1, 35: 1, 41: 1, 11: 2, 14: 4, 15: 1, 17: 1}
Did not match all atoms present	50901-84-3	C[C@@H]1[C@@H](CC(=N1)N)C2=CC=CC=C2	{1: 1, 35: 1, 11: 1, 12: 2, 14: 5, 15: 1, 30: 1}
Did not match all atoms present	50901-87-6	C[C@@H]1[C@H](CC(=N1)N)C2=CC=CC=C2	{1: 1, 35: 1, 11: 1, 12: 2, 14: 5, 15: 1, 30: 1}
Did not match all atoms present	50908-62-8	C1CC1NC(=O)C2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)O	{33: 1, 35: 3, 11: 2, 12: 5, 14: 2, 20: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	50910-55-9	C1=C(C=C(C(=C1Br)N)C=O)Br	{18: 2, 30: 1, 26: 1, 14: 2}
Did not match all atoms present	50916-04-6	CC1=NCCN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC	{1: 4, 35: 1, 33: 1, 11: 2, 14: 2, 15: 1, 22: 3, 24: 1}
Did not match all atoms present	50916-11-5	CCOC1=CC(=CC(=C1OCC)OCC)C(=O)C2CCON2	{32: 1, 1: 3, 2: 3, 11: 2, 12: 1, 14: 2, 22: 3, 23: 1, 24: 1}
Did not match all atoms present	50916-12-6	CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCOC2	{1: 3, 2: 3, 33: 1, 11: 3, 14: 2, 22: 3, 23: 1, 24: 1}
Did not match all atoms present	50917-29-8	C1=CC(=C(C(=C1N)Cl)C(=O)O)Cl	{17: 2, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	50919-06-7	C1=CC=C(C(=C1)CCO)F	{16: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	50921-39-6	C1CC(C1)(C2=CC=C(C=C2)Cl)C(=O)O	{27: 1, 17: 1, 11: 3, 13: 1, 14: 4}
Did not match all atoms present	50924-49-7	C1=NC(=C(N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)N	{33: 1, 2: 1, 35: 1, 12: 4, 14: 1, 20: 3, 21: 1, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	50927-81-6	[Si]=S	{}
Did not match all atoms present	50930-41-1	CCOC(=O)C1=CC(=CC=C1)N.Cl	{1: 1, 2: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	50930-79-5	C1=CC=C(C=C1)N.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{27: 2, 30: 1, 14: 9}
Did not match all atoms present	50935-04-1	C[C@H]1[C@H]([C@H](CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5O)O)(C(=O)C)O)N)O	{1: 2, 11: 3, 12: 5, 13: 1, 14: 3, 20: 2, 21: 3, 22: 1, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	50957-96-5	CCCCCCCCCCCCOP(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 2: 11, 29: 3, 22: 1}
Did not match all atoms present	5096-17-3	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)Cl	{1: 1, 11: 1, 14: 6, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	5096-18-4	CC1=CC2=CC=CC=C2C=C1[NH3+].[Cl-]	{1: 1, 14: 6, 17: 1}
Did not match all atoms present	5096-19-5	CC(=O)NC1=CC2=C(C=C1)OC(=O)C3=CC=CC=C32	{24: 1, 1: 1, 28: 1, 14: 7, 31: 1}
Did not match all atoms present	5096-21-9	CC1=CC(=C(C(=C1)C)NC(=O)C)C	{24: 1, 1: 4, 14: 2, 31: 1}
Did not match all atoms present	5096-24-2	CCC1CCC2=C1C=CC3=C(C4=CC=CC=C4C=C23)C	{1: 2, 2: 1, 11: 2, 12: 1, 14: 7}
Did not match all atoms present	5096-57-1	COC1=C(C2=C(C[C@H]3C4=CC5=C(C=C4CCN3C2)OCO5)C=C1)OC	{1: 2, 33: 1, 11: 5, 12: 1, 14: 4, 22: 2, 23: 2}
Did not match all atoms present	50960-09-3	CCCCOC(=O)C=C.CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].C=CC1=CC=CC=C1.[Zn+2]	{1: 3, 2: 3, 5: 4, 6: 2, 7: 2, 14: 5, 24: 2, 28: 1}
Did not match all atoms present	50960-82-2	[C-](=O)Cl.[Au+]	{17: 1, 29: 1}
Did not match all atoms present	50963-62-7	CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)N=NC3=C(C=C(C=C3C#N)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C	{1: 2, 2: 2, 37: 1, 38: 2, 33: 1, 34: 2, 14: 10, 24: 1, 31: 1}
Did not match all atoms present	50972-17-3	CCOC(=O)OC(C)OC(=O)[C@H]1C(S[C@H]2N1C(=O)[C@H]2NC(=O)[C@@H](C3=CC=CC=C3)N)(C)C	{1: 4, 2: 1, 3: 2, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 24: 1, 25: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	50974-47-5	CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOC(=O)C=C	{1: 1, 2: 16, 5: 1, 6: 1, 14: 4, 22: 4, 28: 1}
Did not match all atoms present	50975-64-9	C1=CC=C(C(=C1)C(=O)Cl)OC2=CC=CC=C2C(=O)Cl	{24: 2, 17: 2, 22: 1, 14: 8}
Did not match all atoms present	50976-35-7	C1=CC2=C(C=C(C=C2C=C1N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 29: 6, 14: 5}
Did not match all atoms present	50977-11-2	CC(C)CCCCCCCCCCOP(=O)(O)O	{1: 2, 2: 10, 3: 1, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	50977-65-6	[Li+].[Li+].C(=C\C(=O)[O-])\C(=O)[O-]	{24: 2, 6: 2}
Did not match all atoms present	50979-18-5	C(=N)(N)N.NS(=O)(=O)O	{36: 1, 20: 1, 29: 2, 30: 3, 7: 1}
Did not match all atoms present	50981-28-7	C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 10, 8: 2, 34: 2, 14: 16, 20: 2, 27: 2, 29: 2, 30: 2}
Did not match all atoms present	50982-13-3	C1/C=C\CC/C=C\C1.Cl[Ru]Cl	{17: 2, 11: 4, 14: 4}
Did not match all atoms present	50987-86-5	COC(=O)C1=CC=C(C=C1)C(=O)OC.C(CCCO)CCO.C(CCO)CO	{1: 2, 2: 10, 20: 4, 14: 4, 28: 2}
Did not match all atoms present	50988-02-8	CCC(=O)NC1=CC=CC2=C1C(=O)C3=C4C2=NSC4=CC=C3	{1: 1, 2: 1, 35: 1, 41: 1, 14: 6, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	5099-06-9	C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2O)[N+](=O)[O-])Cl	{38: 1, 14: 7, 17: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	5099-13-8	C1=CC=C(C=C1)C(=O)NC2=C(C=C(C(=C2)Cl)N)O	{14: 7, 17: 1, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	50993-51-6	COC(=O)C1=C(N=CN1)N=[N+]=[N-]	{32: 1, 1: 1, 34: 2, 35: 1, 14: 1, 28: 1}
Did not match all atoms present	50995-95-4	CCCC1=NC=CN1	{32: 1, 1: 1, 2: 2, 35: 1, 14: 2}
Did not match all atoms present	51-02-5	CC(C)NCC(C1=CC2=CC=CC=C2C=C1)O.Cl	{1: 2, 2: 1, 3: 2, 14: 7, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	51-03-6	CCCCOCCOCCOCC1=CC2=C(C=C1CCC)OCO2	{1: 2, 2: 10, 11: 1, 14: 2, 22: 3, 23: 2}
Did not match all atoms present	51-05-8	CCN(CC)CCOC(=O)C1=CC=C(C=C1)N.Cl	{1: 2, 2: 4, 33: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	51-06-9	CCN(CC)CCNC(=O)C1=CC=C(C=C1)N	{1: 2, 2: 4, 33: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	51-12-7	C1=CC=C(C=C1)CNC(=O)CCNNC(=O)C2=CC=NC=C2	{24: 2, 2: 3, 35: 1, 14: 9, 31: 3}
Did not match all atoms present	51-14-9	CCOCCOCCOC(C)OC1=CC2=C(C=C1)OCO2	{1: 2, 2: 5, 3: 1, 11: 1, 14: 3, 22: 4, 23: 2}
Did not match all atoms present	51-17-2	C1=CC=C2C(=C1)NC=N2	{32: 1, 35: 1, 14: 5}
Did not match all atoms present	51-18-3	C1CN1C2=NC(=NC(=N2)N3CC3)N4CC4	{33: 3, 11: 6, 35: 3}
Did not match all atoms present	51-19-4	C1=CC=C(C(=C1)N)O.Cl	{17: 1, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	51-20-7	C1=C(C(=O)NC(=O)N1)Br	{32: 2, 25: 2, 18: 1, 14: 1}
Did not match all atoms present	51-21-8	C1=C(C(=O)NC(=O)N1)F	{16: 1, 25: 2, 14: 1, 32: 2}
Did not match all atoms present	51-26-3	C1=CC(=C(C=C1OC2=C(C=C(C=C2I)CCC(=O)O)I)I)O	{2: 2, 14: 5, 19: 3, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	51-28-5	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O	{38: 2, 21: 1, 14: 3}
Did not match all atoms present	51-30-9	CC(C)NCC(C1=CC(=C(C=C1)O)O)O.Cl	{1: 2, 2: 1, 3: 2, 14: 3, 17: 1, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	51-34-3	CN1C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4	{1: 1, 2: 1, 3: 1, 33: 1, 11: 2, 12: 5, 14: 5, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	51-36-5	C1=C(C=C(C=C1Cl)Cl)C(=O)O	{17: 2, 27: 1, 14: 3}
Did not match all atoms present	51-40-1	C1=CC(=C(C=C1C(CN)O)O)O.C(C(C(=O)O)O)(C(=O)O)O	{2: 1, 3: 3, 14: 3, 20: 3, 21: 2, 27: 2, 30: 1}
Did not match all atoms present	51-41-2	C1=CC(=C(C=C1[C@H](CN)O)O)O	{2: 1, 3: 1, 14: 3, 20: 1, 21: 2, 30: 1}
Did not match all atoms present	51-42-3	CNC[C@@H](C1=CC(=C(C=C1)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 1, 2: 1, 3: 3, 14: 3, 20: 3, 21: 2, 27: 2, 31: 1}
Did not match all atoms present	51-43-4	CNC[C@@H](C1=CC(=C(C=C1)O)O)O	{1: 1, 2: 1, 3: 1, 14: 3, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	51-44-5	C1=CC(=C(C=C1C(=O)O)Cl)Cl	{17: 2, 27: 1, 14: 3}
Did not match all atoms present	51-45-6	C1=C(NC=N1)CCN	{32: 1, 2: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	51-48-9	C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)C[C@@H](C(=O)O)N	{2: 1, 3: 1, 14: 4, 19: 4, 21: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	51-49-0	C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)C[C@H](C(=O)O)N	{2: 1, 3: 1, 14: 4, 19: 4, 21: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	51-50-3	C1=CC=C(C=C1)CN(CCCl)CC2=CC=CC=C2	{17: 1, 2: 4, 14: 10, 33: 1}
Did not match all atoms present	51-52-5	CCCC1=CC(=O)NC(=S)N1	{32: 2, 1: 1, 2: 2, 14: 1, 25: 1}
Did not match all atoms present	51-55-8	CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	51-56-9	CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O	{1: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	51-57-0	C[C@@H](CC1=CC=CC=C1)NC.Cl	{1: 2, 2: 1, 3: 1, 14: 5, 17: 1, 31: 1}
Did not match all atoms present	51-58-1	C1=CC(=CC=C1NC(=O)N=C(N)N)[N+](=O)[O-].Cl	{34: 1, 38: 1, 7: 1, 14: 4, 17: 1, 24: 1, 30: 2, 31: 1}
Did not match all atoms present	51-59-2	CC(=O)NC1=CC(=C(C=C1)O)C(=O)O	{1: 1, 14: 3, 21: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	51-60-5	CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 6, 33: 1, 14: 4, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	51-61-6	C1=CC(=C(C=C1CCN)O)O	{2: 2, 30: 1, 21: 2, 14: 3}
Did not match all atoms present	51-64-9	C[C@@H](CC1=CC=CC=C1)N	{1: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	51-65-0	C1=CC(=CC=C1CC(C(=O)O)N)F	{2: 1, 3: 1, 14: 4, 16: 1, 27: 1, 30: 1}
Did not match all atoms present	51-66-1	CC(=O)NC1=CC=C(C=C1)OC	{24: 1, 1: 2, 22: 1, 14: 4, 31: 1}
Did not match all atoms present	51-67-2	C1=CC(=CC=C1CCN)O	{2: 2, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	51-68-3	CN(C)CCOC(=O)COC1=CC=C(C=C1)Cl	{1: 2, 2: 3, 33: 1, 14: 4, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	51-71-8	C1=CC=C(C=C1)CCNN	{2: 2, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	51-78-5	C1=CC(=CC=C1N)O.Cl	{17: 1, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	51-82-1	CN(C)CSC(=S)N(C)C	{40: 1, 1: 4, 2: 1, 33: 2, 7: 1}
Did not match all atoms present	51-83-2	C[N+](C)(C)CCOC(=O)N.[Cl-]	{1: 3, 2: 2, 28: 1, 30: 1, 17: 1}
Did not match all atoms present	51-84-3	CC(=O)OCC[N+](C)(C)C	{1: 4, 2: 2, 28: 1}
Did not match all atoms present	51-92-3	C[N+](C)(C)C	{1: 4}
Did not match all atoms present	51-93-4	CC[N+](C)(C)C.[I-]	{1: 4, 2: 1, 19: 1}
Did not match all atoms present	510-13-4	CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)N(C)C)O	{1: 4, 4: 1, 33: 2, 14: 13, 20: 1}
Did not match all atoms present	510-15-6	CCOC(=O)C(C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)O	{1: 1, 2: 1, 4: 1, 14: 8, 17: 2, 20: 1, 28: 1}
Did not match all atoms present	510-90-7	CC(C)CC1(C(=O)NC(=NC1=O)[S-])CC=C.[Na+]	{32: 1, 1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	5100-91-4	C1=CC=C2C(=C1)C3=C(C4=C(N3)C5=C(C=C4)C=NC=C5)OC2=O	{32: 1, 35: 1, 28: 1, 14: 9}
Did not match all atoms present	5100-98-1	CC1=C(C(=CC=C1)Cl)I	{1: 1, 19: 1, 14: 3, 17: 1}
Did not match all atoms present	51003-81-7	CCCC1=CC2=CC3=C(C=C2C1N(C)C)OCO3.Cl	{1: 3, 2: 2, 33: 1, 11: 1, 12: 1, 14: 3, 15: 1, 17: 1, 23: 2}
Did not match all atoms present	51003-83-9	CCCCC1=CC2=CC3=C(C=C2C1N(C)C)OCO3.Cl	{1: 3, 2: 3, 33: 1, 11: 1, 12: 1, 14: 3, 15: 1, 17: 1, 23: 2}
Did not match all atoms present	51006-57-6	C1CO[Si]2(OCCN1CCO2)CCCCl	{17: 1, 2: 3, 11: 6, 33: 1, 23: 3}
Did not match all atoms present	5101-27-9	C1=CC=C(C=C1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2	{14: 14}
Did not match all atoms present	5101-44-0	C#CC1=CC=CC=C1O	{9: 1, 10: 1, 21: 1, 14: 4}
Did not match all atoms present	51012-32-9	CCN(CC)CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)C)OC	{1: 4, 2: 4, 33: 1, 14: 3, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	51012-33-0	CCN(CC)CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)C)OC.Cl	{1: 4, 2: 4, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	51018-94-1	CCOC(=O)C1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)C(=O)O)C(=O)OCC)C(=O)O	{1: 2, 2: 2, 14: 6, 24: 1, 27: 2, 28: 2}
Did not match all atoms present	5102-79-4	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)C3/C(=N/N)/C4=CC=CC=C4C3=O	{34: 1, 3: 1, 12: 1, 14: 14, 15: 1, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	5102-83-0	CC1=CC(=C(C=C1)NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)C)C)Cl)Cl)C	{1: 6, 34: 4, 3: 2, 14: 12, 17: 2, 24: 4, 31: 2}
Did not match all atoms present	51022-74-3	C1=C(C(=C(C(=C1I)NC(=O)COCCOCCOCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I	{2: 6, 14: 2, 19: 6, 22: 3, 24: 2, 27: 2, 31: 2}
Did not match all atoms present	51023-76-8	CC(=O)NC1=CC(=C(C=C1)C=CC2=C(C=C(C=C2)N=C=S)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 6: 2, 8: 1, 14: 6, 24: 1, 29: 6, 31: 1}
Did not match all atoms present	51026-47-2	CC1=C(C=CC(=C1)N(CCC#N)CCOC(=O)C)N/N=C\2/C=CC(=CC2=O)[N+](=O)[O-]	{1: 2, 2: 4, 37: 1, 38: 1, 33: 1, 34: 1, 14: 6, 15: 2, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	51029-30-2	C1C2=C(C=C(C=C2)NO)C3=CC=CC=C31	{11: 1, 20: 1, 14: 7, 31: 1}
Did not match all atoms present	5103-42-4	C1=CC=C2C(=C1)C(=O)C(C2=O)(C3(C(=O)C4=CC=CC=C4C3=O)O)O	{25: 4, 20: 2, 13: 2, 14: 8}
Did not match all atoms present	51030-47-8	CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].[Nb+5]	{1: 5, 2: 15, 29: 5}
Did not match all atoms present	51034-39-0	C(CS(=O)(=O)[O-])CCl.[Na+]	{17: 1, 2: 3, 29: 3}
Did not match all atoms present	51039-84-0	C1=CC=C(C(=C1)NC(=S)N)[N+](=O)[O-]	{38: 1, 31: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	5104-49-4	CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O	{16: 1, 1: 1, 3: 1, 14: 8, 27: 1}
Did not match all atoms present	51041-36-2	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Na+].[Fe+2].[Fe+3]	{}
Did not match all atoms present	51044-13-4	C1=CC=C(C=C1)[P+](CC2=CC=C(C=C2)Br)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{2: 1, 18: 2, 14: 19}
Did not match all atoms present	51052-00-7	CC1=CC=CC=C1CC(=O)C	{24: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	51052-72-3	CC(C)C12COP(=O)(OC1)OC2	{1: 2, 3: 1, 11: 3, 13: 1, 23: 3, 29: 1}
Did not match all atoms present	51053-69-1	C1CC2=CC=C(N2)CCC3=CC=C1C=C3	{32: 1, 11: 4, 14: 6}
Did not match all atoms present	51053-89-5	CC1=CC=C(C=C1)SC2(C3=CC=CC=C3OC2=O)OC	{1: 2, 40: 1, 13: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	5106-98-9	C1=CC(=C(C=C1Cl)O)C(=O)O	{17: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	51060-05-0	C#[N+][O-]	{34: 1, 29: 1}
Did not match all atoms present	51064-65-4	CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@H](OC(O2)(C)C)COS(=O)(=O)C3=CC=C(C=C3)C	{1: 4, 2: 2, 12: 2, 13: 1, 14: 8, 22: 2, 23: 2, 29: 4}
Did not match all atoms present	51066-54-7	C1=CC=C(C=C1)C(=S)[O-].[Na+]	{14: 5, 7: 1}
Did not match all atoms present	51067-38-0	B(C1=CC=C(C=C1)OC2=CC=CC=C2)(O)O	{20: 2, 22: 1, 14: 9}
Did not match all atoms present	51069-11-5	C1CN2CCC1(CC2)C3=CC=CC=C3	{33: 1, 11: 6, 13: 1, 14: 5}
Did not match all atoms present	5107-01-7	CCN(CC)CCNC(=O)C1=C(C=C(C=C1)Cl)OCC=C.Cl	{1: 2, 2: 5, 5: 1, 6: 1, 33: 1, 14: 3, 17: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5107-18-6	C1=CC=C(C=C1)C(=O)NCCCCC(C(=O)O)N	{2: 4, 3: 1, 14: 5, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	51072-66-3	COC1=C(C=C(C(=C1)[N+](=O)[O-])Br)OC	{1: 2, 18: 1, 38: 1, 22: 2, 14: 2}
Did not match all atoms present	51076-46-1	C1=CN=CC=C1C(C=O)C=O	{35: 1, 26: 2, 3: 1, 14: 4}
Did not match all atoms present	51082-78-1	CC[N+]1=C(SC2=CC3=CC=CC=C3C=C21)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 33: 1, 41: 1, 14: 10, 29: 3}
Did not match all atoms present	51084-32-3	COC(=O)C1=CC=C(C=C1)C(=O)[O-].COC(=O)C1=CC=C(C=C1)C(=O)[O-].[Co+2]	{24: 2, 1: 2, 28: 2, 14: 8}
Did not match all atoms present	51085-07-5	C1C2=C(CC3=C1NC4=C(C3=O)C=C(C=C4)Cl)NC5=C(C2=O)C=C(C=C5)Cl	{32: 2, 17: 2, 11: 2, 14: 6, 25: 2}
Did not match all atoms present	51085-52-0	CC1=C(C=C(C=C1)[N+](=O)[O-])N.Cl	{1: 1, 38: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	5109-95-5	CCN1C2=CC=CC=C2C(CC1(C)C)C	{1: 4, 2: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 4}
Did not match all atoms present	51094-78-1	CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].[Ta+5]	{1: 5, 2: 15, 29: 5}
Did not match all atoms present	511-09-1	CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O	{32: 1, 1: 5, 2: 1, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	511-10-4	CC(C)C[C@@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O	{32: 1, 1: 5, 2: 1, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	511-12-6	C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@@H]5C[C@H]6[C@@H](CC7=CNC8=CC=CC6=C78)N(C5)C	{32: 1, 1: 2, 2: 1, 33: 3, 11: 6, 12: 5, 13: 2, 14: 9, 20: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	511-13-7	CN(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2Cl)O.Cl	{1: 2, 2: 2, 4: 1, 33: 1, 14: 9, 17: 2, 20: 1}
Did not match all atoms present	511-15-9	CC(C)C1=C(C=CC2=C1CC[C@@H]3[C@@]2(CCCC3(C)C)C)O	{1: 5, 3: 1, 11: 5, 12: 1, 13: 2, 14: 2, 21: 1}
Did not match all atoms present	511-46-6	CCN(CC)CCOC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)Cl	{1: 3, 2: 4, 4: 1, 33: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	511-55-7	C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5.[Br-]	{1: 1, 2: 2, 3: 1, 11: 4, 12: 3, 14: 14, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	5110-69-0	C[N+](C)(C)CCI.[I-]	{1: 3, 2: 2, 19: 2}
Did not match all atoms present	51105-19-2	C1COCOC1.O	{11: 4, 23: 2}
Did not match all atoms present	5111-65-9	COC1=CC2=C(C=C1)C=C(C=C2)Br	{1: 1, 18: 1, 22: 1, 14: 6}
Did not match all atoms present	5111-69-3	COC1=CC2=C(CCC2)C=C1	{1: 1, 11: 3, 22: 1, 14: 3}
Did not match all atoms present	5111-70-6	COC1=CC2=C(C=C1)C(=O)CC2	{1: 1, 11: 2, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	51110-01-1	CC(C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)CC5=CC=CC=C5)CC(=O)N)CCCCN)NC(=O)CNC(=O)C(C)N)C(=O)O)CO)C(C)O)CC6=CC=CC=C6)O	{32: 12, 1: 3, 2: 15, 3: 3, 41: 2, 11: 2, 12: 12, 14: 20, 20: 3, 24: 3, 25: 11, 27: 1, 30: 4, 31: 2}
Did not match all atoms present	51112-72-2	CC(C)[Te]C(C)C	{1: 4, 3: 2}
Did not match all atoms present	51114-12-6	C1=CC(=CC=C1C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(C(F)(F)F)F	{16: 14, 4: 6, 14: 4}
Did not match all atoms present	51114-68-2	COC1=C(C=CC=C1Cl)N	{1: 1, 30: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	51115-63-0	CCC(C)COC(=O)C1=CC=CC=C1O	{1: 2, 2: 2, 3: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	51118-04-8	CC1=C(C=C(C=C1N=[N+](C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 34: 1, 38: 4, 33: 1, 14: 4, 29: 1}
Did not match all atoms present	5112-21-0	C1=CC=C(C(=C1)OCC(CO)O)Cl	{2: 2, 3: 1, 14: 4, 17: 1, 20: 2, 22: 1}
Did not match all atoms present	5112-95-8	C1=CC=C(C=C1)P(C#CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{10: 2, 14: 20}
Did not match all atoms present	51120-01-5	CCCCC(CC)CNC(=O)C1=CC=C(C=C1)N	{1: 2, 2: 5, 3: 1, 14: 4, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	51123-09-2	CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)N)C	{1: 2, 2: 1, 33: 1, 14: 8, 29: 2, 30: 1}
Did not match all atoms present	51126-65-9	C1=CC=C2C(=C1)[N-]N=N2.[K+]	{35: 3, 14: 4}
Did not match all atoms present	51127-21-0	C[C@@]1(COCOC1=O)NC(=O)C2=CC=CC=C2	{1: 1, 11: 2, 13: 1, 14: 5, 23: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	51127-25-4	CC(C)[C@@]1(COCOC1=O)NC(=O)C2=CC=CC=C2	{1: 2, 3: 1, 11: 2, 13: 1, 14: 5, 23: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	51127-26-5	CC(C)CC1(COCOC1=O)NC(=O)C2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 11: 2, 13: 1, 14: 5, 23: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	51127-28-7	C1[C@@](C(=O)OCO1)(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3	{2: 1, 11: 2, 13: 1, 14: 10, 23: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	51128-83-7	C1=CC(=CC=C1N=C=NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{8: 1, 34: 2, 38: 2, 14: 8}
Did not match all atoms present	51131-85-2	CC1=C2C(=C(C3=C1C=CN=C3)C)C4=C(N2)C=CC(=C4)O	{32: 1, 1: 2, 35: 1, 21: 1, 14: 6}
Did not match all atoms present	51131-92-1	C=O.C1(=NC(=NC(=N1)N)N)N.C(=N)(N)N.Cl	{35: 3, 36: 1, 5: 1, 7: 1, 17: 1, 30: 5}
Did not match all atoms present	51135-96-7	C1CNCCC1(CC2=CC=CC=C2)O	{32: 1, 2: 1, 11: 4, 13: 1, 14: 5, 20: 1}
Did not match all atoms present	51137-36-1	C=CO.C=O.C1=CC=C(C=C1)O	{14: 5, 20: 1, 5: 2, 6: 1, 21: 1}
Did not match all atoms present	51137-37-2	CC(=O)OC=C.C=C.C=CC(=O)[O-].[Na+]	{24: 1, 1: 1, 28: 1, 5: 4, 6: 2}
Did not match all atoms present	51137-43-0	CC1=CC(=CC(=C1O)C)C(C)(C)C2=CC(=C(C(=C2)C)O)C.C(=O)(Cl)Cl	{1: 6, 4: 1, 14: 4, 17: 2, 21: 2, 24: 1}
Did not match all atoms present	51138-06-8	CN1C(=NN=N1)[S-].[Na+]	{1: 1, 35: 3, 33: 1}
Did not match all atoms present	51138-16-0	C1=CC=C(C(=C1)NCCN)[N+](=O)[O-]	{2: 2, 38: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	51138-28-4	C1CO[Sb](O1)OCCO[Sb]2OCCO2	{2: 2, 11: 4, 22: 2, 23: 4}
Did not match all atoms present	51142-87-1	[O-2].[Na+].[Ti+4]	{}
Did not match all atoms present	51143-35-2	C1=CC=C(C=C1)N=CCC=CC=NC2=CC=CC=C2.Cl	{17: 1, 2: 1, 34: 2, 14: 10, 6: 4}
Did not match all atoms present	51143-41-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)[N+]#N.OS(=O)(=O)[O-]	{25: 2, 34: 1, 20: 1, 29: 3, 14: 7}
Did not match all atoms present	51146-56-6	C[C@@H](C1=CC=C(C=C1)CC(C)C)C(=O)O	{27: 1, 1: 3, 2: 1, 3: 2, 14: 4}
Did not match all atoms present	5115-25-3	C1C2(COC(O1)C3=CC=CO3)COC(OC2)C4=CC=CO4	{11: 4, 12: 2, 13: 1, 14: 6, 23: 6}
Did not match all atoms present	51155-15-8	CC1=CC(=CC(=C1O)C)[C@@H]([C@@H](C)CO)OC.Cl	{1: 4, 2: 1, 3: 2, 14: 2, 17: 1, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	5116-24-5	C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)CO)CO)O	{32: 1, 33: 1, 2: 2, 11: 1, 12: 3, 14: 1, 20: 3, 23: 1, 25: 2}
Did not match all atoms present	5116-94-9	CCCCCCCCCCCCCOP(=O)(O)O	{1: 1, 2: 12, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	51162-51-7	CCOP(=S)(OC(C)C)Cl	{1: 3, 2: 1, 3: 1, 22: 2, 17: 1}
Did not match all atoms present	51163-27-0	CC1=C(C=C(C=C1)N=C=O)C	{8: 1, 1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	51163-29-2	CC1=CC(=C(C=C1)N=C=O)C	{8: 1, 1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	51169-05-2	C1=CC=NC(=C1)NN.Cl	{17: 1, 35: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	51169-17-6	CC1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC=CC=C3	{32: 2, 1: 1, 13: 1, 14: 9, 25: 2}
Did not match all atoms present	5117-07-7	C1=CC=C(C=C1)N2C(=NN=N2)SSC3=NN=NN3C4=CC=CC=C4	{40: 2, 33: 2, 35: 6, 14: 10}
Did not match all atoms present	5117-16-8	CN(C)C(=N)[Se]	{1: 2, 36: 1, 33: 1, 7: 1}
Did not match all atoms present	5117-17-9	CCN(CC)C(=N)[Se]	{1: 2, 2: 2, 36: 1, 33: 1, 7: 1}
Did not match all atoms present	51176-12-6	C.[Hg]	{}
Did not match all atoms present	51177-04-9	[C-].[Co+]	{}
Did not match all atoms present	5118-29-6	CC1(C2=CC=CC=C2C(=CCCN(C)C)C3=CC=CC=C31)C	{1: 4, 2: 2, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1}
Did not match all atoms present	51184-13-5	N[Si](N([Al])[Si])O	{33: 1, 20: 1, 30: 1}
Did not match all atoms present	51184-77-1	[Ar].[Kr]	{}
Did not match all atoms present	51192-04-2	C[Sn](C)C.[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[TaH2]	{1: 3, 14: 10}
Did not match all atoms present	51198-56-2	[Eu].[Au].[Au]	{}
Did not match all atoms present	51199-85-0	N#[Ge]O[Ge]#N	{22: 1}
Did not match all atoms present	512-15-2	CN(C)CCOC(=O)C(C1=CC=CC=C1)C2(CCCC2)O	{1: 2, 2: 2, 3: 1, 33: 1, 11: 4, 13: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	512-25-4	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ba+2].[Ba+2].[Ba+2]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	512-26-5	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Pb+2].[Pb+2].[Pb+2]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	512-42-5	COS(=O)(=O)[O-].[Na+]	{1: 1, 29: 3, 22: 1}
Did not match all atoms present	512-56-1	COP(=O)(OC)OC	{1: 3, 29: 1, 22: 3}
Did not match all atoms present	512-63-0	C1=CC=C(C=C1)[Si]2(O[Si](O[Si](O2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7	{14: 30, 23: 3}
Did not match all atoms present	512-64-1	CC1C(=O)N(C2CSC(C(C(=O)N(C(C(=O)OCC(C(=O)N1)NC(=O)C3=NC4=CC=CC=C4N=C3)C(C)C)C)N(C(=O)C(NC(=O)C(COC(=O)C(N(C2=O)C)C(C)C)NC(=O)C5=NC6=CC=CC=C6N=C5)C)C)SC)C	{32: 2, 1: 11, 3: 2, 33: 4, 40: 1, 41: 1, 11: 3, 12: 9, 14: 10, 35: 4, 24: 2, 25: 6, 28: 2, 31: 2}
Did not match all atoms present	51201-34-4	CC1=C(C=CC=C1N=C=O)N=C=O.C(COCCO)O.C(C(CO)O)O	{1: 1, 2: 6, 3: 1, 8: 2, 34: 2, 14: 3, 20: 5, 22: 1, 29: 2}
Did not match all atoms present	51202-86-9	COC1=CC=C(C=C1)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)C4=NC(=CC5=CC=C(C=C5)OC)C(=O)O4	{1: 2, 35: 2, 6: 2, 14: 12, 15: 4, 22: 2, 28: 2}
Did not match all atoms present	51206-97-4	CC(=O)NC.[Na+]	{24: 1, 1: 2, 31: 1}
Did not match all atoms present	51207-31-9	C1=C2C3=CC(=C(C=C3OC2=CC(=C1Cl)Cl)Cl)Cl	{17: 4, 14: 4, 23: 1}
Did not match all atoms present	5121-88-0	C1=C(C(=C(C(=C1F)F)C2=C(C(=C(C(=C2F)F)F)F)F)F)F	{16: 9, 14: 1}
Did not match all atoms present	51218-45-2	CCC1=CC=CC(=C1N(C(C)COC)C(=O)CCl)C	{1: 4, 2: 3, 3: 1, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	51218-49-6	CCCOCCN(C1=C(C=CC=C1CC)CC)C(=O)CCl	{1: 3, 2: 7, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	51219-00-2	CCC1=CC=CC(=C1NC(C)COC)C	{1: 4, 2: 2, 3: 1, 14: 3, 22: 1, 31: 1}
Did not match all atoms present	5122-95-2	B(C1=CC(=CC=C1)C2=CC=CC=C2)(O)O	{20: 2, 14: 9}
Did not match all atoms present	5122-99-6	B(C1=CC=C(C=C1)I)(O)O	{19: 1, 20: 2, 14: 4}
Did not match all atoms present	51220-35-0	C[Ge](C)(C)CC1=CC=CC2=CC=CC=C21	{1: 3, 2: 1, 14: 7}
Did not match all atoms present	51220-36-1	C[Sn](C)(C)CC1=CC=CC2=CC=CC=C21	{1: 3, 2: 1, 14: 7}
Did not match all atoms present	51222-17-4	C=CC(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].[Cr+3]	{24: 3, 5: 3, 6: 3}
Did not match all atoms present	51222-60-7	B([O-])([O-])[O-].B([O-])([O-])[O-].[Cd+2].[Cd+2].[Cd+2]	{29: 6}
Did not match all atoms present	51225-20-8	CCOC1=CC(=C(C(=C1)Cl)N)Cl	{1: 1, 2: 1, 14: 2, 17: 2, 22: 1, 30: 1}
Did not match all atoms present	51228-92-3	CC1=CC(=CC=C1)N(CCC#N)CCOC(=O)C	{1: 2, 2: 4, 37: 1, 33: 1, 14: 4, 28: 1}
Did not match all atoms present	51231-85-7	COC(=O)C=[C-]C(=O)OC.C[Sn](C)C.[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[Mo]	{1: 5, 28: 2, 14: 10, 6: 1}
Did not match all atoms present	51232-43-0	CCCC.C1CCCC1.[Rh]	{1: 2, 2: 2, 11: 5}
Did not match all atoms present	51234-28-7	CC(C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)Cl)C(=O)O	{1: 1, 3: 1, 14: 7, 17: 1, 35: 1, 23: 1, 27: 1}
Did not match all atoms present	51235-04-2	CN1C(=NC(=O)N(C1=O)C2CCCCC2)N(C)C	{1: 3, 35: 1, 33: 3, 11: 5, 12: 1, 25: 2}
Did not match all atoms present	5124-25-4	C1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-]	{38: 1, 29: 2, 14: 13, 31: 2}
Did not match all atoms present	5124-39-0	C(=O)(N)N.C(=O)(N)N.C(=O)(N)N.C(=O)(N)N.[O-]S(=O)(=O)[O-].[Ca+2]	{24: 4, 29: 4, 30: 8}
Did not match all atoms present	51241-49-7	CCC(C)OC1=CC=C(C=C1)OC	{1: 3, 2: 1, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	51243-47-1	CCCCOC(=O)C=C.CCOC(=O)C=C.C=CC1=CC=CC=C1	{1: 2, 2: 4, 5: 3, 6: 3, 14: 5, 28: 2}
Did not match all atoms present	51247-58-6	C1=CC(=C(C=C1N)N)S(=O)(=O)[O-].C1=CC(=C(C=C1N)N)S(=O)(=O)[O-].[Ca+2]	{30: 4, 29: 6, 14: 6}
Did not match all atoms present	51248-73-8	CC(=O)NC1=C(C=CC(=C1)N(CCC#N)CCC(=O)OCCOC)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 2, 2: 6, 37: 1, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	51249-05-9	CCCCNC1(CCCCC1)P(=O)(OCCCC)OCCCC	{1: 3, 2: 9, 11: 5, 13: 1, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	5125-13-3	CCOC1=CC(=NC2=CC=CC=C2)C3=CC=CC=C3C1=O	{1: 1, 2: 1, 34: 1, 14: 10, 15: 2, 22: 1, 25: 1}
Did not match all atoms present	51252-07-4	CCCCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCC=C.C=CC1=CC=CC=C1	{1: 4, 2: 4, 5: 5, 6: 3, 7: 2, 14: 5, 28: 3}
Did not match all atoms present	51263-32-2	C1CCC(=O)N(CC1)C2=CC=CC=N2	{25: 1, 11: 5, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	51264-14-3	COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42	{1: 2, 35: 1, 14: 11, 22: 1, 29: 2, 31: 2}
Did not match all atoms present	51274-00-1	O.[OH-].[O-2].[Fe+3]	{}
Did not match all atoms present	51275-92-4	C1CS(=O)(=O)C(C1Cl)Cl	{17: 2, 11: 2, 12: 2, 29: 2}
Did not match all atoms present	51276-47-2	CP(=O)(CCC(C(=O)O)N)O	{1: 1, 2: 2, 3: 1, 20: 1, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	51277-02-2	CCCCCCCCCCCCCCCCCC[N+](CC)(CCO)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 23, 20: 2, 29: 3, 22: 1}
Did not match all atoms present	51277-96-4	CCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)C.[Cl-]	{24: 1, 1: 4, 2: 17, 31: 1, 17: 1}
Did not match all atoms present	5128-10-9	CCCCCCC(=O)[O-].CCCCCCC(=O)[O-].[Cu+2]	{24: 2, 1: 2, 2: 10}
Did not match all atoms present	51282-49-6	COC(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	5129-00-0	COC(=O)C(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 1, 3: 1, 28: 1, 21: 2, 14: 8}
Did not match all atoms present	5129-14-6	COC1=CC=CC=C1C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O	{1: 1, 27: 1, 22: 1, 14: 14, 7: 2}
Did not match all atoms present	51290-10-9	CC(=C)C(=O)OCC[N+](C)(C)CC1=CC=CC=C1.C=CC(=O)N.[Cl-]	{1: 3, 2: 3, 5: 2, 6: 1, 7: 1, 14: 5, 17: 1, 24: 1, 28: 1, 30: 1}
Did not match all atoms present	51290-26-7	C[Si](C)(Cl)Cl.[Si](Cl)(Cl)(Cl)Cl	{1: 2, 17: 6}
Did not match all atoms present	51290-65-4	CC(CCC1=CC=C(C=C1)C(C)(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 14: 4, 20: 1}
Did not match all atoms present	51291-82-8	COC1=NC(=O)NN1	{32: 2, 1: 1, 35: 1, 22: 1, 25: 1}
Did not match all atoms present	51293-83-5	CC(=O)CC(C)(C)NC(=O)C=C.C=O.C1(=NC(=NC(=N1)N)N)N	{1: 3, 2: 1, 35: 3, 4: 1, 5: 2, 6: 1, 24: 2, 30: 3, 31: 1}
Did not match all atoms present	51294-37-2	C1=CC=C2C(=C1)C3=C(C=N2)N=NC(=N3)N	{35: 4, 30: 1, 14: 5}
Did not match all atoms present	51299-95-7	CSC1=CC=C[Te]1	{40: 1, 1: 1, 14: 3}
Did not match all atoms present	513-02-0	CC(C)OP(=O)(OC(C)C)OC(C)C	{1: 6, 3: 3, 29: 1, 22: 3}
Did not match all atoms present	513-08-6	CCCOP(=O)(OCCC)OCCC	{1: 3, 2: 6, 29: 1, 22: 3}
Did not match all atoms present	513-10-0	CCOP(=O)(OCC)SCC[N+](C)(C)C.[I-]	{1: 5, 2: 4, 40: 1, 19: 1, 22: 2, 29: 1}
Did not match all atoms present	513-12-2	CCS(=O)(=O)CCO	{1: 1, 2: 3, 20: 1, 29: 2}
Did not match all atoms present	513-29-1	C(C(=O)O)N.C(C(=O)O)N.C(C(=O)O)N.OS(=O)(=O)O	{2: 3, 27: 3, 20: 2, 29: 2, 30: 3}
Did not match all atoms present	513-62-2	C(C(=O)[O-])F	{16: 1, 24: 1, 2: 1}
Did not match all atoms present	513-74-6	C(=S)(N)[S-].[NH4+]	{30: 1, 7: 1}
Did not match all atoms present	513-77-9	C(=O)([O-])[O-].[Ba+2]	{24: 1}
Did not match all atoms present	513-78-0	C(=O)([O-])[O-].[Cd+2]	{24: 1}
Did not match all atoms present	513-79-1	C(=O)([O-])[O-].[Co+2]	{24: 1}
Did not match all atoms present	51307-45-0	CCN(CC)CCCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31	{1: 2, 2: 5, 33: 2, 41: 1, 14: 8, 24: 1}
Did not match all atoms present	51307-92-7	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Na+].[Na+]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	51308-52-2	CC(C)(C)C1=CC=C(C=C1)CSC(=NC2=CN=CC=C2)SC	{1: 4, 2: 1, 35: 1, 4: 1, 7: 1, 40: 2, 34: 1, 14: 8}
Did not match all atoms present	51308-53-3	CCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C	{1: 4, 2: 2, 35: 1, 4: 1, 7: 1, 40: 2, 34: 1, 14: 8}
Did not match all atoms present	51308-55-5	CC(C)CSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 7: 1, 40: 2, 34: 1, 14: 8, 35: 1}
Did not match all atoms present	51308-56-6	CCC(C)SC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 7: 1, 40: 2, 34: 1, 14: 8, 35: 1}
Did not match all atoms present	51308-57-7	CC(C)(C)C1=CC=C(C=C1)C(C(C)(C)C)SC(=S)NC2=CN=CC=C2	{1: 6, 3: 1, 4: 2, 7: 1, 40: 1, 14: 8, 35: 1, 31: 1}
Did not match all atoms present	51308-58-8	CCCCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C	{1: 4, 2: 6, 35: 1, 4: 1, 7: 1, 40: 2, 34: 1, 14: 8}
Did not match all atoms present	51308-59-9	CCC(C)(CC)SC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C	{1: 6, 2: 3, 35: 1, 4: 2, 7: 1, 40: 2, 34: 1, 14: 8}
Did not match all atoms present	51308-60-2	CCCCCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C	{1: 4, 2: 7, 35: 1, 4: 1, 7: 1, 40: 2, 34: 1, 14: 8}
Did not match all atoms present	51308-65-7	CC(C)CC1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)C(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 40: 1, 14: 7, 35: 1, 24: 1, 31: 1}
Did not match all atoms present	51308-66-8	CCC(C)C1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)C(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 40: 1, 14: 7, 35: 1, 24: 1, 31: 1}
Did not match all atoms present	51308-67-9	CCCCCC1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)C(C)(C)C	{1: 4, 2: 5, 35: 1, 4: 1, 40: 1, 14: 7, 24: 1, 31: 1}
Did not match all atoms present	51308-68-0	CCCC(C)C1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)C(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1, 40: 1, 14: 7, 35: 1, 24: 1, 31: 1}
Did not match all atoms present	51308-69-1	CC(C)C(C)C1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)C(C)(C)C	{1: 6, 2: 1, 3: 2, 4: 1, 40: 1, 14: 7, 35: 1, 24: 1, 31: 1}
Did not match all atoms present	51308-70-4	CC(C)CCC1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)C(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1, 40: 1, 14: 7, 35: 1, 24: 1, 31: 1}
Did not match all atoms present	51308-72-6	CC(C)C1=CC=C(C=C1)CSC(=NC2=CN=CC=C2)SC	{1: 3, 2: 1, 3: 1, 7: 1, 40: 2, 34: 1, 14: 8, 35: 1}
Did not match all atoms present	51308-73-7	CCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)C	{1: 3, 2: 2, 3: 1, 7: 1, 40: 2, 34: 1, 14: 8, 35: 1}
Did not match all atoms present	51308-74-8	CCCCCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)C	{1: 3, 2: 7, 3: 1, 7: 1, 40: 2, 34: 1, 14: 8, 35: 1}
Did not match all atoms present	51308-75-9	CC(C)C1=CC=C(C=C1)CSC(=NC2=CN=CC=C2)SCC3=CC=C(C=C3)C(C)C	{1: 4, 2: 2, 3: 2, 7: 1, 40: 2, 34: 1, 14: 12, 35: 1}
Did not match all atoms present	51308-76-0	CC(C)(C)C1=CC=C(C=C1)CSC(=NC2=CN=CC=C2)SCC3=CC=C(C=C3)C(C)(C)C	{1: 6, 2: 2, 35: 1, 4: 2, 7: 1, 40: 2, 34: 1, 14: 12}
Did not match all atoms present	51308-77-1	CC(C)CSC(=O)NC1=C(N=CC=C1)CC2=CC=C(C=C2)Cl	{1: 2, 2: 2, 3: 1, 40: 1, 14: 7, 17: 1, 35: 1, 24: 1, 31: 1}
Did not match all atoms present	51308-78-2	CC(C)CC1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)Cl	{1: 2, 2: 2, 3: 1, 40: 1, 14: 7, 17: 1, 35: 1, 24: 1, 31: 1}
Did not match all atoms present	51308-79-3	CCCCC1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)Br	{1: 1, 2: 4, 35: 1, 40: 1, 14: 7, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	51308-80-6	CCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)Br	{1: 1, 2: 4, 35: 1, 7: 1, 40: 2, 34: 1, 14: 8, 18: 1}
Did not match all atoms present	5131-00-0	CCCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=CC1=N2)N5)C)CC)C)CCC)C)CC)C	{32: 2, 1: 8, 2: 6, 35: 2, 14: 4}
Did not match all atoms present	5131-24-8	CCOP(=S)(N1C(=O)C2=CC=CC=C2C1=O)OCC	{1: 2, 2: 2, 33: 1, 14: 4, 22: 2, 25: 2}
Did not match all atoms present	5131-58-8	C1=CC(=C(C=C1N)N)[N+](=O)[O-]	{38: 1, 30: 2, 14: 3}
Did not match all atoms present	5131-60-2	C1=CC(=C(C=C1N)N)Cl	{17: 1, 30: 2, 14: 3}
Did not match all atoms present	51310-19-1	CCCCOC(=O)C1=CC=CC=C1N=C=O	{1: 1, 2: 3, 8: 1, 34: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	51321-79-0	C([C@@H](C(=O)O)NC(=O)CP(=O)(O)O)C(=O)O	{2: 2, 3: 1, 20: 2, 24: 1, 27: 2, 29: 1, 31: 1}
Did not match all atoms present	51325-35-0	CC(=O)NC1=NC(=NC(=N1)C2=CC=C(O2)[N+](=O)[O-])NC(=O)C	{1: 2, 35: 3, 38: 1, 14: 2, 23: 1, 24: 2, 31: 2}
Did not match all atoms present	51325-91-8	CC1=CC(=C(C#N)C#N)C=C(O1)C=CC2=CC=C(C=C2)N(C)C	{1: 3, 33: 1, 6: 2, 7: 1, 14: 6, 15: 3, 23: 1, 37: 2}
Did not match all atoms present	51326-37-5	CC(C)(C)C1=CC=C(C=C1)C(=O)C(Cl)(Cl)Cl	{24: 1, 1: 3, 4: 2, 14: 4, 17: 3}
Did not match all atoms present	51329-12-5	C#C[SnH3]	{9: 1, 10: 1}
Did not match all atoms present	5133-19-7	C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3[C@@H]2[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)CO)O	{2: 2, 12: 6, 14: 5, 20: 5, 21: 2, 23: 1, 25: 1}
Did not match all atoms present	51333-75-6	CSC1=CC=CC=C1N=C=S	{8: 1, 1: 1, 34: 1, 14: 4, 40: 1}
Did not match all atoms present	51333-80-3	CSC1=CC=CC(=C1)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4, 40: 1}
Did not match all atoms present	51336-94-8	C1=CC(=C(C=C1F)F)C(=O)CCl	{16: 2, 17: 1, 2: 1, 14: 3, 24: 1}
Did not match all atoms present	51338-27-3	CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl	{1: 2, 3: 1, 14: 7, 17: 2, 22: 2, 28: 1}
Did not match all atoms present	51349-86-1	C1=CC2=C(C=C1[N+](=O)[O-])N=C[N-]2.[Na+]	{35: 2, 38: 1, 14: 4}
Did not match all atoms present	51350-84-6	C1N2CN3CN1C[N+](C2)(C3)CC=CC[N+]45CN6CN(C4)CN(C6)C5.[Cl-].[Cl-]	{17: 2, 2: 2, 11: 12, 6: 2, 33: 6}
Did not match all atoms present	51351-75-8	[CH3-].[CH3-].C[PH+](C)C.C[PH+](C)C.[Pt+2]	{1: 6}
Did not match all atoms present	51353-51-6	C(=N[Hg]C(F)(F)F)=O	{8: 1, 16: 3, 34: 1, 4: 1, 29: 1}
Did not match all atoms present	51353-52-7	C(F)(F)(F)[Hg]N=[N+]=[N-]	{16: 3, 34: 2, 4: 1}
Did not match all atoms present	5136-55-0	CCCCCCCCCCCCCCCCCC(=O)N(C)CC(=O)[O-].[Na+]	{24: 2, 1: 2, 2: 17, 33: 1}
Did not match all atoms present	51363-64-5	CC(C)CCCCCCCOP(=O)(OCCCCCCCC(C)C)OC1=CC=CC=C1	{1: 4, 2: 14, 3: 2, 14: 5, 22: 3, 29: 1}
Did not match all atoms present	51364-51-3	C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.[Pd].[Pd]	{24: 3, 14: 30, 6: 12}
Did not match all atoms present	5137-52-0	CCCCCOC(=O)CC1=CC=CC=C1	{1: 1, 2: 5, 28: 1, 14: 5}
Did not match all atoms present	5137-55-3	CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.[Cl-]	{1: 4, 2: 21, 17: 1}
Did not match all atoms present	5137-70-2	CCCCCCCCCCCCP(=O)(O)O	{1: 1, 2: 11, 20: 2, 29: 1}
Did not match all atoms present	51373-68-3	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Yb+3].[Yb+3]	{24: 6}
Did not match all atoms present	51379-04-5	CCCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C	{1: 4, 2: 5, 35: 1, 4: 1, 7: 1, 40: 2, 34: 1, 14: 8}
Did not match all atoms present	51379-05-6	CCC(C)(C)SC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C	{1: 6, 2: 2, 35: 1, 4: 2, 7: 1, 40: 2, 34: 1, 14: 8}
Did not match all atoms present	5138-18-1	C(C(C(=O)O)S(=O)(=O)O)C(=O)O	{27: 2, 2: 1, 3: 1, 20: 1, 29: 2}
Did not match all atoms present	5138-90-9	C1=CC(=CC=C1S(=O)(=O)[O-])Cl.[Na+]	{17: 1, 29: 3, 14: 4}
Did not match all atoms present	51382-23-1	C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(COCCO)O	{2: 5, 8: 2, 11: 5, 34: 2, 14: 8, 20: 2, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	51382-28-6	CC(C)(CO)CO.COC(=O)C1=CC=C(C=C1)C(=O)OC.C(CCCCC(=O)O)CCCC(=O)O.C(CO)O	{1: 4, 2: 12, 4: 1, 14: 4, 20: 4, 27: 2, 28: 2}
Did not match all atoms present	51384-51-1	CC(C)NCC(COC1=CC=C(C=C1)CCOC)O	{1: 3, 2: 4, 3: 2, 14: 4, 20: 1, 22: 2, 31: 1}
Did not match all atoms present	51389-84-5	CCN1C(=C(C2=CC=CC=C21)C(=O)C3=CC=CC=C3C(=O)O)C	{1: 2, 2: 1, 33: 1, 14: 8, 24: 1, 27: 1}
Did not match all atoms present	5139-88-8	C1=CC=C(C=C1)[P+](=O)O.C1=CC=C(C=C1)[P+](=O)O.C(CCCN)CCN	{2: 6, 30: 2, 20: 2, 29: 2, 14: 10}
Did not match all atoms present	51392-53-1	CSCC1=CC=C(C=C1)[N+](=O)[O-]	{40: 1, 1: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	51394-70-8	CC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O.C(COCCO)O	{1: 2, 2: 6, 4: 1, 14: 6, 20: 4, 22: 1, 28: 4}
Did not match all atoms present	514-12-5	C(C(=O)[C@H]([C@@H](C(=O)COP(=O)(O)O)O)O)OP(=O)(O)O	{2: 2, 3: 2, 20: 6, 22: 2, 24: 2, 29: 2}
Did not match all atoms present	514-62-5	CC(C)C1=C(C=C2C(=C1)CC[C@@H]3[C@@]2(CCCC3(C)C)C)O	{1: 5, 3: 1, 11: 5, 12: 1, 13: 2, 14: 2, 21: 1}
Did not match all atoms present	514-65-8	C1CCN(CC1)CCC(C2CC3CC2C=C3)(C4=CC=CC=C4)O	{33: 1, 2: 2, 4: 1, 11: 7, 12: 3, 14: 7, 20: 1}
Did not match all atoms present	514-73-8	CCN1C2=CC=CC=C2SC1=CC=CC=CC3=[N+](C4=CC=CC=C4S3)CC.[I-]	{1: 2, 2: 2, 6: 5, 33: 2, 41: 2, 14: 8, 15: 1, 19: 1}
Did not match all atoms present	5140-28-3	CC(=O)OC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4C)[C@@H](O2)[C@H](C=C5)O)C=C1	{1: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	5140-35-2	COC1=CC2=C3C4=C(C(=O)C2=CC1=O)NC=CC4=CC(=C3OC)OC	{32: 1, 1: 3, 14: 5, 15: 1, 22: 3, 25: 2}
Did not match all atoms present	51404-69-4	CC(=O)O[Pb]OC(=O)C.O.O.[Pb]	{1: 2, 28: 2}
Did not match all atoms present	5141-20-8	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=C(C=C5)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 20, 15: 2, 29: 9}
Did not match all atoms present	51410-44-7	COC1=CC=C(C=C1)C(C=C)O	{1: 1, 3: 1, 5: 1, 6: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	51418-86-1	CCOC(=O)C1=C2C3=CC=CC=C3C(=O)C4=C(C=C(C(=C24)NC1=O)C)Br	{32: 1, 1: 2, 2: 1, 14: 5, 18: 1, 25: 2, 28: 1}
Did not match all atoms present	51418-90-7	CCC(COC1=C(C=C(C=C1)N=NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])OC)C)O.[Na+]	{1: 3, 2: 2, 3: 1, 34: 4, 14: 10, 20: 1, 22: 2, 29: 3}
Did not match all atoms present	51418-91-8	[Li+].CCC(COC1=C(C=C(C=C1)N=NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])OC)C)O	{1: 3, 2: 2, 3: 1, 34: 4, 14: 10, 20: 1, 22: 2, 29: 3}
Did not match all atoms present	5142-22-3	CN1C=NC2=NC=NC2=C1N	{1: 1, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	5142-23-4	CN1C=NC(=C2C1=NC=N2)N	{1: 1, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	5142-76-7	CC(=O)O[Bi]=O	{1: 1, 28: 1, 29: 1}
Did not match all atoms present	51436-99-8	CC1=C(C=C(C=C1)Br)F	{16: 1, 1: 1, 18: 1, 14: 3}
Did not match all atoms present	51437-00-4	CC1=C(C=CC(=C1)Br)F	{16: 1, 1: 1, 18: 1, 14: 3}
Did not match all atoms present	5144-11-6	CC1=NN=NN1C	{1: 2, 35: 3, 33: 1}
Did not match all atoms present	5144-52-5	C1CN=C(N1)CC2=CC=CC3=CC=CC=C32.[N+](=O)(O)[O-]	{32: 1, 2: 1, 35: 1, 11: 2, 14: 7, 15: 1, 20: 1}
Did not match all atoms present	51452-88-1	C[Sn]1(C2=CC=CC=C2OC3=CC=CC=C3[Sn](C4=CC=CC=C4OC5=CC=CC=C51)(C)C)C	{1: 4, 14: 16, 23: 2}
Did not match all atoms present	51458-06-1	[B](C1=C(C=C(C=C1C)C)C)C2=C(C=C(C=C2C)C)C	{1: 6, 14: 4}
Did not match all atoms present	51460-26-5	CN1C(CC2=C/C(=N\NC(=O)N)/C(=O)C=C21)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 1, 33: 1, 11: 1, 12: 1, 14: 2, 15: 3, 24: 1, 25: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	51460-84-5	C1=C(C=C(C(=C1[N+](=O)[O-])C2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 9, 14: 5}
Did not match all atoms present	51461-11-1	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)N)C(C)(C)CC	{1: 6, 2: 5, 4: 2, 14: 6, 17: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	51461-29-1	C1COCCN1C2=NC(=NC(=N2)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)O)N7CCOCC7)S(=O)(=O)O)S(=O)(=O)O)NC8=CC=C(C=C8)S(=O)(=O)O	{33: 2, 35: 6, 6: 2, 11: 8, 14: 14, 20: 4, 23: 2, 29: 8, 31: 4}
Did not match all atoms present	51462-26-1	CCCCCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)CCCCCC	{1: 2, 2: 13, 35: 2, 22: 1, 14: 6}
Did not match all atoms present	51471-45-5	CC(=O)NC1=NC(=O)C(=C(N1)Cl)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 17: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	51473-23-5	CN1CC(CC2C1CC3=C(NC4=CC=CC2=C34)Cl)CC#N.CS(=O)(=O)O	{32: 1, 1: 2, 2: 1, 37: 1, 33: 1, 11: 3, 12: 3, 14: 3, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	51475-16-2	CCN(CC[N+]1=CC=CC=C1)C2=CC=CC(=C2)C.[Cl-]	{1: 2, 2: 3, 33: 2, 14: 9, 17: 1}
Did not match all atoms present	51481-61-9	CC1=C(N=CN1)CSCCNC(=NC)NC#N	{32: 1, 1: 2, 2: 3, 35: 1, 37: 1, 7: 1, 40: 1, 34: 1, 14: 1, 31: 2}
Did not match all atoms present	51481-65-3	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)NC(=O)N4CCN(C4=O)S(=O)(=O)C)C(=O)O)C	{1: 3, 3: 1, 33: 3, 41: 1, 11: 2, 12: 3, 13: 1, 14: 5, 24: 2, 25: 2, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	51486-55-6	CC(C)C12COP(OC1)OC2	{11: 3, 1: 2, 3: 1, 13: 1, 23: 3}
Did not match all atoms present	51487-69-5	CNC(=O)OC1=CC=CC=C1OC(CCl)OC	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	51488-20-1	CC1=C(C=CC(=C1)N=C=O)Cl	{1: 1, 34: 1, 8: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	5149-69-9	C1=CC=C2C(=C1)C=C(O2)C(=O)CC#N	{24: 1, 2: 1, 37: 1, 14: 5, 23: 1}
Did not match all atoms present	5149-85-9	CCN(CC)C1=CC=C(C=C1)[N+]#N.CCN(CC)C1=CC=C(C=C1)[N+]#N.Cl[Zn-2](Cl)(Cl)Cl	{1: 4, 2: 4, 33: 2, 34: 2, 14: 8, 17: 4}
Did not match all atoms present	51492-01-4	C1=CC(=NC(=C1Cl)Cl)C(Cl)(Cl)Cl	{17: 5, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	51495-03-5	C1CCC2=C(C1)C=C(N2C3=CC=CC=C3)C4=CC=CC=C4	{33: 1, 11: 4, 14: 11}
Did not match all atoms present	515-25-3	C[N+]1(C[C@@H](C[C@H]1C(=O)[O-])O)C	{24: 1, 1: 2, 11: 2, 12: 2, 20: 1}
Did not match all atoms present	515-30-0	CC(C1=CC=CC=C1)(C(=O)O)O	{1: 1, 27: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	515-40-2	CC(C)(CCl)C1=CC=CC=C1	{1: 2, 2: 1, 4: 1, 14: 5, 17: 1}
Did not match all atoms present	515-42-4	C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{29: 3, 14: 5}
Did not match all atoms present	515-46-8	CCOS(=O)(=O)C1=CC=CC=C1	{1: 1, 2: 1, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	515-49-1	C1=CC(=CC=C1N)S(=O)(=O)NC(=S)N	{30: 2, 31: 1, 29: 2, 14: 4, 7: 1}
Did not match all atoms present	515-59-3	CC1=CSC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 1, 41: 1, 14: 5, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	515-64-0	CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 2, 35: 2, 14: 5, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	515-98-0	CC(C(=O)[O-])O.[NH4+]	{24: 1, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	5150-42-5	COC1=CC=CC(=C1OC)O	{1: 2, 22: 2, 21: 1, 14: 3}
Did not match all atoms present	5150-50-5	C[C@@H]1C[C@@H](C(=O)N1C2=CC=CC=C2)N	{1: 1, 33: 1, 11: 1, 12: 2, 14: 5, 25: 1, 30: 1}
Did not match all atoms present	51500-43-7	CC1=CS(=O)C2=CC=CC=C12	{1: 1, 29: 1, 14: 5, 15: 1}
Did not match all atoms present	51501-27-0	CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC=CC2=C1NC=C2	{32: 1, 1: 1, 2: 15, 14: 5, 29: 2, 31: 1}
Did not match all atoms present	51501-87-2	CC1=CC=C(C=C1)[Si](C)(C)OC	{1: 4, 22: 1, 14: 4}
Did not match all atoms present	51508-06-6	CC(C)(C)C1=NN=C(S1)N=C=O.CC(C)(C)C1=NN=C(S1)N=C=O	{1: 6, 34: 2, 35: 4, 4: 2, 8: 2, 41: 2, 29: 2}
Did not match all atoms present	51508-59-9	COC1=CC[CH+]C=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].F[P-](F)(F)(F)(F)F.[Fe]	{1: 1, 11: 1, 14: 4, 15: 1, 16: 6, 22: 1, 29: 3}
Did not match all atoms present	51517-45-4	C1=CC=C(C(=C1)C2=C3C=CC4=CC(=O)C=CC4=C3OC5=C2C=CC6=C5C=CC(=C6)O)C(=O)O	{25: 1, 27: 1, 21: 1, 14: 14, 23: 1}
Did not match all atoms present	51518-19-5	F[Si](F)(F)P	{16: 3}
Did not match all atoms present	5152-30-7	C[N+]1(CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)OC)O3)[N+](CCC6=CC(=C5OC)OC)(C)C)OC)C	{1: 8, 11: 6, 12: 2, 14: 10, 22: 4, 23: 2}
Did not match all atoms present	51523-40-1	CC[N+](CC)(CC)CCCCCCCC[N+](CC)(CC)CC	{1: 6, 2: 14}
Did not match all atoms present	51523-41-2	CC[N+](CC)(CC)CCCCCCCCCC[N+](CC)(CC)CC	{1: 6, 2: 16}
Did not match all atoms present	51523-42-3	C=CC[N+](CC[N+](CC=C)(CC=C)CC=C)(CC=C)CC=C.[Br-]	{2: 8, 18: 1, 5: 6, 6: 6}
Did not match all atoms present	51523-43-4	C[N+](CC[N+](C)(CC=C)CC=C)(CC=C)CC=C.[Br-].[Br-]	{1: 2, 2: 6, 18: 2, 5: 4, 6: 4}
Did not match all atoms present	51523-44-5	C=CC[N+](CCC[N+](CC=C)(CC=C)CC=C)(CC=C)CC=C.[Br-]	{2: 9, 18: 1, 5: 6, 6: 6}
Did not match all atoms present	51523-45-6	C=CC[N+](CC=C)(CC=C)CC=CC[N+](CC=C)(CC=C)CC=C	{2: 8, 5: 6, 6: 8}
Did not match all atoms present	51524-84-6	CNC1=CC=CC(=C1)C(=O)O	{1: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	51524-87-9	[2H]C1=CC(=C(C(=C1)[2H])[N+]#[C-])[2H]	{34: 1, 14: 5}
Did not match all atoms present	51526-06-8	CCC1=CC=C(C=C1)CCC2=CC=C(C=C2)CC	{1: 2, 2: 4, 14: 8}
Did not match all atoms present	51527-73-2	C1=C(C=C(C(=C1Cl)S(=O)(=O)Cl)Cl)Cl	{17: 4, 29: 2, 14: 2}
Did not match all atoms present	51527-96-9	C1=CC=C(C(=C1)CN(CCO)CCO)O	{33: 1, 2: 5, 20: 2, 21: 1, 14: 4}
Did not match all atoms present	5153-39-9	CC1=C(C(=C(C(=C1C)C)Cl)C)C	{1: 5, 17: 1}
Did not match all atoms present	5153-63-9	CC(=O)[O-].C1=CC=[NH+]C=C1	{24: 1, 1: 1, 14: 5, 32: 1}
Did not match all atoms present	51535-00-3	COC(=O)C1CC(=O)N(C1)CC2=CC=CC=C2	{1: 1, 2: 1, 33: 1, 11: 2, 12: 1, 14: 5, 25: 1, 28: 1}
Did not match all atoms present	5154-00-7	C1=CC(=O)NC(=C1)N	{32: 1, 25: 1, 30: 1, 14: 3}
Did not match all atoms present	5154-02-9	C1=CC2=C(C=CNC2=O)C(=C1)O	{32: 1, 25: 1, 21: 1, 14: 5}
Did not match all atoms present	51542-33-7	CN(C(=O)NC1=NC2=CC=CC=C2S1)N=O	{1: 1, 34: 1, 35: 1, 33: 1, 41: 1, 14: 4, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	51550-25-5	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)[O-])N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 1, 14: 7, 15: 2, 21: 2, 25: 1, 29: 12, 31: 1}
Did not match all atoms present	51554-93-9	CCCCCCCCC1=CC=C(C=C1)Br	{1: 1, 2: 7, 18: 1, 14: 4}
Did not match all atoms present	51555-38-5	CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.C=CC#N.[Na+]	{1: 2, 2: 1, 4: 1, 5: 2, 6: 2, 37: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	51557-75-6	C1=CC2=CC3=C(C=C2)C=CC(=C3)C=CC4=CC5=C(C=CC1=C5)C=C4	{14: 16}
Did not match all atoms present	5156-98-9	CCOP(NC1=CC=CC=C1)OCC	{1: 2, 2: 2, 22: 2, 14: 5, 31: 1}
Did not match all atoms present	5157-15-3	C1=CC=C(C=C1)C23C(NC(=O)N2)(NC(=O)N3)C4=CC=CC=C4	{32: 4, 25: 2, 13: 2, 14: 10}
Did not match all atoms present	5157-75-5	CCCCCCCCCCCCCCCCCC[Si](C)(Cl)Cl	{1: 2, 2: 17, 17: 2}
Did not match all atoms present	51576-23-9	C1=CC(=CC(=C1)[O-])C(=O)[O-].[K+].[K+]	{24: 1, 14: 4}
Did not match all atoms present	51579-82-9	C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)CC(=O)O)N	{24: 1, 2: 1, 27: 1, 30: 1, 14: 8}
Did not match all atoms present	5158-09-8	C[Si](C)(C#N)C#N	{1: 2, 37: 2}
Did not match all atoms present	5158-50-9	B(C)(C)Br	{1: 2, 18: 1}
Did not match all atoms present	51580-86-0	C1(=NC(=O)N(C(=O)N1Cl)Cl)[O-].O.O.[Na+]	{17: 2, 35: 1, 33: 2, 25: 2}
Did not match all atoms present	51581-50-1	C1=CC=C(C(=C1)N2C=CN=C2)Cl	{17: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	51581-52-3	C1=CC(=CC(=C1)Cl)N2C=CN=C2	{17: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	51581-54-5	C1=CC(=CC=C1N2C=CN=C2)Cl	{17: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	51583-69-8	CC1=[N+](C2=CC=CC=C2C=C1)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 29: 3, 14: 6, 33: 1}
Did not match all atoms present	51583-97-2	C1=CC=C2C=C(C=CC2=C1)C(=O)CC(=O)C3=CC4=CC=CC=C4C=C3	{24: 2, 2: 1, 14: 14}
Did not match all atoms present	51584-21-5	C1(=C(SC(=C1[N+](=O)[O-])Cl)Cl)[N+](=O)[O-]	{17: 2, 38: 2, 41: 1}
Did not match all atoms present	5159-41-1	C1=CC=C(C(=C1)CO)I	{2: 1, 19: 1, 20: 1, 14: 4}
Did not match all atoms present	51590-67-1	CCCC[Sn]=O	{1: 1, 2: 3, 29: 1}
Did not match all atoms present	51592-06-4	C1=CC=C(C=C1)C23C(N(C(=O)N2Cl)Cl)(N(C(=O)N3Cl)Cl)C4=CC=CC=C4	{17: 4, 33: 4, 13: 2, 14: 10, 25: 2}
Did not match all atoms present	51593-70-5	CC(=O)C1=CC2=CC=CC=C2OC1	{1: 1, 11: 1, 14: 5, 15: 1, 23: 1, 24: 1}
Did not match all atoms present	51599-32-7	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)SC3=NN=NN3C4=CC=CC=C4)C(C)(C)CC	{1: 9, 2: 5, 3: 1, 4: 3, 33: 1, 40: 1, 14: 11, 17: 1, 35: 3, 22: 1, 24: 3, 31: 2}
Did not match all atoms present	516-02-9	C(=O)(C(=O)[O-])[O-].[Ba+2]	{24: 2}
Did not match all atoms present	516-03-0	C(=O)(C(=O)[O-])[O-].[Fe+2]	{24: 2}
Did not match all atoms present	516-21-2	CC1(N=C(N=C(N1C2=CC=C(C=C2)Cl)N)N)C	{1: 2, 35: 2, 33: 1, 13: 1, 14: 4, 15: 2, 17: 1, 30: 2}
Did not match all atoms present	516-90-5	C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C	{1: 3, 2: 4, 3: 1, 11: 9, 12: 6, 13: 2, 20: 2, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	5160-02-1	CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=CC2=O.CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=CC2=O.[Ba+2]	{1: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	5160-55-4	CC1=CC2=CC=CC=C2C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 21: 1, 14: 9}
Did not match all atoms present	5160-99-6	CCOC(=O)C(C1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC=C2)O)C(=O)C	{1: 2, 2: 1, 3: 1, 14: 8, 21: 1, 24: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	51604-43-4	COCNC(=S)N	{1: 1, 2: 1, 7: 1, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	51604-48-9	CCCCC(CC)COC(=O)NC1=CC(=C(C=C1)C)N=C=O	{1: 3, 2: 5, 3: 1, 8: 1, 34: 1, 14: 3, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	51605-32-4	CCOC(=O)C1=C(NC=N1)C	{32: 1, 1: 2, 2: 1, 35: 1, 14: 1, 28: 1}
Did not match all atoms present	51605-97-1	CC(C)C1=CC(=C(C=C1)N)Br	{1: 2, 18: 1, 3: 1, 30: 1, 14: 3}
Did not match all atoms present	51609-64-4	CC1CO1.C1CO1.C(CC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{1: 1, 2: 2, 11: 3, 12: 1, 23: 2, 24: 2}
Did not match all atoms present	5161-04-6	CC1=CC=C(C=C1)CC(C)C	{1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	5161-12-6	CCCCNC(=C(S(=O)(=O)CC)S(=O)(=O)CC)NCCCC	{1: 4, 2: 8, 31: 2, 29: 4, 7: 2}
Did not match all atoms present	5162-03-8	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2Cl	{24: 1, 17: 1, 14: 9}
Did not match all atoms present	5162-82-3	CC1=C(C=C(C=C1)C(=O)O)Cl	{1: 1, 27: 1, 14: 3, 17: 1}
Did not match all atoms present	51621-16-0	F[W]	{16: 1}
Did not match all atoms present	51621-17-1	F[W](F)F	{16: 3}
Did not match all atoms present	51622-02-7	CCCCCCC[Hg]CCCCCCC	{1: 2, 2: 12}
Did not match all atoms present	51624-18-1	[2H]C(=N)[2H]	{36: 1, 5: 1}
Did not match all atoms present	51625-14-0	CC(C)(C)C1=CC(=CC(=C1)CCl)C(C)(C)C	{1: 6, 2: 1, 4: 2, 14: 3, 17: 1}
Did not match all atoms present	51627-14-6	C1C(=C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)O)CSC4=NNN=C4	{32: 1, 33: 1, 2: 1, 3: 1, 40: 1, 41: 1, 11: 1, 12: 2, 14: 5, 15: 2, 35: 2, 21: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	51627-42-0	COC1=NN=C(O1)C2=CC=CC=C2	{1: 1, 35: 2, 22: 1, 14: 5, 23: 1}
Did not match all atoms present	51628-12-7	C1=CC(=CC=C1CC#N)I	{2: 1, 19: 1, 37: 1, 14: 4}
Did not match all atoms present	51628-37-6	CCC(C1=CC=CC=C1)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3	{1: 1, 2: 2, 3: 1, 14: 14, 22: 1, 28: 1}
Did not match all atoms present	51628-95-6	CC(C)C(C1=CC=C(C=C1)OC)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3	{1: 3, 2: 1, 3: 2, 14: 13, 22: 2, 28: 1}
Did not match all atoms present	51629-13-1	CCC(C1=CC=C(C=C1)OC)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3	{1: 2, 2: 2, 3: 1, 14: 13, 22: 2, 28: 1}
Did not match all atoms present	51629-48-2	CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3	{1: 2, 2: 1, 3: 2, 14: 13, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	51629-54-0	CC1=CC=C(C=C1)C(C(=C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 14: 13, 22: 1, 28: 1}
Did not match all atoms present	51630-58-1	CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3	{1: 2, 3: 3, 37: 1, 14: 13, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	51632-16-7	C1=CC=C(C=C1)OC2=CC=CC(=C2)CBr	{2: 1, 22: 1, 18: 1, 14: 9}
Did not match all atoms present	51632-28-1	CCC1=CC=C(C=C1)CC#N	{1: 1, 2: 2, 37: 1, 14: 4}
Did not match all atoms present	51632-29-2	C1=CC=C(C=C1)OC2=CC=CC(=C2)CC#N	{2: 1, 22: 1, 14: 9, 37: 1}
Did not match all atoms present	51635-81-5	CC[N+](C)(CC)CN1CCN(C1=O)C[N+](C)(C2=CC=CC=C2)C3=CC=CC=C3.[O-]S(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 11: 2, 14: 10, 25: 1, 29: 4}
Did not match all atoms present	51639-48-6	CC(=O)C1=CC=C(C=C1)N2CCNCC2	{32: 1, 1: 1, 33: 1, 11: 4, 14: 4, 24: 1}
Did not match all atoms present	51647-34-8	C1=CC/2=NC(=C1)/C=C\C3=CC=C(C=C3)/C=C2	{35: 1, 14: 11}
Did not match all atoms present	51649-83-3	C1=CC2=C(C=C1N)C3(C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O)OC2=O	{13: 1, 14: 9, 21: 2, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	5165-79-7	CC1=CC(=C(C=C1OC)NC(=O)C2=CC=CC=C2)N=NN(C)CC(=O)[O-].[Na+]	{1: 3, 2: 1, 33: 1, 34: 2, 14: 7, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	5165-81-1	CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC3=CC=CC=C3C=C2O	{1: 2, 14: 8, 17: 1, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5165-97-9	CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.[Na+]	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	51655-39-1	COC1=C(C=C(C(=C1)CC#N)Br)OC	{1: 2, 2: 1, 37: 1, 14: 2, 18: 1, 22: 2}
Did not match all atoms present	51656-57-6	CC(C)(C)CC(C)(C)C1=CC(=NNC2=CC=CC=C2[N+](=O)[O-])C(=O)C=C1	{1: 5, 2: 1, 4: 2, 38: 1, 34: 1, 14: 7, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	5167-69-1	C1C=CCC2C1C(=O)[N-]C2=O.[Na+]	{25: 2, 11: 2, 12: 2, 14: 2, 35: 1}
Did not match all atoms present	51672-22-1	CC(C)(C)C(=O)NNC(=S)NC	{24: 1, 1: 4, 31: 3, 4: 1, 7: 1}
Did not match all atoms present	51673-59-7	C1=CC=C(C(=C1)C(CO)O)[N+](=O)[O-]	{2: 1, 3: 1, 20: 2, 38: 1, 14: 4}
Did not match all atoms present	51675-53-7	C[Sn](C)(C)CC1CC1	{1: 3, 2: 1, 11: 2, 12: 1}
Did not match all atoms present	51682-05-4	[Ge].[Se-2].[Se-2]	{}
Did not match all atoms present	51682-34-9	[Ne].[Kr]	{}
Did not match all atoms present	51685-13-3	C[Si]1(C(=P(C)(C)C)[Si]([Si](C1=P(C)(C)C)(C)C)(C)C)C	{1: 12, 15: 2}
Did not match all atoms present	51686-35-2	[Cl-].[Th]	{17: 1}
Did not match all atoms present	51686-78-3	C1=CC(=C(C=C1Br)Br)[N+](=O)[O-]	{18: 2, 38: 1, 14: 3}
Did not match all atoms present	51688-73-4	CCC1=C(C=CC(=C1)Br)NC(=O)C	{1: 2, 2: 1, 14: 3, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	5169-78-8	CN1CCCC(=C(C2=CC=CS2)C3=CC=CS3)C1	{1: 1, 33: 1, 41: 2, 11: 4, 14: 6, 15: 1, 7: 1}
Did not match all atoms present	51694-22-5	C1=CC=C(C(=C1)[N+](=O)[O-])[Se]C#N	{38: 1, 37: 1, 14: 4}
Did not match all atoms present	517-04-4	C[C@]12CC[C@H]3[C@@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	517-09-9	C[C@]12CCC3=C([C@@H]1CCC2=O)C=CC4=C3C=CC(=C4)O	{1: 1, 11: 4, 12: 1, 13: 1, 14: 5, 21: 1, 25: 1}
Did not match all atoms present	517-16-8	CC[Hg]N(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C	{1: 2, 2: 1, 29: 2, 14: 9, 33: 1}
Did not match all atoms present	517-21-5	C(C([O-])S(=O)(=O)O)([O-])S(=O)(=O)O.[Na+].[Na+]	{3: 2, 20: 2, 29: 6}
Did not match all atoms present	517-22-6	CCC1=C(NC=C1C)C	{32: 1, 1: 3, 2: 1, 14: 1}
Did not match all atoms present	517-28-2	C1C2=CC(=C(C=C2C3C1(COC4=C3C=CC(=C4O)O)O)O)O	{11: 2, 12: 1, 13: 1, 14: 4, 20: 1, 21: 4, 23: 1}
Did not match all atoms present	517-43-1	C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O	{2: 2, 12: 12, 14: 10, 20: 8, 21: 2, 22: 2, 23: 2, 25: 2, 27: 2}
Did not match all atoms present	517-51-1	C1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=C(C5=CC=CC=C5C(=C24)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8	{14: 28}
Did not match all atoms present	517-60-2	C1(=C(C(=C(C(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 6}
Did not match all atoms present	517-66-8	CN1CCC2=CC3=C(C4=C2[C@@H]1CC5=CC(=C(C=C54)OC)OC)OCO3	{1: 3, 33: 1, 11: 4, 12: 1, 14: 3, 22: 2, 23: 2}
Did not match all atoms present	517-73-7	CN1C2=CC=CC=C2C(=O)C3=C1C(=C(C(=C3OC)OC)OC)OC	{1: 5, 33: 1, 22: 4, 14: 4, 25: 1}
Did not match all atoms present	517-85-1	C1CC2=CC=CC3=C4C(=C5CCC1C5=C23)C=CC6=CC=CC=C64	{11: 4, 12: 1, 14: 9}
Did not match all atoms present	517-92-0	C1=C(C2=C(C(=C1[N+](=O)[O-])O)C(=O)C3=C(C2=O)C(=CC(=C3O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{25: 2, 38: 4, 21: 2, 14: 2}
Did not match all atoms present	517-97-5	CC1=CC(=NC(=N1)/N=C(\N)/NC2=CC(=C(C=C2)Cl)Cl)NCC3CCNCC3	{32: 1, 1: 1, 2: 1, 35: 2, 7: 1, 11: 4, 12: 1, 34: 1, 14: 4, 17: 2, 30: 1, 31: 2}
Did not match all atoms present	51706-34-4	C1CCOC(C1)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3	{3: 1, 11: 4, 12: 1, 14: 10, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	51707-55-2	C1=CC=C(C=C1)NC(=O)NC2=CN=NS2	{24: 1, 41: 1, 35: 2, 14: 6, 31: 2}
Did not match all atoms present	5171-91-5	CC(C)(C)C1=CC=C(C=C1)C(C)(C)C(C)(C)C2=CC=C(C=C2)C(C)(C)C	{1: 10, 4: 4, 14: 8}
Did not match all atoms present	51716-04-2	CC(=C1C2CCC1C3=C2C(=C(C(=C3F)F)F)F)C	{1: 2, 7: 1, 11: 2, 12: 2, 15: 1, 16: 4}
Did not match all atoms present	51717-23-8	CCOP(OCC)OCC.[Cu]I	{1: 3, 2: 3, 19: 1, 22: 3}
Did not match all atoms present	5173-27-3	C1=CC(=CC=C1C(C(C2=CC=C(C=C2)O)O)O)O	{3: 2, 20: 2, 21: 2, 14: 8}
Did not match all atoms present	51733-03-0	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=[N+](N2CC3=CC=CC=C3)CCO.CCN(CC)C1=CC=C(C=C1)N=NC2=CC=[N+](N2CC3=CC=CC=C3)CCO.[Cl-].[Cl-].[Cl-].[Cl-].[Zn]	{1: 4, 2: 10, 33: 6, 34: 4, 14: 22, 17: 4, 20: 2}
Did not match all atoms present	5174-83-4	CCC1=C2C=C3C(=CC(=CC4=NC(=CC5=NC(=CC(=C1C)N2)C(=C5C)CC)C(=C4CCC(=O)OC)C)N3)C	{32: 2, 1: 7, 2: 4, 35: 2, 14: 5, 28: 1}
Did not match all atoms present	51741-78-7	CN1C2=CC=CC=C2SC1=CC(=S)SC	{1: 2, 6: 1, 33: 1, 40: 1, 41: 1, 7: 1, 14: 4, 15: 1}
Did not match all atoms present	51749-28-1	CCCCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)CCCC	{1: 2, 34: 1, 6: 1, 2: 11, 14: 8, 22: 1}
Did not match all atoms present	51749-41-8	CCCCOCNC(=O)C=C.CCOC(=O)C=C.C=CC1=CC=CC=C1.C=CC(=O)O	{1: 2, 2: 5, 5: 4, 6: 4, 14: 5, 22: 1, 24: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	51749-83-8	C1=CC=C(C=C1)C#CC2=C3C=CC=C(C3=C(C4=C2C=CC=C4Cl)C#CC5=CC=CC=C5)Cl	{17: 2, 10: 4, 14: 16}
Did not match all atoms present	5175-83-7	C1=C(C=C(C(=C1Br)[O-])Br)Br.C1=C(C=C(C(=C1Br)[O-])Br)Br.C1=C(C=C(C(=C1Br)[O-])Br)Br.[Bi+3]	{18: 9, 14: 6}
Did not match all atoms present	51750-32-4	CC1=C(C=C(C(=C1Cl)N)S(=O)(=O)O)Cl	{1: 1, 14: 1, 17: 2, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	51753-57-2	C1C(=O)NC2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=C3Cl	{32: 1, 35: 1, 11: 1, 14: 7, 15: 1, 17: 1, 18: 1, 25: 1}
Did not match all atoms present	51754-03-1	C(O)S(=O)(=O)[O-].[K+]	{2: 1, 20: 1, 29: 3}
Did not match all atoms present	5176-20-5	C1=CC=C2C3C=CC(C2=C1)N3	{32: 1, 12: 2, 14: 6}
Did not match all atoms present	5176-30-7	C1CC2C3=CC=CC=C3C1N2	{32: 1, 11: 2, 12: 2, 14: 4}
Did not match all atoms present	51760-21-5	COC(=O)C1=CC(=CC(=C1)Br)C(=O)OC	{1: 2, 18: 1, 28: 2, 14: 3}
Did not match all atoms present	51764-33-1	CNCC(C(C(C(CO)O)O)O)O.CNCC(C(C(C(CO)O)O)O)O.C1=C(C(=C(C(=C1I)NC(=O)CCOCCOCCOCCOCCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I	{1: 2, 2: 14, 3: 8, 14: 2, 19: 6, 20: 10, 22: 4, 24: 2, 27: 2, 31: 4}
Did not match all atoms present	51766-21-3	C1=CC=C(C=C1)NP(=O)(OC2=CC=CC=C2)Cl	{17: 1, 31: 1, 22: 1, 14: 10, 29: 1}
Did not match all atoms present	51767-45-4	C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C(=C2)Cl)O)Cl	{17: 2, 31: 1, 21: 1, 14: 7, 29: 2}
Did not match all atoms present	51767-46-5	C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C(=C2)Br)O)Br	{18: 2, 31: 1, 21: 1, 14: 7, 29: 2}
Did not match all atoms present	51769-43-8	CSC1=NC2=C(S1)C=CC3=CC=CC=C32	{40: 1, 1: 1, 35: 1, 14: 6, 41: 1}
Did not match all atoms present	5177-27-5	C1=C(C(=NC(=N1)Cl)Cl)N	{17: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	51772-30-6	CCC(=O)C1=CC(=CC=C1)C	{24: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	51774-88-0	C1=CC(=CC(=C1)N)N.C1=CC(=CC(=C1)O)O	{30: 2, 21: 2, 14: 8}
Did not match all atoms present	51775-17-8	CC[NH+](CCCl)CC1COC2=CC=CC=C2O1.[Cl-]	{1: 1, 2: 4, 11: 1, 12: 1, 14: 4, 17: 2, 23: 2}
Did not match all atoms present	51781-06-7	CC(C)(C)NCC(COC1=CC=CC2=C1CCC(=O)N2)O	{32: 1, 1: 3, 2: 2, 3: 1, 4: 1, 11: 2, 14: 3, 20: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	51781-21-6	CC(C)(C)NCC(COC1=CC=CC2=C1CCC(=O)N2)O.Cl	{32: 1, 1: 3, 2: 2, 3: 1, 4: 1, 11: 2, 14: 3, 17: 1, 20: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	51784-10-2	C(C(CBr)Br)N=C=S	{8: 1, 34: 1, 2: 2, 3: 1, 18: 2}
Did not match all atoms present	51786-53-9	CC1=CC(=C(C=C1)C)N.Cl	{1: 2, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	51787-42-9	CC1=CC(=C2C(=C1)C(=C3C=CC4=CC=CC=C4C3=N2)C)C	{1: 3, 35: 1, 14: 8}
Did not match all atoms present	51787-43-0	CC1=CC(=C2C(=C1)C(=C3C(=N2)C=CC4=CC=CC=C43)C)C	{1: 3, 35: 1, 14: 8}
Did not match all atoms present	51787-44-1	CC1=CC(=C2C(=C1C)C(=C3C=CC4=CC=CC=C4C3=N2)C)C	{1: 4, 35: 1, 14: 7}
Did not match all atoms present	51787-75-8	C1=CC(=CC=C1C2=C(C=C(C=C2)[N+](=O)[O-])N)[N+](=O)[O-]	{38: 2, 30: 1, 14: 7}
Did not match all atoms present	51787-96-3	C1CC(=O)OC1C2=CC=C(C=C2)F	{16: 1, 28: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	51788-80-8	CC(=O)C1=C(C=C(C=C1)F)OC	{16: 1, 1: 2, 22: 1, 14: 3, 24: 1}
Did not match all atoms present	51793-51-2	C1CC2CNC(=S)NC2C1	{32: 2, 11: 4, 12: 2, 15: 1}
Did not match all atoms present	51795-97-2	C1=CC=C(C=C1)OCCCCCCBr	{2: 6, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	51799-29-2	CC(=O)O.CN1CCN(CC1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-]	{1: 2, 2: 1, 38: 1, 6: 1, 33: 2, 11: 4, 34: 1, 14: 2, 23: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	51799-31-6	CN1CCN(CC1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-].C(=C/C(=O)O)\C(=O)O	{1: 1, 2: 1, 38: 1, 6: 3, 33: 2, 11: 4, 34: 1, 14: 2, 23: 1, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	51799-33-8	CCCCNC(C)CC1=CC=CC=C1	{1: 2, 2: 4, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	518-02-5	C1CCC2=CC=C3CCC4=C3C2=C(C1)C=C4	{11: 6, 14: 4}
Did not match all atoms present	518-03-6	C1CC2=CC=C3C=CC=CC4=C3C2=C1C=C4	{11: 2, 14: 8}
Did not match all atoms present	518-05-8	C1=CC2=C(C(=C1)C(=O)O)C(=CC=C2)C(=O)O	{27: 2, 14: 6}
Did not match all atoms present	518-20-7	CC1(CC(C2=C(O1)C3=CC=CC=C3OC2=O)C4=CC=CC=C4)OC	{1: 2, 11: 1, 12: 1, 13: 1, 14: 9, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	518-28-5	COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O	{1: 3, 11: 2, 12: 4, 14: 4, 20: 1, 22: 3, 23: 2, 28: 1}
Did not match all atoms present	518-34-3	CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@H]6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)OC)OC	{1: 6, 33: 2, 11: 6, 12: 2, 14: 10, 22: 4, 23: 2}
Did not match all atoms present	518-44-5	C1=CC=C(C(=C1)C2C3=C(C=C(C=C3)O)OC4=C2C=CC(=C4)O)C(=O)O	{27: 1, 12: 1, 21: 2, 14: 10, 23: 1}
Did not match all atoms present	518-61-6	CN(C)CC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31	{1: 2, 2: 1, 33: 2, 41: 1, 14: 8, 24: 1}
Did not match all atoms present	518-63-8	CN(C)CCOCCOC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31.Cl	{1: 2, 2: 4, 33: 2, 41: 1, 14: 8, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	518-69-4	C[C@@H]1[C@@H]2C3=CC(=C(C=C3CCN2CC4=C1C=CC(=C4OC)OC)OC)OC	{1: 5, 33: 1, 11: 3, 12: 2, 14: 4, 22: 4}
Did not match all atoms present	518-77-4	C[C@H]1[C@H]2C3=CC(=C(C=C3CCN2CC4=C1C=CC(=C4OC)OC)O)OC	{1: 4, 33: 1, 11: 3, 12: 2, 14: 4, 21: 1, 22: 3}
Did not match all atoms present	518-82-1	CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O	{1: 1, 21: 3, 14: 4, 25: 2}
Did not match all atoms present	5180-53-0	C1=C(C=C(C(=C1[N+](=O)[O-])CCC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{2: 2, 38: 6, 14: 4}
Did not match all atoms present	5180-79-0	C1=CC(=CC(=C1)N=C=O)C(=O)Cl	{34: 1, 8: 1, 14: 4, 17: 1, 24: 1, 29: 1}
Did not match all atoms present	51805-41-5	CP(=O)(CCC(=O)O)CCC(=O)O	{1: 1, 2: 4, 27: 2, 29: 1}
Did not match all atoms present	51805-45-9	C(CP(CCC(=O)O)CCC(=O)O)C(=O)O.Cl	{17: 1, 2: 6, 27: 3}
Did not match all atoms present	51806-69-0	CC1=CC(=C(C(=C1)C2CCCCC2)O)C(C)(C)C	{1: 4, 4: 1, 11: 5, 12: 1, 14: 2, 21: 1}
Did not match all atoms present	51806-90-7	CCNC1=CC(=NC2=NC=NN12)C	{1: 2, 2: 1, 35: 3, 33: 1, 14: 2, 31: 1}
Did not match all atoms present	51807-53-5	CCC1=NC=CN1CC	{1: 2, 2: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	5181-10-2	C1=CC(=CC=C1SC2=CC=C(C=C2)Cl)Cl	{40: 1, 17: 2, 14: 8}
Did not match all atoms present	5182-44-5	C1=CC(=CC(=C1)Cl)CCO	{17: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	5183-78-8	CNS(=O)(=O)C1=CC=CC=C1	{1: 1, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	51838-10-9	CNC1=CC2=C(C=C1)C(=O)C(=NNC3=C(C=C(C=C3)OC)S(=O)(=O)O)C(=C2)S(=O)(=O)O	{1: 2, 34: 1, 14: 7, 15: 2, 20: 2, 22: 1, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	51839-16-8	C1=C(C=C(C=C1C(=O)O)I)C(=O)O	{27: 2, 19: 1, 14: 3}
Did not match all atoms present	5184-75-8	CC1=CC(=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)C)C)C	{1: 4, 29: 2, 14: 6}
Did not match all atoms present	51845-86-4	B(O)(O)OCC	{1: 1, 2: 1, 20: 2, 22: 1}
Did not match all atoms present	5185-70-6	C1=CC(=CC=C1N(CCO)CCO)[As](=O)(O)O	{33: 1, 2: 4, 20: 4, 29: 1, 14: 4}
Did not match all atoms present	5185-71-7	C1=CC(=CC=C1N(CCCl)CCCl)[As](=O)(O)O	{33: 1, 2: 4, 14: 4, 17: 2, 20: 2, 29: 1}
Did not match all atoms present	5185-76-2	CCN(CC)C1=CC=C(C=C1)[As](=O)(O)O	{1: 2, 2: 2, 33: 1, 14: 4, 20: 2, 29: 1}
Did not match all atoms present	5185-77-3	C1CS[As](S1)C2=CC=C(C=C2)N(CCCl)CCCl	{33: 1, 2: 4, 41: 2, 11: 2, 14: 4, 17: 2}
Did not match all atoms present	5185-78-4	CCN(CC)C1=CC=C(C=C1)[As]2SCCS2	{1: 2, 2: 2, 33: 1, 41: 2, 11: 2, 14: 4}
Did not match all atoms present	5185-80-8	C1=CC(=CC=C1N(CCO)CCO)[As]=O	{33: 1, 2: 4, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	5185-84-2	COC1CCCCCCC1[Hg]Cl	{1: 1, 11: 6, 12: 2, 22: 1, 17: 1}
Did not match all atoms present	51851-37-7	CCO[Si](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCC)OCC	{16: 13, 1: 3, 2: 5, 4: 6, 22: 3}
Did not match all atoms present	51856-79-2	CN1C=CC=C1CC(=O)OC	{1: 2, 2: 1, 28: 1, 14: 3, 33: 1}
Did not match all atoms present	51858-17-4	C1=CC(=CC=C1N2C(=O)C(=C(N2)C(=O)[O-])/C=C/C=C/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)O)C(=O)O)S(=O)(=O)[O-].[K+].[K+]	{32: 1, 33: 2, 35: 1, 6: 5, 14: 8, 15: 2, 20: 1, 24: 1, 25: 2, 27: 1, 29: 5}
Did not match all atoms present	5186-68-5	CC1=CC(=C(C=C1C(C)C)C(C)C)C	{1: 6, 3: 2, 14: 2}
Did not match all atoms present	51863-60-6	CC(=O)C1=CC(=CC(=C1)O)O	{24: 1, 1: 1, 21: 2, 14: 3}
Did not match all atoms present	51864-09-6	C/C(=C\1/C=CC2=CC=CC=C2C1=O)/NO	{1: 1, 7: 1, 14: 6, 15: 1, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	51865-84-0	CN(C=O)C1=CC=C(C=C1)C(=O)O	{1: 1, 26: 1, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	51866-19-4	CCOC1=NC(=NC2=C1NC=N2)N	{32: 1, 1: 1, 2: 1, 35: 3, 14: 1, 22: 1, 30: 1}
Did not match all atoms present	51867-77-7	C1=CC=C2C(=C1)C=C(C(=O)C2=NNC3=C(C=CC(=C3)Cl)Cl)C(=O)O	{34: 1, 14: 8, 15: 2, 17: 2, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	51867-83-5	CC(=O)NC1=CC(=C(C=C1)Cl)N	{1: 1, 14: 3, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	51868-96-3	CCOP(=O)(CN1CCCC1)OCC	{1: 2, 2: 3, 33: 1, 11: 4, 22: 2, 29: 1}
Did not match all atoms present	5187-77-9	CCCCCCC[NH+](CCCCCCC)CCCCCCC.[N+](=O)([O-])[O-]	{1: 3, 2: 18}
Did not match all atoms present	51872-26-5	COCNC(=S)NCOC	{1: 2, 2: 2, 31: 2, 22: 2, 7: 1}
Did not match all atoms present	51877-44-2	CC(C)SN(C1=CC=CC=C1)P(=O)(N(C2=CC=CC=C2)SC(C)C)N(C3=CC=CC=C3)SC(C)C	{1: 6, 3: 3, 33: 3, 40: 3, 14: 15, 29: 1}
Did not match all atoms present	51877-53-3	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Mn+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	5188-07-8	C[S-].[Na+]	{1: 1}
Did not match all atoms present	51884-03-8	C1=CC(=CC=C1C(=O)NC(=O)N)[N+](=O)[O-]	{24: 2, 38: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	51884-33-4	CC(C)(C)C(=C(C(C)(C)C)[O-])[N+]#N	{1: 6, 34: 1, 4: 2, 7: 2}
Did not match all atoms present	51887-67-3	C=CC1=CC=CC=C1S(=O)(=O)[O-].[Na+]	{14: 4, 5: 1, 6: 1, 29: 3}
Did not match all atoms present	51889-17-9	C1=CC(=C(C=C1Br)Br)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)N	{14: 7, 18: 2, 21: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	5189-40-2	C1CCC(=C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)CC1	{15: 1, 11: 5, 21: 2, 14: 8, 7: 1}
Did not match all atoms present	51896-27-6	CC1=C(C=C(C=C1)S(=O)(=O)N)Cl	{1: 1, 30: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	51897-36-0	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)NC3CCCCC3	{1: 2, 34: 2, 38: 2, 11: 5, 12: 1, 14: 4, 18: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	51897-37-1	CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C	{1: 2, 2: 2, 38: 2, 33: 1, 34: 2, 14: 10, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	51897-39-3	CCN(CC(CO)O)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)NC(=O)C	{1: 2, 2: 3, 3: 1, 37: 2, 38: 1, 33: 1, 34: 2, 14: 5, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	51897-40-6	CCN(CCN1C(=O)CCC1=O)C2=CC(=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])C#N)NC(=O)C	{1: 2, 2: 3, 37: 1, 38: 1, 33: 2, 11: 2, 34: 2, 14: 6, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	51898-39-6	CCCCCCCC(=O)OCC(=O)C1(CC(C2=C(C3=C(C(=C2C1)O)C(=O)C4=C(C3=O)C(=CC=C4)OC)O)OC5CC(C(C(O5)C)O)N)O.Cl	{1: 3, 2: 7, 11: 3, 12: 5, 13: 1, 14: 3, 17: 1, 20: 2, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 28: 1, 30: 1}
Did not match all atoms present	519-04-0	CC1C2=C3C(=C(C=C2CCN1)OC)OCO3	{32: 1, 1: 2, 11: 3, 12: 1, 14: 1, 22: 1, 23: 2}
Did not match all atoms present	519-05-1	COC1=C(C(=C(C=C1)C=O)C(=O)O)OC	{1: 2, 26: 1, 27: 1, 22: 2, 14: 2}
Did not match all atoms present	519-09-5	CN1C2CCC1C(C(C2)OC(=O)C3=CC=CC=C3)C(=O)O	{1: 1, 33: 1, 11: 3, 12: 4, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	519-23-3	CC1=C2C(=C(C3=C1C=CN=C3)C)C4=CC=CC=C4N2	{32: 1, 1: 2, 35: 1, 14: 7}
Did not match all atoms present	519-34-6	C1=CC(=C(C=C1C(=O)C2=C(C=C(C=C2O)O)O)O)O	{24: 1, 21: 5, 14: 5}
Did not match all atoms present	519-37-9	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCO	{1: 2, 2: 2, 35: 1, 33: 3, 14: 1, 20: 1, 25: 2}
Did not match all atoms present	519-44-8	C1=CC(=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])O	{38: 2, 21: 2, 14: 2}
Did not match all atoms present	519-61-9	C1=CC2=CC=CC3=CC=CC(=C1)N23	{33: 1, 14: 9}
Did not match all atoms present	519-65-3	CC(=O)N(C)N(C1=CC=CC=C1)C(=O)C(=O)N(C)C	{24: 3, 1: 4, 14: 5, 33: 3}
Did not match all atoms present	519-72-2	CCN(CC)C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 2, 3: 1, 14: 10, 33: 1}
Did not match all atoms present	519-73-3	C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=CC=C3	{3: 1, 14: 15}
Did not match all atoms present	519-87-9	CC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2	{24: 1, 1: 1, 14: 10, 33: 1}
Did not match all atoms present	519-88-0	CCCCN(CCCC)C(C1=CC=C(C=C1)OC)C(=O)N	{1: 3, 2: 6, 3: 1, 33: 1, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	519-98-2	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC	{1: 3, 31: 1, 33: 2, 14: 5, 25: 1}
Did not match all atoms present	5190-63-6	CC1=NN(C(=O)C1=CC=C2C(C3=CC=CC=C3N2C)(C)C)C4=CC=CC=C4	{1: 4, 35: 1, 6: 2, 33: 2, 13: 1, 14: 9, 15: 3, 25: 1}
Did not match all atoms present	51901-85-0	B1(OC2=CC=CC=C2O1)Br	{18: 1, 14: 4, 23: 2}
Did not match all atoms present	51908-16-8	C1=C(C=C(C(=C1Cl)Cl)C2=CC(=C(C=C2Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	51908-29-3	C1=CC(=CC=C1N=C=S)S(=O)(=O)N	{8: 1, 30: 1, 34: 1, 29: 2, 14: 4}
Did not match all atoms present	5192-03-0	C1=CC2=C(C=CN2)C=C1N	{32: 1, 30: 1, 14: 5}
Did not match all atoms present	51922-16-8	CC1(COC(C(C1NC)O)OC2C(CC(C(C2O)OC3C(CC=C(O3)CNC)N)N)N)O.OS(=O)(=O)O	{1: 3, 2: 1, 11: 3, 12: 10, 13: 1, 14: 1, 15: 1, 20: 5, 22: 2, 23: 2, 29: 2, 30: 3, 31: 2}
Did not match all atoms present	51922-42-0	C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O.C(CO)COCCCO	{28: 4, 2: 6, 20: 2, 22: 1, 14: 6}
Did not match all atoms present	51929-55-6	CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=CC=C3)N	{1: 1, 2: 1, 33: 1, 14: 13, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	51932-77-5	CCC1=C(C(=C(C1=O)CC)C2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 2: 2, 25: 1, 14: 10, 15: 4}
Did not match all atoms present	51934-41-9	CCOC(=O)C1=CC=C(C=C1)I	{1: 1, 2: 1, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	51939-28-7	CCCCOC(=O)C=C.CC(=C)C(=O)O.COC(=O)C=C.C=CC1=CC=CC=C1	{1: 3, 2: 3, 5: 4, 6: 3, 7: 1, 14: 5, 27: 1, 28: 2}
Did not match all atoms present	51940-44-4	CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)O	{32: 1, 1: 1, 2: 1, 35: 2, 33: 2, 11: 4, 14: 2, 25: 1, 27: 1}
Did not match all atoms present	51943-58-9	CCN1C(=CSC1=CC=CC2=[N+](C3=CC=CC=C3O2)CC)C.[I-]	{1: 3, 2: 2, 6: 3, 33: 2, 41: 1, 14: 5, 15: 2, 19: 1, 23: 1}
Did not match all atoms present	51943-99-8	CCOC(=O)OC1=CC(=C(C=C1)OC(=O)OCC)CCC(=O)C2CCCC2=O	{1: 2, 2: 4, 11: 3, 12: 1, 14: 3, 24: 1, 25: 1}
Did not match all atoms present	51944-00-4	CCOC(=O)OC1=CC(=C(C=C1)OC(=O)OCC)CCC(=O)O	{1: 2, 2: 4, 27: 1, 14: 3}
Did not match all atoms present	51944-67-3	C/C=C/C(=O)NCC1=CC=CC=C1	{1: 1, 2: 1, 6: 2, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	51944-68-4	C/C=C/C(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 6: 2, 38: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	51946-13-5	CCCCCCCCCCOCC(CS(=O)(=O)[O-])O.[Na+]	{1: 1, 2: 11, 3: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	51946-14-6	CCCCCCCCOCC(CS(=O)(=O)[O-])O.[Na+]	{1: 1, 2: 9, 3: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	51947-19-4	C1=CC(=CC=C1OC(=C(C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)S(=O)(=O)Cl	{4: 8, 7: 2, 14: 4, 16: 19, 17: 1, 22: 1, 29: 2}
Did not match all atoms present	51951-64-5	CC(C)C[C-]1[CH-][CH-][CH-][CH-][CH-]1.CC(C)CC1=CC=CC=C1.[Cr]	{1: 4, 2: 2, 3: 2, 14: 10, 15: 1}
Did not match all atoms present	51954-76-8	CCN(CC)C(=O)S(=O)CC1=CC=C(C=C1)Cl	{1: 2, 2: 3, 33: 1, 14: 4, 17: 1, 24: 1, 29: 1}
Did not match all atoms present	51955-66-9	CC1=C(C=CC(=C1)Cl)N=NN(C)CC(=O)[O-].[Na+]	{1: 2, 2: 1, 33: 1, 34: 2, 14: 3, 17: 1, 24: 1}
Did not match all atoms present	51955-67-0	CC1=CC=C(C=C1)N=NN(C)CC(=O)[O-].[Na+]	{1: 2, 2: 1, 33: 1, 34: 2, 14: 4, 24: 1}
Did not match all atoms present	51956-20-8	C[N-]C.C[N-]C.C[N-]C.C[N-]C.C[N-]C.C[N-]C.[Mo]#[Mo]	{1: 12, 34: 6}
Did not match all atoms present	51958-56-6	CC1=CC2=C(C(=C(C=C2C=C1)C)C)C	{1: 4, 14: 4}
Did not match all atoms present	51959-14-9	CCC(C)(C)C1=CC(=C(C=C1)OCCCCN)C(C)(C)CC	{1: 6, 2: 6, 4: 2, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	51963-82-7	CCOC1=CC(=C(C=C1N2CCOCC2)OCC)N	{1: 2, 2: 2, 33: 1, 11: 4, 14: 2, 22: 2, 23: 1, 30: 1}
Did not match all atoms present	51964-49-9	C=O.C1=CC=C(C(=C1)O)O.C1=CC(=CC(=C1)O)O	{5: 1, 14: 8, 21: 4}
Did not match all atoms present	5197-95-5	CC[N+](CC)(CC)CC1=CC=CC=C1.[Br-]	{1: 3, 2: 4, 18: 1, 14: 5}
Did not match all atoms present	51971-64-3	C1=C(C=C2C(=C1Cl)C(=O)OC2=O)Cl	{17: 2, 28: 2, 14: 2}
Did not match all atoms present	51976-94-4	CN(C)C(=S)SN(C1CCCCC1)C2CCCCC2	{1: 2, 33: 2, 40: 1, 11: 10, 12: 2, 7: 1}
Did not match all atoms present	51979-57-8	C1=CC(=C(C=C1N=C=O)N=C=O)CCl	{2: 1, 8: 2, 34: 2, 14: 3, 17: 1, 29: 2}
Did not match all atoms present	51980-54-2	C1CCN(C1)C2=CC=C(C=C2)C=O	{33: 1, 26: 1, 11: 4, 14: 4}
Did not match all atoms present	51981-34-1	CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)[O-]	{1: 2, 2: 2, 3: 1, 33: 1, 14: 8, 23: 1, 29: 3}
Did not match all atoms present	51988-26-2	[Li+].C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=CC=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)[O-]	{34: 3, 14: 14, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	52-24-4	C1CN1P(=S)(N2CC2)N3CC3	{33: 3, 11: 6}
Did not match all atoms present	52-26-6	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O.Cl	{1: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	52-28-8	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.OP(=O)(O)O	{1: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 4, 22: 1, 23: 1, 29: 1}
Did not match all atoms present	52-46-0	C1CN1P2(=NP(=NP(=N2)(N3CC3)N4CC4)(N5CC5)N6CC6)N7CC7	{33: 6, 11: 12, 35: 3}
Did not match all atoms present	52-49-3	C1CCC(CC1)C(CCN2CCCCC2)(C3=CC=CC=C3)O.Cl	{33: 1, 2: 2, 4: 1, 11: 10, 12: 1, 14: 5, 17: 1, 20: 1}
Did not match all atoms present	52-53-9	CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC	{1: 7, 2: 5, 3: 1, 4: 1, 37: 1, 33: 1, 14: 6, 22: 4}
Did not match all atoms present	52-60-8	CCOP(=S)(OCC)OC1=CC(=C(C(=C1)C)SC)C	{40: 1, 1: 5, 2: 2, 22: 3, 14: 2}
Did not match all atoms present	52-62-0	C[N+]1(CCCC1)CCCCC[N+]2(CCCC2)C.[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O.[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O	{1: 2, 2: 5, 3: 4, 11: 8, 20: 4, 24: 2, 27: 2}
Did not match all atoms present	52-68-6	COP(=O)(C(C(Cl)(Cl)Cl)O)OC	{1: 2, 3: 1, 4: 1, 17: 3, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	52-85-7	CN(C)S(=O)(=O)C1=CC=C(C=C1)OP(=S)(OC)OC	{1: 4, 33: 1, 22: 3, 14: 4, 29: 2}
Did not match all atoms present	52-86-8	C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(=O)C3=CC=C(C=C3)F	{33: 1, 2: 3, 11: 4, 13: 1, 14: 8, 16: 1, 17: 1, 20: 1, 24: 1}
Did not match all atoms present	52-88-0	C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[N+](=O)([O-])[O-]	{1: 2, 2: 1, 3: 1, 11: 4, 12: 3, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	520-03-6	C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O	{25: 2, 14: 9, 33: 1}
Did not match all atoms present	520-09-2	CC1=C(C(=O)NC(=O)N1)N(CCCl)CCCl	{32: 2, 1: 1, 2: 4, 33: 1, 17: 2, 25: 2}
Did not match all atoms present	520-14-9	C1=C(C=C(C(=C1O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C3=C(C(=O)C4=C(C=C(C=C4O3)O)O)O	{2: 1, 12: 5, 14: 4, 20: 4, 21: 5, 22: 1, 23: 2, 25: 1}
Did not match all atoms present	520-18-3	C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O	{25: 1, 21: 4, 14: 6, 23: 1}
Did not match all atoms present	520-26-3	CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)O)O)O)O)O)O	{1: 2, 2: 1, 11: 1, 12: 11, 14: 5, 20: 6, 21: 2, 22: 3, 23: 3, 25: 1}
Did not match all atoms present	520-28-5	COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=CC=C3)O	{1: 1, 14: 8, 21: 1, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	520-33-2	COC1=C(C=C(C=C1)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)O)O	{1: 1, 11: 1, 12: 1, 14: 5, 21: 3, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	520-36-5	C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O	{25: 1, 21: 3, 14: 7, 23: 1}
Did not match all atoms present	520-52-5	CN(C)CCC1=CNC2=C1C(=CC=C2)OP(=O)(O)O	{32: 1, 1: 2, 2: 2, 33: 1, 14: 4, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	520-53-6	CN(C)CCC1=CNC2=C1C(=CC=C2)O	{32: 1, 1: 2, 2: 2, 33: 1, 14: 4, 21: 1}
Did not match all atoms present	520-69-4	CCC1=C(NC(=C1C)C)C	{32: 1, 1: 4, 2: 1}
Did not match all atoms present	52005-46-6	C1=CC(=C(C2=C1C(=O)OC2=O)Cl)Cl	{17: 2, 28: 2, 14: 2}
Did not match all atoms present	52014-82-1	[O-2].[Ti].[Ce]	{}
Did not match all atoms present	52018-21-0	[B-](F)(F)(F)F.COC1=CC(=C(C=C1[N+]#N)OC)N2CCCC2	{1: 2, 34: 1, 33: 1, 11: 4, 14: 2, 16: 4, 22: 2}
Did not match all atoms present	52018-28-7	[B-](F)(F)(F)F.COC1=CC(=C(C=C1[N+]#N)OC)N2CCOCC2	{1: 2, 34: 1, 33: 1, 11: 4, 14: 2, 16: 4, 22: 2, 23: 1}
Did not match all atoms present	52018-82-3	CC(=O)NC1=CC=C(C=C1)C(=O)C[N+](C)(C)C.[Cl-]	{1: 4, 2: 1, 14: 4, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	5202-85-7	C1=CC(=C(C=C1Cl)C(=O)N)N	{24: 1, 17: 1, 30: 2, 14: 3}
Did not match all atoms present	5202-89-1	COC(=O)C1=C(C=CC(=C1)Cl)N	{1: 1, 28: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	52022-77-2	C1=CC(=CC(=C1)[N+](=O)[O-])CCO	{2: 2, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	5203-14-5	CCCCOC1=CC=C(C=C1)C#N	{1: 1, 2: 3, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	52031-72-8	CC(C)C1=CC=C(C=C1)C(C)(C)OOC(C)(C)C	{1: 7, 3: 1, 4: 2, 22: 2, 14: 4}
Did not match all atoms present	52033-73-5	CCCCCCCCCC1=CC=CC=C1NC2=CC=CC=C2	{1: 1, 2: 8, 14: 9, 31: 1}
Did not match all atoms present	52046-75-0	COC(=O)C(=C1SC(=C(C#N)C(=O)OC)S1)C#N	{1: 2, 41: 2, 28: 2, 37: 2, 7: 2}
Did not match all atoms present	52047-59-3	CCCCCCCCCCCCC1=CC=C(C=C1)C2=CC3=CC=CC=C3N2	{32: 1, 1: 1, 2: 11, 14: 9}
Did not match all atoms present	52048-31-4	CCN(CC)C1=CC=C(C=C1)N=NC2=NC=CS2	{1: 2, 2: 2, 35: 1, 33: 1, 41: 1, 34: 2, 14: 6}
Did not match all atoms present	5205-11-8	CC(=CCOC(=O)C1=CC=CC=C1)C	{1: 2, 2: 1, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	5205-82-3	C[N+]1(CCCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.COS(=O)(=O)[O-]	{1: 3, 2: 1, 4: 1, 11: 4, 12: 1, 14: 10, 20: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	52057-53-1	C1C2CC3(CC1CC(C2)(C3)CC[Si](Cl)(Cl)Cl)CC[Si](Cl)(Cl)Cl	{17: 6, 2: 4, 11: 6, 12: 2, 13: 2}
Did not match all atoms present	52059-53-7	C1=CC(=CC(=C1)F)CCO	{16: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	5206-47-3	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Zr+4]	{24: 4, 1: 4, 2: 24}
Did not match all atoms present	52062-92-7	C1=CC(=CC=C1CCBr)C(=O)O	{2: 2, 27: 1, 18: 1, 14: 4}
Did not match all atoms present	52072-38-5	CCCCCCCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 6, 3: 1, 14: 10}
Did not match all atoms present	52073-04-8	CCNC(=O)N(C)C1=CC=CC=C1	{1: 2, 2: 1, 33: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	52075-14-6	CC1=NC(C(O1)C2=CC=CC=C2)COC	{1: 2, 2: 1, 35: 1, 12: 2, 14: 5, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	52077-53-9	CC1=NN2C=NN=C2C(=C1)[O-].[NH4+]	{1: 1, 35: 3, 14: 2, 33: 1}
Did not match all atoms present	52078-66-7	CCN1C2=C(C=C(C(=C2)C)C)OC1=CC=CC3=[N+](C4=C(O3)C=C(C(=C4)C)C)CC.[I-]	{1: 6, 2: 2, 6: 3, 33: 2, 14: 4, 15: 1, 19: 1, 23: 2}
Did not match all atoms present	5208-87-7	C=CC(C1=CC2=C(C=C1)OCO2)O	{3: 1, 5: 1, 6: 1, 11: 1, 14: 3, 20: 1, 23: 2}
Did not match all atoms present	52083-12-2	C1=CC2=C(C=CC3=C2C(=C1)C(=O)OC3=O)S(=O)(=O)O	{28: 2, 20: 1, 29: 2, 14: 5}
Did not match all atoms present	52085-52-6	CN(CCCl)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 2: 2, 38: 1, 33: 1, 34: 2, 14: 7, 17: 2}
Did not match all atoms present	5209-18-7	C1=CC=C(C=C1)C/C=C/C2=CC=CC=C2	{2: 1, 14: 10, 6: 2}
Did not match all atoms present	5209-33-6	C1CC2=CC=CC3=C(C=CC1=C23)Cl	{17: 1, 11: 2, 14: 5}
Did not match all atoms present	52093-26-2	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[La+3]	{16: 9, 4: 3, 29: 9}
Did not match all atoms present	52093-30-8	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Y+3]	{16: 9, 4: 3, 29: 9}
Did not match all atoms present	52094-42-5	CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 40}
Did not match all atoms present	52094-50-5	CC(C)(CO)COC(=O)C(C)(C)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{1: 4, 2: 3, 4: 2, 14: 7, 20: 2, 27: 3, 28: 3}
Did not match all atoms present	52098-13-2	C1=CC=C2C(=C1)C=C(N2)C(=O)CO	{24: 1, 32: 1, 2: 1, 20: 1, 14: 5}
Did not match all atoms present	52098-14-3	CN1C2=CC=CC=C2C=C1C(=O)CO	{1: 1, 2: 1, 33: 1, 14: 5, 20: 1, 24: 1}
Did not match all atoms present	52098-15-4	CC1=C(NC2=CC=CC=C12)C(=O)CO	{32: 1, 1: 1, 2: 1, 14: 4, 20: 1, 24: 1}
Did not match all atoms present	52098-16-5	C1=CC=C(C=C1)CN2C3=CC=CC=C3C=C2C(=O)CO	{24: 1, 33: 1, 2: 2, 20: 1, 14: 10}
Did not match all atoms present	52098-17-6	CN1C2=CC=CC=C2C=C1C(=O)COC	{1: 2, 2: 1, 33: 1, 14: 5, 22: 1, 24: 1}
Did not match all atoms present	52098-18-7	CC1=C(NC2=CC=CC=C12)C(=O)COC	{32: 1, 1: 2, 2: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	52098-56-3	CCC(=O)N(CC1=CC=CC=C1)C2CC(N(C(C2)(C)C)CC)(C)C	{1: 6, 2: 3, 33: 2, 11: 2, 12: 1, 13: 2, 14: 5, 24: 1}
Did not match all atoms present	52099-72-6	CC(=C)N1C2=CC=CC=C2NC1=O	{32: 1, 1: 1, 5: 1, 7: 1, 14: 4, 25: 1, 33: 1}
Did not match all atoms present	521-24-4	C1=CC=C2C(=C1)C(=CC(=O)C2=O)S(=O)(=O)[O-].[Na+]	{25: 2, 29: 3, 14: 5, 15: 1}
Did not match all atoms present	521-31-3	C1=CC2=C(C(=C1)N)C(=O)NNC2=O	{32: 2, 25: 2, 30: 1, 14: 3}
Did not match all atoms present	521-35-7	CCCCCC1=CC2=C(C(=C1)O)C3=C(C=CC(=C3)C)C(O2)(C)C	{1: 4, 2: 4, 13: 1, 14: 5, 21: 1, 23: 1}
Did not match all atoms present	521-37-9	CCCCCC1=CC(=C(C(=C1)O)C2C=C(CCC2C(=C)C)C)O	{1: 3, 2: 4, 5: 1, 7: 1, 11: 2, 12: 2, 14: 3, 15: 1, 21: 2}
Did not match all atoms present	521-74-4	C1=CC2=C(C(=C(C=C2Br)Br)O)N=C1	{18: 2, 35: 1, 21: 1, 14: 4}
Did not match all atoms present	521-78-8	CC(CN1C2=CC=CC=C2CCC3=CC=CC=C31)CN(C)C.C(=C\C(=O)O)\C(=O)O	{1: 3, 2: 2, 3: 1, 6: 2, 33: 2, 11: 2, 14: 8, 27: 2}
Did not match all atoms present	521-85-7	C[C@@H]1C2=C(CN(CCC3=CC4=C(C=C3C1=O)OCO4)C)C5=C(C=C2)OCO5	{1: 2, 33: 1, 11: 5, 12: 1, 14: 4, 23: 4, 25: 1}
Did not match all atoms present	52106-86-2	CC1=C(C=CC(=C1)Cl)[O-].[Na+]	{1: 1, 14: 3, 17: 1}
Did not match all atoms present	52109-66-7	C1=CC=C(C=C1)C2=CN=C(C(=N2)C#N)C#N	{35: 2, 37: 2, 14: 6}
Did not match all atoms present	52109-67-8	CC1=NC(=C(N=C1C2=CC=CC=C2)C#N)C#N	{1: 1, 35: 2, 37: 2, 14: 5}
Did not match all atoms present	5211-62-1	CC(=O)CC1=CC=CC=C1OC	{24: 1, 1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	52110-05-1	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Mg+2].[Zr+4]	{29: 9}
Did not match all atoms present	52112-07-9	CCCC[Sn](CCCC)(OC(=O)C(Cl)(Cl)Cl)O[Sn](CCCC)(CCCC)OC(=O)C(Cl)(Cl)Cl	{1: 4, 2: 12, 4: 2, 17: 6, 22: 1, 28: 2}
Did not match all atoms present	52112-09-1	CCCC[Sn](CCCC)(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F	{16: 6, 1: 2, 2: 6, 4: 2, 28: 2}
Did not match all atoms present	52112-66-0	C1=CC2=C(C=C1Br)OC(=N2)N	{18: 1, 35: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	52112-67-1	C1=C(C=C2C(=C1Br)OC(=N2)N)Br	{18: 2, 35: 1, 30: 1, 14: 2, 23: 1}
Did not match all atoms present	52112-68-2	C1=CC2=C(C=C1Cl)OC(=N2)N	{17: 1, 35: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	52115-81-8	C1CN=C(N1)CC2=C(C=CC=C2Cl)Cl	{32: 1, 2: 1, 35: 1, 11: 2, 14: 3, 15: 1, 17: 2}
Did not match all atoms present	52123-15-6	CCOC(=CC1=[N+](C2=CC=CC=C2S1)CCC(C)S(=O)(=O)[O-])C	{1: 3, 2: 3, 3: 1, 33: 1, 6: 1, 7: 1, 41: 1, 14: 4, 22: 1, 29: 3}
Did not match all atoms present	52125-43-6	CC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC(=C(C4=CC=CC=C43)[O-])[N+]#N	{1: 2, 34: 1, 3: 1, 14: 13, 22: 1, 29: 2}
Did not match all atoms present	52126-51-9	C1C(=NN(C1=O)C2=CC=C(C=C2)S(=O)(=O)O)C(=O)[O-].[Na+]	{33: 1, 35: 1, 11: 1, 14: 4, 15: 1, 20: 1, 24: 1, 25: 1, 29: 2}
Did not match all atoms present	52129-61-0	CC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]	{24: 1, 1: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	52129-70-1	CC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)[N+](=O)[O-]	{24: 1, 1: 1, 38: 2, 14: 2, 17: 1}
Did not match all atoms present	52129-71-2	CCCN(CCC)C1=C(C=C(C=C1[N+](=O)[O-])C(=O)C)[N+](=O)[O-]	{1: 3, 2: 4, 38: 2, 33: 1, 14: 2, 24: 1}
Did not match all atoms present	5213-47-8	CC1=C(N=C(N1)[N+](=O)[O-])C	{32: 1, 1: 2, 35: 1, 38: 1}
Did not match all atoms present	52130-17-3	CC1=C(C=CC=C1N)C(=O)O	{1: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	52132-61-3	C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C=O	{26: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	52136-46-6	CC1=C(C=C(C=C1)N=C=O)N=C=O.C1CCC(=O)OCC1	{1: 1, 34: 2, 8: 2, 11: 5, 14: 3, 28: 1, 29: 2}
Did not match all atoms present	52140-06-4	[Ga+3].[OH-].[OH-]	{}
Did not match all atoms present	52140-35-9	[Be+2].[CH-]1C=CC=C1.[Br-]	{18: 1, 14: 5}
Did not match all atoms present	52140-36-0	[Be+2].C#[C-].[CH-]1C=CC=C1	{9: 1, 14: 5}
Did not match all atoms present	52152-93-9	C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)S(=O)(=O)[O-])C(=O)[O-])C[N+]4=CC=C(C=C4)C(=O)N.[Na+]	{33: 2, 2: 1, 3: 1, 41: 1, 11: 1, 12: 2, 14: 9, 15: 2, 24: 3, 25: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	52157-57-0	CC1=CC=C(O1)CCl	{1: 1, 2: 1, 23: 1, 14: 2, 17: 1}
Did not match all atoms present	52158-21-1	C1=CC=C(C=C1)C(=C(C(=O)O)F)F	{16: 2, 27: 1, 14: 5, 7: 2}
Did not match all atoms present	5216-17-1	C1=C(C(=C(C(=C1F)F)C#N)F)F	{16: 4, 37: 1, 14: 1}
Did not match all atoms present	5216-25-1	C1=CC(=CC=C1C(Cl)(Cl)Cl)Cl	{17: 4, 4: 1, 14: 4}
Did not match all atoms present	5216-32-0	CCC(=O)C1=C(C=CC(=C1)Cl)NC(=O)C2=CC=CC=C2	{1: 1, 2: 1, 14: 8, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	5216-35-3	C1=CC(=CC=C1CCC2=CC=C(C=C2)Cl)Cl	{17: 2, 2: 2, 14: 8}
Did not match all atoms present	5216-36-4	C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)C#N)C#N	{14: 8, 6: 2, 37: 2}
Did not match all atoms present	52166-72-0	C1=CC(=C(C=C1Cl)[O-])Cl.[Na+]	{17: 2, 14: 3}
Did not match all atoms present	5217-47-0	CCN1C(=O)CC(=O)N(C1=S)CC	{1: 2, 2: 2, 33: 2, 11: 1, 15: 1, 25: 2}
Did not match all atoms present	5217-54-9	CC[N+]1=C(OC2=CC=CC=C21)C=CC=CN(C3=CC=CC=C3)C(=O)C.[I-]	{1: 2, 2: 1, 6: 4, 33: 2, 14: 9, 19: 1, 23: 1, 24: 1}
Did not match all atoms present	5217-59-4	CC1=CC(=O)N2C(=C1)N=CN2	{32: 1, 1: 1, 35: 1, 33: 1, 14: 3, 25: 1}
Did not match all atoms present	52170-97-5	[CH3-].[CH3-].[CH3-].C[PH+](C1=CC=CC=C1)C2=CC=CC=C2.[Au]	{1: 1, 14: 10}
Did not match all atoms present	52171-37-6	CC(C)OC1=CC=C(C=C1)/C=C/C(=O)C2=C(C3=C(C(=C2OCC[NH+](C)C)OC)OC=C3)OC.C(=C\C(=O)[O-])\C(=O)O	{1: 6, 2: 2, 3: 1, 6: 4, 14: 6, 22: 4, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	52171-41-2	C[NH+](C)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=C(C=C3)O)OC)OC.C(=O)(C(=O)[O-])O	{1: 4, 2: 2, 6: 2, 14: 6, 21: 1, 22: 3, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	52171-42-3	COC1=C(C(=C(C2=C1C=CO2)OC)OCC[NH+]3CCCC3)C(=O)/C=C/C4=CC=C(C=C4)O.C(=C\C(=O)[O-])\C(=O)O	{1: 2, 2: 2, 6: 4, 11: 4, 14: 6, 21: 1, 22: 3, 23: 1, 24: 2, 27: 1}
Did not match all atoms present	52171-92-3	CC1=CC=CC2=C3C=CC4=CC=CC=C4C3=C(C=C12)C	{1: 2, 14: 10}
Did not match all atoms present	52171-93-4	CC1=CCCC2=C3C=CC4=CC=CC=C4C3=C(C=C12)C	{1: 2, 11: 2, 14: 8, 15: 1}
Did not match all atoms present	52171-94-5	CC1CCCC2=C3C=CC4=CC=CC=C4C3=C(C=C12)C	{1: 2, 11: 3, 12: 1, 14: 7}
Did not match all atoms present	52175-10-7	C1=NC2=C(N1)C(=NC=N2)N.OP(=O)(O)O	{32: 1, 35: 3, 14: 2, 20: 3, 29: 1, 30: 1}
Did not match all atoms present	52182-15-7	CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O	{1: 1, 2: 1, 4: 1, 14: 10, 20: 1, 28: 1}
Did not match all atoms present	52184-19-7	CCC(C)(C)C1=C/C(=N\NC2=CC=CC=C2[N+](=O)[O-])/C(=O)C(=C1)C(C)(C)CC	{1: 6, 2: 2, 4: 2, 38: 1, 34: 1, 14: 6, 15: 3, 25: 1, 31: 1}
Did not match all atoms present	52184-29-9	CC(C)(C)C1=CC(=NNC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C(=C1)C(C)(C)C	{1: 6, 34: 1, 4: 2, 38: 1, 14: 5, 15: 3, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	52185-71-4	CC1(CC(CC(N1CC2=CC=CC=C2)(C)C)O)C	{1: 4, 2: 1, 33: 1, 11: 2, 12: 1, 13: 2, 14: 5, 20: 1}
Did not match all atoms present	52189-63-6	COC1=CC(=CC(=C1)F)OC	{16: 1, 1: 2, 22: 2, 14: 3}
Did not match all atoms present	5219-07-8	CC(=O)C(C#N)C1=CC=C(C=C1)Cl	{1: 1, 3: 1, 37: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	5219-17-0	CCC1=C(C(=O)OC2=C1C=CC(=C2)O)C3=CC=C(C=C3)OC	{1: 2, 2: 1, 14: 7, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	5219-48-7	CCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)Cl	{1: 1, 2: 5, 6: 1, 34: 1, 14: 8, 17: 1, 22: 1}
Did not match all atoms present	5219-49-8	CCCCCCOC1=CC=C(C=C1)C=NC2=CC=CC=C2	{1: 1, 34: 1, 6: 1, 2: 5, 14: 9, 22: 1}
Did not match all atoms present	5219-61-4	C1=CC=C(C=C1)SCC#N	{40: 1, 2: 1, 37: 1, 14: 5}
Did not match all atoms present	52195-07-0	[H+].[H+].C1CNCCN1.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{11: 4, 24: 4, 3: 4, 29: 4, 32: 2}
Did not match all atoms present	52196-74-4	CCOC1=CC(=C(C=C1)OCC)Cl	{1: 2, 2: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	52199-46-9	CCOC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)OCC)OCC	{24: 1, 1: 3, 2: 3, 22: 3, 14: 7}
Did not match all atoms present	522-00-9	CCN(CC)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31	{1: 3, 2: 3, 3: 1, 33: 2, 41: 1, 14: 8}
Did not match all atoms present	522-12-3	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O	{1: 1, 12: 5, 14: 5, 20: 3, 21: 4, 22: 1, 23: 2, 25: 1}
Did not match all atoms present	522-16-7	COC1=CC=C(C=C1)C2=C(C(=O)C3=CC(=C(C(=C3O2)OC)OC)OC)OC	{1: 5, 25: 1, 22: 5, 14: 5, 23: 1}
Did not match all atoms present	522-24-7	CN(C)CCN1C2=CC=CC=C2SC3=CC=CC=C31	{1: 2, 2: 2, 41: 1, 14: 8, 33: 2}
Did not match all atoms present	522-25-8	C1CCN(C1)CCN2C3=CC=CC=C3SC4=CC=CC=C42.Cl	{33: 2, 2: 2, 41: 1, 11: 4, 14: 8, 17: 1}
Did not match all atoms present	522-40-7	CC/C(=C(/CC)\C1=CC=C(C=C1)OP(=O)(O)O)/C2=CC=C(C=C2)OP(=O)(O)O	{1: 2, 2: 2, 7: 2, 14: 8, 20: 4, 22: 2, 29: 2}
Did not match all atoms present	522-48-5	C1CC(C2=CC=CC=C2C1)C3=NCCN3.Cl	{32: 1, 35: 1, 11: 5, 12: 1, 14: 4, 15: 1, 17: 1}
Did not match all atoms present	522-57-6	COC1=C(C=C(C=C1)C(=O)C2=NC=CC3=CC(=C(C=C32)OC)OC)OC	{24: 1, 1: 4, 35: 1, 22: 4, 14: 7}
Did not match all atoms present	522-75-8	C1=CC=C2C(=C1)C(=O)C(=C3C(=O)C4=CC=CC=C4S3)S2	{25: 2, 41: 2, 14: 8, 15: 2}
Did not match all atoms present	52200-48-3	C1=CC(=C(N=C1)Cl)Br	{17: 1, 18: 1, 35: 1, 14: 3}
Did not match all atoms present	52204-20-3	CC1(C2=CC=CC=C2[N+](=C1/C=C/N3C(CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C)C.[Cl-]	{1: 3, 35: 1, 6: 2, 33: 2, 11: 1, 12: 1, 13: 1, 14: 14, 15: 2, 17: 1}
Did not match all atoms present	52205-73-9	CC12CCC3C(C1CC[C@@H]2OP(=O)([O-])[O-])CCC4=C3C=CC(=C4)OC(=O)N(CCCl)CCCl.[Na+].[Na+]	{1: 1, 2: 4, 33: 1, 11: 6, 12: 4, 13: 1, 14: 3, 17: 2, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	52207-48-4	CN(C)C(CSS(=O)(=O)[O-])CSS(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 2, 3: 1, 33: 1, 40: 2, 29: 6}
Did not match all atoms present	52207-87-1	CCOC1=NN(C(=O)C(=C1)NCCCN(C)C)C2=CC=CC=C2.Cl	{1: 3, 2: 4, 35: 1, 33: 2, 14: 6, 17: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	52208-11-4	C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC(=N)N.Br	{33: 1, 2: 2, 36: 1, 7: 1, 40: 1, 14: 4, 18: 1, 25: 2, 30: 1}
Did not match all atoms present	5221-16-9	CC1=C(C=CC(=C1)Cl)OCC(=O)[O-].[K+]	{1: 1, 2: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	5221-42-1	CC(=O)NC1=CC=NC=C1	{24: 1, 1: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	5221-53-4	CCCCC1=C(NC(=NC1=O)N(C)C)C	{32: 1, 1: 4, 2: 3, 35: 1, 33: 1, 25: 1}
Did not match all atoms present	52211-63-9	COC1=CC2=C(C=CN=C2C=C1)C(=O)CC[C@@H]3CCNC[C@@H]3C=C	{32: 1, 1: 1, 2: 2, 35: 1, 5: 1, 6: 1, 11: 3, 12: 2, 14: 5, 22: 1, 24: 1}
Did not match all atoms present	52212-02-9	CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N4CC[N+](CC4)(C)C)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)N6CC[N+](CC6)(C)C)C.[Br-].[Br-]	{1: 8, 33: 2, 11: 15, 12: 8, 13: 2, 18: 2, 28: 2}
Did not match all atoms present	52214-84-3	CC(C)(C(=O)O)OC1=CC=C(C=C1)C2CC2(Cl)Cl	{1: 2, 4: 1, 11: 1, 12: 1, 13: 1, 14: 4, 17: 2, 22: 1, 27: 1}
Did not match all atoms present	52217-52-4	C=CCCCCCC[Si](Cl)(Cl)Cl	{17: 3, 2: 6, 5: 1, 6: 1}
Did not match all atoms present	52217-57-9	CO[Si](CCCCCCC=C)(OC)OC	{1: 3, 2: 6, 22: 3, 5: 1, 6: 1}
Did not match all atoms present	52218-35-6	C1=CC2=C(C=CC(=C2)S(=O)(=O)CCO)C=C1N	{2: 2, 30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	5222-73-1	COC1=C(C(=O)C1=O)OC	{1: 2, 22: 2, 25: 2}
Did not match all atoms present	52221-67-7	C(O)[P+](CO)(CO)CO.C(O)[P+](CO)(CO)CO.C(=O)(C(=O)[O-])[O-]	{24: 2, 2: 8, 20: 8}
Did not match all atoms present	52222-87-4	C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)C=C(C=C3)O	{24: 1, 21: 1, 14: 11}
Did not match all atoms present	5223-61-0	CCC(C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 1, 4: 1, 14: 10}
Did not match all atoms present	52235-55-9	C1=CC(=CC(=C1)CNC(=O)O)CN	{2: 2, 27: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	52235-92-4	CC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O.C(CO)O.C12=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)OC2=O	{1: 1, 2: 3, 3: 1, 14: 6, 18: 4, 20: 4, 28: 6}
Did not match all atoms present	52236-29-0	CCS(=O)C(=O)N1CCCCCC1	{1: 1, 2: 1, 33: 1, 11: 6, 24: 1, 29: 1}
Did not match all atoms present	52237-03-3	C1=CC=C(C=C1)C2=NN(N=C2)C3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)N5N=CC(=N5)C6=CC=CC=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+]	{33: 2, 35: 4, 14: 18, 6: 2, 29: 6}
Did not match all atoms present	52237-05-5	C1=CC=C2C(=C1)C=C(C(=N2)C3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)Cl)O	{35: 1, 12: 1, 14: 8, 17: 1, 21: 1, 24: 1, 25: 2}
Did not match all atoms present	52238-94-5	C1=CC=C2C(=C1)C=C(C(=O)C2=NNC3=C(C=CC(=C3)C(F)(F)F)Cl)C(=O)O	{34: 1, 4: 1, 14: 8, 15: 2, 16: 3, 17: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	52240-18-3	C1CCC(C(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O	{11: 4, 12: 2, 14: 4, 17: 1, 24: 1, 27: 1}
Did not match all atoms present	52240-19-4	C1CC[C@H]([C@@H](C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O	{11: 4, 12: 2, 14: 4, 17: 1, 24: 1, 27: 1}
Did not match all atoms present	52240-20-7	C[C@@H](CC(=O)C1=CC=C(C=C1)Cl)C(=O)[O-]	{1: 1, 2: 1, 3: 1, 14: 4, 17: 1, 24: 2}
Did not match all atoms present	52243-33-1	CC1=CC=C(C=C1)S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 6, 33: 1, 14: 4, 20: 4, 29: 2}
Did not match all atoms present	52244-06-1	COC1=C(C=C2C(NCCC2=C1)CC#N)OC	{32: 1, 1: 2, 2: 1, 37: 1, 11: 2, 12: 1, 14: 2, 22: 2}
Did not match all atoms present	52244-70-9	COC1=CC=C(C=C1)CCCCO	{1: 1, 2: 4, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	52251-71-5	CCC1=CC2=CC3=CC=CC=C3C=C2C=C1	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	52256-37-8	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Cr+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 14: 16, 15: 4, 25: 2}
Did not match all atoms present	52256-38-9	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Co+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 14: 16, 15: 4, 25: 2}
Did not match all atoms present	52256-39-0	[H+].CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Co+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 17, 15: 4, 24: 1, 25: 2}
Did not match all atoms present	52256-40-3	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-])[O-].[Cr+3]	{1: 1, 34: 4, 35: 1, 33: 1, 14: 17, 29: 4, 30: 2}
Did not match all atoms present	52256-80-1	CC(C)(C1=CC=C(C=C1)OC2=CC=CC3=C2C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)OC6=O	{1: 2, 4: 1, 22: 2, 14: 14, 28: 4}
Did not match all atoms present	52258-02-3	CC(=O)NC1=CC(=C(C=C1)OC)NCC2=CC=CC=C2	{1: 2, 2: 1, 14: 8, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	5226-48-2	C1=CC=C(C(=C1)[N+]2=NOC(=C2)[O-])Cl	{17: 1, 35: 1, 33: 1, 14: 5, 23: 1}
Did not match all atoms present	52260-30-7	CSC1=CC=CC=C1N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 40: 1, 29: 1}
Did not match all atoms present	52260-82-9	C(C(=O)[O-])(C(=O)[O-])O.N.N.[Pt+2]	{24: 2, 3: 1, 20: 1}
Did not match all atoms present	52262-38-1	CC1=C(C=C(C(=C1Br)O)C(C)C)Br	{1: 3, 18: 2, 3: 1, 21: 1, 14: 1}
Did not match all atoms present	52262-58-5	[O-]P(=O)([O-])F.[Sn+2]	{16: 1, 29: 3}
Did not match all atoms present	52267-39-7	COC(=O)CC(=O)OCC1=CC=CC=C1	{1: 1, 2: 2, 28: 2, 14: 5}
Did not match all atoms present	5227-71-4	CC1(C(=C)N(C2=CC=CC=C21)C3=CC=CC=C3)C	{1: 2, 5: 1, 33: 1, 13: 1, 14: 9, 15: 1}
Did not match all atoms present	52273-60-6	C1=CC(=CC=C1CCCl)N	{17: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	52273-67-3	CC(=O)NC1=CC=C(C=C1)CCCl	{1: 1, 2: 2, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	52277-69-7	[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=C(C=CC3=O)N([O-])[O-].[Co+3]	{25: 2, 34: 4, 38: 1, 14: 18, 15: 3}
Did not match all atoms present	52277-73-3	[H+].CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])[O-].[Co+3]	{1: 1, 34: 4, 35: 1, 38: 1, 33: 1, 14: 17, 15: 4, 25: 2}
Did not match all atoms present	52278-77-0	C1C(C(OC1N2C=C(C(=NC2=O)N)O)CO)O	{33: 1, 2: 1, 35: 1, 11: 1, 12: 3, 14: 1, 20: 2, 21: 1, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	52279-59-1	CN1C(=CN=C1/C=N/N2CC(OC2=O)CN3CCOCC3)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 6: 1, 33: 3, 11: 5, 12: 1, 34: 1, 14: 1, 23: 1, 28: 1}
Did not match all atoms present	52279-66-0	CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)OP(=O)(O)O)C(C)C)C(C)C)O.CC(CO)(CO)N	{1: 7, 2: 2, 3: 2, 4: 1, 13: 1, 14: 8, 20: 4, 21: 1, 22: 1, 28: 1, 29: 1, 30: 1}
Did not match all atoms present	5228-48-8	CN1C=C2C=C(C=CC2=N1)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	52284-35-2	CC(C)CCCCCCCOC(=O)C1=CC(=CC=C1)C(=O)OCCCCCCCC(C)C	{1: 4, 2: 14, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	52285-42-4	C1=CC(=CC=C1N)SC2=CC=C(C=C2)N.Cl.Cl	{40: 1, 17: 2, 30: 2, 14: 8}
Did not match all atoms present	52286-11-0	C=CC=O.C=CC(=O)[O-].[Na+]	{24: 1, 26: 1, 5: 2, 6: 2}
Did not match all atoms present	52286-56-3	CCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[K+]	{1: 1, 2: 7, 29: 3, 14: 4}
Did not match all atoms present	52287-51-1	C1COC2=C(O1)C=CC(=C2)Br	{18: 1, 11: 2, 14: 3, 23: 2}
Did not match all atoms present	52298-01-8	C1NC2=C3C(=C(C=C2C(=O)O1)[N+](=O)[O-])C(=O)C4=CC=CC=C4C3=O	{32: 1, 38: 1, 11: 1, 14: 5, 25: 2, 28: 1}
Did not match all atoms present	52298-44-9	COC1=CC(=C(C=C1N)OC)S(=O)(=O)NC2=CC=CC=C2	{1: 2, 14: 7, 22: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	52298-71-2	CN(C)C1=NC(=NC(=N1)N(C)CCO)N(C)C	{1: 5, 2: 2, 35: 3, 20: 1, 33: 3}
Did not match all atoms present	52299-73-7	CC[N+]1=C(OC2=C1C3=CC=CC=C3C=C2)C.[I-]	{1: 2, 2: 1, 33: 1, 14: 6, 19: 1, 23: 1}
Did not match all atoms present	523-21-7	C1(=C(C(=O)C(=O)C(=O)C1=O)[O-])[O-].[Na+].[Na+]	{25: 4}
Did not match all atoms present	523-27-3	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2Br)Br	{18: 2, 14: 8}
Did not match all atoms present	523-42-2	CC(C)CCN1C=CC(=CC2=CC=[N+](C3=CC=CC=C23)CCC(C)C)C4=CC=CC=C41.[I-]	{1: 4, 2: 4, 3: 2, 6: 1, 33: 2, 14: 12, 15: 1, 19: 1}
Did not match all atoms present	523-44-4	C1=CC=C2C(=O)C=C/C(=N\NC3=CC=C(C=C3)S(=O)(=O)[O-])/C2=C1.[Na+]	{34: 1, 14: 10, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	523-50-2	C1=CC2=C(C=CO2)C3=C1C=CC(=O)O3	{28: 1, 14: 6, 23: 1}
Did not match all atoms present	523-80-8	COC1=C2C(=C(C(=C1)CC=C)OC)OCO2	{1: 2, 2: 1, 5: 1, 6: 1, 11: 1, 14: 1, 22: 2, 23: 2}
Did not match all atoms present	523-87-5	CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2	{32: 1, 1: 4, 2: 2, 3: 1, 33: 3, 14: 10, 17: 1, 35: 1, 22: 1, 25: 2}
Did not match all atoms present	5230-78-4	CC1=C(C(=CC(=C1F)F)F)F	{16: 4, 1: 1, 14: 1}
Did not match all atoms present	52301-18-5	CC(=C)O[Si](C1=CC=CC=C1)(OC(=C)C)OC(=C)C	{1: 3, 22: 3, 5: 3, 14: 5, 7: 3}
Did not match all atoms present	52301-88-9	C1=CC(=C(C=C1[N+](=O)[O-])Cl)CO	{17: 1, 2: 1, 20: 1, 38: 1, 14: 3}
Did not match all atoms present	52302-51-9	C1[NH+]2CN3CN1CN(C2)C3.C(#N)[S-]	{33: 3, 11: 6, 37: 1}
Did not match all atoms present	52303-01-2	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=CC=C4)C(=O)C5=C(C=CC(=C5C3=O)O)O	{25: 2, 21: 2, 14: 14, 31: 2}
Did not match all atoms present	52303-15-8	COP(OC)OC.C(COCCO)O	{1: 3, 2: 4, 20: 2, 22: 4}
Did not match all atoms present	52303-93-2	CCCCC(=O)[O-].CCCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 6}
Did not match all atoms present	52304-21-9	CCCCCCCCCCCCCCOS(=O)(=O)O.N	{1: 1, 2: 13, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	5231-87-8	CCOC1=C(C(=O)C1=O)OCC	{1: 2, 2: 2, 22: 2, 25: 2}
Did not match all atoms present	52315-07-8	CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C	{1: 2, 3: 1, 37: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	5232-99-5	CCOC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C#N	{1: 1, 2: 1, 37: 1, 7: 2, 14: 10, 28: 1}
Did not match all atoms present	52320-66-8	CCOC1=CC=C(C=C1)NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1, 34: 2, 14: 7, 17: 1, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	52323-02-1	C(#P)Cl	{17: 1, 10: 1}
Did not match all atoms present	52326-84-8	C1=CC=C(C=C1)C2=C3C(=C(C=C2)C4=CC=CC=C4)C3(F)F	{16: 2, 13: 1, 14: 12}
Did not match all atoms present	52329-60-9	C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)N=C(N3)N	{24: 1, 32: 1, 35: 1, 30: 1, 14: 8}
Did not match all atoms present	5233-42-1	C1NC2=C(C(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl)Cl	{32: 2, 11: 1, 14: 1, 17: 2, 29: 4, 30: 1}
Did not match all atoms present	52334-81-3	C1=CC(=NC=C1C(F)(F)F)Cl	{16: 3, 17: 1, 35: 1, 4: 1, 14: 3}
Did not match all atoms present	52337-77-6	CC1=CC=CC=C1C(=O)[O-].CC1=CC=CC=C1C(=O)[O-].[Ba+2]	{24: 2, 1: 2, 14: 8}
Did not match all atoms present	52337-78-7	CC1=CC=CC=C1C(=O)[O-].CC1=CC=CC=C1C(=O)[O-].[Cd+2]	{24: 2, 1: 2, 14: 8}
Did not match all atoms present	52338-25-7	CCCCC(CC)CNC(=O)C1=CC=C(C=C1)N/N=C\2/C(=C(C(=O)NC2=O)C#N)C	{32: 1, 1: 3, 2: 5, 3: 1, 37: 1, 34: 1, 14: 4, 15: 3, 24: 1, 25: 2, 31: 2}
Did not match all atoms present	52339-03-4	CC(C)(C1=CC(=C(C(=C1)Br)OCCO)Br)C2=CC(=C(C(=C2)Br)OCCO)Br.C=O	{1: 2, 2: 4, 4: 1, 5: 1, 14: 4, 18: 4, 20: 2, 22: 2}
Did not match all atoms present	5234-68-4	CC1=C(SCCO1)C(=O)NC2=CC=CC=C2	{1: 1, 41: 1, 11: 2, 14: 5, 15: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	52340-78-0	C1=CC=C(C=C1)[C@H]([C@@H](C2=CC=CC=C2)O)O	{3: 2, 20: 2, 14: 10}
Did not match all atoms present	52345-47-8	CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N	{1: 1, 2: 1, 14: 4, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	52348-51-3	CC(C)CC1=C(C(=CC=C1)CC(C)C)O	{1: 4, 2: 2, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	52350-17-1	[O-][W](=O)(=O)[O-].[Cs+].[Cs+]	{29: 4}
Did not match all atoms present	52351-96-9	COC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C5=CC=CC=C51	{1: 1, 22: 1, 14: 11}
Did not match all atoms present	52352-15-5	CCCCOCC(C[N+](C)(C)/N=C(/C(=C)C)\[O-])O	{1: 4, 2: 5, 3: 1, 5: 1, 7: 2, 34: 1, 20: 1, 22: 1}
Did not match all atoms present	52353-57-8	CC1=CN(S2=C1C(=CN2C)C)C	{1: 4, 33: 2, 14: 2, 15: 3}
Did not match all atoms present	52356-01-1	C1=CC=C(C(=C1)C(=O)O)NN.Cl	{17: 1, 27: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	52357-41-2	CCCCOC(=O)C=C.CCOC(=O)C=C.CC(=C)C(=O)O.C=CC1=CC=CC=C1CCl	{1: 3, 2: 5, 5: 4, 6: 3, 7: 1, 14: 4, 17: 1, 27: 1, 28: 2}
Did not match all atoms present	52358-73-3	C1=CC=C2C(=C1)C=C(C=C2Br)Br	{18: 2, 14: 6}
Did not match all atoms present	52364-70-2	CCC(C)COC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 2, 2: 2, 3: 1, 37: 1, 14: 8, 22: 1}
Did not match all atoms present	52364-71-3	CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 4, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	52364-72-4	CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 6, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	52364-73-5	CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 7, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	52371-97-8	C1=CC2=C(C=CC(=C2N=NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)N)C(=C1)S(=O)(=O)O	{2: 2, 34: 2, 14: 8, 20: 3, 22: 1, 29: 8, 30: 1}
Did not match all atoms present	52372-36-8	CCN(CC)C1=CC2=C(C=C1)C=C3C(=C(C(=O)N4C3=NC5=CC=CC=C54)C#N)O2	{1: 2, 2: 2, 35: 1, 37: 1, 33: 2, 14: 8, 23: 1, 25: 1}
Did not match all atoms present	52373-92-9	CCNC1=CC(=C(C2=C1C=CC3=C2C(=O)C(=O)C=C3)N)S(=O)(=O)O	{1: 1, 2: 1, 14: 5, 20: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	52383-49-0	C=CC=C.C=CC1=CC=CC=C1.C=CC(=O)[O-].[NH4+]	{24: 1, 14: 5, 5: 4, 6: 4}
Did not match all atoms present	5239-06-5	C(C=[N+]=[N-])C=[N+]=[N-]	{2: 1, 34: 2, 6: 2}
Did not match all atoms present	52390-75-7	CCCCCC[C@H](C/C=C\CCCCCCCC(=O)OCC(CO)(CO)CO)O.CC1=C(C=CC=C1N=C=O)N=C=O	{1: 2, 2: 17, 3: 1, 4: 1, 6: 2, 8: 2, 34: 2, 14: 3, 20: 4, 28: 1, 29: 2}
Did not match all atoms present	52395-66-1	C1CCC(CC1)CN=C=S	{8: 1, 2: 1, 11: 5, 12: 1, 34: 1}
Did not match all atoms present	52398-83-1	COC1=C(C=C(C=C1)S(=O)(=O)CCO)[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 14: 3, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	524-15-2	COC1=CC=CC2=C1N=C3C(=C2OC)C=CO3	{1: 2, 35: 1, 22: 2, 14: 5, 23: 1}
Did not match all atoms present	524-30-1	COC1=C(C(=C2C(=C1)C=CC(=O)O2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O	{1: 1, 2: 1, 12: 5, 14: 3, 20: 4, 21: 1, 22: 2, 23: 1, 28: 1}
Did not match all atoms present	524-34-5	C=CCOC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3	{2: 1, 35: 1, 5: 1, 6: 1, 14: 10, 28: 1}
Did not match all atoms present	524-36-7	CC1=NC=C(C(=C1O)CN)CO	{1: 1, 2: 2, 35: 1, 14: 1, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	524-38-9	C1=CC=C2C(=C1)C(=O)N(C2=O)O	{25: 2, 20: 1, 14: 4, 33: 1}
Did not match all atoms present	524-40-3	CN1C=CC(=C(C1=O)C#N)OC	{1: 2, 37: 1, 33: 1, 14: 2, 22: 1, 25: 1}
Did not match all atoms present	524-42-5	C1=CC=C2C(=C1)C=CC(=O)C2=O	{25: 2, 14: 6}
Did not match all atoms present	524-63-0	C=C[C@H]1CN2CCC1C[C@H]2[C@@H](C3=C4C=C(C=CC4=NC=C3)O)O	{33: 1, 3: 1, 5: 1, 6: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 1, 21: 1}
Did not match all atoms present	524-80-1	C1=CC=C2C(=C1)C3=CC=CC=C3N2CC(=O)O	{33: 1, 2: 1, 27: 1, 14: 8}
Did not match all atoms present	524-81-2	CN1CCC2=C(C1)C3=CC=CC=C3N2CC4=CC=CC=C4	{1: 1, 2: 1, 11: 3, 14: 9, 33: 2}
Did not match all atoms present	524-83-4	CCN1[C@@H]2CC[C@@H]1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 10, 22: 1}
Did not match all atoms present	524-84-5	CC(C=C(C1=CC=CS1)C2=CC=CS2)N(C)C	{1: 3, 3: 1, 6: 1, 33: 1, 41: 2, 7: 1, 14: 6}
Did not match all atoms present	524-89-0	COC1=C2C=COC2=NC3=CC4=C(C=C31)OCO4	{1: 1, 35: 1, 11: 1, 14: 4, 22: 1, 23: 3}
Did not match all atoms present	524-95-8	B(C1=CC=CC=C1)(C2=CC=CC=C2)OCCN	{2: 2, 30: 1, 22: 1, 14: 10}
Did not match all atoms present	524-96-9	COC1=CC=C(C=C1)C(=NCC2=CC=CC=C2)C3=CC=C(C=C3)OC	{1: 2, 2: 1, 7: 1, 34: 1, 14: 13, 22: 2}
Did not match all atoms present	52400-55-2	CCNCCC1(OC2=CC=CC=C2O1)C.Cl	{1: 2, 2: 3, 13: 1, 14: 4, 17: 1, 23: 2, 31: 1}
Did not match all atoms present	52400-58-5	CC[NH+](CC[NH2+]CCC1OC2=CC=CC=C2O1)CC.C(=C\C(=O)[O-])\C(=O)O.C(=C\C(=O)[O-])\C(=O)O	{1: 2, 2: 6, 6: 4, 12: 1, 14: 4, 23: 2, 24: 2, 27: 2}
Did not match all atoms present	52400-60-9	CCC1(OC2=CC=CC=C2O1)CC[NH2+]CC[NH+](CC)CC.C(=C\C(=O)[O-])\C(=O)O.C(=C\C(=O)[O-])\C(=O)O	{1: 3, 2: 7, 6: 4, 13: 1, 14: 4, 23: 2, 24: 2, 27: 2}
Did not match all atoms present	52400-61-0	CC1(OC2=CC=CC=C2O1)CC[NH2+]CC[NH+](C)C.[Cl-].[Cl-]	{1: 3, 2: 4, 13: 1, 14: 4, 17: 2, 23: 2}
Did not match all atoms present	52400-65-4	CC1(OC2=CC=CC=C2O1)CC[NH+]3CCN(CC3)C.[Cl-]	{1: 2, 2: 2, 33: 1, 11: 4, 13: 1, 14: 4, 17: 1, 23: 2}
Did not match all atoms present	52400-76-7	CC1(OC2=CC=CC=C2O1)CC[NH2+]CC3=CC=CC=C3.[Cl-]	{1: 1, 2: 3, 13: 1, 14: 9, 17: 1, 23: 2}
Did not match all atoms present	52400-77-8	CC[NH+](CC)CC[NH2+]CCC1(OC2=C(O1)C=C(C=C2)Cl)C.[Cl-].[Cl-]	{1: 3, 2: 6, 13: 1, 14: 3, 17: 3, 23: 2}
Did not match all atoms present	52400-80-3	CC[NH+](CC)CC[NH2+]CCC1(OC2=CC(=C(C=C2O1)Br)Br)C.[Cl-].[Cl-]	{1: 3, 2: 6, 13: 1, 14: 2, 17: 2, 18: 2, 23: 2}
Did not match all atoms present	52400-82-5	CC[NH+](CC[NH2+]CC1(OC2=CC=CC=C2O1)C)CC.C(=C\C(=O)[O-])\C(=O)O.C(=C\C(=O)[O-])\C(=O)O	{1: 3, 2: 5, 6: 4, 13: 1, 14: 4, 23: 2, 24: 2, 27: 2}
Did not match all atoms present	52400-99-4	CC[NH+](CC[NH2+]CCC1(OC2=CC=CC=C2O1)C)CC.C(=C\C(=O)[O-])\C(=O)O.C(=C\C(=O)[O-])\C(=O)O	{1: 3, 2: 6, 6: 4, 13: 1, 14: 4, 23: 2, 24: 2, 27: 2}
Did not match all atoms present	52401-02-2	C[NH+](C)CCC1(OC2=CC=CC=C2O1)C3=CC=CC=C3.[Cl-]	{1: 2, 2: 2, 13: 1, 14: 9, 17: 1, 23: 2}
Did not match all atoms present	52401-04-4	CC[NH+](CC[NH2+]CCC1(OC2=C(O1)C=CC(=C2)C)C)CC.C(=C\C(=O)[O-])\C(=O)O.C(=C\C(=O)[O-])\C(=O)O	{1: 4, 2: 6, 6: 4, 13: 1, 14: 3, 23: 2, 24: 2, 27: 2}
Did not match all atoms present	52405-73-9	C1=CC(=C(C=C1O)C(=O)N)O	{24: 1, 30: 1, 21: 2, 14: 3}
Did not match all atoms present	52409-66-2	[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].C1C=CC=[C-]1.C(=O)=[Fe]=C=O	{8: 2, 11: 1, 29: 2, 14: 3}
Did not match all atoms present	5241-64-5	CC(C)(C)OC(=O)N[C@H](CC1=CNC2=CC=CC=C21)C(=O)O	{32: 1, 1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	52411-33-3	C1=CC=C(C(=C1)N)SCCSC2=CC=CC=C2N	{40: 2, 2: 2, 30: 2, 14: 8}
Did not match all atoms present	52414-82-1	CCCC1=CN=CS1	{1: 1, 2: 2, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	52414-91-2	CCC1=C(SC=N1)C	{1: 2, 2: 1, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	52414-97-8	CC1=C(C(=CC=C1)Br)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	52414-98-9	CC1=C(C=CC(=C1)Br)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	5242-57-9	C1=C(SN=C1)C=O	{41: 1, 26: 1, 35: 1, 14: 2}
Did not match all atoms present	52421-46-2	CC(C)[C@](CO)(C(=O)[O-])NC(=O)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 4: 1, 14: 5, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	52421-47-3	CC(C)CC(CO)(C(=O)O)NC(=O)C1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 4: 1, 14: 5, 20: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	52421-48-4	C1=CC=C(C=C1)C[C@](CO)(C(=O)[O-])NC(=O)C2=CC=CC=C2	{2: 2, 4: 1, 14: 10, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	52431-78-4	C1=CC(=CC=C1N2C(=S)N=NN2)O	{32: 1, 33: 1, 35: 2, 21: 1, 14: 4}
Did not match all atoms present	52435-87-7	CC(=O)OC1(C2=CC=CC3=C2C(=CC=C3)C(=O)O1)C4=CC(=C(C5=CC=CC=C54)O)C(=O)OC	{1: 2, 28: 3, 13: 1, 14: 11, 21: 1}
Did not match all atoms present	52438-26-3	O.O.[OH-].[OH-].[OH-].[OH-].[Pt+4]	{}
Did not match all atoms present	52445-55-3	CC.C1CCCC1.[Ni]	{1: 2, 11: 5}
Did not match all atoms present	52445-59-7	C1CCCC1.C(CC(F)(F)F)C(F)(F)F.[Ni]	{16: 6, 2: 2, 11: 5, 4: 2}
Did not match all atoms present	52449-43-1	COC(=O)CC1=CC=C(C=C1)Cl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	52450-80-3	C=O.C(CN)N.C(#N)N=C(N)N	{2: 2, 37: 1, 7: 1, 34: 1, 30: 4, 5: 1}
Did not match all atoms present	52453-41-5	CCC(CO)(CO)CO.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCC(=O)O)CCCC(=O)O	{1: 3, 2: 13, 4: 2, 14: 4, 20: 5, 27: 4}
Did not match all atoms present	52457-25-7	COC1=C2C3CC(C2=C(C4=CC=CC=C41)OC)C=C3	{1: 2, 11: 1, 12: 2, 22: 2, 14: 6}
Did not match all atoms present	52459-90-2	CC1=CNC(=C1C(=O)OC)C	{32: 1, 1: 3, 28: 1, 14: 1}
Did not match all atoms present	5246-57-1	C1=CC(=CC(=C1)S(=O)(=O)CCO)N	{2: 2, 30: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	52460-86-3	CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)Cl	{1: 1, 2: 1, 4: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	52462-29-0	CC1=CC=C(C=C1)C(C)C.CC1=CC=C(C=C1)C(C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ru+2].[Ru+2]	{1: 6, 3: 2, 14: 8, 17: 4}
Did not match all atoms present	52462-43-8	C1CCCCC1.C1CCCCC1.[Ti]	{11: 12}
Did not match all atoms present	52463-50-0	CC(C)(COP(=O)(Cl)Br)CBr	{1: 2, 2: 2, 4: 1, 17: 1, 18: 2, 22: 1, 29: 1}
Did not match all atoms present	52463-83-9	C#CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3	{33: 1, 2: 1, 35: 1, 9: 1, 10: 1, 11: 1, 14: 8, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	52467-63-7	CCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC.[Cl-]	{1: 4, 2: 45, 17: 1}
Did not match all atoms present	52468-60-7	C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F	{33: 2, 2: 1, 3: 1, 6: 2, 11: 4, 14: 13, 16: 2}
Did not match all atoms present	52479-15-9	CC[NH+](CC)CC[NH2+]CCCC1(OC2=CC3=CC=CC=C3C=C2O1)C.[Cl-].[Cl-]	{1: 3, 2: 7, 13: 1, 14: 6, 17: 2, 23: 2}
Did not match all atoms present	52479-18-2	CC1(OC2=CC=CC=C2O1)CC[NH3+].[Cl-]	{1: 1, 2: 2, 13: 1, 14: 4, 17: 1, 23: 2}
Did not match all atoms present	52479-65-9	CNC1=CC=CC=C1C(=O)NN	{24: 1, 1: 1, 30: 1, 14: 4, 31: 2}
Did not match all atoms present	52480-43-0	CC1=C(OC(=C1)C=O)C	{1: 2, 26: 1, 14: 1, 23: 1}
Did not match all atoms present	52485-79-7	C[C@]([C@H]1C[C@@]23CC[C@@]1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)CC7CC7)OC)(C(C)(C)C)O	{1: 5, 2: 1, 4: 2, 33: 1, 11: 8, 12: 4, 13: 3, 14: 2, 20: 1, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	52486-78-9	C1=CC(=C(C=C1[Hg])[N+](=O)[O-])[O-].O.[Na+]	{38: 1, 14: 3}
Did not match all atoms present	52488-28-5	CC1=CC(=CC(=C1)Br)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	52488-36-5	C1=CC2=C(C=CN2)C(=C1)Br	{32: 1, 18: 1, 14: 5}
Did not match all atoms present	52497-46-8	CC1=C(C(=C(C=C1)C(=N)C2=C(C(=C(C=C2)C)C)NOS(=O)(=O)O)NOS(=O)(=O)O)C	{1: 4, 36: 1, 7: 1, 14: 4, 20: 2, 22: 2, 29: 4, 31: 2}
Did not match all atoms present	525-02-0	CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)CCN.Cl	{1: 2, 2: 3, 33: 1, 14: 8, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	525-03-1	C1=CC=C2C(=C1)C(C3=CC=CC=C32)N	{12: 1, 30: 1, 14: 8}
Did not match all atoms present	525-05-3	C1=CC2=C(C(=C(C=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])O)N=O.[Na+].[Na+]	{34: 1, 21: 1, 14: 4, 29: 7}
Did not match all atoms present	525-06-4	C1=CC=C(C=C1)C(=C=O)C2=CC=CC=C2	{8: 1, 29: 1, 14: 10, 7: 1}
Did not match all atoms present	525-15-5	CC1=CC=CC=C1CC2=NC=CC3=C2NC4=CC=CC=C34	{32: 1, 1: 1, 2: 1, 35: 1, 14: 10}
Did not match all atoms present	525-26-8	C1CN(CCN1CCCN2C(=O)C3=CC=CC=C3NC2=O)C4=CC(=CC=C4)Cl.Cl	{32: 1, 33: 3, 2: 3, 11: 4, 14: 8, 17: 2, 25: 2}
Did not match all atoms present	525-37-1	C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C(=C1)S(=O)(=O)O	{20: 2, 29: 4, 14: 6}
Did not match all atoms present	525-52-0	CC(=O)OC1=C(C(=CC=C1)OC(=O)C)OC(=O)C	{1: 3, 28: 3, 14: 3}
Did not match all atoms present	525-57-5	CC1=C2C(=C3C=CC(=O)C=C3N2)CCN1	{32: 2, 1: 1, 11: 2, 14: 3, 15: 1, 25: 1}
Did not match all atoms present	525-64-4	C1C2=C(C=CC(=C2)N)C3=C1C=C(C=C3)N	{11: 1, 30: 2, 14: 6}
Did not match all atoms present	525-66-6	CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O	{1: 2, 2: 2, 3: 2, 14: 7, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	525-76-8	CC1=NC2=CC=CC=C2C(=O)O1	{1: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	525-79-1	C1=COC(=C1)CNC2=NC=NC3=C2NC=N3	{32: 1, 2: 1, 35: 3, 14: 5, 23: 1, 31: 1}
Did not match all atoms present	525-82-6	C1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3O2	{25: 1, 14: 10, 23: 1}
Did not match all atoms present	5250-39-5	CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O	{1: 3, 35: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 3, 16: 1, 17: 1, 23: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	52502-12-2	[O-2].[V].[Ni]	{}
Did not match all atoms present	52502-66-6	C1=NC(=O)C(=C(N1)N)N.OS(=O)(=O)O	{32: 1, 35: 1, 14: 1, 20: 2, 25: 1, 29: 2, 30: 2}
Did not match all atoms present	52502-91-7	CC(CO)O.OP(=O)(O)O	{1: 1, 2: 1, 3: 1, 20: 5, 29: 1}
Did not match all atoms present	52509-14-5	C1COC(O1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{2: 1, 11: 2, 12: 1, 14: 15, 18: 1, 23: 2}
Did not match all atoms present	52509-83-8	CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].CC(C)(C)C1=CC=C(C=C1)C(=O)[O-].[Mg+2]	{24: 2, 1: 6, 4: 2, 14: 8}
Did not match all atoms present	52509-85-0	N#SBr	{40: 1, 18: 1}
Did not match all atoms present	5251-79-6	C1=CC=C(C=C1)C(=O)NOCC(=O)[O-].[NH4+]	{24: 2, 2: 1, 22: 1, 14: 5, 31: 1}
Did not match all atoms present	5251-93-4	C1=CC=C(C=C1)C(=O)NOCC(=O)O	{2: 1, 14: 5, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	52510-63-1	CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C.OS(=O)(=O)[O-]	{1: 3, 2: 2, 40: 1, 34: 1, 14: 6, 20: 1, 22: 2, 29: 3}
Did not match all atoms present	52513-03-8	CCC(C)COC(=O)C1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	52513-11-8	CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 14, 14: 5, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	52514-66-6	CC1CC(OC(O1)C2=CC(=C(C=C2)O)OC)(C)C	{1: 4, 11: 1, 12: 2, 13: 1, 14: 3, 21: 1, 22: 1, 23: 2}
Did not match all atoms present	52516-13-9	C1=CC(=C(C=C1Cl)Cl)CCN	{17: 2, 2: 2, 30: 1, 14: 3}
Did not match all atoms present	52522-40-4	C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.C1=CC=C(C=C1)/C=C/C(=O)/C=C/C2=CC=CC=C2.C(Cl)(Cl)Cl.[Pd].[Pd]	{24: 3, 17: 3, 3: 1, 14: 30, 6: 12}
Did not match all atoms present	52522-49-3	C1=CC=C(C=C1)COC[C@@H]2[C@H]([C@@H](C(O2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OCC4=CC=CC=C4)OCC5=CC=CC=C5	{2: 4, 38: 1, 12: 4, 14: 19, 22: 3, 23: 1, 28: 1}
Did not match all atoms present	52536-09-1	C1=CC(=CN=C1)[O-].[Na+]	{35: 1, 14: 4}
Did not match all atoms present	5254-41-1	CC(=O)NC1=CC=CC=C1CCNC(=O)C2=C(C3=CC=CC=C3C=C2)O	{1: 1, 2: 2, 14: 10, 21: 1, 24: 2, 31: 2}
Did not match all atoms present	52543-24-5	CCOC1=CC(=C(C=C1[N+]#N)OCC)NC(=O)C2=CC=C(C=C2)OC.CCOC1=CC(=C(C=C1[N+]#N)OCC)NC(=O)C2=CC=C(C=C2)OC.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 6, 2: 4, 34: 2, 14: 12, 17: 4, 22: 6, 24: 2, 31: 2}
Did not match all atoms present	52547-00-9	CC1=NSC(=C1)N.Cl	{1: 1, 35: 1, 41: 1, 14: 1, 17: 1, 30: 1}
Did not match all atoms present	52548-11-5	C[Si](C)(SC1=CC=CC=C1)Cl	{40: 1, 1: 2, 14: 5, 17: 1}
Did not match all atoms present	52548-14-8	CC1=CC(=C(C=C1)I)C(=O)O	{27: 1, 1: 1, 19: 1, 14: 3}
Did not match all atoms present	52549-17-4	CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)O	{1: 1, 3: 1, 11: 1, 14: 6, 35: 1, 23: 1, 27: 1}
Did not match all atoms present	52549-57-2	CC(=O)NC1=C(C=CC(=C1)N(CCOC)CCOC)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N	{1: 3, 2: 4, 37: 1, 38: 1, 33: 1, 34: 2, 14: 6, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	5255-71-0	CCOC(=O)NC1=CC=CC=C1C	{1: 2, 2: 1, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	5255-75-4	C1C(O1)COC2=CC=C(C=C2)[N+](=O)[O-]	{2: 1, 38: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	5255-91-4	C1=CC(=CC=C1C2=C(NC(=O)N2)C3=CC=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{32: 2, 25: 1, 29: 6, 14: 8}
Did not match all atoms present	52551-67-4	C1=CC(=C(C=C1[N+](=O)[O-])O)N(CCO)CCO	{33: 1, 2: 4, 38: 1, 14: 3, 20: 2, 21: 1}
Did not match all atoms present	5256-77-9	C=CC#[C-].[Cu+]	{10: 1, 5: 1, 6: 1}
Did not match all atoms present	52562-19-3	CC(=C)C1=CC=CC=C1N	{1: 1, 30: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	52562-37-5	CCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCOS(=O)(=O)[O-].[Mn+2]	{1: 2, 2: 26, 29: 6, 22: 2}
Did not match all atoms present	52562-50-2	CC1=CC2=C(C=C1)NC=C2C=O	{32: 1, 1: 1, 26: 1, 14: 4}
Did not match all atoms present	52570-16-8	CC(C(=O)NC1=CC=CC=C1)OC2=CC3=CC=CC=C3C=C2	{1: 1, 3: 1, 14: 12, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	52572-38-0	CC1=C(C=CC(=C1)[N+]#N)N2CCCC2.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 33: 1, 11: 4, 14: 3, 17: 3}
Did not match all atoms present	52576-59-7	COC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N)C(=O)C4=C(C=CC(=C4C3=O)O)[N+](=O)[O-]	{1: 1, 38: 1, 14: 8, 21: 1, 22: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	52577-09-0	COC1=C(C=C(C=C1)C=O)CCl	{1: 1, 2: 1, 14: 3, 17: 1, 22: 1, 26: 1}
Did not match all atoms present	52578-56-0	C1=C(C=C(C=C1O)SC2=CC(=CC(=C2)O)O)O	{40: 1, 21: 4, 14: 6}
Did not match all atoms present	5258-64-0	CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 1, 38: 1, 29: 3, 14: 3}
Did not match all atoms present	52584-39-1	CN1C=CC2=C1N(C(=O)N(C2=O)C)C	{1: 3, 33: 3, 14: 2, 25: 2}
Did not match all atoms present	52584-45-9	C1=CC(=CC=C1OC(=C(C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)S(=O)(=O)[O-].[Na+]	{4: 8, 7: 2, 14: 4, 16: 19, 22: 1, 29: 3}
Did not match all atoms present	52584-47-1	CC1=CC=C(C=C1)S(=O)(=O)OCCCN(CCCOS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3	{1: 2, 2: 6, 33: 1, 14: 13, 22: 2, 29: 4}
Did not match all atoms present	5259-87-0	COC(=O)CNC(=O)CC1=CC=CC=C1	{1: 1, 2: 2, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	5259-88-1	CC1=C(S(=O)(=O)CCO1)C(=O)NC2=CC=CC=C2	{1: 1, 11: 2, 14: 5, 15: 2, 23: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	526-08-9	C1=CC=C(C=C1)N2C(=CC=N2)NS(=O)(=O)C3=CC=C(C=C3)N	{33: 1, 35: 1, 14: 11, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	526-18-1	C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)O)O	{24: 1, 21: 2, 14: 8, 31: 1}
Did not match all atoms present	526-26-1	C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].[Sr+2]	{27: 2, 14: 8}
Did not match all atoms present	526-31-8	CNC(CC1=CNC2=CC=CC=C21)C(=O)O	{32: 1, 1: 1, 2: 1, 3: 1, 14: 5, 27: 1, 31: 1}
Did not match all atoms present	526-36-3	CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C	{32: 1, 1: 5, 2: 1, 35: 1, 4: 1, 11: 2, 14: 2, 15: 1}
Did not match all atoms present	526-55-6	C1=CC=C2C(=C1)C(=CN2)CCO	{32: 1, 2: 2, 20: 1, 14: 5}
Did not match all atoms present	526-73-8	CC1=C(C(=CC=C1)C)C	{1: 3, 14: 3}
Did not match all atoms present	526-75-0	CC1=C(C(=CC=C1)O)C	{1: 2, 21: 1, 14: 3}
Did not match all atoms present	526-94-3	C(C(C(=O)[O-])O)(C(=O)O)O.[Na+]	{24: 1, 27: 1, 3: 2, 20: 2}
Did not match all atoms present	5260-37-7	CC[N+]1=C(OC2=CC=CC=C21)C.[I-]	{1: 2, 2: 1, 33: 1, 14: 4, 19: 1, 23: 1}
Did not match all atoms present	52600-40-5	CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].[Ce+3]	{24: 3, 1: 3, 2: 24}
Did not match all atoms present	52602-68-3	CNC1=C(C(=NC=N1)Cl)N	{1: 1, 35: 2, 14: 1, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	52604-91-8	C1=CC=C(C=C1)NC(=O)CCC(C(=O)O)N2C(=O)C3=CC=CC=C3C2=O.O	{33: 1, 2: 2, 3: 1, 14: 9, 24: 1, 25: 2, 27: 1, 31: 1}
Did not match all atoms present	52609-48-0	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1CCC(=O)OCC1	{1: 2, 4: 1, 11: 5, 14: 8, 21: 2, 28: 1}
Did not match all atoms present	5261-50-7	CC1=CC=C(C2=CC=CC=C12)CCl	{1: 1, 2: 1, 14: 6, 17: 1}
Did not match all atoms present	52623-84-4	B(=O)[O-].[O-]Cl(=O)=O.[Na+].[Na+]	{17: 1, 29: 5}
Did not match all atoms present	52623-88-8	COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC.C(CNC(=S)[S-])NC(=S)[S-].[Mn+2]	{1: 2, 2: 2, 7: 4, 14: 4, 28: 2, 31: 6}
Did not match all atoms present	52625-25-9	CC(C)(C)C1=CC(=CC(=C1[O-])C(C)(C)C)C(=O)O.CC(C)(C)C1=CC(=CC(=C1[O-])C(C)(C)C)C(=O)O.[Ni+2]	{1: 12, 27: 2, 4: 4, 14: 4}
Did not match all atoms present	52628-34-9	CCCC[Sn](CCCC)(SCC(=O)OCCCCCC(C)C)S[Sn](CCCC)(CCCC)SCC(=O)OCCCCCC(C)C	{40: 3, 1: 8, 2: 24, 3: 2, 28: 2}
Did not match all atoms present	52629-13-7	CC(C)(C)C(=O)NC1=CC=CC=C1C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7NC(=O)C(C)(C)C)C8=CC=CC=C8N=C(C(C)(C)C)[O-])N4)C9=CC=CC=C9N=C(C(C)(C)C)[O-].[Fe+2]	{32: 2, 1: 12, 34: 2, 35: 2, 4: 4, 7: 2, 14: 24, 24: 2, 31: 2}
Did not match all atoms present	5263-87-6	COC1=CC2=C(C=C1)N=CC=C2	{1: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	52636-61-0	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C=C2)N=NC3=CC=C(C=C3)NC4=C(C=C(C=C4)S(=O)(=O)O)[N+](=O)[O-])C	{1: 2, 34: 2, 38: 1, 14: 14, 20: 1, 22: 1, 29: 4, 31: 1}
Did not match all atoms present	52636-67-6	C1COCCN1.NS(=O)(=O)O	{32: 1, 11: 4, 20: 1, 23: 1, 29: 2, 30: 1}
Did not match all atoms present	52637-67-9	[K+].[K+].[Br-].[Br-].[Br-].[Br-].[Br-].[Br-].[Ru+4]	{18: 6}
Did not match all atoms present	5264-47-1	CC1=NN(C(=O)C1NN=C2C=C(C=CC2=O)S(=O)(=O)N)C3=CC=CC=C3	{1: 1, 34: 1, 35: 1, 33: 1, 12: 1, 14: 8, 15: 3, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	5264-55-1	C1=CC=C(C=C1)S(=O)(=O)C2=C(C3=C(C(=C2)N)C(=O)C4=CC=CC=C4C3=O)N	{25: 2, 30: 2, 29: 2, 14: 10}
Did not match all atoms present	5264-65-3	CC1=CC(=C(C(=C1)[N+](=O)[O-])Cl)[N+](=O)[O-]	{1: 1, 38: 2, 14: 2, 17: 1}
Did not match all atoms present	52642-22-5	CCC(COCC=C)(COCC=C)COC(=O)NC1=C(C(=CC=C1)NC(=O)OCC(CC)(COCC=C)COCC=C)C	{1: 3, 2: 12, 4: 2, 5: 4, 6: 4, 14: 3, 22: 4, 28: 2, 31: 2}
Did not match all atoms present	52642-68-9	CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C=CC(=O)OCCO	{1: 2, 2: 6, 4: 1, 5: 1, 6: 1, 8: 2, 34: 2, 14: 3, 20: 4, 28: 1, 29: 2}
Did not match all atoms present	52645-53-1	CC1(C(C1C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C	{1: 2, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	52656-15-2	CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O	{1: 2, 2: 8, 4: 1, 8: 2, 34: 2, 14: 3, 20: 3, 27: 2, 29: 2}
Did not match all atoms present	52659-57-1	CC1CC(C23CC(C(C(O2)C(C)CCC(C4=C(C=CC(=C4)O)Br)OC)C)OC(=O)CC(OC(=O)CC1(O3)O)C(C)O)(C)C	{1: 7, 2: 2, 3: 3, 11: 4, 12: 5, 13: 3, 14: 3, 18: 1, 20: 2, 21: 1, 22: 1, 23: 2, 28: 2}
Did not match all atoms present	5266-20-6	[Li+].C1=C(NC(=O)NC1=O)C(=O)[O-]	{24: 1, 25: 2, 14: 1, 32: 2}
Did not match all atoms present	5266-85-3	CC1=C(C(=CC=C1)C(C)C)N	{1: 3, 3: 1, 30: 1, 14: 3}
Did not match all atoms present	52663-57-7	CCCCOCC[O-].[Na+]	{1: 1, 2: 5, 29: 1, 22: 1}
Did not match all atoms present	52663-58-8	C1=CC(=CC=C1C2=C(C=CC(=C2Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	52663-59-9	C1=CC=C(C(=C1)C2=C(C(=C(C=C2)Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	52663-60-2	C1=CC(=C(C(=C1)Cl)Cl)C2=C(C=CC(=C2Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	52663-61-3	C1=CC(=C(C=C1Cl)C2=CC(=CC(=C2Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	52663-62-4	C1=CC(=C(C(=C1)Cl)Cl)C2=C(C(=C(C=C2)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	52663-63-5	C1=CC(=C(C=C1Cl)C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	52663-64-6	C1=CC(=C(C(=C1Cl)C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	52663-65-7	C1=CC(=C(C(=C1Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	52663-66-8	C1=CC(=C(C(=C1C2=CC(=CC(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	52663-67-9	C1=C(C=C(C(=C1Cl)Cl)C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	52663-68-0	C1=C(C(=CC(=C1Cl)Cl)Cl)C2=C(C(=CC(=C2Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	52663-69-1	C1=C(C(=CC(=C1Cl)Cl)Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	52663-70-4	C1=CC(=C(C(=C1C2=C(C(=CC(=C2Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	52663-71-5	C1=CC(=C(C(=C1C2=C(C(=C(C=C2Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	52663-72-6	C1=C(C=C(C(=C1Cl)Cl)Cl)C2=CC(=C(C=C2Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	52663-74-8	C1=C(C=C(C(=C1Cl)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	52663-75-9	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C2=C(C(=CC(=C2Cl)Cl)Cl)Cl	{17: 8, 14: 2}
Did not match all atoms present	52663-77-1	C1=C(C(=C(C(=C1Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 9, 14: 1}
Did not match all atoms present	52663-78-2	C1=CC(=C(C(=C1C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 8, 14: 2}
Did not match all atoms present	52663-79-3	C1=C(C(=C(C(=C1Cl)Cl)Cl)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 9, 14: 1}
Did not match all atoms present	5267-64-1	C1=CC=C(C=C1)C[C@H](CO)N	{2: 2, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	52670-78-7	CCOP(=O)(N(C)C1=CC=CC=C1)OCC	{1: 3, 2: 2, 33: 1, 14: 5, 22: 2, 29: 1}
Did not match all atoms present	52673-14-0	COCCCN1C(=O)C2=C3C4=C(C=C2)C(=O)N5C6=CC=CC=C6N=C5C4=CC(=C3C1=O)C#N	{1: 1, 2: 3, 35: 1, 37: 1, 33: 2, 14: 7, 22: 1, 25: 3}
Did not match all atoms present	52684-23-8	CCCC[Sn](CCCC)(CCCC)OC(=O)C(=C)C.CCC[Sn](CCC)(CCC)OC(=O)C(=C)C.CC(=C)C(=O)OC	{1: 10, 2: 15, 28: 3, 5: 3, 7: 3}
Did not match all atoms present	52689-36-8	COP(=[Fe]=P(OC)(OC)OC)(OC)OC.[N-]=O.[N-]=O	{1: 6, 29: 2, 22: 6}
Did not match all atoms present	5269-44-3	CCOC(=O)C1=CC(=CC(=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C(=O)OCC	{1: 2, 2: 2, 33: 3, 11: 5, 12: 1, 14: 7, 17: 1, 25: 2, 28: 2}
Did not match all atoms present	52691-24-4	C1CCC(C(C1)N)N.Cl[Pt]Cl	{17: 2, 11: 4, 12: 2, 30: 2}
Did not match all atoms present	52692-74-7	CCCC[N+]1([C@@H]2CC(C[C@H]1C3C2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCS(=O)(=O)[O-]	{1: 4, 2: 7, 3: 1, 33: 3, 11: 2, 12: 5, 14: 6, 35: 1, 20: 1, 23: 1, 25: 2, 28: 1, 29: 3}
Did not match all atoms present	52693-87-5	CC1=CC(=CC=C1)N2C(=O)C(SC2=NC3CCCCC3)CC(=O)O	{1: 1, 2: 1, 33: 1, 41: 1, 11: 5, 12: 2, 34: 1, 14: 4, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	52694-54-9	C1CCC(CC1)N2CCN(CC2)[C@@H](CC3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl	{33: 2, 2: 1, 3: 1, 11: 9, 12: 1, 14: 10, 17: 2}
Did not match all atoms present	52695-39-3	C1C(O1)C2=CC=C(C=C2)C#N	{11: 1, 12: 1, 37: 1, 14: 4, 23: 1}
Did not match all atoms present	52695-54-2	CCOC1=C(C=C(C=C1)C)N=NC2=CC=C(C3=CC=CC=C32)N=NC4=CC(=CC=C4)S(=O)(=O)O	{1: 2, 2: 1, 34: 4, 14: 13, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	527-07-1	C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.[Na+]	{24: 1, 2: 1, 3: 4, 20: 5}
Did not match all atoms present	527-09-3	C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.[Cu+2]	{24: 2, 2: 2, 3: 8, 20: 10}
Did not match all atoms present	527-18-4	CC1=C(C(=C(C(=C1O)C)C)O)C	{1: 4, 21: 2}
Did not match all atoms present	527-20-8	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)N	{17: 5, 30: 1}
Did not match all atoms present	527-35-5	CC1=CC(=C(C(=C1C)O)C)C	{1: 4, 21: 1, 14: 1}
Did not match all atoms present	527-53-7	CC1=CC(=C(C(=C1)C)C)C	{1: 4, 14: 2}
Did not match all atoms present	527-54-8	CC1=CC(=CC(=C1C)C)O	{1: 3, 21: 1, 14: 2}
Did not match all atoms present	527-55-9	CC1=CC(=CC(=C1C)O)O	{1: 2, 21: 2, 14: 2}
Did not match all atoms present	527-60-6	CC1=CC(=C(C(=C1)C)O)C	{1: 3, 21: 1, 14: 2}
Did not match all atoms present	527-62-8	C1=C(C=C(C(=C1Cl)O)N)Cl	{17: 2, 30: 1, 21: 1, 14: 2}
Did not match all atoms present	527-69-5	C1=COC(=C1)C(=O)Cl	{24: 1, 17: 1, 14: 3, 23: 1}
Did not match all atoms present	527-72-0	C1=CSC(=C1)C(=O)O	{41: 1, 27: 1, 14: 3}
Did not match all atoms present	527-73-1	C1=CN=C(N1)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 2}
Did not match all atoms present	527-84-4	CC1=CC=CC=C1C(C)C	{1: 3, 3: 1, 14: 4}
Did not match all atoms present	527-85-5	CC1=CC=CC=C1C(=O)N	{24: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	527-93-5	CC1=C2C(=C(C(=C1Cl)O)Cl)OC3=C(C(=C(C(=C3OC2=O)Cl)OC)Cl)C	{1: 3, 17: 4, 21: 1, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	52704-04-8	C1=CC=C(C(=C1)C(=O)O)S(=O)C2=CC=CC=C2C(=O)O	{27: 2, 29: 1, 14: 8}
Did not match all atoms present	52707-46-7	C1=CNC(=C1)C2=CC=CS2	{32: 1, 41: 1, 14: 6}
Did not match all atoms present	52709-83-8	CCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 3, 37: 1, 14: 8}
Did not match all atoms present	52709-84-9	CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 7, 37: 1, 14: 8}
Did not match all atoms present	52709-85-0	CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 8, 37: 1, 14: 8}
Did not match all atoms present	52709-86-1	CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 2, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	52709-87-2	CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 3, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	5271-39-6	CC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 4: 1, 14: 15}
Did not match all atoms present	5271-67-0	C1=CSC(=C1)C(=O)Cl	{24: 1, 17: 1, 14: 3, 41: 1}
Did not match all atoms present	5271-88-5	CC1=CC(=C(C=C1C)C(C)C2=CC=CC=C2)C(C)C3=CC=CC=C3	{1: 4, 3: 2, 14: 12}
Did not match all atoms present	52710-27-7	CCCC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 2: 2, 14: 4, 17: 1}
Did not match all atoms present	52711-92-9	COC1=CC(=C(C=C1)OC)CC(=O)Cl	{1: 2, 2: 1, 14: 3, 17: 1, 22: 2, 24: 1}
Did not match all atoms present	52712-04-6	C1=CC(=C(C=C1Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	52712-76-2	CCCC(=O)N1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.Cl	{1: 3, 2: 2, 35: 2, 33: 2, 11: 5, 14: 2, 17: 1, 22: 2, 24: 1, 30: 1}
Did not match all atoms present	52716-30-0	CCN(CC)C1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O)O	{1: 2, 2: 2, 33: 1, 14: 6, 21: 1, 24: 1, 27: 2}
Did not match all atoms present	52716-31-1	CCN(CC)C1=CC(=C(C=C1)C(=O)C2=C(C=CC(=C2)C(=O)O)C(=O)O)O	{1: 2, 2: 2, 33: 1, 14: 6, 21: 1, 24: 1, 27: 2}
Did not match all atoms present	52719-55-8	CC1=CC(=C(C(=C1)C)C(C2=C(C=C(C=C2C)C)C)C3=C(C=C(C=C3C)C)C)C	{1: 9, 3: 1, 14: 6}
Did not match all atoms present	5272-18-4	C[Si](C)(C1=CC=CC=C1)O	{1: 2, 20: 1, 14: 5}
Did not match all atoms present	5272-36-6	C[Si](C)(C)C#CCO	{1: 3, 2: 1, 20: 1, 10: 2}
Did not match all atoms present	52720-24-8	C1=CC=C2C=C3C4C=CC4C3=CC2=C1	{12: 2, 14: 8}
Did not match all atoms present	52721-69-4	C1=CC=C(C(=C1)CCN)F	{16: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	52723-96-3	CC1=C(C=C(C=C1)NC(=O)OC(C)COC(=O)C=C)NC(=O)OC(C)COC(=O)C=C	{1: 3, 2: 2, 3: 2, 5: 2, 6: 2, 14: 3, 28: 4, 31: 2}
Did not match all atoms present	52724-09-1	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C2=CC=C(C=C2)O)O.C1=CC(=CC=C1C(=O)O)O	{27: 3, 21: 3, 14: 16}
Did not match all atoms present	52725-43-6	[O-2].[O-2].[O-2].[Al+3].[Dy+3]	{}
Did not match all atoms present	52729-03-0	C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl)C(=O)O	{17: 2, 27: 1, 38: 2, 14: 1}
Did not match all atoms present	5273-85-8	C/C=C/C1=CC(=C(C(=C1)OC)OC)OC	{1: 4, 22: 3, 14: 2, 6: 2}
Did not match all atoms present	5273-86-9	CC=CC1=CC(=C(C=C1OC)OC)OC	{1: 4, 22: 3, 14: 2, 6: 2}
Did not match all atoms present	52731-68-7	C1=CC=C(C=C1)C2=PC3=CC=CC=C3C4=CC=CC=C42	{14: 13}
Did not match all atoms present	52733-73-0	CC(CCO)O.CC(CO)O.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(COCCO)O	{1: 2, 2: 8, 3: 2, 8: 2, 34: 2, 14: 8, 20: 6, 22: 1, 29: 2}
Did not match all atoms present	52735-88-3	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3[O-])OC)NC(=O)C5=CC6=CC=CC=C6C=C5[O-].[Na+].[Na+]	{24: 2, 1: 2, 22: 2, 14: 18, 31: 2}
Did not match all atoms present	52739-00-1	CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)O)O.C1=CC(=O)OC1=O	{1: 4, 2: 2, 3: 2, 4: 1, 14: 10, 20: 2, 22: 2, 28: 2}
Did not match all atoms present	5274-70-4	C1=CC(=C(C(=C1)[N+](=O)[O-])O)C=O	{26: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	52740-56-4	CC(CC1=CC=C(C=C1)OC)N.Cl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	52740-90-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)NC4=C(C=C5C(=C4)C(=O)C6=CC=CC=C6C5=O)Br)N	{14: 12, 18: 1, 24: 1, 25: 4, 30: 1, 31: 1}
Did not match all atoms present	52744-85-1	CCOC(=O)C(=CC1=CC=CC=C1)[N+]#[C-]	{1: 1, 2: 1, 6: 1, 7: 1, 34: 1, 14: 5, 28: 1}
Did not match all atoms present	52749-23-2	CC1=C(C(=CC=C1)N/N=C\2/C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-])C.[Na+]	{1: 2, 34: 1, 14: 8, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	5275-02-5	C1CNCCC1C(=O)C2=CNC3=CC=CC=C32	{24: 1, 32: 2, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	5275-69-4	CC(=O)C1=CC=C(O1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	52750-12-6	C1C2=C(C=CC(=C21)C3=CC=CC=C3)C4=CC=CC=C4	{11: 1, 14: 12}
Did not match all atoms present	52751-15-2	C1=CN=C(C(=N1)F)F	{16: 2, 35: 2, 14: 2}
Did not match all atoms present	52756-22-6	CC(C)OC(=O)C(C)N(C1=CC(=C(C=C1)F)Cl)C(=O)C2=CC=CC=C2	{1: 3, 3: 2, 33: 1, 14: 8, 16: 1, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	52756-25-9	CC(C(=O)OC)N(C1=CC(=C(C=C1)F)Cl)C(=O)C2=CC=CC=C2	{1: 2, 3: 1, 33: 1, 14: 8, 16: 1, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	52766-62-8	C1=CC=C2C(=C1)C(=O)N(C2=O)C3=C(C=C(C=C3)OC4=CC(=C(C=C4)N5C(=O)C6=CC=CC=C6C5=O)N7C(=O)C8=CC=CC=C8C7=O)N9C(=O)C1=CC=CC=C1C9=O	{25: 8, 22: 1, 14: 22, 33: 4}
Did not match all atoms present	52771-21-8	C1=CC(=CC(=C1)OC(F)(F)F)C=O	{16: 3, 26: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	52771-22-9	C1=CC(=CC(=C1)OC(F)(F)F)C#N	{16: 3, 4: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	52780-14-0	CC(C1=CC(=CC=C1)Br)O	{1: 1, 18: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	52780-23-1	C1=C(C=C(C=C1O)Cl)O	{17: 1, 21: 2, 14: 3}
Did not match all atoms present	52784-31-3	C1C(CC1=O)C2=CC=CC=C2	{25: 1, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	52788-53-1	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.[Gd+3]	{}
Did not match all atoms present	52788-54-2	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Sc+3].[Sc+3]	{29: 12}
Did not match all atoms present	52789-62-5	C1=CC2=C(C(=C1)O)C(=C(C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{30: 1, 21: 1, 14: 4, 29: 6}
Did not match all atoms present	5279-32-3	C1OC2=CC(=C(C=C2O1)Br)Br	{18: 2, 11: 1, 14: 2, 23: 2}
Did not match all atoms present	5279-59-4	CC(C)(C)C1=CC=C(C=C1)NC	{1: 4, 4: 1, 14: 4, 31: 1}
Did not match all atoms present	52793-11-0	CC(=O)CC(=O)NC1=C(C=CC(=C1)Cl)OC	{1: 2, 2: 1, 14: 3, 17: 1, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	52794-97-5	C[C@H]1[C@H]([C@H](CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5O)O)(C(=O)C)O)N)O.Cl	{1: 2, 11: 3, 12: 5, 13: 1, 14: 3, 17: 1, 20: 2, 21: 3, 22: 1, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	528-21-2	CC(=O)C1=C(C(=C(C=C1)O)O)O	{24: 1, 1: 1, 21: 3, 14: 2}
Did not match all atoms present	528-29-0	C1=CC=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 4}
Did not match all atoms present	528-43-8	C=CCC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)CC=C)O	{2: 2, 14: 6, 5: 2, 6: 2, 21: 2}
Did not match all atoms present	528-44-9	C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O	{27: 3, 14: 3}
Did not match all atoms present	528-45-0	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])[N+](=O)[O-]	{27: 1, 38: 2, 14: 3}
Did not match all atoms present	528-48-3	C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O)O	{25: 1, 21: 4, 14: 6, 23: 1}
Did not match all atoms present	528-53-0	C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]	{17: 1, 21: 6, 14: 5, 23: 1}
Did not match all atoms present	528-58-5	C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O)O)O.[Cl-]	{17: 1, 21: 5, 14: 6, 23: 1}
Did not match all atoms present	528-71-2	C1=CC=C2C(=C1)NC3=CC=CC(=O)C3=N2	{32: 1, 25: 1, 35: 1, 14: 7}
Did not match all atoms present	528-74-5	CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=C(C=C(C=C3Cl)C(=O)N[C@@H](CCC(=O)O)C(=O)O)Cl	{1: 1, 2: 3, 3: 1, 33: 1, 14: 3, 17: 2, 35: 4, 24: 1, 27: 2, 30: 2, 31: 1}
Did not match all atoms present	528-75-6	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C=O	{26: 1, 38: 2, 14: 3}
Did not match all atoms present	528-76-7	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCl	{40: 1, 17: 1, 38: 2, 14: 3}
Did not match all atoms present	528-79-0	CC1=CC(=C(C=C1)C(C)C)OC(=O)C	{1: 4, 3: 1, 28: 1, 14: 3}
Did not match all atoms present	528-90-5	CC1=CC(=C(C=C1C(=O)O)C)C	{1: 3, 27: 1, 14: 2}
Did not match all atoms present	528-94-9	C1=CC=C(C(=C1)C(=O)O)[O-].[NH4+]	{27: 1, 14: 4}
Did not match all atoms present	528-97-2	C1=CC=C2C=C(C=CC2=C1)C=NC3=CC=CC4=C3C(=O)NNC4=O	{32: 2, 25: 2, 34: 1, 14: 10, 6: 1}
Did not match all atoms present	5280-66-0	[H+].CC1=CC(=C(C=C1Cl)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)[O-])[O-])S(=O)(=O)[O-].[Mn+2]	{1: 1, 34: 2, 14: 7, 17: 1, 24: 1, 29: 3}
Did not match all atoms present	5280-69-3	CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Ba+2]	{1: 2, 34: 4, 3: 2, 38: 2, 14: 16, 24: 4, 29: 6, 31: 2}
Did not match all atoms present	52805-84-2	CC(=O)C1=CC=C(O1)CC2=CC=CO2	{24: 1, 1: 1, 2: 1, 14: 5, 23: 2}
Did not match all atoms present	52805-90-0	CC1=C(C(=CC=C1)C)SC2=C(C=CC=C2C)C	{40: 1, 1: 4, 14: 6}
Did not match all atoms present	5281-13-0	CCCCOCCOCCOC(C1=CC2=C(C=C1)OCO2)OCCOCCOCCCC	{1: 2, 2: 14, 3: 1, 11: 1, 14: 3, 22: 6, 23: 2}
Did not match all atoms present	5281-18-5	C1=CC=C(C=C1)C=NN	{30: 1, 34: 1, 14: 5, 6: 1}
Did not match all atoms present	52811-80-0	CCCCCC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CCC	{1: 2, 2: 6, 28: 2, 14: 8}
Did not match all atoms present	52814-92-3	CC(=O)C1=CC2=C(O1)C=C(C=C2)OC	{24: 1, 1: 2, 22: 1, 14: 4, 23: 1}
Did not match all atoms present	52818-63-0	COC1=CC=C(C=C1)CNC2=CC=CC=N2	{1: 1, 2: 1, 35: 1, 14: 8, 22: 1, 31: 1}
Did not match all atoms present	52819-09-7	C1=CS(=O)(=O)C(C1(Cl)Cl)Cl	{17: 3, 12: 1, 13: 1, 14: 2, 29: 2}
Did not match all atoms present	52821-30-4	CCCCCCCCCCCCS(=O)(=O)CC#N	{1: 1, 2: 12, 29: 2, 37: 1}
Did not match all atoms present	52828-97-4	CC(=C)C(=O)OC(C[N+](C)(C)C)C[N+](C)(C)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]	{1: 9, 2: 2, 3: 1, 5: 1, 7: 1, 22: 2, 28: 1, 29: 6}
Did not match all atoms present	5283-66-9	CCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 7, 17: 3}
Did not match all atoms present	5283-67-0	CCCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 8, 17: 3}
Did not match all atoms present	52830-65-6	CCN(CC)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)C	{1: 3, 2: 2, 33: 1, 14: 7, 24: 1, 27: 1}
Did not match all atoms present	52830-71-4	CCN(CC)C1=CC(=C(C=C1)C(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)O)C	{1: 3, 2: 2, 33: 1, 14: 3, 17: 4, 24: 1, 27: 1}
Did not match all atoms present	52830-74-7	CN(C)C1=CC=C(C=C1)C2(C3=C(C=C(C=C3)N(C)C)C(=O)O2)C4=C(C=C(C=C4)N(C)C)N(C)C	{1: 8, 28: 1, 13: 1, 14: 10, 33: 4}
Did not match all atoms present	52830-80-5	CCN(CC)C1=CC(=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(C(=CC=C4)N(C)C)N(C)C)C	{1: 7, 2: 2, 33: 3, 13: 1, 14: 10, 28: 1}
Did not match all atoms present	52831-39-7	C1=CC=C2C(=C1)C3=CSC4=C(C3=N2)C=C(C=C4)F	{16: 1, 41: 1, 35: 1, 14: 8}
Did not match all atoms present	52831-41-1	C1C2=C(C3=C(S1)C=CC(=C3)F)NC4=C2C=CC5=CC=CC=C54	{16: 1, 32: 1, 11: 1, 14: 9, 41: 1}
Did not match all atoms present	52831-45-5	C1=CC=C2C(=C1)C=CC3=C2C4=CSC5=C(C4=N3)C=C(C=C5)F	{16: 1, 41: 1, 35: 1, 14: 10}
Did not match all atoms present	52831-53-5	C1=CC=C2C(=C1)C=CC3=C2N=C4C3=CSC5=C4C=CC(=C5)F	{16: 1, 41: 1, 35: 1, 14: 10}
Did not match all atoms present	52831-55-7	C1C2=C(C3=C(S1)C=C(C=C3)F)NC4=C2C=CC5=CC=CC=C54	{16: 1, 32: 1, 11: 1, 14: 9, 41: 1}
Did not match all atoms present	52831-56-8	C1=CC=C2C(=C1)C=CC3=C2C4=CSC5=C(C4=N3)C=CC(=C5)F	{16: 1, 41: 1, 35: 1, 14: 10}
Did not match all atoms present	52831-58-0	C1C2=CC3=CC=CC=C3N=C2C4=C(S1)C(=CC=C4)F	{16: 1, 35: 1, 11: 1, 14: 8, 41: 1}
Did not match all atoms present	52831-60-4	CC1=C2CSC3=C(C2=NC4=CC=CC=C14)C=CC=C3F	{1: 1, 35: 1, 41: 1, 11: 1, 14: 7, 16: 1}
Did not match all atoms present	52831-62-6	C1=CC=C2C(=C1)C3=CSC4=C(C3=N2)C=CC=C4F	{16: 1, 41: 1, 35: 1, 14: 8}
Did not match all atoms present	52831-65-9	C1=CC=C2C(=C1)C=CC3=C2N=C4C3=CSC5=C4C=CC=C5F	{16: 1, 41: 1, 35: 1, 14: 10}
Did not match all atoms present	52831-67-1	C1C2=C(C3=C(S1)C(=CC=C3)F)NC4=C2C5=CC=CC=C5C=C4	{16: 1, 32: 1, 11: 1, 14: 9, 41: 1}
Did not match all atoms present	52831-68-2	C1=CC=C2C(=C1)C=CC3=C2C4=CSC5=C(C4=N3)C=CC=C5F	{16: 1, 41: 1, 35: 1, 14: 10}
Did not match all atoms present	52833-94-0	C1=C(C(=NC=C1Br)N)C(=O)O	{35: 1, 18: 1, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	5284-06-0	CCCCP(=O)(OCC)OCCCCOP(=O)(CCCC)OCC	{1: 4, 2: 12, 29: 2, 22: 4}
Did not match all atoms present	5284-07-1	CP(=O)(C)OCCCCOP(=O)(C)C	{1: 4, 2: 4, 29: 2, 22: 2}
Did not match all atoms present	5284-29-7	CCCCCCCCCCCCC1=CC=CC=C1O	{1: 1, 2: 11, 21: 1, 14: 4}
Did not match all atoms present	5284-66-2	CCCS(=O)(=O)O	{1: 1, 2: 2, 20: 1, 29: 2}
Did not match all atoms present	5284-80-0	C1=CC(=CC=C1C=CC(=O)C=CC2=CC=C(C=C2)N=[N+]=[N-])N=[N+]=[N-]	{24: 1, 34: 4, 14: 8, 6: 4}
Did not match all atoms present	52840-38-7	CCNC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 28: 1, 31: 1}
Did not match all atoms present	52849-30-6	CC(C)OP(=O)(C=C)C=C	{1: 2, 3: 1, 5: 2, 6: 2, 22: 1, 29: 1}
Did not match all atoms present	5285-18-7	C1OC2=C(O1)C=C(C=C2)C=CC=CC(=O)O	{27: 1, 11: 1, 14: 3, 6: 4, 23: 2}
Did not match all atoms present	5285-87-0	C1=CC=C(C=C1)SC#N	{40: 1, 37: 1, 14: 5}
Did not match all atoms present	52858-75-0	COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)COC.C=CC(=O)OCCO	{1: 6, 2: 8, 35: 3, 5: 1, 6: 1, 33: 3, 20: 1, 22: 6, 28: 1}
Did not match all atoms present	52868-49-2	CCOC(=O)CCNC1=C(C=CC(=C1)NC(=O)C)OC	{1: 3, 2: 3, 14: 3, 22: 1, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	52868-69-6	CSC1=NC(=C(S1)N)C(=O)N	{1: 1, 35: 1, 40: 1, 41: 1, 24: 1, 30: 2}
Did not match all atoms present	52869-31-5	CN(C)C1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C=CC4=C3C(=O)C(=O)C=C4	{1: 2, 33: 1, 14: 10, 21: 1, 25: 2, 31: 1}
Did not match all atoms present	52869-91-7	[O-2].[Al+3].[Ti+4].[Ba+2]	{}
Did not match all atoms present	52869-93-9	[O-2].[Ca+2].[Ti+4].[Ba+2]	{}
Did not match all atoms present	52870-46-9	CC(C)CC(C)N=C1C=CC(=NC2=CC=CC=C2)C=C1	{1: 3, 2: 1, 3: 2, 34: 2, 14: 9, 15: 2}
Did not match all atoms present	52871-23-5	CC[NH+](CC)CCN1C2=C3C(=C(C=C2)C)SC4=CC=CC=C4C3=N1.CS(=O)(=O)[O-]	{1: 4, 2: 4, 35: 1, 33: 1, 41: 1, 14: 6, 29: 3}
Did not match all atoms present	52875-49-7	C1=CC2=C3C(=C1)[Te][Te]C3=CC=C2	{14: 6}
Did not match all atoms present	52881-76-2	C1CC=CN(C1)C(=O)C2=CC=CC=C2C(=O)N3CCCC=C3	{24: 2, 33: 2, 11: 6, 14: 8}
Did not match all atoms present	52881-77-3	C1CC=CN(C1)C(=O)C2=CC=C(C=C2)C(=O)N3CCCC=C3	{24: 2, 33: 2, 11: 6, 14: 8}
Did not match all atoms present	52881-78-4	C1CCN(CC1)C(=O)C2=CC=C(C=C2)C(=O)N3CCCC=C3	{24: 2, 33: 2, 11: 8, 14: 6}
Did not match all atoms present	52881-79-5	C1CCN(CC1)C(=O)CC2=CC=CC=C2CC(=O)N3CCCCC3	{24: 2, 33: 2, 2: 2, 11: 10, 14: 4}
Did not match all atoms present	52881-80-8	C1CC=CN(C1)C(=O)CC2=CC=CC=C2CC(=O)N3CCCC=C3	{24: 2, 33: 2, 2: 2, 11: 6, 14: 8}
Did not match all atoms present	52882-84-5	C1CCN(CC1)C(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)N4CCCCC4	{24: 2, 33: 2, 11: 10, 14: 8}
Did not match all atoms present	52882-85-6	C1CC=CN(C1)C(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)N4CCCC=C4	{24: 2, 33: 2, 11: 6, 14: 12}
Did not match all atoms present	52882-86-7	C1CCN(CC1)C(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)N4CCCC=C4	{24: 2, 33: 2, 11: 8, 14: 10}
Did not match all atoms present	52882-87-8	C1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)N4CCCCC4	{24: 2, 33: 2, 11: 10, 14: 8}
Did not match all atoms present	52882-88-9	C1CC=CN(C1)C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)N4CCCC=C4	{24: 2, 33: 2, 11: 6, 14: 12}
Did not match all atoms present	52884-84-1	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)OCC=C)C)C	{1: 5, 2: 4, 3: 2, 5: 1, 6: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1}
Did not match all atoms present	52888-80-9	CCCN(CCC)C(=O)SCC1=CC=CC=C1	{1: 2, 2: 5, 33: 1, 40: 1, 14: 5, 24: 1}
Did not match all atoms present	52889-80-2	[1H]CC1=CC=CC=C1C2=CC=CC=C2C[1H]	{1: 2, 14: 8}
Did not match all atoms present	52889-82-4	[1H]CC1=CC=C(C=C1)C2=CC=C(C=C2)C[1H]	{1: 2, 14: 8}
Did not match all atoms present	52899-27-1	CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CCCC)C#N	{1: 2, 2: 8, 37: 1, 14: 11, 22: 1, 28: 2}
Did not match all atoms present	529-05-5	CCC1=CC2=C(C=CC2=C(C=C1)C)C	{1: 3, 2: 1, 14: 5}
Did not match all atoms present	529-08-8	CC1=C2C=C(C=C2C(=CC=C1)C)C(C)C	{1: 4, 3: 1, 14: 5}
Did not match all atoms present	529-19-1	CC1=CC=CC=C1C#N	{1: 1, 37: 1, 14: 4}
Did not match all atoms present	529-20-4	CC1=CC=CC=C1C=O	{1: 1, 26: 1, 14: 4}
Did not match all atoms present	529-21-5	CCC1=C(C=CN=C1)C	{1: 2, 2: 1, 35: 1, 14: 3}
Did not match all atoms present	529-23-7	C1=CC=C(C(=C1)C=O)N	{26: 1, 30: 1, 14: 4}
Did not match all atoms present	529-28-2	COC1=CC=CC=C1I	{1: 1, 19: 1, 22: 1, 14: 4}
Did not match all atoms present	529-33-9	C1CC(C2=CC=CC=C2C1)O	{20: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	529-34-0	C1CC2=CC=CC=C2C(=O)C1	{25: 1, 11: 3, 14: 4}
Did not match all atoms present	529-35-1	C1CCC2=C(C1)C=CC=C2O	{11: 4, 21: 1, 14: 3}
Did not match all atoms present	529-36-2	C1=CC=C2C(=C1)C=CC=C2S	{14: 7, 39: 1}
Did not match all atoms present	529-38-4	CCOC(=O)[C@@H]1[C@H]2CC[C@H](N2C)C[C@@H]1OC(=O)C3=CC=CC=C3	{1: 2, 2: 1, 33: 1, 11: 3, 12: 4, 14: 5, 28: 2}
Did not match all atoms present	529-44-2	C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	{25: 1, 21: 6, 14: 4, 23: 1}
Did not match all atoms present	529-64-6	C1=CC=C(C=C1)C(CO)C(=O)O	{27: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	529-65-7	CCN(C1=CC=CC=C1)C(=O)C	{24: 1, 1: 2, 2: 1, 14: 5, 33: 1}
Did not match all atoms present	529-78-2	C=CCCN1C[C@@H]2C[C@H](C1)C3=CC=CC(=O)N3C2	{33: 2, 2: 2, 5: 1, 6: 1, 11: 4, 12: 2, 14: 3, 25: 1}
Did not match all atoms present	529-84-0	CC1=CC(=O)OC2=CC(=C(C=C12)O)O	{1: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	529-85-1	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2F	{16: 1, 14: 9}
Did not match all atoms present	529-86-2	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2O	{21: 1, 14: 9}
Did not match all atoms present	529-92-0	COC1=CC(=NC2=CC=CC=C21)CCC3=CC4=C(C=C3)OCO4	{1: 1, 2: 2, 35: 1, 11: 1, 14: 8, 22: 1, 23: 2}
Did not match all atoms present	5290-24-4	CC(=O)OCCC[Si](C)(Cl)Cl	{1: 2, 2: 3, 28: 1, 17: 2}
Did not match all atoms present	5290-62-0	C1=CC=C2C(=O)C=CC(=NNC3=CC=C(C=C3)[N+](=O)[O-])C2=C1	{34: 1, 38: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	5290-66-4	C1=CC=C(C=C1)N/N=C/2\C=C(C(=O)C3=CC=CC=C32)N=NC4=CC=CC=C4	{25: 1, 34: 3, 31: 1, 14: 15, 15: 2}
Did not match all atoms present	52900-12-6	CCCCCCCCCCCCCC(=O)[N+](CCO)(CC[O-])C(=O)CCCCCCCCCCC	{24: 2, 1: 2, 2: 26, 20: 1, 29: 1}
Did not match all atoms present	52907-01-4	CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C.CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C.C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=C(C=C(C=C3)C(=O)O)C(=O)O)OC(=O)C4=C(C=C(C=C4)C(=O)O)C(=O)O)OC(=O)C5=C(C=C(C=C5)C(=O)O)C(=O)O)OC6C(C(C(C(O6)COC(=O)C7=C(C=C(C=C7)C(=O)O)C(=O)O)OC(=O)C8=C(C=C(C=C8)C(=O)O)C(=O)O)OC(=O)C9=C(C=C(C=C9)C(=O)O)C(=O)O)OC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O.C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O.C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O	{1: 16, 2: 10, 12: 50, 14: 24, 20: 16, 22: 5, 23: 10, 27: 16, 28: 24}
Did not match all atoms present	5291-77-0	C1CC(=O)N(C1)CC2=CC=CC=C2	{25: 1, 2: 1, 11: 3, 14: 5, 33: 1}
Did not match all atoms present	52910-78-8	CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 7, 38: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	52911-98-5	CC1=CC(=CC(=S)O1)OC	{1: 2, 22: 1, 14: 2, 23: 1}
Did not match all atoms present	52911-99-6	CC1=CC(=O)C=C(O1)SC	{40: 1, 1: 2, 25: 1, 14: 2, 23: 1}
Did not match all atoms present	52913-14-1	CC1=CC=C(C=C1)S(=O)(=O)ON	{1: 1, 30: 1, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	52913-45-8	CC1=CC=C(C=C1)S(=O)(=O)N(C)SCl	{1: 2, 33: 1, 40: 1, 14: 4, 17: 1, 29: 2}
Did not match all atoms present	52917-87-0	C1C2CC3CC1CC(C2)(C3/C(=C/[N+]#N)/[O-])Br	{34: 1, 6: 1, 7: 1, 11: 5, 12: 4, 13: 1, 18: 1}
Did not match all atoms present	52918-63-5	CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Br)Br)C	{1: 2, 3: 1, 37: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 18: 2, 22: 1, 28: 1}
Did not match all atoms present	5292-45-5	COC(=O)C1=CC(=C(C=C1)C(=O)OC)[N+](=O)[O-]	{1: 2, 28: 2, 38: 1, 14: 3}
Did not match all atoms present	5292-53-5	CCOC(=O)C(=CC1=CC=CC=C1)C(=O)OCC	{1: 2, 2: 2, 6: 1, 7: 1, 14: 5, 28: 2}
Did not match all atoms present	5293-84-5	C1=CC=C(C=C1)[P+](CCl)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{17: 2, 2: 1, 14: 15}
Did not match all atoms present	52933-62-7	[O-2].[Fe+3].[Zr+4]	{}
Did not match all atoms present	52934-83-5	C[C@H]1C2=C(C[C@@H](O1)CC(=O)O)C(=O)C3=C(C2=O)C(=CC=C3)O	{1: 1, 2: 1, 11: 1, 12: 2, 14: 3, 15: 2, 21: 1, 23: 1, 25: 2, 27: 1}
Did not match all atoms present	52935-15-6	[Cu].[Cu].[Sn]	{}
Did not match all atoms present	52939-94-3	C1=CC=C(C=C1)C=CC(=NO)C2=CC=CC=C2	{34: 1, 20: 1, 14: 10, 6: 2, 7: 1}
Did not match all atoms present	52944-34-0	CCCC1=CC=C(C=C1)Cl	{1: 1, 2: 2, 14: 4, 17: 1}
Did not match all atoms present	52950-18-2	C1=CC=C(C(=C1)[C@H](C(=O)O)O)Cl	{27: 1, 17: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	52951-38-9	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Bi+3]	{24: 3, 1: 3, 2: 42, 6: 6}
Did not match all atoms present	52953-36-3	COC1=CC(=C(C=C1)N=NC2=C(C=C3C=C(C=CC3=C2[O-])NC4=NC(=NC(=N4)NCCO)NC5=CC6=C(C=C5)C(=O)/C(=N\NC7=C(C=CC(=C7)S(=O)(=O)[O-])[O-])/C(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{1: 1, 2: 2, 35: 3, 34: 3, 14: 14, 15: 2, 20: 1, 22: 1, 25: 1, 29: 12, 31: 4}
Did not match all atoms present	5296-64-0	C=CCSC1=CC=CC=C1	{40: 1, 2: 1, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	52963-27-6	[1H]CC1=CC=CC2=C1C(=CC=C2)C3=CC=CC4=C3C(=CC=C4)C[1H]	{1: 2, 14: 12}
Did not match all atoms present	52968-02-2	CNC(=O)NC1=NC(=CS1)C2=CC=CC=C2	{1: 1, 35: 1, 41: 1, 14: 6, 24: 1, 31: 2}
Did not match all atoms present	52981-88-1	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCC3=CC=C(C=C3)C4=NC5=CC=CC=C5O4)O	{2: 1, 35: 1, 14: 16, 21: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	52986-66-0	C1=CC=C(C(=C1)CCl)N=C=O	{2: 1, 8: 1, 34: 1, 14: 4, 17: 1, 29: 1}
Did not match all atoms present	52996-94-8	CC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O.C(CCCO)CCO	{1: 1, 2: 7, 3: 1, 14: 6, 20: 4, 28: 4}
Did not match all atoms present	53-16-7	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 6, 12: 3, 13: 1, 14: 3, 21: 1, 25: 1}
Did not match all atoms present	53-18-9	CCN(CC)CCN1C2=C(C=CC(=C2)OC)C3=C1[C@H]4C[C@H]5[C@H](C[C@H]([C@@H](C5C(=O)OC)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC)CN4CC3	{1: 8, 2: 4, 33: 3, 11: 5, 12: 6, 14: 5, 22: 5, 28: 2}
Did not match all atoms present	53-19-0	C1=CC=C(C(=C1)C(C2=CC=C(C=C2)Cl)C(Cl)Cl)Cl	{17: 4, 3: 2, 14: 8}
Did not match all atoms present	53-21-4	CN1[C@@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)C3=CC=CC=C3)C(=O)OC.Cl	{1: 2, 33: 1, 11: 3, 12: 4, 14: 5, 17: 1, 28: 2}
Did not match all atoms present	53-44-1	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OCCC#N)CCC4=C3C=CC(=C4)OC	{1: 2, 2: 2, 37: 1, 11: 6, 12: 4, 13: 1, 14: 3, 22: 2}
Did not match all atoms present	53-46-3	CC[N+](C)(CC)CCOC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13.[Br-]	{1: 3, 2: 4, 12: 1, 14: 8, 18: 1, 23: 1, 28: 1}
Did not match all atoms present	53-57-6	C1C=CN(C=C1C(=O)N)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)OP(=O)(O)O)O)O)O	{33: 2, 2: 2, 35: 3, 11: 1, 12: 8, 14: 5, 15: 1, 20: 7, 22: 4, 23: 2, 24: 1, 29: 3, 30: 2}
Did not match all atoms present	53-59-8	C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN=C5N)OP(=O)(O)O)O)O)O)C(=O)N	{33: 2, 2: 2, 35: 3, 12: 8, 14: 6, 20: 6, 22: 4, 23: 2, 24: 1, 29: 4, 30: 2}
Did not match all atoms present	53-60-1	CN(C)CCCN1C2=CC=CC=C2SC3=CC=CC=C31.Cl	{1: 2, 2: 3, 33: 2, 41: 1, 14: 8, 17: 1}
Did not match all atoms present	53-63-4	C[C@@]12CCC[C@H]1[C@@H]3CCC4=C([C@H]3CC2)C=CC(=C4)O	{1: 1, 11: 7, 12: 3, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	53-64-5	CCC(=C(C#N)C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC	{1: 3, 2: 1, 37: 1, 7: 2, 14: 8, 22: 2}
Did not match all atoms present	53-69-0	CC1=CC2=CC3=C(C=CC4=CC=CC=C43)N=C2C(=C1)C	{1: 2, 35: 1, 14: 9}
Did not match all atoms present	53-70-3	C1=CC=C2C(=C1)C=CC3=CC4=C(C=CC5=CC=CC=C54)C=C32	{14: 14}
Did not match all atoms present	53-79-2	CN(C)C1=NC=NC2=C1N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)NC(=O)[C@H](CC4=CC=C(C=C4)OC)N)O	{1: 3, 2: 2, 3: 1, 33: 2, 12: 4, 14: 6, 35: 3, 20: 2, 22: 1, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	53-84-9	C1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN=C5N)O)O)O)O)C(=O)N	{33: 2, 2: 2, 35: 3, 12: 8, 14: 6, 20: 5, 22: 3, 23: 2, 24: 1, 29: 3, 30: 2}
Did not match all atoms present	53-85-0	C1=C2C(=CC(=C1Cl)Cl)N(C=N2)C3C(C(C(O3)CO)O)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 3, 17: 2, 20: 3, 23: 1}
Did not match all atoms present	53-86-1	CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O	{1: 2, 2: 1, 33: 1, 14: 7, 17: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	53-89-4	CN1CCC(CC1)N2C(=O)C(=C(N2)C3=CC=CC=C3)CC4=CC=CC=C4	{32: 1, 1: 1, 2: 1, 33: 2, 11: 4, 12: 1, 14: 10, 25: 1}
Did not match all atoms present	53-94-1	C1C2=CC=CC=C2C3=C1C=C(C=C3)NO	{11: 1, 20: 1, 14: 7, 31: 1}
Did not match all atoms present	53-95-2	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)O	{1: 1, 33: 1, 11: 1, 14: 7, 20: 1, 24: 1}
Did not match all atoms present	53-96-3	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2	{24: 1, 1: 1, 11: 1, 14: 7, 31: 1}
Did not match all atoms present	530-14-3	CC(=O)C1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	{1: 1, 2: 1, 12: 5, 14: 4, 20: 4, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	530-31-4	C1=CC=C(C=C1)C(C(=O)O)O.N	{27: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	530-35-8	CC[NH+](C)C(C)C(C1=CC=CC=C1)O.[Cl-]	{1: 3, 2: 1, 3: 2, 14: 5, 17: 1, 20: 1}
Did not match all atoms present	530-40-5	CCN(CC)C(=O)C1=CC=NC=C1	{1: 2, 2: 2, 35: 1, 33: 1, 14: 4, 24: 1}
Did not match all atoms present	530-43-8	CCCCCCCCCCCCCCCC(=O)OCC(C(C1=CC=C(C=C1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl	{1: 1, 2: 15, 3: 3, 38: 1, 14: 4, 17: 2, 20: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	530-44-9	CN(C)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 2, 14: 9, 33: 1}
Did not match all atoms present	530-45-0	CC1=CC=C(C=C1)C(C)C2=CC=C(C=C2)C	{1: 3, 3: 1, 14: 8}
Did not match all atoms present	530-47-2	C1=CC=C(C=C1)N(C2=CC=CC=C2)N.Cl	{17: 1, 30: 1, 14: 10, 33: 1}
Did not match all atoms present	530-48-3	C=C(C1=CC=CC=C1)C2=CC=CC=C2	{5: 1, 14: 10, 7: 1}
Did not match all atoms present	530-50-7	C1=CC=C(C=C1)N(C2=CC=CC=C2)N	{33: 1, 30: 1, 14: 10}
Did not match all atoms present	530-56-3	COC1=CC(=CC(=C1O)OC)CO	{1: 2, 2: 1, 14: 2, 20: 1, 21: 1, 22: 2}
Did not match all atoms present	530-57-4	COC1=CC(=CC(=C1O)OC)C(=O)O	{1: 2, 22: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	530-59-6	COC1=CC(=CC(=C1O)OC)C=CC(=O)O	{1: 2, 6: 2, 14: 2, 21: 1, 22: 2, 27: 1}
Did not match all atoms present	530-64-3	C1=CC=C2C(=C1)C=CC=N2.Cl	{17: 1, 35: 1, 14: 7}
Did not match all atoms present	530-75-6	CC(=O)OC1=CC=CC=C1C(=O)OC2=CC=CC=C2C(=O)O	{1: 1, 27: 1, 28: 2, 14: 8}
Did not match all atoms present	530-78-9	C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F	{16: 3, 27: 1, 4: 1, 14: 8, 31: 1}
Did not match all atoms present	530-85-8	C1=CC=C(C(=C1)C#CC(=O)O)[N+](=O)[O-]	{10: 2, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	530-91-6	C1CC2=CC=CC=C2CC1O	{20: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	530-93-8	C1CC2=CC=CC=C2CC1=O	{25: 1, 11: 3, 14: 4}
Did not match all atoms present	53001-22-2	[2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])O[2H]	{1: 3, 4: 1, 20: 1}
Did not match all atoms present	53001-71-1	C1=C(C(=C(C(=C1F)F)F)F)CBr	{16: 4, 2: 1, 18: 1, 14: 1}
Did not match all atoms present	53001-73-3	C1=C(C(=C(C(=C1F)F)CBr)F)F	{16: 4, 2: 1, 18: 1, 14: 1}
Did not match all atoms present	53007-06-0	C1[C@H]2CN(C[C@@H]1C3=CC=CC(=O)N3C2)C=O	{33: 2, 11: 4, 12: 2, 14: 3, 25: 1, 26: 1}
Did not match all atoms present	53008-63-2	CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5	{1: 1, 2: 5, 12: 5, 14: 20, 22: 5, 23: 1}
Did not match all atoms present	53010-03-0	CNC1=NNN=N1	{32: 1, 1: 1, 35: 3, 31: 1}
Did not match all atoms present	53011-73-7	CC(CC(CC1=COC=C1)O)O	{1: 1, 2: 2, 3: 2, 14: 3, 20: 2, 23: 1}
Did not match all atoms present	53011-74-8	C1CCCC2=CC=C(CC1)C=C2	{11: 6, 14: 4}
Did not match all atoms present	53012-61-6	CC1=CC2=C(C=C1)N=C(O2)C	{1: 2, 35: 1, 14: 3, 23: 1}
Did not match all atoms present	53019-76-4	CC[N+]1=C(SC2=C1C=CC3=CC=CC=C32)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 33: 1, 41: 1, 14: 10, 29: 3}
Did not match all atoms present	5302-41-0	CCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 2: 1, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	53020-10-3	C1=CSC2=C1C=C(S2)I	{41: 2, 19: 1, 14: 3}
Did not match all atoms present	53020-11-4	C1=CSC2=C1C(=CS2)I	{41: 2, 19: 1, 14: 3}
Did not match all atoms present	53022-70-1	[CH3-].[CH3-].[CH3-].[CH3-].O=[Re]	{29: 1}
Did not match all atoms present	53023-59-9	CC(CCCC(C)(C)OC)CC=C(C(=CC(=O)[O-])C)C(=O)[O-].[Na+].[Na+]	{1: 5, 2: 4, 3: 1, 4: 1, 6: 2, 7: 2, 22: 1, 24: 2}
Did not match all atoms present	53023-66-8	CC(CCCC(C)(C)OC)C/C=C/C(=C/C(=O)O)/C.N	{1: 5, 2: 4, 3: 1, 4: 1, 6: 3, 7: 1, 22: 1, 27: 1}
Did not match all atoms present	53023-68-0	CC(C)CCCC(C)C/C=C/C(=C/C(=O)O)/C.N	{1: 4, 2: 4, 3: 2, 6: 3, 7: 1, 27: 1}
Did not match all atoms present	53032-72-7	CCCCCCCCC1=CC=C(C=C1)OP(OCCCCCCOP(OC2=CC=C(C=C2)CCCCCCCC)OC3=C(C=C(C(=C3)C)C(CCC)C4=CC(=C(C=C4C)O)CCCC)CCCC)OC5=C(C=C(C(=C5)C)C(CCC)C6=CC(=C(C=C6C)O)CCCC)CCCC	{1: 12, 2: 36, 3: 2, 14: 16, 21: 2, 22: 6}
Did not match all atoms present	53037-66-4	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCCC(=O)O)CCCC(=O)O.C(CCO)CO	{2: 12, 8: 2, 34: 2, 14: 8, 20: 2, 27: 2, 29: 2}
Did not match all atoms present	5304-21-2	CC1=NC2=C(S1)C=C(C=C2)Br	{1: 1, 18: 1, 35: 1, 14: 3, 41: 1}
Did not match all atoms present	53042-19-6	CC(CCCC(C)(C)OC)C/C=C\C(=C/C(=O)O)\C.N	{1: 5, 2: 4, 3: 1, 4: 1, 6: 3, 7: 1, 22: 1, 27: 1}
Did not match all atoms present	53042-79-8	CCCCC=CCCC=CCCCCCCO.CC(=O)[O-]	{24: 1, 1: 2, 2: 11, 20: 1, 6: 4}
Did not match all atoms present	53048-62-7	CCN(CC[N+](C)(C)N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl.[Cl-]	{1: 3, 2: 3, 38: 1, 33: 1, 34: 2, 14: 6, 17: 3, 30: 1}
Did not match all atoms present	53051-19-7	CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)C)OP(=O)(OC3=C(C=C(C=C3C(C)(C)C)C)CC4=C(C(=CC(=C4)C)C(C)(C)C)O)OC5=C(C=C(C=C5C(C)(C)C)C)CC6=C(C(=CC(=C6)C)C(C)(C)C)O	{1: 24, 2: 3, 4: 6, 14: 12, 21: 3, 22: 3, 29: 1}
Did not match all atoms present	53052-06-5	C1=CC2=C(NC(=S)O2)N=C1	{32: 1, 35: 1, 14: 3, 23: 1}
Did not match all atoms present	53053-57-9	[O-]Cl.[O-]Cl.[O-]Cl.[Na+].[Ca+2]	{17: 3, 29: 3}
Did not match all atoms present	53054-76-5	C1=CN=CC=C1CCS(=O)(=O)O	{2: 2, 35: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	53054-77-6	C=CC[N+]1=CC2=CC=CC=C2C=C1.[Br-]	{33: 1, 2: 1, 5: 1, 6: 1, 14: 7, 18: 1}
Did not match all atoms present	5306-98-9	CC1=C(C=C(C=C1)Cl)O	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	53061-07-7	CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCCCS(=O)(=O)[O-]	{1: 1, 2: 4, 33: 1, 41: 1, 14: 3, 17: 1, 29: 3}
Did not match all atoms present	53061-10-2	C(CCl)S(=O)(=O)COCS(=O)(=O)CCCl	{17: 2, 2: 6, 29: 4, 22: 1}
Did not match all atoms present	53064-41-8	CCC1=NOC(=C1C(=O)OCC)C	{1: 3, 2: 2, 35: 1, 28: 1, 23: 1}
Did not match all atoms present	53066-19-6	CC(C1=C(C=CC=C1Cl)Cl)O	{1: 1, 3: 1, 20: 1, 14: 3, 17: 2}
Did not match all atoms present	53067-74-6	CCC1=NCCC1(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 35: 1, 11: 2, 13: 1, 14: 10, 15: 1}
Did not match all atoms present	5307-02-8	COC1=C(C=CC(=C1)N)N	{1: 1, 30: 2, 22: 1, 14: 3}
Did not match all atoms present	5307-03-9	CC1=CC(=C(C=C1N)Cl)N	{1: 1, 30: 2, 14: 2, 17: 1}
Did not match all atoms present	5307-07-3	CC1=C(C=C(C=C1)NC(=O)C)O	{24: 1, 1: 2, 21: 1, 14: 3, 31: 1}
Did not match all atoms present	5307-14-2	C1=CC(=C(C=C1N)[N+](=O)[O-])N	{38: 1, 30: 2, 14: 3}
Did not match all atoms present	53072-18-7	C1=C(C(=C(C(=C1F)F)F)F)CO	{16: 4, 2: 1, 20: 1, 14: 1}
Did not match all atoms present	53078-85-6	CC1=CC(=C(C=C1)Br)N	{1: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	53083-27-5	CCCCCCCCCCCC(=O)OC1=C(C(=O)C2=CC=CC=C21)C3=C(C=C(C=C3C)C)C	{1: 4, 2: 10, 14: 6, 15: 2, 25: 1, 28: 1}
Did not match all atoms present	53086-28-5	C1=CC2=C3C(=C1)C4=C5C6=C(C=C4)C7=CC=CC8=C7C9=C6C1=C(C=CC4=C1C5=C3C(=C4)C=C2)C=C9C=C8	{14: 16}
Did not match all atoms present	53088-50-9	B1(NC=CN1C)C2=CC=CC=C2	{32: 1, 1: 1, 14: 7, 33: 1}
Did not match all atoms present	53088-51-0	B1(N(C=CN1C)C)C(C)(C)C	{1: 5, 4: 1, 14: 2, 33: 2}
Did not match all atoms present	53088-52-1	B1(N(CCN1C)C)C(C)(C)C	{1: 5, 11: 2, 4: 1, 33: 2}
Did not match all atoms present	53088-68-9	COC(=O)CC1=CC(=CC=C1)Cl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	5309-18-2	COC1=CC2=C(C=CC=C2OC)C=C1	{1: 2, 22: 2, 14: 6}
Did not match all atoms present	53098-12-7	F[Si](F)(F)[AsH2]	{16: 3}
Did not match all atoms present	531-02-2	C1=C(C=C(C=C1O)O)C2=CC(=CC(=C2)O)O	{21: 4, 14: 6}
Did not match all atoms present	531-14-6	CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CCC(=O)O)C)C(=C4C)CCC(=O)O)C(=C3C)CCC(=O)O)CCC(=O)O	{32: 2, 1: 4, 2: 8, 35: 2, 14: 4, 27: 4}
Did not match all atoms present	531-18-0	C(N(CO)C1=NC(=NC(=N1)N(CO)CO)N(CO)CO)O	{33: 3, 2: 6, 35: 3, 20: 6}
Did not match all atoms present	531-29-3	COC1=C(C=CC(=C1)/C=C/CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	{1: 1, 2: 2, 6: 2, 12: 5, 14: 3, 20: 5, 22: 2, 23: 1}
Did not match all atoms present	531-37-3	COC1=CC=CC=C1OC(=O)C2=CC=CC=C2	{1: 1, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	531-39-5	CCCCC(=O)OC1=CC=CC=C1OC	{1: 2, 2: 3, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	531-52-2	C1=CC=C(C=C1)C(=NNC2=CC=CC=C2)N=NC3=CC=CC=C3	{34: 3, 31: 1, 14: 15, 7: 1}
Did not match all atoms present	531-53-3	C[N+](=C1C=CC2=NC3=C(C=C(C=C3)N)SC2=C1)C.[Cl-]	{1: 2, 35: 1, 33: 1, 41: 1, 14: 6, 17: 1, 30: 1}
Did not match all atoms present	531-59-9	COC1=CC2=C(C=C1)C=CC(=O)O2	{1: 1, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	531-72-6	C1=CC(=CC=C1C(=O)N)[As](SCC(=O)O)SCC(=O)O	{2: 2, 40: 2, 14: 4, 24: 1, 27: 2, 30: 1}
Did not match all atoms present	531-75-9	C1=CC(=O)OC2=CC(=C(C=C21)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O	{2: 1, 12: 5, 14: 4, 20: 4, 21: 1, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	531-76-0	C1=CC(=CC=C1CC(C(=O)O)N)N(CCCl)CCCl	{33: 1, 2: 5, 3: 1, 14: 4, 17: 2, 27: 1, 30: 1}
Did not match all atoms present	531-81-7	C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)O	{27: 1, 28: 1, 14: 5}
Did not match all atoms present	531-82-8	CC(=O)NC1=NC(=CS1)C2=CC=C(O2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 41: 1, 14: 3, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	531-84-0	CCCCCCCCCCCCCCCCOC(=O)C1=CC2=CC=CC=C2C=C1O	{1: 1, 2: 15, 28: 1, 21: 1, 14: 6}
Did not match all atoms present	531-85-1	C1=CC(=CC=C1C2=CC=C(C=C2)N)N.Cl.Cl	{17: 2, 30: 2, 14: 8}
Did not match all atoms present	531-86-2	C1=CC(=CC=C1C2=CC=C(C=C2)N)N.OS(=O)(=O)O	{30: 2, 20: 2, 29: 2, 14: 8}
Did not match all atoms present	531-91-9	C1=CC=C(C=C1)NC2=CC=C(C=C2)C3=CC=C(C=C3)NC4=CC=CC=C4	{14: 18, 31: 2}
Did not match all atoms present	531-95-3	C1[C@H](COC2=C1C=CC(=C2)O)C3=CC=C(C=C3)O	{11: 2, 12: 1, 21: 2, 14: 7, 23: 1}
Did not match all atoms present	5310-17-8	CC1=CC=C(C=C1)NC(=S)C	{1: 2, 31: 1, 14: 4, 7: 1}
Did not match all atoms present	5310-18-9	CC(=S)NC1=CC=C(C=C1)OC	{1: 2, 31: 1, 22: 1, 14: 4, 7: 1}
Did not match all atoms present	5310-55-4	CN(C)CCCC1C2=CC=CC=C2NC3=C1C=C(C=C3)Cl	{32: 1, 1: 2, 2: 3, 33: 1, 12: 1, 14: 7, 17: 1}
Did not match all atoms present	53101-68-1	CC1=C(C(=C2CCC(OC2=C1C)(C)O)C)O	{1: 4, 11: 2, 13: 1, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	53101-69-2	CC1=C(C(=C(C(=C1OC(=O)C)C)CCC(=O)C)OC(=O)C)C	{24: 1, 1: 6, 2: 2, 28: 2}
Did not match all atoms present	53108-50-2	C(C(=O)O)N(CC(=O)[O-])CC(=O)[O-].[Co+2]	{24: 2, 33: 1, 2: 3, 27: 1}
Did not match all atoms present	53111-20-9	COC1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 22: 1, 14: 14}
Did not match all atoms present	53112-33-7	CN1CCC2=CC=CC=C2C1.Cl	{1: 1, 11: 3, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	53119-51-0	CCC1=C(SC=C1)C	{1: 2, 2: 1, 14: 2, 41: 1}
Did not match all atoms present	53123-38-9	CC1=C(C=CC=C1N=C=O)N=C=O.CC(CO)O.C(CCC(=O)O)CC(=O)O.C(CO)O.C(C(CO)O)O	{1: 2, 2: 9, 3: 2, 8: 2, 34: 2, 14: 3, 20: 7, 27: 2, 29: 2}
Did not match all atoms present	53126-67-3	CCCCOP(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 2: 3, 29: 3, 22: 1}
Did not match all atoms present	53130-67-9	C1=CC=C2C(=C1)C(=O)C=C(C2=O)NO	{25: 2, 31: 1, 20: 1, 14: 5, 15: 1}
Did not match all atoms present	5314-37-4	C1=CC(=CC=C1C2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O	{20: 2, 29: 4, 14: 8}
Did not match all atoms present	5314-55-6	CC[Si](OC)(OC)OC	{1: 4, 2: 1, 22: 3}
Did not match all atoms present	5314-83-0	B(CC)(CC)Cl	{1: 2, 2: 2, 17: 1}
Did not match all atoms present	5314-85-2	B1(NB(NB(N1)C)C)C	{32: 3, 1: 3}
Did not match all atoms present	5315-25-3	CC1=NC(=CC=C1)Br	{1: 1, 18: 1, 35: 1, 14: 3}
Did not match all atoms present	5315-79-7	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)O	{21: 1, 14: 9}
Did not match all atoms present	53151-84-1	C1=CC=C2C(=C1)/C(=C\3/C(=NC(=N)S3)N)/N=C2N	{35: 2, 36: 1, 41: 1, 14: 4, 15: 5, 30: 2}
Did not match all atoms present	53152-21-9	C[C@]([C@H]1C[C@@]23CC[C@@]1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)CC7CC7)OC)(C(C)(C)C)O.Cl	{1: 5, 2: 1, 4: 2, 33: 1, 11: 8, 12: 4, 13: 3, 14: 2, 17: 1, 20: 1, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	5316-74-5	CCSC1=NC(=CS1)C2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 40: 1, 41: 1, 14: 6}
Did not match all atoms present	5316-79-0	CC1=CSC(=S)N1C	{1: 2, 41: 1, 14: 1, 33: 1}
Did not match all atoms present	53161-86-7	B1(N(B(N(N1C)C)OC)C)OC	{1: 5, 22: 2, 33: 3}
Did not match all atoms present	53163-97-6	CCOC1=NC(=CN=C1)C	{1: 2, 2: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	53164-05-9	CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC(=O)O	{1: 2, 2: 2, 33: 1, 14: 7, 17: 1, 22: 1, 24: 1, 27: 1, 28: 1}
Did not match all atoms present	53169-23-6	[O-2].[Sn+4].[Ce+3]	{}
Did not match all atoms present	53169-53-2	[Al].[Al].[Al].[Al].[Sr]	{}
Did not match all atoms present	53172-84-2	CCC=C(C)C1=CC=CC=C1	{1: 2, 2: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	53184-19-3	CC1=CC2=C(C=C1N)[Se]C3=CC(=[N+](C)C)C=CC3=N2.[Cl-]	{1: 3, 35: 1, 33: 1, 14: 5, 17: 1, 30: 1}
Did not match all atoms present	53188-07-1	CC1=C(C(=C2CCC(OC2=C1C)(C)C(=O)O)C)O	{1: 4, 11: 2, 13: 1, 21: 1, 23: 1, 27: 1}
Did not match all atoms present	5319-77-7	CSC1=NN=C(S1)N	{40: 1, 1: 1, 35: 2, 30: 1, 41: 1}
Did not match all atoms present	53194-93-7	O.O.O.O.[V]	{}
Did not match all atoms present	53196-94-4	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)OC6=O	{1: 2, 4: 1, 22: 2, 14: 14, 28: 4}
Did not match all atoms present	532-03-6	COC1=CC=CC=C1OCC(COC(=O)N)O	{1: 1, 2: 2, 3: 1, 14: 4, 20: 1, 22: 2, 28: 1, 30: 1}
Did not match all atoms present	532-11-6	COC1=CC=C(C=C1)C2=CC(=S)SS2	{1: 1, 22: 1, 14: 5, 41: 2}
Did not match all atoms present	532-18-3	C1=CC=C2C=C(C=CC2=C1)NC3=CC4=CC=CC=C4C=C3	{14: 14, 31: 1}
Did not match all atoms present	532-27-4	C1=CC=C(C=C1)C(=O)CCl	{24: 1, 17: 1, 2: 1, 14: 5}
Did not match all atoms present	532-28-5	C1=CC=C(C=C1)C(C#N)O	{3: 1, 20: 1, 37: 1, 14: 5}
Did not match all atoms present	532-31-0	C1=CC=C(C=C1)C(=O)[O-].[Ag+]	{24: 1, 14: 5}
Did not match all atoms present	532-32-1	C1=CC=C(C=C1)C(=O)[O-].[Na+]	{24: 1, 14: 5}
Did not match all atoms present	532-43-4	CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.[N+](=O)([O-])[O-]	{1: 2, 2: 3, 35: 2, 33: 1, 41: 1, 14: 2, 20: 1, 30: 1}
Did not match all atoms present	532-48-9	CC(=C)C1=CC2=CC(=C(C=C2O1)O)C(=O)C	{1: 2, 5: 1, 7: 1, 14: 3, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	532-49-0	CCCCN(CCCC)C(=O)OCC[N+](C)(C)CC.CCCCN(CCCC)C(=O)OCC[N+](C)(C)CC.[O-]S(=O)(=O)[O-]	{1: 10, 2: 18, 28: 2, 29: 4, 33: 2}
Did not match all atoms present	532-54-7	C1=CC=C(C=C1)C(=O)C=NO	{24: 1, 34: 1, 20: 1, 14: 5, 6: 1}
Did not match all atoms present	532-55-8	C1=CC=C(C=C1)C(=O)N=C=S	{8: 1, 24: 1, 34: 1, 14: 5}
Did not match all atoms present	532-62-7	CC(CN(C)C)C(C)OC(=O)C1=CC=C(C=C1)N.Cl	{1: 4, 2: 1, 3: 2, 33: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	532-76-3	CC(CNC1CCCCC1)OC(=O)C2=CC=CC=C2.Cl	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 14: 5, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	532-77-4	CC(CNC1CCCCC1)OC(=O)C2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	532-82-1	C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N.Cl	{17: 1, 34: 2, 30: 2, 14: 8}
Did not match all atoms present	532-91-2	COC1=CC2=C(C=C1)NC(=O)O2	{32: 1, 1: 1, 28: 1, 22: 1, 14: 3}
Did not match all atoms present	532-94-5	C1=CC=C(C=C1)C(=O)NCC(=O)[O-].[Na+]	{24: 2, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	532-96-7	C1=CC=C(C=C1)C(=O)NNC2=CC=CC=C2	{24: 1, 14: 10, 31: 2}
Did not match all atoms present	5320-75-2	C1=CC=C(C=C1)C=CCOC(=O)C2=CC=CC=C2	{2: 1, 28: 1, 14: 10, 6: 2}
Did not match all atoms present	5320-98-9	C1COCCN1C2=CC=CC=C2[N+](=O)[O-]	{33: 1, 11: 4, 38: 1, 14: 4, 23: 1}
Did not match all atoms present	53206-92-1	CCN(CC)CCCNC(=O)COC1=C(C=CC(=C1C(=O)OC)C)C(C)C	{1: 6, 2: 6, 3: 1, 33: 1, 14: 2, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	53209-24-8	CC1=C(C(=C2CCC(OC2=C1C)(C)OC)C)O	{1: 5, 11: 2, 13: 1, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	5321-31-3	C1=CC=C(C=C1)C(C(=O)Cl)N.Cl	{24: 1, 17: 2, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	53213-29-9	CN1N([Si](N(N([Si]1(C)C)C)C)(C)C)C	{1: 8, 33: 4}
Did not match all atoms present	53213-81-3	CCCCCN\1C2=CC=CC=C2O/C1=C/C=C/C3=[N+](C4=CC=CC=C4O3)CCCCC.[I-]	{1: 2, 2: 8, 6: 3, 33: 2, 14: 8, 15: 1, 19: 1, 23: 2}
Did not match all atoms present	53213-82-4	CCCCCCN1C2=CC=CC=C2OC1=CC=CC3=[N+](C4=CC=CC=C4O3)CCCCCC.[I-]	{1: 2, 2: 10, 6: 3, 33: 2, 14: 8, 15: 1, 19: 1, 23: 2}
Did not match all atoms present	53214-57-6	CC(C(C1=CC=CC=C1)O)NC	{1: 2, 3: 2, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	53215-95-5	C[Si](C)(C)CNCC1=CC=CC=C1	{1: 3, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	53216-90-3	C[C@@H]1C/C=C\2/C(=O)NC/C=C\C=C/[C@H](C[C@H](CC3=NC(=CO3)C(=O)N[C@H](CS2)C(=O)O1)O)O	{32: 2, 1: 1, 35: 1, 41: 1, 11: 5, 12: 4, 14: 6, 15: 1, 20: 2, 23: 1, 25: 2, 28: 1}
Did not match all atoms present	53220-82-9	C1=CC=C2C(=C1)C(=CC=C2Br)Cl	{17: 1, 18: 1, 14: 6}
Did not match all atoms present	53221-79-7	CC1=CC=CC2=C(C3=CC=CC=C3N=C12)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 2, 35: 1, 29: 2, 14: 11, 31: 2}
Did not match all atoms present	53221-83-3	CCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42.Cl	{1: 1, 2: 1, 35: 1, 14: 12, 17: 1, 29: 2, 31: 2}
Did not match all atoms present	53221-85-5	CCCCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=[NH+]C4=CC=CC=C42.[Cl-]	{32: 1, 1: 1, 2: 3, 14: 12, 17: 1, 29: 2, 31: 2}
Did not match all atoms present	53221-86-6	CCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42	{1: 1, 2: 1, 35: 1, 14: 12, 29: 2, 31: 2}
Did not match all atoms present	53221-88-8	CCCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42	{1: 1, 2: 2, 35: 1, 14: 12, 29: 2, 31: 2}
Did not match all atoms present	53222-10-9	CC1=CC2=C(C3=CC=CC=C3N=C2C=C1)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 2, 35: 1, 29: 2, 14: 11, 31: 2}
Did not match all atoms present	53222-14-3	CC(=O)NC1=CC2=NC3=CC=CC=C3C(=C2C=C1)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 2, 35: 1, 14: 11, 24: 1, 29: 2, 31: 3}
Did not match all atoms present	53222-15-4	CC(=O)NC1=CC2=NC3=CC=CC=C3C(=C2C=C1)[NH2+]C4=CC=C(C=C4)NS(=O)(=O)C.CS(=O)(=O)[O-]	{1: 3, 35: 1, 14: 11, 24: 1, 29: 5, 31: 2}
Did not match all atoms present	53222-25-6	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)C)N)N.[I-].[I-]	{1: 2, 33: 2, 14: 16, 19: 2, 24: 1, 30: 2, 31: 3}
Did not match all atoms present	53222-52-9	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)C)N.[Br-].[Br-]	{1: 2, 33: 2, 14: 17, 18: 2, 24: 1, 30: 1, 31: 3}
Did not match all atoms present	53222-92-7	CC1=C(C=CC=C1O)N	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	5323-50-2	CCCN1C(=O)C2=CC=CC=C2C1=O	{1: 1, 2: 2, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	5323-95-5	CCCCCCC(C/C=C\CCCCCCCC(=O)[O-])O.[Na+]	{1: 1, 2: 13, 3: 1, 6: 2, 20: 1, 24: 1}
Did not match all atoms present	5324-00-5	C1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C4=CC=CC=C4	{11: 1, 14: 14, 15: 2}
Did not match all atoms present	5324-12-9	C(C(CBr)Br)OP(=O)(O)O	{2: 2, 3: 1, 18: 2, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	5324-30-1	CCOP(=O)(CCBr)OCC	{1: 2, 2: 4, 18: 1, 22: 2, 29: 1}
Did not match all atoms present	5324-68-5	CC1=C(C(=C(C(=C1Cl)C)Cl)C)Cl	{1: 3, 17: 3}
Did not match all atoms present	5324-69-6	C1=CC=C2C=C(C=CC2=C1)SCC#N	{40: 1, 2: 1, 37: 1, 14: 7}
Did not match all atoms present	53246-08-5	B1(N(B(N(N1C)C)N(C)C)C)N(C)C	{1: 7, 33: 5}
Did not match all atoms present	53246-09-6	B1(N(B(N(N1C)C)Cl)C)Cl	{1: 3, 33: 3, 17: 2}
Did not match all atoms present	53246-10-9	B1(N(B(N(N1C)C)Br)C)Br	{1: 3, 18: 2, 33: 3}
Did not match all atoms present	53246-11-0	B1N(BN(N1C)C)C	{1: 3, 33: 3}
Did not match all atoms present	53246-13-2	B1(N(B(N(N1C)C)C)[Sn](C)(C)C)C	{1: 7, 33: 3}
Did not match all atoms present	53246-15-4	B1(N(B(N(N1C)C)C)P(C)C)C	{1: 6, 33: 3}
Did not match all atoms present	53246-16-5	B1(N(B(N(N1C)C)C)P(N(C)C)N(C)C)C	{1: 8, 33: 5}
Did not match all atoms present	53246-18-7	B1(N(B(N(N1C)[Si](C)(C)C)C)C)C	{1: 7, 33: 3}
Did not match all atoms present	53246-19-8	B1(N(B(N(N1C)[Sn](C)(C)C)C)C)C	{1: 7, 33: 3}
Did not match all atoms present	53246-20-1	B1(N(B(N(N1C)P(C)C)C)C)C	{1: 6, 33: 3}
Did not match all atoms present	5325-20-2	C1C(=O)NC2=CC=CC=C2S1	{32: 1, 25: 1, 11: 1, 14: 4, 41: 1}
Did not match all atoms present	5325-43-9	C(CS(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 2, 29: 6}
Did not match all atoms present	5325-97-3	C1CCC2=C(C1)C=CC3=C2CCCC3	{11: 8, 14: 2}
Did not match all atoms present	53250-83-2	CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl	{1: 1, 27: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	53250-93-4	COC1=CC2=NC3=CC=CC=C3C(=C2C=C1)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 2, 35: 1, 14: 11, 22: 1, 29: 2, 31: 2}
Did not match all atoms present	53251-04-0	CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 11, 29: 2, 31: 2}
Did not match all atoms present	53255-78-0	C1=C(C2=C(S1)SC=C2Br)Br	{41: 2, 18: 2, 14: 2}
Did not match all atoms present	53255-84-8	C1=C(C2=C(S1)SC(=C2Br)Br)Br	{41: 2, 18: 3, 14: 1}
Did not match all atoms present	53255-85-9	C1=C(SC2=C1C(=C(S2)Br)Br)Br	{41: 2, 18: 3, 14: 1}
Did not match all atoms present	53255-86-0	C12=C(SC(=C1Br)Br)SC(=C2Br)Br	{41: 2, 18: 4}
Did not match all atoms present	5326-16-9	CCOC(=O)NC1=NNN=N1	{32: 1, 1: 1, 2: 1, 35: 3, 28: 1, 31: 1}
Did not match all atoms present	5326-23-8	C1=CC(=NC=C1C(=O)O)Cl	{17: 1, 27: 1, 14: 3, 35: 1}
Did not match all atoms present	5326-34-1	CC1=CC(=C(C=C1)Br)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	5326-39-6	CC1=CC(=C(C=C1)I)[N+](=O)[O-]	{1: 1, 19: 1, 38: 1, 14: 3}
Did not match all atoms present	5326-47-6	C1=CC(=C(C=C1I)C(=O)O)N	{27: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	53266-94-7	CCOC(=O)CC1=CSC(=N1)N	{1: 1, 2: 2, 35: 1, 41: 1, 14: 1, 28: 1, 30: 1}
Did not match all atoms present	5327-44-6	COC1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 22: 1, 14: 3}
Did not match all atoms present	5327-45-7	CCCCCCCCCCCCCCCCCC(=O)NCC1=CC=CC=C1	{24: 1, 1: 1, 2: 17, 14: 5, 31: 1}
Did not match all atoms present	5327-72-0	C1=CC=C2C(=C1)C(=C3C(=CC=C(C3=C2O)N)N)O	{30: 2, 21: 2, 14: 6}
Did not match all atoms present	53272-22-3	CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C	{1: 4, 2: 12, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	53277-15-9	C1=CC=C(C=C1)C2=NC(=O)C=C(S2)O	{25: 1, 35: 1, 21: 1, 14: 6, 41: 1}
Did not match all atoms present	5328-01-8	CCOC1=CC=CC2=CC=CC=C21	{1: 1, 2: 1, 22: 1, 14: 7}
Did not match all atoms present	53282-12-5	CCOC(=O)C=CC1=CC=CO1	{1: 1, 2: 1, 6: 2, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	5329-12-4	C1=C(C=C(C(=C1Cl)NN)Cl)Cl	{17: 3, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	5329-14-6	NS(=O)(=O)O	{20: 1, 29: 2, 30: 1}
Did not match all atoms present	53293-32-6	CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C\C(=O)C(C)(C)C)/O)(C)C.Cl[Ti]Cl	{1: 12, 4: 4, 6: 2, 7: 2, 17: 2, 20: 2, 24: 2}
Did not match all atoms present	53293-42-8	[Cr-].[O].[O]	{}
Did not match all atoms present	53296-64-3	CN(C(=O)C(C(C(F)(F)F)(F)F)(F)F)[Si](C)(C)C	{16: 7, 1: 4, 4: 3, 24: 1, 33: 1}
Did not match all atoms present	53297-70-4	CC1=C(C=CC(=C1)S(=O)(=O)N)N	{1: 1, 30: 2, 29: 2, 14: 3}
Did not match all atoms present	533-01-7	C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Cu+2]	{24: 2, 14: 10}
Did not match all atoms present	533-06-2	CC1=CC=CC=C1OCC(COC(=O)N)O	{1: 1, 2: 2, 3: 1, 14: 4, 20: 1, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	533-17-5	CC(=O)NC1=CC=CC=C1Cl	{24: 1, 1: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	533-18-6	CC1=CC=CC=C1OC(=O)C	{1: 2, 28: 1, 14: 4}
Did not match all atoms present	533-23-3	CCOC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 2, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	533-24-4	CCCCCC1=C(C=C(C=C1)O)O	{1: 1, 2: 4, 21: 2, 14: 3}
Did not match all atoms present	533-28-8	CC1CCCCN1CCCOC(=O)C2=CC=CC=C2.Cl	{1: 1, 2: 3, 33: 1, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	533-30-2	C1=CC2=C(C=C1N)SC=N2	{41: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	533-31-3	C1OC2=C(O1)C=C(C=C2)O	{11: 1, 21: 1, 14: 3, 23: 2}
Did not match all atoms present	533-35-7	C1CC2=C(C1)C=NC=C2	{35: 1, 11: 3, 14: 3}
Did not match all atoms present	533-37-9	C1CC2=C(C1)N=CC=C2	{35: 1, 11: 3, 14: 3}
Did not match all atoms present	533-45-9	CC1=C(SC=N1)CCCl	{1: 1, 2: 2, 35: 1, 41: 1, 14: 1, 17: 1}
Did not match all atoms present	533-51-7	C(=O)(C(=O)[O-])[O-].[Ag+].[Ag+]	{24: 2}
Did not match all atoms present	533-58-4	C1=CC=C(C(=C1)O)I	{19: 1, 21: 1, 14: 4}
Did not match all atoms present	533-70-0	C1=CC(=C(C=C1I)I)N	{19: 2, 30: 1, 14: 3}
Did not match all atoms present	533-73-3	C1=CC(=C(C=C1O)O)O	{21: 3, 14: 3}
Did not match all atoms present	533-74-4	CN1CN(C(=S)SC1)C	{1: 2, 41: 1, 11: 2, 33: 2, 15: 1}
Did not match all atoms present	533-75-5	C1=CC=C(C(=O)C=C1)O	{25: 1, 21: 1, 14: 5}
Did not match all atoms present	533-96-0	C(=O)(O)[O-].C(=O)([O-])[O-].[Na+].[Na+].[Na+]	{24: 1, 27: 1}
Did not match all atoms present	5330-66-5	CC(=O)COC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	53303-23-4	[Cl-].[Sm]	{17: 1}
Did not match all atoms present	53304-33-9	C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=NC7=CC=CC=C7N6C5=O)S2	{25: 1, 35: 1, 41: 1, 14: 12, 33: 1}
Did not match all atoms present	53304-43-1	C1=CC=C(C=C1)CC(CN2C(=O)C3=C(C4=C(C(=C3C2=O)N)C(=O)C5=CC=CC=C5C4=O)N)C6=CC=CC=C6	{33: 1, 2: 2, 3: 1, 14: 14, 25: 4, 30: 2}
Did not match all atoms present	53305-31-0	CC1CCCCN1CC2=C(C=C3CCCC3=C2)O.C(=C\C(=O)O)\C(=O)O	{1: 1, 2: 1, 6: 2, 33: 1, 11: 7, 12: 1, 14: 2, 21: 1, 27: 2}
Did not match all atoms present	53308-23-9	COC1=CC=CC2=C1C3CC2C=C3	{1: 1, 11: 1, 12: 2, 22: 1, 14: 5}
Did not match all atoms present	5331-17-9	CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)O	{1: 1, 2: 2, 4: 1, 14: 10, 20: 1}
Did not match all atoms present	5331-43-1	C1=CC=C(C=C1)COC(=O)NN	{2: 1, 28: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	5331-77-1	CCCCCCCCCCCCCCCCCCCCCC(=O)O.[Na+]	{1: 1, 2: 20, 27: 1}
Did not match all atoms present	5331-91-9	C1=CC2=C(C=C1Cl)NC(=S)S2	{32: 1, 17: 1, 14: 3, 41: 1}
Did not match all atoms present	5331-92-0	C1=CC(=C(C=C1C=NO)Cl)Cl	{17: 2, 34: 1, 20: 1, 14: 3, 6: 1}
Did not match all atoms present	53317-25-2	C(CCl)N(CCCl)NC(=O)[C@H](CSSC[C@@H](C(=O)NN(CCCl)CCCl)[NH3+])[NH3+].[Br-].[Br-]	{33: 2, 2: 10, 3: 2, 40: 2, 17: 4, 18: 2, 24: 2, 31: 2}
Did not match all atoms present	5332-24-1	C1=CC=C2C(=C1)C=C(C=N2)Br	{18: 1, 35: 1, 14: 6}
Did not match all atoms present	5332-25-2	C1=CC2=C(C=CC(=C2)Br)N=C1	{18: 1, 35: 1, 14: 6}
Did not match all atoms present	5332-26-3	C1=CC=C2C(=C1)C(=O)N(C2=O)CBr	{25: 2, 2: 1, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	5332-96-7	CC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]	{24: 1, 1: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	5332-98-9	C1=CC=C(C(=C1)C=CC(=O)C=CC2=CC=CC=C2Cl)Cl	{24: 1, 17: 2, 14: 8, 6: 4}
Did not match all atoms present	53320-90-4	CC1CO1.CC1=C(C(=CC=C1)N(CCO)CCO)N(CCO)CCO.C1CO1	{1: 2, 2: 8, 33: 2, 11: 3, 12: 1, 14: 3, 20: 4, 23: 2}
Did not match all atoms present	53323-98-1	B1(N(B(N(N1C)C)C)[Si](C)(C)C)C	{1: 7, 33: 3}
Did not match all atoms present	53323-99-2	B1(N(B(N(N1C)C)C)B(N(C)C)N(C)C)C	{1: 8, 33: 5}
Did not match all atoms present	53324-00-8	B1(N(B(N(N1B(N(C)C)N(C)C)C)C)C)C	{1: 8, 33: 5}
Did not match all atoms present	53324-38-2	C1=CC(=C(C=C1N)[N+](=O)[O-])Br	{18: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	5333-00-6	CC1=C(C=C(C=C1C(=O)C=CC2=CC=CC=C2)[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 1: 1, 38: 2, 14: 7, 6: 2}
Did not match all atoms present	5333-02-8	COC1=C(C2=C(C(=C1)[N+](=O)[O-])N=CC=C2)OC	{38: 1, 1: 2, 35: 1, 22: 2, 14: 4}
Did not match all atoms present	5333-03-9	COC1=CC=C(C=C1)C2=CC(=O)C(=CC2=O)C3=CC=C(C=C3)OC	{1: 2, 25: 2, 22: 2, 14: 10, 15: 2}
Did not match all atoms present	5333-05-1	C1C(=O)NC2=C(S1)C=C(C=C2)Cl	{32: 1, 41: 1, 11: 1, 14: 3, 17: 1, 25: 1}
Did not match all atoms present	5333-27-7	CC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-]	{24: 1, 1: 2, 38: 1, 14: 3}
Did not match all atoms present	5333-90-4	CC1=C2C(=C(C=C1)Cl)CCC2=O	{1: 1, 11: 2, 25: 1, 14: 2, 17: 1}
Did not match all atoms present	53330-94-2	CC(=O)C1=CC2=C(C=C1)NC=C2	{24: 1, 1: 1, 14: 5, 32: 1}
Did not match all atoms present	53336-42-8	C1C(C=CS1(=O)=O)Br	{18: 1, 11: 1, 12: 1, 29: 2, 14: 2}
Did not match all atoms present	53338-04-8	C1(=NSC(=N1)[S-])[S-].[K+].[K+]	{41: 1, 35: 2}
Did not match all atoms present	5334-23-6	C1=C2C(=NC=NC2=S)NN1	{32: 2, 35: 2, 14: 2}
Did not match all atoms present	5334-30-5	C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)N	{33: 1, 35: 3, 30: 1, 14: 7}
Did not match all atoms present	5334-43-0	C1=CC=C(C=C1)N2C(=C(C=N2)C#N)N	{33: 1, 35: 1, 30: 1, 14: 6, 37: 1}
Did not match all atoms present	5334-87-2	CCCCC(C)N=C=S	{8: 1, 1: 2, 2: 3, 3: 1, 34: 1}
Did not match all atoms present	5334-99-6	CN1C2=C(C=N1)C(=NC=N2)N	{1: 1, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	53340-16-2	CCN(CC)C1=CC2=C(C=C1)N=C3C4=CC=CC=C4C(=[NH2+])C=C3O2.[O-]Cl(=O)(=O)=O	{1: 2, 2: 2, 35: 1, 33: 1, 14: 8, 17: 1, 23: 1, 29: 4, 30: 1}
Did not match all atoms present	53348-04-2	C1=CC=C2C(=C1)C3=CC=CC=C3C(=C2N)N	{30: 2, 14: 8}
Did not match all atoms present	5335-24-0	C1=CC=C(C=C1)C2=CC(=CC(=C2O)Cl)Cl	{17: 2, 21: 1, 14: 7}
Did not match all atoms present	5335-26-2	C1=C(C(=C(C(=C1Cl)Cl)Cl)OCCOCCCl)Cl	{17: 5, 2: 4, 22: 2, 14: 1}
Did not match all atoms present	5335-75-1	CCCCC1=CC=NC=C1	{1: 1, 2: 3, 35: 1, 14: 4}
Did not match all atoms present	5335-87-5	COC1=CC=C(C=C1)SSC2=CC=C(C=C2)OC	{40: 2, 1: 2, 22: 2, 14: 8}
Did not match all atoms present	53350-33-7	CC1CC(N(C2=CC=CC=C12)CCO)(C)C	{1: 3, 2: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 4, 20: 1}
Did not match all atoms present	5336-22-1	C1=CC(=C(C=C1Br)SC2=C(C=CC(=C2)Br)O)O	{40: 1, 18: 2, 21: 2, 14: 6}
Did not match all atoms present	5336-53-8	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)N=O	{33: 1, 2: 2, 34: 1, 29: 1, 14: 10}
Did not match all atoms present	5336-57-2	CCC(CC)(C#N)C1=CC=CC=C1	{1: 2, 2: 2, 4: 1, 37: 1, 14: 5}
Did not match all atoms present	5336-97-0	C1=CC=C2C(=C1)C(=O)N(C2=O)[N+](=O)[O-]	{25: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	53365-77-8	CN1C=CC(=C1CO)CO	{1: 1, 2: 2, 20: 2, 14: 2, 33: 1}
Did not match all atoms present	53368-84-6	C1[C@@H]2C=C[C@H]1[C@@H]3[C@H]2C(=O)OC3=O.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{2: 1, 11: 1, 12: 4, 14: 13, 27: 1, 28: 4, 30: 2}
Did not match all atoms present	5337-19-9	C1=CC(=CC(=C1)P(=O)(O)O)[N+](=O)[O-]	{38: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	5337-36-0	B(OCCCCCC)(OCCCCCC)OCCCCCC	{1: 3, 2: 15, 22: 3}
Did not match all atoms present	5337-37-1	B(OC(C)CC(C)C)(OC(C)CC(C)C)OC(C)CC(C)C	{1: 9, 2: 3, 3: 6, 22: 3}
Did not match all atoms present	5337-41-7	B(OCCCCCCCCCCCCCCCCCC)(OCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCC	{1: 3, 2: 51, 22: 3}
Did not match all atoms present	5337-42-8	B(OCCCCCCCC/C=C\CCCCCCCC)(OCCCCCCCC/C=C\CCCCCCCC)OCCCCCCCC/C=C\CCCCCCCC	{1: 3, 2: 45, 22: 3, 6: 6}
Did not match all atoms present	5337-60-0	B(OC1=CC=CC=C1Cl)(OC2=CC=CC=C2Cl)OC3=CC=CC=C3Cl	{17: 3, 22: 3, 14: 12}
Did not match all atoms present	5337-79-1	C1=CN=CC=C1/C=C/C(=O)O	{35: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	5337-93-9	CCC(=O)C1=CC=C(C=C1)C	{24: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	53370-45-9	B(O)(O)OC1CC(CCC1C(C)C)C	{1: 3, 3: 1, 11: 3, 12: 3, 20: 2, 22: 1}
Did not match all atoms present	53370-57-3	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)OCC3=CC=CC=C3	{1: 4, 2: 1, 3: 1, 33: 2, 14: 13, 22: 1}
Did not match all atoms present	53370-90-4	CCCCCCOC1=CC=CC=C1C(=O)N	{1: 1, 2: 5, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	53378-52-2	CC(C)COP(=S)([O-])OCC(C)C.[Na+]	{1: 4, 2: 2, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	53378-72-6	[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Ta+5]	{}
Did not match all atoms present	5339-26-4	C1=CC(=CC=C1CCBr)[N+](=O)[O-]	{2: 2, 38: 1, 18: 1, 14: 4}
Did not match all atoms present	5339-39-9	C1=CC(=CC=C1NC2=CC=C(C=C2)SC#N)SC#N	{40: 2, 37: 2, 14: 8, 31: 1}
Did not match all atoms present	5339-59-3	CCCCN(CCCC)S(=O)(=O)C1=CC=CC=C1	{1: 2, 2: 6, 29: 2, 14: 5, 33: 1}
Did not match all atoms present	5339-74-2	C1=CC(=O)C=CC1=CNNC(=S)N	{6: 1, 7: 1, 14: 4, 15: 1, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	5339-85-5	C1=CC=C(C(=C1)CCO)N	{2: 2, 20: 1, 30: 1, 14: 4}
Did not match all atoms present	53392-43-1	C1C(C(=O)S1)(C2=CC=CC=C2)C3=CC=CC=C3	{25: 1, 11: 1, 13: 1, 14: 10, 41: 1}
Did not match all atoms present	53397-65-2	C1=CC=C2C#CC3=CC=CC=C3C#CC2=C1	{10: 4, 14: 8}
Did not match all atoms present	53397-66-3	C1=CC=C2C#CC3=CC=CC=C3C=CC2=C1	{10: 2, 14: 10}
Did not match all atoms present	53398-78-0	CCC/C=C/COC=O	{1: 1, 2: 3, 26: 1, 6: 2}
Did not match all atoms present	534-13-4	CNC(=S)NC	{1: 2, 31: 2, 7: 1}
Did not match all atoms present	534-16-7	C(=O)([O-])[O-].[Ag+].[Ag+]	{24: 1}
Did not match all atoms present	534-17-8	C(=O)([O-])[O-].[Cs+].[Cs+]	{24: 1}
Did not match all atoms present	534-22-5	CC1=CC=CO1	{1: 1, 14: 3, 23: 1}
Did not match all atoms present	534-25-8	C1=CSSC1=S	{41: 2, 14: 2}
Did not match all atoms present	534-51-0	C1=CC(=CC=C1O)OC2=C(C=C(C=C2I)CC(C(=O)O)N)I	{2: 1, 3: 1, 14: 6, 19: 2, 21: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	534-52-1	CC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	534-85-0	C1=CC=C(C=C1)NC2=CC=CC=C2N	{30: 1, 14: 9, 31: 1}
Did not match all atoms present	534-97-4	C1=CC=C(C=C1)NN=CC(=NNC2=CC=CC=C2)C(C(C(CO)O)O)O	{2: 1, 3: 3, 6: 1, 7: 1, 34: 2, 14: 10, 20: 4, 31: 2}
Did not match all atoms present	53402-10-1	CC1(C2CCC1(C(=S)C2)C)C	{1: 3, 11: 3, 12: 1, 13: 2, 15: 1}
Did not match all atoms present	53404-18-5	CCC(C)(C)C1=CC=C(C=C1)[O-].[K+]	{1: 3, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	53404-19-6	[Li+].CCC(C)N1C(=O)C(=C([N-]C1=O)C)Br	{33: 1, 2: 1, 3: 1, 1: 3, 18: 1, 35: 1, 25: 2}
Did not match all atoms present	53404-31-2	CCCCOCCOC(=O)C(C)OC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 5, 3: 1, 14: 3, 17: 2, 22: 2, 28: 1}
Did not match all atoms present	53404-67-4	CC(=O)O[Hg]C1=CC=CC=C1.N	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	53404-82-3	CCCC[Sn](CCCC)(CCCC)OC(=O)CCC(=O)OC(C)C	{1: 5, 2: 11, 3: 1, 28: 2}
Did not match all atoms present	53407-78-6	CC(C)C1=CC=C(C=C1)/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C#N	{1: 2, 3: 1, 37: 1, 6: 1, 7: 1, 14: 8, 38: 1}
Did not match all atoms present	53407-79-7	CC(C)C1=CC=C(C=C1)/C(=C/C2=CC=C(C=C2)N(C)C)/C#N	{1: 4, 3: 1, 37: 1, 6: 1, 33: 1, 7: 1, 14: 8}
Did not match all atoms present	53408-94-9	CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Sn+2]	{1: 2, 29: 6}
Did not match all atoms present	53408-96-1	C1COCCOCCOC2=C(C=CC(=C2)[N+](=O)[O-])OCCOCCO1	{11: 10, 38: 1, 14: 3, 23: 6}
Did not match all atoms present	5341-07-1	C1=CC2=CC(=CN=C2C(=C1)[N+](=O)[O-])Br	{18: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	5341-44-6	C1=CC=C(C=C1)C=NC2=CC(=CC=C2)[N+](=O)[O-]	{34: 1, 38: 1, 14: 9, 6: 1}
Did not match all atoms present	5341-58-2	C1=CC=C2C=C(C(=CC2=C1)C(=O)NN)O	{24: 1, 30: 1, 21: 1, 14: 6, 31: 1}
Did not match all atoms present	53411-33-9	C1C(=NN(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl)NC3=C(C=CC(=C3)N)Cl	{33: 1, 35: 1, 11: 1, 14: 5, 15: 1, 17: 4, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	53413-47-1	C1CCC(CC1)[Sn](C2CCCCC2)C3=CC=CC=C3.O	{11: 10, 12: 2, 14: 5}
Did not match all atoms present	5342-31-4	C1=CC=C(C=C1)C(=O)OCOC(=O)C2=CC=CC=C2	{2: 1, 28: 2, 14: 10}
Did not match all atoms present	5342-87-0	CC(CC1=CC=CC=C1)(C2=CC=CC=C2)O	{1: 1, 2: 1, 4: 1, 14: 10, 20: 1}
Did not match all atoms present	53421-38-8	CCN(CC)CCOC(=O)CC(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl	{1: 2, 2: 5, 4: 1, 33: 1, 14: 10, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	53422-49-4	C(CO[N+](=O)[O-])N=[N+]=[N-]	{2: 2, 34: 2, 22: 1}
Did not match all atoms present	53423-98-6	CCCCC(CC)CN(CC(CC)CCCC)C(=S)[S-].CCCCC(CC)CN(CC(CC)CCCC)C(=S)[S-].[Zn+2]	{1: 8, 2: 20, 3: 4, 33: 2, 7: 2}
Did not match all atoms present	5343-98-6	C1=CC=C(C=C1)C(=O)CCC#N	{24: 1, 2: 2, 37: 1, 14: 5}
Did not match all atoms present	53439-64-8	C=CC=S	{5: 1, 6: 2}
Did not match all atoms present	5344-27-4	C1=CN=CC=C1CCO	{2: 2, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	5344-78-5	COC1=CC(=C(C=C1)Br)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	5344-82-1	C1=CC=C(C(=C1)NC(=S)N)Cl	{17: 1, 31: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	5344-88-7	C1=CC=C(C=C1)C(=NN)C(=O)C2=CC=CC=C2	{24: 1, 34: 1, 30: 1, 14: 10, 7: 1}
Did not match all atoms present	5344-90-1	C1=CC=C(C(=C1)CO)N	{2: 1, 20: 1, 30: 1, 14: 4}
Did not match all atoms present	5344-97-8	CC1=CC(=CC(=C1[N+](=O)[O-])C)O	{1: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	53440-12-3	C1CC2=CC=CC=C2CC1C(=O)O	{27: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	5345-27-7	CS(=O)(=O)C1=CC=CC(=C1)C(=O)O	{1: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	5345-42-6	CC1=C(C(=CC=C1)OC)[N+](=O)[O-]	{1: 2, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	5345-47-1	C1=CC(=C(N=C1)N)C(=O)O	{35: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	5345-53-9	CC(=O)NC1=CC(=C(C=C1)NC(=O)C)[N+](=O)[O-]	{24: 2, 1: 2, 38: 1, 14: 3, 31: 2}
Did not match all atoms present	5345-54-0	COC1=C(C=C(C=C1)N)Cl	{1: 1, 30: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	5345-89-1	C1=CC(=C(C(=C1)Cl)C=CC(=O)O)Cl	{17: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	53452-54-3	C=CC(=O)OCCOCCOC(=O)C=C.C1=CC=C2C(=C1)C(=O)OC2=O	{2: 4, 5: 2, 6: 2, 14: 4, 22: 1, 28: 4}
Did not match all atoms present	53452-70-3	[H+].[Br-].[Br-].[Br-].[Br-].[Au+3]	{18: 4}
Did not match all atoms present	53459-38-4	C(CC(=O)[O-])[C@@H](C(=O)[O-])N.[Mg+2].Br	{24: 2, 2: 2, 3: 1, 18: 1, 30: 1}
Did not match all atoms present	53459-40-8	C1=CC(=CC=C1CCCl)CCl	{17: 2, 2: 3, 14: 4}
Did not match all atoms present	53460-81-4	C1C(OC(O1)C2=CC=CC=C2[N+](=O)[O-])CCl	{2: 1, 38: 1, 11: 1, 12: 2, 14: 4, 17: 1, 23: 2}
Did not match all atoms present	53461-82-8	C(COP(=O)(OCCCl)OCCCl)OCCOP(=O)(OCCCl)OCCCl	{17: 4, 2: 12, 29: 2, 22: 7}
Did not match all atoms present	53464-88-3	C=O.C1=CC=C(C=C1)O.C(C(=O)O)NCC(=O)O	{2: 2, 5: 1, 14: 5, 21: 1, 27: 2, 31: 1}
Did not match all atoms present	53464-95-2	CC(C)(C1=CC=C(C=C1)OC2=CC=CC(=C2C(=O)O)C(=O)O)C3=CC=C(C=C3)OC4=CC=CC(=C4C(=O)O)C(=O)O	{1: 2, 27: 4, 4: 1, 22: 2, 14: 14}
Did not match all atoms present	53466-03-8	CC(C)C1=CC=C(C=C1)/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C#N	{1: 2, 3: 1, 37: 1, 6: 1, 7: 1, 14: 8, 38: 1}
Did not match all atoms present	5347-12-6	C1=C(SC=C1[N+](=O)[O-])[N+](=O)[O-]	{41: 1, 38: 2, 14: 2}
Did not match all atoms present	5347-15-9	COC1=C(C2=C(C(=C1)[N+](=O)[O-])N=CC=C2)Br	{1: 1, 35: 1, 38: 1, 14: 4, 18: 1, 22: 1}
Did not match all atoms present	53477-27-3	CNC1=CC=C(C=C1)CC2=CC=C(C=C2)N(C)C	{1: 3, 2: 1, 33: 1, 14: 8, 31: 1}
Did not match all atoms present	53478-39-0	CC1=CC2=NC3=CC=CC=C3C(=C2C=C1)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 2, 35: 1, 29: 2, 14: 11, 31: 2}
Did not match all atoms present	5348-07-2	C=CCC1=C(C(=CC=C1)Cl)O	{2: 1, 5: 1, 6: 1, 14: 3, 17: 1, 21: 1}
Did not match all atoms present	5348-42-5	C1=C(C(=CC(=C1Cl)Cl)N)N	{17: 2, 30: 2, 14: 2}
Did not match all atoms present	5348-74-3	CCCCOC(=O)C1=CC(=C(C=C1)O)OC	{1: 2, 2: 3, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	53483-12-8	CC(C)(C)C(CC1=CC=CC=C1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 27: 1}
Did not match all atoms present	53486-88-7	C1=CC=C(C=C1)C23C(C4=CC=CC=C42)OC5=CC=CC=C5O3	{12: 1, 13: 1, 14: 13, 23: 2}
Did not match all atoms present	5349-18-8	CCCOC1=CC=C(C=C1)C	{1: 2, 2: 2, 22: 1, 14: 4}
Did not match all atoms present	5349-60-0	CCC(C1=CC=C(C=C1)OC)O	{1: 2, 2: 1, 3: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	5349-62-2	CC(C)CC(=O)CC1=CC=CC=C1	{24: 1, 1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	5349-63-3	CCC(C)C1=CC=C(C=C1)OCCO	{1: 2, 2: 3, 3: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	53498-30-9	CC1=C(SC(=N1)C(C)C)C	{1: 4, 3: 1, 35: 1, 41: 1}
Did not match all atoms present	53498-32-1	CC1=C(SC(=N1)CC(C)C)C	{1: 4, 2: 1, 3: 1, 35: 1, 41: 1}
Did not match all atoms present	53499-68-6	CC(=O)N(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC	{1: 3, 34: 2, 33: 1, 14: 8, 24: 1, 31: 1}
Did not match all atoms present	53499-88-0	CCN(CC)CCCN(CCC(=O)N)C1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)C5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])N(CCCN(CC)CC)CCC(=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])C6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 4, 2: 14, 35: 6, 6: 2, 33: 4, 14: 12, 24: 2, 29: 18, 30: 2, 31: 2}
Did not match all atoms present	535-46-6	C1=CC=C(C=C1)[Sb](=O)(O)O	{20: 2, 29: 1, 14: 5}
Did not match all atoms present	535-52-4	C1=CC(=C(C=C1C(F)(F)F)N)F	{16: 4, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	535-55-7	C1=CC(=CC=C1[O-])S(=O)(=O)[O-].C1=CC(=CC=C1[O-])S(=O)(=O)[O-].[Na+].[Na+].[Hg+2]	{29: 6, 14: 8}
Did not match all atoms present	535-65-9	CC(C)(C)C1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 3, 35: 2, 4: 1, 41: 1, 14: 4, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	535-77-3	CC1=CC(=CC=C1)C(C)C	{1: 3, 3: 1, 14: 4}
Did not match all atoms present	535-80-8	C1=CC(=CC(=C1)Cl)C(=O)O	{17: 1, 27: 1, 14: 4}
Did not match all atoms present	535-83-1	C[N+]1=CC=CC(=C1)C(=O)[O-]	{24: 1, 1: 1, 14: 4, 33: 1}
Did not match all atoms present	535-87-5	C1=C(C=C(C=C1N)N)C(=O)O	{27: 1, 30: 2, 14: 3}
Did not match all atoms present	535-89-7	CC1=CC(=NC(=N1)Cl)N(C)C	{1: 3, 35: 2, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	5350-05-0	C1=CC=C2C(=C1)C=C(S2(=O)=O)Br	{18: 1, 29: 2, 14: 5, 15: 1}
Did not match all atoms present	5350-12-9	C1=CC=C(C(=C1)/C=C\C2=CC=CC=N2)Cl	{17: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	5350-41-4	C[N+](C)(C)CC1=CC=CC=C1.[Br-]	{1: 3, 2: 1, 18: 1, 14: 5}
Did not match all atoms present	5350-47-0	CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 8}
Did not match all atoms present	5350-56-1	COC1=CC(=C(C(=C1)[N+](=O)[O-])N)[N+](=O)[O-]	{1: 1, 30: 1, 38: 2, 22: 1, 14: 2}
Did not match all atoms present	5350-57-2	C1=CC=C(C=C1)C(=NN)C2=CC=CC=C2	{34: 1, 30: 1, 14: 10, 7: 1}
Did not match all atoms present	5350-93-6	C1=CC(=NC=C1N)Cl	{17: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	53506-00-6	CC1=C(C(=C(C(=C1CP(=O)(CCC#N)CCC#N)C)C)CP(=O)(CCC#N)CCC#N)C	{1: 4, 2: 10, 29: 2, 37: 4}
Did not match all atoms present	5351-17-7	C1=CC(=CC=C1C(=O)NN)N	{24: 1, 30: 2, 14: 4, 31: 1}
Did not match all atoms present	5351-23-5	C1=CC(=CC=C1C(=O)NN)O	{24: 1, 30: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	5351-51-9	CC1=C(SC(=S)N1)C	{32: 1, 1: 2, 41: 1}
Did not match all atoms present	5351-69-9	C1=CC=C(C=C1)NC(=S)NN	{31: 2, 30: 1, 14: 5, 7: 1}
Did not match all atoms present	5351-85-9	C1OC2=C(O1)C=C(C=C2)C=NNC(=S)N	{34: 1, 6: 1, 7: 1, 11: 1, 14: 3, 23: 2, 30: 1, 31: 1}
Did not match all atoms present	53510-49-9	CN(C)C1=CC2=C(CC3=C(O2)C=C(C=C3)N(C)C)C=C1	{1: 4, 11: 1, 33: 2, 14: 6, 23: 1}
Did not match all atoms present	53516-81-7	C1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=C(C(=C(C=C2Cl)Cl)N)Cl	{34: 1, 6: 1, 14: 6, 17: 3, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	53518-15-3	C1=CC2=C(C=C1N)OC(=O)C=C2C(F)(F)F	{16: 3, 28: 1, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	53518-18-6	C1CC2=C3C(=C4C(=C2)C(=CC(=O)O4)C(F)(F)F)CCCN3C1	{33: 1, 4: 1, 11: 6, 14: 2, 16: 3, 28: 1}
Did not match all atoms present	53518-19-7	CN1CCCC2=C1C=C3C(=C2)C(=CC(=O)O3)C(F)(F)F	{1: 1, 4: 1, 33: 1, 11: 3, 14: 3, 16: 3, 28: 1}
Did not match all atoms present	5352-90-9	C1N(CCN(C1)CCO)CCCN2C3=C(SC4=CC=CC=C24)C=CC(=C3)Cl.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O	{33: 3, 2: 5, 6: 4, 41: 1, 11: 4, 14: 7, 17: 1, 20: 1, 27: 4}
Did not match all atoms present	53520-45-9	CC(=O)[Ge](C)(C)C	{24: 1, 1: 4}
Did not match all atoms present	53521-41-8	CCCCCCCCP(=O)(CCCCCCCC)CCC(C)C	{1: 4, 2: 16, 3: 1, 29: 1}
Did not match all atoms present	53524-27-9	CC1=CC(=C(C=C1Cl)N)O	{1: 1, 30: 1, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	53531-31-0	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 9}
Did not match all atoms present	53532-37-9	C1=NN=C(S1)N(CO)CO	{33: 1, 2: 2, 35: 2, 41: 1, 14: 1, 20: 2}
Did not match all atoms present	53535-33-4	C1=C(NC=N1)C[C@H]2C(=O)NC(=O)N2	{32: 3, 2: 1, 35: 1, 12: 1, 14: 2, 25: 2}
Did not match all atoms present	53539-29-0	C1CC2=CC=C(S2)CCC3=CC=C1C4=CC=CC=C34	{41: 1, 11: 4, 14: 8}
Did not match all atoms present	53548-21-3	C1=C(C=C(C(=C1Cl)OCCC(=O)O)Cl)Cl	{17: 3, 2: 2, 27: 1, 22: 1, 14: 2}
Did not match all atoms present	5355-88-4	C1=CC2=C(C(=C1)N)C(=O)C3=CC(=C(C=C3C2=O)Cl)Cl	{17: 2, 30: 1, 14: 5, 25: 2}
Did not match all atoms present	53554-75-9	CC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)C=C(C#N)C(=O)OC	{1: 4, 2: 4, 33: 1, 6: 1, 7: 1, 14: 3, 28: 3, 37: 1}
Did not match all atoms present	53555-02-5	C1=CC2=C(C=C1Cl)OC3=C(C(=C(C=C3O2)Cl)Cl)Cl	{17: 4, 14: 4, 23: 2}
Did not match all atoms present	53555-64-9	C1=C(C=C(C2=CC(=CC(=C21)Cl)Cl)Cl)Cl	{17: 4, 14: 4}
Did not match all atoms present	53555-67-2	CC(=O)OC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C5=CC=CC=C51	{1: 1, 28: 1, 14: 11}
Did not match all atoms present	53558-25-1	C1=CC(=CN=C1)CNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]	{2: 1, 35: 1, 38: 1, 14: 8, 24: 1, 31: 2}
Did not match all atoms present	5356-83-2	CCO[Si](C)(C)C=C	{1: 3, 2: 1, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	5356-84-3	C[Si](C)(C)O[Si](C=C)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 22: 3, 5: 1, 6: 1}
Did not match all atoms present	53569-62-3	C(=O)=O.N#[N+][O-]	{8: 1, 34: 1, 29: 3}
Did not match all atoms present	53569-64-5	C(CO[N+](=O)[O-])O[N+](=O)[O-].C(C(CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{2: 4, 3: 1, 22: 5}
Did not match all atoms present	53571-63-4	C1=CC=C2C(=C1)/C(=C/3\C(=NC(=N)S3)N)/N=C2N.[Cl-].[Cl-].[Zn+2]	{35: 2, 36: 1, 41: 1, 14: 4, 15: 5, 17: 2, 30: 2}
Did not match all atoms present	53575-08-9	CCOP(=O)(CC1=CC=CC2=CC=CC=C21)OCC	{1: 2, 2: 3, 22: 2, 14: 7, 29: 1}
Did not match all atoms present	5358-06-5	COC(=O)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C#N	{1: 1, 28: 1, 37: 1, 17: 4}
Did not match all atoms present	53580-45-3	[H+].[C-]#N.[C-]#N.[C-]#N.[Pd+2]	{}
Did not match all atoms present	53581-53-6	CC(CC1=CC(=C(C=C1OC)Br)OC)N.Br	{1: 3, 2: 1, 3: 1, 14: 2, 18: 2, 22: 2, 30: 1}
Did not match all atoms present	53583-79-2	CCN1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)CC)OC	{1: 3, 2: 3, 33: 1, 11: 3, 12: 1, 14: 3, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	5359-38-6	COC(=O)C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl	{1: 1, 3: 1, 28: 1, 14: 8, 17: 2}
Did not match all atoms present	53593-61-6	C=C[SnH3]	{5: 1, 6: 1}
Did not match all atoms present	53597-27-6	C1CC2=C(C=C(N2C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4)C5=CC=CC=C51	{27: 1, 33: 1, 11: 2, 21: 1, 14: 13}
Did not match all atoms present	53597-29-8	CC[N+](C)(CC)CC(C)OCC[N+](C)(C)C.[I-].[I-]	{19: 2, 1: 7, 2: 5, 3: 1, 22: 1}
Did not match all atoms present	53597-69-6	C1N2CN3CN1CP(C2)C3	{33: 3, 11: 6}
Did not match all atoms present	53597-70-9	C1N2CN3CN1CP(=O)(C2)C3	{33: 3, 11: 6, 29: 1}
Did not match all atoms present	536-08-3	C1=C(C=C(C(=C1O)O)O)C(=O)OC2=CC(=CC(=C2O)O)C(=O)O	{27: 1, 28: 1, 21: 5, 14: 4}
Did not match all atoms present	536-17-4	CN(C)C1=CC=C(C=C1)/C=C/2\C(=O)NC(=S)S2	{32: 1, 1: 2, 6: 1, 33: 1, 41: 1, 14: 4, 15: 2, 25: 1}
Did not match all atoms present	536-21-0	C1=CC(=CC(=C1)O)C(CN)O	{2: 1, 3: 1, 14: 4, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	536-25-4	COC(=O)C1=CC(=C(C=C1)O)N	{1: 1, 30: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	536-29-8	C1=CC(=C(C=C1[As](Cl)Cl)N)O.Cl	{17: 3, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	536-33-4	CCC1=NC=CC(=C1)C(=S)N	{1: 1, 2: 1, 35: 1, 7: 1, 14: 3, 30: 1}
Did not match all atoms present	536-38-9	C1=CC(=CC=C1C(=O)CBr)Cl	{24: 1, 17: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	536-40-3	C1=CC(=CC=C1C(=O)NN)Cl	{24: 1, 17: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	536-43-6	CCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl	{1: 1, 2: 5, 33: 1, 11: 5, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	536-50-5	CC1=CC=C(C=C1)C(C)O	{1: 2, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	536-57-2	CC1=CC=C(C=C1)S(=O)O	{1: 1, 20: 1, 29: 1, 14: 4}
Did not match all atoms present	536-60-7	CC(C)C1=CC=C(C=C1)CO	{1: 2, 2: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	536-66-3	CC(C)C1=CC=C(C=C1)C(=O)O	{27: 1, 1: 2, 3: 1, 14: 4}
Did not match all atoms present	536-69-6	CCCCC1=CN=C(C=C1)C(=O)O	{1: 1, 2: 3, 27: 1, 14: 3, 35: 1}
Did not match all atoms present	536-74-3	C#CC1=CC=CC=C1	{9: 1, 10: 1, 14: 5}
Did not match all atoms present	536-75-4	CCC1=CC=NC=C1	{1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	536-78-7	CCC1=CN=CC=C1	{1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	536-80-1	C1=CC=C(C=C1)I=O	{19: 1, 29: 1, 14: 5}
Did not match all atoms present	536-88-9	CCC1=CC(=NC=C1)C	{1: 2, 2: 1, 35: 1, 14: 3}
Did not match all atoms present	536-89-0	CC1=CC(=CC=C1)NN	{1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	536-90-3	COC1=CC=CC(=C1)N	{1: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	536-95-8	C1=CC=C(C=C1)CS(=O)(=O)NC2=CC=C(C=C2)C(=O)O	{2: 1, 27: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	53606-06-7	CS(=O)(=O)C1=CC=C(C=C1)CBr	{1: 1, 2: 1, 18: 1, 14: 4, 29: 2}
Did not match all atoms present	53607-04-8	CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 2, 2: 2, 3: 4, 14: 6, 35: 2, 20: 5, 22: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	5361-54-6	C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)O	{27: 1, 29: 2, 14: 9}
Did not match all atoms present	53611-17-9	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C/3\C=C(C4=C(C3=O)N=CC=C4)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 35: 1, 14: 10, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	53621-34-4	CC(=C)C(=O)OCCOS(=O)(=O)O.N	{1: 1, 2: 2, 5: 1, 7: 1, 20: 1, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	53622-16-5	CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCC(C)S(=O)(=O)[O-]	{1: 2, 2: 2, 3: 1, 33: 1, 41: 1, 14: 3, 17: 1, 29: 3}
Did not match all atoms present	53622-39-2	CC(C)NC1=CC2=CC=CC=C2C=C1	{1: 2, 3: 1, 14: 7, 31: 1}
Did not match all atoms present	53633-35-5	CC1=CC2=C(C=C1)C(=O)C(=C3C(=O)C4=CC=CC=C4S3)S2	{1: 1, 25: 2, 41: 2, 14: 7, 15: 2}
Did not match all atoms present	53633-79-7	CC(=O)C=C(C(F)(F)F)[O-].CC(=O)C=C(C(F)(F)F)[O-].[Mg+2]	{1: 2, 4: 2, 6: 2, 7: 2, 16: 6, 24: 2}
Did not match all atoms present	53639-82-0	CS(=O)(=O)OC(CCN1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 2, 4: 1, 33: 1, 11: 5, 14: 10, 22: 1, 29: 2}
Did not match all atoms present	53643-48-4	CC[C@@]1(C[C@@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)N)O)O)CC)OC)C(=O)OC)O	{32: 1, 1: 5, 2: 2, 33: 3, 11: 9, 12: 4, 13: 5, 14: 8, 20: 3, 22: 1, 24: 1, 28: 1, 30: 1}
Did not match all atoms present	53651-67-5	C(C[O-])[O-].[Mg+2]	{2: 2, 29: 2}
Did not match all atoms present	53655-17-7	CCN1C2=C(C=CC(=C2)Cl)SC1=CC=C3CCC(=C3N(C4=CC=CC=C4)C5=CC=CC=C5)C=CC6=[N+](C7=C(S6)C=CC(=C7)Cl)CC.[O-]Cl(=O)(=O)=O	{1: 2, 2: 2, 6: 4, 33: 3, 41: 2, 11: 2, 14: 16, 15: 4, 17: 3, 29: 4}
Did not match all atoms present	5366-49-4	CC1=CC=C(C=C1)S(=O)(=O)CC(=O)C	{24: 1, 1: 2, 2: 1, 29: 2, 14: 4}
Did not match all atoms present	53660-25-6	C.C1N(CN(CN1CCO)CCO)CCO	{33: 3, 2: 6, 11: 3, 20: 3}
Did not match all atoms present	53663-14-2	C1=CC2=C(C(=C1)[N+](=O)[O-])[Hg]OC2=O	{28: 1, 38: 1, 14: 3}
Did not match all atoms present	53663-17-5	C[N+](C)(C)C.C(=C(C#N)C(=C(C#N)C#N)C#N)=[N-]	{8: 1, 1: 4, 37: 4, 7: 3}
Did not match all atoms present	53663-23-3	C1=C(C=C(C(=C1I)I)I)[N+](=O)[O-]	{19: 3, 38: 1, 14: 2}
Did not match all atoms present	53666-09-4	CN(C)C=NC1=CC=CC=C1F	{1: 2, 34: 1, 6: 1, 33: 1, 14: 4, 16: 1}
Did not match all atoms present	53666-10-7	CN(C)C=NC1=CC=CC=C1I	{1: 2, 34: 1, 6: 1, 33: 1, 14: 4, 19: 1}
Did not match all atoms present	53666-30-1	CN(C)C=NC1=C(C=C(C=C1)N(C)C)Cl	{1: 4, 34: 1, 6: 1, 33: 2, 14: 3, 17: 1}
Did not match all atoms present	53666-31-2	CN(C)C=NC1=CC=C(C=C1)N(C)C	{1: 4, 34: 1, 14: 4, 6: 1, 33: 2}
Did not match all atoms present	53666-32-3	CN(C)C=NC1=CC(=CC=C1)N(C)C	{1: 4, 34: 1, 14: 4, 6: 1, 33: 2}
Did not match all atoms present	53666-34-5	CC(C)N=NC1=C(C=C(C=C1)OC)Cl	{1: 3, 34: 2, 3: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	53666-35-6	CC1=CC(=C(C=C1)N=CN(C)C)Cl	{1: 3, 34: 1, 6: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	53666-38-9	CN(C)C=NC1=C(C=C(C=C1)[N+](=O)[O-])Cl	{1: 2, 34: 1, 38: 1, 6: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	53666-40-3	CC(C)N=NC1=C(C=CC(=C1)OC)Cl	{1: 3, 34: 2, 3: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	53666-41-4	CC1=CC(=C(C=C1)Cl)N=CN(C)C	{1: 3, 34: 1, 6: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	53666-43-6	CC(C)N=NC1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 2, 34: 2, 3: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	53666-45-8	COC1=CC(=C(C=C1)NC=O)Cl	{1: 1, 14: 3, 17: 1, 22: 1, 26: 1, 31: 1}
Did not match all atoms present	53666-46-9	CN(C)C1=CC(=C(C=C1)Cl)NC=O	{1: 2, 33: 1, 14: 3, 17: 1, 26: 1, 31: 1}
Did not match all atoms present	53666-47-0	COC1=CC(=C(C=C1)Cl)NC=O	{1: 1, 14: 3, 17: 1, 22: 1, 26: 1, 31: 1}
Did not match all atoms present	53666-48-1	C1=CC(=C(C=C1[N+](=O)[O-])NC=O)Cl	{17: 1, 26: 1, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	5367-26-0	CC1=C(C(=CC=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	5367-28-2	CC1=C(C=CC(=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	5367-32-8	CC1=C(C=CC(=C1)OC)[N+](=O)[O-]	{1: 2, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	53676-18-9	C1=CC(=C(C=C1Cl)OP(=O)(Cl)Cl)Cl	{17: 4, 22: 1, 14: 3, 29: 1}
Did not match all atoms present	53676-22-5	C(C(Br)(Br)Br)OP(=O)(Cl)Cl	{2: 1, 4: 1, 17: 2, 18: 3, 22: 1, 29: 1}
Did not match all atoms present	5368-28-5	C1CNC(=O)C(N1)C2=CC=CC=C2	{32: 2, 25: 1, 11: 2, 12: 1, 14: 5}
Did not match all atoms present	5368-81-0	COC1=CC=CC(=C1)C(=O)OC	{1: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	53684-60-9	C1=CC=C2C(=C1)C(=CC(=O)C2=O)S(=O)(=O)[O-].[NH4+]	{25: 2, 29: 3, 14: 5, 15: 1}
Did not match all atoms present	5369-17-5	CCCCC1=CC(=CC=C1)N	{1: 1, 2: 3, 30: 1, 14: 4}
Did not match all atoms present	5369-19-7	CC(C)(C)C1=CC(=CC=C1)N	{1: 3, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	5369-22-2	C1=CC=C(C=C1)CCC2=CC(=CC=C2)N	{2: 2, 30: 1, 14: 9}
Did not match all atoms present	5369-25-5	CC1=CC(=CC(=C1)NC2=CC(=CC(=C2)C)C)C	{1: 4, 14: 6, 31: 1}
Did not match all atoms present	5369-84-6	CC1=C(C(=CC=C1)C)OCCN2C=NN=C2N	{1: 2, 2: 2, 35: 2, 33: 1, 14: 4, 22: 1, 30: 1}
Did not match all atoms present	53692-24-3	CC(C)(C)C1=CC=CC(=C1)C2=CC(=CC=C2)C(C)(C)C	{1: 6, 4: 2, 14: 8}
Did not match all atoms present	53697-17-9	CCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C\CCCC(=O)[O-])O)O.[Na+]	{1: 1, 2: 8, 3: 1, 6: 4, 11: 1, 12: 3, 20: 2, 24: 1, 25: 1}
Did not match all atoms present	537-00-8	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Ce+3]	{24: 3, 1: 3}
Did not match all atoms present	537-03-1	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[La+3].[La+3]	{24: 6}
Did not match all atoms present	537-05-3	CCOC1=CC=C(C=C1)N=C(NC2=CC=C(C=C2)OC)NC3=CC=C(C=C3)OC.Cl	{1: 3, 2: 1, 7: 1, 34: 1, 14: 12, 17: 1, 22: 3, 31: 2}
Did not match all atoms present	537-09-7	CC1=CC(=CC(=C1C(=O)OC2=CC(=C(C(=C2)C)C(=O)O)O)O)OC	{1: 3, 14: 4, 21: 2, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	537-12-2	C1CCN(CC1)CC(COC(=O)NC2=CC=CC=C2)OC(=O)NC3=CC=CC=C3.Cl	{33: 1, 2: 2, 3: 1, 11: 5, 14: 10, 17: 1, 28: 2, 31: 2}
Did not match all atoms present	537-17-7	C1=CC=C(C=C1)NC2=NC=NC(=N2)N	{35: 3, 30: 1, 14: 6, 31: 1}
Did not match all atoms present	537-21-3	CC(C)N=C(N)/N=C(\N)/NC1=CC(=C(C=C1)Cl)Cl	{1: 2, 34: 2, 3: 1, 7: 2, 14: 3, 17: 2, 30: 2, 31: 1}
Did not match all atoms present	537-24-6	C1=C(C=C(C(=C1Br)O)Br)CC(C(=O)O)N	{2: 1, 3: 1, 14: 2, 18: 2, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	537-26-8	CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C3=CC=CC=C3	{1: 1, 33: 1, 11: 4, 12: 3, 14: 5, 28: 1}
Did not match all atoms present	537-29-1	C1CC2CC(CC1N2)OC(=O)[C@H](CO)C3=CC=CC=C3	{32: 1, 2: 1, 3: 1, 11: 4, 12: 3, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	537-46-2	C[C@@H](CC1=CC=CC=C1)NC	{1: 2, 2: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	537-47-3	C1=CC=C(C=C1)NC(=O)NN	{24: 1, 30: 1, 14: 5, 31: 2}
Did not match all atoms present	537-49-5	CN[C@@H](CC1=CC=C(C=C1)O)C(=O)O	{1: 1, 2: 1, 3: 1, 14: 4, 21: 1, 27: 1, 31: 1}
Did not match all atoms present	537-55-3	CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O	{1: 1, 2: 1, 3: 1, 14: 4, 21: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	537-64-4	CC1=CC=C(C=C1)[Hg]C2=CC=C(C=C2)C	{1: 2, 14: 8}
Did not match all atoms present	537-65-5	C1=CC(=CC=C1N)NC2=CC=C(C=C2)N	{30: 2, 14: 8, 31: 1}
Did not match all atoms present	537-67-7	C1=CC=C(C=C1)NC2=CC=CC=C2.Cl	{17: 1, 14: 10, 31: 1}
Did not match all atoms present	537-73-5	COC1=C(C=C(C=C1)C=CC(=O)O)O	{1: 1, 6: 2, 14: 3, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	537-91-7	C1=CC(=CC(=C1)SSC2=CC=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]	{40: 2, 38: 2, 14: 8}
Did not match all atoms present	537-92-8	CC1=CC(=CC=C1)NC(=O)C	{24: 1, 1: 2, 14: 4, 31: 1}
Did not match all atoms present	537-98-4	COC1=C(C=CC(=C1)/C=C/C(=O)O)O	{1: 1, 6: 2, 14: 3, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	5370-01-4	CC1=C(C(=CC=C1)C)OCC(C)N.Cl	{1: 3, 2: 1, 3: 1, 14: 3, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	5370-25-2	CC(=O)C1=CC=C(S1)Br	{24: 1, 1: 1, 18: 1, 14: 2, 41: 1}
Did not match all atoms present	53700-79-1	C1CC2=CC=CC3=C(C=CC1=C23)S(=O)(=O)O	{11: 2, 20: 1, 29: 2, 14: 5}
Did not match all atoms present	53705-85-4	CC(=O)NP(=S)([O-])OC.[NH4+]	{24: 1, 1: 2, 29: 1, 22: 1, 31: 1}
Did not match all atoms present	53708-21-7	CCCCCCCCCCCCOC1=CC=CC=N1	{1: 1, 2: 11, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	53710-66-0	C1C(CCC(C1)OCCO)OCCO.C1=CC(=CC=C1/C=C/C(=O)O)/C=C/C(=O)O	{2: 4, 6: 4, 11: 4, 12: 2, 14: 4, 20: 2, 22: 2, 27: 2}
Did not match all atoms present	53714-34-4	CC(C)(C1=CC(=C(C(=C1)Br)OCCO)Br)C2=CC(=C(C(=C2)Br)OCCO)Br.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CO)O	{1: 2, 2: 6, 4: 1, 14: 8, 18: 4, 20: 4, 22: 2, 27: 2}
Did not match all atoms present	53716-49-7	CC(C1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl)C(=O)O	{32: 1, 1: 1, 3: 1, 14: 6, 17: 1, 27: 1}
Did not match all atoms present	53716-50-0	COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)C3=CC=CC=C3	{32: 1, 1: 1, 35: 1, 14: 8, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	5372-13-4	CCN(CC)CCOC1=CC(=NN1C2=CC=CC=C2)C	{1: 3, 2: 4, 35: 1, 33: 2, 14: 6, 22: 1}
Did not match all atoms present	5372-17-8	CCN(CC)CCOC1=CC(=NN1CC2=CC=CC=C2)C	{1: 3, 2: 5, 35: 1, 33: 2, 14: 6, 22: 1}
Did not match all atoms present	5372-81-6	COC(=O)C1=CC(=C(C=C1)C(=O)OC)N	{1: 2, 28: 2, 30: 1, 14: 3}
Did not match all atoms present	5373-42-2	CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)OC5=CC(=C(C=C5C[C@H]6C7=CC(=C(C=C7CCN6C)OC)OC)OC)OC)OC)OC	{1: 9, 2: 1, 33: 2, 11: 5, 12: 2, 14: 7, 22: 8}
Did not match all atoms present	53731-35-4	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Mn]	{29: 6, 22: 1}
Did not match all atoms present	53733-94-1	COC(=O)CCN(CCC(=O)OC)C1=CC=CC=C1	{1: 2, 2: 4, 28: 2, 14: 5, 33: 1}
Did not match all atoms present	53734-79-5	CN1CCN2C3=C(C=C(C=C3)OC)C4=C2C1=NCC4.Cl	{1: 2, 35: 1, 33: 2, 11: 4, 14: 3, 15: 1, 17: 1, 22: 1}
Did not match all atoms present	5374-06-1	CC(C)(C)C1=CC(=C(C=C1O)O)C(C)(C)C	{1: 6, 4: 2, 21: 2, 14: 2}
Did not match all atoms present	53743-11-6	CC1=CC=C(C=C1)OCCOCCOCCOCCO	{1: 1, 2: 8, 20: 1, 22: 4, 14: 4}
Did not match all atoms present	53744-50-6	CC(C1=CC=C(C=C1)OC(=O)C)O	{1: 2, 3: 1, 20: 1, 14: 4, 28: 1}
Did not match all atoms present	53746-45-5	CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].O.O.[Ca+2]	{24: 2, 1: 2, 3: 2, 22: 2, 14: 18}
Did not match all atoms present	53757-28-1	C1=C(OC(=C1)[N+](=O)[O-])C2=CSC=N2	{41: 1, 35: 1, 38: 1, 14: 4, 23: 1}
Did not match all atoms present	53757-29-2	CC1=NC(=CS1)C2=CC=C(O2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 41: 1, 14: 3, 23: 1}
Did not match all atoms present	53757-30-5	C1=C(OC(=C1)[N+](=O)[O-])C=CC2=CSC(=N2)NC=O	{35: 1, 38: 1, 6: 2, 41: 1, 14: 3, 23: 1, 26: 1, 31: 1}
Did not match all atoms present	53757-31-6	C1=CC=C(C=C1)C(=CC2=CC=C(O2)[N+](=O)[O-])C(=O)N	{38: 1, 6: 1, 7: 1, 14: 7, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	5376-15-8	COC1=NNN=N1	{32: 1, 1: 1, 35: 3, 22: 1}
Did not match all atoms present	53760-19-3	CC1C/C=C/C2C(C(=C)C(C3C2(C(/C=C/C(C1)(C)O)OC(=O)C)C(=O)NC3CC4=CC=CC=C4)C)O	{32: 1, 1: 4, 2: 1, 5: 1, 11: 2, 12: 7, 13: 2, 14: 9, 15: 1, 20: 2, 25: 1, 28: 1}
Did not match all atoms present	53761-45-8	CCN1C2=C(C=CC1=O)C=C(C=C2)C	{1: 2, 2: 1, 33: 1, 14: 5, 25: 1}
Did not match all atoms present	53761-50-5	CCN1C(=O)C=CC2=CC=CC=C21	{1: 1, 2: 1, 33: 1, 14: 6, 25: 1}
Did not match all atoms present	5377-20-8	CC(C1=CC=CC=C1)N2C=NC=C2C(=O)OC	{1: 2, 3: 1, 33: 1, 14: 7, 35: 1, 28: 1}
Did not match all atoms present	53775-55-6	C1=CC(=C(C=C1OC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-])[N+](=O)[O-].[K+]	{24: 1, 17: 2, 38: 1, 22: 1, 14: 6}
Did not match all atoms present	53778-51-1	C1=CC=C(C=C1)C(CC(NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=N3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 1, 35: 1, 14: 13, 3: 2, 29: 8, 31: 2}
Did not match all atoms present	5378-31-4	CCCCOC1=CC=CC(=C1)C2=NN=CO2	{1: 1, 2: 3, 35: 2, 14: 5, 22: 1, 23: 1}
Did not match all atoms present	5378-32-5	C1=CC(=CC(=C1)F)C2=NN=CO2	{16: 1, 35: 2, 14: 5, 23: 1}
Did not match all atoms present	5378-52-9	C1=CC=C(C=C1)N2C=NN=N2	{33: 1, 35: 3, 14: 6}
Did not match all atoms present	53780-33-9	CC1=CC(=C(C=C1N)NC(=O)C)C	{24: 1, 1: 3, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	53780-34-0	CC1=CC(=C(C=C1NC(=O)C)NS(=O)(=O)C(F)(F)F)C	{1: 3, 4: 1, 14: 2, 16: 3, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	53784-33-1	CC(=O)O[C@@H]1CO[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)N=[N+]=[N-]	{1: 3, 34: 2, 11: 1, 12: 4, 23: 1, 28: 3}
Did not match all atoms present	5379-16-8	CC1=CC(=CC(=C1)C(=O)C)C	{24: 1, 1: 3, 14: 3}
Did not match all atoms present	5379-19-1	CC1=CC(=C(C=C1)C(C)O)C	{1: 3, 3: 1, 20: 1, 14: 3}
Did not match all atoms present	5379-20-4	CC1=CC(=CC(=C1)C=C)C	{1: 2, 14: 3, 5: 1, 6: 1}
Did not match all atoms present	53794-87-9	C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C1=CC(=CC=C1OCCO)OCCO	{2: 5, 8: 2, 11: 5, 34: 2, 14: 12, 20: 2, 22: 2, 28: 1, 29: 2}
Did not match all atoms present	53797-35-6	C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N)O[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)O)N.OS(=O)(=O)O	{2: 2, 11: 1, 12: 14, 20: 8, 22: 2, 23: 2, 29: 2, 30: 4}
Did not match all atoms present	538-03-4	C1=CC(=C(C=C1[As]=O)N)O.Cl	{17: 1, 30: 1, 21: 1, 14: 3, 29: 1}
Did not match all atoms present	538-04-5	C1=CC(=C(C=C1[Hg])Cl)O.O	{17: 1, 21: 1, 14: 3}
Did not match all atoms present	538-17-0	C(#N)[S-].C(#N)[S-].C(#N)[S-].[Al+3]	{37: 3}
Did not match all atoms present	538-28-3	C1=CC=C(C=C1)CSC(=N)N.Cl	{2: 1, 36: 1, 7: 1, 40: 1, 14: 5, 17: 1, 30: 1}
Did not match all atoms present	538-32-9	C1=CC=C(C=C1)CNC(=O)N	{24: 1, 2: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	538-39-6	CC1=CC=C(C=C1)CCC2=CC=C(C=C2)C	{1: 2, 2: 2, 14: 8}
Did not match all atoms present	538-41-0	C1=CC(=CC=C1N)N=NC2=CC=C(C=C2)N	{34: 2, 30: 2, 14: 8}
Did not match all atoms present	538-42-1	C1=CC=C(C=C1)/C=C/C(=O)[O-].[Na+]	{24: 1, 14: 5, 6: 2}
Did not match all atoms present	538-43-2	C1=CC=C(C=C1)OCC(CO)O	{2: 2, 3: 1, 20: 2, 22: 1, 14: 5}
Did not match all atoms present	538-44-3	CC(C)(C)C(=O)C=CC1=CC=CC=C1	{24: 1, 1: 3, 4: 1, 14: 5, 6: 2}
Did not match all atoms present	538-49-8	C1=CC=C(C=C1)/C=C/C2=CC=CC=N2	{35: 1, 14: 9, 6: 2}
Did not match all atoms present	538-51-2	C1=CC=C(C=C1)C=NC2=CC=CC=C2	{34: 1, 14: 10, 6: 1}
Did not match all atoms present	538-56-7	C1=CC=C(C=C1)C=CC(=O)OC(=O)C=CC2=CC=CC=C2	{28: 2, 14: 10, 6: 4}
Did not match all atoms present	538-58-9	C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=CC=C2	{24: 1, 14: 10, 6: 4}
Did not match all atoms present	538-64-7	C1=CC=C(C=C1)COC(=O)C=CC(=O)[O-]	{24: 1, 2: 1, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	538-65-8	CCCCOC(=O)C=CC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	538-68-1	CCCCCC1=CC=CC=C1	{1: 1, 2: 4, 14: 5}
Did not match all atoms present	538-71-6	CCCCCCCCCCCC[N+](C)(C)CCOC1=CC=CC=C1.[Br-]	{1: 3, 2: 13, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	538-74-9	C1=CC=C(C=C1)CSCC2=CC=CC=C2	{40: 1, 2: 2, 14: 10}
Did not match all atoms present	538-79-4	CNCCC=CC1=CN=CC=C1	{1: 1, 2: 2, 35: 1, 6: 2, 14: 4, 31: 1}
Did not match all atoms present	538-81-8	C1=CC=C(C=C1)/C=C/C=C/C2=CC=CC=C2	{14: 10, 6: 4}
Did not match all atoms present	538-86-3	COCC1=CC=CC=C1	{1: 1, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	538-93-2	CC(C)CC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	5380-40-5	C1=CC=C(C=C1)COC(=O)C2=CC=CO2	{2: 1, 28: 1, 14: 8, 23: 1}
Did not match all atoms present	5380-42-7	COC(=O)C1=CC=CS1	{1: 1, 28: 1, 14: 3, 41: 1}
Did not match all atoms present	5380-87-0	C1C(O1)COCC2=CC=CO2	{2: 2, 11: 1, 12: 1, 14: 3, 22: 1, 23: 2}
Did not match all atoms present	53801-86-8	[O-]P(=O)=O.[O-]P(=O)=O.[Ca+2]	{29: 6}
Did not match all atoms present	53808-39-2	CCC(CO)(CO)CO.CC(C)(CO)CO.COC(=O)C1=CC=C(C=C1)C(=O)OC	{1: 5, 2: 6, 4: 2, 14: 4, 20: 5, 28: 2}
Did not match all atoms present	53809-79-3	[Cd].[Cd].[Cd]	{}
Did not match all atoms present	5381-20-4	C1=CC=C2C(=C1)C(=CS2)C=O	{41: 1, 26: 1, 14: 5}
Did not match all atoms present	5381-92-0	C1=CC=C(C=C1)CC(CC2=CC=CC=C2)O	{2: 2, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	5381-99-7	C1=CC=C2C(=C1)C(=O)OP(O2)Cl	{17: 1, 28: 1, 14: 4, 23: 1}
Did not match all atoms present	53815-04-6	CC1=C(C=CC(=C1)Cl)NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)Cl)C)Cl)Cl	{1: 4, 34: 4, 3: 2, 14: 12, 17: 4, 24: 4, 31: 2}
Did not match all atoms present	53815-85-3	C1=CC=C2C(=C1)C=CC=C2NCCOCCO	{2: 4, 20: 1, 22: 1, 14: 7, 31: 1}
Did not match all atoms present	53816-93-6	CC1=NC2=CC3=C(C=C2O1)OC(=N3)C	{1: 2, 35: 2, 14: 2, 23: 2}
Did not match all atoms present	53817-43-9	CC1CCC2=C(N1CCO)C=C(C=C2)C	{1: 2, 2: 2, 33: 1, 11: 2, 12: 1, 14: 3, 20: 1}
Did not match all atoms present	53817-44-0	CC1CC(N(C2=C1C=CC(=C2)C)CCO)(C)C	{1: 4, 2: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 3, 20: 1}
Did not match all atoms present	53818-14-7	CC(COC=O)OC=O	{1: 1, 2: 1, 3: 1, 26: 2}
Did not match all atoms present	5382-10-5	CCCCCCCCSC(C)CC1=CC2=C(C=C1)OCO2	{1: 2, 2: 8, 3: 1, 40: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	53823-60-2	[Na+].[Na+].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Pd]	{17: 6}
Did not match all atoms present	53823-68-0	C=C(C(=O)O)OP(=O)(O)[O-].O.[Na+]	{5: 1, 7: 1, 20: 1, 22: 1, 27: 1, 29: 2}
Did not match all atoms present	53830-54-9	CCOC(=O)CCOC1=CC(=C(C(=C1)C)Cl)C	{1: 3, 2: 3, 14: 2, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	53832-00-1	CC(=C)C(=O)OC.C=CC=C.C=CC1=CC=CC=C1.C(=C/C(=O)O)\C(=O)O	{1: 2, 5: 4, 6: 5, 7: 1, 14: 5, 27: 2, 28: 1}
Did not match all atoms present	53833-30-0	CCC1=NC(=C(O1)C)C	{1: 3, 2: 1, 35: 1, 23: 1}
Did not match all atoms present	5384-03-2	CCC(=O)C1=CC(=C(C(=C1O)C)C)Br	{1: 3, 2: 1, 14: 1, 18: 1, 21: 1, 24: 1}
Did not match all atoms present	53844-93-2	[B]S	{39: 1}
Did not match all atoms present	53848-85-4	CCCCCCCCCCCCCCCCCCOC(=O)C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 17, 28: 1, 38: 3, 14: 2}
Did not match all atoms present	53848-86-5	CCCCCCCCCCCCCCCCOC(=O)C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 15, 28: 1, 38: 3, 14: 2}
Did not match all atoms present	53848-87-6	CCCCCCCCCCCCOC(=O)C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 11, 28: 1, 38: 3, 14: 2}
Did not match all atoms present	53848-89-8	CCCCCCOC(=O)C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 5, 28: 1, 38: 3, 14: 2}
Did not match all atoms present	5385-26-2	C1=CC=C2C#CC3=CC=CC=C3C#CC4=CC=CC=C4C#CC2=C1	{10: 6, 14: 12}
Did not match all atoms present	5385-36-4	C1CC2=CC(=CC=C2)CCC3=CC=C1C=C3	{11: 4, 14: 8}
Did not match all atoms present	5385-75-1	C1=CC=C2C(=C1)C=C3C4=CC=CC=C4C5=C3C2=CC6=CC=CC=C65	{14: 14}
Did not match all atoms present	53850-36-5	[Rf]	{}
Did not match all atoms present	53852-20-3	CCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCC	{1: 2, 2: 24, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	53859-83-9	C1C=CCC2C1C(=O)OC2=O.C1=CC(=O)OC1=O.C(CO)O.C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)OC2=O	{2: 2, 11: 2, 12: 2, 14: 4, 17: 4, 20: 2, 28: 6}
Did not match all atoms present	5386-11-8	C1C2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=C3C1=O	{25: 1, 11: 1, 38: 1, 14: 5}
Did not match all atoms present	5386-30-1	C12=C(C(=C(C(=C1O)F)F)F)C(=C(C(=C2F)F)F)F	{16: 7, 21: 1}
Did not match all atoms present	53863-86-8	CC1CC2=CC(=CC3=CC(=CC(=C23)C1=O)C)C	{1: 3, 11: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	53866-33-4	[2H]C1=CC2=C(CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4O)C)C(=C1O)[2H]	{1: 1, 11: 6, 12: 4, 13: 1, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	53868-44-3	C1=CC=C(C(=C1)C(C=O)C=O)[N+](=O)[O-]	{26: 2, 3: 1, 38: 1, 14: 4}
Did not match all atoms present	53874-66-1	C1=CC=C(C=C1)OC2=CC=CC(=C2)CCl	{17: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	53874-67-2	C1=CC=C(C=C1)OC2=CC=CC(=C2)C(Br)Br	{18: 2, 3: 1, 22: 1, 14: 9}
Did not match all atoms present	53879-74-6	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC1=CC=CC=C1C=C.CC(C)COC(=O)C(=C)C	{1: 6, 2: 18, 3: 1, 5: 3, 6: 1, 7: 2, 14: 4, 28: 2}
Did not match all atoms present	5388-42-1	C1C2=CC=CC=C2C(=O)N1C3=CC=CC=C3	{25: 1, 11: 1, 14: 9, 33: 1}
Did not match all atoms present	5388-62-5	C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])Cl	{17: 1, 38: 2, 30: 1, 14: 2}
Did not match all atoms present	53882-81-8	CC1=CC=CC(=C1)C(=O)CC#N	{24: 1, 1: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	53883-47-9	C1CO[Si]2(OCCN1CC(=O)O2)C3=CC=CC=C3	{33: 1, 11: 5, 28: 1, 14: 5, 23: 2}
Did not match all atoms present	53885-35-1	C1CN(CC2=C1SC=C2)CC3=CC=CC=C3Cl.Cl	{33: 1, 2: 1, 41: 1, 11: 3, 14: 6, 17: 2}
Did not match all atoms present	53889-94-4	CC=CC1=C(C=CC(=C1)C)O	{1: 2, 14: 3, 6: 2, 21: 1}
Did not match all atoms present	53891-22-8	C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)[O-])N)O)S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 21: 1, 14: 4, 29: 6}
Did not match all atoms present	53894-36-3	C1=CC=C2C(=C1)C=CC=C2C3=C(C=C(C=C3)N4C(=O)C=CC4=O)N	{25: 2, 30: 1, 14: 12, 33: 1}
Did not match all atoms present	539-03-7	CC(=O)NC1=CC=C(C=C1)Cl	{24: 1, 1: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	539-15-1	CN(C)CCC1=CC=C(C=C1)O	{1: 2, 2: 2, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	539-17-3	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N	{1: 2, 34: 2, 30: 1, 14: 8, 33: 1}
Did not match all atoms present	539-21-9	C1=CC(=CC=C1NN=C(N)N)N=NC(=S)N	{34: 3, 31: 1, 30: 3, 14: 4, 7: 2}
Did not match all atoms present	539-23-1	CCCCOC1=NC=C(C=C1)N	{1: 1, 2: 3, 35: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	539-30-0	CCOCC1=CC=CC=C1	{1: 1, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	539-32-2	CCCCC1=CN=CC=C1	{1: 1, 2: 3, 35: 1, 14: 4}
Did not match all atoms present	539-48-0	C1=CC(=CC=C1CN)CN	{2: 2, 30: 2, 14: 4}
Did not match all atoms present	539-52-6	CC(=CCCC1=COC=C1)C	{1: 2, 2: 2, 6: 1, 7: 1, 14: 3, 23: 1}
Did not match all atoms present	539-86-6	C=CCSS(=O)CC=C	{40: 1, 2: 2, 5: 2, 6: 2, 29: 1}
Did not match all atoms present	539-92-4	CC(C)COC(=O)OCC(C)C	{1: 4, 2: 2, 3: 2}
Did not match all atoms present	5390-94-3	COCNS(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 29: 3, 22: 1, 31: 1}
Did not match all atoms present	53900-32-6	CN1C=NC(=C1SC2=CC=CC=C2N)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 33: 1, 40: 1, 14: 5, 30: 1}
Did not match all atoms present	53901-05-6	C1=CC(=C(C2=C1NC(=N2)C(F)(F)F)[N+](=O)[O-])Cl	{32: 1, 35: 1, 4: 1, 38: 1, 14: 2, 16: 3, 17: 1}
Did not match all atoms present	53902-12-8	COC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2C(=O)O)OC	{1: 2, 6: 2, 14: 7, 22: 2, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	53905-38-7	CC(C)C1=CC=C(C=C1)CCCC(C)CCCC(C)(C)OC	{1: 6, 2: 6, 3: 2, 4: 1, 14: 4, 22: 1}
Did not match all atoms present	5391-30-0	C1=CC=C(C(=C1)NC(=S)N)Br	{18: 1, 31: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	5391-70-8	COC1=C(C(=CC(=C1)C(=CC2=CC=CC=C2N)C(=O)O)Br)OC	{1: 2, 6: 1, 7: 1, 14: 6, 18: 1, 22: 2, 27: 1, 30: 1}
Did not match all atoms present	5391-88-8	CC(C1=CC=C(C=C1)Br)O	{1: 1, 18: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	53910-25-1	C1[C@H](C2=C(NC=N1)N(C=N2)C3CC(C(O3)CO)O)O	{32: 1, 33: 1, 2: 1, 35: 2, 11: 2, 12: 4, 14: 2, 20: 3, 23: 1}
Did not match all atoms present	53911-35-6	CCCC1=C(C=NC=C1)C2=CC=CC=C2	{1: 1, 2: 2, 35: 1, 14: 8}
Did not match all atoms present	53911-92-5	CCCC[Sn](CCCC)(CCCC)CC=C(C)C	{1: 5, 2: 10, 6: 1, 7: 1}
Did not match all atoms present	53912-80-4	C1C[C@H](N(C1)CC2=CC=CC=C2)CO	{33: 1, 2: 2, 11: 3, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	53915-69-8	CCCC[Sn](CCCC)(CCCC)C=C=C	{8: 1, 1: 3, 2: 9, 5: 1, 6: 1}
Did not match all atoms present	53917-01-4	CCC(=O)CC1=CC=C(C=C1)OC	{24: 1, 1: 2, 2: 2, 22: 1, 14: 4}
Did not match all atoms present	53918-53-9	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)OC3=CC=C(C=C3)C(=O)O)C(C)(C)CC	{1: 9, 2: 5, 3: 1, 4: 3, 14: 10, 17: 1, 22: 2, 24: 3, 27: 1, 31: 2}
Did not match all atoms present	5392-10-9	COC1=C(C=C(C(=C1)C=O)Br)OC	{1: 2, 18: 1, 26: 1, 22: 2, 14: 2}
Did not match all atoms present	5392-12-1	COC1=C(C2=CC=CC=C2C=C1)C=O	{1: 1, 26: 1, 22: 1, 14: 6}
Did not match all atoms present	5392-23-4	CC1=CC(NC(=S)N1)(C)C	{32: 2, 1: 3, 13: 1, 14: 1, 15: 2}
Did not match all atoms present	5392-28-9	C1(=C(N=C(N=C1N)N)N)N.OS(=O)(=O)O	{35: 2, 20: 2, 29: 2, 30: 4}
Did not match all atoms present	5392-67-6	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NNC3=CC=C(C=C3)[N+](=O)[O-]	{34: 4, 38: 1, 14: 13, 31: 1}
Did not match all atoms present	5392-82-5	C1=CC(=C(C=C1Cl)N=C=O)Cl	{8: 1, 17: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	5392-86-9	CCOC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	53924-05-3	C1=CC2=C(C(=C1)Cl)NC=C2	{32: 1, 17: 1, 14: 5}
Did not match all atoms present	5393-22-6	C1=CC(=C(C=C1SC#N)O)O	{40: 1, 21: 2, 14: 3, 37: 1}
Did not match all atoms present	5393-41-9	C1=CC=C2C(=C1)C3=C(N2N=O)C=CC(=C3)[N+](=O)[O-]	{33: 1, 34: 1, 38: 1, 29: 1, 14: 7}
Did not match all atoms present	5393-46-4	CC(=O)NC1=C(C=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 8, 31: 1}
Did not match all atoms present	5393-55-5	CC(=O)NC1=NN=CS1	{1: 1, 35: 2, 41: 1, 14: 1, 24: 1, 31: 1}
Did not match all atoms present	5393-59-9	COC1=C(C=C(C=C1)C=O)S(=O)(=O)O	{1: 1, 14: 3, 20: 1, 22: 1, 26: 1, 29: 2}
Did not match all atoms present	5393-75-9	CC(=O)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 28: 1, 14: 2, 17: 3}
Did not match all atoms present	53933-88-3	C1CC2=C(C1)C=C3C(=C2)C(=O)C4=CC=CC=C4C3=O	{25: 2, 11: 3, 14: 6}
Did not match all atoms present	53934-25-1	CCCCOC(=O)C=C.CCOC(=O)C=C.CC(=C)C(=O)[O-].[NH4+]	{1: 3, 2: 4, 5: 3, 6: 2, 7: 1, 24: 1, 28: 2}
Did not match all atoms present	53934-41-1	[B-](F)(F)(F)F.C1CCN(C1)C2=C(C=C(C=C2)[N+]#N)Cl	{33: 1, 34: 1, 11: 4, 14: 3, 16: 4, 17: 1}
Did not match all atoms present	53935-32-3	C1CC(N(C1)C(=O)C(CC2=CN=CN2)NC(=O)C3CCC(=O)N3)C(=O)N.C(C(C(=O)O)O)(C(=O)O)O	{32: 2, 33: 1, 2: 1, 3: 3, 11: 5, 12: 2, 14: 2, 35: 1, 20: 2, 24: 3, 25: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	53939-30-3	C1=CC(=NC=C1Br)Cl	{17: 1, 18: 1, 35: 1, 14: 3}
Did not match all atoms present	5394-18-3	C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCBr	{25: 2, 2: 4, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	5394-57-0	COC1=CC=C(C=C1)OCCO	{1: 1, 2: 2, 20: 1, 22: 2, 14: 4}
Did not match all atoms present	53940-49-1	COC1=C(C=CC(=C1)CC2CO2)O	{1: 1, 2: 1, 11: 1, 12: 1, 14: 3, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	53944-40-4	CC(=O)C1=CC2=C(C=C1)OC3=C(C2=O)C=CC=N3	{1: 1, 35: 1, 14: 6, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	5395-08-4	CCCCOC(C1=CC=CC=C1)OCCCC	{1: 2, 2: 6, 3: 1, 22: 2, 14: 5}
Did not match all atoms present	5395-70-0	CNC1=CC=C(C=C1)N.Cl.Cl	{1: 1, 31: 1, 30: 1, 14: 4, 17: 2}
Did not match all atoms present	5395-71-1	CCOC1=CC=CC=C1N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	5395-94-8	CCC1=CC=CC=C1NC(=S)NC2=CC=CC=C2CC	{1: 2, 2: 2, 31: 2, 14: 8, 7: 1}
Did not match all atoms present	53950-28-0	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)NC	{1: 3, 34: 2, 38: 2, 14: 4, 18: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	53954-86-2	CCC(C)(C)[C-]1C=CC=C1.[CH-]1[CH-][CH-][CH-][CH-]1.[Fe]	{1: 3, 2: 1, 4: 1, 14: 9}
Did not match all atoms present	53957-33-8	CC1=CC(=C(C=C1)C)CO	{1: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	53957-34-9	CCC1=CC(=CC=C1)CO	{1: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	53959-54-9	C1=CC=C(C=C1)CS/C=C/SCC2=CC=CC=C2	{40: 2, 2: 2, 14: 10, 6: 2}
Did not match all atoms present	5396-38-3	CC(C)(C)C1=CC=C(C=C1)OC	{1: 4, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	5396-64-5	COC1=C(C=C(C=C1)/C=C/C(=O)OC)OC	{1: 3, 22: 2, 28: 1, 14: 3, 6: 2}
Did not match all atoms present	5396-71-4	CCOC(=O)C=CC1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 2: 1, 6: 2, 38: 1, 14: 4, 28: 1}
Did not match all atoms present	5396-89-4	CC(=O)CC(=O)OCC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	5396-91-8	C1=CC=C(C=C1)CCC(=O)CCC2=CC=CC=C2	{24: 1, 2: 4, 14: 10}
Did not match all atoms present	5396-94-1	C1=CC=C2C(=C1)C=CC(=N2)C=CC3=CC=C(C=C3)Br	{18: 1, 35: 1, 14: 10, 6: 2}
Did not match all atoms present	53966-05-5	[CH-]1[CH-][C-]([CH-][C-]([CH-]1)C(F)(F)F)C(F)(F)F.C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F.[Cr]	{16: 12, 4: 4, 14: 8, 15: 2}
Did not match all atoms present	53968-86-8	CN(C)C1=CC=C(C=C1)P2(=NP(=NP(=N2)(F)F)(F)F)F	{16: 5, 1: 2, 35: 3, 14: 4, 33: 1}
Did not match all atoms present	5397-03-5	CSC(=S)NN	{40: 1, 1: 1, 31: 1, 30: 1, 7: 1}
Did not match all atoms present	5397-34-2	C1=CC=C(C(=C1)O)S(=O)(=O)C2=CC=C(C=C2)O	{21: 2, 14: 8, 29: 2}
Did not match all atoms present	5397-37-5	C1C2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C31	{11: 1, 38: 1, 14: 7}
Did not match all atoms present	5398-27-6	C1=C(C=C(C(=C1I)N)I)[N+](=O)[O-]	{38: 1, 19: 2, 30: 1, 14: 2}
Did not match all atoms present	5398-44-7	C1=C(C=C(N=C1Cl)Cl)C(=O)O	{17: 2, 27: 1, 14: 2, 35: 1}
Did not match all atoms present	5398-58-3	CC(C)(C)C1=CC=CN1	{32: 1, 1: 3, 4: 1, 14: 3}
Did not match all atoms present	5398-75-4	CC1=CC=CC2=C1C(=O)C(=O)C3=C2C=CC(=C3)C(C)C	{1: 3, 3: 1, 14: 6, 25: 2}
Did not match all atoms present	5398-77-6	CS(=O)(=O)C1=CC=C(C=C1)C=O	{1: 1, 26: 1, 29: 2, 14: 4}
Did not match all atoms present	53987-32-9	CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])N	{1: 1, 38: 1, 14: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	5399-30-4	C1=CC=C(C=C1)C(=O)CSC#N	{24: 1, 40: 1, 2: 1, 37: 1, 14: 5}
Did not match all atoms present	5399-63-3	C1=CC(=CC=C1C(=O)O)S(=O)(=O)[O-].[K+]	{27: 1, 29: 3, 14: 4}
Did not match all atoms present	54-04-6	COC1=CC(=CC(=C1OC)OC)CCN	{1: 3, 2: 2, 30: 1, 22: 3, 14: 2}
Did not match all atoms present	54-05-7	CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl	{1: 3, 2: 5, 3: 1, 33: 1, 14: 5, 17: 1, 35: 1, 31: 1}
Did not match all atoms present	54-12-6	C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	54-16-0	C1=CC2=C(C=C1O)C(=CN2)CC(=O)O	{32: 1, 2: 1, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	54-20-6	C1=C(C(=O)NC(=O)N1)C(F)(F)F	{16: 3, 25: 2, 4: 1, 14: 1, 32: 2}
Did not match all atoms present	54-21-7	C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]	{24: 1, 21: 1, 14: 4}
Did not match all atoms present	54-30-8	CCN(CC)CCNC(C1=CC=CC=C1)C(=O)OCCC(C)C	{1: 4, 2: 6, 3: 2, 33: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	54-31-9	C1=COC(=C1)CNC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl	{2: 1, 14: 5, 17: 1, 23: 1, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	54-32-0	CC1=CC(=C(C=C1OC(=O)C)C(C)C)OCCN(C)C	{1: 6, 2: 2, 3: 1, 33: 1, 14: 2, 22: 1, 28: 1}
Did not match all atoms present	54-35-3	CCN(CC)CCOC(=O)C1=CC=C(C=C1)N.CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C	{1: 4, 2: 5, 33: 2, 41: 1, 12: 3, 13: 1, 14: 9, 24: 1, 25: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	54-36-4	CC(C)(C1=CN=CC=C1)C(=O)C2=CN=CC=C2	{24: 1, 1: 2, 35: 2, 4: 1, 14: 8}
Did not match all atoms present	54-42-2	C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)I)CO)O	{32: 1, 33: 1, 2: 1, 11: 1, 12: 3, 14: 1, 19: 1, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	54-47-7	CC1=NC=C(C(=C1O)C=O)COP(=O)(O)O	{1: 1, 2: 1, 35: 1, 14: 1, 20: 2, 21: 1, 22: 1, 26: 1, 29: 1}
Did not match all atoms present	54-49-9	C[C@@H]([C@@H](C1=CC(=CC=C1)O)O)N	{1: 1, 3: 2, 14: 4, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	54-62-6	C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N	{2: 3, 3: 1, 14: 5, 35: 4, 24: 1, 27: 2, 30: 2, 31: 2}
Did not match all atoms present	54-64-8	CC[Hg]SC1=CC=CC=C1C(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 1, 14: 4, 40: 1}
Did not match all atoms present	54-71-7	CC[C@H]1[C@H](COC1=O)CC2=CN=CN2C.Cl	{1: 2, 2: 2, 35: 1, 33: 1, 11: 1, 12: 2, 14: 2, 17: 1, 28: 1}
Did not match all atoms present	54-77-3	C[N+]1(CCN(CC1)C2=CC=CC=C2)C.[I-]	{19: 1, 1: 2, 11: 4, 14: 5, 33: 1}
Did not match all atoms present	54-80-8	CC(C)NCC(C1=CC2=CC=CC=C2C=C1)O	{1: 2, 2: 1, 3: 2, 14: 7, 20: 1, 31: 1}
Did not match all atoms present	54-84-2	CN(C)CCCSC1=CC=CC=C1NC(=O)/C=C/C2=CC=CC=C2.Cl	{1: 2, 2: 3, 6: 2, 33: 1, 40: 1, 14: 9, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	54-85-3	C1=CN=CC=C1C(=O)NN	{24: 1, 35: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	54-86-4	C1=CC(=CN=C1)C(=O)[O-].[Na+]	{24: 1, 35: 1, 14: 4}
Did not match all atoms present	54-87-5	C1C(=O)N=C(N1/N=C/C2=CC=C(O2)[N+](=O)[O-])[O-].[Na+]	{33: 1, 34: 1, 35: 1, 38: 1, 6: 1, 11: 1, 14: 2, 15: 1, 23: 1, 25: 1}
Did not match all atoms present	54-88-6	CC1=C(C=CC(=C1)N(C)C)N=NC2=CC=CC=C2	{1: 3, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	54-92-2	CC(C)NNC(=O)C1=CC=NC=C1	{1: 2, 3: 1, 14: 4, 35: 1, 24: 1, 31: 2}
Did not match all atoms present	54-95-5	C1CCC2=NN=NN2CC1	{33: 1, 11: 5, 35: 3}
Did not match all atoms present	54-96-6	C1=CN=CC(=C1N)N	{35: 1, 30: 2, 14: 3}
Did not match all atoms present	540-16-9	CCCC(=O)[O-].CCCC(=O)[O-].[Cu+2]	{24: 2, 1: 2, 2: 4}
Did not match all atoms present	540-23-8	CC1=CC=C(C=C1)N.Cl	{1: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	540-36-3	C1=CC(=CC=C1F)F	{16: 2, 14: 4}
Did not match all atoms present	540-37-4	C1=CC(=CC=C1N)I	{19: 1, 30: 1, 14: 4}
Did not match all atoms present	540-38-5	C1=CC(=CC=C1O)I	{19: 1, 21: 1, 14: 4}
Did not match all atoms present	540-69-2	C(=O)[O-].[NH4+]	{26: 1}
Did not match all atoms present	540-72-7	C(#N)[S-].[Na+]	{37: 1}
Did not match all atoms present	540-82-9	CCOS(=O)(=O)O	{1: 1, 2: 1, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	540-97-6	C[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 12, 23: 6}
Did not match all atoms present	5400-80-6	C1C(C(C2=CC=CC=C21)O)Br	{20: 1, 18: 1, 11: 1, 12: 2, 14: 4}
Did not match all atoms present	54002-45-8	COC(=O)C1=CC(=CC(=C1)OC2=CC=CC=C2)C(=O)OC	{1: 2, 28: 2, 22: 1, 14: 8}
Did not match all atoms present	5401-14-9	C1=CC=C(C=C1)OP(=O)(N=C=S)OC2=CC=CC=C2	{8: 1, 34: 1, 22: 2, 14: 10, 29: 1}
Did not match all atoms present	5401-86-5	CC1=C(C=C(C=C1N)S(=O)(=O)O)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]	{1: 1, 38: 1, 14: 6, 20: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	54010-75-2	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zn+2]	{16: 6, 4: 2, 29: 6}
Did not match all atoms present	54012-92-9	C1CC2=C(C(=CC=C2)N)NC1	{32: 1, 11: 3, 30: 1, 14: 3}
Did not match all atoms present	5402-55-1	C1=CSC(=C1)CCO	{41: 1, 2: 2, 20: 1, 14: 3}
Did not match all atoms present	5402-73-3	C1=CC(=C(C=C1Cl)S(=O)(=O)Cl)Cl	{17: 3, 29: 2, 14: 3}
Did not match all atoms present	54023-77-7	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC(=CC=C3)O)O	{24: 1, 21: 2, 14: 10, 31: 1}
Did not match all atoms present	54039-37-1	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.Cl[Ta]Cl	{17: 2, 14: 10}
Did not match all atoms present	54039-38-2	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.Cl[Zr+2]Cl	{1: 10, 17: 2}
Did not match all atoms present	5404-86-4	C1=NC2=C(N1)C(=NC=N2)NN	{32: 1, 35: 3, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	54041-17-7	CC(C)N(C1=CC=C(C=C1)F)C(=O)CO	{1: 2, 2: 1, 3: 1, 33: 1, 14: 4, 16: 1, 20: 1, 24: 1}
Did not match all atoms present	5405-13-0	CC1=CC=CC=C1NCC2=CC=CC=C2	{1: 1, 2: 1, 14: 9, 31: 1}
Did not match all atoms present	5405-15-2	CC1=CC=C(C=C1)NCC2=CC=CC=C2	{1: 1, 2: 1, 14: 9, 31: 1}
Did not match all atoms present	5405-17-4	CC1=CC(=CC=C1)NCC2=CC=CC=C2	{1: 1, 2: 1, 14: 9, 31: 1}
Did not match all atoms present	5405-53-8	C1C2=C(C=CC(=C2)[N+](=O)[O-])C3=C1C=C(C=C3)[N+](=O)[O-]	{11: 1, 38: 2, 14: 6}
Did not match all atoms present	5405-96-9	C1CC2=CC=CC=C2C(=C1)C3=CCCC4=CC=CC=C43	{11: 4, 14: 10, 15: 2}
Did not match all atoms present	54057-95-3	C1=CC(=CC=C1C=CC(=O)O)N.Cl	{17: 1, 30: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	5406-12-2	CC1=CC=C(C=C1)CCC=O	{1: 1, 2: 2, 26: 1, 14: 4}
Did not match all atoms present	5406-18-8	COC1=CC=C(C=C1)CCCO	{1: 1, 2: 3, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	5406-58-6	CC1(COC(OC1)(C)C2=CC=CC=C2)C	{1: 3, 11: 2, 13: 2, 14: 5, 23: 2}
Did not match all atoms present	5406-76-8	CC[N+]12CN3CN(C1)CN(C3)C2.[I-]	{19: 1, 1: 1, 2: 1, 11: 6, 33: 3}
Did not match all atoms present	54060-30-9	C#CC1=CC(=CC=C1)N	{9: 1, 10: 1, 30: 1, 14: 4}
Did not match all atoms present	54060-31-0	C1=CC(=CC(=C1)OC2=CC(=CC=C2)OC3=CC=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 22: 2, 14: 12}
Did not match all atoms present	54060-67-2	CC(C)(C1=CC(=C(C(=C1)Br)OC(=O)OC2=C(C=C(C=C2Br)Br)Br)Br)C3=CC(=C(C(=C3)Br)OC(=O)OC4=C(C=C(C=C4Br)Br)Br)Br	{1: 2, 18: 10, 4: 1, 14: 8}
Did not match all atoms present	54060-92-3	CC1(C2=CC=CC=C2[N+](=C1C=NN(C)C3=CC=C(C=C3)OC)C)C.COS(=O)(=O)[O-]	{1: 6, 34: 1, 6: 1, 33: 2, 13: 1, 14: 8, 15: 1, 22: 2, 29: 3}
Did not match all atoms present	54060-93-4	CC1(C2=C(C=CC(=C2)OC)N(C1=CC=C3C4=CC=CC=C4[N+](=C3C5=CC=CC=C5)C)C)C.[Cl-]	{1: 5, 6: 2, 33: 2, 13: 1, 14: 12, 15: 3, 17: 1, 22: 1}
Did not match all atoms present	54061-05-1	CC1=C(C=C(C=C1)NC(C)CCC(C)C)NC(C)CCC(C)C	{1: 7, 2: 4, 3: 4, 14: 3, 31: 2}
Did not match all atoms present	54063-28-4	CC(C)CCOC(=O)C(C1=CC=CC=C1)NCCN2CCCC2	{1: 2, 2: 4, 3: 2, 33: 1, 11: 4, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	54063-38-6	C1CCC(CC1)OC(=O)N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F	{33: 2, 2: 3, 11: 9, 12: 1, 14: 4, 16: 1, 24: 1, 28: 1}
Did not match all atoms present	54063-56-8	CCCCCCCCNC(C)C(C1=CC=C(C=C1)SC(C)C)O	{1: 4, 2: 7, 3: 3, 40: 1, 14: 4, 20: 1, 31: 1}
Did not match all atoms present	54066-04-5	C=CC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O.C(CO)O	{2: 2, 5: 1, 6: 1, 14: 4, 20: 2, 27: 3}
Did not match all atoms present	5407-87-4	CC1=CC(=NC(=C1)N)C	{1: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	5407-91-0	C1=CC=C(C=C1)CCCC(=O)C2=CC=CC=C2	{24: 1, 2: 3, 14: 10}
Did not match all atoms present	5407-98-7	C1CC(C1)C(=O)C2=CC=CC=C2	{24: 1, 11: 3, 12: 1, 14: 5}
Did not match all atoms present	54076-93-6	CC(C)(CN(C)C)C(=O)C1=CC=C(C=C1)SC	{1: 5, 2: 1, 4: 1, 33: 1, 40: 1, 14: 4, 24: 1}
Did not match all atoms present	5408-07-1	CCOC(=O)C1=C(C(=C(N1)C)Br)C	{32: 1, 1: 3, 2: 1, 28: 1, 18: 1}
Did not match all atoms present	5408-74-2	CCC1=CN=C(C=C1)C=C	{1: 1, 2: 1, 35: 1, 5: 1, 6: 1, 14: 3}
Did not match all atoms present	54083-22-6	CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(/C(=N/NC(=O)C6=CC=CC=C6)/C)O)N)O	{1: 3, 34: 1, 7: 1, 11: 3, 12: 5, 13: 1, 14: 8, 20: 2, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	5409-31-4	CCOC1=C(C=C(C=C1)C(=O)O)OCC	{1: 2, 2: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	5409-54-1	CC(=O)NC1=C(C=CC(=C1)C2=CC=CC=C2)O	{24: 1, 1: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	5409-55-2	CC1=CC(=C2C(=C1)CC(CC2=O)(C)C)C	{1: 4, 11: 2, 13: 1, 14: 2, 25: 1}
Did not match all atoms present	5409-83-6	C1=CC2=C(C=C1Cl)C3=C(O2)C=CC(=C3)Cl	{17: 2, 14: 6, 23: 1}
Did not match all atoms present	54098-92-9	[B]OC	{1: 1, 22: 1}
Did not match all atoms present	54099-11-5	CC[N+](CC)(CC)CCOC(=O)CC12CC3CC(C1)CC(C3)C2.[I-]	{1: 3, 2: 6, 11: 6, 12: 3, 13: 1, 19: 1, 28: 1}
Did not match all atoms present	54099-23-9	CC[N+](CC)(CC)CCOC1C2CC3CC(C2)CC1C3.[I-]	{1: 3, 2: 5, 11: 5, 12: 5, 19: 1, 22: 1}
Did not match all atoms present	541-01-5	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 16, 22: 6}
Did not match all atoms present	541-02-6	C[Si]1(O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)C	{1: 10, 23: 5}
Did not match all atoms present	541-05-9	C[Si]1(O[Si](O[Si](O1)(C)C)(C)C)C	{1: 6, 23: 3}
Did not match all atoms present	541-09-3	CC(=O)O.CC(=O)O.O=[U]=O	{1: 2, 27: 2, 29: 2}
Did not match all atoms present	541-14-0	C[N+](C)(C)C[C@H](CC(=O)[O-])O	{24: 1, 1: 3, 2: 2, 3: 1, 20: 1}
Did not match all atoms present	541-15-1	C[N+](C)(C)C[C@@H](CC(=O)[O-])O	{24: 1, 1: 3, 2: 2, 3: 1, 20: 1}
Did not match all atoms present	541-19-5	C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C.[I-].[I-]	{1: 6, 2: 6, 19: 2, 28: 2}
Did not match all atoms present	541-20-8	C[N+](C)(C)CCCCC[N+](C)(C)C.[Br-].[Br-]	{1: 6, 2: 5, 18: 2}
Did not match all atoms present	541-22-0	C[N+](C)(C)CCCCCCCCCC[N+](C)(C)C.[Br-].[Br-]	{1: 6, 2: 10, 18: 2}
Did not match all atoms present	541-25-3	C(=C/[As](Cl)Cl)\Cl	{17: 3, 6: 2}
Did not match all atoms present	541-43-5	C(=O)[O-].C(=O)[O-].[Ba+2]	{26: 2}
Did not match all atoms present	541-53-7	C(=S)(N)NC(=S)N	{31: 1, 30: 2, 7: 2}
Did not match all atoms present	541-58-2	CC1=CSC(=N1)C	{1: 2, 35: 1, 14: 1, 41: 1}
Did not match all atoms present	541-64-0	C[N+](C)(C)CC1=CC=CO1.[I-]	{1: 3, 2: 1, 19: 1, 14: 3, 23: 1}
Did not match all atoms present	541-66-2	C[N+](C)(C)CC1COCO1.[I-]	{1: 3, 2: 1, 11: 2, 12: 1, 19: 1, 23: 2}
Did not match all atoms present	541-69-5	C1=CC(=CC(=C1)N)N.Cl.Cl	{17: 2, 30: 2, 14: 4}
Did not match all atoms present	541-70-8	C1=CC(=CC(=C1)N)N.OS(=O)(=O)O	{30: 2, 20: 2, 29: 2, 14: 4}
Did not match all atoms present	541-73-1	C1=CC(=CC(=C1)Cl)Cl	{17: 2, 14: 4}
Did not match all atoms present	5410-16-2	CCCCN1CCNC1=S	{32: 1, 1: 1, 2: 3, 33: 1, 11: 2, 15: 1}
Did not match all atoms present	5410-29-7	C1=CC=C(C(=C1)[N+](=O)[O-])[As](=O)(O)O	{38: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	5410-78-6	C1=CC(=CC=C1[NH3+])[As](Cl)Cl.[Cl-]	{17: 3, 14: 4}
Did not match all atoms present	5410-93-5	C1=CC=C2C(=C(C=CC2=C1)O)N/N=C/3\C(=O)C=C(C4=CC=CC=C34)S(=O)(=O)[O-].C1=CC=C2C(=C(C=CC2=C1)O)N/N=C/3\C(=O)C=C(C4=CC=CC=C34)S(=O)(=O)[O-].[Zn+2]	{34: 2, 14: 22, 15: 4, 21: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	5410-97-9	C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)[N+](=O)[O-]	{38: 1, 14: 7, 23: 1}
Did not match all atoms present	54100-59-3	C1CC2=CC3=C4CCC5=C(CC3)C=C1C(=C5)CCC2=C4	{11: 8, 14: 4}
Did not match all atoms present	54100-60-6	C1=CC=C2C(=C3C=CC4=CC=CC5=C4C3=C2C=C5)C=C1	{14: 12}
Did not match all atoms present	54104-82-4	CC1=CC=C(C=C1)N2CCCC2	{1: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	5411-08-5	CC(COC1=CC=C(C=C1)[As](=O)(O)O)O	{1: 1, 2: 1, 3: 1, 14: 4, 20: 3, 22: 1, 29: 1}
Did not match all atoms present	5411-12-1	C1=CC=C(C=C1)C2C(O2)C(=O)C3=CC=CC=C3	{24: 1, 12: 2, 14: 10, 23: 1}
Did not match all atoms present	5411-22-3	CC(CC1=CC=CC=C1)N(C)CC2=CC=CC=C2.Cl	{1: 2, 2: 2, 3: 1, 33: 1, 14: 10, 17: 1}
Did not match all atoms present	5411-48-3	C(CCl)OS(=O)(=O)OCCCl	{17: 2, 2: 4, 29: 2, 22: 2}
Did not match all atoms present	5411-50-7	C1=CC(=C(C=C1[N+](=O)[O-])Br)Br	{18: 2, 38: 1, 14: 3}
Did not match all atoms present	5411-56-3	CC(C1=CC=CC=C1Br)O	{1: 1, 18: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	54110-21-3	C1=CC(=CC(=C1)S(=O)(=O)[O-])C=O.[K+]	{26: 1, 29: 3, 14: 4}
Did not match all atoms present	54112-23-1	C1CCC(=O)N(CC1)C(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)N4CCCCCC4=O	{33: 2, 2: 1, 11: 10, 14: 8, 24: 2, 25: 2, 31: 2}
Did not match all atoms present	54116-08-4	CCCCCCCCCCCCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 14, 29: 3, 22: 2}
Did not match all atoms present	54119-21-0	[NH4+].[NH4+].OP(=O)(O)OP(=O)([O-])[O-]	{20: 2, 29: 4, 22: 1}
Did not match all atoms present	54119-29-8	CCC1=CN=C(C=C1)CC	{1: 2, 2: 2, 35: 1, 14: 3}
Did not match all atoms present	54119-35-6	C1=CC=C(C=C1)CN(CCNCCO)CC2=CC=CC=C2	{33: 1, 2: 6, 20: 1, 14: 10, 31: 1}
Did not match all atoms present	54119-37-8	C1=CC=C(C=C1)CNCCNCCO	{2: 5, 20: 1, 14: 5, 31: 2}
Did not match all atoms present	5412-25-9	C(C(CBr)Br)OP(=O)(O)OCC(CBr)Br	{2: 4, 3: 2, 18: 4, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	5412-43-1	CCN(CC)C1=CC=C(C=C1)C2=CC=CC=C2	{1: 2, 2: 2, 14: 9, 33: 1}
Did not match all atoms present	5412-64-6	CCCCNC(C)C1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	54125-02-9	CO/C=C/C(=C)O[Si](C)(C)C	{1: 4, 22: 2, 5: 1, 6: 2, 7: 1}
Did not match all atoms present	54127-63-8	C1=C(C(=O)NC=C1C(=O)O)Cl	{32: 1, 17: 1, 27: 1, 14: 2, 25: 1}
Did not match all atoms present	5413-05-8	CCOC(=O)C(C1=CC=CC=C1)C(=O)C	{1: 2, 2: 1, 3: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	5413-85-4	C1=NC(=C(C(=N1)Cl)N)Cl	{17: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	54131-97-4	CSC1=C(C(=O)C1=O)SC	{40: 2, 1: 2, 25: 2}
Did not match all atoms present	54132-75-1	CC1=CC(=CC(=C1)N=C=O)C	{8: 1, 1: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	54135-54-5	CC[N+](C)(CC)CCO.COS(=O)(=O)[O-]	{1: 4, 2: 4, 20: 1, 29: 3, 22: 1}
Did not match all atoms present	54135-80-7	COC1=C(C(=C(C=C1)Cl)Cl)Cl	{1: 1, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	54135-82-9	COC1=CC(=C(C(=C1)Cl)Cl)Cl	{1: 1, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	54139-41-2	CCN(CC)C1=NC(=NC(=N1)SN(CC)CC)SN(CC)CC	{40: 2, 1: 6, 2: 6, 35: 3, 33: 3}
Did not match all atoms present	54140-17-9	CC(C)C(C)CC(C)COC=O	{1: 4, 2: 2, 3: 3, 26: 1}
Did not match all atoms present	54141-88-7	CC(C)(C)[SiH]1[SiH]([SiH]([SiH]1C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 4: 4}
Did not match all atoms present	54143-55-4	C1CCNC(C1)CNC(=O)C2=C(C=CC(=C2)OCC(F)(F)F)OCC(F)(F)F	{32: 1, 2: 3, 4: 2, 11: 4, 12: 1, 14: 3, 16: 6, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	5415-07-6	C1=CC=C(C=C1)C(C#N)C(=O)C2=CC=CC=C2	{24: 1, 3: 1, 37: 1, 14: 10}
Did not match all atoms present	5415-23-6	C1=CC(=O)C=CC1=NC2=CC(=C(C(=C2)Br)O)Br	{34: 1, 14: 6, 15: 1, 18: 2, 21: 1, 25: 1}
Did not match all atoms present	5415-44-1	CN1C2=C(NC1=O)N(C(=O)N(C2=O)C)C	{32: 1, 1: 3, 33: 3, 25: 3}
Did not match all atoms present	5415-80-5	C1=CC=C(C=C1)CC(CN)C2=CC=CC=C2	{2: 2, 3: 1, 30: 1, 14: 10}
Did not match all atoms present	54150-69-5	COC1=CC(=C(C=C1)N)OC.Cl	{1: 2, 30: 1, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	54151-74-5	C1=CC=C(C=C1)C2=CC(=NC=C2)Br	{18: 1, 35: 1, 14: 8}
Did not match all atoms present	54154-14-2	B1(N(N(B(N(N1C)C)SC)C)C)SC	{40: 2, 1: 6, 33: 4}
Did not match all atoms present	54154-15-3	B1(N(N(B(N(N1C)C)OC)C)C)OC	{1: 6, 22: 2, 33: 4}
Did not match all atoms present	54154-16-4	B1(N(N(B(N(N1C)C)N(C)C)C)C)N(C)C	{1: 8, 33: 6}
Did not match all atoms present	54156-67-1	CC[C@H]([C@@H]1[C@H](C[C@@](O1)(CC)[C@H]2CC[C@@](O2)(CC)[C@@H](C)O)C)C(=O)[C@@H](C)[C@H]([C@H](C)CCC3=C(C(=C(C=C3)C)O)C(=O)O)O	{1: 8, 2: 5, 3: 5, 11: 3, 12: 3, 13: 2, 14: 2, 20: 2, 21: 1, 23: 2, 24: 1, 27: 1}
Did not match all atoms present	5416-30-8	CSC(=NC1=CC=CC=C1)NC2=CC=CC=C2	{1: 1, 34: 1, 7: 1, 40: 1, 14: 10, 31: 1}
Did not match all atoms present	5416-74-0	CCCCCCCCCCCCS[Hg]C1=CC=CC=C1	{40: 1, 1: 1, 2: 11, 14: 5}
Did not match all atoms present	5416-80-8	CC1=C(C2=CC=CC=C2N1)C=O	{32: 1, 1: 1, 26: 1, 14: 4}
Did not match all atoms present	5416-93-3	COC1=CC=C(C=C1)N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	5417-63-0	C1=CC=C2C=C(C(=CC2=C1)N)O	{30: 1, 21: 1, 14: 6}
Did not match all atoms present	5417-84-5	CCSC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 1, 35: 3, 40: 1, 14: 2}
Did not match all atoms present	5417-86-7	CCCOC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 2, 35: 3, 14: 2, 22: 1}
Did not match all atoms present	54175-61-0	C1=CC2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)CC3=CC=CC4=C3C=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+]	{2: 1, 29: 6, 14: 12}
Did not match all atoms present	54178-94-8	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=CC(=C4)N)O)C(C)(C)CC	{1: 6, 2: 6, 4: 2, 14: 12, 21: 1, 22: 1, 24: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	54179-01-0	C1=CC2=C(C=CC(=C2C(=C1)O)O)S(=O)(=O)[O-].[Na+]	{21: 2, 14: 5, 29: 3}
Did not match all atoms present	54179-10-1	COC1=CC(=C(C=C1N)OC)S(=O)(=O)N	{1: 2, 30: 2, 22: 2, 14: 2, 29: 2}
Did not match all atoms present	54179-19-0	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=C(C=C4)N)O)C(C)(C)CC	{1: 6, 2: 6, 4: 2, 14: 12, 21: 1, 22: 1, 24: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	54179-45-2	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2C=CC=C3O	{1: 1, 31: 1, 21: 1, 14: 10, 29: 2}
Did not match all atoms present	54179-49-6	CS(=O)(=O)NC1=CC=CC2=C1C=CC=C2O	{1: 1, 31: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	5418-10-0	CSC1=NC=NC2=C1C=NN2	{32: 1, 1: 1, 35: 3, 14: 2, 40: 1}
Did not match all atoms present	5418-32-6	C1=CC(=O)C=CC1=NC2=CC=C(C=C2)[O-].[Na+]	{25: 1, 34: 1, 14: 8, 15: 1}
Did not match all atoms present	5418-51-9	C1=CC(=O)NC=C1[N+](=O)[O-]	{32: 1, 25: 1, 38: 1, 14: 3}
Did not match all atoms present	5418-63-3	CC1=[N+](C2=CC=CC=C2C1(C)C)C.[I-]	{1: 4, 33: 1, 13: 1, 14: 4, 15: 1, 19: 1}
Did not match all atoms present	5418-93-9	C1=CC2=C(C=C1Cl)NC(=N2)N	{32: 1, 17: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	5418-95-1	C1=CC=C2C(=C1)NC(=N2)N=C(N)N	{32: 1, 34: 1, 35: 1, 7: 1, 14: 4, 30: 2}
Did not match all atoms present	54180-05-1	CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N/N=C\2/C=CC(=O)C3=C2C(=CC=C3)NS(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)F	{1: 1, 34: 1, 38: 1, 14: 12, 15: 1, 16: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	54181-64-5	CCCCCCCCCC1=CC=CC=C1[O-].[Na+]	{1: 1, 2: 8, 14: 4}
Did not match all atoms present	5419-55-6	B(OC(C)C)(OC(C)C)OC(C)C	{1: 6, 3: 3, 22: 3}
Did not match all atoms present	5419-77-2	C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)O.[Na+]	{21: 1, 14: 6, 29: 3}
Did not match all atoms present	5419-81-8	CC1=CC(=C(C=C1)O)CC2=CC=CC=C2Cl	{1: 1, 2: 1, 21: 1, 14: 7, 17: 1}
Did not match all atoms present	5419-82-9	CC(=O)NC1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 6, 31: 1}
Did not match all atoms present	54191-78-5	C1=CC(=C=S)C=C1	{8: 1, 14: 4, 15: 1}
Did not match all atoms present	54196-15-5	B1(N(N(B(N(N1C)C)Cl)C)C)Cl	{1: 4, 33: 4, 17: 2}
Did not match all atoms present	542-11-0	C1=CC=C(C=C1)N.Br	{18: 1, 30: 1, 14: 5}
Did not match all atoms present	542-15-4	C1=CC=C(C=C1)N.[N+](=O)(O)[O-]	{20: 1, 30: 1, 14: 5}
Did not match all atoms present	542-42-7	CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 28}
Did not match all atoms present	542-52-9	CCCCOC(=O)OCCCC	{1: 2, 2: 6}
Did not match all atoms present	542-55-2	CC(C)COC=O	{1: 2, 2: 1, 3: 1, 26: 1}
Did not match all atoms present	542-62-1	[C-]#N.[C-]#N.[Ba+2]	{}
Did not match all atoms present	542-83-6	[C-]#N.[C-]#N.[Cd+2]	{}
Did not match all atoms present	542-85-8	CCN=C=S	{8: 1, 1: 1, 2: 1, 34: 1}
Did not match all atoms present	5420-98-4	CC1CCOC(O1)C=CC2=CC=CC=C2	{1: 1, 6: 2, 11: 2, 12: 2, 14: 5, 23: 2}
Did not match all atoms present	54200-67-8	CC1=C(C(=C(C=C1)C)C(=O)C)C	{24: 1, 1: 4, 14: 2}
Did not match all atoms present	54203-05-3	C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)OC2=NC(=NC(=N2)OC3=C(C(=C(C(=C3Br)Br)Br)Br)Br)OC4=C(C(=C(C(=C4Br)Br)Br)Br)Br	{18: 15, 35: 3, 22: 3}
Did not match all atoms present	54208-63-8	C1C(O1)COC2=CC=CC=C2CC3=CC=CC=C3OCC4CO4	{2: 3, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2}
Did not match all atoms present	5421-00-1	C1CC(OC1)COC(=O)CC2=CC=CC=C2	{2: 2, 11: 3, 12: 1, 14: 5, 23: 1, 28: 1}
Did not match all atoms present	5421-04-5	CC(C)CCOC(=O)C(C1=CC=CC=C1)O	{1: 2, 2: 2, 3: 2, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	5421-17-0	CCCCCCOC(=O)CC1=CC=CC=C1	{1: 1, 2: 6, 28: 1, 14: 5}
Did not match all atoms present	5421-40-9	CCCC(=O)NC1=CC=C(C=C1)OC	{1: 2, 2: 2, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5421-46-5	C(C(=O)[O-])S.[NH4+]	{24: 1, 2: 1, 39: 1}
Did not match all atoms present	5421-92-1	C1=CC=[N+](C=C1)C2=CC=NC=C2.Cl.[Cl-]	{17: 2, 35: 1, 14: 9, 33: 1}
Did not match all atoms present	54210-32-1	CN1C=CC(=N1)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 2, 33: 1}
Did not match all atoms present	54210-33-2	CN1C(=CC=N1)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 2, 33: 1}
Did not match all atoms present	54211-46-0	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N	{1: 1, 2: 4, 37: 1, 14: 12}
Did not match all atoms present	5422-44-6	CN1C(=NN=N1)N	{1: 1, 35: 3, 30: 1, 33: 1}
Did not match all atoms present	5422-45-7	CN(C)C1=NNN=N1	{32: 1, 1: 2, 35: 3, 33: 1}
Did not match all atoms present	5422-72-0	CC(=O)NC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 2, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	5422-88-8	C1CCC(C1)C(=O)C2=CC=CC=C2	{24: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	5422-89-9	CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)CO	{32: 1, 1: 3, 2: 3, 20: 1, 28: 2}
Did not match all atoms present	5422-91-3	C1=CC=C(C=C1)C2=CC(=C(C=C2O)C3=CC=CC=C3)O	{21: 2, 14: 12}
Did not match all atoms present	5423-07-4	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 38: 2, 14: 7, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	5423-12-1	CC(COC1=C(C=C(C=C1)[As](=O)(O)O)N)O	{1: 1, 2: 1, 3: 1, 14: 3, 20: 3, 22: 1, 29: 1, 30: 1}
Did not match all atoms present	5423-38-1	CCCCOC(=O)C1=CC=CC=C1C(=O)[O-].CCCCOC(=O)C1=CC=CC=C1C(=O)[O-].[Cu+2]	{24: 2, 1: 2, 2: 6, 28: 2, 14: 8}
Did not match all atoms present	54230-59-0	CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=NC=N2)C	{1: 3, 35: 2, 29: 2, 14: 4, 33: 1}
Did not match all atoms present	54230-60-3	CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N2C=NC=N2)C(C)C	{1: 6, 3: 3, 33: 1, 14: 4, 35: 2, 29: 2}
Did not match all atoms present	54237-83-1	CC1=C(C(=CC=C1)C)NCC2OCCO2	{1: 2, 2: 1, 11: 2, 12: 1, 14: 3, 23: 2, 31: 1}
Did not match all atoms present	5424-01-1	C1=CN=C(C(=N1)C(=O)O)N	{35: 2, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	5424-19-1	C1=CC=C(C=C1)C(=O)C2=CN=CC=C2	{24: 1, 35: 1, 14: 9}
Did not match all atoms present	5424-21-5	CC1=CC(=NC(=N1)Cl)Cl	{1: 1, 35: 2, 14: 1, 17: 2}
Did not match all atoms present	5424-25-9	CC[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 14: 15}
Did not match all atoms present	5424-26-0	CC(C)CC[N+](CCC(C)C)(CCC(C)C)CCC(C)C.[I-]	{19: 1, 1: 8, 2: 8, 3: 4}
Did not match all atoms present	54240-36-7	CC(C)(C)NCC(C1=CC(=C(C(=C1)Cl)N)C(F)(F)F)O.Cl	{1: 3, 2: 1, 3: 1, 4: 2, 14: 2, 16: 3, 17: 2, 20: 1, 30: 1, 31: 1}
Did not match all atoms present	54241-45-1	CC1=CC(=C(C(=C1)Cl)N2C(=O)CC(=N2)N)C	{1: 2, 35: 1, 33: 1, 11: 1, 14: 2, 15: 1, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	54244-10-9	CCCCCCCNC(=S)NCCCCCCC	{1: 2, 2: 12, 31: 2, 7: 1}
Did not match all atoms present	54245-33-9	C1=CC=C2C=C(C(=CC2=C1)N)Br	{18: 1, 30: 1, 14: 6}
Did not match all atoms present	54253-62-2	CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Cu+2]	{1: 2, 29: 6}
Did not match all atoms present	54256-43-8	CCCCCCCCCCC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 2: 9, 14: 4, 17: 1}
Did not match all atoms present	54256-51-8	CCCCCCCCC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 7, 28: 1, 14: 4}
Did not match all atoms present	5426-55-1	CCN(CC)CC(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 3, 33: 1}
Did not match all atoms present	5426-65-3	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)Br	{1: 2, 18: 1, 33: 2, 14: 5, 25: 1}
Did not match all atoms present	54262-83-8	C1=NC2=C(C(=N1)N)N=CN2C[C@@H](CO)O	{33: 1, 2: 2, 3: 1, 14: 2, 35: 3, 20: 2, 30: 1}
Did not match all atoms present	54268-71-2	CC1(C(N(C2=CC=CC=C21)C)C=CC3=CC=C(C=C3)N(C)C)C	{1: 5, 6: 2, 33: 2, 12: 1, 13: 1, 14: 8}
Did not match all atoms present	54268-90-5	CC1(C(N(C2=CC=CC=C21)C)C=CC=C(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C)C	{1: 7, 33: 3, 6: 3, 7: 1, 12: 1, 13: 1, 14: 12}
Did not match all atoms present	5427-03-2	CC(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 8, 3: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	5427-20-3	CCN1C=NC2=C1NC=NC2=S	{32: 1, 1: 1, 2: 1, 35: 2, 33: 1, 14: 2}
Did not match all atoms present	5427-21-4	CCN1C=NC2=C1N=CN=C2NN	{1: 1, 2: 1, 35: 3, 33: 1, 14: 2, 30: 1, 31: 1}
Did not match all atoms present	5427-30-5	C1=CC(=CC(=C1)P(=O)(O)O)N	{30: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	54272-30-9	CN(C)C.OS(=O)(=O)O	{1: 3, 20: 2, 29: 2, 33: 1}
Did not match all atoms present	54274-15-6	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)N/N=C\6/C=CC7=C(C=CC(=C7C6=O)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 4, 14: 19, 15: 3, 20: 3, 24: 1, 25: 2, 29: 6, 30: 2, 31: 3}
Did not match all atoms present	5428-37-5	C1=COC(=C1)C=NN=CC2=CC=CO2	{34: 2, 14: 6, 6: 2, 23: 2}
Did not match all atoms present	5428-54-6	CC1=C(C=C(C=C1)[N+](=O)[O-])O	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	5428-89-7	C1=C(C=NC(=N1)N)Cl	{17: 1, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	5428-90-0	C1=CC(=CN=C1)[Hg]Cl	{17: 1, 35: 1, 14: 4}
Did not match all atoms present	5428-95-5	C1=CC=C(C=C1)NC(=O)CSC(=O)N	{2: 1, 40: 1, 14: 5, 24: 2, 30: 1, 31: 1}
Did not match all atoms present	54288-04-9	CC1=CC(=C(C(=C1)C)C(=CO)C2=C(C=C(C=C2C)C)C)C	{1: 6, 20: 1, 14: 4, 6: 1, 7: 1}
Did not match all atoms present	54288-95-8	C1=CC=C2C(=C1)C=C(C(=C2Br)N)Br	{18: 2, 30: 1, 14: 5}
Did not match all atoms present	54288-96-9	CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C3=CC=CC=C3C=C2Br)Br	{1: 1, 18: 2, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	5429-28-7	CCN(CC)C1=CC=C(C=C1)C(=O)O	{1: 2, 2: 2, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	5429-37-8	CCCCCCC1=NC2=C(N1)C(=O)N(C(=O)N2C)C	{32: 1, 1: 3, 2: 5, 35: 1, 33: 2, 25: 2}
Did not match all atoms present	5429-85-6	CCCCCCCCC=CCCCCCCCC(=O)NC1=CC=CC=C1	{1: 1, 2: 14, 6: 2, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	54290-50-5	C1=CC(=CC=C1C2=CC(=S)SS2)F	{16: 1, 41: 2, 14: 5}
Did not match all atoms present	54291-12-2	C1=CC=C(C=C1)NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)O	{34: 3, 14: 11, 15: 2, 20: 2, 25: 1, 29: 4, 30: 2, 31: 1}
Did not match all atoms present	54292-17-0	CCN(CC)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2I)[N+](=O)[O-])[N+](=O)[O-])OC	{1: 4, 2: 2, 38: 2, 33: 1, 34: 2, 14: 4, 19: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	54292-18-1	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2I)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C	{1: 3, 2: 2, 38: 2, 33: 1, 34: 2, 14: 5, 19: 1, 24: 1, 31: 1}
Did not match all atoms present	543-29-3	CC(C)CO[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 22: 1}
Did not match all atoms present	543-63-5	CCCC[Hg]Cl	{1: 1, 2: 3, 17: 1}
Did not match all atoms present	543-80-6	CC(=O)[O-].CC(=O)[O-].[Ba+2]	{24: 2, 1: 2}
Did not match all atoms present	543-81-7	[Be+2].CC(=O)[O-].CC(=O)[O-]	{24: 2, 1: 2}
Did not match all atoms present	543-87-3	CC(C)CCO[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 22: 1}
Did not match all atoms present	543-90-8	CC(=O)[O-].CC(=O)[O-].[Cd+2]	{24: 2, 1: 2}
Did not match all atoms present	543-94-2	CC(=O)[O-].CC(=O)[O-].[Sr+2]	{24: 2, 1: 2}
Did not match all atoms present	54300-08-2	CC1=CN=C(C(=N1)C)C(=O)C	{24: 1, 1: 3, 35: 2, 14: 1}
Did not match all atoms present	54300-09-3	CC1=CN=C(C(=N1)C(=O)C)C	{24: 1, 1: 3, 35: 2, 14: 1}
Did not match all atoms present	54301-15-4	COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42.Cl	{1: 2, 35: 1, 14: 11, 17: 1, 22: 1, 29: 2, 31: 2}
Did not match all atoms present	54301-19-8	CN1CC[C@]23[C@@H]4[C@@H](CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O)N=[N+]=[N-]	{1: 1, 34: 2, 33: 1, 11: 5, 12: 3, 13: 2, 14: 2, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	54306-27-3	C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)[O-].[Na+]	{38: 1, 20: 1, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	54307-02-7	CNS(=O)(=O)C1=CC=CC=C1.C=O.C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N	{1: 1, 35: 3, 5: 1, 14: 10, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	5431-31-2	CCCCCCOC(=O)C(C1=CC=CC=C1)O	{1: 1, 2: 5, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	5431-44-7	C1=CC(=NC(=C1)C=O)C=O	{26: 2, 35: 1, 14: 3}
Did not match all atoms present	54314-84-0	C1=CC=C(C=C1)COCCCBr	{2: 4, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	5432-07-5	COC1=CC=C(C=C1)C=C(C#N)C2=CC=CC=C2	{1: 1, 37: 1, 6: 1, 7: 1, 14: 9, 22: 1}
Did not match all atoms present	5432-66-6	CC(C)COC(=O)COC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	5432-74-6	CC1=C([N+](=O)C2=CC=CC=C2N1[O-])C	{1: 2, 29: 2, 14: 4, 33: 2}
Did not match all atoms present	54322-31-5	C1=CC(=CC=C1CCBr)S(=O)(=O)O	{2: 2, 20: 1, 18: 1, 14: 4, 29: 2}
Did not match all atoms present	54322-81-5	C1CC(=CCCC2=CC=CC=C2)C(=O)C1	{2: 2, 6: 1, 11: 3, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	54324-99-1	CC1=CCC2C(C1C2(C)C)O.CC(=O)[O-]	{1: 4, 11: 1, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	54326-11-3	CCCCCCCCCCCCCCCCCC(=O)O[Al]OC(=O)C1=CC=CC=C1.O	{1: 1, 2: 16, 28: 2, 14: 5}
Did not match all atoms present	54326-16-8	C1=C(C=NC(=O)N1)Cl	{32: 1, 17: 1, 35: 1, 14: 2, 25: 1}
Did not match all atoms present	54328-07-3	[O-2].[O-2].[O-2].[O-2].[K+].[Re]	{}
Did not match all atoms present	5433-01-2	CC(C)C1=CC(=CC=C1)Br	{1: 2, 18: 1, 3: 1, 14: 4}
Did not match all atoms present	5433-10-3	COC1=CC=C(C=C1)C=NCCCO	{1: 1, 2: 3, 6: 1, 34: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	5433-11-4	C1=CC=C(C=C1)C=NCCCO	{2: 3, 34: 1, 20: 1, 14: 5, 6: 1}
Did not match all atoms present	5433-44-3	C1=CC(=CC=C1NN=NC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)N	{30: 2, 34: 2, 29: 4, 14: 8, 31: 1}
Did not match all atoms present	54334-63-3	CC(=O)O.CC(=O)O.C1=CC=C(C=C1)C(C2=CC=CC=C2)(O)O	{1: 2, 27: 2, 4: 1, 14: 10, 20: 2}
Did not match all atoms present	54335-11-4	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O.C(COCCOCCO)O	{2: 14, 14: 6, 20: 4, 22: 3, 27: 4, 28: 2}
Did not match all atoms present	54338-54-4	C[Pb](C)(C)CC1=CC=CC=C1	{1: 3, 2: 1, 14: 5}
Did not match all atoms present	5434-20-8	C1=CC(=C(C(=C1)N)C(=O)O)C(=O)O	{27: 2, 30: 1, 14: 3}
Did not match all atoms present	5434-21-9	C1=CC(=C(C=C1N)C(=O)O)C(=O)O	{27: 2, 30: 1, 14: 3}
Did not match all atoms present	5434-24-2	CCCCNC1=NC2=C(C(=N1)NC)NC=N2	{32: 1, 1: 2, 2: 3, 35: 3, 14: 1, 31: 2}
Did not match all atoms present	5434-30-0	CC1=C(C=C(C=C1)N)NC(=O)C	{24: 1, 1: 2, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	5434-60-6	C[N+]1=CC=CC(=C1)C(=O)NO.[I-]	{1: 1, 33: 1, 14: 4, 19: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	5434-68-4	CCCC(=O)O.[Ni]	{1: 1, 2: 2, 27: 1}
Did not match all atoms present	5434-69-5	CCCCC(=O)O.[Ni]	{1: 1, 2: 3, 27: 1}
Did not match all atoms present	54340-62-4	CCC1=CC=CC2=C1OC(=C2)C(CNC(C)(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 14: 4, 20: 1, 23: 1, 31: 1}
Did not match all atoms present	54340-87-3	CC1CCC2=C(C=CC(=C12)C)C	{1: 3, 11: 2, 12: 1, 14: 2}
Did not match all atoms present	54345-83-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)N(NS(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{25: 2, 33: 1, 29: 6, 14: 7, 31: 1}
Did not match all atoms present	5435-60-9	CC(=O)OC1=C(C(=C(C=C1Cl)Cl)Cl)Cl	{1: 1, 28: 1, 14: 1, 17: 4}
Did not match all atoms present	5435-78-9	C1=CC=C(C=C1)P(=O)(C2=CC=C(C=C2)[N+](=O)[O-])O	{38: 1, 20: 1, 29: 1, 14: 9}
Did not match all atoms present	54350-31-1	CC1=C(C(=CC=C1)C)OC(C)C	{1: 4, 3: 1, 22: 1, 14: 3}
Did not match all atoms present	54350-32-2	CC1=C(C(=CC=C1)C)OC(C)(C)C	{1: 5, 4: 1, 22: 1, 14: 3}
Did not match all atoms present	54350-48-0	CCOC(=O)/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C(=C(C=C1C)OC)C)C	{1: 7, 2: 1, 6: 6, 7: 2, 14: 1, 22: 1, 28: 1}
Did not match all atoms present	54353-24-1	C1C(N(C2=C(N1)NC(=NC2=O)N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O	{32: 2, 33: 1, 2: 3, 3: 1, 11: 1, 12: 1, 14: 4, 35: 1, 24: 1, 25: 1, 26: 1, 27: 2, 30: 1, 31: 2}
Did not match all atoms present	5437-11-6	C1=CC=C(C=C1)N=C(N)N=C(N)N.C1=CC=C2C(=C1)NC(=S)S2	{32: 1, 34: 2, 7: 2, 41: 1, 14: 9, 30: 3}
Did not match all atoms present	5437-12-7	C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N=NC5=C(C=CC6=CC=CC=C65)N)S(=O)(=O)O)S(=O)(=O)O)N	{34: 4, 6: 2, 14: 18, 20: 2, 29: 4, 30: 2}
Did not match all atoms present	5437-25-2	C1=NC2=C(N1)C(=S)NC(=S)N2	{32: 3, 35: 1, 14: 1}
Did not match all atoms present	5437-33-2	C1=C(C(=O)NC=C1Cl)Cl	{32: 1, 17: 2, 14: 2, 25: 1}
Did not match all atoms present	5437-38-7	CC1=CC=CC(=C1[N+](=O)[O-])C(=O)O	{1: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	5437-45-6	C1=CC=C(C=C1)COC(=O)CBr	{2: 2, 28: 1, 18: 1, 14: 5}
Did not match all atoms present	5437-46-7	C1CC(CCC1C2=CC=CC=C2)O	{20: 1, 11: 4, 12: 2, 14: 5}
Did not match all atoms present	5437-50-3	CCCCNC1=NC(=NC2=C1NC=N2)N	{32: 1, 1: 1, 2: 3, 35: 3, 14: 1, 30: 1, 31: 1}
Did not match all atoms present	5437-88-7	COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=C(C=C(C=C4)C5=CC(=C(C=C5)N/N=C\6/C7=CC=CC=C7C=C(C6=O)C(=O)NC8=CC=CC=C8OC)OC)OC)/C2=O	{1: 4, 34: 2, 14: 24, 15: 4, 22: 4, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	5437-98-9	CC(=O)CC(=O)NC1=CC=C(C=C1)OC	{1: 2, 2: 1, 14: 4, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	54373-15-8	C1=CC(=CC=C1C=O)OCCCl	{17: 1, 2: 2, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	5438-19-7	CCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	5438-36-8	COC1=C(C(=CC(=C1)C=O)I)O	{1: 1, 14: 2, 19: 1, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	5438-85-7	C1=CC=C2C(=C1)C(=N)C=C(C2=O)[NH3+].[Cl-]	{17: 1, 25: 1, 36: 1, 14: 5, 15: 2}
Did not match all atoms present	54381-08-7	C1=CC=C(C(=C1)NC2=CC=C(C=C2)O)[N+](=O)[O-]	{38: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	54381-16-7	C1=CC(=CC=C1N)N(CCO)CCO.OS(=O)(=O)O	{33: 1, 2: 4, 14: 4, 20: 4, 29: 2, 30: 1}
Did not match all atoms present	54385-47-6	C1=CC=C(C=C1)[C@H](C(=O)[O-])O.[Na+]	{24: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	54385-63-6	CCC1=CC2=C(C=C1)C=CS2	{1: 1, 2: 1, 14: 5, 41: 1}
Did not match all atoms present	54388-56-6	C1=CC2=C3NC(=C2C=C1)NC4=C5C=CC=CC5=C([N-]4)NC6=C7C=CC=CC7=C(N6)NC8=C9C=CC=CC9=C(N3)[N-]8.[Ag]	{32: 6, 35: 2, 14: 16}
Did not match all atoms present	54388-96-4	CC1=CC=CC=C1N([N+](=O)C2=CC=CC=C2C)[O-]	{1: 2, 29: 2, 14: 8, 33: 2}
Did not match all atoms present	5439-01-0	CC1=CC(=NC(=C1)C)C=O	{1: 2, 26: 1, 35: 1, 14: 2}
Did not match all atoms present	54393-42-9	C1([Se]C([Se]1)(F)F)(F)F	{16: 4, 13: 2}
Did not match all atoms present	54395-51-6	CC(C)(C1=CC=C(C=C1)OC2=CC=CC3=C2C(=O)N(C3=O)C)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)N(C6=O)C	{1: 4, 4: 1, 33: 2, 14: 14, 22: 2, 25: 4}
Did not match all atoms present	54395-52-7	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)N(C6=O)C	{1: 4, 4: 1, 33: 2, 14: 14, 22: 2, 25: 4}
Did not match all atoms present	54396-69-9	CC(C)(C)C(=S)C(C)(C)C	{1: 6, 4: 2, 7: 1}
Did not match all atoms present	54397-20-5	C1=CC(=CC(=C1)[N+](=O)[O-])COCCl	{17: 1, 2: 2, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	544-15-0	CCCCC[Hg]Cl	{1: 1, 2: 4, 17: 1}
Did not match all atoms present	544-17-2	C(=O)[O-].C(=O)[O-].[Ca+2]	{26: 2}
Did not match all atoms present	544-18-3	C(=O)[O-].C(=O)[O-].[Co+2]	{26: 2}
Did not match all atoms present	544-19-4	C(=O)[O-].C(=O)[O-].[Cu+2]	{26: 2}
Did not match all atoms present	544-47-8	C1=CC(=CC=C1CSC(=N)N)Cl.Cl	{2: 1, 36: 1, 7: 1, 40: 1, 14: 4, 17: 2, 30: 1}
Did not match all atoms present	544-60-5	CCCCCCCCC=CCCCCCCCC(=O)O.N	{1: 1, 2: 14, 27: 1, 6: 2}
Did not match all atoms present	544-92-3	[C]#N.[Cu]	{}
Did not match all atoms present	544-97-8	[CH3-].[CH3-].[Zn+2]	{}
Did not match all atoms present	5440-00-6	CN1C(=C(C(=O)N(C1=O)C)N)N	{1: 2, 33: 2, 30: 2, 25: 2}
Did not match all atoms present	5440-19-7	B(OC1CCCCC1C2CCCCC2)(OC3CCCCC3C4CCCCC4)OC5CCCCC5C6CCCCC6	{11: 27, 12: 9, 22: 3}
Did not match all atoms present	54401-85-3	CCOC(=O)CC1=CC=NC=C1	{1: 1, 2: 2, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	54409-77-7	CC(C)(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)C(C)(C)C)C3=CC=C(C=C3)C(C)(C)C	{1: 9, 4: 3, 14: 12}
Did not match all atoms present	5441-02-1	CC(=O)NC1=NC(=CC=C1)NC(=O)C	{24: 2, 1: 2, 35: 1, 14: 3, 31: 2}
Did not match all atoms present	5441-14-5	C1=CC=C(C=C1)NC(=O)NN.Cl	{24: 1, 17: 1, 30: 1, 14: 5, 31: 2}
Did not match all atoms present	5441-16-7	C=CCOC1=C(C=C(C=C1)Cl)Cl	{2: 1, 5: 1, 6: 1, 14: 3, 17: 2, 22: 1}
Did not match all atoms present	5441-77-0	C1=CC=C(C=C1)CSC2=NC(=NC3=C2NC=N3)SCC4=CC=CC=C4	{32: 1, 40: 2, 2: 2, 35: 3, 14: 11}
Did not match all atoms present	5441-78-1	CC(=O)CSC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 1, 35: 3, 40: 1, 14: 2, 24: 1}
Did not match all atoms present	54410-26-3	CC(C)(CNC1=CC=CC=C1)S	{1: 2, 2: 1, 4: 1, 39: 1, 14: 5, 31: 1}
Did not match all atoms present	54410-28-5	CC(C)(CNC1=CC=C(C=C1)Cl)S	{1: 2, 2: 1, 4: 1, 39: 1, 14: 4, 17: 1, 31: 1}
Did not match all atoms present	54410-74-1	CCC(CC)C1=CC=CC=C1C	{1: 3, 2: 2, 3: 1, 14: 4}
Did not match all atoms present	54410-83-2	CC1=NC=C(N=C1C)CC(C)C	{1: 4, 2: 1, 3: 1, 14: 1, 35: 2}
Did not match all atoms present	54411-06-2	CCCCC1=CC=C(S1)CC	{1: 2, 2: 4, 14: 2, 41: 1}
Did not match all atoms present	54412-40-7	C/C(=C\C(=O)C(F)(F)F)/O[Tl]	{1: 1, 4: 1, 6: 1, 7: 1, 16: 3, 22: 1, 24: 1}
Did not match all atoms present	5442-35-3	CCOC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 7, 2: 1, 4: 2, 14: 2, 21: 1, 22: 1}
Did not match all atoms present	5442-40-0	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC(=CC=C3)Cl)O	{24: 1, 17: 1, 21: 1, 14: 10, 31: 1}
Did not match all atoms present	5442-83-1	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCCN(C)C	{1: 7, 2: 5, 4: 2, 33: 1, 14: 4, 22: 2}
Did not match all atoms present	5442-92-2	CCOC(=O)C1=C(NC(=C1C)CC2=C(C(=C(N2)C)C(=O)OCC)C)C	{32: 2, 1: 6, 2: 3, 28: 2}
Did not match all atoms present	54429-56-0	C(CBr)S(=O)(=O)Cl	{17: 1, 2: 2, 18: 1, 29: 2}
Did not match all atoms present	5443-16-3	C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)OC4=O	{28: 2, 12: 4, 14: 8}
Did not match all atoms present	5443-49-2	C1=CC=C(C=C1)/C=C(/C=O)\Br	{18: 1, 26: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	5443-89-0	CCCCCSC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 4, 35: 3, 40: 1, 14: 2}
Did not match all atoms present	5444-02-0	CC1=CC(=O)NC(=C1C#N)O	{32: 1, 1: 1, 37: 1, 14: 1, 21: 1, 25: 1}
Did not match all atoms present	5444-08-6	CC1=CC=C(C=C1)SC2=NC=NC3=C2NC=N3	{32: 1, 1: 1, 35: 3, 14: 6, 40: 1}
Did not match all atoms present	5444-75-7	CCCCC(CC)COC(=O)c1ccccc1	{1: 2, 2: 5, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	54443-68-4	C1C2C3C=CC3C1C4=CC=CC=C24	{11: 1, 12: 4, 14: 6}
Did not match all atoms present	54443-89-9	CCCCN1C(=O)CC(=O)N(C1=S)CCCC	{1: 2, 2: 6, 33: 2, 11: 1, 15: 1, 25: 2}
Did not match all atoms present	54443-90-2	CCCCCC[N+]1=C(OC2=CC=CC=C21)C.[I-]	{1: 2, 2: 5, 33: 1, 14: 4, 19: 1, 23: 1}
Did not match all atoms present	54443-97-9	CC1=[N+](C2=CC=CC=C2O1)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 14: 4, 23: 1, 29: 3}
Did not match all atoms present	54449-74-0	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC(=O)C=C	{1: 2, 4: 1, 5: 1, 6: 1, 14: 9, 28: 1}
Did not match all atoms present	5445-26-1	CCOC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 2, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	5445-86-3	CC(=O)C1=CC=CC=C1OC(=O)C2=CC=C(C=C2)OC	{24: 1, 1: 2, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	54454-10-3	CC1=NN(C(=C1)Cl)C	{1: 2, 35: 1, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	54454-12-5	CC1=C(C=CC=C1Cl)C#N	{1: 1, 37: 1, 14: 3, 17: 1}
Did not match all atoms present	54459-88-0	C1=CN=CC(=C1[N+]#N)[O-]	{34: 1, 35: 1, 14: 3}
Did not match all atoms present	54459-89-1	C1=C2C(=NC=C1Cl)SN=N2	{17: 1, 35: 3, 14: 2, 41: 1}
Did not match all atoms present	54459-90-4	COC1=CN=C2C(=C1)N=NS2	{1: 1, 35: 3, 22: 1, 14: 2, 41: 1}
Did not match all atoms present	5446-02-6	COC1=CC(=C(C=C1)C(=O)OC)O	{1: 2, 22: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	5446-10-6	CCOC1=CC=C(C=C1)N=NS(=O)(=O)O.[Na+]	{1: 1, 2: 1, 34: 2, 14: 4, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	5446-38-8	COC1=CC=C(C=C1)OC2=NC=NC3=C2NC=N3	{32: 1, 1: 1, 35: 3, 22: 2, 14: 6}
Did not match all atoms present	5446-92-4	COC1=NC=C(C=C1)[N+](=O)[O-]	{38: 1, 1: 1, 35: 1, 22: 1, 14: 3}
Did not match all atoms present	54467-95-7	C1=CC=C(C(=C1)N=[N+]=[N-])I	{34: 2, 19: 1, 14: 4}
Did not match all atoms present	5447-28-9	C1=CC=C2C=C(C=CC2=C1)NC3=CC(=CC=C3)Cl	{17: 1, 14: 11, 31: 1}
Did not match all atoms present	5447-37-0	COC1=C(C=CC(=C1)/C=C/2\C(=O)NC(=S)S2)O	{32: 1, 1: 1, 6: 1, 41: 1, 14: 3, 15: 2, 21: 1, 22: 1, 25: 1}
Did not match all atoms present	5447-87-0	CC(=C(C#N)C#N)C1=CC=CC=C1	{1: 1, 37: 2, 14: 5, 7: 2}
Did not match all atoms present	54474-28-1	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[TaH2]	{14: 10}
Did not match all atoms present	5448-17-9	CC1=C(NC(=C1C(=O)OC)C)C(=O)OC	{32: 1, 1: 4, 28: 2}
Did not match all atoms present	5448-31-7	CC(C)(CNC1=CC=CC=C1)[N+](=O)[O-]	{1: 2, 2: 1, 4: 1, 38: 1, 14: 5, 31: 1}
Did not match all atoms present	5448-43-1	C1=CC2=NC=CN=C2C=C1Cl	{17: 1, 35: 2, 14: 5}
Did not match all atoms present	5448-47-5	C1=CC=C2C(=C1)C(=CN2)CC(=O)NN	{32: 1, 2: 1, 14: 5, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	5448-60-2	CCCCCOC(=O)C1=CC(=CC=C1)C	{1: 2, 2: 4, 28: 1, 14: 4}
Did not match all atoms present	54481-45-7	CC(=O)O[Hg]C1=C(C=CC(=C1)[N+](=O)[O-])N	{1: 1, 38: 1, 28: 1, 30: 1, 14: 3}
Did not match all atoms present	54484-63-8	CCC1=C(C=CC(=C1)Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	54484-91-2	CCN(CC)CCN1C2=C3C(=C(C=C2)CO)SC4=C(C3=[N+]1[O-])C=CC(=C4)Cl	{1: 2, 2: 5, 33: 3, 41: 1, 14: 5, 17: 1, 20: 1, 29: 1}
Did not match all atoms present	54489-01-9	C1=C[Se]C(=C2[Se]C=C[Se]2)[Se]1	{14: 4, 15: 2}
Did not match all atoms present	54494-06-3	C[Si](C)(C)OCCCCCO[Si](C)(C)C	{1: 6, 2: 5, 22: 2}
Did not match all atoms present	54494-07-4	C[Si](C)(C)OCCCCCCCO[Si](C)(C)C	{1: 6, 2: 7, 22: 2}
Did not match all atoms present	54499-06-8	C1=CN=C2N=CN=C3N2C1=NC=N3	{33: 1, 35: 5, 14: 4}
Did not match all atoms present	545-55-1	C1CN1P(=O)(N2CC2)N3CC3	{33: 3, 11: 6, 29: 1}
Did not match all atoms present	545-91-5	CCC(=O)C(CC(C)N1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3.Cl	{1: 2, 2: 2, 3: 1, 4: 1, 33: 1, 11: 4, 14: 10, 17: 1, 23: 1, 24: 1}
Did not match all atoms present	5450-64-6	CCCCCCC(C)(C#C[Hg]C#CC(C)(CCCCCC)O)O	{1: 4, 2: 10, 4: 2, 10: 4, 20: 2}
Did not match all atoms present	5450-96-4	C(CC(O)S(=O)(=O)[O-])C(O)S(=O)(=O)[O-].[Na+].[Na+]	{2: 2, 3: 2, 20: 2, 29: 6}
Did not match all atoms present	54504-70-0	CC(C)(C(=O)OCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)OC3=CC=C(C=C3)Cl	{1: 4, 2: 2, 35: 1, 4: 1, 33: 3, 14: 5, 17: 1, 22: 1, 25: 2, 28: 1}
Did not match all atoms present	5451-36-5	C1=C/C(=C\NNC(=S)N)/N=C1	{35: 1, 6: 1, 7: 1, 14: 3, 15: 1, 30: 1, 31: 2}
Did not match all atoms present	5451-40-1	C1=NC2=C(N1)C(=NC(=N2)Cl)Cl	{32: 1, 17: 2, 35: 3, 14: 1}
Did not match all atoms present	5451-41-2	CCCCNC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 3, 35: 3, 14: 2, 31: 1}
Did not match all atoms present	5451-52-5	CCCCCCCCCCOC=O	{1: 1, 2: 9, 26: 1}
Did not match all atoms present	5451-63-8	CCCCCCCCCCCCCCOC=O	{1: 1, 2: 13, 26: 1}
Did not match all atoms present	5451-75-2	CCCCCCCCCCCCCCCCCCOC=O	{1: 1, 2: 17, 26: 1}
Did not match all atoms present	5451-83-2	CC(=O)OC1=CC(=CC=C1)OC	{1: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	5451-92-3	CCCCCCCCCOC=O	{1: 1, 2: 8, 26: 1}
Did not match all atoms present	5451-95-6	CCCCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 8, 28: 1, 14: 5}
Did not match all atoms present	54514-12-4	CC1=CC=CC=C1[N+]#N.[Br-]	{1: 1, 18: 1, 34: 1, 14: 4}
Did not match all atoms present	54518-00-2	CC(C)CC(C)CC1=CC=CC=C1	{1: 3, 2: 2, 3: 2, 14: 5}
Did not match all atoms present	54518-41-1	C1=CC=C(C(=C1)N/N=C\2/C(=CC3=C(C=CC(=C3C2=O)NC(=O)C4=CC(=CC=C4)S(=O)(=O)CCCl)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{2: 2, 34: 1, 14: 11, 15: 2, 17: 1, 20: 3, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	54519-12-9	C1=CC=C(C=C1)/C=C(/C(=O)C2=CC=CC=C2)\O	{24: 1, 20: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	5452-07-3	CC(C)CC(=O)OCCCC1=CC=CC=C1	{1: 2, 2: 4, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	5452-08-4	CCCCCCCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 6, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	5452-83-5	C1CCN(CC1)CCC2=CC=CC=N2	{33: 1, 2: 2, 11: 5, 14: 4, 35: 1}
Did not match all atoms present	54523-78-3	CC1=CC=CC=C1C(=O)C2=CC=CC=N2	{24: 1, 1: 1, 35: 1, 14: 8}
Did not match all atoms present	54527-84-3	CC1=C(C(C(=C(N1)C)C(=O)OCCN(C)CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC.Cl	{32: 1, 1: 4, 2: 3, 38: 1, 33: 1, 12: 1, 14: 9, 15: 4, 17: 1, 28: 2}
Did not match all atoms present	5453-04-3	CC1=C(C(=C2C(=C1)C(=C(C(=C2C=O)O)O)C(C)C)O)C3=C(C=C4C(=C3O)C(=C(C(=C4C(C)C)O)O)C=O)C.CC(=O)O	{1: 7, 3: 2, 14: 2, 21: 6, 26: 2, 27: 1}
Did not match all atoms present	5453-66-7	C1=CC(=CC=C1O)[As]=O	{21: 1, 14: 4, 29: 1}
Did not match all atoms present	54531-52-1	C=O.C1=CC(=CC=C1O)[As](=O)(O)O	{29: 1, 20: 2, 5: 1, 14: 4, 21: 1}
Did not match all atoms present	54532-97-7	CCCCC1=CC=CC=C1C2=CC=CC=C2	{1: 1, 2: 3, 14: 9}
Did not match all atoms present	54533-83-4	C1COCCOC2=CC=CC=C2OCCOCC[NH2+]1	{11: 8, 14: 4, 23: 4}
Did not match all atoms present	5454-11-5	CCCCCCC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 7, 28: 1, 14: 5}
Did not match all atoms present	5454-24-0	CCCCCCCCCCCOC=O	{1: 1, 2: 10, 26: 1}
Did not match all atoms present	5455-59-4	C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)N	{30: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	5455-98-1	C1C(O1)CN2C(=O)C3=CC=CC=C3C2=O	{33: 1, 2: 1, 11: 1, 12: 1, 14: 4, 23: 1, 25: 2}
Did not match all atoms present	54551-83-6	COC(=O)CC1=C(C=CC=C1Cl)Cl	{1: 1, 2: 1, 28: 1, 14: 3, 17: 2}
Did not match all atoms present	54553-90-1	C1CN=C(N1)C2=CC=CC=C2.C1=C(C(=CC(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O	{32: 1, 35: 1, 11: 2, 14: 7, 15: 1, 27: 4}
Did not match all atoms present	54554-39-1	C=CC(=O)OCCOC(=O)NC1=CC=CC(=C1)CN=C=O	{2: 3, 5: 1, 6: 1, 8: 1, 34: 1, 14: 4, 28: 2, 29: 1, 31: 1}
Did not match all atoms present	5456-05-3	B1(OCC(CO1)(C)C)OCC(C)(C)COB2OCC(CO2)(C)C	{1: 6, 2: 2, 4: 1, 11: 4, 13: 2, 22: 2, 23: 4}
Did not match all atoms present	5456-08-6	CCCCCN(CCCCC)CC(C1=CC=C(C=C1)Br)O	{1: 2, 2: 9, 3: 1, 33: 1, 14: 4, 18: 1, 20: 1}
Did not match all atoms present	5456-28-0	CCN(CC)C(=S)S[Se](SC(=S)N(CC)CC)(SC(=S)N(CC)CC)SC(=S)N(CC)CC	{40: 4, 1: 8, 2: 8, 33: 4, 7: 4}
Did not match all atoms present	5456-94-0	CC1=CC(=C(C=C1Br)Br)OC	{1: 2, 18: 2, 22: 1, 14: 2}
Did not match all atoms present	54564-58-8	CC1=C(C1C(=O)OC)C2=CC=CC=C2	{1: 2, 12: 1, 28: 1, 14: 5, 15: 2}
Did not match all atoms present	5457-28-3	C1=CC=C2C(=C1)C(=CN2)C#N	{32: 1, 37: 1, 14: 5}
Did not match all atoms present	5457-70-5	CCCCCCCC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 8, 28: 1, 14: 5}
Did not match all atoms present	5457-90-9	CCN1C2=NC(=NC(=O)C2=NN1)N	{32: 1, 1: 1, 2: 1, 35: 3, 33: 1, 25: 1, 30: 1}
Did not match all atoms present	5457-92-1	CCN1C2=C(C(=NC(=N2)N)Cl)N=N1	{1: 1, 2: 1, 35: 4, 33: 1, 17: 1, 30: 1}
Did not match all atoms present	54574-01-5	CCCCCCCCNC1=CC2=C(C=C1)OC3=C(C24C5=CC=CC=C5C(=O)O4)C=CC(=C3)N(CC)CC	{1: 3, 2: 9, 33: 1, 13: 1, 14: 10, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	54576-42-0	CC(C)SCCC1=CC=CC=C1	{40: 1, 1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	54576-53-3	[O-2].[Ti+4].[Ni+2].[Sb+3]	{}
Did not match all atoms present	5458-41-3	CCCCCCCCCCCOC(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 10, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	5458-48-0	C1CCC(CC1)C2=CC=C(C=C2)[N+](=O)[O-]	{11: 5, 12: 1, 38: 1, 14: 4}
Did not match all atoms present	5458-54-8	CC(C)CC1=CC=CC2=C1CCCC2	{11: 4, 1: 2, 2: 1, 3: 1, 14: 3}
Did not match all atoms present	54581-50-9	CC[N+]1=C(OC2=C1C=CC3=CC=CC=C32)C.[I-]	{1: 2, 2: 1, 33: 1, 14: 6, 19: 1, 23: 1}
Did not match all atoms present	54585-47-6	CC1=CC(=C(C(=S)N1)C#N)C	{32: 1, 1: 2, 37: 1, 14: 1}
Did not match all atoms present	54589-71-8	C1=CC2=C(C=C1Cl)C3=CC(=CC(=C3O2)Cl)Cl	{17: 3, 14: 5, 23: 1}
Did not match all atoms present	5459-40-5	CCOC1=CC=C(C=C1)C=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 4, 22: 1}
Did not match all atoms present	5459-85-8	CC1=C(C=C(C=C1)N)N.Cl	{1: 1, 30: 2, 14: 3, 17: 1}
Did not match all atoms present	54590-52-2	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CC(CN)O	{1: 2, 2: 12, 3: 1, 14: 4, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	54593-83-8	CCOP(=S)(OCC)OC(C(Cl)(Cl)Cl)Cl	{1: 2, 2: 2, 3: 1, 4: 1, 17: 4, 22: 3}
Did not match all atoms present	546-44-1	C[Si](C)(C)O[Si](C)(C1=CC=CC=C1)O[Si](C)(C)C	{1: 7, 22: 2, 14: 5}
Did not match all atoms present	546-45-2	C[Si]1(O[Si](O[Si](O1)(C)C2=CC=CC=C2)(C)C3=CC=CC=C3)C4=CC=CC=C4	{1: 3, 14: 15, 23: 3}
Did not match all atoms present	546-46-3	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Zn+2].[Zn+2].[Zn+2]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	546-56-5	C1=CC=C(C=C1)[Si]2(O[Si](O[Si](O[Si](O2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9	{14: 40, 23: 4}
Did not match all atoms present	546-67-8	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Pb+2]	{24: 4, 1: 4}
Did not match all atoms present	546-68-9	CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]	{1: 8, 3: 4, 29: 4}
Did not match all atoms present	546-71-4	CCOP(=O)(CC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 14: 4, 22: 2, 29: 1}
Did not match all atoms present	546-74-7	CCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 29: 3, 22: 1}
Did not match all atoms present	546-89-4	[Li+].CC(=O)[O-]	{24: 1, 1: 1}
Did not match all atoms present	546-93-0	C(=O)([O-])[O-].[Mg+2]	{24: 1}
Did not match all atoms present	5460-29-7	C1=CC=C2C(=C1)C(=O)N(C2=O)CCCBr	{25: 2, 2: 3, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	5460-31-1	CC1=C(C=CC=C1O)[N+](=O)[O-]	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	5460-32-2	COC1=C(C=C(C=C1)I)OC	{1: 2, 19: 1, 22: 2, 14: 3}
Did not match all atoms present	5460-60-6	C1=CC=C(C=C1)CCNC(=O)CC2=CC=CC=C2	{24: 1, 2: 3, 14: 10, 31: 1}
Did not match all atoms present	54600-85-0	CC1=C(N=C(C(=N1)C2=CC=CC=C2)C)C3=CC=CC=C3	{1: 2, 35: 2, 14: 10}
Did not match all atoms present	54605-45-7	CNCC(C(C(C(CO)O)O)O)O.CNCC(C(C(C(CO)O)O)O)O.CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I	{1: 4, 2: 8, 3: 8, 19: 6, 20: 10, 24: 4, 27: 2, 31: 6}
Did not match all atoms present	5461-49-4	CCN(C=O)C1=CC=CC=C1	{1: 1, 2: 1, 26: 1, 14: 5, 33: 1}
Did not match all atoms present	5461-51-8	CC(C)N(C1=CC=CC=C1)C(=O)C	{24: 1, 1: 3, 3: 1, 14: 5, 33: 1}
Did not match all atoms present	54613-99-9	CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)OCC1=CC=CC=C1Cl)C(=O)O	{1: 3, 2: 5, 3: 1, 4: 1, 14: 4, 17: 1, 27: 1, 28: 2, 31: 2}
Did not match all atoms present	54614-88-9	C1=CC(=CC=C1C(=O)NCl)C(=O)NCl	{24: 2, 17: 2, 14: 4, 31: 2}
Did not match all atoms present	5462-02-2	CCCCCCCOC(=O)C1=CC(=CC=C1)C	{1: 2, 2: 6, 28: 1, 14: 4}
Did not match all atoms present	5462-06-6	CC(CC1=CC=C(C=C1)OC)C=O	{1: 2, 2: 1, 3: 1, 14: 4, 22: 1, 26: 1}
Did not match all atoms present	5462-13-5	CCOC(=O)CCC1=CC(=C(C=C1)OC)OC	{1: 3, 2: 3, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	5462-27-1	CC1=CC(=C(C=C1OC(=O)C)OC(=O)C)OC(=O)C	{1: 4, 28: 3, 14: 2}
Did not match all atoms present	5462-29-3	CC1=C2C(=CC(=C1)Cl)C(=O)C(=C3C(=O)C4=CC(=CC(=C4S3)C)Cl)S2	{1: 2, 41: 2, 14: 4, 15: 2, 17: 2, 25: 2}
Did not match all atoms present	5462-60-2	C(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{24: 1, 2: 1, 29: 3}
Did not match all atoms present	5462-86-2	CCN1C=NC2=C1N=CN=C2Cl	{1: 1, 2: 1, 35: 3, 33: 1, 14: 2, 17: 1}
Did not match all atoms present	5462-97-5	COC1=CC=C(C=C1)/C=C\2/C(=O)NC(=S)S2	{32: 1, 1: 1, 6: 1, 41: 1, 14: 4, 15: 2, 22: 1, 25: 1}
Did not match all atoms present	54622-43-4	C(C(CN(CP(=O)(O)O)CP(=O)(O)O)O)N(CP(=O)(O)O)CP(=O)(O)O	{33: 2, 2: 6, 3: 1, 20: 9, 29: 4}
Did not match all atoms present	54626-77-6	CC(CO)O.C1C=CCC2C1C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O	{1: 1, 2: 1, 3: 1, 11: 2, 12: 2, 14: 8, 20: 2, 27: 2, 28: 4}
Did not match all atoms present	54629-30-0	C1=CC=C2C(=C1)C(=O)C3=C(O2)C=CN=C3	{25: 1, 35: 1, 14: 7, 23: 1}
Did not match all atoms present	5463-10-5	CCCCNC1=NC2=C(C(=N1)N(C)C)NC=N2	{32: 1, 1: 3, 2: 3, 35: 3, 33: 1, 14: 1, 31: 1}
Did not match all atoms present	5463-44-5	CCOC(=O)C1=C(C(=C(N1)C)[N+](=O)[O-])C	{32: 1, 1: 3, 2: 1, 28: 1, 38: 1}
Did not match all atoms present	5463-64-9	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)N=NC5=CC=C(C6=CC=CC=C65)N)S(=O)(=O)O)S(=O)(=O)O)N	{34: 4, 6: 2, 14: 18, 20: 2, 29: 4, 30: 2}
Did not match all atoms present	5463-96-7	C1CC[C@H]([C@@H](C1)N2C=NC3=C2N=CN=C3Cl)O	{33: 1, 35: 3, 11: 4, 12: 2, 14: 2, 17: 1, 20: 1}
Did not match all atoms present	54636-29-2	C1=CC=C(C=C1)CCCCCCCCl	{17: 1, 2: 7, 14: 5}
Did not match all atoms present	54636-31-6	CC(=O)C(CC1=CC=CC=C1)C2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 3: 1, 14: 10}
Did not match all atoms present	5464-79-9	COC1=C2C(=CC=C1)SC(=N2)N	{1: 1, 35: 1, 41: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	5464-87-9	C1COCCN1CC2=CC(=C(C(=C2)CN3CCOCC3)O)CN4CCOCC4	{33: 3, 2: 3, 11: 12, 14: 2, 21: 1, 23: 3}
Did not match all atoms present	54643-52-6	C1=NC(=O)N(C2=C1NC=N2)O	{32: 1, 33: 1, 35: 2, 14: 2, 21: 1, 25: 1}
Did not match all atoms present	54648-07-6	CC1(CC(C2=C1C=C(C=C2)[N+](=O)[O-])(C)C3=CC=C(C=C3)[N+](=O)[O-])C	{38: 2, 1: 3, 11: 1, 13: 2, 14: 7}
Did not match all atoms present	54649-24-0	CCCCCCOS(=O)(=O)[O-].[K+]	{1: 1, 2: 5, 29: 3, 22: 1}
Did not match all atoms present	5465-13-4	CC1=C(C(=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-])C	{1: 4, 38: 2}
Did not match all atoms present	5465-38-3	C1=CC=C(C=C1)C2C(C(=O)OC2=O)C3=CC=CC=C3	{28: 2, 12: 2, 14: 10}
Did not match all atoms present	5465-65-6	CC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	54655-07-1	[Li+].C[Si](C)(C)C#[C-]	{1: 3, 10: 1}
Did not match all atoms present	5466-11-5	C1=C2C(=NC(=N1)Cl)N(C=N2)C3C(C(C(O3)CO)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 17: 1, 20: 3, 23: 1}
Did not match all atoms present	5466-13-7	CCCC1(OC(CS1)COC(=O)N)C2=CC=CC=C2	{1: 1, 2: 3, 41: 1, 11: 1, 12: 1, 13: 1, 14: 5, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	5466-41-1	C1=C(C(=CNC1=O)C(=O)N)O	{32: 1, 14: 2, 21: 1, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	5466-57-9	C1=CC=C2C(=C1)NC(=N2)C(Cl)Cl	{32: 1, 17: 2, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	5466-77-3	CCCCC(CC)COC(=O)C=CC1=CC=C(C=C1)OC	{1: 3, 2: 5, 3: 1, 6: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	5466-84-2	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)OC2=O	{28: 2, 38: 1, 14: 3}
Did not match all atoms present	5466-90-0	CC(=O)OCCN1C(=O)C2=CC=CC=C2C1=O	{1: 1, 2: 2, 33: 1, 14: 4, 25: 2, 28: 1}
Did not match all atoms present	54660-04-7	COC1=CC=C(C=C1)N2CCCC2	{1: 1, 11: 4, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	54660-08-1	C1CC(=O)N(C1)C2=CC=C(C=C2)F	{16: 1, 25: 1, 11: 3, 14: 4, 33: 1}
Did not match all atoms present	54662-30-5	C[C@@H]1C[C@@]2([C@@H](C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)COC(=O)C)O)C)O)OC(=O)CC5=CC=CC=C5	{1: 5, 2: 2, 11: 2, 12: 4, 13: 4, 14: 7, 15: 2, 20: 2, 25: 1, 28: 2}
Did not match all atoms present	54663-78-4	CCCC[Sn](CCCC)(CCCC)C1=CC=CS1	{1: 3, 2: 9, 14: 3, 41: 1}
Did not match all atoms present	54667-43-5	C1=CC(=CC=C1C(=O)OCCCCOC(=O)C2=CC=C(C=C2)N)N	{2: 4, 28: 2, 30: 2, 14: 8}
Did not match all atoms present	5467-44-7	CCCCCCCCCCCCCCCCCC(=O)CCC1=CC=CC=C1	{24: 1, 1: 1, 2: 18, 14: 5}
Did not match all atoms present	5467-56-1	CCCCCOC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 4, 22: 1, 14: 4}
Did not match all atoms present	5467-58-3	COC1=CC=C(C2=CC=CC=C21)Br	{1: 1, 18: 1, 22: 1, 14: 6}
Did not match all atoms present	5467-74-3	B(C1=CC=C(C=C1)Br)(O)O	{18: 1, 20: 2, 14: 4}
Did not match all atoms present	5467-78-7	C1=CC=C(C=C1)N2C(=NN=N2)N	{33: 1, 35: 3, 30: 1, 14: 5}
Did not match all atoms present	5467-84-5	C1=CC=C(C=C1)CCNC(=O)NCCC2=CC=CC=C2	{24: 1, 2: 4, 14: 10, 31: 2}
Did not match all atoms present	54672-09-2	CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F	{1: 2, 4: 1, 38: 1, 33: 1, 14: 3, 16: 3}
Did not match all atoms present	54673-07-3	C1=CC(=CC(=C1)O)C=C(C#N)C(=O)O	{37: 1, 6: 1, 7: 1, 14: 4, 21: 1, 27: 1}
Did not match all atoms present	54673-97-1	C=CCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]	{2: 13, 5: 1, 6: 1, 29: 3}
Did not match all atoms present	54678-23-8	CSC.[Cu]Br	{40: 1, 1: 2, 18: 1}
Did not match all atoms present	5468-00-8	C1COC(OC1)CC2=CC=CC=C2	{2: 1, 11: 3, 12: 1, 14: 5, 23: 2}
Did not match all atoms present	5468-37-1	C1=CC=C(C=C1)C(=O)CN.Cl	{24: 1, 17: 1, 2: 1, 30: 1, 14: 5}
Did not match all atoms present	5468-67-7	C1=C(N=CN=C1N)N.Cl	{17: 1, 35: 2, 30: 2, 14: 2}
Did not match all atoms present	5468-75-7	CC1=CC=CC=C1NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4C)Cl)Cl	{1: 4, 34: 4, 3: 2, 14: 14, 17: 2, 24: 4, 31: 2}
Did not match all atoms present	5468-97-3	CC(C)(CC1=CC=C(C=C1)Cl)O	{1: 2, 2: 1, 4: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	54684-88-7	C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(CO)O.C(COCCO)O	{2: 6, 14: 6, 20: 4, 22: 1, 27: 2, 28: 2}
Did not match all atoms present	54687-25-1	CC1=C(C=C(C=C1)NC(=O)OCCOC(=O)C=C)NC(=O)OCCOC(=O)C=C	{1: 1, 2: 4, 5: 2, 6: 2, 14: 3, 28: 4, 31: 2}
Did not match all atoms present	54687-44-4	CCN(CC1=CC(=CC=C1)S(=O)(=O)N(C)C)C2=CC=CC=C2	{1: 3, 2: 2, 29: 2, 14: 9, 33: 2}
Did not match all atoms present	54688-30-1	CC(C)CC(=NC1=CC=C(C=C1)CC2=CC=C(C=C2)N=C(C)CC(C)C)C	{1: 6, 2: 3, 3: 2, 7: 2, 34: 2, 14: 8}
Did not match all atoms present	54688-53-8	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CCCC(=O)O)CCCC(=O)O.C(CCC(=O)O)CC(=O)O.C(CO)O	{2: 13, 27: 8, 20: 2, 14: 8}
Did not match all atoms present	5469-19-2	CC1=CC(=C(C=C1C)Br)C	{1: 3, 18: 1, 14: 2}
Did not match all atoms present	5469-45-4	CC(=O)NC(=CC1=CC=CC=C1)C(=O)O	{1: 1, 6: 1, 7: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	5469-65-8	CCOC(=O)C1(C(N(C(=O)C1=O)C2=CC=CC=C2)C3=CC=CC=C3)C	{1: 2, 2: 1, 33: 1, 12: 1, 13: 1, 14: 10, 25: 2, 28: 1}
Did not match all atoms present	5469-69-2	C1=CC(=NN=C1N)Cl	{17: 1, 35: 2, 30: 1, 14: 2}
Did not match all atoms present	54692-27-2	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ru+3]	{}
Did not match all atoms present	54696-05-8	CC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	54697-52-8	CC1C(S1(=O)=O)C	{1: 2, 12: 2, 29: 2}
Did not match all atoms present	54699-14-8	[2H]C([2H])([2H])C(=O)C(C)(C)C	{24: 1, 1: 4, 4: 1}
Did not match all atoms present	54699-33-1	CCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(=O)OCC	{1: 2, 2: 10, 28: 2, 14: 4}
Did not match all atoms present	547-32-0	C1=CN=C(N=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.[Na+]	{35: 2, 30: 1, 34: 1, 29: 2, 14: 7}
Did not match all atoms present	547-44-4	C1=CC(=CC=C1N)S(=O)(=O)NC(=O)N	{24: 1, 30: 2, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	547-57-9	C1=CC(=CC=C1N/N=C\2/C=CC(=O)C=C2O)S(=O)(=O)O	{34: 1, 14: 7, 15: 2, 20: 2, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	547-67-1	C(=O)(C(=O)[O-])[O-].[Ni+2]	{24: 2}
Did not match all atoms present	547-68-2	C(=O)(C(=O)[O-])[O-].[Zn+2]	{24: 2}
Did not match all atoms present	547-81-9	CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 5, 12: 5, 13: 1, 14: 3, 20: 2, 21: 1}
Did not match all atoms present	547-91-1	C1=CC2=C(C(=C(C=C2S(=O)(=O)O)I)O)N=C1	{35: 1, 14: 4, 19: 1, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	547-95-5	C1C[NH+]1CCCCl.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{2: 3, 38: 3, 11: 2, 14: 2, 17: 1, 29: 3}
Did not match all atoms present	5470-18-8	C1=CC(=C(N=C1)Cl)[N+](=O)[O-]	{17: 1, 35: 1, 38: 1, 14: 3}
Did not match all atoms present	5470-47-3	CC(C)C(C1=CC=CC=C1)C(=O)N	{24: 1, 1: 2, 3: 2, 30: 1, 14: 5}
Did not match all atoms present	5470-49-5	CS(=O)(=O)C1=CC=C(C=C1)N	{1: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	5470-65-5	C1=CC(=C(C=C1O)Br)[N+](=O)[O-]	{18: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	5470-66-6	CC1=[N+](C=CC(=C1)[N+](=O)[O-])[O-]	{1: 1, 38: 1, 29: 1, 14: 3, 33: 1}
Did not match all atoms present	5470-70-2	CC1=NC=C(C=C1)C(=O)OC	{1: 2, 35: 1, 28: 1, 14: 3}
Did not match all atoms present	5470-75-7	C1=CC2=CC(=CC(=C2N=C1)N)Cl	{17: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	5470-96-2	C1=CC=C2C(=C1)C=CC(=N2)C=O	{26: 1, 35: 1, 14: 6}
Did not match all atoms present	54708-68-8	CNC(=O)C1=NN(C(=C1)OC)C2=CC(=CC=C2)Cl	{1: 2, 35: 1, 33: 1, 14: 5, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5471-51-2	CC(=O)CCC1=CC=C(C=C1)O	{24: 1, 1: 1, 2: 2, 21: 1, 14: 4}
Did not match all atoms present	5471-63-6	C1=CC=C(C=C1)C2=C3C=CC=CC3=C(O2)C4=CC=CC=C4	{14: 14, 23: 1}
Did not match all atoms present	5471-76-1	C1=CC(=C(C=C1Cl)N)O.Cl	{17: 2, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	5471-82-9	CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OC	{1: 2, 28: 1, 38: 1, 14: 3}
Did not match all atoms present	5471-90-9	C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)O	{31: 1, 21: 1, 14: 9, 29: 2}
Did not match all atoms present	54715-57-0	C1=C(C(=CC(=C1[N+](=O)[O-])Cl)O)[N+](=O)[O-]	{17: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	5472-01-5	C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Br	{24: 1, 2: 1, 3: 1, 18: 1, 14: 14}
Did not match all atoms present	5472-05-9	C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)Br)C3=CC=CC4=CC=CC=C43	{24: 1, 2: 1, 3: 1, 18: 1, 14: 16}
Did not match all atoms present	5472-13-9	CC1=CC=CC=C1C(C2=CC=CC=C2)O	{1: 1, 3: 1, 20: 1, 14: 9}
Did not match all atoms present	5472-23-1	C1=CC=C(C=C1)N2C3=CC=CC=C3C(=O)C4=CC=CC=C42	{25: 1, 14: 13, 33: 1}
Did not match all atoms present	5472-41-3	C1=C2C(=NC(=O)N=C2NN1)N	{32: 2, 25: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	5472-84-4	C1=CC2=C3C(=C1)C(=CC(=O)C3=CC=C2)O	{25: 1, 20: 1, 14: 7, 15: 1}
Did not match all atoms present	54731-72-5	COP(=O)(CCO)OC	{1: 2, 2: 2, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	54737-45-0	C1=CC=C(C=C1)C=CC2=CC=CC=C2Br	{18: 1, 14: 9, 6: 2}
Did not match all atoms present	54739-18-3	COCCCC/C(=N\OCCN)/C1=CC=C(C=C1)C(F)(F)F	{1: 1, 2: 6, 4: 1, 7: 1, 34: 1, 14: 4, 16: 3, 22: 2, 30: 1}
Did not match all atoms present	54760-87-1	CC(C)S[Hg]SC(C)C	{40: 2, 1: 4, 3: 2}
Did not match all atoms present	54762-86-6	CC(=O)C1=CC=C(C=C1)C2CC3CCC2C3	{24: 1, 1: 1, 11: 4, 12: 3, 14: 4}
Did not match all atoms present	54764-32-8	[2H+].[F-].[F-].[F-].[F-].[F-].[F-].[Sb]	{16: 6}
Did not match all atoms present	54767-28-1	CC1=CC[Si]2(C1)CC=C(C2)C	{1: 2, 11: 4, 14: 2, 15: 2}
Did not match all atoms present	54767-75-8	CCCCCCCCN[C@H](C)[C@H](C1=CC=C(C=C1)SC(C)C)O	{1: 4, 2: 7, 3: 3, 40: 1, 14: 4, 20: 1, 31: 1}
Did not match all atoms present	54770-19-3	CC1=NNC(=O)N1C	{32: 1, 1: 2, 35: 1, 33: 1, 25: 1}
Did not match all atoms present	54771-60-7	CC(=O)C1=CC(=C(C=C1)OC(=O)C)OC	{24: 1, 1: 3, 28: 1, 22: 1, 14: 3}
Did not match all atoms present	54773-20-5	C1=C(C=C(C=C1Cl)Cl)C(F)(F)F	{16: 3, 17: 2, 4: 1, 14: 3}
Did not match all atoms present	54774-47-9	CC1([C@H]([C@@H]1C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C	{1: 2, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	54774-89-9	CCCC1=C(C=CC2=CC=CC=C21)C	{1: 2, 2: 2, 14: 6}
Did not match all atoms present	54777-65-0	CC(=O)NC1=CC=C(C=C1)CCl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	54781-19-0	C[Si](C)(C)OC1=CCCC=C1	{1: 3, 11: 2, 22: 1, 14: 3, 15: 1}
Did not match all atoms present	54781-93-0	COC(=O)C1=C(NC2=CC=CC=C21)C(=O)OC	{32: 1, 1: 2, 28: 2, 14: 4}
Did not match all atoms present	54789-30-9	CC(C1=CC=C(C=C1)CCl)Cl	{1: 1, 2: 1, 3: 1, 14: 4, 17: 2}
Did not match all atoms present	54798-92-4	C1=CC=C(C=C1)N2N=C(N=N2)C(=O)O	{33: 1, 27: 1, 14: 5, 35: 3}
Did not match all atoms present	548-00-5	CCOC(=O)C(C1=C(C2=CC=CC=C2OC1=O)O)C3=C(C4=CC=CC=C4OC3=O)O	{1: 1, 2: 1, 3: 1, 14: 8, 21: 2, 28: 3}
Did not match all atoms present	548-35-6	C1C2=CC=CC=C2C3=C1C4=C(CC5=CC=CC=C54)C6=C3CC7=CC=CC=C76	{11: 3, 14: 12}
Did not match all atoms present	548-39-0	C1=CC2=C3C(=C1)C=CC(=O)C3=CC=C2	{25: 1, 14: 8}
Did not match all atoms present	548-43-6	CN1CC(=CC2C1CC3=CNC4=CC=CC2=C34)CO	{32: 1, 1: 1, 2: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1}
Did not match all atoms present	548-51-6	CC1=C(C(=C(C=C1)C(C)C)O)C(=O)O	{27: 1, 1: 3, 3: 1, 21: 1, 14: 2}
Did not match all atoms present	548-61-8	C1=CC(=CC=C1C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N)N	{3: 1, 30: 3, 14: 12}
Did not match all atoms present	548-62-9	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]	{1: 6, 33: 3, 7: 1, 14: 12, 15: 2, 17: 1}
Did not match all atoms present	548-68-5	CCN(CC)CCSC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 2, 2: 4, 3: 1, 33: 1, 40: 1, 14: 10, 17: 1, 24: 1}
Did not match all atoms present	548-73-2	C1CN(CC=C1N2C3=CC=CC=C3NC2=O)CCCC(=O)C4=CC=C(C=C4)F	{32: 1, 33: 2, 2: 3, 11: 3, 14: 9, 15: 1, 16: 1, 24: 1, 25: 1}
Did not match all atoms present	548-77-6	COC1=C(C=C2C(=C1O)C(=O)C(=CO2)C3=CC=C(C=C3)O)O	{1: 1, 14: 6, 21: 3, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	548-80-1	C1=CC(=CC=C1N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-].[Na+].[Na+]	{34: 1, 38: 1, 14: 7, 15: 2, 21: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	548-83-4	C1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	{25: 1, 21: 3, 14: 7, 23: 1}
Did not match all atoms present	548-93-6	C1=CC(=C(C(=C1)O)N)C(=O)O	{30: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	54800-07-6	CC(=O)N.CC(=O)N.CC(=O)N.[N+](=O)(O)[O-]	{24: 3, 1: 3, 20: 1, 30: 3}
Did not match all atoms present	54813-56-8	C=C(C1=CC=CC=C1)C2=CC=NC=C2	{35: 1, 5: 1, 14: 9, 7: 1}
Did not match all atoms present	54813-77-3	CCN(C1=CC=CC=C1)C(C)C	{1: 3, 2: 1, 3: 1, 14: 5, 33: 1}
Did not match all atoms present	54815-21-3	CC(C)(C)C1=CC2=C(C=C1)OC(=O)O2	{1: 3, 4: 1, 14: 3, 28: 2}
Did not match all atoms present	54817-63-9	CC1=NN(C(=O)C1)C2=C(C=CC(=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 35: 1, 33: 1, 11: 1, 14: 3, 15: 1, 20: 2, 25: 1, 29: 4}
Did not match all atoms present	54818-71-2	CNC1=C[N+](=CC=C1)[O-]	{1: 1, 33: 1, 29: 1, 14: 4, 31: 1}
Did not match all atoms present	54818-74-5	CC(=O)N(C)C1=CC=[N+](C=C1)[O-]	{24: 1, 1: 2, 29: 1, 14: 4, 33: 2}
Did not match all atoms present	54818-75-6	CN=C1C=CC(=CN1O)Cl	{1: 1, 34: 1, 33: 1, 14: 3, 17: 1, 21: 1}
Did not match all atoms present	54818-76-7	CON1C=CC=CC1=N	{1: 1, 36: 1, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	54818-77-8	CON1C=C(C=CC1=N)Cl	{1: 1, 36: 1, 33: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	54824-17-8	CN(C)CCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 33: 2, 14: 5, 25: 2}
Did not match all atoms present	54824-20-3	C1CCN(C1)CCN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]	{33: 2, 2: 2, 38: 1, 11: 4, 14: 5, 25: 2}
Did not match all atoms present	54824-83-8	CC1CN2CC(O[Si](O1)(OC(C2)C)C3=CC=CC=C3)C	{1: 3, 33: 1, 11: 3, 12: 3, 14: 5, 23: 3}
Did not match all atoms present	54827-17-7	CC1=CC(=CC(=C1N)C)C2=CC(=C(C(=C2)C)N)C	{1: 4, 30: 2, 14: 4}
Did not match all atoms present	54828-00-1	CN(C)CC1=C(C=CC(=C1)Cl)O	{1: 2, 2: 1, 33: 1, 14: 3, 17: 1, 21: 1}
Did not match all atoms present	54829-48-0	C1=COC(=C1)I	{19: 1, 14: 3, 23: 1}
Did not match all atoms present	54837-90-0	CCCNC1=CC=C(C=C1)C	{1: 2, 2: 2, 14: 4, 31: 1}
Did not match all atoms present	54846-43-4	C(C(=O)[O-])Br.C(C(=O)[O-])Br.[Co+2]	{24: 2, 2: 2, 18: 2}
Did not match all atoms present	54849-16-0	CCCCCCCCCC1=NCC[N+]1(CCOCC(=O)[O-])CC(=O)[O-].[OH-].[Na+].[Na+]	{1: 1, 2: 12, 35: 1, 11: 2, 15: 1, 22: 1, 24: 2}
Did not match all atoms present	54849-69-3	CCN(CC)CC.CCOC(=O)N1CC[N+](=C\2/C(=C/C=C/3\C(C4=C(N3CCCS(=O)(=O)O)C=CC5=CC=CC=C54)(C)C)/CC/C2=C/C=C\6/C(C7=C(N6CCCS(=O)(=O)[O-])C=CC8=CC=CC=C87)(C)C)CC1	{1: 8, 2: 10, 6: 4, 33: 5, 11: 6, 13: 2, 14: 12, 15: 5, 20: 1, 28: 1, 29: 5}
Did not match all atoms present	54849-70-6	CCN\1C2=CC=CC=C2S/C1=C\C3=C/C(=C/C=C/C4=[N+](C5=CC=CC=C5S4)CC)/C6=CC=CC=C6O3.[I-]	{1: 2, 2: 2, 6: 4, 33: 2, 41: 2, 14: 13, 15: 3, 19: 1, 23: 1}
Did not match all atoms present	54851-13-7	CC(=O)OC1=CC=CC=C1C(=O)O.C1CN(CCN1CCO)C2=CC=CC(=C2)C(F)(F)F	{1: 1, 2: 2, 4: 1, 33: 2, 11: 4, 14: 8, 16: 3, 20: 1, 27: 1, 28: 1}
Did not match all atoms present	54852-73-2	CCOC1=CC=CC(=C1)C2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	54854-14-7	[B-](F)(F)(F)F.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C	{1: 5, 2: 3, 14: 8, 16: 4, 23: 1, 28: 1, 31: 2}
Did not match all atoms present	54854-73-8	[CH3-].[CH3-].[CH3-].C[PH+](C)C1=CC=CC=C1.[Au]	{1: 2, 14: 5}
Did not match all atoms present	54856-23-4	CNCCC1=CC=CC=N1.CS(=O)(=O)O.CS(=O)(=O)O	{1: 3, 2: 2, 35: 1, 14: 4, 20: 2, 29: 4, 31: 1}
Did not match all atoms present	54856-36-9	C(=C(C#N)C#N)=S	{8: 1, 37: 2, 7: 1}
Did not match all atoms present	5486-03-3	CCOC(=O)C1=CNC2=CC(=C(C=C2C1=O)OCC(C)C)OCC(C)C	{32: 1, 1: 5, 2: 3, 3: 2, 14: 3, 22: 2, 25: 1, 28: 1}
Did not match all atoms present	5486-55-5	COC1=CC2=C(C=C1)C=C(C=C2)OC	{1: 2, 22: 2, 14: 6}
Did not match all atoms present	5486-77-1	CCN(CC)CCNC(=O)C1=C(C=C(C=C1)Cl)OCC=C	{1: 2, 2: 5, 5: 1, 6: 1, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5486-84-0	CCOC1=CC(=C(C=C1[N+]#N)OCC)NC(=O)C2=CC=CC=C2	{1: 2, 2: 2, 34: 1, 14: 7, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	54867-08-2	C1CC[C@H]([C@H](C1)C(=O)O)NC(=O)OCC2=CC=CC=C2	{2: 1, 11: 4, 12: 2, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	54867-58-2	CCCOP(=S)(CC)CC	{1: 3, 2: 4, 22: 1}
Did not match all atoms present	5488-16-4	C1=C(C(=CC(=C1O)CC(=O)O)O)CC(=O)O	{2: 2, 27: 2, 21: 2, 14: 2}
Did not match all atoms present	5488-45-9	CCCC[Sn](CCCC)(CCCC)OC1=CC=CC2=C1N=CC=C2	{1: 3, 2: 9, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	5488-50-6	C1=CC=C(C=C1)NC(=O)NCCI	{24: 1, 2: 2, 19: 1, 14: 5, 31: 2}
Did not match all atoms present	54884-99-0	C1=CC=C(C=C1)CC2=CC3=C(C=C2)N=CC=C3	{2: 1, 35: 1, 14: 11}
Did not match all atoms present	54888-15-2	C1=CC(=CC=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)N(CCC#N)CCO	{33: 1, 2: 4, 37: 2, 38: 1, 34: 2, 14: 7, 20: 1}
Did not match all atoms present	54889-55-3	CCCCCCC1=CC2=C(CCC2)C=C1	{1: 1, 2: 5, 11: 3, 14: 3}
Did not match all atoms present	54889-82-6	CCCC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21	{1: 1, 2: 2, 14: 11}
Did not match all atoms present	54890-07-2	CCCCC(C(=O)O[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 2: 3, 3: 1, 28: 1, 22: 1}
Did not match all atoms present	54894-37-0	C1=CC=C(C=C1)CCOCC2=CC=CC=C2	{2: 3, 22: 1, 14: 10}
Did not match all atoms present	54897-33-5	CC1=CC=C(C=C1)S(=O)(=O)C=CC2=CC=CC=C2	{1: 1, 14: 9, 6: 2, 29: 2}
Did not match all atoms present	549-18-8	CN(C)CCC=C1C2=CC=CC=C2CCC3=CC=CC=C31.Cl	{1: 2, 2: 2, 6: 1, 33: 1, 11: 2, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	549-49-5	COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.Br	{1: 1, 3: 1, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 5, 18: 1, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	549-68-8	CCOC1=CC(=CC(=C1OCC)OCC)C2=NC=CC3=CC(=C(C=C32)OC)OC	{1: 5, 2: 3, 35: 1, 22: 5, 14: 6}
Did not match all atoms present	549-94-0	C1=CC=C(C=C1)NN=C(C(=NNC2=CC=CC=C2)C(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 34: 2, 31: 2, 14: 10, 7: 2}
Did not match all atoms present	5490-27-7	C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(CO)O.C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(CO)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O	{1: 4, 2: 4, 34: 4, 7: 4, 12: 28, 13: 2, 20: 22, 22: 4, 23: 4, 29: 6, 30: 8, 31: 2}
Did not match all atoms present	5490-31-3	C[NH+](C)CC/C=C\1/C2=CC=CC=C2C=CC3=C1C=C(C=C3)Cl.[Cl-]	{1: 2, 2: 2, 6: 1, 14: 9, 15: 1, 17: 2}
Did not match all atoms present	54902-67-9	CC1=CC(=NN1N=C(N)N)C.[N+](=O)(O)[O-]	{1: 2, 34: 1, 35: 1, 33: 1, 7: 1, 14: 1, 20: 1, 30: 2}
Did not match all atoms present	54909-56-7	CCCCOC(=O)C(=C)C.CC(=C)C(=O)[O-].N.[Na+]	{1: 3, 2: 3, 5: 2, 7: 2, 24: 1, 28: 1}
Did not match all atoms present	54911-02-3	C1CC2=CC=CC3=C2C=CC=C3CCC4=CC=CC5=C4C=CC=C51	{11: 4, 14: 12}
Did not match all atoms present	54914-85-1	CC1=CC(=CC=C1)OCCOC2=CC=CC(=C2)C	{1: 2, 2: 2, 22: 2, 14: 8}
Did not match all atoms present	54914-98-6	C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)[O-])N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{30: 1, 29: 9, 14: 4}
Did not match all atoms present	54919-49-2	CC[N+]1=C(OC2=C1C=C(C=C2)C3=CC=CC=C3)C.[I-]	{1: 2, 2: 1, 33: 1, 14: 8, 19: 1, 23: 1}
Did not match all atoms present	54922-12-2	C1CC2=C(C1)C3=C(CC3)C4=C2CCC4	{11: 8}
Did not match all atoms present	54923-07-8	[Tm-]	{}
Did not match all atoms present	54923-31-8	CC1=C(C=CC(=O)N1)Br	{32: 1, 1: 1, 18: 1, 14: 2, 25: 1}
Did not match all atoms present	54925-45-0	CONC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)O	{1: 1, 35: 3, 33: 1, 12: 4, 14: 2, 20: 2, 22: 1, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	54925-64-3	CC(C)(C)[Si](C)(C)N1C=CN=C1	{1: 5, 35: 1, 4: 1, 14: 3, 33: 1}
Did not match all atoms present	54929-05-4	CC1=CC(=C(C=C1C)N(C)C)N(C)C	{1: 6, 14: 2, 33: 2}
Did not match all atoms present	54929-09-8	CC(C)COC1=CC=C(C=C1)OC	{1: 3, 2: 1, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	54929-10-1	COC1=CC=C(C=C1)OCC2CC2	{1: 1, 2: 1, 11: 2, 12: 1, 14: 4, 22: 2}
Did not match all atoms present	54929-11-2	COC1=CC=C(C=C1)OC(C2CC2)C3CC3	{1: 1, 3: 1, 11: 4, 12: 2, 14: 4, 22: 2}
Did not match all atoms present	54932-72-8	CC1=C(C=CC(=C1)Br)Cl	{1: 1, 18: 1, 14: 3, 17: 1}
Did not match all atoms present	54932-77-3	CCC(C)C1=CC(=C(C=C1)C(C)CC)O	{1: 4, 2: 2, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	54932-78-4	CC(C)(C)C(C)(C)CC1=CC=C(C=C1)O	{1: 5, 2: 1, 4: 2, 21: 1, 14: 4}
Did not match all atoms present	54935-70-5	C[N-]C.C[N-]C.C[N-]C.C[N-]C.C[N-]C.C[N-]C.[W]	{1: 12, 34: 6}
Did not match all atoms present	54946-60-0	COC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{1: 1, 14: 9, 20: 1, 22: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	54950-20-8	COC(=O)CC(=O)C1=CN=CC=C1	{1: 1, 2: 1, 35: 1, 14: 4, 24: 1, 28: 1}
Did not match all atoms present	54951-54-1	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)C	{1: 3, 33: 1, 14: 4, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	54952-43-1	CC(=CCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)O)C	{1: 2, 2: 1, 3: 1, 6: 1, 7: 1, 14: 3, 15: 1, 20: 1, 21: 2, 25: 2}
Did not match all atoms present	54958-18-8	C[N+](C)(CC=C)CC=C.C=CC(=O)N.C=CN1CCCC1=O.[Cl-]	{1: 2, 2: 2, 5: 4, 6: 4, 33: 1, 11: 3, 17: 1, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	54959-35-2	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[K+].[Fe+3]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	5496-71-9	CCCCN(CCCC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CCCC)CCCC)C3=CC=C(C=C3)[N+](=C4C=CC(=[N+](CCCC)CCCC)C=C4)C5=CC=C(C=C5)N(CCCC)CCCC.[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[Sb].[Sb]	{1: 8, 2: 24, 33: 6, 14: 20, 15: 2, 16: 12}
Did not match all atoms present	54965-21-8	CCCSC1=CC2=C(C=C1)N=C(N2)NC(=O)OC	{32: 1, 1: 2, 2: 2, 35: 1, 40: 1, 14: 3, 28: 1, 31: 1}
Did not match all atoms present	54965-24-1	CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 5, 4: 1, 33: 1, 7: 2, 14: 14, 20: 1, 22: 1, 27: 3}
Did not match all atoms present	54975-08-5	CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(COCCO)O	{1: 1, 2: 5, 3: 1, 14: 4, 20: 4, 22: 1, 27: 2}
Did not match all atoms present	54976-38-4	CC(=CCO)C1=CC=CC=C1	{1: 1, 2: 1, 6: 1, 7: 1, 14: 5, 20: 1}
Did not match all atoms present	54979-21-4	CCC[Si](CCCCl)(Cl)Cl	{1: 1, 2: 5, 17: 3}
Did not match all atoms present	54983-54-9	CC1=CC(=CC(=C1Cl)C)[O-].[Na+]	{1: 2, 14: 2, 17: 1}
Did not match all atoms present	54983-89-0	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Ba+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	54993-39-4	CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].[Ca+2].[Ca+2].[Sr+2]	{24: 6, 1: 6, 2: 6}
Did not match all atoms present	55-03-8	C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)C[C@@H](C(=O)[O-])N.[Na+]	{2: 1, 3: 1, 14: 4, 19: 4, 21: 1, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	55-06-1	C1=CC(=C(C=C1OC2=C(C=C(C=C2I)C[C@@H](C(=O)[O-])N)I)I)O.[Na+]	{2: 1, 3: 1, 14: 5, 19: 3, 21: 1, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	55-10-7	COC1=C(C=CC(=C1)C(C(=O)O)O)O	{1: 1, 3: 1, 14: 3, 20: 1, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	55-21-0	C1=CC=C(C=C1)C(=O)N	{24: 1, 30: 1, 14: 5}
Did not match all atoms present	55-22-1	C1=CN=CC=C1C(=O)O	{35: 1, 27: 1, 14: 4}
Did not match all atoms present	55-27-6	C1=CC(=C(C=C1C(CN)O)O)O.Cl	{2: 1, 3: 1, 14: 3, 17: 1, 20: 1, 21: 2, 30: 1}
Did not match all atoms present	55-31-2	CNC[C@@H](C1=CC(=C(C=C1)O)O)O.Cl	{1: 1, 2: 1, 3: 1, 14: 3, 17: 1, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	55-37-8	CC1=CC(=CC(=C1SC)C)OP(=S)(OC)OC	{40: 1, 1: 5, 22: 3, 14: 2}
Did not match all atoms present	55-38-9	CC1=C(C=CC(=C1)OP(=S)(OC)OC)SC	{40: 1, 1: 4, 22: 3, 14: 3}
Did not match all atoms present	55-43-6	C1=CC=C(C=C1)CN(CCCl)CC2=CC=CC=C2.Cl	{17: 2, 2: 4, 14: 10, 33: 1}
Did not match all atoms present	55-48-1	CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3.OS(=O)(=O)O	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 5, 20: 3, 28: 1, 29: 2}
Did not match all atoms present	55-51-6	C1=CC=C(C=C1)CN(CCCl)CCCl	{17: 2, 2: 5, 14: 5, 33: 1}
Did not match all atoms present	55-52-7	CC(CC1=CC=CC=C1)NN	{1: 1, 2: 1, 3: 1, 14: 5, 30: 1, 31: 1}
Did not match all atoms present	55-56-1	C1=CC(=CC=C1N/C(=N/C(=NCCCCCCN=C(/N=C(/NC2=CC=C(C=C2)Cl)\N)N)N)/N)Cl	{2: 6, 7: 4, 34: 4, 14: 8, 17: 2, 30: 4, 31: 2}
Did not match all atoms present	55-57-2	C1=CC=C(C=C1)N=C(N)N=C(N)N.Cl	{17: 1, 34: 2, 30: 3, 14: 5, 7: 2}
Did not match all atoms present	55-63-0	C(C(CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{2: 2, 3: 1, 22: 3}
Did not match all atoms present	55-68-5	C1=CC=C(C=C1)[Hg]O[N+](=O)[O-]	{22: 1, 14: 5}
Did not match all atoms present	55-73-2	CNC(=NC)NCC1=CC=CC=C1	{1: 2, 2: 1, 7: 1, 34: 1, 14: 5, 31: 2}
Did not match all atoms present	55-80-1	CC1=CC(=CC=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	55-81-2	COC1=CC=C(C=C1)CCN	{1: 1, 2: 2, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	55-91-4	CC(C)OP(=O)(OC(C)C)F	{16: 1, 1: 4, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	55-92-5	CC(C[N+](C)(C)C)OC(=O)C	{1: 5, 2: 1, 3: 1, 28: 1}
Did not match all atoms present	55-93-6	C1=CSC(=C1)C(=O)N2C3=C(C=C(C=C3)N)C=N2	{33: 1, 35: 1, 41: 1, 14: 7, 24: 1, 30: 1}
Did not match all atoms present	55-98-1	CS(=O)(=O)OCCCCOS(=O)(=O)C	{1: 2, 2: 4, 29: 4, 22: 2}
Did not match all atoms present	55-99-2	CS(=O)(=O)SCCCCSS(=O)(=O)C	{40: 2, 1: 2, 2: 4, 29: 4}
Did not match all atoms present	550-10-7	CN1CCC2=CC3=C(C(=C2C1)OC)OCO3	{1: 2, 33: 1, 11: 4, 14: 1, 22: 1, 23: 2}
Did not match all atoms present	550-15-2	CCN1C(=CC2=CC(=NC(=[N+]2C)C3=CC=CC=C3)C)C=CC4=CC=CC=C41.[Cl-]	{1: 3, 2: 1, 35: 1, 6: 1, 33: 2, 14: 12, 15: 1, 17: 1}
Did not match all atoms present	550-28-7	CC(=C)CN1C(=CC(=O)N(C1=O)C)N	{1: 2, 2: 1, 5: 1, 7: 1, 14: 1, 25: 2, 33: 2, 30: 1}
Did not match all atoms present	550-33-4	C1=C2C(=NC=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 3, 20: 3, 23: 1}
Did not match all atoms present	550-34-5	CCN(CC)CCOC(=O)C1=CC=C(C2=CC=CC=C21)N.Cl	{1: 2, 2: 4, 33: 1, 14: 6, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	550-44-7	CN1C(=O)C2=CC=CC=C2C1=O	{1: 1, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	550-60-7	C1=CC=C2C(=C1)C=CC(=C2[N+](=O)[O-])O	{38: 1, 21: 1, 14: 6}
Did not match all atoms present	550-74-3	CC1=NN(C(=O)C1[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 2, 33: 1, 12: 1, 14: 4, 15: 1, 25: 1}
Did not match all atoms present	550-82-3	C1=CC2=C(C=C1O)OC3=CC(=O)C=CC3=[N+]2[O-]	{33: 1, 14: 6, 21: 1, 23: 1, 25: 1, 29: 1}
Did not match all atoms present	550-99-2	C1CN=C(N1)CC2=CC=CC3=CC=CC=C32.Cl	{32: 1, 2: 1, 35: 1, 11: 2, 14: 7, 15: 1, 17: 1}
Did not match all atoms present	55000-53-8	CCCCCCCCC1=CC=CC2=C(C=CC(=C21)C)C	{1: 3, 2: 7, 14: 5}
Did not match all atoms present	55000-55-0	CCCCCCC1=CC=CC2=C1C=C(C=C2)CCCC	{1: 2, 2: 8, 14: 6}
Did not match all atoms present	55000-56-1	CCCCCCC1=CC2=CC=CC=C2C=C1CCCC	{1: 2, 2: 8, 14: 6}
Did not match all atoms present	55009-84-2	CC(CSC1=CC=C(C=C1)Cl)C(=O)OC	{1: 2, 2: 1, 3: 1, 40: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	55011-46-6	C1(=NNN=N1)[N+](=O)[O-]	{32: 1, 35: 3, 38: 1}
Did not match all atoms present	55011-64-8	C(CO)N.NS(=O)(=O)O	{2: 2, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	55011-91-1	C(=S)(N)N.[N+](=O)(O)[O-]	{20: 1, 30: 2, 7: 1}
Did not match all atoms present	55012-69-6	CCC1=CC=C(C=C1)C(=O)C(C)(C)Cl	{1: 3, 2: 1, 4: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	55012-80-1	CC1=CC(=C(C=C1)C(C)C)O[Si](C)(C)C	{1: 6, 3: 1, 22: 1, 14: 3}
Did not match all atoms present	55019-74-4	CCCP1P(P(P(P1CCC)CCC)CCC)CCC	{1: 5, 2: 10}
Did not match all atoms present	55027-89-9	CC(C)C1=CC2=CC=CC=C2C=C(C1=O)C(C)C	{1: 4, 3: 2, 14: 6, 25: 1}
Did not match all atoms present	55027-90-2	CC1=C(C=C2CCC(=O)CCC2=C1)C	{1: 2, 11: 4, 14: 2, 25: 1}
Did not match all atoms present	55027-91-3	C1CCCC2=CC3=CC=CC=C3C=C(C2=O)CC1	{25: 1, 11: 6, 14: 6}
Did not match all atoms present	55027-92-4	CCC1=CC2=CC3=CC=CC=C3C=C2C=C(C1=O)CC	{1: 2, 2: 2, 14: 8, 25: 1}
Did not match all atoms present	55027-93-5	CC(C)C1=CC2=CC3=CC=CC=C3C=C2C=C(C1=O)C(C)C	{1: 4, 3: 2, 14: 8, 25: 1}
Did not match all atoms present	55028-71-2	C1[C@H]([C@H](C([C@H]1O)/C=C/[C@@H](COC2=CC=CC(=C2)C(F)(F)F)O)C/C=C/CCCC(=O)[O-])O.[Na+]	{2: 5, 3: 1, 4: 1, 6: 4, 11: 1, 12: 4, 14: 4, 16: 3, 20: 3, 22: 1, 24: 1}
Did not match all atoms present	5503-08-2	C[NH+]1CCC2=C(C1)C(C3=CC=CC=C23)C4=CC=CC=C4.[Cl-]	{1: 1, 11: 3, 12: 1, 14: 9, 15: 2, 17: 1}
Did not match all atoms present	5503-41-3	CC(=O)[O-].CC(=O)[O-].[Rh+2]	{24: 2, 1: 2}
Did not match all atoms present	5503-65-1	C1CC2CC1CCN2S(=O)(=O)C3=CC=CC=C3	{33: 1, 11: 5, 12: 2, 29: 2, 14: 5}
Did not match all atoms present	55030-78-9	P1=P[P]1	{}
Did not match all atoms present	55031-97-5	CC(=C)C(=O)OC.CC(=C)C(=O)OCCS(=O)(=O)O	{1: 3, 2: 2, 5: 2, 7: 2, 20: 1, 28: 2, 29: 2}
Did not match all atoms present	55034-69-0	CC1=CC(=C(C(=C1)Cl)NN)C	{1: 2, 31: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	55035-43-3	CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C=CC4=CC=C(C=C4)C=CC5=CC=C(C=C5)N(C6=CC=C(C=C6)C)C7=CC=C(C=C7)C	{1: 4, 14: 28, 6: 4, 33: 2}
Did not match all atoms present	55036-57-2	C1CN(CCN1CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=N5	{33: 2, 2: 2, 35: 1, 4: 1, 11: 4, 14: 19}
Did not match all atoms present	55038-01-2	C1=CC=C2C(=C1)C=C(O2)CO	{2: 1, 20: 1, 14: 5, 23: 1}
Did not match all atoms present	55039-14-0	CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)C)[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[Na+].[Na+].[Cr+3]	{1: 2, 34: 4, 38: 1, 14: 16, 24: 1, 29: 5, 31: 1}
Did not match all atoms present	5504-68-7	CC1=CC2=C(C=C1)N=C3N2C(=O)C4=CC=CC5=C4C3=CC=C5	{1: 1, 35: 1, 33: 1, 14: 9, 25: 1}
Did not match all atoms present	55040-91-0	CC(=O)NC(=S)N(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 33: 1, 7: 1, 14: 10, 24: 1, 31: 1}
Did not match all atoms present	55042-51-8	COC1=CC2=C(C=C1)NC=C2C(C3=CN=CC=C3)O	{32: 1, 1: 1, 3: 1, 14: 8, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	55044-52-5	CC1=CC=C(C=C1)C(=O)OCC2=CC=C(C=C2)C(=O)OC	{1: 2, 2: 1, 28: 2, 14: 8}
Did not match all atoms present	55044-79-6	CC(=C(C(=O)O[Si](C)(C)C)O[Si](C)(C)C)C	{1: 8, 28: 1, 22: 1, 7: 2}
Did not match all atoms present	55047-82-0	C1CC(=O)N=C1[O-].[Ag+]	{25: 1, 11: 2, 35: 1, 15: 1}
Did not match all atoms present	55048-24-3	C1COCCN1C2=C(C=C(C=C2)N)Cl	{33: 1, 11: 4, 14: 3, 17: 1, 23: 1, 30: 1}
Did not match all atoms present	55049-48-4	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.[Na+].[Na+].[Na+].[K+].[K+].[K+]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	5505-49-7	[2H]CC	{1: 2}
Did not match all atoms present	55062-09-4	CCCCC(CC)COP(OCCCCCCCCCC1=CC=CC=C1)OCCCCCCCCCC2=CC=CC=C2	{1: 2, 2: 23, 3: 1, 22: 3, 14: 10}
Did not match all atoms present	55066-45-0	CC(CCC1=CC=CC=C1)(C=C)O	{1: 1, 2: 2, 4: 1, 5: 1, 6: 1, 14: 5, 20: 1}
Did not match all atoms present	55076-09-0	COC1=CC2=C(C=C1CCC3=CC(=C(CC2)C=C3[N+](=O)[O-])[N+](=O)[O-])OC	{38: 2, 1: 2, 11: 4, 22: 2, 14: 4}
Did not match all atoms present	55076-10-3	COC1=CC2=C(C=C1CCC3=CC(=O)C(=CC3=O)CC2)OC	{1: 2, 11: 4, 14: 4, 15: 2, 22: 2, 25: 2}
Did not match all atoms present	55077-30-0	CC(C(=O)OCC[N+](C)(C)C)OC(=O)C.CC(C(=O)OCC[N+](C)(C)C)OC(=O)C.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-]	{1: 10, 2: 4, 3: 2, 14: 6, 28: 4, 29: 6}
Did not match all atoms present	55079-83-9	CC1=CC(=C(C(=C1/C=C/C(=C/C=C/C(=C/C(=O)O)/C)/C)C)C)OC	{1: 6, 6: 6, 7: 2, 14: 1, 22: 1, 27: 1}
Did not match all atoms present	5508-42-9	CS(=C1C(=O)C2=CC=CC=C2C1=O)C	{1: 2, 14: 4, 25: 2}
Did not match all atoms present	55080-20-1	CC(=O)N(C1=CC=CC2=C1C3=CC=CC=C3C2)O.CC(=O)[O-]	{1: 2, 33: 1, 11: 1, 14: 7, 20: 1, 24: 2}
Did not match all atoms present	55088-52-3	CCC(=C=O)C1=CC=CC=C1	{1: 1, 2: 1, 7: 1, 8: 1, 14: 5, 29: 1}
Did not match all atoms present	5509-65-9	C1=CC(=C(C(=C1)F)N)F	{16: 2, 30: 1, 14: 3}
Did not match all atoms present	55092-47-2	C1=CC=C(C=C1)C(=O)OCCCCCCl	{17: 1, 2: 5, 28: 1, 14: 5}
Did not match all atoms present	55097-80-8	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C6C(O6)C(C5O)O)C=C2	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	551-01-9	CCN(CC)CCCNC1=C2C(=CC(=C1)OC)C=CC=N2	{1: 3, 2: 5, 35: 1, 33: 1, 14: 5, 22: 1, 31: 1}
Did not match all atoms present	551-06-4	C1=CC=C2C(=C1)C=CC=C2N=C=S	{8: 1, 34: 1, 14: 7}
Did not match all atoms present	551-08-6	CCCC=C1C2=CC=CC=C2C(=O)O1	{1: 1, 2: 2, 6: 1, 14: 4, 15: 1, 28: 1}
Did not match all atoms present	551-09-7	C1=CC=C2C(=C1)C=CC=C2NCCN	{2: 2, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	551-62-2	C1=CC(=C(C(=C1F)F)F)F	{16: 4, 14: 2}
Did not match all atoms present	551-64-4	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Zn+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	551-76-8	CC1=C(C(=C(C=C1Cl)Cl)O)Cl	{1: 1, 21: 1, 14: 1, 17: 3}
Did not match all atoms present	551-78-0	CC1=CC(=C(C(=C1O)Cl)Cl)Cl	{1: 1, 21: 1, 14: 1, 17: 3}
Did not match all atoms present	551-92-8	CC1=NC=C(N1C)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 14: 1, 33: 1}
Did not match all atoms present	551-93-9	CC(=O)C1=CC=CC=C1N	{24: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	5510-87-2	CC1=CC=CC=C1P(Cl)Cl	{1: 1, 14: 4, 17: 2}
Did not match all atoms present	5510-88-3	CC1=CC(=CC=C1)P(Cl)Cl	{1: 1, 14: 4, 17: 2}
Did not match all atoms present	5510-99-6	CCC(C)C1=C(C(=CC=C1)C(C)CC)O	{1: 4, 2: 2, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	55102-19-7	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ru]	{17: 1, 14: 45}
Did not match all atoms present	55102-44-8	CC1(O[C@@H]2[C@H](OC([C@@H]2O1)NC(=O)N(CCCl)N=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C	{1: 2, 2: 3, 34: 1, 38: 1, 33: 1, 12: 4, 13: 1, 14: 4, 17: 1, 23: 3, 24: 1, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	55106-96-2	C1=C(C=C(C(=C1[N+](=O)[O-])N=NC2=C(C=C(C(=N2)N=NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{34: 4, 35: 1, 38: 8, 14: 5}
Did not match all atoms present	55116-09-1	C1=CC=C(C(=C1)CC(=O)Cl)Br	{24: 1, 17: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	55117-15-2	C1=CC(=C(C(=C1)Cl)CCl)F	{16: 1, 17: 2, 2: 1, 14: 3}
Did not match all atoms present	55118-19-9	CN1C(=CN=C1/C=C/2\CCC3=C(C2=O)C=CC(=C3)OCC[NH+](C)C)[N+](=O)[O-].OS(=O)(=O)[O-]	{1: 3, 2: 2, 35: 1, 38: 1, 6: 1, 33: 1, 11: 2, 14: 4, 15: 1, 20: 1, 22: 1, 25: 1, 29: 3}
Did not match all atoms present	55120-60-0	CC1=CC=C(C=C1)N(C)N=CC2(C(C3=CC=CC=C3N2C)(C)C)O	{1: 5, 34: 1, 6: 1, 33: 2, 13: 2, 14: 8, 20: 1}
Did not match all atoms present	55120-75-7	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ca+2]	{16: 6, 4: 2, 29: 6}
Did not match all atoms present	55120-77-9	[Li+].C(C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 13, 4: 6, 29: 3}
Did not match all atoms present	55124-14-6	B(CB(F)F)(F)F	{16: 4, 2: 1}
Did not match all atoms present	55124-90-8	CC(C)(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C	{1: 8, 2: 1, 4: 1, 22: 1, 28: 1}
Did not match all atoms present	55124-92-0	CC(C)C(C(=O)O[Si](C)(C)C)O[Si](C)(C)C	{1: 8, 3: 2, 28: 1, 22: 1}
Did not match all atoms present	55127-03-2	[Rb].[Bi]	{}
Did not match all atoms present	55127-80-5	CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4.C=CC(=O)O.C=CC(=O)O	{1: 2, 2: 2, 4: 1, 5: 2, 6: 2, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2, 27: 2}
Did not match all atoms present	55129-21-0	CC1=CC(=C(C=C1)C(C)C)OCCO	{1: 3, 2: 2, 3: 1, 14: 3, 20: 1, 22: 1}
Did not match all atoms present	55129-22-1	CC1=CC(=C(C=C1Cl)C(C)C)OCCO	{1: 3, 2: 2, 3: 1, 14: 2, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	55130-16-0	CCCCCCCCC=CCCCCCCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 15, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	55133-94-3	CC(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 2: 1, 3: 1, 28: 1, 22: 1}
Did not match all atoms present	55133-95-4	C[Si](C)(C)OCCCC(=O)O[Si](C)(C)C	{1: 6, 2: 3, 28: 1, 22: 1}
Did not match all atoms present	55142-85-3	C1CN(CC2=C1SC=C2)CC3=CC=CC=C3Cl	{33: 1, 2: 1, 41: 1, 11: 3, 14: 6, 17: 1}
Did not match all atoms present	55145-14-7	CC1=C(C(=O)OC2=C1C=CC(=C2)N(C)C)N3C(=O)C=CC3=O	{1: 3, 28: 1, 33: 2, 14: 5, 25: 2}
Did not match all atoms present	55147-59-6	C[Si](C)(C)N([Si](C)(C)C)[PbH2]N([Si](C)(C)C)[Si](C)(C)C	{1: 12, 33: 2}
Did not match all atoms present	55147-78-9	C[Si](C)(C)N([Si](C)(C)C)[SnH2]N([Si](C)(C)C)[Si](C)(C)C	{1: 12, 33: 2}
Did not match all atoms present	55147-80-3	CC(C)(C)N([Si](C)(C)C)[SnH2]N(C(C)(C)C)[Si](C)(C)C	{1: 12, 4: 2, 33: 2}
Did not match all atoms present	55147-81-4	CC(C)(C)N([Si](C)(C)C)[GeH2]N(C(C)(C)C)[Si](C)(C)C	{1: 12, 4: 2, 33: 2}
Did not match all atoms present	55147-94-9	O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cr+3]	{17: 3, 29: 12}
Did not match all atoms present	55153-02-1	CC1=C(C(=CC=C1)[N+](=O)[O-])C2=C(C=CC=C2[N+](=O)[O-])C	{1: 2, 38: 2, 14: 6}
Did not match all atoms present	55158-44-6	[Be].[Co].[Cu]	{}
Did not match all atoms present	5516-20-1	C1=CC=C2C(=C1)C=CC3=NN(N=C32)C4=CC(=C(C=C4)C=CC5=CC=C(C=C5)Cl)C#N	{33: 1, 35: 2, 37: 1, 6: 2, 14: 13, 17: 1}
Did not match all atoms present	5516-22-3	CCN(CC)C1=NC(=NC(=N1)NC2=CC3=C(C=C2)C=C(C(=O)O3)C4=CC=CC=C4)Cl	{1: 2, 2: 2, 35: 3, 33: 1, 14: 9, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	55162-41-9	CC(C)(C(=O)OC)OC1=CC=C(C=C1)Cl	{1: 3, 4: 1, 14: 4, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	55165-33-8	CC1=CC2=C(O1)C(=C3C(=C(C=CO3)OCC(C[NH+](CC4=CC=CC=C4)C(C)C)O)C2=O)OC.[Cl-]	{1: 4, 2: 3, 3: 2, 14: 8, 17: 1, 20: 1, 22: 2, 23: 2, 25: 1}
Did not match all atoms present	55168-74-6	COC(=O)C(=C)P(=O)(OC)OC	{1: 3, 5: 1, 7: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	5517-32-8	CC(C)(C)C1=C/C(=N\NC2=CC=C(C=C2)N=NC3=CC=CC=C3)/C(=O)C=C1	{1: 3, 34: 3, 4: 1, 14: 12, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	5517-62-4	COC1C2C(C(O1)COC(=O)C3=CC=CC=C3)OC(=O)O2	{1: 1, 2: 1, 12: 4, 14: 5, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	55179-31-2	CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3)O	{1: 3, 3: 2, 4: 1, 33: 1, 14: 11, 35: 2, 20: 1, 22: 1}
Did not match all atoms present	5518-52-5	C1=COC(=C1)P(C2=CC=CO2)C3=CC=CO3	{14: 9, 23: 3}
Did not match all atoms present	5518-62-7	C(CP)P	{2: 2}
Did not match all atoms present	55186-75-9	CC(=C)C1=CC=C(C=C1)C(F)(F)F	{1: 1, 4: 1, 5: 1, 7: 1, 14: 4, 16: 3}
Did not match all atoms present	55186-89-5	C1CN(CCNC1=O)CC2=CC=CC=C2	{32: 1, 33: 1, 2: 1, 11: 4, 14: 5, 25: 1}
Did not match all atoms present	5519-23-3	CCCCCCCCCCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 9, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	5519-42-6	CC1=C(NN=C1C)C	{32: 1, 1: 3, 35: 1}
Did not match all atoms present	55191-13-4	C[Si](C)(C)OC(=C)C(=O)O[Si](C)(C)C	{1: 6, 28: 1, 5: 1, 22: 1, 7: 1}
Did not match all atoms present	55191-36-1	CCCCCCCCCCCC(CCCCCCC)C1=CC=C(C=C1)C	{1: 3, 2: 16, 3: 1, 14: 4}
Did not match all atoms present	55191-63-4	CCCCCCCCCCCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 14, 14: 7}
Did not match all atoms present	552-16-9	C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]	{27: 1, 38: 1, 14: 4}
Did not match all atoms present	552-25-0	CCC(=O)N(CC(C)N(C)CCC1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 2: 4, 3: 1, 33: 2, 14: 10, 24: 1}
Did not match all atoms present	552-30-7	C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{27: 1, 28: 2, 14: 3}
Did not match all atoms present	552-32-9	CC(=O)NC1=CC=CC=C1[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	552-41-0	CC(=O)C1=C(C=C(C=C1)OC)O	{24: 1, 1: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	552-45-4	CC1=CC=CC=C1CCl	{1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	552-46-5	C1=CC=C2C(=C1)C=CC=C2N.Cl	{17: 1, 30: 1, 14: 7}
Did not match all atoms present	552-58-9	C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC(=C(C=C3)O)O	{11: 1, 12: 1, 14: 5, 21: 4, 23: 1, 25: 1}
Did not match all atoms present	552-59-0	COC1=CC(=C2C(=C1)OC=C(C2=O)C3=CC=C(C=C3)O)O	{1: 1, 14: 7, 21: 2, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	552-72-7	CN1C(CCCC1CC(C2=CC=CC=C2)O)CC(C3=CC=CC=C3)O	{1: 1, 2: 2, 3: 2, 33: 1, 11: 3, 12: 2, 14: 10, 20: 2}
Did not match all atoms present	552-79-4	C[C@@H]([C@@H](C1=CC=CC=C1)O)N(C)C	{1: 3, 3: 2, 20: 1, 14: 5, 33: 1}
Did not match all atoms present	552-80-7	C/C(=C(/C)\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O	{1: 2, 21: 2, 14: 8, 7: 2}
Did not match all atoms present	552-82-9	CN(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 14: 10, 33: 1}
Did not match all atoms present	552-86-3	C1=COC(=C1)C(C(=O)C2=CC=CO2)O	{24: 1, 3: 1, 20: 1, 14: 6, 23: 2}
Did not match all atoms present	552-89-6	C1=CC=C(C(=C1)C=O)[N+](=O)[O-]	{26: 1, 38: 1, 14: 4}
Did not match all atoms present	552-94-3	C1=CC=C(C(=C1)C(=O)OC2=CC=CC=C2C(=O)O)O	{27: 1, 28: 1, 21: 1, 14: 8}
Did not match all atoms present	5520-20-7	CC(C)N.C[Si](C)(C)O[Si](C)(CCCOS(=O)(=O)O)O[Si](C)(C)C	{1: 9, 2: 3, 3: 1, 20: 1, 22: 3, 29: 2, 30: 1}
Did not match all atoms present	5520-66-1	CCN(CC)C1=CC=C(C=C1)C(=O)C	{24: 1, 1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	55203-51-5	CC[N+]1=C(C(C2=C1C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)(C)C)C.[I-]	{1: 4, 2: 1, 33: 1, 13: 1, 14: 8, 15: 1, 19: 1, 29: 2}
Did not match all atoms present	55203-59-3	CC1=NC2=C(C1(C)C)C=C(C=C2)S(=O)(=O)C3=CC=CC=C3	{1: 3, 35: 1, 13: 1, 14: 8, 15: 1, 29: 2}
Did not match all atoms present	55203-60-6	CC(C)C(=NNC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2)C	{1: 3, 34: 1, 3: 1, 7: 1, 14: 9, 29: 2, 31: 1}
Did not match all atoms present	55203-66-2	CCN1C2=C(C=C(C=C2)S(=O)(=O)C3=CC=CC=C3)C(C1=CC=O)(C)C	{1: 3, 2: 1, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1, 26: 1, 29: 2}
Did not match all atoms present	55203-76-4	CCN1C2=C(C=C(C=C2)S(=O)(=O)C3=CC=CC=C3)C(C1=CC=C4C(=NOC4=O)C5=CC=CC=C5)(C)C	{1: 3, 2: 1, 35: 1, 6: 2, 33: 1, 13: 1, 14: 13, 15: 3, 28: 1, 29: 2}
Did not match all atoms present	55204-93-8	C1=CC=C(C(=C1)CN=C=O)Cl	{2: 1, 8: 1, 34: 1, 14: 4, 17: 1, 29: 1}
Did not match all atoms present	55208-38-3	CN1C2=C(C(=O)N(C1=O)C)NC=N2.N.N.N.N.N.[Cl-].[Cl-].[Cl-].[Ru+3]	{32: 1, 1: 2, 35: 1, 33: 2, 14: 1, 17: 3, 25: 2}
Did not match all atoms present	5521-55-1	CC1=NC=C(N=C1)C(=O)O	{1: 1, 27: 1, 14: 2, 35: 2}
Did not match all atoms present	55215-18-4	C1=CC(=C(C(=C1)Cl)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	55216-04-1	C[Sn](C)(SC1=CC=C(C=C1)Cl)SC2=CC=C(C=C2)Cl	{40: 2, 1: 2, 14: 8, 17: 2}
Did not match all atoms present	55216-72-3	CC[N+](C)(C)CCOC(=O)C(=C)C.CCOS(=O)(=O)[O-].C=CC(=O)N	{1: 5, 2: 4, 5: 2, 6: 1, 7: 1, 22: 1, 24: 1, 28: 1, 29: 3, 30: 1}
Did not match all atoms present	55219-65-3	CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)Cl)O	{1: 3, 3: 2, 4: 1, 33: 1, 14: 6, 17: 1, 35: 2, 20: 1, 22: 1}
Did not match all atoms present	5522-43-0	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	5522-63-4	CC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)C)CCC(=O)OC)C)CCC(=O)OC)CCC(=O)OC	{32: 2, 1: 8, 2: 8, 35: 2, 14: 4, 28: 4}
Did not match all atoms present	5522-66-7	CC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C=C)C)C=C	{32: 2, 1: 6, 2: 4, 35: 2, 5: 2, 6: 2, 14: 4, 28: 2}
Did not match all atoms present	5522-71-4	CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C=O)N2)N6)C=C)C)C)CCC(=O)OC)C4=N3)C(=O)OC)C	{32: 2, 1: 6, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 25: 1, 26: 1, 28: 2}
Did not match all atoms present	55225-88-2	C1=CC(=CC(=C1)SC(F)(F)F)N=C=O	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 40: 1, 29: 1}
Did not match all atoms present	5523-19-3	[B-]([S+](C)C)(Cl)(Cl)Cl	{1: 2, 17: 3}
Did not match all atoms present	55231-61-3	CC1=CC(=C(C(=C1CBr)C)CBr)C	{1: 3, 2: 2, 18: 2, 14: 1}
Did not match all atoms present	55235-80-8	C1C(O1)CCl.C1=CC=NC(=C1)N	{2: 1, 35: 1, 11: 1, 12: 1, 14: 4, 17: 1, 23: 1, 30: 1}
Did not match all atoms present	5524-57-2	CCOC(=O)C(=O)C1=C(C=C(C=C1C)C)C	{24: 1, 1: 4, 2: 1, 28: 1, 14: 2}
Did not match all atoms present	5524-60-7	C1CC12C3C=CC2C4C3C(=O)N(C4=O)/N=C/C5=C(C=C(C=C5)Cl)Cl	{33: 1, 34: 1, 6: 1, 11: 2, 12: 4, 13: 1, 14: 5, 17: 2, 25: 2}
Did not match all atoms present	55248-17-4	O.O.O.O.O.[O-]Cl.[O-]Cl.[Na+].[Na+]	{17: 2, 29: 2}
Did not match all atoms present	5525-95-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C(=C(C(=C3F)F)F)F)F	{16: 5, 14: 10}
Did not match all atoms present	55250-54-9	CC(C)NCC(COC1=CC=C(C=C1)CCOC)O.CC(C)NCC(COC1=CC=C(C=C1)CCOC)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 6, 2: 8, 3: 6, 14: 8, 20: 4, 22: 4, 27: 2, 31: 2}
Did not match all atoms present	55250-84-5	CC1=C(C=C2C(=C1)OC3=C(C24C5=CC=CC=C5C(=O)O4)C=CC(=C3)N(C)C6CCCCC6)NC7=CC=CC=C7	{1: 2, 33: 1, 11: 5, 12: 1, 13: 1, 14: 14, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	55254-34-7	COC1=C(C=CC(=C1)[C@@H]2[C@H](OC3=C(O2)C=C(C=C3)[C@@H]4[C@H](C(=O)C5=C(C=C(C=C5O4)O)O)OC(=O)CCC(=O)[O-])COC(=O)CCC(=O)[O-])O.[Na+].[Na+]	{1: 1, 2: 5, 12: 4, 14: 8, 21: 3, 22: 1, 23: 3, 24: 2, 25: 1, 28: 2}
Did not match all atoms present	55256-53-6	CC(C)(CCC1=C2C(=C(C=C1)O)C(=O)C3=C(C4=C(C=C3O2)O[C@@H]5[C@]4(C=CO5)O)O)O	{1: 2, 2: 2, 4: 1, 12: 1, 13: 1, 14: 5, 20: 2, 21: 2, 23: 3, 25: 1}
Did not match all atoms present	55257-99-3	CN1C2CCC1C3=CC=CC=C23	{1: 1, 11: 2, 12: 2, 14: 4, 33: 1}
Did not match all atoms present	55258-00-9	CN1C2C=CC1C3=CC=CC=C23	{1: 1, 12: 2, 14: 6, 33: 1}
Did not match all atoms present	55259-49-9	CC1=C([Se]C(=C2[Se]C(=C([Se]2)C)C)[Se]1)C	{1: 4, 15: 6}
Did not match all atoms present	55268-74-1	C1CCC(CC1)C(=O)N2CC3C4=CC=CC=C4CCN3C(=O)C2	{33: 2, 11: 9, 12: 2, 14: 4, 24: 1, 25: 1}
Did not match all atoms present	55268-75-2	CON=C(C1=CC=CO1)C(=O)NC2C3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)O	{1: 1, 2: 1, 33: 1, 7: 1, 41: 1, 11: 1, 12: 2, 34: 1, 14: 3, 15: 2, 22: 1, 23: 1, 24: 1, 25: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	5527-95-7	C1=CC(=C(C=C1C=O)F)Cl	{16: 1, 17: 1, 26: 1, 14: 3}
Did not match all atoms present	55270-71-8	C1=CC=C(C(=C1)C(=O)C2=CC=CC=C2Cl)O	{24: 1, 17: 1, 21: 1, 14: 8}
Did not match all atoms present	55281-23-7	CN(CCO)S(=O)(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 2, 33: 1, 14: 4, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	55283-68-6	CCN(CC(=C)C)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]	{1: 2, 2: 2, 4: 1, 5: 1, 38: 2, 7: 1, 14: 2, 16: 3, 33: 1}
Did not match all atoms present	55285-05-7	CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SN3CCOCC3)C	{1: 3, 33: 2, 40: 1, 11: 5, 13: 1, 14: 3, 23: 2, 28: 1}
Did not match all atoms present	55285-14-8	CCCCN(CCCC)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C	{1: 5, 2: 6, 33: 2, 40: 1, 11: 1, 13: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	55289-35-5	CC1=C(C=CC=C1Br)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	55289-36-6	CC1=C(C=CC=C1Br)N	{1: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	55289-50-4	[Li+].CC(C)(CO)C(C(=O)[O-])O	{1: 2, 2: 1, 3: 1, 4: 1, 20: 2, 24: 1}
Did not match all atoms present	55290-64-7	CC1=C(S(=O)(=O)CCS1(=O)=O)C	{1: 2, 11: 2, 29: 4, 15: 2}
Did not match all atoms present	55294-15-0	CC(C1=CC(=C(C=C1)Cl)Cl)N2C(=O)CC(=N2)N	{1: 1, 3: 1, 33: 1, 11: 1, 14: 3, 15: 1, 17: 2, 35: 1, 25: 1, 30: 1}
Did not match all atoms present	55295-70-0	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1CO1.C1C(O1)CCl	{1: 2, 2: 1, 4: 1, 11: 3, 12: 1, 14: 8, 17: 1, 21: 2, 23: 2}
Did not match all atoms present	55296-90-7	C1=CC=C(C=C1)CCCN(CCC#N)C2=CC=C(C=C2)N=NC3=NC=C(S3)[N+](=O)[O-]	{33: 1, 2: 5, 35: 1, 37: 1, 38: 1, 41: 1, 34: 2, 14: 10}
Did not match all atoms present	55299-24-6	C[Si](C)(C)N1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3	{1: 3, 35: 1, 33: 1, 11: 1, 14: 8, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	553-03-7	C1CC(=O)NC2=CC=CC=C21	{32: 1, 25: 1, 11: 2, 14: 4}
Did not match all atoms present	553-06-0	C1=CC=C(C=C1)CC(C2=CC=CC=C2)NC(=O)C3=CN=CC=C3	{2: 1, 35: 1, 14: 14, 3: 1, 24: 1, 31: 1}
Did not match all atoms present	553-12-8	CC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)O)CCC(=O)O)C)C=C)C)C=C	{32: 2, 1: 4, 2: 4, 35: 2, 5: 2, 6: 2, 14: 4, 27: 2}
Did not match all atoms present	553-17-3	COC1=CC=CC=C1OC(=O)OC2=CC=CC=C2OC	{1: 2, 22: 2, 14: 8}
Did not match all atoms present	553-19-5	CC1(C=CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)C	{1: 2, 28: 1, 13: 1, 14: 6, 23: 1}
Did not match all atoms present	553-20-8	CCCOC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C	{1: 2, 2: 2, 38: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	553-24-2	CC1=CC2=NC3=C(C=C(C=C3)N(C)C)N=C2C=C1N.Cl	{1: 3, 35: 2, 33: 1, 14: 5, 17: 1, 30: 1}
Did not match all atoms present	553-26-4	C1=CN=CC=C1C2=CC=NC=C2	{35: 2, 14: 8}
Did not match all atoms present	553-27-5	C1=CC=C(C=C1)N(CCCl)CCCl	{17: 2, 2: 4, 14: 5, 33: 1}
Did not match all atoms present	553-30-0	C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.OS(=O)(=O)O	{30: 2, 35: 1, 20: 2, 29: 2, 14: 7}
Did not match all atoms present	553-39-9	C1=CC2=C(C=CC(=C2)O)C=C1CCC(=O)O	{2: 2, 27: 1, 21: 1, 14: 6}
Did not match all atoms present	553-53-7	C1=CC(=CN=C1)C(=O)NN	{24: 1, 35: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	553-54-8	[Li+].C1=CC=C(C=C1)C(=O)[O-]	{24: 1, 14: 5}
Did not match all atoms present	553-60-6	CC(C)OC(=O)C1=CN=CC=C1	{1: 2, 3: 1, 28: 1, 14: 4, 35: 1}
Did not match all atoms present	553-68-4	CC(C)CNCCOC(=O)C1=CC=C(C=C1)N.Cl	{1: 2, 2: 3, 3: 1, 14: 4, 17: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	553-69-5	C1=CC=C(C=C1)C(CNC2=CC=CC=N2)O	{2: 1, 35: 1, 14: 9, 3: 1, 20: 1, 31: 1}
Did not match all atoms present	553-79-7	CCCOC1=C(C=C(C=C1)[N+](=O)[O-])N	{1: 1, 2: 2, 38: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	553-82-2	COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	553-84-4	CC(C)CCC(=O)C1=COC=C1	{1: 2, 2: 2, 3: 1, 14: 3, 23: 1, 24: 1}
Did not match all atoms present	553-86-6	C1C2=CC=CC=C2OC1=O	{11: 1, 28: 1, 14: 4}
Did not match all atoms present	553-94-6	CC1=CC(=C(C=C1)C)Br	{1: 2, 18: 1, 14: 3}
Did not match all atoms present	55301-58-1	CCOC(=O)C(CC1=CC=C(C=C1)OC)O	{1: 2, 2: 2, 3: 1, 14: 4, 20: 1, 22: 1, 28: 1}
Did not match all atoms present	55304-75-1	C1=CC(=NC(=C1C(F)(F)F)Cl)Cl	{16: 3, 17: 2, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	55308-37-7	COC1=CC=CC(=C1)C2=NN3CCC4=CC=CC=C4C3=N2	{1: 1, 35: 2, 33: 1, 11: 2, 14: 8, 22: 1}
Did not match all atoms present	55308-57-1	C1CN2C(=NC(=N2)C3=CC=CC=C3)C4=CC=CC=C41	{33: 1, 11: 2, 14: 9, 35: 2}
Did not match all atoms present	55308-64-0	CCOC1=CC=CC(=C1)C2=NN3CCC4=CC=CC=C4C3=N2	{1: 1, 2: 1, 35: 2, 33: 1, 11: 2, 14: 8, 22: 1}
Did not match all atoms present	55309-14-3	COC1=CC=CC(=C1)C2=NN3C=CC4=CC=CC=C4C3=N2	{1: 1, 35: 2, 22: 1, 14: 10, 33: 1}
Did not match all atoms present	5531-65-7	CCCCCCCCCCCCCCCCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 17, 28: 1, 14: 5}
Did not match all atoms present	55310-46-8	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].[Na+]	{33: 1, 2: 2, 14: 10, 7: 1}
Did not match all atoms present	5532-86-5	C1=CC=C(C=C1)COC(=O)C#N	{2: 1, 28: 1, 37: 1, 14: 5}
Did not match all atoms present	5532-90-1	CCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	55320-54-2	[2H]C1(CCC(CC1)O)[2H]	{20: 1, 11: 5, 12: 1}
Did not match all atoms present	55321-99-8	C1=CN=C(C(=O)N1)C(=O)N	{32: 1, 35: 1, 14: 2, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	55327-54-3	C1=CC(=CC=C1C=NC2=CC=C(C=C2)Cl)Br	{17: 1, 18: 1, 34: 1, 14: 8, 6: 1}
Did not match all atoms present	5533-38-0	CN1C2=CC=CC=C2N=C1S(=O)(=O)O	{1: 1, 35: 1, 33: 1, 14: 4, 20: 1, 29: 2}
Did not match all atoms present	55334-51-5	COC(=O)C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)C(=O)OC	{1: 2, 2: 1, 28: 3, 14: 8}
Did not match all atoms present	55334-57-1	C1=CC=C(C=C1)CCC(=CCC2=CC=CC=C2)CCC3=CC=CC=C3	{2: 5, 14: 15, 6: 1, 7: 1}
Did not match all atoms present	55335-06-3	C1=C(C(=NC(=C1Cl)Cl)OCC(=O)O)Cl	{2: 1, 35: 1, 14: 1, 17: 3, 22: 1, 27: 1}
Did not match all atoms present	55340-64-2	CC(C(C1=CC=CC=C1)OP(=O)(O)O)NC	{1: 2, 3: 2, 14: 5, 20: 2, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	55343-67-4	[O-2].[V].[Cs+]	{}
Did not match all atoms present	55345-44-3	C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=CC=CC4=C3C(=O)C5=C(C4=O)C(=CC=C5)NC6=CC=C(C=C6)OC7=CC=CC=C7	{25: 2, 22: 2, 14: 24, 31: 2}
Did not match all atoms present	5535-48-8	C=CS(=O)(=O)C1=CC=CC=C1	{14: 5, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	5535-49-9	C1=CC=C(C=C1)SCCCl	{40: 1, 17: 1, 2: 2, 14: 5}
Did not match all atoms present	5535-52-4	CC1=CC=C(C=C1)S(=O)(=O)C=C	{1: 1, 14: 4, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	5536-16-3	CCCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[O-]Cl(=O)(=O)=O	{1: 4, 2: 21, 29: 4, 17: 1}
Did not match all atoms present	5536-17-4	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	5536-61-8	CC(=C)C(=O)[O-].[Na+]	{24: 1, 1: 1, 5: 1, 7: 1}
Did not match all atoms present	55372-76-4	CC1=C(C=CC(=C1)N/N=C/2\C(=O)C(=CC3=C2C=CC(=C3)S(=O)(=O)O)S(=O)(=O)O)C4=C(C=C(C=C4)N/N=C/5\C(=O)C(=CC6=C5C=CC(=C6)S(=O)(=O)O)S(=O)(=O)O)C	{1: 2, 34: 2, 14: 14, 15: 4, 20: 4, 25: 2, 29: 8, 31: 2}
Did not match all atoms present	55379-84-5	CC(=O)NC1=CC(=CC=C1)N(CCC#N)CCO	{1: 1, 2: 4, 37: 1, 33: 1, 14: 4, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	5538-41-0	CC1=CC(=C(C(=C1)O)Cl)C	{1: 2, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	5538-51-2	CC(=O)OC1=CC=CC=C1C(=O)Cl	{24: 1, 1: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	5538-94-3	CCCCCCCC[N+](C)(C)CCCCCCCC.[Cl-]	{1: 4, 2: 14, 17: 1}
Did not match all atoms present	55382-85-9	B(C1CCCCC1)(C2CCCCC2)I	{19: 1, 11: 10, 12: 2}
Did not match all atoms present	55395-25-0	CC=[Si](C)C	{1: 3, 6: 1}
Did not match all atoms present	55398-24-8	CCN(C1=CC=C(C=C1)N=NC2=CC=CC=C2)OC(=O)C3=CC=CC=C3	{1: 1, 2: 1, 33: 1, 34: 2, 14: 14, 28: 1}
Did not match all atoms present	55398-25-9	CC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)OC(=O)C3=CC=CC=C3	{1: 2, 34: 2, 28: 1, 14: 13, 33: 1}
Did not match all atoms present	55398-26-0	CCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)OC(=O)C3=CC=CC=C3	{1: 2, 2: 1, 33: 1, 34: 2, 14: 13, 28: 1}
Did not match all atoms present	55398-27-1	CCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC	{1: 2, 2: 1, 34: 2, 14: 8, 31: 1}
Did not match all atoms present	554-00-7	C1=CC(=C(C=C1Cl)Cl)N	{17: 2, 30: 1, 14: 3}
Did not match all atoms present	554-01-8	CC1=C(NC(=O)N=C1)N	{32: 1, 1: 1, 35: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	554-13-2	[Li+].[Li+].C(=O)([O-])[O-]	{24: 1}
Did not match all atoms present	554-14-3	CC1=CC=CS1	{1: 1, 14: 3, 41: 1}
Did not match all atoms present	554-18-7	C1=CC(=CC=C1NC(C(C(C(C(CO)O)O)O)O)S(=O)(=O)O)S(=O)(=O)C2=CC=C(C=C2)NC(C(C(C(C(CO)O)O)O)O)S(=O)(=O)O	{2: 2, 3: 10, 14: 8, 20: 12, 29: 6, 31: 2}
Did not match all atoms present	554-52-9	COC1=C(C=CC(=C1)CCN)O	{1: 1, 2: 2, 14: 3, 21: 1, 22: 1, 30: 1}
Did not match all atoms present	554-57-4	CC(=O)N=C1N(N=C(S1)S(=O)(=O)N)C	{1: 2, 34: 1, 35: 1, 33: 1, 41: 1, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	554-70-1	CCP(CC)CC	{1: 3, 2: 3}
Did not match all atoms present	554-73-4	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]	{34: 2, 29: 3, 14: 13, 31: 1}
Did not match all atoms present	554-76-7	C1=CC(=CC=C1N)[Sb](=O)(O)O	{30: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	554-84-7	C1=CC(=CC(=C1)O)[N+](=O)[O-]	{38: 1, 21: 1, 14: 4}
Did not match all atoms present	554-92-7	CN(C)CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC.Cl	{1: 5, 2: 3, 33: 1, 14: 6, 17: 1, 22: 4, 24: 1, 31: 1}
Did not match all atoms present	554-95-0	C1=C(C=C(C=C1C(=O)O)C(=O)O)C(=O)O	{27: 3, 14: 3}
Did not match all atoms present	554-99-4	CN(C)CC(C1=CC(=C(C=C1)O)O)O	{1: 2, 2: 1, 3: 1, 33: 1, 14: 3, 20: 1, 21: 2}
Did not match all atoms present	55403-91-3	C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl	{17: 1, 11: 4, 38: 1, 14: 3, 33: 1}
Did not match all atoms present	55406-13-8	CC1=C(SC=C1)C#N	{1: 1, 37: 1, 14: 2, 41: 1}
Did not match all atoms present	55408-49-6	C1=CC=C2C(=C1)C3=CC=CC=C3C4=NC(=C(N=C24)C#N)C#N	{35: 2, 37: 2, 14: 8}
Did not match all atoms present	55418-52-5	CC(=O)CCC1=CC2=C(C=C1)OCO2	{1: 1, 2: 2, 11: 1, 14: 3, 23: 2, 24: 1}
Did not match all atoms present	5542-28-9	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C5N=CN=C6N)O)O)O)O	{33: 2, 2: 2, 35: 6, 12: 8, 14: 4, 20: 8, 22: 5, 23: 2, 29: 4, 30: 2}
Did not match all atoms present	55425-27-9	C1=CC=C2C(=C1)N(/C(=C\C3=[N+](C4=CC=CC=C4[Se]3)CCCS(=O)(=O)[O-])/[Se]2)CCCS(=O)(=O)[O-].[Na+]	{33: 2, 2: 6, 6: 1, 14: 8, 15: 1, 29: 6}
Did not match all atoms present	55425-38-2	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C2=NNC4=NC=NN4	{32: 1, 34: 1, 35: 3, 14: 10, 15: 2, 31: 1}
Did not match all atoms present	55426-39-6	C=O.C1=CC=C(C=C1)[O-].[NH4+]	{5: 1, 14: 5}
Did not match all atoms present	55429-29-3	C[Si](C)(C)O[As](O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 22: 3}
Did not match all atoms present	5543-31-7	CC(=O)OCC1=NC(=NO1)C2=CC=CC=C2	{1: 1, 2: 1, 35: 2, 14: 5, 23: 1, 28: 1}
Did not match all atoms present	55435-71-7	C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl	{33: 1, 38: 1, 11: 4, 14: 3, 17: 1, 23: 1}
Did not match all atoms present	5544-25-2	CC1=C(C2=C(C=C1)C(=O)N3C=C(C[C@H]3[C@H](N2)OC)/C=C/C(=O)N)O	{32: 1, 1: 2, 6: 2, 33: 1, 11: 1, 12: 2, 14: 3, 15: 1, 21: 1, 22: 1, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	55440-55-6	COC1=CC(=C(C=C1N=C=O)Cl)OC	{1: 2, 34: 1, 8: 1, 14: 2, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	55447-00-2	CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC2=CC=CC=C21)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 7, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	55449-46-2	C[C@H](CC1=CC=CC=C1)Cl	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	55467-31-7	CC[C@@H](C)C(C(=O)O)NC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C(CO)NC(=O)C([C@@H](C)O)NC(=O)C(CC(CCN)O)NC(=O)C(CC(=O)N)NC(=O)C(CC(=O)N)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)C(CC(=O)N)NC(=O)CC(CCCCCC(C)C)O	{32: 1, 1: 9, 2: 15, 3: 17, 14: 5, 20: 4, 24: 13, 27: 1, 30: 4, 31: 10}
Did not match all atoms present	55469-25-5	CCCCCCCCCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 8, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	55474-90-3	CC1=CC(=NC(=N1)NC#N)C	{1: 2, 35: 2, 37: 1, 14: 1, 31: 1}
Did not match all atoms present	55477-20-8	CC(C)(C)NC1=NC(=C(C(=N1)Cl)SC)N2CCN(CC2)C	{1: 5, 35: 2, 4: 1, 33: 2, 40: 1, 11: 4, 17: 1, 31: 1}
Did not match all atoms present	55477-27-5	CNC1=NC(=C(C(=N1)Cl)SC)N2CCN(CC2)CCO	{1: 2, 2: 2, 35: 2, 33: 2, 40: 1, 11: 4, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	55477-35-5	CC1=C(N=C(NC1=O)N)O	{32: 1, 1: 1, 35: 1, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	55479-14-6	CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 6: 1, 33: 2, 41: 1, 14: 14, 15: 1, 29: 3}
Did not match all atoms present	55482-31-0	C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].[Ba+2]	{38: 2, 29: 3, 14: 4}
Did not match all atoms present	55484-55-4	C1=CC=C(C=C1)C2=C3C=CC=C(C3=NC=C2)N	{35: 1, 30: 1, 14: 10}
Did not match all atoms present	55484-87-2	[Cl-].[Cl-].[Cl-].[Es]	{17: 3}
Did not match all atoms present	55488-18-1	C=CC(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].[Fe+3]	{24: 3, 5: 3, 6: 3}
Did not match all atoms present	55488-87-4	C(=O)(C(=O)O)O.N.[Fe+3]	{27: 2}
Did not match all atoms present	55489-49-1	CC[NH+](CC)CC(=O)NC1=CC(=CC=C1)Cl.[Cl-]	{1: 2, 2: 3, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	5549-54-2	CC(=NNC1=NC2=CC=CC=C2S1)C	{1: 2, 34: 1, 35: 1, 7: 1, 41: 1, 14: 4, 31: 1}
Did not match all atoms present	55490-03-4	CC1=CC=C(C=C1)S(=O)(=O)C(C(=O)N)Br	{1: 1, 3: 1, 14: 4, 18: 1, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	55491-44-6	CC1=CC(=C(C=C1)N/N=C\2/C(=O)C(=CC3=CC=CC=C23)C(=O)[O-])S(=O)(=O)[O-].CC1=CC(=C(C=C1)N/N=C\2/C(=O)C(=CC3=CC=CC=C23)C(=O)[O-])S(=O)(=O)[O-].[Ca+2].[Sr+2]	{1: 2, 34: 2, 14: 16, 15: 4, 24: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	55492-08-5	CCCCOC(=O)C=C.CC(=C)C1=CC=CC=C1.C=CC(=O)O	{1: 2, 2: 3, 5: 3, 6: 2, 7: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	55493-89-5	COC(=O)CNC(=O)C1=CC=CC=C1O	{1: 1, 2: 1, 14: 4, 21: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	55494-04-7	C[Si](C)(C)OC(=O)CC(=C)C(=O)O[Si](C)(C)C	{1: 6, 2: 1, 28: 2, 5: 1, 7: 1}
Did not match all atoms present	55494-06-9	CCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 6, 28: 1}
Did not match all atoms present	55494-07-0	C[Si](C)(C)OC(=O)CCCC(=O)O[Si](C)(C)C	{1: 6, 2: 3, 28: 2}
Did not match all atoms present	55494-15-0	CCCCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 8, 28: 1}
Did not match all atoms present	55496-55-4	CNCCC1=CC=NC=C1	{1: 1, 2: 2, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	55499-43-9	B(C1=CC(=C(C=C1)C)C)(O)O	{1: 2, 20: 2, 14: 3}
Did not match all atoms present	555-03-3	COC1=CC=CC(=C1)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	555-06-6	C1=CC(=CC=C1C(=O)[O-])N.[Na+]	{24: 1, 30: 1, 14: 4}
Did not match all atoms present	555-15-7	C1=C(OC(=C1)[N+](=O)[O-])C=NO	{34: 1, 6: 1, 38: 1, 14: 2, 20: 1, 23: 1}
Did not match all atoms present	555-16-8	C1=CC(=CC=C1C=O)[N+](=O)[O-]	{26: 1, 38: 1, 14: 4}
Did not match all atoms present	555-21-5	C1=CC(=CC=C1CC#N)[N+](=O)[O-]	{2: 1, 38: 1, 37: 1, 14: 4}
Did not match all atoms present	555-30-6	C[C@](CC1=CC(=C(C=C1)O)O)(C(=O)O)N	{1: 1, 2: 1, 4: 1, 14: 3, 21: 2, 27: 1, 30: 1}
Did not match all atoms present	555-35-1	CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC(=O)[O-].[Al+3]	{24: 3, 1: 3, 2: 42}
Did not match all atoms present	555-37-3	CCCCN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl	{1: 2, 2: 3, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	555-48-6	C1=CC=C(C=C1)NC(=O)CN	{24: 1, 2: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	555-57-7	CN(CC#C)CC1=CC=CC=C1	{1: 1, 2: 2, 33: 1, 9: 1, 10: 1, 14: 5}
Did not match all atoms present	555-59-9	C1=CC=C(C=C1)NC(=O)/C=C\C(=O)O	{24: 1, 27: 1, 14: 5, 6: 2, 31: 1}
Did not match all atoms present	555-60-2	C1=CC(=CC(=C1)Cl)NN=C(C#N)C#N	{34: 1, 37: 2, 7: 1, 14: 4, 17: 1, 31: 1}
Did not match all atoms present	555-65-7	C1=CC(=C(C=C1CON)O)Br	{2: 1, 14: 3, 18: 1, 21: 1, 22: 1, 30: 1}
Did not match all atoms present	555-66-8	CCCCC/C=C/C(=O)CCC1=CC(=C(C=C1)O)OC	{1: 2, 2: 6, 6: 2, 14: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	555-68-0	C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)O	{38: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	555-75-9	CC[O-].CC[O-].CC[O-].[Al+3]	{1: 3, 2: 3, 29: 3}
Did not match all atoms present	555-84-0	C1CN(C(=O)N1)/N=C/C2=CC=C(O2)[N+](=O)[O-]	{32: 1, 33: 1, 34: 1, 38: 1, 6: 1, 11: 2, 14: 2, 23: 1, 25: 1}
Did not match all atoms present	555-89-5	C1=CC(=CC=C1OCOC2=CC=C(C=C2)Cl)Cl	{17: 2, 2: 1, 22: 2, 14: 8}
Did not match all atoms present	555-96-4	C1=CC=C(C=C1)CNN	{2: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	5550-12-9	C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)([O-])[O-])O)O)NC(=NC2=O)N.[Na+].[Na+]	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 1, 20: 2, 22: 1, 23: 1, 25: 1, 29: 3, 30: 1}
Did not match all atoms present	55502-53-9	C(C(=O)Cl)OC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 17: 1, 2: 1, 22: 1, 24: 1}
Did not match all atoms present	55507-27-2	C1=CC=C(C=C1)N2C3C(C(=O)C4=CC=CC=C34)N=N2	{25: 1, 35: 2, 12: 2, 14: 9, 33: 1}
Did not match all atoms present	55507-28-3	COC1=CC=C(C=C1)N2C3C(C(=O)C4=CC=CC=C34)N=N2	{1: 1, 35: 2, 33: 1, 12: 2, 14: 8, 22: 1, 25: 1}
Did not match all atoms present	55507-29-4	C1=CC=C2C(=C1)C3C(C2=O)N=NN3C4=CC=C(C=C4)[N+](=O)[O-]	{33: 1, 35: 2, 38: 1, 12: 2, 14: 8, 25: 1}
Did not match all atoms present	55507-30-7	CN1C2C(C(=O)C3=CC=CC=C23)N=N1	{1: 1, 35: 2, 33: 1, 12: 2, 14: 4, 25: 1}
Did not match all atoms present	55507-31-8	CCCCN1C2C(C(=O)C3=CC=CC=C23)N=N1	{1: 1, 2: 3, 35: 2, 33: 1, 12: 2, 14: 4, 25: 1}
Did not match all atoms present	55507-32-9	COC1=CC=C(C=C1)N2C3C2C(=O)C4=CC=CC=C34	{1: 1, 33: 1, 12: 2, 14: 8, 22: 1, 25: 1}
Did not match all atoms present	55507-33-0	C1=CC=C2C(=C1)C3C(C2=O)N3C4=CC=C(C=C4)[N+](=O)[O-]	{25: 1, 12: 2, 38: 1, 14: 8, 33: 1}
Did not match all atoms present	55509-78-9	C(C[Se](=O)O)C(=O)O	{2: 2, 27: 1, 20: 1, 29: 1}
Did not match all atoms present	55511-98-3	CC(C)(C)C1=NN=C(S1)N2C(CN(C2=O)C)O	{1: 4, 35: 2, 4: 1, 33: 2, 41: 1, 11: 1, 12: 1, 20: 1, 25: 1}
Did not match all atoms present	55512-33-9	CCCCCCCCSC(=O)OC1=CC(=NN=C1C2=CC=CC=C2)Cl	{1: 1, 2: 7, 35: 2, 40: 1, 14: 6, 17: 1, 28: 1}
Did not match all atoms present	55514-14-2	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=C(SC2=CC=CC=C21)SC	{1: 3, 33: 1, 40: 1, 41: 1, 14: 8, 29: 3}
Did not match all atoms present	55516-54-6	C1=CC=C2C(=C1)C=CC=C2C[C@@H](C(=O)O)N	{27: 1, 2: 1, 3: 1, 30: 1, 14: 7}
Did not match all atoms present	55517-40-3	C[Si](C)(C)OCC1=CC=C(O1)C(=O)O[Si](C)(C)C	{1: 6, 2: 1, 14: 2, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	55517-47-0	COC1=CC(=C(C=C1)O[Si](C)(C)C)C(=O)O[Si](C)(C)C	{1: 7, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	55520-67-7	C=CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O	{32: 1, 33: 1, 2: 1, 5: 1, 6: 1, 11: 1, 12: 3, 14: 1, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	55520-89-3	CCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 14, 28: 1}
Did not match all atoms present	55526-24-4	CCN(CC)C1=CC2=C(C=C1)C=CC3(O2)C(=CC4=CC=CC=C4O3)C5=CC=CC=C5	{1: 2, 2: 2, 33: 1, 13: 1, 14: 15, 15: 1, 23: 2}
Did not match all atoms present	55526-73-3	CC(C)(C)C1=CC=C(C=C1)OP(=NC2CCCCC2)(OC3=CC=C(C=C3)C(C)(C)C)S	{1: 6, 34: 1, 4: 2, 39: 1, 11: 5, 12: 1, 14: 8, 22: 2}
Did not match all atoms present	55526-94-8	CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCCS(=O)(=O)[O-]	{1: 1, 2: 4, 33: 1, 14: 8, 23: 1, 29: 3}
Did not match all atoms present	55526-95-9	CC1=[N+](C2=CC=CC=C2S1)CCCCS(=O)(=O)[O-]	{1: 1, 2: 4, 33: 1, 41: 1, 14: 4, 29: 3}
Did not match all atoms present	55527-36-1	CC(C)C(C(C)(C)CO)O.CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O	{1: 5, 2: 2, 3: 3, 4: 1, 14: 6, 20: 4, 27: 2, 28: 2}
Did not match all atoms present	55527-79-2	C1=CC=C(C=C1)CN2C3C(C(=O)C4=CC=CC=C34)N=N2	{33: 1, 2: 1, 35: 2, 12: 2, 14: 9, 25: 1}
Did not match all atoms present	55527-82-7	C[C-]1[CH-][CH-][CH-][CH-][CH-]1.CC1=CC=CC=C1.[Ti]	{1: 2, 14: 10, 15: 1}
Did not match all atoms present	55530-45-5	C[Si](C)(C)C12C(=NC(=O)N1[Si](C)(C)C)C(=O)N(C(=O)N2[Si](C)(C)C)[Si](C)(C)C	{1: 12, 35: 1, 33: 3, 13: 1, 15: 1, 25: 3}
Did not match all atoms present	55530-70-6	CCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 18, 28: 1}
Did not match all atoms present	55531-95-8	C/C(=C(\C)/C[Si](C)(C)C)/C[Si](C)(C)C	{1: 8, 2: 2, 7: 2}
Did not match all atoms present	5555-13-5	CC(C(=O)O)OC1=CC=C(C=C1)C2=CC=CC=C2	{27: 1, 1: 1, 3: 1, 22: 1, 14: 9}
Did not match all atoms present	55553-86-1	CC(C)C(C)[O-].[K+]	{1: 3, 3: 2, 29: 1}
Did not match all atoms present	5556-07-0	CC(=O)C1=C(C=CS1)O	{24: 1, 1: 1, 21: 1, 14: 2, 41: 1}
Did not match all atoms present	55563-72-9	COCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	55566-30-8	C(O)[P+](CO)(CO)CO.C(O)[P+](CO)(CO)CO.[O-]S(=O)(=O)[O-]	{2: 8, 20: 8, 29: 4}
Did not match all atoms present	5557-16-4	CC1=NN(C(=O)C1N=NC2=C(C3=C(C=C2)C(=CC=C3)S(=O)(=O)O)S(=O)(=O)O)C4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)O	{1: 1, 2: 2, 35: 1, 33: 1, 12: 1, 34: 2, 14: 9, 15: 1, 20: 3, 22: 1, 25: 1, 29: 8}
Did not match all atoms present	5557-27-7	COC1=C2C(=C(C=C1)O)C(=O)C3=C(C=C(C=C3O2)OC)OC	{1: 3, 14: 4, 21: 1, 22: 3, 23: 1, 25: 1}
Did not match all atoms present	5558-29-2	CC(C)C(C#N)C1=CC=CC=C1	{1: 2, 3: 2, 37: 1, 14: 5}
Did not match all atoms present	5558-31-6	CC(C)CC(C#N)C1=CC=CC=C1	{1: 2, 2: 1, 3: 2, 37: 1, 14: 5}
Did not match all atoms present	5558-66-7	CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)O	{1: 1, 27: 1, 4: 1, 14: 10}
Did not match all atoms present	5558-67-8	CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 4: 1, 37: 1, 14: 10}
Did not match all atoms present	5558-68-9	CCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 4: 1, 37: 1, 14: 10}
Did not match all atoms present	5558-78-1	CCCC(C#N)C1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 37: 1, 14: 5}
Did not match all atoms present	55588-51-7	CC(=O)NC1=C(C=CC(=C1)[As](=O)(O)[O-])O.[Na+]	{1: 1, 14: 3, 20: 1, 21: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	55589-62-3	CC1=CC(=O)[N-]S(=O)(=O)O1.[K+]	{1: 1, 35: 1, 14: 1, 15: 1, 23: 1, 25: 1, 29: 2}
Did not match all atoms present	556-02-5	C1=CC(=CC=C1C[C@H](C(=O)O)N)O	{2: 1, 3: 1, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	556-03-6	C1=CC(=CC=C1CC(C(=O)O)N)O	{2: 1, 3: 1, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	556-08-1	CC(=O)NC1=CC=C(C=C1)C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	556-10-5	C1=CC(=CC=C1NC(=O)N)[N+](=O)[O-]	{24: 1, 38: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	556-12-7	C1=C(OC(=C1)[N+](=O)[O-])/C=C/C2=CN=C(N=N2)N	{35: 3, 6: 2, 38: 1, 14: 3, 23: 1, 30: 1}
Did not match all atoms present	556-18-3	C1=CC(=CC=C1C=O)N	{26: 1, 30: 1, 14: 4}
Did not match all atoms present	556-37-6	CCCCC(=O)[O-].CCCCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 6}
Did not match all atoms present	556-38-7	CCCCC(=O)[O-].CCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 6}
Did not match all atoms present	556-45-6	CCCC(=O)[O-].CCCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 4}
Did not match all atoms present	556-61-6	CN=C=S	{8: 1, 1: 1, 34: 1}
Did not match all atoms present	556-63-8	[Li+].C(=O)[O-]	{26: 1}
Did not match all atoms present	556-65-0	[Li+].C(#N)[S-]	{37: 1}
Did not match all atoms present	556-67-2	C[Si]1(O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)C	{1: 8, 23: 4}
Did not match all atoms present	556-68-3	C[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 16, 23: 8}
Did not match all atoms present	556-69-4	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 18, 22: 7}
Did not match all atoms present	556-70-7	C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C	{1: 22, 22: 9}
Did not match all atoms present	556-71-8	C[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 18, 23: 9}
Did not match all atoms present	556-75-2	CCOP(=O)(C)SCCSCC	{40: 2, 1: 3, 2: 4, 29: 1, 22: 1}
Did not match all atoms present	556-76-3	CCCCCOS(=O)(=O)[O-]	{1: 1, 2: 4, 29: 3, 22: 1}
Did not match all atoms present	556-96-7	CC1=CC(=CC(=C1)Br)C	{1: 2, 18: 1, 14: 3}
Did not match all atoms present	556-97-8	CC1=CC(=CC(=C1)Cl)C	{1: 2, 14: 3, 17: 1}
Did not match all atoms present	5560-62-3	CCN(CC)CCOC(=O)C1=CC=CC(=C1O)C2=CC=CC=C2.Cl	{1: 2, 2: 4, 33: 1, 14: 8, 17: 1, 21: 1, 28: 1}
Did not match all atoms present	5560-69-0	CCOS(=O)(=O)C1=C2C=CC(=CC2=CC(=C1)C(C)(C)C)C(C)(C)C	{1: 7, 2: 1, 4: 2, 14: 5, 22: 1, 29: 2}
Did not match all atoms present	5560-72-5	CN(C)CCCN1C2=C(CCCCCC2)C3=CC=CC=C31	{1: 2, 2: 3, 11: 6, 14: 4, 33: 2}
Did not match all atoms present	5560-77-0	CN(C)CCO[C@@H](C1=CC=C(C=C1)Cl)C2=CC=CC=N2	{1: 2, 2: 2, 3: 1, 33: 1, 14: 8, 17: 1, 35: 1, 22: 1}
Did not match all atoms present	55605-65-7	C1=CC(=C(C=C1O)O)S(=O)(=O)[O-].[NH4+]	{21: 2, 14: 3, 29: 3}
Did not match all atoms present	55609-55-7	C1CC2=NC(=CN2C3=CC=CC=C31)C4=CC=CC=C4	{33: 1, 11: 2, 14: 10, 35: 1}
Did not match all atoms present	55613-78-0	[H+].[H+].[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].[Cr+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 14: 14, 15: 4, 25: 2, 29: 6}
Did not match all atoms present	55619-06-2	CCN(CCCl)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 33: 1, 34: 2, 14: 8, 17: 1}
Did not match all atoms present	55619-17-5	CC(=O)OCCN(CCOC(=O)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl	{1: 2, 2: 4, 38: 1, 33: 1, 34: 2, 14: 6, 17: 2, 28: 2}
Did not match all atoms present	55620-18-3	CC(=O)OC1=CC=CC=C1C=CC(=O)O	{1: 1, 27: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	55620-97-8	CCCC(C1=CC2=C(CC1)C=C(C=C2)OC)C(C)(C)C(=O)O	{1: 4, 2: 2, 3: 1, 4: 1, 11: 2, 14: 4, 15: 1, 22: 1, 27: 1}
Did not match all atoms present	55623-27-3	CN1C2CCC1CC(C2)OC(=O)C3=CC=CC=C3.Cl	{1: 1, 33: 1, 11: 4, 12: 3, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	55628-54-1	C1=CC=C(C=C1)COC[C@@H]2[C@H]([C@@H](C=CO2)OCC3=CC=CC=C3)OCC4=CC=CC=C4	{2: 4, 12: 3, 22: 3, 14: 17, 23: 1}
Did not match all atoms present	55632-03-6	C[Si](C)(C)/C/1=C/C=C\C=C/C=C1	{1: 3, 14: 7, 15: 1}
Did not match all atoms present	55635-13-7	CCC/C(=N\OCC=C)/C1=C(CC(C(C1=O)C(=O)OC)(C)C)[O-].[Na+]	{1: 4, 2: 3, 34: 1, 5: 1, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1, 15: 2, 22: 1, 25: 1, 28: 1}
Did not match all atoms present	55636-92-5	CC(C)NCC(COC1=CC=CC2=C1OC(=C2)CCO)O	{1: 2, 2: 4, 3: 2, 14: 4, 20: 2, 22: 1, 23: 1, 31: 1}
Did not match all atoms present	55642-43-8	C(F)(F)(F)[Ge](C(F)(F)F)(C(F)(F)F)C(F)(F)F	{16: 12, 4: 4}
Did not match all atoms present	55648-29-8	CO[Si](CCCOC1=CC=C(C=C1)N)(OC)OC	{1: 3, 2: 3, 30: 1, 22: 4, 14: 4}
Did not match all atoms present	55649-90-6	CCC(C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C	{1: 10, 2: 1, 3: 1, 28: 1, 33: 1}
Did not match all atoms present	55650-58-3	C[C@@H](C1=C([CH-]C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3)N(C)C.[CH-]1C=CC=C1.[Fe+2]	{1: 3, 3: 1, 14: 18, 33: 1}
Did not match all atoms present	55651-31-5	CC1=C2C(=C3C(CC(=O)C3=C1)O)C=CC4=CC=CC=C42	{1: 1, 11: 1, 12: 1, 14: 7, 20: 1, 25: 1}
Did not match all atoms present	55651-36-0	C1CC(=O)C2=CC(=C3C(=C21)C=CC4=CC=CC=C43)CO	{25: 1, 2: 1, 11: 2, 20: 1, 14: 7}
Did not match all atoms present	55652-52-3	[B]Br.CSC	{40: 1, 1: 2, 18: 1}
Did not match all atoms present	55661-38-6	CC1=NC=C(C(=N1)N)CNC(=O)N(CCCl)N=O.Cl	{1: 1, 2: 3, 35: 2, 33: 1, 34: 1, 14: 1, 17: 2, 24: 1, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	55664-78-3	CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)NC3=NN(C(=O)C3N=NC4=CC=CC=C4OC)C5=C(C=C(C=C5Cl)Cl)Cl)C(C)(C)CC	{1: 7, 2: 3, 35: 1, 4: 2, 33: 1, 12: 1, 34: 2, 14: 13, 15: 1, 17: 3, 22: 2, 24: 2, 25: 1, 31: 2}
Did not match all atoms present	55666-83-6	CCOP1N(CCN1C)C	{1: 3, 2: 1, 11: 2, 22: 1, 33: 2}
Did not match all atoms present	55668-34-3	CC(C)C1OCC(O1)C2=CC=CC=C2	{1: 2, 3: 1, 11: 1, 12: 2, 14: 5, 23: 2}
Did not match all atoms present	55668-47-8	C1CCC2(CC1)OCC(O2)C3=CC=CC=C3	{11: 6, 12: 1, 13: 1, 14: 5, 23: 2}
Did not match all atoms present	55668-56-9	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=CC(=CC3=O)N([O-])[O-].[Co+3]	{1: 1, 34: 4, 35: 1, 38: 1, 33: 1, 14: 17, 15: 3, 25: 2}
Did not match all atoms present	55669-88-0	CC1=CC(=C(C=C1)C)CC(C)C	{1: 4, 2: 1, 3: 1, 14: 3}
Did not match all atoms present	55671-55-1	[B](Br)Br.CSC	{40: 1, 1: 2, 18: 2}
Did not match all atoms present	55673-54-6	CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCC(=O)N)C)N.Cl	{1: 2, 2: 2, 33: 2, 14: 4, 17: 1, 24: 3, 30: 2, 31: 2}
Did not match all atoms present	55676-76-1	COC(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)OC	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	55676-77-2	COC(=O)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	55677-97-9	C1=CC=C(C=C1)CN2C=NC3=C(C2=N)N=CN3C4C(C(C(O4)CO)O)O.Br	{33: 2, 2: 2, 35: 2, 36: 1, 12: 4, 14: 7, 18: 1, 20: 3, 23: 1}
Did not match all atoms present	5568-08-1	C1CN(CCN1C2CC(=O)N(C2=O)C3=CC=C(C=C3)Cl)C(C4=CC=CC=C4)C5=CC=CC=C5	{33: 3, 3: 1, 11: 5, 12: 1, 14: 14, 17: 1, 25: 2}
Did not match all atoms present	55685-51-3	CN(C)C(=O)C1=CC=C[Se]1	{24: 1, 1: 2, 14: 3, 33: 1}
Did not match all atoms present	55688-38-5	CC(C)[NH2+]CC(C1=CC(=CC=C1)O)O.[Cl-]	{1: 2, 2: 1, 3: 2, 14: 4, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	55689-65-1	C1C2=CC=CC=C2C(=O)C3=C(O1)C=C(C=C3)CC(=O)O	{2: 1, 11: 1, 14: 7, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	55691-69-5	C1=CC=C2C(=C1)C3=C4C2=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	55695-37-9	C[N+](C)(CCOC)[O-]	{1: 3, 2: 2, 29: 1, 22: 1}
Did not match all atoms present	55695-80-2	[Li+].C(CC(=O)[O-])[C@@H](C(=O)O)N	{24: 1, 27: 1, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	55697-63-7	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)N3C(=O)CN(C3=O)CC4=CC=CC=C4)C(C)(C)CC	{1: 9, 2: 6, 3: 1, 4: 3, 33: 2, 11: 1, 14: 11, 17: 1, 22: 1, 24: 3, 25: 2, 31: 2}
Did not match all atoms present	55697-65-9	CCCCCCCCCCCCCCCCC=CC1CC(=O)N(C1=O)C2=CC(=C(C=C2)Cl)NC3=NN(C(=O)C3)C4=C(C=C(C=C4Cl)Cl)Cl	{1: 1, 2: 15, 35: 1, 6: 2, 33: 2, 11: 2, 12: 1, 14: 5, 15: 1, 17: 4, 25: 3, 31: 1}
Did not match all atoms present	557-04-0	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	557-05-1	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	557-06-2	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 30, 6: 2}
Did not match all atoms present	557-07-3	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	557-08-4	C=CCCCCCCCCC(=O)[O-].C=CCCCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 2: 16, 5: 2, 6: 2}
Did not match all atoms present	557-09-5	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 12}
Did not match all atoms present	557-18-6	C[CH2-].C[CH2-].[Mg+2]	{1: 2, 5: 2}
Did not match all atoms present	557-19-7	[C-]#N.[C-]#N.[Ni+2]	{}
Did not match all atoms present	557-20-0	C[CH2-].C[CH2-].[Zn+2]	{1: 2, 5: 2}
Did not match all atoms present	557-21-1	[C-]#N.[C-]#N.[Zn+2]	{}
Did not match all atoms present	557-27-7	CCC(=O)[O-].CCC(=O)[O-].[Mg+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	557-28-8	CCC(=O)[O-].CCC(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	557-34-6	CC(=O)[O-].CC(=O)[O-].[Zn+2]	{24: 2, 1: 2}
Did not match all atoms present	557-39-1	C(=O)[O-].C(=O)[O-].[Mg+2]	{26: 2}
Did not match all atoms present	557-41-5	C(=O)[O-].C(=O)[O-].[Zn+2]	{26: 2}
Did not match all atoms present	557-89-1	C[As](C)Cl	{1: 2, 17: 1}
Did not match all atoms present	55700-14-6	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Cd+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	55700-98-6	CC1([C@@H]([C@@H]1C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Br)Br)C	{1: 2, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 18: 2, 22: 1, 28: 1}
Did not match all atoms present	55702-46-0	C1=CC=C(C=C1)C2=C(C(=C(C=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	55705-29-8	CC1=C2CCC3=CC(=C(C=C3)C)CCC(=C2)C=C1	{1: 2, 11: 4, 14: 6}
Did not match all atoms present	55708-65-1	COC1=C(C=CC(=C1)C=C)OCC2=CC=CC=C2	{1: 1, 2: 1, 5: 1, 6: 1, 14: 8, 22: 2}
Did not match all atoms present	5571-97-1	CN1C(S(=O)(=O)CCC1=O)C2=CC(=C(C=C2)Cl)Cl	{1: 1, 33: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 29: 2}
Did not match all atoms present	55712-37-3	C1=CC(=CC(=C1)Cl)C2=C(C=C(C=C2)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	55715-03-2	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])CBr	{38: 1, 2: 1, 27: 1, 18: 1, 14: 3}
Did not match all atoms present	55719-85-2	C/C=C(\C)/C(=O)OCCC1=CC=CC=C1	{1: 2, 2: 2, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	55719-88-5	C1=CC=C(C=C1)C2=NN=N[N-]2.C1=CC=C(C=C1)C2=NN=N[N-]2.[Ba+2]	{35: 8, 14: 10}
Did not match all atoms present	55719-89-6	C1=CC=C(C=C1)C2=NN=N[N-]2.C1=CC=C(C=C1)C2=NN=N[N-]2.[Ca+2]	{35: 8, 14: 10}
Did not match all atoms present	55720-07-5	C1=CC2=C(C(=C1)O)N=CC=C2.C(CC(=O)O)C(=O)O	{35: 1, 2: 2, 27: 2, 21: 1, 14: 6}
Did not match all atoms present	55720-09-7	C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC2=C(C(=C1)O)N=CC=C2.C1=CC(=C(C=C1N)O)C(=O)O	{35: 2, 30: 1, 27: 1, 21: 3, 14: 15}
Did not match all atoms present	55720-10-0	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])N=CC3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5	{33: 1, 34: 1, 6: 1, 38: 1, 14: 22, 31: 1}
Did not match all atoms present	55720-11-1	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])NC=C3C=CC(=O)C=C3	{6: 1, 38: 1, 14: 12, 15: 1, 25: 1, 31: 2}
Did not match all atoms present	55720-13-3	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])N=CC3=CC=C(C=C3)Cl	{34: 1, 6: 1, 38: 1, 14: 12, 17: 1, 31: 1}
Did not match all atoms present	55720-14-4	COC1=CC=C/C(=C/NC2=C(C=CC(=C2)[N+](=O)[O-])NC3=CC=CC=C3)/C1=O	{1: 1, 38: 1, 6: 1, 14: 11, 15: 2, 22: 1, 25: 1, 31: 2}
Did not match all atoms present	55720-15-5	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])N/C=C\3/C=CC=CC3=O	{6: 1, 38: 1, 14: 12, 15: 1, 25: 1, 31: 2}
Did not match all atoms present	55720-16-6	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])N/C=C\3/C=CC=C(C3=O)[N+](=O)[O-]	{6: 1, 38: 2, 14: 11, 15: 2, 25: 1, 31: 2}
Did not match all atoms present	55720-17-7	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])NC=C3C=C(C=CC3=O)Cl	{38: 1, 6: 1, 14: 11, 15: 2, 17: 1, 25: 1, 31: 2}
Did not match all atoms present	55720-18-8	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])N/C=C\3/C=C(C=CC3=O)Br	{38: 1, 6: 1, 14: 11, 15: 2, 18: 1, 25: 1, 31: 2}
Did not match all atoms present	55720-37-1	C1=CC(=CC2=C(C=C(C=C21)Cl)Cl)Cl	{17: 3, 14: 5}
Did not match all atoms present	55720-40-6	C1=CC(=CC2=CC(=C(C=C21)Cl)Cl)Cl	{17: 3, 14: 5}
Did not match all atoms present	55720-43-9	C1=CC(=C2C=C(C(=CC2=C1Cl)Cl)Cl)Cl	{17: 4, 14: 4}
Did not match all atoms present	55726-45-9	CCCCCCCCCCCCCCCC(=O)NC1=NC(=O)N(C=C1)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O	{1: 1, 2: 15, 35: 1, 33: 1, 12: 4, 14: 2, 20: 3, 23: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	55726-47-1	CCCCCCCCCCCCCCCCCCCCCC(=O)NC1=NC(=O)N(C=C1)C2C(C(C(O2)CO)O)O	{1: 1, 2: 21, 35: 1, 33: 1, 12: 4, 14: 2, 20: 3, 23: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	55728-17-1	CCCCCCCCCC(=O)NC(C)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC	{32: 1, 1: 3, 2: 9, 3: 2, 14: 5, 24: 2, 28: 1, 31: 2}
Did not match all atoms present	5573-62-6	CCS[Si](C)(C)C	{40: 1, 1: 4, 2: 1}
Did not match all atoms present	55735-23-4	CCC1=C(SC(=C1)C)C	{1: 3, 2: 1, 14: 1, 41: 1}
Did not match all atoms present	55739-01-0	C1=CC(=CC(=C1)[N+](=O)[O-])N[N+](=O)[O-]	{38: 2, 14: 4, 31: 1}
Did not match all atoms present	5574-97-0	CCCC[N+](CCCC)(CCCC)CCCC.OP(=O)(O)[O-]	{1: 4, 2: 12, 20: 2, 29: 2}
Did not match all atoms present	5575-43-9	CCCC(C(CC)C[O-])O.CCCC(C(CC)C[O-])O.CCCC(C(CC)C[O-])O.CCCC(C(CC)C[O-])O.[Ti+4]	{1: 8, 2: 16, 3: 8, 20: 4, 29: 4}
Did not match all atoms present	55751-54-7	CCC(C)C1=CC=CC=C1N	{1: 2, 2: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	55753-38-3	B(=S)Cl	{17: 1}
Did not match all atoms present	55755-16-3	CC1=CC=CC=C1CCN	{1: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	55755-17-4	CC1=CC(=CC=C1)CCN	{1: 1, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	55758-10-6	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])N=CC3=CC=C(C=C3)[N+](=O)[O-]	{34: 1, 38: 2, 14: 12, 6: 1, 31: 1}
Did not match all atoms present	5576-62-5	CC1=CC=CC=C1CN2CCN(CC2)CCOC(C3=CC=CC=C3)C4=CC=CC=C4Cl.Cl.Cl	{1: 1, 2: 3, 3: 1, 33: 2, 11: 4, 14: 13, 17: 3, 22: 1}
Did not match all atoms present	55764-23-3	CC1=CC(=C(O1)C)S	{1: 2, 39: 1, 14: 1, 23: 1}
Did not match all atoms present	55765-70-3	C1=CC(C=C1)[Si](F)(F)F	{16: 3, 12: 1, 14: 4}
Did not match all atoms present	55769-64-7	CC[C@@H](COC(=O)C1=CC(=C(C(=C1)OC)OC)OC)[NH+](C)CC[NH+](C)[C@@H](CC)COC(=O)C2=CC(=C(C(=C2)OC)OC)OC.[Cl-].[Cl-]	{1: 10, 2: 6, 3: 2, 14: 4, 17: 2, 22: 6, 28: 2}
Did not match all atoms present	5577-67-3	CC(C)(C)N[Si](C)(C)C	{1: 6, 4: 1, 31: 1}
Did not match all atoms present	55771-81-8	CCOC(=O)C1=CC(=C(C(=C1)Br)O)Br	{1: 1, 2: 1, 14: 2, 18: 2, 21: 1, 28: 1}
Did not match all atoms present	55772-72-0	CC1=C(C=C2C(=C1)OC3=C(C24C5=CC=CC=C5C(=O)O4)C=CC(=C3)N6CCCC6)NC7=CC=CC=C7	{1: 1, 33: 1, 11: 4, 13: 1, 14: 14, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	55775-26-3	CC1=[N+](C2=CC=CC=C2S1)CCC(=O)O.[Br-]	{1: 1, 2: 2, 33: 1, 41: 1, 14: 4, 18: 1, 27: 1}
Did not match all atoms present	55776-20-0	COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)OC	{1: 3, 38: 1, 28: 1, 22: 2, 14: 2}
Did not match all atoms present	5578-42-7	C[Si](C1CCCCC1)(Cl)Cl	{1: 1, 11: 5, 12: 1, 17: 2}
Did not match all atoms present	5578-73-4	C[N+]1=C2C(=C3C=CC4=C(C3=C1)OCO4)C=CC5=CC6=C(C=C52)OCO6.[Cl-]	{1: 1, 33: 1, 11: 2, 14: 7, 17: 1, 23: 4}
Did not match all atoms present	5579-85-1	C1=C2C(=CC(=C1Cl)Br)OC(=O)N2	{32: 1, 17: 1, 18: 1, 28: 1, 14: 2}
Did not match all atoms present	5579-93-1	C1=C(C(=O)C(=CN1)I)I	{32: 1, 25: 1, 19: 2, 14: 2}
Did not match all atoms present	55792-21-7	CCCCCCCOC1=CC=CC=C1NC(=O)OCC[NH+]2CCCCC2.[Cl-]	{1: 1, 2: 8, 11: 5, 14: 4, 17: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	55792-37-5	CCCCCCCOC1=CC=C(C=C1)N=C=O	{1: 1, 2: 6, 8: 1, 34: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	558-20-3	[2H]C([2H])([2H])[2H]	{}
Did not match all atoms present	558-21-4	[2H]C([2H])([2H])F	{16: 1, 1: 1}
Did not match all atoms present	558-25-8	CS(=O)(=O)F	{16: 1, 1: 1, 29: 2}
Did not match all atoms present	558-32-7	C[N+](C)(C)C.F[P-](F)(F)(F)(F)F	{16: 6, 1: 4}
Did not match all atoms present	5580-33-6	CC1=C(C=C(C=C1)C(=O)N)C	{24: 1, 1: 2, 30: 1, 14: 3}
Did not match all atoms present	5580-34-7	CC1=CC=CC(=C1C)C(=O)N	{24: 1, 1: 2, 30: 1, 14: 3}
Did not match all atoms present	5580-58-5	C1=CC(=CC=C1F)[As](=O)(O)O	{16: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	5580-79-0	C1=C(C(=C(C(=C1F)F)F)F)[N+](=O)[O-]	{16: 4, 38: 1, 14: 1}
Did not match all atoms present	5580-80-3	C1=C(C(=C(C(=C1F)F)F)F)N	{16: 4, 30: 1, 14: 1}
Did not match all atoms present	55804-65-4	C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C(=O)O)CCCN3C1	{27: 1, 33: 1, 11: 6, 28: 1, 14: 2}
Did not match all atoms present	55804-66-5	CCOC(=O)C1=CC2=CC3=C4C(=C2OC1=O)CCCN4CCC3	{1: 1, 2: 1, 33: 1, 11: 6, 14: 2, 28: 2}
Did not match all atoms present	55804-67-6	CC(=O)C1=CC2=CC3=C4C(=C2OC1=O)CCCN4CCC3	{1: 1, 33: 1, 11: 6, 14: 2, 24: 1, 28: 1}
Did not match all atoms present	55804-68-7	C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C#N)CCCN3C1	{33: 1, 11: 6, 28: 1, 37: 1, 14: 2}
Did not match all atoms present	55804-70-1	CCNC1=C(C=C2C(=CC(=O)OC2=C1)C(F)(F)F)C	{1: 2, 2: 1, 4: 1, 14: 3, 16: 3, 28: 1, 31: 1}
Did not match all atoms present	55804-98-3	CC1=C(C(=C(C(=C1N)[Si](F)(F)F)F)F)C	{16: 5, 1: 2, 30: 1}
Did not match all atoms present	5581-35-1	CC(CC1=CC=CC=C1)N=CC(Cl)(Cl)Cl	{1: 1, 2: 1, 3: 1, 4: 1, 6: 1, 34: 1, 14: 5, 17: 3}
Did not match all atoms present	5581-40-8	CN(C)C1CC(C2=CC=CC=C12)C3=CC=CC=C3	{1: 2, 11: 1, 12: 2, 14: 9, 33: 1}
Did not match all atoms present	5581-52-2	CN1C=NC(=C1SC2=NC(=NC3=C2NC=N3)N)[N+](=O)[O-]	{32: 1, 1: 1, 35: 4, 38: 1, 33: 1, 40: 1, 14: 2, 30: 1}
Did not match all atoms present	5581-75-9	C1=CC=C(C=C1)CCCCCC(=O)O	{2: 5, 27: 1, 14: 5}
Did not match all atoms present	55810-17-8	C1=CC2=C(C=C(C=C2C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 5}
Did not match all atoms present	55811-52-4	CCO[Si](C1=CC=CO1)(OCC)OCC	{1: 3, 2: 3, 22: 3, 14: 3, 23: 1}
Did not match all atoms present	55812-59-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[NH4+]	{25: 2, 29: 3, 14: 7}
Did not match all atoms present	55814-41-0	CC1=CC=CC=C1C(=O)NC2=CC(=CC=C2)OC(C)C	{1: 3, 3: 1, 14: 8, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	55814-54-5	CC(C)(C)C(=O)C1=CC=C(C=C1)OC2=CC=CC=C2	{24: 1, 1: 3, 4: 1, 22: 1, 14: 9}
Did not match all atoms present	55818-96-7	CC(=O)[O-].C(O)[P+](CO)(CO)CO.C(O)[P+](CO)(CO)CO.C(O)[P+](CO)(CO)CO.C(O)[P+](CO)(CO)CO.[O-]P(=O)([O-])[O-]	{24: 1, 1: 1, 2: 16, 20: 16, 29: 4}
Did not match all atoms present	55819-78-8	CC(=O)SC1=CC=CC=C1C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4, 40: 1}
Did not match all atoms present	5582-62-7	C[Si](C)(C)OCC#C	{1: 3, 2: 1, 10: 1, 22: 1, 9: 1}
Did not match all atoms present	55833-07-3	CN1C=CC(=S)N1C	{1: 2, 14: 2, 33: 2}
Did not match all atoms present	55836-69-6	CCOC1=CC=CC(=C1)C(=O)N	{1: 1, 2: 1, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	55837-18-8	CCC(C1=CC=C(C=C1)CC(C)C)C(=O)O	{27: 1, 1: 3, 2: 2, 3: 2, 14: 4}
Did not match all atoms present	55837-25-7	COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCC2)OC	{1: 3, 2: 3, 33: 1, 11: 4, 14: 2, 22: 3, 24: 1}
Did not match all atoms present	55837-27-9	C1CCN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3	{33: 1, 11: 4, 14: 7, 22: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	55837-29-1	CCCN(CCC)C(=O)C(CC1=CC=C(C=C1)OCCN(CC)CC)NC(=O)C2=CC=CC=C2	{1: 4, 2: 9, 3: 1, 33: 2, 14: 9, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	55843-86-2	CC(C1=CC=C(C=C1)C2=CN3C=CC=CC3=N2)C(=O)O	{1: 1, 3: 1, 33: 1, 14: 9, 35: 1, 27: 1}
Did not match all atoms present	5585-19-3	C1=CC=C(C=C1)C2=NNC(=S)S2	{32: 1, 41: 1, 35: 1, 14: 5}
Did not match all atoms present	5585-33-1	C1COCCN1C2=CC=CC=C2N	{33: 1, 11: 4, 30: 1, 14: 4, 23: 1}
Did not match all atoms present	5585-71-7	C1=CC=C(C=C1)C[NH+]2C=C(C3=CC=CC=C32)CCC4=CC=NC=C4.[Cl-]	{17: 1, 2: 3, 35: 1, 14: 14, 15: 1}
Did not match all atoms present	5585-73-9	CC(CC1C2=CC=CC=C2CCC3=CC=CC=C13)C[NH+](C)C.[Cl-]	{1: 3, 2: 2, 3: 1, 11: 2, 12: 1, 14: 8, 17: 1}
Did not match all atoms present	55850-00-5	CC1(C2=CC=CC=C2[N+](=C1/C=N/NCC3=CC=C(C=C3)Cl)CCOC)C.[Cl-]	{1: 3, 2: 3, 34: 1, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1, 17: 2, 22: 1, 31: 1}
Did not match all atoms present	55850-01-6	CC1(C2=CC=CC=C2[N+](=C1C=NN(C)C3=CC=CC=C3)C)C.[Cl-]	{1: 4, 34: 1, 6: 1, 33: 2, 13: 1, 14: 9, 15: 1, 17: 1}
Did not match all atoms present	55850-41-4	CC1=NC2=C(O1)C3=C(C=C2)OC(=N3)C	{1: 2, 35: 2, 14: 2, 23: 2}
Did not match all atoms present	55851-03-1	COC1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)N)O	{1: 1, 14: 8, 21: 2, 22: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	55852-24-9	C(#N)C(C#N)C1=C(C(=C(C(=C1F)F)C(F)(F)F)F)F	{16: 7, 3: 1, 4: 1, 37: 2}
Did not match all atoms present	55852-84-1	CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CN=CN2)C(=O)N[C@H](CC(=O)O)C(=O)N[C@@H](CC(=O)N)C(=O)O)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)C3CSC(=N3)C(C(C)CC)N.C1=CC=C(C(=C1)C(=O)OCOC(=O)C2=CC=CC=C2O)O	{32: 1, 1: 8, 2: 18, 3: 15, 41: 1, 11: 1, 12: 1, 14: 15, 15: 1, 35: 2, 21: 2, 24: 11, 27: 3, 28: 2, 30: 4, 31: 10}
Did not match all atoms present	5586-15-2	C1=CC=C2C=C(C=CC2=C1)SSC3=CC4=CC=CC=C4C=C3	{40: 2, 14: 14}
Did not match all atoms present	5586-70-9	C(CCCN=C=S)CCN=C=S	{8: 2, 2: 6, 34: 2}
Did not match all atoms present	5586-73-2	C1=CC=C(C=C1)C(CCN)C2=CC=CC=C2	{2: 2, 3: 1, 30: 1, 14: 10}
Did not match all atoms present	5586-87-8	CC(CC1=CC=CC=C1)NCCCCl.Cl	{1: 1, 2: 4, 3: 1, 14: 5, 17: 2, 31: 1}
Did not match all atoms present	5586-88-9	CC(=O)CC1=CC=C(C=C1)Cl	{24: 1, 1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	55860-10-1	CC(C)CCS(=O)C	{1: 3, 2: 2, 3: 1, 29: 1}
Did not match all atoms present	55861-78-4	CC(C)(C)C1=CC(=NO1)NC(=O)N(C)C	{1: 5, 35: 1, 4: 1, 33: 1, 14: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	55864-04-5	CC(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 2, 3: 1, 22: 3, 14: 14, 29: 1}
Did not match all atoms present	55864-39-6	CSC1=NOC(=N1)N	{40: 1, 1: 1, 35: 2, 30: 1, 23: 1}
Did not match all atoms present	55868-93-4	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)[O-].CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)[O-].[Ni+2]	{1: 12, 2: 4, 4: 4, 14: 4, 21: 2, 24: 2}
Did not match all atoms present	5587-61-1	C[Si](N=C=O)(N=C=O)N=C=O	{8: 3, 1: 1, 34: 3, 29: 3}
Did not match all atoms present	5587-62-2	C[Si](C)(N=C=O)N=C=O	{8: 2, 1: 2, 34: 2, 29: 2}
Did not match all atoms present	55870-50-3	C[C@]12CC[C@H]([C@]1(C)CS(=O)(=O)[O-])[C@H](C2=O)Br.[NH4+]	{1: 2, 2: 1, 11: 2, 12: 2, 13: 2, 18: 1, 25: 1, 29: 3}
Did not match all atoms present	55877-07-1	CCCCC(=CC1=C(C2=C(C=CC=N2)C=C1)O)CC	{1: 2, 2: 4, 35: 1, 6: 1, 7: 1, 14: 5, 21: 1}
Did not match all atoms present	55879-93-1	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O	{24: 1, 25: 2, 14: 20, 31: 1}
Did not match all atoms present	55879-96-4	C1=CC=C(C=C1)SC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)SC5=CC=CC=C5	{40: 2, 25: 2, 14: 16}
Did not match all atoms present	5588-10-3	CC(CC1=CC=CC=C1OC)NC.Cl	{1: 3, 2: 1, 3: 1, 14: 4, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	5588-29-4	CC1C(OCC(=O)N1)C2=CC=CC=C2	{32: 1, 1: 1, 11: 1, 12: 2, 14: 5, 23: 1, 25: 1}
Did not match all atoms present	5588-33-0	CN1CCCCC1CCN2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)C	{1: 2, 2: 2, 33: 2, 41: 1, 11: 4, 12: 1, 14: 7, 29: 1}
Did not match all atoms present	55887-46-2	CCCC(C(=O)O[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 2: 2, 3: 1, 28: 1, 22: 1}
Did not match all atoms present	55896-88-3	[In+3].[OH-].[OH-]	{}
Did not match all atoms present	55899-58-6	CC1=CC=CC=C1NN=C2C(=O)OC(=N2)C3=CC=CC=C3	{1: 1, 34: 1, 35: 1, 14: 9, 15: 2, 28: 1, 31: 1}
Did not match all atoms present	559-94-4	C1=CSC(=C1)C(=O)CC(=O)C(C(C(F)(F)F)(F)F)(F)F	{2: 1, 4: 3, 41: 1, 14: 3, 16: 7, 24: 2}
Did not match all atoms present	5590-14-7	C1C(C1C2=CC=CC=C2)C#N	{11: 1, 12: 2, 37: 1, 14: 5}
Did not match all atoms present	55901-67-2	CCCCCCCCCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 11, 29: 3, 22: 2}
Did not match all atoms present	55902-04-0	CC1=NN(C(=O)C=C1)CC(=O)N(CC=C)C(C)CC2=CC=CC=C2	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 33: 2, 14: 7, 35: 1, 24: 1, 25: 1}
Did not match all atoms present	55902-35-7	CC(=O)C(=CC1=CC=CC=C1)[N+](=O)[O-]	{1: 1, 6: 1, 38: 1, 7: 1, 14: 5, 24: 1}
Did not match all atoms present	55906-42-8	C1(=NN=C(S1)[S-])[S-].[Na+].[Na+]	{41: 1, 35: 2}
Did not match all atoms present	55907-61-4	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NN.Cl	{17: 1, 38: 2, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	5591-33-3	CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)CCCCCCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NC)I)I)C(=O)O)I	{1: 2, 2: 8, 19: 6, 24: 4, 27: 2, 31: 4}
Did not match all atoms present	5591-44-6	CC(CN1CCCC1)C(CC2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)C	{1: 2, 2: 2, 3: 1, 4: 1, 33: 1, 11: 4, 14: 10, 28: 1}
Did not match all atoms present	5591-45-7	CN1CCN(CC1)CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C	{1: 3, 2: 2, 6: 1, 33: 3, 41: 1, 11: 4, 14: 7, 15: 1, 29: 2}
Did not match all atoms present	55910-01-5	CCCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]	{1: 1, 2: 18, 20: 2, 14: 5, 17: 1}
Did not match all atoms present	55910-10-6	CCCN(CC(=O)[O-])S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[K+]	{1: 1, 2: 3, 4: 8, 33: 1, 16: 17, 24: 1, 29: 2}
Did not match all atoms present	55911-06-3	C1=C(C=C(C2=C1SC(=N2)N)Br)[N+](=O)[O-]	{35: 1, 38: 1, 41: 1, 14: 2, 18: 1, 30: 1}
Did not match all atoms present	55912-20-4	C1=CC(=C(C=C1CO)[N+](=O)[O-])Cl	{17: 1, 2: 1, 20: 1, 38: 1, 14: 3}
Did not match all atoms present	55918-56-4	COC(=O)C1=CC=C(C=C1)C(=O)OC.CP1(=O)CCC(=O)O1.C(CO)O	{1: 3, 2: 2, 11: 2, 14: 4, 20: 2, 28: 3, 29: 1}
Did not match all atoms present	55931-94-7	CN(C)CC[S-].[Na+]	{1: 2, 2: 2, 33: 1}
Did not match all atoms present	55933-85-2	CC1=NC(=NC=C1C(=O)C)C	{24: 1, 1: 3, 35: 2, 14: 1}
Did not match all atoms present	55936-75-9	CN(C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)OC)OC(=O)C3=CC=CC=C3	{1: 2, 34: 2, 28: 2, 14: 13, 33: 1}
Did not match all atoms present	55936-76-0	CC(=O)ON(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)OC	{1: 3, 34: 2, 28: 2, 14: 8, 33: 1}
Did not match all atoms present	55936-77-1	CC(=O)ON(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 2, 34: 2, 28: 1, 14: 9, 33: 1}
Did not match all atoms present	55936-78-2	CN(C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)OC)O	{1: 2, 34: 2, 33: 1, 14: 8, 20: 1, 28: 1}
Did not match all atoms present	55939-25-8	CCN(CC)C1=CC(=O)/C(=N/NC2=NC3=CC=CC=C3S2)/C=C1	{1: 2, 2: 2, 35: 1, 33: 1, 41: 1, 34: 1, 14: 7, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	55939-60-1	C1=CC=C(C(=C1)C(=O)[O-])[Hg].O.[Na+]	{24: 1, 14: 4}
Did not match all atoms present	5594-30-9	CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)OC)C4=N3)C(=O)OC)C	{32: 2, 1: 7, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 25: 1, 28: 2}
Did not match all atoms present	55952-56-2	CC[N+]1=CC=C(C2=CC=CC=C21)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 29: 3, 14: 10, 33: 1}
Did not match all atoms present	55954-23-9	COC(=O)CC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 1, 28: 1, 14: 3, 17: 2}
Did not match all atoms present	55963-78-5	C/C=C/C1=CC=C(C=C1)OC.[O-]S(=O)[O-].[Na+]	{1: 2, 22: 1, 14: 4, 6: 2, 29: 3}
Did not match all atoms present	55965-84-9	CN1C(=O)C=CS1.CN1C(=O)C=C(S1)Cl	{1: 2, 33: 2, 41: 2, 14: 3, 17: 1, 25: 2}
Did not match all atoms present	5597-50-2	COC(=O)CCC1=CC=C(C=C1)O	{1: 1, 2: 2, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	55979-29-8	[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mo]	{29: 3}
Did not match all atoms present	5598-13-0	COP(=S)(OC)OC1=NC(=C(C=C1Cl)Cl)Cl	{1: 2, 35: 1, 22: 3, 14: 1, 17: 3}
Did not match all atoms present	5598-15-2	CCOP(=O)(OCC)OC1=NC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 2, 35: 1, 14: 1, 17: 3, 22: 3, 29: 1}
Did not match all atoms present	5598-52-7	COP(=O)(OC)OC1=NC(=C(C=C1Cl)Cl)Cl	{1: 2, 35: 1, 14: 1, 17: 3, 22: 3, 29: 1}
Did not match all atoms present	55981-23-2	C1C[N+]2(CCN1C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl)CCOCC2.Cl.[Cl-]	{33: 1, 3: 1, 11: 8, 14: 9, 17: 3, 23: 1}
Did not match all atoms present	55986-09-9	COC1=CC=C(C=C1)C[Si](CC2=CC=C(C=C2)OC)(C#C)C#C	{1: 2, 2: 2, 9: 2, 10: 2, 14: 8, 22: 2}
Did not match all atoms present	5599-32-6	CC[Si](CC)(CC)N=[N+]=[N-]	{1: 3, 2: 3, 34: 2}
Did not match all atoms present	5599-34-8	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)N=[N+]=[N-]	{34: 2, 14: 15}
Did not match all atoms present	5599-39-3	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(N=[N+]=[N-])N=[N+]=[N-]	{34: 4, 14: 10}
Did not match all atoms present	5599-49-5	CCC1=CC2=C(C=C1)NC3=CC=CC=C32	{32: 1, 1: 1, 2: 1, 14: 7}
Did not match all atoms present	55990-21-1	CC1=C(C(=O)N(C(=O)N1C)C2=CC=CC=C2)N3CCCCC3	{1: 2, 11: 5, 33: 3, 14: 5, 25: 2}
Did not match all atoms present	55990-91-5	CC1=C(C(=CC=C1)SSC2=CC=CC(=C2C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	55993-15-2	CCOCCOCCN1C(=O)C2=CC=CC3=C2C(=C/C(=N/NC4=C(C=C(C=C4)[N+](=O)[O-])C)/C3=O)C1=O	{1: 2, 2: 5, 38: 1, 33: 1, 34: 1, 14: 7, 22: 2, 25: 3, 31: 1}
Did not match all atoms present	55994-13-3	CC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)N	{1: 1, 34: 2, 14: 7, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	55994-71-3	COC(=O)C1=CC=CC=C1N/N=C\2/C(=NC(=NC2=O)NC#N)N	{1: 1, 34: 1, 35: 2, 37: 1, 14: 4, 15: 3, 25: 1, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	56-04-2	CC1=CC(=O)NC(=S)N1	{32: 2, 1: 1, 14: 1, 25: 1}
Did not match all atoms present	56-05-3	C1=C(N=C(N=C1Cl)N)Cl	{17: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	56-06-4	C1=C(NC(=NC1=O)N)N	{32: 1, 25: 1, 35: 1, 30: 2, 14: 1}
Did not match all atoms present	56-09-7	C1=C(N=C(NC1=O)N)O	{32: 1, 35: 1, 14: 1, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	56-24-6	C[Sn](C)C.O	{1: 3}
Did not match all atoms present	56-33-7	C[Si](C)(C1=CC=CC=C1)O[Si](C)(C)C2=CC=CC=C2	{1: 4, 22: 1, 14: 10}
Did not match all atoms present	56-34-8	CC[N+](CC)(CC)CC.[Cl-]	{1: 4, 2: 4, 17: 1}
Did not match all atoms present	56-35-9	CCCC[Sn](CCCC)(CCCC)O[Sn](CCCC)(CCCC)CCCC	{1: 6, 2: 18, 22: 1}
Did not match all atoms present	56-36-0	CCCC[Sn](CCCC)(CCCC)OC(=O)C	{1: 4, 2: 9, 28: 1}
Did not match all atoms present	56-37-1	CC[N+](CC)(CC)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 4, 14: 5, 17: 1}
Did not match all atoms present	56-38-2	CCOP(=S)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 22: 3, 14: 4}
Did not match all atoms present	56-49-5	CC1=C2CCC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1	{1: 1, 11: 2, 14: 9}
Did not match all atoms present	56-53-1	CC/C(=C(/CC)\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O	{1: 2, 2: 2, 21: 2, 14: 8, 7: 2}
Did not match all atoms present	56-55-3	C1=CC=C2C(=C1)C=CC3=CC4=CC=CC=C4C=C32	{14: 12}
Did not match all atoms present	56-57-5	C1=CC=C2C(=C1)C(=CC=[N+]2[O-])[N+](=O)[O-]	{33: 1, 38: 1, 29: 1, 14: 6}
Did not match all atoms present	56-65-5	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 6, 22: 3, 23: 1, 29: 3, 30: 1}
Did not match all atoms present	56-72-4	CCOP(=S)(OCC)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C	{1: 3, 2: 2, 14: 3, 17: 1, 22: 3, 28: 1}
Did not match all atoms present	56-75-7	C1=CC(=CC=C1[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]	{2: 1, 3: 3, 38: 1, 14: 4, 17: 2, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	56-91-7	C1=CC(=CC=C1CN)C(=O)O	{2: 1, 27: 1, 30: 1, 14: 4}
Did not match all atoms present	56-92-8	C1=C(NC=N1)CCN.Cl.Cl	{32: 1, 2: 2, 35: 1, 14: 2, 17: 2, 30: 1}
Did not match all atoms present	56-93-9	C[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 1, 14: 5, 17: 1}
Did not match all atoms present	56-94-0	CN(CCCCCCCCCCN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C)C(=O)OC2=CC=CC(=C2)[N+](C)(C)C.[Br-].[Br-]	{1: 8, 2: 10, 33: 2, 14: 8, 18: 2, 28: 2}
Did not match all atoms present	5600-01-1	CC1=C(C(NC(=O)N1)C2=CC3=C(C=C2)OCO3)C(=O)OCC4=CC=C(C=C4)OC	{32: 2, 1: 2, 2: 1, 11: 1, 12: 1, 14: 7, 15: 2, 22: 1, 23: 2, 25: 1, 28: 1}
Did not match all atoms present	5600-21-5	CC1=CC(=NC(=N1)N)Cl	{1: 1, 35: 2, 30: 1, 14: 1, 17: 1}
Did not match all atoms present	5600-62-4	C1=CC(=CC=C1CCCC(=O)O)[N+](=O)[O-]	{2: 3, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	56011-02-0	CC(C)CCOCCC1=CC=CC=C1	{1: 2, 2: 4, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	56022-37-8	CCCCCCCC[P+](CC)(CCCCCCCC)CCCCCCCC.[Br-]	{1: 4, 2: 22, 18: 1}
Did not match all atoms present	56022-49-2	CCCCCCCCCCCC(=O)OCCS(=O)(=O)O	{1: 1, 2: 12, 20: 1, 29: 2, 28: 1}
Did not match all atoms present	56023-03-1	C(#N)N=C=S	{8: 1, 34: 1, 37: 1}
Did not match all atoms present	56025-87-7	C1=CC=C(C=C1)CN2C=NC3=C2C(=NC(=N3)Cl)Cl	{17: 2, 2: 1, 35: 3, 14: 6, 33: 1}
Did not match all atoms present	56030-56-9	C1=CC(=C(C=C1Cl)Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	56042-78-5	CNC1=CC=CC=C1C(=O)NCC2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 14: 9, 31: 2}
Did not match all atoms present	56046-61-8	CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)N)C.OP(=O)(O)O	{1: 3, 2: 3, 33: 1, 14: 3, 20: 3, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	56046-62-9	CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)N=O)C	{1: 3, 2: 3, 33: 1, 34: 1, 14: 3, 29: 3, 31: 1}
Did not match all atoms present	56046-83-4	CC(=O)C(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N=NC3=C(C=CC(=C3)Cl)Cl	{32: 2, 1: 1, 34: 2, 3: 1, 14: 6, 17: 2, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	56047-14-4	CCCC(=O)[O-].CCCC(=O)[O-].[Rh+2]	{24: 2, 1: 2, 2: 4}
Did not match all atoms present	56047-23-5	C1=CC(=C(C=C1Cl)C(=O)[O-])C(=O)O.[Na+]	{24: 1, 17: 1, 27: 1, 14: 3}
Did not match all atoms present	56048-54-5	CC1=CC(=O)C(=C2NC3=CC=CC=C3S2)C=C1	{32: 1, 1: 1, 41: 1, 14: 7, 15: 3, 25: 1}
Did not match all atoms present	56049-85-5	C1CCN(C1)C=C2C(=O)N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4	{33: 3, 6: 1, 11: 4, 14: 10, 15: 1, 25: 2}
Did not match all atoms present	56052-14-3	CCCCCCC(=O)OC1=CC=CC=C1	{1: 1, 2: 5, 28: 1, 14: 5}
Did not match all atoms present	56053-84-0	CCCCOC(=O)C1=CC=CS1	{1: 1, 2: 3, 28: 1, 14: 3, 41: 1}
Did not match all atoms present	56057-19-3	CC1=NC(=C(C=C1)[N+](=O)[O-])Cl	{1: 1, 35: 1, 38: 1, 14: 2, 17: 1}
Did not match all atoms present	5606-24-6	CCCCNC1=NC(=NC(=N1)N)N	{1: 1, 2: 3, 35: 3, 30: 2, 31: 1}
Did not match all atoms present	56066-86-5	CC1=CC(=CC(=C1N(C)C)C)C(=O)OC	{1: 5, 28: 1, 14: 2, 33: 1}
Did not match all atoms present	56070-42-9	CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO[Si](C)(C)C(C)(C)C)OC(=O)C	{32: 1, 1: 7, 2: 1, 4: 1, 33: 1, 11: 1, 12: 3, 14: 1, 22: 1, 23: 1, 25: 2, 28: 1}
Did not match all atoms present	56073-07-5	C1C(CC2=CC=CC=C2C1C3=C(C4=CC=CC=C4OC3=O)O)C5=CC=C(C=C5)C6=CC=CC=C6	{28: 1, 11: 2, 12: 2, 21: 1, 14: 17}
Did not match all atoms present	56073-10-0	C1C(CC2=CC=CC=C2C1C3=C(C4=CC=CC=C4OC3=O)O)C5=CC=C(C=C5)C6=CC=C(C=C6)Br	{11: 2, 12: 2, 14: 16, 18: 1, 21: 1, 28: 1}
Did not match all atoms present	56079-22-2	C1=CC=C(C(=C1)N([N+](=O)C2=CC=CC=C2[N+](=O)[O-])[O-])[N+](=O)[O-]	{33: 2, 38: 2, 29: 2, 14: 8}
Did not match all atoms present	56081-97-1	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[Ru+4]	{}
Did not match all atoms present	56083-99-9	CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(CO)COCCCO	{1: 2, 2: 8, 4: 1, 14: 6, 20: 4, 22: 1, 27: 2, 28: 2}
Did not match all atoms present	56095-08-0	[Li+].[Na+].[Na+]	{}
Did not match all atoms present	56095-14-8	CCOC1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)OC)[O-]	{1: 2, 2: 1, 33: 1, 34: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	56095-71-7	CCC=C[Al](CC)CC	{1: 3, 2: 3, 6: 2}
Did not match all atoms present	56095-72-8	CCCC/C=C\[Al](CCCC)CCCC	{1: 3, 2: 9, 6: 2}
Did not match all atoms present	56095-73-9	CC(C)CC=C[Al](CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 3, 6: 2}
Did not match all atoms present	56095-74-0	CCCCCCC=C[Al](CCCCCC)CCCCCC	{1: 3, 2: 15, 6: 2}
Did not match all atoms present	561-07-9	CC(=O)OC12CC(C3(CC(C1C3OC(=O)C4=CC=CC=C4)C56C(CCC7(C5C(C2C6N(C7)C)OC)COC)OC)O)OC	{1: 6, 2: 1, 33: 1, 11: 5, 12: 9, 13: 4, 14: 5, 20: 1, 22: 4, 28: 2}
Did not match all atoms present	561-27-3	CC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)OC(=O)C)CCN3C	{1: 3, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 23: 1, 28: 2}
Did not match all atoms present	561-48-8	CCC(=O)C(CCN1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 3, 4: 1, 33: 1, 11: 5, 14: 10, 24: 1}
Did not match all atoms present	561-76-2	CC(C)OC(=O)C1(CCN(CC1)C)C2=CC=CC=C2	{1: 3, 3: 1, 33: 1, 11: 4, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	561-78-4	CCC(=O)O[C@@]1(CCN(C[C@@H]1C)C)C2=CC=CC=C2.Cl	{1: 3, 2: 1, 33: 1, 11: 3, 12: 1, 13: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	561-94-4	CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O	{32: 1, 1: 4, 2: 1, 3: 1, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	5610-59-3	[C-]#[N+][O-].[Ag+]	{34: 1, 29: 1}
Did not match all atoms present	56103-67-4	CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)C	{1: 7, 2: 2, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	56106-37-7	CCCOC1=CC(=CC=C1)OCCC	{1: 2, 2: 4, 22: 2, 14: 4}
Did not match all atoms present	56107-02-9	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]	{24: 1, 17: 1, 38: 1, 14: 8}
Did not match all atoms present	56124-62-0	CCCCC(=O)OCC(=O)[C@]1(C[C@@H](C2=C(C3=C(C(=C2C1)O)C(=O)C4=C(C3=O)C(=CC=C4)OC)O)OC5CC(C(C(O5)C)O)NC(=O)C(F)(F)F)O	{1: 3, 2: 4, 4: 1, 11: 3, 12: 5, 13: 1, 14: 3, 16: 3, 20: 2, 21: 2, 22: 2, 23: 1, 24: 2, 25: 2, 28: 1, 31: 1}
Did not match all atoms present	56124-72-2	CCCCN(CCCC)C(=O)NC1=CC=CC=C1C	{1: 3, 2: 6, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	56124-73-3	CCCCN(CCCC)C(=O)NC1=CC=C(C=C1)C	{1: 3, 2: 6, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	5613-46-7	CC1=CC(=CC(=C1O)C)C(C)(C)C2=CC(=C(C(=C2)C)O)C	{1: 6, 4: 1, 21: 2, 14: 4}
Did not match all atoms present	5613-68-3	C=C[Sb](C=C)C=C	{5: 3, 6: 3}
Did not match all atoms present	56136-13-1	C1C=CCC2=C(C3=CC=CC=C3C(=C21)O)O	{11: 2, 21: 2, 14: 6}
Did not match all atoms present	56136-20-0	CCOC(=O)C1=CC2=C(C=C1)C3CC2C=C3	{1: 1, 2: 1, 11: 1, 12: 2, 14: 5, 28: 1}
Did not match all atoms present	56139-33-4	CC(C)(C)OC(=O)OOCl	{1: 3, 4: 1, 22: 1, 17: 1}
Did not match all atoms present	56139-76-5	CN1C=CC=C1CN(C)C	{1: 3, 2: 1, 14: 3, 33: 2}
Did not match all atoms present	56141-33-4	C=O.C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ba+2]	{5: 1, 14: 10}
Did not match all atoms present	56149-12-3	C1=CC=C2C=C(C=CC2=C1)C(=O)NNC(=O)C3=CC4=CC=CC=C4C=C3	{24: 2, 14: 14, 31: 2}
Did not match all atoms present	56149-35-0	CN(C)P(=O)(O)O	{1: 2, 20: 2, 29: 1, 33: 1}
Did not match all atoms present	56159-70-7	COC1=C(C=C(C=C1)C(=O)C(=O)C2=CC=CC=C2Cl)OC	{24: 2, 1: 2, 22: 2, 14: 7, 17: 1}
Did not match all atoms present	56166-25-7	CC1=CC[C@@H](CC1)C(=C)C.CC(=C)C1=CC=CC=C1.C=CC1=CC=CC=C1	{1: 3, 5: 3, 6: 1, 7: 2, 11: 3, 12: 1, 14: 11, 15: 1}
Did not match all atoms present	5617-28-7	C1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{11: 5, 12: 1, 14: 5, 20: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	56173-18-3	CC(=NNC1=NN=CC2=CC=CC=C21)C	{1: 2, 34: 1, 35: 2, 7: 1, 14: 5, 31: 1}
Did not match all atoms present	56175-44-1	COC1C(CC2=CC=CC=C12)O	{1: 1, 11: 1, 12: 2, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	56179-80-7	C1CC2=C(C=CC3=CC=CC=C23)C4C1O4	{11: 2, 12: 2, 14: 6, 23: 1}
Did not match all atoms present	56179-83-0	C1CC2=C(C=C1)C3=CC=CC=C3C=C2	{11: 2, 14: 8}
Did not match all atoms present	56181-82-9	C1C(CC2=CC=CC=C2C1O)C3=CC=C(C=C3)C4=CC=C(C=C4)Br	{20: 1, 18: 1, 11: 2, 12: 2, 14: 12}
Did not match all atoms present	56183-20-1	COC1=CC2=CC3=CC=CC=C3C=C2C4=CC=CC=C41	{1: 1, 22: 1, 14: 11}
Did not match all atoms present	56183-63-2	CC(C)N(C(C)C)P(N(C(C)C)C(C)C)Cl	{1: 8, 3: 4, 33: 2, 17: 1}
Did not match all atoms present	56183-69-8	CCOP(=O)(NN)OCC	{1: 2, 2: 2, 22: 2, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	56187-09-8	C1C[NH2+]CC[NH2+]CC[NH2+]CC[NH2+]CC[NH2+]CC[NH2+]1.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-]	{11: 12, 29: 12}
Did not match all atoms present	56187-37-2	C1=C(C(=O)C(=CN1CC(=O)O)Cl)Cl	{33: 1, 2: 1, 14: 2, 17: 2, 25: 1, 27: 1}
Did not match all atoms present	56190-26-2	CC(=O)NCCCNC1=NC(=NC(=N1)NC2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NCCCNC(=O)C)NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 2: 6, 35: 6, 6: 2, 14: 12, 24: 2, 29: 18, 31: 8}
Did not match all atoms present	562-09-4	CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCCN(C)C.Cl	{1: 3, 2: 2, 4: 1, 33: 1, 14: 9, 17: 2, 22: 1}
Did not match all atoms present	562-10-7	CC(C1=CC=CC=C1)(C2=CC=CC=N2)OCCN(C)C.C(CC(=O)O)C(=O)O	{1: 3, 2: 4, 35: 1, 4: 1, 33: 1, 14: 9, 22: 1, 27: 2}
Did not match all atoms present	562-26-5	CCOC(=O)C1(CCN(CC1)CCC(C2=CC=CC=C2)O)C3=CC=CC=C3	{1: 1, 2: 3, 3: 1, 33: 1, 11: 4, 13: 1, 14: 10, 20: 1, 28: 1}
Did not match all atoms present	562-54-9	COS(=O)(=O)[O-].[K+]	{1: 1, 29: 3, 22: 1}
Did not match all atoms present	562-88-9	C(C(F)(F)F)OP1(=NP(=NP(=NP(=N1)(OCC(F)(F)F)OCC(F)(F)F)(OCC(F)(F)F)OCC(F)(F)F)(OCC(F)(F)F)OCC(F)(F)F)OCC(F)(F)F	{16: 24, 2: 8, 35: 4, 4: 8, 22: 8}
Did not match all atoms present	56201-37-7	COP(=S)(OC1=CC(=C(C=C1Cl)Cl)Cl)OC2=CC(=C(C=C2Cl)Cl)Cl	{1: 1, 22: 3, 14: 4, 17: 6}
Did not match all atoms present	56207-93-3	CC(CC1=C(C=CC(=C1)OC)OC)NS(=O)(=O)C2=CC3=C(C=C2)C4=NC5=NC(=NC6=C7C=C(C=CC7=C([N-]6)N=C8C9=C(C=CC(=C9)S(=O)(=O)NC(C)CC1=C(C=CC(=C1)OC)OC)C(=N8)N=C3[N-]4)S(=O)(=O)NC(C)CC1=C(C=CC(=C1)OC)OC)C1=C5C=CC=C1S(=O)(=O)NC(C)CC1=C(C=CC(=C1)OC)OC.[Cu+2]	{1: 12, 2: 4, 3: 4, 14: 24, 35: 8, 22: 8, 29: 8, 31: 4}
Did not match all atoms present	5621-02-3	CN(C)C1=NC=CC=N1	{1: 2, 35: 2, 14: 3, 33: 1}
Did not match all atoms present	5621-17-0	CC1=C2C=CNC2=C(C=C1)C	{32: 1, 1: 2, 14: 4}
Did not match all atoms present	5621-86-3	CNC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2Cl	{24: 1, 1: 1, 31: 1, 14: 7, 17: 2}
Did not match all atoms present	56217-89-1	CN1CCN(CC1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-].Cl	{1: 1, 2: 1, 38: 1, 6: 1, 33: 2, 11: 4, 34: 1, 14: 2, 17: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	56218-79-2	CCCCC=CCCCCCCCCOC=O	{1: 1, 2: 11, 26: 1, 6: 2}
Did not match all atoms present	5622-83-3	C1=CC(=CC(=C1)[N+](=O)[O-])C2=CS/C(=C(\C=C\3/C=CC(=O)C(=C3)O)/C#N)/N2	{32: 1, 37: 1, 6: 1, 7: 1, 41: 1, 14: 8, 15: 4, 20: 1, 25: 1, 38: 1}
Did not match all atoms present	56222-04-9	CN1CCC(C(C1)COC2=CC=C(C=C2)OC)C3=CC=CC=C3	{1: 2, 2: 1, 33: 1, 11: 3, 12: 2, 14: 9, 22: 2}
Did not match all atoms present	56222-83-4	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)OC5=CC=CC=C5	{1: 1, 14: 14, 22: 1, 25: 2, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	5623-04-1	C1=CC=C(C(=C1)C(=O)NO)N	{24: 1, 20: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	56235-95-1	COC1=C(C=C(C=C1)[N+](=O)[O-])NCC2=CC=C(C=C2)C(F)(F)F	{1: 1, 2: 1, 4: 1, 38: 1, 14: 7, 16: 3, 22: 1, 31: 1}
Did not match all atoms present	56236-54-5	CC(=C)C1=CC=CC=C1.C=CC1=CC=CC=C1.C1C=CC2C1C3CC2C=C3	{1: 1, 5: 2, 6: 1, 7: 1, 11: 2, 12: 4, 14: 14}
Did not match all atoms present	56237-73-1	CCCCC(CC)C(=O)O[Al]=O	{1: 2, 2: 4, 3: 1, 28: 1, 29: 1}
Did not match all atoms present	56240-38-1	CC(C)(C)C1=CC=CC=C1CCl	{1: 3, 2: 1, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	56245-02-4	CC(C)COC1=CC=CC=C1[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1, 14: 4, 22: 1}
Did not match all atoms present	56247-94-0	CCCCCCCCCCC1=C2CCCC3=C2C4=C(CCCC4=C1)C=C3	{1: 1, 2: 9, 11: 6, 14: 3}
Did not match all atoms present	56247-97-3	CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C1=CC=CC=C1	{1: 2, 2: 26, 3: 1, 14: 5}
Did not match all atoms present	5625-37-6	C1CN(CCN1CCS(=O)(=O)O)CCS(=O)(=O)O	{33: 2, 2: 4, 11: 4, 20: 2, 29: 4}
Did not match all atoms present	5625-49-0	C1C(=O)NC(C(=O)N1)CC2=CC=C(C=C2)O	{32: 2, 2: 1, 11: 1, 12: 1, 14: 4, 21: 1, 25: 2}
Did not match all atoms present	5625-56-9	C1CN(CCN1CCCS(=O)(=O)O)CCCS(=O)(=O)O	{33: 2, 2: 6, 11: 4, 20: 2, 29: 4}
Did not match all atoms present	56253-60-2	C[Si](C)(C)C[Se]C1=CC=CC=C1	{1: 3, 2: 1, 14: 5}
Did not match all atoms present	56253-64-6	CCC(=CC1=CC=CC=C1)C	{1: 2, 2: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	5626-16-4	C1C2=CC=CC=C2/C(=C/CCN)/C3=CC=CC=C3O1	{2: 2, 6: 1, 11: 1, 14: 8, 15: 1, 23: 1, 30: 1}
Did not match all atoms present	56264-98-3	CCC=CC1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	56267-87-9	CC[Pb](CC)(CC)OP(=O)(O)O	{1: 3, 2: 3, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	56275-25-3	CC1=CC(=NNC2=CC=C(C=C2)NC3=NC(=NC(=N3)Cl)N(CCO)CCO)C(=O)C=C1	{1: 1, 2: 4, 35: 3, 33: 1, 34: 1, 14: 7, 15: 2, 17: 1, 20: 2, 25: 1, 31: 2}
Did not match all atoms present	56276-49-4	CC(=O)C(C(=O)C)N=NC1=CC=CC=C1	{24: 2, 1: 2, 34: 2, 3: 1, 14: 5}
Did not match all atoms present	56278-25-2	CC[N+]1=CC=C(C2=CC=CC=C21)/C=C/N(C3=CC=CC=C3)C(=O)C.[I-]	{1: 2, 2: 1, 6: 2, 33: 2, 14: 11, 19: 1, 24: 1}
Did not match all atoms present	56278-50-3	C1=CC=C2C(=C1)N=C(S2)CC#N	{41: 1, 2: 1, 35: 1, 37: 1, 14: 4}
Did not match all atoms present	5628-96-6	CCOC(=O)OCCS	{1: 1, 2: 3, 39: 1}
Did not match all atoms present	56280-59-2	CCN(CC(C[N+](C)(C)C)O)C1=CC=CC(=C1)C.[Cl-]	{1: 5, 2: 3, 3: 1, 33: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	56280-76-3	[N-]=[N+]=NP(N=[N+]=[N-])N=[N+]=[N-]	{34: 6}
Did not match all atoms present	56287-19-5	COP(=NC1=CC=C(C=C1)S(=O)(=O)N)(OC)OC	{1: 3, 34: 1, 14: 4, 22: 3, 29: 2, 30: 1}
Did not match all atoms present	56287-41-3	CCN(CC)CCOCCC1(OC2=C(O1)C=C(C=C2)Cl)C	{1: 3, 2: 6, 33: 1, 13: 1, 14: 3, 17: 1, 22: 1, 23: 2}
Did not match all atoms present	56287-74-2	CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)N)CF	{1: 1, 2: 1, 35: 1, 33: 1, 14: 7, 16: 1, 25: 1, 30: 1}
Did not match all atoms present	56288-95-0	CCNC1=C(C=CC(=C1)[N+](=O)[O-])C	{1: 2, 2: 1, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	563-03-1	COC1=CC=CC=C1OP(=O)(OC2=CC=CC=C2OC)OC3=CC=CC=C3OC	{1: 3, 22: 6, 14: 12, 29: 1}
Did not match all atoms present	563-04-2	CC1=CC(=CC=C1)OP(=O)(OC2=CC=CC(=C2)C)OC3=CC=CC(=C3)C	{1: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	563-12-2	CCOP(=S)(OCC)SCSP(=S)(OCC)OCC	{40: 2, 1: 4, 2: 5, 22: 4}
Did not match all atoms present	563-17-7	CCOS(=O)(=O)[O-].[K+]	{1: 1, 2: 1, 29: 3, 22: 1}
Did not match all atoms present	563-25-7	CCCC[Sn](CCCC)(F)F	{16: 2, 1: 2, 2: 6}
Did not match all atoms present	563-43-9	CC[Al](Cl)Cl	{1: 1, 2: 1, 17: 2}
Did not match all atoms present	563-63-3	CC(=O)[O-].[Ag+]	{24: 1, 1: 1}
Did not match all atoms present	563-67-7	CC(=O)[O-].[Rb+]	{24: 1, 1: 1}
Did not match all atoms present	563-68-8	CC(=O)[O-].[Tl+]	{24: 1, 1: 1}
Did not match all atoms present	563-71-3	C(=O)([O-])[O-].[Fe+2]	{24: 1}
Did not match all atoms present	563-72-4	C(=O)(C(=O)[O-])[O-].[Ca+2]	{24: 2}
Did not match all atoms present	5630-56-8	C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)I)I	{24: 1, 19: 2, 14: 8}
Did not match all atoms present	56302-13-7	CN1C(=CN=C1N2CCN(C2=O)S(=O)(=O)C)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 33: 3, 11: 2, 14: 1, 25: 1, 29: 2}
Did not match all atoms present	56307-84-7	CCCCCCCCCCCC[N+](C)(C)CC1=CC=C(C=C1)C=C.[Cl-]	{1: 3, 2: 12, 5: 1, 6: 1, 14: 4, 17: 1}
Did not match all atoms present	56309-56-9	CC(C)C1=CC=CC=C1N=C=O	{1: 2, 34: 1, 3: 1, 8: 1, 14: 4, 29: 1}
Did not match all atoms present	56309-59-2	CC1=C(C=CC(=C1)[N+](=O)[O-])N=C=O	{1: 1, 34: 1, 38: 1, 8: 1, 14: 3, 29: 1}
Did not match all atoms present	56309-62-7	COC1=CC(=C(C=C1)OC)N=C=O	{1: 2, 34: 1, 8: 1, 14: 3, 22: 2, 29: 1}
Did not match all atoms present	56310-18-0	CC(C)(C)[Si](C(C)(C)C)Cl	{1: 6, 4: 2, 17: 1}
Did not match all atoms present	56312-14-2	C(CCCCN=C=S)CCCN=C=S	{8: 2, 2: 8, 34: 2}
Did not match all atoms present	56317-51-2	C1=CC(=CC=C1N=NC2=C3C=CC(=CC3=CC(=C2N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O	{2: 2, 34: 2, 14: 8, 20: 3, 22: 1, 29: 8, 30: 1}
Did not match all atoms present	5632-44-0	CC1=CC=C(C=C1)C(CCN(C)C)C2=CC=CC=C2	{1: 3, 2: 2, 3: 1, 14: 9, 33: 1}
Did not match all atoms present	56323-90-1	CCCCCCCCCC1=CC(=CC=C1)OCCOCC(=O)O	{1: 1, 2: 11, 27: 1, 22: 2, 14: 4}
Did not match all atoms present	5633-14-7	C1CN(CCC1C2(CCC(=O)NC2=O)C3=CC=CC=C3)CC4=CC=CC=C4.Cl	{32: 1, 33: 1, 2: 1, 11: 6, 12: 1, 13: 1, 14: 10, 17: 1, 25: 2}
Did not match all atoms present	5633-16-9	CCN(CC)CCOC1=CC=CC=C1N2C(=CC=C2C3=CC=CC=C3)C	{1: 3, 2: 4, 22: 1, 14: 11, 33: 2}
Did not match all atoms present	5633-57-8	COC1=CC=C(C=C1)SC2=CC=CC=C2	{40: 1, 1: 1, 22: 1, 14: 9}
Did not match all atoms present	56330-12-2	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC(=O)C4=C(N3)C=CC(=C4)S(=O)(=O)[O-].[Na+]	{32: 1, 1: 2, 2: 2, 35: 1, 33: 1, 14: 7, 25: 1, 28: 1, 29: 3}
Did not match all atoms present	56339-92-5	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC(=C(C(=C2O)Cl)C)Cl	{1: 3, 2: 15, 3: 1, 14: 5, 17: 2, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5634-22-0	CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NNC(=C4C=CC=CC4=O)C	{1: 2, 2: 1, 33: 1, 7: 1, 14: 17, 15: 1, 24: 1, 25: 1, 29: 2, 31: 2}
Did not match all atoms present	5634-37-7	C(C(Cl)(Cl)Cl)OC(=O)OCC(Cl)(Cl)Cl	{17: 6, 2: 2, 4: 2}
Did not match all atoms present	5634-42-4	CC1=CC=C(C=C1)C(C)OC(=O)C2(CCC(C2(C)C)C(=O)O)C.C(CO)NCCO	{1: 5, 2: 4, 3: 1, 11: 2, 12: 1, 13: 2, 14: 4, 20: 2, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	56341-36-7	CC1=CC=C(N1C)C#N	{1: 2, 37: 1, 14: 2, 33: 1}
Did not match all atoms present	56346-57-7	C1CNCCC1C(=O)C2=CC=C(C=C2)F	{32: 1, 11: 4, 12: 1, 14: 4, 16: 1, 24: 1}
Did not match all atoms present	5635-50-7	CCC(C1=CC=C(C=C1)O)C(CC)C2=CC=C(C=C2)O	{1: 2, 2: 2, 3: 2, 21: 2, 14: 8}
Did not match all atoms present	56358-10-2	CCCCC(CC)CNC1=C(C2=CC=CC=C2C=C1)N=NC3=CC(=C(C=C3)N=NC4=CC=CC(=C4)C)C	{1: 4, 2: 5, 3: 1, 34: 4, 14: 13, 31: 1}
Did not match all atoms present	56358-42-0	CC1=C(C=CC=C1Cl)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC5=C4C=CC=C5NC(=O)C6=CC7=CC=CC=C7/C(=N/NC8=C(C(=CC=C8)Cl)C)/C6=O	{1: 2, 34: 2, 14: 22, 15: 4, 17: 2, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	56359-28-5	CCCCN1C2C1C(=O)C3=CC=CC=C23	{1: 1, 2: 3, 33: 1, 12: 2, 14: 4, 25: 1}
Did not match all atoms present	56359-29-6	C1=CC=C(C=C1)[N+]2=CC3=CC=CC=C3C(=C2)[O-]	{33: 1, 14: 11}
Did not match all atoms present	56359-30-9	COC1=CC=C(C=C1)[N+]2=CC3=CC=CC=C3C(=C2)[O-]	{1: 1, 22: 1, 14: 10, 33: 1}
Did not match all atoms present	56359-31-0	C1=CC=C2C(=C1)C=[N+](C=C2[O-])C3=CC=C(C=C3)[N+](=O)[O-]	{33: 1, 38: 1, 14: 10}
Did not match all atoms present	5636-83-9	CC(C1=CC=CC=N1)C2=C(CC3=CC=CC=C32)CCN(C)C	{1: 3, 2: 2, 3: 1, 33: 1, 11: 1, 14: 8, 15: 2, 35: 1}
Did not match all atoms present	56361-55-8	CC(C)(C1=CC=C(C=C1)OCCOCCOC(=O)C=C)C2=CC=C(C=C2)OCCOCCOC(=O)C=C	{1: 2, 2: 8, 4: 1, 5: 2, 6: 2, 14: 8, 22: 4, 28: 2}
Did not match all atoms present	56362-01-7	C1=C(C=C(C(=C1Br)OC2=NC(=NC(=N2)OC3=C(C=C(C=C3Br)Br)Br)OC4=C(C=C(C=C4Br)Br)Br)Br)Br	{18: 9, 35: 3, 22: 3, 14: 6}
Did not match all atoms present	56363-84-9	C1=CC(=C(C=C1O)Cl)C(=O)O	{17: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	5637-83-2	C1(=NC(=NC(=N1)N=[N+]=[N-])N=[N+]=[N-])N=[N+]=[N-]	{34: 6, 35: 3}
Did not match all atoms present	5637-96-7	CCCCCCCCC(CCCCCCCC)CCC1=CC=CC=C1	{1: 2, 2: 16, 3: 1, 14: 5}
Did not match all atoms present	56370-30-0	CCOC1=CC=C(C=C1)CCN	{1: 1, 2: 3, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	56374-57-3	C/C=C/C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 14: 15, 6: 3}
Did not match all atoms present	56378-72-4	C(=O)(O)[O-].O.O.O.O.O.[OH-].[Mg+2]	{27: 1}
Did not match all atoms present	5638-76-6	CNCCC1=CC=CC=N1	{1: 1, 2: 2, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	56386-98-2	CC1=C(C=CC(=C1)N)N.C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O	{1: 1, 2: 1, 8: 2, 11: 13, 12: 4, 34: 2, 14: 3, 28: 1, 29: 2, 30: 2}
Did not match all atoms present	56388-47-7	CCCCCCCCCCCCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 15, 14: 7}
Did not match all atoms present	56388-48-8	CCCCCCCCCCCCCCCCCCC1=CC=CC2=CC=CC=C21	{1: 1, 2: 17, 14: 7}
Did not match all atoms present	56390-16-0	C[C@H]1[C@H]2CC3=C([C@@]1(CCN2CCCC(=O)C4=CC=C(C=C4)F)C)C=C(C=C3)O	{1: 2, 2: 3, 33: 1, 11: 3, 12: 2, 13: 1, 14: 7, 16: 1, 21: 1, 24: 1}
Did not match all atoms present	56391-57-2	CCN[C@@H]1C[C@@H]([C@H]([C@@H]([C@H]1O[C@@H]2[C@@H]([C@H]([C@@](CO2)(C)O)NC)O)O)O[C@@H]3[C@@H](CC=C(O3)CN)N)N.CCN[C@@H]1C[C@@H]([C@H]([C@@H]([C@H]1O[C@@H]2[C@@H]([C@H]([C@@](CO2)(C)O)NC)O)O)O[C@@H]3[C@@H](CC=C(O3)CN)N)N.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O	{1: 6, 2: 4, 11: 6, 12: 20, 13: 2, 14: 2, 15: 2, 20: 16, 22: 4, 23: 4, 29: 10, 30: 6, 31: 4}
Did not match all atoms present	56392-17-7	CC(C)NCC(COC1=CC=C(C=C1)CCOC)O.CC(C)NCC(COC1=CC=C(C=C1)CCOC)O.C(C(C(=O)O)O)(C(=O)O)O	{1: 6, 2: 8, 3: 6, 14: 8, 20: 4, 22: 4, 27: 2, 31: 2}
Did not match all atoms present	56395-29-0	CC1=C(C=CC(=C1)NN=C2C=CC(=O)C=C2)N=NC3=CC=C(C=C3)NC(=O)C	{1: 2, 34: 3, 14: 11, 15: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	56395-51-8	CCOC(=CC(=O)OCC)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 2, 2: 2, 38: 1, 6: 1, 7: 1, 14: 3, 17: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	56396-10-2	COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)N/N=C\3/C4=CC=CC=C4C=C(C3=O)C(=O)N	{1: 1, 34: 1, 14: 13, 15: 2, 22: 1, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	56399-35-0	COP(=O)(O)OP(=O)(O)O	{1: 1, 20: 3, 29: 2, 22: 2}
Did not match all atoms present	564-25-0	C[C@@H]1[C@H]2[C@@H]([C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O	{1: 3, 33: 1, 12: 5, 13: 1, 14: 3, 15: 4, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	564-36-3	CC(C)C1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O	{32: 1, 1: 5, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	56400-02-3	N#[N+][S-]	{34: 1}
Did not match all atoms present	56405-32-4	C1=CC(=CC=C1N)NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)O	{34: 3, 14: 10, 15: 2, 20: 2, 25: 1, 29: 4, 30: 3, 31: 1}
Did not match all atoms present	56405-37-9	CC1=[N+](C2=CC=CC=C2S1)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 41: 1, 14: 4, 29: 3}
Did not match all atoms present	56405-41-5	CN(CCS(=O)(=O)[O-])C1=CC=C(C=C1)C=O.[Na+]	{1: 1, 2: 2, 33: 1, 14: 4, 26: 1, 29: 3}
Did not match all atoms present	56418-72-5	CC1=C(C=CC=C1Cl)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)NC(=O)C6=CC7=CC=CC=C7/C(=N\NC8=C(C(=CC=C8)Cl)C)/C6=O	{1: 2, 34: 2, 14: 24, 15: 4, 17: 2, 24: 3, 25: 2, 31: 5}
Did not match all atoms present	56420-45-2	C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N)O	{1: 2, 2: 1, 11: 3, 12: 5, 13: 1, 14: 3, 20: 3, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	56423-40-6	CCC(C)C(=O)OCC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	56423-47-3	CC1=C(C=C(C=C1)C(=C)C)O	{1: 2, 21: 1, 5: 1, 14: 3, 7: 1}
Did not match all atoms present	56423-99-5	CCOC(=O)C1=NC2=NC(=CC(=O)N2N1)C	{32: 1, 1: 2, 2: 1, 35: 2, 33: 1, 14: 1, 25: 1, 28: 1}
Did not match all atoms present	56424-77-2	CCOC(=O)COC1=CC=CC=C1C(=O)OCC	{1: 2, 2: 3, 28: 2, 22: 1, 14: 4}
Did not match all atoms present	56425-91-3	CC(C)C(C1=CC=C(C=C1)OC(F)(F)F)(C2=CN=CN=C2)O	{1: 2, 3: 1, 4: 2, 14: 7, 16: 3, 35: 2, 20: 1, 22: 1}
Did not match all atoms present	56428-00-3	C1=CC(=CC=C1COCC2=CC=C(C=C2)Cl)Cl	{17: 2, 2: 2, 22: 1, 14: 8}
Did not match all atoms present	56430-08-1	CC1=CC=C(C=C1)N2C(=O)C=C(N2C)C	{1: 3, 33: 2, 14: 5, 25: 1}
Did not match all atoms present	56431-61-9	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=CC(=O)C3=C2N)S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-].[Na+].[Na+]	{34: 1, 38: 1, 14: 7, 15: 6, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	56433-01-3	C1=CC(=C(C(=C1)Cl)CBr)[N+](=O)[O-]	{17: 1, 2: 1, 38: 1, 18: 1, 14: 3}
Did not match all atoms present	56433-30-8	CC1=CC(=O)N2C(=N1)N=C(N2)CCl	{32: 1, 1: 1, 2: 1, 35: 2, 33: 1, 14: 1, 17: 1, 25: 1}
Did not match all atoms present	56442-22-9	C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3	{2: 2, 28: 1, 22: 1, 14: 14}
Did not match all atoms present	56444-79-2	CC1=CC(=C(C(=C1)C)OP(=O)(OC2=C(C=C(C=C2C)C)C)OC3=C(C=C(C=C3C)C)C)C	{1: 9, 22: 3, 14: 6, 29: 1}
Did not match all atoms present	56453-08-8	CCCCCCC1C=CC(CC1C(=O)[O-])CCCCCCCC(=O)[O-].[Na+].[Na+]	{1: 1, 2: 12, 11: 1, 12: 3, 14: 2, 24: 2}
Did not match all atoms present	56453-09-9	CCCCCCC1C=CC(CC1C(=O)[O-])CCCCCCCC(=O)[O-].[K+].[K+]	{1: 1, 2: 12, 11: 1, 12: 3, 14: 2, 24: 2}
Did not match all atoms present	56453-93-1	CCOC(=O)C1=C(NC(=C1C)Cl)C	{32: 1, 1: 3, 2: 1, 28: 1, 17: 1}
Did not match all atoms present	56455-90-4	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)OCCCC(=O)O)OCCCC(=O)O)N.Cl.Cl	{2: 6, 14: 6, 17: 2, 22: 2, 27: 2, 30: 2}
Did not match all atoms present	56456-47-4	C1=CC(=C(C=C1F)F)CO	{16: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	56456-50-9	C1=CC(=C(C(=C1)Cl)CO)F	{16: 1, 17: 1, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	56463-61-7	CC1=CC=C(C=C1)C2=C(C(=C(N2)C)C(=O)C)N	{24: 1, 1: 3, 30: 1, 14: 4, 32: 1}
Did not match all atoms present	56463-62-8	CC1=C(C(=C(N1)C2=CC=C(C=C2)OC)N)C(=O)C	{32: 1, 1: 3, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	56463-65-1	CC1=C(C(=C(N1)C2=CC=C(C=C2)F)N)C(=O)C	{32: 1, 1: 2, 14: 4, 16: 1, 24: 1, 30: 1}
Did not match all atoms present	56463-70-8	CC1=CC=CC(=C1)C2=C(C(=C(N2)C)C(=O)C)N	{24: 1, 1: 3, 30: 1, 14: 4, 32: 1}
Did not match all atoms present	56463-73-1	CC1=C(C(=C(N1)C2=CC=C(C=C2)Cl)N)C(=O)C	{32: 1, 1: 2, 14: 4, 17: 1, 24: 1, 30: 1}
Did not match all atoms present	56463-76-4	CC1=CC=CC=C1C2=C(C(=C(N2)C)C(=O)C)N	{24: 1, 1: 3, 30: 1, 14: 4, 32: 1}
Did not match all atoms present	56464-05-2	CC1=C(C(=C(N1)C2=CC=CC=C2)N(C)C)C(=O)C	{24: 1, 1: 4, 33: 1, 14: 5, 32: 1}
Did not match all atoms present	56464-19-8	CC1=C(C(=C(N1C)C2=CC=CC=C2)N)C(=O)C	{24: 1, 1: 3, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	56464-20-1	CCN1C(=C(C(=C1C2=CC=CC=C2)N)C(=O)C)C	{1: 3, 2: 1, 33: 1, 14: 5, 24: 1, 30: 1}
Did not match all atoms present	56467-17-5	CC(=C)C(=O)OCCC[Si](OC)(OC)OC.CC(=O)OC=C	{1: 5, 2: 3, 5: 2, 6: 1, 7: 1, 22: 3, 28: 2}
Did not match all atoms present	56484-15-2	CCCCCCCCC1=NCCN1CCOCCC(=O)[O-].[Na+]	{1: 1, 2: 11, 35: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1}
Did not match all atoms present	56484-47-0	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4[C@@H]([C@@H](C=C5)O)O)C=C2	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	56488-59-6	CC(C)(C)C1=CC=C(C=C1)OCC(COC2=CC=C(C=C2)C(=O)O)O	{1: 3, 2: 2, 3: 1, 4: 1, 14: 8, 20: 1, 22: 2, 27: 1}
Did not match all atoms present	5649-36-5	CC1=CC2=C(C=C1)C=C(N2)C	{32: 1, 1: 2, 14: 4}
Did not match all atoms present	5649-79-6	CCN(CC)CCCNC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])C	{1: 3, 2: 5, 38: 1, 33: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	565-20-8	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 14: 8, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	565-33-3	CC1=C(C=C(C=C1)S(=O)(=O)NC(=O)NC2CCCCC2)N	{1: 1, 11: 5, 12: 1, 14: 3, 24: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	565-73-1	C(=O)(C(=O)[O-])N.[Na+]	{24: 2, 30: 1}
Did not match all atoms present	5650-40-8	CC(C(=O)C1=CC=CC=C1)O	{24: 1, 1: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	5650-41-9	C1=CC=C(C=C1)C(=O)CCO	{24: 1, 2: 2, 20: 1, 14: 5}
Did not match all atoms present	5650-44-2	CC(C(=O)C1=CC=CC=C1)NC	{24: 1, 1: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	56501-30-5	CCCCCCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 12, 11: 5, 18: 1}
Did not match all atoms present	56501-31-6	CCCCCCCCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 14, 11: 5, 18: 1}
Did not match all atoms present	56501-32-7	CCCCCCCCCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 15, 11: 5, 18: 1}
Did not match all atoms present	56501-33-8	CCCCCCCCCCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 16, 11: 5, 18: 1}
Did not match all atoms present	56501-34-9	CCCCCCCCCCCCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 18, 11: 5, 18: 1}
Did not match all atoms present	56501-35-0	CCCCCCCCCCCC[N+]1(CCCCC1)[O-]	{1: 1, 2: 11, 11: 5, 29: 1}
Did not match all atoms present	56501-36-1	CCCCCCCCCCCC[N+]1(CCCCCC1)[O-]	{1: 1, 2: 11, 11: 6, 29: 1}
Did not match all atoms present	56504-94-0	CNC1=C2C(=C(C=C1)NCCCO)C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 3, 14: 6, 20: 1, 25: 2, 31: 2}
Did not match all atoms present	56507-10-9	CCCCC1=CC=CC=C1C(=O)[O-].CCCCC1=CC=CC=C1C(=O)[O-].[Zn+2]	{24: 2, 1: 2, 2: 6, 14: 8}
Did not match all atoms present	5651-26-3	C=CC(=O)[O-].[Ag+]	{24: 1, 5: 1, 6: 1}
Did not match all atoms present	5651-47-8	CC(C)C1=CC=CC(=C1)C(=O)O	{27: 1, 1: 2, 3: 1, 14: 4}
Did not match all atoms present	5651-88-7	C#CCSC1=CC=CC=C1	{40: 1, 9: 1, 2: 1, 10: 1, 14: 5}
Did not match all atoms present	56512-49-3	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)Cl	{1: 2, 34: 2, 33: 1, 14: 8, 17: 1, 29: 2}
Did not match all atoms present	56516-72-4	C(C(=O)O)N(CP(=O)(O)O)N=O	{33: 1, 34: 1, 2: 2, 20: 2, 27: 1, 29: 2}
Did not match all atoms present	56519-47-2	C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].O=[Re]	{1: 12, 5: 4, 29: 1}
Did not match all atoms present	56519-51-8	CCC1(C(=O)N(C1=O)C)C2=CC=CC=C2	{1: 2, 2: 1, 33: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	56522-42-0	CC(N=[N+]=[N-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 34: 2, 4: 1, 38: 2}
Did not match all atoms present	56525-23-6	CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Fe+2]	{1: 2, 29: 6}
Did not match all atoms present	56525-25-8	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCOC(=O)CCSCCC(=O)OCCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C	{1: 12, 2: 8, 4: 4, 40: 1, 14: 4, 21: 2, 28: 2}
Did not match all atoms present	56525-86-1	CC1=C(C=C(C=C1)C(CC(C)C2=CC=CC=C2)C3=CC=CC=C3)C	{1: 3, 2: 1, 3: 2, 14: 13}
Did not match all atoms present	56528-99-5	CC1=C(C=CC(=C1C)C(=O)O)C(=O)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCC(=O)O)CCCC(=O)O.C(CCO)CO	{1: 2, 2: 11, 27: 6, 20: 2, 14: 6}
Did not match all atoms present	56529-00-1	CC1=C(C=CC(=C1C)C(=O)O)C(=O)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO.C(CCO)CO	{1: 2, 2: 10, 27: 4, 20: 4, 14: 6}
Did not match all atoms present	5653-40-7	COC1=C(C=C(C(=C1)C(=O)O)N)OC	{1: 2, 30: 1, 27: 1, 22: 2, 14: 2}
Did not match all atoms present	5653-62-3	COC1=CC=CC(=C1OC)C#N	{1: 2, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	5653-67-8	COC1=CC=CC(=C1OC)CO	{1: 2, 2: 1, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	5653-80-5	CCC(=O)C(C[C@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 10, 24: 1}
Did not match all atoms present	56532-85-5	CC(=O)OC(CN1CCN(CC1)CC2=CC=CC=C2)CN3C=NC4=C3C(=O)N(C(=O)N4C)C	{1: 3, 2: 3, 3: 1, 33: 5, 11: 4, 14: 6, 35: 1, 25: 2, 28: 1}
Did not match all atoms present	56535-52-5	CCC[Sn](C)(C)CCC	{1: 4, 2: 4}
Did not match all atoms present	56538-00-2	C1=CC(=C(C=C1[N+](=O)[O-])CNCCCl)O	{2: 3, 38: 1, 14: 3, 17: 1, 21: 1, 31: 1}
Did not match all atoms present	56538-01-3	COC1=C(C=C(C=C1)[N+](=O)[O-])CNCCCl	{1: 1, 2: 3, 38: 1, 14: 3, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	56538-02-4	CCOC1=C(C=C(C=C1)[N+](=O)[O-])CNCCCl	{1: 1, 2: 4, 38: 1, 14: 3, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	5654-07-9	C[Si](C)(C)C(=C)[Si](C)(C)C	{1: 6, 5: 1, 7: 1}
Did not match all atoms present	56549-24-7	C1=CC=C2C(=C1)C=CC=[NH+]2.C1=CC=C2C(=C1)C=CC=[NH+]2.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]	{32: 2, 22: 1, 14: 14, 29: 6}
Did not match all atoms present	56552-80-8	C1=CC=C(C=C1)COC[C@@H](CO)O	{2: 3, 3: 1, 20: 2, 22: 1, 14: 5}
Did not match all atoms present	56553-60-7	[B-](OC(=O)C)(OC(=O)C)OC(=O)C.[Na+]	{1: 3, 28: 3}
Did not match all atoms present	56557-00-7	CCCCCCCCCC(=O)C1=C(NN(C1=O)C2=CC=CC=C2)C.CCCCCCCCCC(=O)C1=C(NN(C1=O)C2=CC=CC=C2)C.[Ni]	{32: 2, 1: 4, 2: 16, 33: 2, 14: 10, 24: 2, 25: 2}
Did not match all atoms present	56558-16-8	C1=CC(=C(C(=C1)Cl)C2=C(C=C(C=C2Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	56558-18-0	C1=C(C=C(C=C1Cl)Cl)C2=C(C=C(C=C2Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	5656-10-0	C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)O)N=NC3=C(C=C(C=C3)N)S(=O)(=O)O)S(=O)(=O)O	{33: 1, 34: 2, 35: 1, 12: 1, 14: 7, 15: 1, 20: 2, 25: 1, 27: 1, 29: 4, 30: 1}
Did not match all atoms present	5656-90-6	C1=CC2=C3C(=C1)C(OC(=O)C3=CC=C2)O	{20: 1, 12: 1, 14: 6, 28: 1}
Did not match all atoms present	56564-56-8	N(P(F)F)(P(F)F)P(F)F	{16: 6, 33: 1}
Did not match all atoms present	56580-70-2	C[Sn](C)(C)CC[Sn](C)(C)C	{1: 6, 2: 2}
Did not match all atoms present	56580-71-3	C[Sn](C)(C)C1C2CCC(C2)C1[Sn](C)(C)C	{1: 6, 11: 3, 12: 4}
Did not match all atoms present	56583-56-3	C1=CC=C2C(=C1)C=CC=[N+]2CCOC(=O)CCC(=O)OCC[N+]3=CC=CC4=CC=CC=C43.[I-].[I-]	{33: 2, 2: 6, 19: 2, 28: 2, 14: 14}
Did not match all atoms present	56593-14-7	C(F)(F)(F)[Ge](C(F)(F)F)(Cl)Cl	{16: 6, 17: 2, 4: 2}
Did not match all atoms present	56593-15-8	C(F)(F)(F)[Ge](Br)(Br)Br	{16: 3, 18: 3, 4: 1}
Did not match all atoms present	56593-16-9	C(F)(F)(F)[Ge](C(F)(F)F)(Br)Br	{16: 6, 18: 2, 4: 2}
Did not match all atoms present	56594-76-4	CC1=CC(=CC2=CC=CC2=C1)C	{1: 2, 14: 6}
Did not match all atoms present	56594-77-5	CC1=C(C2=CC=CC2=CC=C1)C	{1: 2, 14: 6}
Did not match all atoms present	56594-78-6	CC1=CC=C2C=CC=C2C(=C1)C	{1: 2, 14: 6}
Did not match all atoms present	56595-08-5	C1=CC=C2C(=C1)C=NC(=N2)F	{16: 1, 35: 2, 14: 5}
Did not match all atoms present	56595-09-6	C1=CC=C2C(=C1)C(=NC=N2)F	{16: 1, 35: 2, 14: 5}
Did not match all atoms present	56595-10-9	C1=CC=C2C(=C1)C(=NC(=N2)F)F	{16: 2, 35: 2, 14: 4}
Did not match all atoms present	56595-11-0	C1=CC(=NC2=C1C=CC(=N2)F)F	{16: 2, 35: 2, 14: 4}
Did not match all atoms present	56595-12-1	C12=C(C(=C(N=C1N=C(C(=C2F)F)F)F)F)F	{16: 6, 35: 2}
Did not match all atoms present	56595-13-2	C1=C2C=C(N=C(C2=C(N=C1F)F)F)F	{16: 4, 35: 2, 14: 2}
Did not match all atoms present	56595-14-3	C12=C(C(=NC(=C1F)F)F)C(=NC(=C2F)F)F	{16: 6, 35: 2}
Did not match all atoms present	56598-46-0	C1=C(C=NC=N1)C2=CN=CN=C2	{35: 4, 14: 6}
Did not match all atoms present	56601-42-4	C1CC1N=C=S	{8: 1, 34: 1, 11: 2, 12: 1}
Did not match all atoms present	56606-38-3	C1=C2C(=NC=N1)C(=O)NC2=O	{32: 1, 25: 2, 35: 2, 14: 2}
Did not match all atoms present	5661-14-3	CC(=O)NS(=O)(=O)C1=CC=CC=C1	{24: 1, 1: 1, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	56611-65-5	CCOC(=O)C1=C(C=C2C(=NNC(=O)C2=C1C)CO)C	{32: 1, 1: 3, 2: 2, 35: 1, 14: 1, 20: 1, 25: 1, 28: 1}
Did not match all atoms present	56613-80-0	C1=CC=C(C=C1)[C@H](CO)N	{2: 1, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	56614-97-2	C1=CC2=C(C=CC(=C2)O)C3=CC4=C(C=C31)C=C(C=C4)O	{21: 2, 14: 10}
Did not match all atoms present	56616-84-3	CC1=NN=C(N1C)Br	{1: 2, 18: 1, 35: 2, 33: 1}
Did not match all atoms present	56616-85-4	CC1=NN=C(N1C)Cl	{1: 2, 35: 2, 33: 1, 17: 1}
Did not match all atoms present	56616-87-6	CN1C=NN=C1Cl	{1: 1, 35: 2, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	56616-91-2	CN1C=NC(=N1)Br	{1: 1, 18: 1, 35: 2, 14: 1, 33: 1}
Did not match all atoms present	56616-92-3	CN1C=NC(=N1)Cl	{1: 1, 35: 2, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	56616-93-4	CC1=NC(=NN1C)Br	{1: 2, 18: 1, 35: 2, 33: 1}
Did not match all atoms present	56616-94-5	CC1=NC(=NN1C)Cl	{1: 2, 35: 2, 33: 1, 17: 1}
Did not match all atoms present	56616-96-7	CC1=NN(C(=N1)Br)C	{1: 2, 18: 1, 35: 2, 33: 1}
Did not match all atoms present	56616-97-8	CC1=NN(C(=N1)Cl)C	{1: 2, 35: 2, 33: 1, 17: 1}
Did not match all atoms present	56616-99-0	CN1C(=NC=N1)Cl	{1: 1, 35: 2, 33: 1, 14: 1, 17: 1}
Did not match all atoms present	56617-69-7	CCCCCC1=NC(=CN=C1C)C	{1: 3, 2: 4, 35: 2, 14: 1}
Did not match all atoms present	56617-70-0	CCC(C)CC1=NC=C(N=C1C)C	{1: 4, 2: 2, 3: 1, 14: 1, 35: 2}
Did not match all atoms present	56619-94-4	CC(C)(C)C(=O)NC1=CC=C(C=C1)OC	{1: 4, 4: 1, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5662-02-2	C1=CC=C2C(=C1)C=CC(=C3C(=O)C4=CC=CC=C4C3=O)N2	{32: 1, 25: 2, 14: 10, 15: 2}
Did not match all atoms present	56622-38-9	CC(=O)C(=CC1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC	{1: 3, 6: 1, 7: 1, 14: 8, 22: 2, 24: 1}
Did not match all atoms present	5663-71-8	CC(=O)OC1=CC=CC=C1C(=O)N	{24: 1, 1: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	56633-19-3	C1=CC=C2C(=C1)C(=O)C=C(C2=O)S(=O)(=O)[O-].[NH4+]	{25: 2, 29: 3, 14: 5, 15: 1}
Did not match all atoms present	56640-11-0	CC1=CC=CC=C1/C=C/C(=O)C	{24: 1, 1: 2, 14: 4, 6: 2}
Did not match all atoms present	56643-49-3	CC1=CC(=NC2=C1C=CC(=C2)OC)N3CCCCCC3	{1: 2, 35: 1, 33: 1, 11: 6, 14: 4, 22: 1}
Did not match all atoms present	56644-06-5	C1=CC=C(C=C1)CCCCCCCl	{17: 1, 2: 6, 14: 5}
Did not match all atoms present	5665-94-1	CC1=C(C=C(C(=C1)Cl)C(C)C)O	{1: 3, 3: 1, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	56651-57-1	CC1=CC=C(C=C1)CN=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	56651-58-2	CC1=CC=CC=C1CN=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	56651-60-6	COC1=CC=C(C=C1)CN=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	5666-12-6	C1CCN(C1)P(N2CCCC2)N3CCCC3	{33: 3, 11: 12}
Did not match all atoms present	56660-19-6	CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]	{1: 8, 2: 24, 29: 6, 22: 1}
Did not match all atoms present	56660-53-8	CCCCP(CCCC)CC1=CC=CC=C1	{1: 2, 2: 7, 14: 5}
Did not match all atoms present	56660-54-9	CCCCP(CCCC)CC=C	{1: 2, 2: 7, 5: 1, 6: 1}
Did not match all atoms present	56662-52-3	CCCCCCCCCCCCCCCCCC1[N-]C2=CC=CC=C2N1CC3=CC=CC=C3.[Na+]	{1: 1, 2: 17, 35: 1, 33: 1, 12: 1, 14: 9}
Did not match all atoms present	56663-29-7	CC(CC(=O)[O-])CC(C)(C)C.[Cr+3]	{24: 1, 1: 4, 2: 2, 3: 1, 4: 1}
Did not match all atoms present	56667-01-7	CC1=C(C(=C(C=C1)C2=C(C(=C(C=C2)C)C)C)C)C	{1: 6, 14: 4}
Did not match all atoms present	56668-59-8	[Ni].[Ni].[Ni].[Ga].[Ga]	{}
Did not match all atoms present	5667-20-9	C1=NC2=C(N1)C(=NC=N2)NO	{32: 1, 35: 3, 20: 1, 14: 2, 31: 1}
Did not match all atoms present	56670-24-7	C1=CC(=O)C=CC1=NNC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NNC4=C5C(=CC(=CC5=O)S(=O)(=O)O)C=CC4=N	{34: 1, 36: 1, 14: 16, 15: 6, 20: 1, 24: 1, 25: 2, 29: 2, 31: 4}
Did not match all atoms present	56670-26-9	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)O)C)C6=CC=C(C=C6)S(=O)(=O)O	{1: 2, 34: 4, 35: 2, 33: 2, 12: 2, 14: 16, 15: 2, 20: 2, 24: 1, 25: 2, 29: 4, 31: 1}
Did not match all atoms present	56675-37-7	CC(C)(C)OC(=O)N[C@@H](CC1=CC=CS1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 41: 1, 14: 3, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	5668-93-9	CCC1=CC=CC(=C1)C2=CC=CC=C2	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	56683-55-7	C1COCCOC2=C(C=C(C=C2)C(=O)O)OCCOCCO1	{27: 1, 11: 8, 14: 3, 23: 5}
Did not match all atoms present	567-13-5	C1=CC=C2C(=C1)C(=CC(=C2O)N)S(=O)(=O)O	{30: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	567-18-0	C1=CC=C2C(=C1)C=CC(=C2O)S(=O)(=O)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	567-47-5	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)O)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	5670-67-7	C1=CC=C(C(=C1)C=C[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 4, 6: 2}
Did not match all atoms present	56706-10-6	CCO[Si](CCCSSCCC[Si](OCC)(OCC)OCC)(OCC)OCC	{40: 2, 1: 6, 2: 12, 22: 6}
Did not match all atoms present	56709-05-8	CCO[Si](CCCN(CC(CCl)O)CC(CCl)O)(OCC)OCC	{1: 3, 2: 10, 3: 2, 33: 1, 17: 2, 20: 2, 22: 3}
Did not match all atoms present	5671-09-0	C1=CC(=CC(=C1)Br)/C=C\2/C(=O)N3C4=NC=C(C=C4N=C3S2)Br	{33: 1, 35: 2, 6: 1, 41: 1, 14: 6, 18: 2, 25: 1}
Did not match all atoms present	56717-11-4	CC(C)CCCC(C)CC[N+]1(CCCCC1)CC=C.[Br-]	{1: 3, 2: 6, 3: 2, 5: 1, 6: 1, 11: 5, 18: 1}
Did not match all atoms present	5672-83-3	COC(=O)[C@H](CCC(=O)O)NC(=O)OCC1=CC=CC=C1	{1: 1, 2: 3, 3: 1, 14: 5, 27: 1, 28: 2, 31: 1}
Did not match all atoms present	5672-84-4	C1=CC(=CC=C1OC(=O)C(F)(F)F)Br	{16: 3, 28: 1, 18: 1, 4: 1, 14: 4}
Did not match all atoms present	56724-82-4	C1=CC=C(C=C1)N/N=C(/N=NC2=CC=CC=C2)\S[Hg]C3=CC=CC=C3	{40: 1, 34: 3, 31: 1, 14: 15, 7: 1}
Did not match all atoms present	56729-01-2	C(C(CCl)O)O.OP(=O)(O)O	{17: 1, 2: 2, 3: 1, 20: 5, 29: 1}
Did not match all atoms present	56729-72-7	Br[W]Br.Br[W](Br)(Br)Br	{18: 6}
Did not match all atoms present	5673-07-4	CC1=C(C=CC=C1OC)OC	{1: 3, 22: 2, 14: 3}
Did not match all atoms present	56730-08-6	[O-]P.[Na+]	{29: 1}
Did not match all atoms present	5674-02-2	CC(C)[CH2-].[Mg+2].[Cl-]	{1: 2, 3: 1, 5: 1, 17: 1}
Did not match all atoms present	56741-95-8	C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N)Br	{32: 1, 35: 1, 14: 5, 18: 1, 25: 1, 30: 1}
Did not match all atoms present	56742-37-1	C1=C[Se]/C(=C/2\SC=C[Se]2)/S1	{41: 2, 14: 4, 15: 2}
Did not match all atoms present	56742-57-5	C[N+](C)(CCO)CCO.[OH-]	{1: 2, 2: 4, 20: 2}
Did not match all atoms present	56743-33-0	C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N=[N+]=[N-]	{34: 2, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	56744-46-8	CC(=C)C(=O)OCCOCCOCCOC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCCOCCOCCOC(=O)C(=C)C	{1: 4, 2: 12, 4: 1, 5: 2, 7: 2, 14: 8, 22: 6, 28: 2}
Did not match all atoms present	56744-60-6	CC(=C)C(=O)OCCOCCOC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCCOCCOC(=O)C(=C)C	{1: 4, 2: 8, 4: 1, 5: 2, 7: 2, 14: 8, 22: 4, 28: 2}
Did not match all atoms present	5675-57-0	CCOC(=O)/C=C(/C)\OP(=O)(OCC)OCC	{1: 4, 2: 3, 6: 1, 7: 1, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	5675-64-9	C1CC2C3=CC=CC=C3C1C4=CC=CC=C24	{11: 2, 12: 2, 14: 8}
Did not match all atoms present	56751-92-9	C1CC2=CC=C3N2N4C(=CC=C4CCC3)C1	{33: 2, 11: 6, 14: 4}
Did not match all atoms present	56759-60-5	CC1=C(C(=C(C(=C1Br)O)Br)C)Br	{1: 2, 18: 3, 21: 1}
Did not match all atoms present	5676-29-9	CC(C)(C)C(=C)C1=CC=CC=C1	{1: 3, 4: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	5676-32-4	CCCC(=C)C1=CC=CC=C1	{1: 1, 2: 2, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	5676-58-4	CC1=CC2=C(C=C1)OC(=N2)C	{1: 2, 35: 1, 14: 3, 23: 1}
Did not match all atoms present	56762-23-3	C1=CC=C(C=C1)C(C(CBr)Br)Br	{2: 1, 3: 2, 18: 3, 14: 5}
Did not match all atoms present	56765-79-8	C1=CC(=C(C=C1N)C#N)C#N	{30: 1, 14: 3, 37: 2}
Did not match all atoms present	56767-12-5	CCCCC(=O)O.[Pb]	{1: 1, 2: 3, 27: 1}
Did not match all atoms present	56767-15-8	CN(C)C(=O)C(C#C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 4: 1, 33: 1, 9: 1, 10: 1, 14: 10, 24: 1}
Did not match all atoms present	56773-42-3	CC[N+](CC)(CC)CC.C(C(C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 17, 1: 4, 2: 4, 4: 8, 29: 3}
Did not match all atoms present	56773-61-6	CCN(CCOC)C1=CC=CC(=C1)C	{1: 3, 2: 3, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	56775-58-7	CC1=C(C2=C(C=C1)C(=CC=C2)N=C=O)N=C=O	{8: 2, 1: 1, 34: 2, 29: 2, 14: 5}
Did not match all atoms present	56775-88-3	CN(C)CC=C(C1=CC=C(C=C1)Br)C2=CN=CC=C2	{1: 2, 2: 1, 35: 1, 33: 1, 6: 1, 7: 1, 14: 8, 18: 1}
Did not match all atoms present	56776-01-3	CC(C)(C)NCC(C1=CC=CC=C1Cl)O.Cl	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 17: 2, 20: 1, 31: 1}
Did not match all atoms present	56776-25-1	CCN(CC)CCO/N=C(\C1=C(C(=C(C=C1)OC)Cl)Cl)/C2=CC=CO2.CS(=O)(=O)O	{1: 4, 2: 4, 33: 1, 7: 1, 34: 1, 14: 5, 17: 2, 20: 1, 22: 2, 23: 1, 29: 2}
Did not match all atoms present	5678-45-5	COC1=CC=C(C=C1)C(CC(=O)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	56780-28-0	O=[Mo].[Fe].[Bi]	{29: 1}
Did not match all atoms present	5679-59-4	C1=CC=C(C=C1)NP=NC2=CC=CC=C2	{34: 1, 14: 10, 31: 1}
Did not match all atoms present	5679-89-0	CC1=C(C=C(C=C1)N=[N+](C2=CC(=C(C=C2)C)[N+](=O)[O-])[O-])[N+](=O)[O-]	{1: 2, 34: 1, 38: 2, 33: 1, 14: 6, 29: 1}
Did not match all atoms present	56791-59-4	CCOC(=O)CN1C=NC2=C1N=CN=C2Cl	{1: 1, 2: 2, 35: 3, 33: 1, 14: 2, 17: 1, 28: 1}
Did not match all atoms present	56791-69-6	CCC(CO)(CO)CO.CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N=C=O)C)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O	{1: 3, 2: 11, 4: 1, 8: 2, 34: 2, 14: 6, 20: 5, 27: 2, 29: 2}
Did not match all atoms present	56796-20-4	CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@](C3=O)(NC(=O)CSCC#N)OC)SC2)C(=O)O	{1: 2, 2: 3, 35: 3, 37: 1, 33: 2, 40: 2, 41: 1, 11: 1, 12: 1, 13: 1, 15: 2, 22: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	56796-56-6	C1N2CN3CN1CP(=S)(C2)C3	{33: 3, 11: 6}
Did not match all atoms present	56797-01-4	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ce+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	56797-10-5	CC(C)([CH2-])C1=CC=CC=C1.CC(C)([CH2-])C1=CC=CC=C1.CC(C)([CH2-])C1=CC=CC=C1.CC(C)([CH2-])C1=CC=CC=C1.[Zr+4]	{1: 8, 4: 4, 5: 4, 14: 20}
Did not match all atoms present	56797-55-8	[H].[H].[Po+]	{}
Did not match all atoms present	56799-32-7	CN(C)C1=C2C(=C(C=C1)N(C)C)C(=O)C3=CC=CC=C3C2=O	{1: 4, 33: 2, 14: 6, 25: 2}
Did not match all atoms present	568-01-4	CN1C2=CC=CC=C2C(=O)C3=C1C4=C(C(=C3OC)OC)OCO4	{1: 3, 33: 1, 11: 1, 14: 4, 22: 2, 23: 2, 25: 1}
Did not match all atoms present	568-02-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=O)C(=C4C3=CC=CN4)O	{32: 1, 25: 3, 21: 1, 14: 7}
Did not match all atoms present	568-21-8	CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=CC=C4)OC)O)OC	{1: 3, 33: 1, 11: 3, 12: 1, 14: 4, 21: 1, 22: 2}
Did not match all atoms present	568-69-4	CN(C)CC(=C(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC.Cl	{1: 5, 2: 1, 33: 1, 7: 2, 14: 12, 17: 1, 22: 3}
Did not match all atoms present	568-70-7	CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C14)CO	{1: 1, 2: 1, 20: 1, 14: 10}
Did not match all atoms present	568-75-2	CC1=C2C(=C(C3=CC=CC=C13)CO)C=CC4=CC=CC=C42	{1: 1, 2: 1, 20: 1, 14: 10}
Did not match all atoms present	568-81-0	CC1=CC2=CC=CC=C2C3=C(C4=CC=CC=C4C=C13)C	{1: 2, 14: 10}
Did not match all atoms present	568-93-4	C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)[N+](=O)[O-]	{25: 2, 38: 1, 21: 2, 14: 5}
Did not match all atoms present	568-99-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)N)O	{25: 2, 30: 1, 21: 1, 14: 6}
Did not match all atoms present	5680-61-5	CCOC(=O)C(C(=O)OCC)N1C(=O)C2=CC=CC=C2C1=O	{1: 2, 2: 2, 3: 1, 33: 1, 14: 4, 25: 2, 28: 2}
Did not match all atoms present	56802-53-0	[O-2].[S-2].[La]	{}
Did not match all atoms present	56818-06-5	C1CC2=CC=CC=C2CC1CC3=CC=CC4=CC=CC=C43	{2: 1, 11: 3, 12: 1, 14: 11}
Did not match all atoms present	5682-80-4	[Cl-].[Tl+]	{17: 1}
Did not match all atoms present	56821-76-2	COC1=CC=CC=C1[Te][Te]C2=CC=CC=C2OC	{1: 2, 22: 2, 14: 8}
Did not match all atoms present	56827-92-0	CCCCCCCCCCCCCCCCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 15, 22: 3, 14: 10, 29: 1}
Did not match all atoms present	5683-30-7	C[Si](C)(C)CCC(=O)O	{1: 3, 2: 2, 27: 1}
Did not match all atoms present	5683-31-8	C[Si](C)(C)C#CC(=O)O	{1: 3, 10: 2, 27: 1}
Did not match all atoms present	5683-33-0	CN(C)C1=CC=CC=N1	{1: 2, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	5683-41-0	CC1=CC2=C(C=C1C)SC(=N2)C	{1: 3, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	56831-62-0	CCCCCCCCCCCCCO.OP(=O)(O)O	{1: 1, 2: 12, 20: 4, 29: 1}
Did not match all atoms present	56836-93-2	CC(CC1=CC=CC=C1)C(C)O	{1: 2, 2: 1, 3: 2, 20: 1, 14: 5}
Did not match all atoms present	56839-43-1	CCC1=CC=C(C=C1)C(=O)C(C)CN2CCCCC2.Cl	{1: 2, 2: 2, 3: 1, 33: 1, 11: 5, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	5684-13-9	CCC1C(CCC2=C1C=CC3=C2C=CC(=C3)OC)C(=O)OC	{1: 3, 2: 1, 11: 2, 12: 2, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	56841-49-7	CC(C)CCCCCCC1=CC=C(C=C1)NC2=CC=CC=C2	{1: 2, 2: 6, 3: 1, 14: 9, 31: 1}
Did not match all atoms present	56842-61-6	CC1=C(C(=NC(=C1N=NC2=CC=CC=C2C#N)NCCOC)NCCOC)C#N	{1: 3, 2: 4, 35: 1, 37: 2, 34: 2, 14: 4, 22: 2, 31: 2}
Did not match all atoms present	56846-22-1	CC(C)CCCCCOP(=O)(OCCCCCC(C)C)OC1=CC=CC=C1	{1: 4, 2: 10, 3: 2, 14: 5, 22: 3, 29: 1}
Did not match all atoms present	5685-07-4	CN1C=CSC1=S	{1: 1, 41: 1, 14: 2, 33: 1}
Did not match all atoms present	5685-38-1	C1C(C1C(=O)O)C2=CC=CC=C2	{27: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	56862-61-4	CC(C)(C(=O)N)OS(=O)(=O)O.OS(=O)(=O)O	{1: 2, 4: 1, 20: 3, 22: 1, 24: 1, 29: 4, 30: 1}
Did not match all atoms present	56866-67-2	C[Ge](C)(C)C1=CC=C(C=C1)Cl	{1: 3, 14: 4, 17: 1}
Did not match all atoms present	5687-22-9	C1=CC=C2C(=C1)C3=CC=CC=C3[As]2(=O)O	{20: 1, 29: 1, 14: 8}
Did not match all atoms present	5687-92-3	C1CS(=O)(=O)C1	{11: 3, 29: 2}
Did not match all atoms present	56877-15-7	CC1=NN(C(=C1C(=O)C2=CC=CC=C2F)NC)C	{1: 3, 35: 1, 33: 1, 14: 4, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	56878-25-2	CN1C(=C(C(=O)O1)C=O)C2=CC=CC=C2	{1: 1, 26: 1, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	5688-80-2	CC(CC1=CC(=C(C(=C1)OC)OC)OC)N.Cl	{1: 4, 2: 1, 3: 1, 14: 2, 17: 1, 22: 3, 30: 1}
Did not match all atoms present	56890-89-2	C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C3=C(C=C(C=C3Br)Br)Br	{11: 1, 12: 1, 13: 3, 14: 2, 15: 2, 17: 6, 18: 3}
Did not match all atoms present	56891-99-7	CC(C)C1=CN=C(C=N1)OC	{1: 3, 3: 1, 22: 1, 14: 2, 35: 2}
Did not match all atoms present	56892-20-7	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)S(=O)(=O)CCOS(=O)(=O)O)OC)C3=CC=C(C=C3)S(=O)(=O)O	{1: 2, 2: 2, 35: 1, 33: 1, 12: 1, 34: 2, 14: 7, 15: 1, 20: 2, 22: 2, 25: 1, 29: 6}
Did not match all atoms present	56892-30-9	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=CC(=CC(=C54)C=C3)O	{21: 1, 14: 11}
Did not match all atoms present	56892-31-0	C1=CC2=C3C(=C1)C=CC4=C5C(=CC(=C43)C=C2)C=CC=C5O	{21: 1, 14: 11}
Did not match all atoms present	56892-32-1	C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C(=CC5=CC=C4)O	{21: 1, 14: 11}
Did not match all atoms present	56892-33-2	C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C=C(C5=CC=C4)O	{21: 1, 14: 11}
Did not match all atoms present	56894-91-8	C1=CC(=CC=C1COCCl)COCCl	{17: 2, 2: 4, 22: 2, 14: 4}
Did not match all atoms present	56898-50-1	B.COC1=CC=NC=C1	{1: 1, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	56898-51-2	[B].CC(C)(C)C1=CC=NC=C1	{1: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	56898-53-4	B.C1=CN=CC=C1Br	{18: 1, 35: 1, 14: 4}
Did not match all atoms present	56898-55-6	B.C1=CN=CC=C1[N+](=O)[O-]	{35: 1, 38: 1, 14: 4}
Did not match all atoms present	56899-77-5	C1CC(CCC1CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{2: 2, 11: 4, 12: 2, 14: 7, 20: 2, 27: 3, 28: 2}
Did not match all atoms present	569-06-2	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)F	{16: 1, 25: 2, 14: 7}
Did not match all atoms present	569-08-4	C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC(=C3)O	{25: 2, 21: 2, 14: 6}
Did not match all atoms present	569-31-3	COC1=C(C2=C(COC2=O)C=C1)OC	{1: 2, 11: 1, 28: 1, 22: 2, 14: 2}
Did not match all atoms present	569-34-6	CN1C2=C(N=C1OC)N(C(=O)N(C2=O)C)C	{1: 4, 35: 1, 33: 3, 22: 1, 25: 2}
Did not match all atoms present	569-41-5	CC1=CC=CC2=C1C(=CC=C2)C	{1: 2, 14: 6}
Did not match all atoms present	569-51-7	C1=CC(=C(C(=C1)C(=O)O)C(=O)O)C(=O)O	{27: 3, 14: 3}
Did not match all atoms present	569-57-3	COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)Cl)C3=CC=C(C=C3)OC	{1: 3, 17: 1, 22: 3, 14: 12, 7: 2}
Did not match all atoms present	569-59-5	CN1CCC2=C(C1)C(C3=CC=CC=C23)C4=CC=CC=C4.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 1, 3: 2, 33: 1, 11: 3, 12: 1, 14: 9, 15: 2, 20: 2, 27: 2}
Did not match all atoms present	569-61-9	C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl	{36: 1, 7: 1, 14: 12, 15: 2, 17: 1, 30: 2}
Did not match all atoms present	569-64-2	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.[Cl-]	{1: 4, 33: 2, 7: 1, 14: 13, 15: 2, 17: 1}
Did not match all atoms present	569-65-3	CC1=CC(=CC=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 1, 2: 1, 3: 1, 33: 2, 11: 4, 14: 13, 17: 1}
Did not match all atoms present	569-77-7	C1=CC(=O)C(=C2C(=C1)C=C(C(=C2O)O)O)O	{25: 1, 21: 4, 14: 4}
Did not match all atoms present	5690-24-4	C1=CC2=C3C(=CC=C4C3=C1C(=O)NC4=O)C(=O)NC2=O	{32: 2, 25: 4, 14: 4}
Did not match all atoms present	56902-79-5	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Zn+2].[Zr+4]	{29: 9}
Did not match all atoms present	56908-88-4	C1=C(C=C(C=C1Br)Br)CBr	{2: 1, 18: 3, 14: 3}
Did not match all atoms present	56911-25-2	C1CC2=C1C=CC=N2	{35: 1, 11: 2, 14: 3}
Did not match all atoms present	56911-27-4	C1CC2=C1C=CN=C2	{35: 1, 11: 2, 14: 3}
Did not match all atoms present	56912-29-9	CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4	{1: 4, 2: 16, 3: 1, 4: 1, 14: 16, 17: 1, 22: 2, 24: 2, 29: 4, 31: 2}
Did not match all atoms present	56912-33-5	CCCCCC1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)OC3=CC=C(C=C3)C(=O)O)CCCCC	{1: 5, 2: 11, 3: 1, 4: 1, 14: 10, 17: 1, 22: 2, 24: 3, 27: 1, 31: 2}
Did not match all atoms present	56918-92-4	CC1=CC(=C(C(=C1N)N=NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)O)N)N=NC5=CC=C(C=C5)S(=O)(=O)O	{1: 1, 34: 5, 14: 16, 15: 2, 20: 1, 24: 1, 25: 1, 27: 1, 29: 2, 30: 2, 31: 2}
Did not match all atoms present	56918-93-5	C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=CC=C(C=C5)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)N/N=C\6/C=CC(=O)C(=C6)C(=O)O	{34: 4, 38: 1, 14: 17, 15: 4, 20: 2, 24: 1, 25: 2, 27: 1, 29: 4, 30: 1, 31: 3}
Did not match all atoms present	56920-20-8	C[Si](C)(C)C1(CO1)[Si](C)(C)C	{1: 6, 11: 1, 13: 1, 23: 1}
Did not match all atoms present	56920-82-2	CCCCOCC1=CC=CO1	{1: 1, 2: 4, 22: 1, 14: 3, 23: 1}
Did not match all atoms present	56927-39-0	CCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-]	{1: 3, 2: 6, 4: 1, 14: 10, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	56927-89-0	CC1=CC(=CC=C1)CN(C)C	{1: 3, 2: 1, 14: 4, 33: 1}
Did not match all atoms present	5693-54-9	C1COC(O1)C2=CC=CC=N2	{35: 1, 11: 2, 12: 1, 14: 4, 23: 2}
Did not match all atoms present	56932-44-6	C1=CC(=C(C=C1[N+](=O)[O-])N)NCCO	{2: 2, 38: 1, 14: 3, 20: 1, 30: 1, 31: 1}
Did not match all atoms present	56935-71-8	C1=CC(=CC=C1C(=NO)N)OC(F)(F)F	{34: 1, 4: 1, 7: 1, 14: 4, 16: 3, 20: 1, 22: 1, 30: 1}
Did not match all atoms present	56935-95-6	CCCCC(CC)C(=O)NC1=CC=CC=C1.[K+]	{1: 2, 2: 4, 3: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	5694-72-4	C1C(OC(O1)CC2=CC=CC=C2)CO	{2: 2, 11: 1, 12: 2, 14: 5, 20: 1, 23: 2}
Did not match all atoms present	56941-72-1	CCCOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OCCC)C(=O)O	{1: 2, 2: 4, 27: 2, 28: 2, 14: 2}
Did not match all atoms present	56946-83-9	C1=C(SC(=C1S(=O)(=O)Cl)Cl)Cl	{17: 3, 29: 2, 14: 1, 41: 1}
Did not match all atoms present	56949-53-2	CC1=CC(=CC(=C1OCCO)Cl)Cl	{1: 1, 2: 2, 14: 2, 17: 2, 20: 1, 22: 1}
Did not match all atoms present	56949-56-5	CC1=CC(=C(C(=C1)OCCO)C)C	{1: 3, 2: 2, 20: 1, 22: 1, 14: 2}
Did not match all atoms present	56954-74-6	CCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 14, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	56955-78-3	CCCCCCCCCCCC[N+](C)(C)CC.CCCCCCOC1=CC=C(C=C1)C(=O)[O-]	{24: 1, 1: 5, 2: 17, 22: 1, 14: 4}
Did not match all atoms present	5696-06-0	CCC1(C(=O)NC(=O)N1C)C2=CC=CC=C2	{32: 1, 1: 2, 2: 1, 33: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	56961-20-7	C1=C(C(=C(C(=C1Cl)Cl)Cl)O)O	{17: 3, 21: 2, 14: 1}
Did not match all atoms present	56961-23-0	C1(=C(C(=C(C(=C1Cl)O)Cl)O)Cl)O	{17: 3, 21: 3}
Did not match all atoms present	56961-50-3	C1=CC(=C(C=C1S(=O)(=O)N)NN=C2C=CC3=C(C=CC(=C3C2=O)Cl)Cl)O	{34: 1, 14: 7, 15: 1, 17: 2, 21: 1, 25: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	56961-56-9	C1=C(C(=CC(=C1[N+](=O)[O-])Cl)S(=O)(=O)O)[N+](=O)[O-]	{17: 1, 38: 2, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	56961-60-5	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC=C(C4=C3)N	{30: 1, 14: 11}
Did not match all atoms present	56961-62-7	CCC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21	{1: 1, 2: 1, 14: 11}
Did not match all atoms present	56961-65-0	CCC1=CC2=C(C=C1)N=C3C(=C2C)C=CC4=CC=CC=C43	{1: 2, 2: 1, 35: 1, 14: 9}
Did not match all atoms present	56961-73-0	CC(C)CC(=O)OC(C)C1=CC=CC=C1	{1: 3, 2: 1, 3: 2, 28: 1, 14: 5}
Did not match all atoms present	56961-75-2	C1=C(C=C(C(=C1Cl)Cl)C=O)Cl	{17: 3, 26: 1, 14: 2}
Did not match all atoms present	56961-77-4	C1=CC(=C(C(=C1)Br)Cl)Cl	{17: 2, 18: 1, 14: 3}
Did not match all atoms present	56961-84-3	C1=CC(=C(C=C1C(Cl)Cl)Cl)Cl	{17: 4, 3: 1, 14: 3}
Did not match all atoms present	56961-86-5	CC1=CC(=CC(=C1Cl)Cl)Cl	{1: 1, 14: 2, 17: 3}
Did not match all atoms present	56961-90-1	C1=CC=C2C(=C1)C=C(C(=C2Cl)O)C(=O)O	{17: 1, 27: 1, 21: 1, 14: 5}
Did not match all atoms present	56962-04-0	C1=C(C=C(C=C1Cl)Br)O	{17: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	56962-08-4	C1=C(C(=CC(=C1Cl)Cl)C(=O)O)C(=O)O	{17: 2, 27: 2, 14: 2}
Did not match all atoms present	56962-11-9	C1=CC(=C(C=C1O)Cl)C=O	{17: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	56966-33-7	CC1=CC(=C(C=C1CC(C)N)OC)OC	{1: 4, 2: 1, 3: 1, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	56966-52-0	C1=CC(=C(C=C1Cl)N)OC2=C(C=C(C=C2)Cl)Cl	{17: 3, 30: 1, 22: 1, 14: 6}
Did not match all atoms present	5697-00-7	CC(=O)OC1=CC=C(C2=CC=CC=C21)OC(=O)C	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	5697-44-9	CC1=CC=C(C=C1)S(=O)(=O)CC#N	{1: 1, 2: 1, 29: 2, 14: 4, 37: 1}
Did not match all atoms present	5697-85-8	C1=CC=C(C=C1)CCC2=CC=CC=C2N	{2: 2, 30: 1, 14: 9}
Did not match all atoms present	56970-24-2	COC1=C(C=CC(=C1)N)C2=CC=CC=C2	{1: 1, 30: 1, 22: 1, 14: 8}
Did not match all atoms present	56971-16-5	C1CN2CN3CN1CP(C2)C3	{33: 3, 11: 7}
Did not match all atoms present	56971-17-6	C1CN2CN3CN1CP(=O)(C2)C3	{33: 3, 11: 7, 29: 1}
Did not match all atoms present	56973-16-1	C1=CC(=O)N(C1=O)C2=C(C(=C(C(=C2F)F)F)N3C(=O)C=CC3=O)F	{16: 4, 25: 4, 14: 4, 33: 2}
Did not match all atoms present	56974-46-0	CCCC[NH+](CCCC)CCNC1=NC(=NO1)C2=CC=CC=C2.[Cl-]	{1: 2, 2: 8, 35: 2, 14: 5, 17: 1, 23: 1, 31: 1}
Did not match all atoms present	56974-57-3	CC(C)(CO)C(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 1, 4: 1, 20: 1}
Did not match all atoms present	56974-61-9	CCOC(=O)C1=CC=C(C=C1)OC(=O)CCCCCN=C(N)N.CS(=O)(=O)O	{1: 2, 2: 6, 7: 1, 34: 1, 14: 4, 20: 1, 28: 2, 29: 2, 30: 2}
Did not match all atoms present	5698-59-9	C1=CC=C2C(=C1)C(=O)SC2=O	{25: 2, 14: 4, 41: 1}
Did not match all atoms present	5698-98-6	C=CC(=O)[O-].C=CC(=O)[O-].[Mg+2]	{24: 2, 5: 2, 6: 2}
Did not match all atoms present	56982-42-4	CCCCC(=O)[O-].CCCCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 6}
Did not match all atoms present	56984-96-4	C=C(CC(Cl)(Cl)Cl)C1=CC(=CC(=C1)Cl)Cl	{2: 1, 4: 1, 5: 1, 7: 1, 14: 3, 17: 5}
Did not match all atoms present	5699-71-8	C=C(C(=O)[O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+]	{24: 1, 29: 3, 5: 1, 22: 1, 7: 1}
Did not match all atoms present	56990-15-9	C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCO)CO.C(COCCO)O	{2: 9, 8: 2, 11: 5, 34: 2, 14: 8, 20: 4, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	56990-57-9	C1=CC2=C(C(=O)/C(=N/NC3=CC4=C(C=C3)C=C(C=C4)S(=O)(=O)O)/C=C2S(=O)(=O)O)N=C1	{34: 1, 35: 1, 14: 10, 15: 2, 20: 2, 25: 1, 29: 4, 31: 1}
Did not match all atoms present	57-03-4	C(C(COP(=O)(O)O)O)O	{2: 2, 3: 1, 20: 4, 29: 1, 22: 1}
Did not match all atoms present	57-04-5	C(C(=O)COP(=O)(O)O)O	{24: 1, 2: 2, 20: 3, 29: 1, 22: 1}
Did not match all atoms present	57-06-7	C=CCN=C=S	{8: 1, 2: 1, 34: 1, 5: 1, 6: 1}
Did not match all atoms present	57-09-0	CCCCCCCCCCCCCCCC[N+](C)(C)C.[Br-]	{1: 4, 2: 15, 18: 1}
Did not match all atoms present	57-12-5	[C-]#N	{}
Did not match all atoms present	57-22-7	CC[C@@]1(C[C@@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C=O)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O	{32: 1, 1: 6, 2: 2, 33: 3, 11: 9, 12: 4, 13: 5, 14: 8, 20: 2, 22: 1, 26: 1, 28: 3}
Did not match all atoms present	57-24-9	C1CN2CC3=CCOC4CC(=O)N5C6C4C3CC2C61C7=CC=CC=C75	{33: 2, 11: 6, 12: 5, 13: 1, 14: 5, 15: 1, 23: 1, 25: 1}
Did not match all atoms present	57-27-2	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O	{1: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	57-29-4	C=CCN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O.Cl	{33: 1, 2: 1, 5: 1, 6: 1, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	57-30-7	CCC1(C(=O)NC(=NC1=O)[O-])C2=CC=CC=C2.[Na+]	{32: 1, 1: 1, 2: 1, 35: 1, 13: 1, 14: 5, 15: 1, 25: 2}
Did not match all atoms present	57-33-0	CCCC(C)C1(C(=O)NC(=O)NC1=O)CC.[Na+]	{32: 2, 1: 3, 2: 3, 3: 1, 13: 1, 25: 3}
Did not match all atoms present	57-37-4	CCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl	{1: 2, 2: 4, 4: 1, 33: 1, 14: 10, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	57-39-6	CC1CN1P(=O)(N2CC2C)N3CC3C	{1: 3, 11: 3, 12: 3, 29: 1, 33: 3}
Did not match all atoms present	57-40-9	CC1CN1P(=O)(C2=CC=CC=C2)N3CC3C	{1: 2, 33: 2, 11: 2, 12: 2, 14: 5, 29: 1}
Did not match all atoms present	57-41-0	C1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC=CC=C3	{32: 2, 25: 2, 13: 1, 14: 10}
Did not match all atoms present	57-42-1	CCOC(=O)C1(CCN(CC1)C)C2=CC=CC=C2	{1: 2, 2: 1, 33: 1, 11: 4, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	57-47-6	C[C@@]12CCN([C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C	{1: 4, 33: 2, 11: 2, 12: 1, 13: 1, 14: 3, 28: 1, 31: 1}
Did not match all atoms present	57-52-3	CC[Sn](CC)(CC)OS(=O)(=O)O[Sn](CC)(CC)CC	{1: 6, 2: 6, 29: 2, 22: 2}
Did not match all atoms present	57-54-5	C[N+]1(CC1)CCCl	{1: 1, 2: 2, 11: 2, 17: 1}
Did not match all atoms present	57-62-5	C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O	{1: 3, 33: 1, 11: 1, 12: 3, 13: 2, 14: 2, 15: 4, 17: 1, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	57-63-6	CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 1, 9: 1, 10: 1, 11: 6, 12: 3, 13: 2, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	57-64-7	C[C@@]12CCN([C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C.C1=CC=C(C(=C1)C(=O)O)O	{1: 4, 33: 2, 11: 2, 12: 1, 13: 1, 14: 7, 21: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	57-65-8	CCN(CC)CCOC(=O)CC1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)OC)I)I.Cl	{1: 3, 2: 5, 33: 1, 14: 5, 17: 1, 19: 3, 22: 2, 28: 1}
Did not match all atoms present	57-66-9	CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O	{1: 2, 2: 4, 33: 1, 14: 4, 27: 1, 29: 2}
Did not match all atoms present	57-67-0	C1=CC(=CC=C1N)S(=O)(=O)N=C(N)N	{30: 3, 34: 1, 29: 2, 14: 4, 7: 1}
Did not match all atoms present	57-68-1	CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C	{1: 2, 35: 2, 14: 5, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	57-91-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@H]2O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	57-95-4	CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)O)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC	{1: 5, 33: 1, 11: 6, 12: 2, 14: 10, 21: 2, 22: 2, 23: 2}
Did not match all atoms present	57-96-5	C1=CC=C(C=C1)N2C(=O)C(C(=O)N2C3=CC=CC=C3)CCS(=O)C4=CC=CC=C4	{33: 2, 2: 2, 12: 1, 14: 15, 25: 2, 29: 1}
Did not match all atoms present	57-97-6	CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C14)C	{1: 2, 14: 10}
Did not match all atoms present	570-02-5	COC1=CC(=C(C(=C1)OC)C(=O)O)OC	{1: 3, 27: 1, 22: 3, 14: 2}
Did not match all atoms present	570-22-9	C1=NC(=C(N1)C(=O)O)C(=O)O	{32: 1, 35: 1, 27: 2, 14: 1}
Did not match all atoms present	570-23-0	C1=CC(=C(C(=C1)N)O)C(=O)O	{30: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	570-24-1	CC1=C(C(=CC=C1)[N+](=O)[O-])N	{1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	570-30-9	C[C@]12CC[C@H]3[C@H]([C@@H]1[C@H](C[C@@H]2O)O)CCC4=C3C=CC(=C4)O	{1: 1, 11: 5, 12: 5, 13: 1, 14: 3, 20: 2, 21: 1}
Did not match all atoms present	5700-28-7	CCO[Si](C#C)(OCC)OCC	{1: 3, 2: 3, 10: 1, 22: 3, 9: 1}
Did not match all atoms present	57000-78-9	CC(C)(C)C(=O)C(OC1=CC=C(C=C1)Cl)Cl	{1: 3, 3: 1, 4: 1, 14: 4, 17: 2, 22: 1, 24: 1}
Did not match all atoms present	5701-82-6	CC(CC1=CC(=C(C=C1)OC)OC)C(C)CC2=CC(=C(C=C2)OC)OC	{1: 6, 2: 2, 3: 2, 22: 4, 14: 6}
Did not match all atoms present	57010-32-9	C[NH+](CCCC1(S(=O)(=O)CCCS1(=O)=O)C2=CC(=C(C=C2)OC)OC)CCC3=CC(=C(C=C3)OC)OC.[Cl-]	{1: 5, 2: 5, 11: 3, 13: 1, 14: 6, 17: 1, 22: 4, 29: 4}
Did not match all atoms present	57011-48-0	C(C(CN=[N+]=[N-])O)N=[N+]=[N-]	{2: 2, 3: 1, 20: 1, 34: 4}
Did not match all atoms present	57015-27-7	CC1=C2C=CC(=O)C=CC2=C(N1)C	{32: 1, 1: 2, 14: 4, 25: 1}
Did not match all atoms present	57015-32-4	CC1=C2C=CC(=O)C=CC2=C(N1C)C	{1: 3, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	57018-04-9	CC1=CC(=C(C(=C1)Cl)OP(=S)(OC)OC)Cl	{1: 3, 22: 3, 14: 2, 17: 2}
Did not match all atoms present	57018-44-7	N.N.N.N.[OH-].[Cl-].[Cl-].[Ru+3]	{17: 2}
Did not match all atoms present	5702-75-0	CC(=O)NC1=CC=C(C=C1)N2C(=O)C=CC2=O	{1: 1, 33: 1, 14: 6, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	57026-52-5	C1=CC=C(C=C1)C2=CC(=C3C=C([Se]C(=C3)C4=CC=CC=C4)C5=CC=CC=C5)C=C([Se]2)C6=CC=CC=C6	{14: 24, 15: 6}
Did not match all atoms present	5703-21-9	COC1=C(C=C(C=C1)CC=O)OC	{1: 2, 2: 1, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	5703-26-4	COC1=CC=C(C=C1)CC=O	{1: 1, 2: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	5703-52-6	CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(O5)C	{1: 2, 2: 1, 35: 1, 41: 1, 11: 4, 14: 7, 23: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	57036-53-0	[H+].C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)N/N=C/3\C=CC(=O)C=C3N)N/N=C/4\C(=O)C=CC(=C4[O-])N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-].[Cu+2]	{34: 4, 14: 16, 15: 5, 24: 1, 25: 2, 29: 3, 30: 1, 31: 3}
Did not match all atoms present	57039-61-9	CCNC1=C(C=CC(=C1)NC(=O)C)OC	{1: 3, 2: 1, 14: 3, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	5705-15-7	C1=CC=C(C=C1)CN(C2=CC=CC=C2)N.Cl	{17: 1, 2: 1, 30: 1, 14: 10, 33: 1}
Did not match all atoms present	57052-04-7	CC(C)C=NN1C(=O)C(=NN=C1SC)C(C)(C)C	{1: 6, 34: 1, 3: 1, 4: 1, 6: 1, 33: 1, 40: 1, 35: 2, 25: 1}
Did not match all atoms present	57057-83-7	COC1=C(C(=C(C=C1O)Cl)Cl)Cl	{1: 1, 22: 1, 21: 1, 14: 1, 17: 3}
Did not match all atoms present	5706-20-7	CN(C)C1=CC=C(C=C1)C=C2CC3=CC=CC=C3C2=O	{1: 2, 6: 1, 33: 1, 11: 1, 14: 8, 15: 1, 25: 1}
Did not match all atoms present	57062-05-2	C1=CC(=CC(=C1)N)N.C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC(=CC=C1N)N	{27: 2, 30: 4, 14: 12}
Did not match all atoms present	57063-29-3	C1CCC(CC1)N2C(=O)C(=C(S2)Cl)Cl	{33: 1, 41: 1, 11: 5, 12: 1, 17: 2, 25: 1}
Did not match all atoms present	57069-48-4	CC(=C)C(=O)OCCC[Si](OCCOC)(OCCOC)OCCOC	{1: 4, 2: 9, 5: 1, 7: 1, 22: 6, 28: 1}
Did not match all atoms present	5707-04-0	C1=CC=C(C=C1)[Se]Cl	{17: 1, 14: 5}
Did not match all atoms present	5707-44-8	CCC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	5707-69-7	CC\1=NOC(=O)/C1=N\NC2=CC=CC=C2Cl	{1: 1, 34: 1, 35: 1, 14: 4, 15: 2, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	5709-67-1	C1=CC=C2C(=C1)NC(=N2)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 4}
Did not match all atoms present	5709-68-2	CN1C2=CC=CC=C2N=C1[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	5709-94-4	B1(N(CCN1C)C)C2=CC=CC=C2	{1: 2, 11: 2, 14: 5, 33: 2}
Did not match all atoms present	571-58-4	CC1=CC=C(C2=CC=CC=C12)C	{1: 2, 14: 6}
Did not match all atoms present	571-60-8	C1=CC=C2C(=C1)C(=CC=C2O)O	{21: 2, 14: 6}
Did not match all atoms present	571-61-9	CC1=CC=CC2=C1C=CC=C2C	{1: 2, 14: 6}
Did not match all atoms present	571-98-2	CCCCOC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 3, 28: 1, 14: 9}
Did not match all atoms present	57109-90-7	C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)C(=O)[O-].[OH-].[K+].[K+]	{32: 1, 35: 1, 12: 1, 14: 8, 15: 1, 17: 1, 24: 1, 25: 1}
Did not match all atoms present	5711-19-3	CC(=O)O[Pb](C)(C)C	{1: 4, 28: 1}
Did not match all atoms present	5711-41-1	COC1=CC=C(C=C1)C(=O)/C=C/C(=O)O	{1: 1, 6: 2, 14: 4, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	5711-69-3	CC(C)C(=O)[O-]	{24: 1, 1: 2, 3: 1}
Did not match all atoms present	57114-54-2	CP(=NC1=CC=CC=C1)(C)C	{1: 3, 34: 1, 14: 5}
Did not match all atoms present	57116-96-8	CC1=CC(=C(C(=C1)C)[N+]#[C-])C	{1: 3, 34: 1, 14: 2}
Did not match all atoms present	57117-31-4	C1=C2C3=CC(=C(C(=C3OC2=CC(=C1Cl)Cl)Cl)Cl)Cl	{17: 5, 14: 3, 23: 1}
Did not match all atoms present	57117-41-6	C1=C2C(=CC(=C1Cl)Cl)OC3=CC(=C(C(=C23)Cl)Cl)Cl	{17: 5, 14: 3, 23: 1}
Did not match all atoms present	57117-44-9	C1=C2C3=C(C(=C(C=C3OC2=C(C(=C1Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 2, 23: 1}
Did not match all atoms present	57119-83-2	CC(=O)OCCOCCNC1=CC=C(C2=CC=CC=C21)N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 4, 38: 2, 34: 2, 14: 8, 18: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	57119-91-2	C1=CC=C2C(=C1)C(=CC=C2N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])[N+](=O)[O-])NCCOCCO	{2: 4, 38: 2, 34: 2, 14: 8, 17: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	57123-34-9	CC(C)(C)CC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 2: 1, 3: 1, 4: 1, 14: 10}
Did not match all atoms present	57125-49-2	CCCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 11, 37: 1, 14: 8}
Did not match all atoms present	57125-50-5	CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 11, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	57132-28-2	CC(C)(C=CC1=CC=CC=C1)O	{1: 2, 4: 1, 14: 5, 6: 2, 20: 1}
Did not match all atoms present	57134-16-4	CCCCCOC1=CC=C(C=C1)C=NC2=CC(=C(C=C2)N=CC3=CC=C(C=C3)OCCCCC)Cl	{1: 2, 2: 8, 6: 2, 34: 2, 14: 11, 17: 1, 22: 2}
Did not match all atoms present	57135-68-9	C1=CC(=C(C=C1[N+](=O)[O-])N=C=S)Cl	{8: 1, 17: 1, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	57137-10-7	CCC1=C(C(=C(C=C1)Br)Br)Br	{1: 1, 2: 1, 18: 3, 14: 2}
Did not match all atoms present	57137-34-5	[C-]#N.[Pr]	{}
Did not match all atoms present	57137-36-7	[Br-].[Br-].[Br-].[Es]	{18: 3}
Did not match all atoms present	5714-00-1	CC(=O)C1=CC2=C(SC3=CC=CC=C3N2CCCN4CCN(CC4)CCO)C=C1.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O	{1: 1, 2: 5, 6: 4, 33: 3, 41: 1, 11: 4, 14: 7, 20: 1, 24: 1, 27: 4}
Did not match all atoms present	5714-05-6	CC1=NC2=CC=CC=C2C(=C1)NCCCCCCCCCCNC3=CC(=NC4=CC=CC=C43)C.CC(=O)O.CC(=O)O	{1: 4, 2: 10, 35: 2, 14: 10, 27: 2, 31: 2}
Did not match all atoms present	5714-22-7	FS(F)(F)(F)(F)S(F)(F)(F)(F)F	{16: 10}
Did not match all atoms present	57147-26-9	C1=CC=C2C(=C1)C(=CS2=O)Br	{18: 1, 29: 1, 14: 5, 15: 1}
Did not match all atoms present	57147-27-0	C1=CC=C2C(=C1)C=C(S2=O)Br	{18: 1, 29: 1, 14: 5, 15: 1}
Did not match all atoms present	57147-28-1	C1=CC=C2C(=C1)C=C(S2=O)Cl	{17: 1, 29: 1, 14: 5, 15: 1}
Did not match all atoms present	57149-07-2	COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC4=CC=CC=C43)O	{1: 1, 2: 2, 3: 1, 33: 2, 11: 4, 14: 11, 20: 1, 22: 2}
Did not match all atoms present	5715-02-6	CC(=O)OC1=CC=CC=C1C#N	{1: 1, 28: 1, 37: 1, 14: 4}
Did not match all atoms present	57153-16-9	C1=CC(=C(C=C1[N+]#N)S(=O)(=O)[O-])C=CC2=C(C=C(C=C2)[N+]#N)S(=O)(=O)[O-]	{34: 2, 14: 6, 6: 2, 29: 6}
Did not match all atoms present	57153-18-1	CC1=C(C=CC(=C1)Cl)OCCCC(=O)OC	{1: 2, 2: 3, 14: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	5716-20-1	CCCC[NH2+]CC(C1=CC=C(C=C1)O)O.CCCC[NH2+]CC(C1=CC=C(C=C1)O)O.[O-]S(=O)(=O)[O-]	{1: 2, 2: 8, 3: 2, 14: 8, 20: 2, 21: 2, 29: 4}
Did not match all atoms present	57164-86-0	COC1=C(C=CC(=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)NS(=O)(=O)C.CS(=O)(=O)O	{1: 3, 35: 1, 14: 11, 20: 1, 22: 1, 29: 4, 31: 2}
Did not match all atoms present	57164-87-1	CC1=C(C=CC(=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)NS(=O)(=O)C	{1: 2, 35: 1, 29: 2, 14: 11, 31: 2}
Did not match all atoms present	57164-89-3	CC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42	{1: 2, 35: 1, 29: 2, 14: 11, 31: 2}
Did not match all atoms present	57165-71-6	C1CNP(=O)(OC1C(F)(F)F)N(CCCl)CCCl	{32: 1, 33: 1, 2: 4, 4: 1, 11: 2, 12: 1, 16: 3, 17: 2, 23: 1, 29: 1}
Did not match all atoms present	5717-37-3	CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C	{1: 2, 2: 1, 28: 1, 14: 15, 7: 1}
Did not match all atoms present	57170-08-8	COC1=CC=CC(=C1)C2=NN3CC4=CC=CC=C4C3=N2	{1: 1, 35: 2, 33: 1, 11: 1, 14: 8, 22: 1}
Did not match all atoms present	57179-35-8	COC1=CC(=CC(=C1)O)C=O	{1: 1, 22: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	5718-83-2	C1C(=O)N(C(=S)S1)CC(=O)O	{33: 1, 2: 1, 41: 1, 11: 1, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	5718-90-1	C1CSCN1CCS(=O)(=O)O	{33: 1, 2: 2, 41: 1, 11: 3, 20: 1, 29: 2}
Did not match all atoms present	57186-90-0	C1=CC(=CC(=C1)Br)C2=CC=C(C=C2)Br	{18: 2, 14: 8}
Did not match all atoms present	57197-43-0	CC1=C(OC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C.COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N	{1: 5, 2: 1, 35: 3, 14: 7, 22: 3, 23: 1, 29: 2, 30: 3, 31: 1}
Did not match all atoms present	57199-00-5	CC(C)C1=CC(=C(C(=C1)C(C)C)C(=O)Cl)C(C)C	{24: 1, 1: 6, 3: 3, 14: 2, 17: 1}
Did not match all atoms present	572-18-9	C1=CC=C(C=C1)/C(=N\NC2=CC=CC=C2)/C(=N\NC3=CC=CC=C3)/C4=CC=CC=C4	{34: 2, 31: 2, 14: 20, 7: 2}
Did not match all atoms present	572-41-8	C1=CC=C2C(=C1)[C@@H]([C@H](C3=CC=CC=C32)O)O	{20: 2, 12: 2, 14: 8}
Did not match all atoms present	572-48-5	CCOP(=S)(OCC)OC1=CC2=C(C=C1)C3=C(CCCC3)C(=O)O2	{1: 2, 2: 2, 11: 4, 14: 3, 22: 3, 28: 1}
Did not match all atoms present	572-59-8	COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@H]3C[C@@H]4CCN3C[C@@H]4C=C)O	{1: 1, 3: 1, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 1, 22: 1}
Did not match all atoms present	572-83-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)Br	{25: 2, 18: 1, 14: 7}
Did not match all atoms present	572-93-0	C1=CC2=C(C=C1O)C(=O)C3=C(C2=O)C=CC(=C3)O	{25: 2, 21: 2, 14: 6}
Did not match all atoms present	5720-05-8	B(C1=CC=C(C=C1)C)(O)O	{1: 1, 20: 2, 14: 4}
Did not match all atoms present	5720-06-9	B(C1=CC=CC=C1OC)(O)O	{1: 1, 20: 2, 22: 1, 14: 4}
Did not match all atoms present	5720-07-0	B(C1=CC=C(C=C1)OC)(O)O	{1: 1, 20: 2, 22: 1, 14: 4}
Did not match all atoms present	57202-29-6	CCCCCCC1=CN=C(N=C1)CCCCCCCOC2=CC=CC=C2	{1: 1, 2: 12, 35: 2, 22: 1, 14: 7}
Did not match all atoms present	57206-44-7	CCC(=CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)CC)C=C4N(C5=C(S4)C=CC6=CC=CC=C65)CC.[I-]	{1: 3, 2: 3, 33: 2, 6: 2, 7: 1, 41: 2, 14: 12, 15: 1, 19: 1}
Did not match all atoms present	57210-34-1	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-].[Cl-]	{1: 4, 2: 3, 38: 1, 33: 1, 34: 2, 14: 8, 17: 1}
Did not match all atoms present	57212-78-9	COC(=O)CSP(=O)(OC)OC	{1: 3, 2: 1, 40: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	57213-48-6	C1=CC(=CC(=C1)C[C@@H](C(=O)O)N)C#N	{2: 1, 3: 1, 37: 1, 14: 4, 27: 1, 30: 1}
Did not match all atoms present	57213-94-2	CC1=C(C=C(C=C1)C(C)C2=CC=CC=C2C(C)C3=CC=CC=C3)C	{1: 4, 3: 2, 14: 12}
Did not match all atoms present	57216-65-6	COC(=O)C1=CC(=CC=C1)S(=O)(=O)[N-]S(=O)(=O)C2=CC=CC(=C2)C(=O)OC.[Na+]	{1: 2, 34: 1, 28: 2, 29: 4, 14: 8}
Did not match all atoms present	57218-68-5	CC[N+]1=C(C=CC2=C1C=CC(=C2)C)SCC.[I-]	{1: 3, 2: 2, 33: 1, 40: 1, 14: 5, 19: 1}
Did not match all atoms present	57224-63-2	CC(C(C(=O)OC)NC(=O)OCC1=CC=CC=C1)O	{1: 2, 2: 1, 3: 2, 14: 5, 20: 1, 28: 2, 31: 1}
Did not match all atoms present	57228-01-0	CCCN(CCC)C(=O)C(CC1=CC=C(C=C1)OCCN2CCN(CC2)C)NC(=O)C3=CC=C(C=C3)Cl.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 9, 3: 1, 4: 1, 33: 3, 11: 4, 14: 8, 17: 1, 20: 1, 22: 1, 24: 2, 27: 3, 31: 1}
Did not match all atoms present	57229-41-1	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2O	{1: 1, 12: 1, 14: 7, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	5723-93-3	CC(C)(C)C1=CC(=CC(=C1)C2=CC=CC=C2)C(C)(C)C	{1: 6, 4: 2, 14: 8}
Did not match all atoms present	57232-83-4	[I-].[Tl+]	{19: 1}
Did not match all atoms present	57232-94-7	CCN1C2=CC=CC3=C2C(=CC=C3)C1=C(C#N)C#N	{1: 1, 2: 1, 37: 2, 33: 1, 7: 1, 14: 6}
Did not match all atoms present	5724-56-1	CC1=CC=CC(=C1C)C#N	{1: 2, 37: 1, 14: 3}
Did not match all atoms present	57244-54-9	CC(=CC(C)(C)C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 3, 4: 1, 6: 1, 7: 1, 14: 8, 21: 2}
Did not match all atoms present	57244-96-9	CCCCCCCCCCCC[N+](C)(C)C.C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2	{1: 4, 2: 11, 22: 2, 14: 10, 29: 2}
Did not match all atoms present	57248-90-5	C1=CC2=C(C(=C1)O)C(=C(C=C2S(=O)(=O)[O-])S(=O)(=O)O)N.[K+]	{30: 1, 20: 1, 21: 1, 14: 4, 29: 5}
Did not match all atoms present	57248-95-0	C1=CC2=C3C(=C1)C4=C(C=CC=C4Cl)C(=O)C3=C(C=C2)Cl	{17: 2, 14: 8, 25: 1}
Did not match all atoms present	57251-86-2	N(=S=O)[SiH3]	{40: 1, 34: 1, 29: 1}
Did not match all atoms present	57260-67-0	C1CN(CCN1)C2=CC(=C(C=C2)Cl)Cl	{32: 1, 17: 2, 11: 4, 14: 3, 33: 1}
Did not match all atoms present	57261-64-0	CC1=CC(=NC=C1)C(=O)C2=CC=CS2	{24: 1, 1: 1, 35: 1, 14: 6, 41: 1}
Did not match all atoms present	57264-46-7	CC1=C(C(=CC=C1)Cl)CN	{1: 1, 2: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	57267-78-4	C(CS(=O)(=O)[O-])O.[NH4+]	{2: 2, 20: 1, 29: 3}
Did not match all atoms present	57272-87-4	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=C(C=C4)N/N=C/5\C=C(C(=O)C6=C5C(=CC=C6)NS(=O)(=O)C)S(=O)(=O)NC(C)(C)C)O)C(C)(C)CC	{1: 10, 2: 6, 4: 3, 34: 1, 14: 16, 15: 2, 21: 1, 22: 1, 24: 1, 25: 1, 29: 6, 31: 5}
Did not match all atoms present	57277-87-9	C1C2CC3CC1CC(C2)(C3)N=CC4=CC=C(O4)[N+](=O)[O-]	{34: 1, 38: 1, 6: 1, 11: 6, 12: 3, 13: 1, 14: 2, 23: 1}
Did not match all atoms present	5728-20-1	C1(=NSN=C1Cl)Cl	{17: 2, 35: 2, 41: 1}
Did not match all atoms present	5728-52-9	C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)O	{2: 1, 27: 1, 14: 9}
Did not match all atoms present	5728-70-1	CCC1=CC=C(C=C1)C2=CC=C(C=C2)N	{1: 1, 2: 1, 30: 1, 14: 8}
Did not match all atoms present	57280-75-8	COCC(=O)C1=C(C=C(C=C1)O)O	{1: 1, 2: 1, 14: 3, 21: 2, 22: 1, 24: 1}
Did not match all atoms present	57281-35-3	C1CCC(CC1)NCCC(COC2=CC=CC3=CC=CC=C32)O	{2: 3, 3: 1, 11: 5, 12: 1, 14: 7, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	5729-06-6	C1=CC=C(C=C1)CNC2=CC=CC=C2[N+](=O)[O-]	{2: 1, 38: 1, 14: 9, 31: 1}
Did not match all atoms present	57292-01-0	CC(=C)C(=O)[O-].COC(=O)C=C.[Na+]	{1: 2, 5: 2, 6: 1, 7: 1, 24: 1, 28: 1}
Did not match all atoms present	57292-44-1	CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 17: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	57292-45-2	CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)F)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 16: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	57294-74-3	C1=CN(C(=O)N=C1NN)C2[C@@H]([C@@H]([C@H](O2)CO)O)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 2, 20: 3, 23: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	57296-00-1	CCOC(=O)C(=CC1=CC=CC=C1)Br	{1: 1, 2: 1, 6: 1, 7: 1, 14: 5, 18: 1, 28: 1}
Did not match all atoms present	57296-63-6	CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)O)C3=CC=CC=C3	{1: 1, 2: 1, 11: 1, 13: 1, 14: 6, 17: 2, 22: 1, 25: 1, 27: 1}
Did not match all atoms present	573-11-5	COC1=C(C(=C(C=C1)C(=O)O)OC)OC	{1: 3, 27: 1, 22: 3, 14: 2}
Did not match all atoms present	573-17-1	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)Br	{18: 1, 14: 9}
Did not match all atoms present	573-20-6	CC1=C(C2=CC=CC=C2C(=C1)OC(=O)C)OC(=O)C	{1: 3, 28: 2, 14: 5}
Did not match all atoms present	573-22-8	C1CC2=C(C=CC3=CC=CC=C23)C(=O)C1	{25: 1, 11: 3, 14: 6}
Did not match all atoms present	573-26-2	CC1=CC=CC=C1N(C)C(=O)C	{24: 1, 1: 3, 14: 4, 33: 1}
Did not match all atoms present	573-33-1	C1=CC=C(C=C1)C2C(N=C(N2)C3=CC=CC=C3)C4=CC=CC=C4	{32: 1, 35: 1, 12: 2, 14: 15, 15: 1}
Did not match all atoms present	573-56-8	C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]	{38: 2, 21: 1, 14: 3}
Did not match all atoms present	573-57-9	C1=CC=C2C3C=CC(C2=C1)O3	{12: 2, 14: 6, 23: 1}
Did not match all atoms present	573-58-0	C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=CC=C(C=C3)C4=CC=C(C=C4)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+]	{30: 2, 34: 4, 29: 6, 14: 18}
Did not match all atoms present	573-83-1	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-].[K+]	{38: 3, 14: 2}
Did not match all atoms present	573-97-7	C1=CC=C2C(=C1)C=CC(=C2Br)O	{18: 1, 21: 1, 14: 6}
Did not match all atoms present	573-98-8	CC1=C(C2=CC=CC=C2C=C1)C	{1: 2, 14: 6}
Did not match all atoms present	5730-85-8	C1=CC=C(C=C1)C2=CC(=C(C=C2)N)Cl	{17: 1, 30: 1, 14: 8}
Did not match all atoms present	57301-22-1	COC1=C(C=C(C=C1)S(=O)(=O)CC2=CC=CC=C2)N/N=C\3/C4=CC=CC=C4C=C(C3=O)C(=O)NC5=CC=CC=C5	{1: 1, 2: 1, 34: 1, 14: 18, 15: 2, 22: 1, 24: 1, 25: 1, 29: 2, 31: 2}
Did not match all atoms present	57303-68-1	CCOC1=CC=C(C=C1)N=NC=C2C(C3=CC=CC=C3N2C)(C)C	{1: 4, 2: 1, 34: 2, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1, 22: 1}
Did not match all atoms present	57303-71-6	CC1=CC=C(C=C1)N=NC=C2C(C3=CC=CC=C3N2C)(C)C	{1: 4, 34: 2, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1}
Did not match all atoms present	57308-10-8	[H-].[H-].[Ca+2]	{}
Did not match all atoms present	5731-13-5	CCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O	{1: 1, 2: 1, 27: 1, 14: 8}
Did not match all atoms present	57312-00-2	C1C2=CC=CC=C2C3=NC(=NN31)C4=CC=CC=C4	{33: 1, 11: 1, 14: 9, 35: 2}
Did not match all atoms present	57312-03-5	C1C2=CC=CC=C2C3=NC(=NN31)C4=CC=C(C=C4)Cl	{17: 1, 11: 1, 35: 2, 14: 8, 33: 1}
Did not match all atoms present	57312-50-2	COC1=CC2=C(CN3C2=NC(=N3)C4=CC(=CC=C4)OC)C=C1	{1: 2, 35: 2, 33: 1, 11: 1, 14: 7, 22: 2}
Did not match all atoms present	57314-55-3	C1CCC(CC1)N2CCN(CC2)C(CC3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl	{33: 2, 2: 1, 3: 1, 11: 9, 12: 1, 14: 10, 17: 2}
Did not match all atoms present	57319-66-1	C1=CC=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2	{32: 1, 35: 1, 37: 1, 6: 1, 7: 1, 14: 9}
Did not match all atoms present	57319-67-2	C1=CC=C2C(=C1)NC(=N2)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C#N	{32: 1, 35: 1, 37: 1, 6: 1, 7: 1, 14: 8, 38: 1}
Did not match all atoms present	57319-69-4	C1=CC=C2C(=C1)NC(=N2)/C(=C/C3=CC(=CC=C3)Cl)/C#N	{32: 1, 35: 1, 37: 1, 6: 1, 7: 1, 14: 8, 17: 1}
Did not match all atoms present	57319-74-1	CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2	{32: 1, 1: 2, 35: 1, 37: 1, 6: 1, 33: 1, 7: 1, 14: 8}
Did not match all atoms present	57328-69-5	[B]1OB(OB(O1)F)F	{16: 2, 23: 3}
Did not match all atoms present	57339-57-8	C1=CC2=CC(=CC(=C2N=C1)N)Br	{18: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	5734-64-5	COC1=CC(=NC(=N1)N)Cl	{1: 1, 35: 2, 14: 1, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	5735-31-9	C1=CC=C(C(=C1)C(=O)[O-])I(=O)=O.[NH4+]	{24: 1, 19: 1, 29: 2, 14: 4}
Did not match all atoms present	57356-18-0	C1CCCN(CC1)C2=CC=C(C=C2)N	{33: 1, 11: 6, 30: 1, 14: 4}
Did not match all atoms present	5736-85-6	CCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 2, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	5736-88-9	CCCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 3, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	5736-89-0	CCCCOC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 3, 22: 1, 14: 4}
Did not match all atoms present	5736-91-4	CCCCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 4, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	5736-94-7	CCCCCCOC1=CC=C(C=C1)C=O	{1: 1, 2: 5, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	57360-63-1	CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=C/C(=N\NC4=CC=CC=C4)/C5=CC=CC=C5C3=O	{1: 3, 34: 1, 4: 1, 14: 18, 15: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	57372-62-0	[B]1O[B]OB(O1)F	{16: 1, 23: 3}
Did not match all atoms present	57373-76-9	[C-]#N.[C-]#N.[K+].[K+].[Pd]	{}
Did not match all atoms present	57381-51-8	C1=CC(=C(C=C1Cl)F)C#N	{16: 1, 17: 1, 37: 1, 14: 3}
Did not match all atoms present	57382-97-5	CCOC(=O)CC1=CC=CS1	{1: 1, 2: 2, 28: 1, 14: 3, 41: 1}
Did not match all atoms present	57383-74-1	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O.CN(C)CCN(CC1=CC=C(C=C1)OC)C2=CC=CC=N2	{1: 5, 2: 4, 35: 2, 33: 5, 14: 9, 22: 1, 25: 2, 27: 1}
Did not match all atoms present	57384-48-2	CCCCCN1C2=CC=CC=C2C(=O)OC1=O	{1: 1, 2: 4, 28: 2, 14: 4, 33: 1}
Did not match all atoms present	57386-83-1	CC1=CC(=C(C(=C1Cl)C)Cl)C	{1: 3, 14: 1, 17: 2}
Did not match all atoms present	57387-52-7	CC1=C(C(=CC=C1)C)N=CC2=CC(=CC=C2)C	{1: 3, 34: 1, 14: 7, 6: 1}
Did not match all atoms present	574-00-5	C1=CC=C2C(=C1)C=CC(=C2O)O	{21: 2, 14: 6}
Did not match all atoms present	574-06-1	CC(=O)OC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 3: 1, 28: 1, 14: 10}
Did not match all atoms present	574-07-2	C1=CC=C(C=C1)C(C(=NNC2=CC=CC=C2)C3=CC=CC=C3)O	{34: 1, 3: 1, 7: 1, 14: 15, 20: 1, 31: 1}
Did not match all atoms present	574-09-4	CCOC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 14: 10, 22: 1, 24: 1}
Did not match all atoms present	574-12-9	C1=CC=C(C=C1)C2=COC3=CC=CC=C3C2=O	{25: 1, 14: 10, 23: 1}
Did not match all atoms present	574-19-6	CC(=O)C1=C(C=CC2=CC=CC=C21)O	{24: 1, 1: 1, 21: 1, 14: 6}
Did not match all atoms present	574-25-4	C1=NC(=S)C2=C(N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 2, 20: 3, 23: 1}
Did not match all atoms present	574-39-0	CC(=O)N1C2=CC=CC=C2C3=CC=CC=C31	{24: 1, 1: 1, 14: 8, 33: 1}
Did not match all atoms present	574-66-3	C1=CC=C(C=C1)C(=NO)C2=CC=CC=C2	{34: 1, 20: 1, 14: 10, 7: 1}
Did not match all atoms present	574-69-6	C1=CC=C2C(=O)C=CC(=NNC3=CC=C(C=C3)S(=O)(=O)O)C2=C1	{34: 1, 14: 10, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	574-84-5	COC1=C(C(=C2C(=C1)C=CC(=O)O2)O)O	{1: 1, 22: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	574-92-5	C1=CC2=C(C=C1C(F)(F)F)NC=C(C2=O)C(=O)O	{32: 1, 4: 1, 14: 4, 16: 3, 25: 1, 27: 1}
Did not match all atoms present	574-93-6	C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C(N4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2N3	{32: 2, 35: 6, 14: 16}
Did not match all atoms present	574-98-1	C1=CC=C2C(=C1)C(=O)N(C2=O)CCBr	{25: 2, 2: 2, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	57402-46-7	C/C(=C/C(=O)C)/[O-].O.[K+]	{24: 1, 1: 2, 6: 1, 7: 1}
Did not match all atoms present	57402-83-2	CN(CCCNC1=CC=CC=C1[N+](=O)[O-])CCCNC2=CC=CC=C2[N+](=O)[O-]	{1: 1, 2: 6, 38: 2, 33: 1, 14: 8, 31: 2}
Did not match all atoms present	57403-35-7	C1=CC(=C(C=C1CCl)[N+](=O)[O-])Cl	{17: 2, 2: 1, 38: 1, 14: 3}
Did not match all atoms present	5741-22-0	CC(C)NCC(COC1=CC=CC=C1OC)O	{1: 3, 2: 2, 3: 2, 14: 4, 20: 1, 22: 2, 31: 1}
Did not match all atoms present	57414-26-3	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CC=C)CC(=O)OC	{1: 3, 2: 2, 5: 1, 6: 1, 33: 1, 34: 2, 14: 4, 18: 1, 22: 1, 24: 1, 38: 2, 28: 1, 31: 1}
Did not match all atoms present	57414-42-3	C1=CC(=C(C=C1NC(=O)CCCCCCCCC(=O)NC2=CC(=C(C=C2)C#N)C#N)C#N)C#N	{24: 2, 2: 8, 37: 4, 14: 6, 31: 2}
Did not match all atoms present	5742-19-8	C1=CC(=C(C=C1Cl)Cl)OCC(=O)O.C(CO)NCCO	{2: 5, 14: 3, 17: 2, 20: 2, 22: 1, 27: 1, 31: 1}
Did not match all atoms present	57420-66-3	CCCCCCCCCCC[N+]1(CCCCC1)CC.[Br-]	{1: 2, 2: 11, 11: 5, 18: 1}
Did not match all atoms present	57422-77-2	C1=CC=C(C=C1)C2=C(C=CC(=C2)Br)Br	{18: 2, 14: 8}
Did not match all atoms present	57422-79-4	CC1=C2C=CC=CC2=PC3=CC=CC=C13	{1: 1, 14: 8}
Did not match all atoms present	5743-04-4	CC(=O)[O-].CC(=O)[O-].O.O.[Cd+2]	{24: 2, 1: 2}
Did not match all atoms present	5743-18-0	C[NH+]1C=NC2=C1C(=O)N(C(=O)N2C)C.[Br-]	{1: 3, 35: 1, 33: 2, 14: 1, 18: 1, 25: 2}
Did not match all atoms present	5743-26-0	CC(=O)[O-].CC(=O)[O-].O.[Ca+2]	{24: 2, 1: 2}
Did not match all atoms present	5743-36-2	CCCC(=O)[O-].CCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 4}
Did not match all atoms present	5743-47-5	CC(C(=O)[O-])O.CC(C(=O)[O-])O.O.O.O.O.O.[Ca+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	57432-60-7	CC(C)[C@@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O.C(=C\C(=O)O)\C(=O)O	{32: 1, 1: 5, 3: 2, 6: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 1, 23: 1, 24: 1, 25: 2, 27: 2, 31: 1}
Did not match all atoms present	57432-61-8	CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C.C(=C\C(=O)O)\C(=O)O	{32: 1, 1: 2, 2: 2, 3: 1, 6: 2, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	5744-40-1	CCOC(=O)C1=CC(=NN1C)C	{1: 3, 2: 1, 35: 1, 33: 1, 14: 1, 28: 1}
Did not match all atoms present	5744-51-4	CCOC(=O)C1=NN(C(=C1)C)C	{1: 3, 2: 1, 35: 1, 33: 1, 14: 1, 28: 1}
Did not match all atoms present	57444-62-9	C[C@@H]1C[C@]2([C@H]3[C@H]4[C@]1([C@@H]5C=C(C(=O)[C@]5(CC(=C4)COC(=O)CC6=CC(=C(C=C6)O)OC)O)C)OC(O3)(O2)CC7=CC=CC=C7)C(=C)C	{1: 4, 2: 3, 5: 1, 7: 1, 11: 2, 12: 4, 13: 4, 14: 10, 15: 2, 20: 1, 21: 1, 22: 1, 23: 3, 25: 1, 28: 1}
Did not match all atoms present	57444-81-2	[2H]C(=O)[O-].[K+]	{26: 1}
Did not match all atoms present	57449-43-1	C(C1=NON=C1CO[N+](=O)[O-])O[N+](=O)[O-]	{2: 2, 35: 2, 22: 2, 23: 1}
Did not match all atoms present	57449-44-2	C(C1=NO[N+](=C1CO[N+](=O)[O-])[O-])O[N+](=O)[O-]	{33: 1, 2: 2, 35: 1, 22: 2, 23: 1}
Did not match all atoms present	57455-06-8	C1=CC(=CC(=C1)I)CO	{2: 1, 19: 1, 20: 1, 14: 4}
Did not match all atoms present	57455-37-5	[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[S-]S[S-]	{40: 1, 29: 24}
Did not match all atoms present	5746-40-7	C(CSP(=O)(O)O)N	{40: 1, 2: 2, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	5746-86-1	C1CC(NC1)C2=CN=CC=C2	{32: 1, 35: 1, 11: 3, 12: 1, 14: 4}
Did not match all atoms present	57465-28-8	C1=CC(=C(C=C1C2=CC(=C(C(=C2)Cl)Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	57468-45-8	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=C5)C=CC7=C6C8=C(C=CC9=C8C1=C(C=C9)C=CC2=CC=CC=C21)C=C7)C=C3	{14: 26}
Did not match all atoms present	57468-46-9	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=C5)C=CC7=C6C8=C(C=CC9=C8C1=C(C=C9)C=CC2=C1C1=CC=CC=C1C=C2)C=C7)C=C3	{14: 28}
Did not match all atoms present	57472-50-1	C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)OCO)CC3=C(C=CC=C3OCO)C(=O)C4=CC=CC=C4	{24: 2, 2: 3, 20: 2, 22: 2, 14: 16}
Did not match all atoms present	57479-70-6	COC1=C(C=CC(=C1)Cl)C(=O)O	{1: 1, 27: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	57483-71-3	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=C5)C=CC7=C6C8=C(C=C7)C=CC9=C8C1=C(C=CC2=C1C1=C(C=C2)C=CC2=C1C1=CC=CC=C1C=C2)C=C9)C=C3	{14: 32}
Did not match all atoms present	57486-67-6	COC(=O)CC1=CC=CC=C1F	{16: 1, 1: 1, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	57486-68-7	COC(=O)CC1=CC=CC=C1Cl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	5749-48-4	N#C[Se-]	{37: 1}
Did not match all atoms present	57491-68-6	C1=CC=C(C(=C1)N)SCSC2=CC=CC=C2N	{40: 2, 2: 1, 30: 2, 14: 8}
Did not match all atoms present	57495-14-4	CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)[O-].[Na+]	{24: 2, 1: 1, 3: 1, 14: 9}
Did not match all atoms present	57497-13-9	CC#CC1=CC=CC=C1C	{1: 2, 10: 2, 14: 4}
Did not match all atoms present	575-03-1	C1=CC2=C(C=C1O)OC(=O)C=C2C(F)(F)F	{16: 3, 28: 1, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	575-36-0	CC(=O)NC1=CC=CC2=CC=CC=C21	{24: 1, 1: 1, 14: 7, 31: 1}
Did not match all atoms present	575-37-1	CC1=CC2=C(C=CC=C2C)C=C1	{1: 2, 14: 6}
Did not match all atoms present	575-38-2	C1=CC2=C(C=C(C=C2)O)C(=C1)O	{21: 2, 14: 6}
Did not match all atoms present	575-41-7	CC1=CC2=CC=CC=C2C(=C1)C	{1: 2, 14: 6}
Did not match all atoms present	575-43-9	CC1=CC2=C(C=C1)C(=CC=C2)C	{1: 2, 14: 6}
Did not match all atoms present	575-44-0	C1=CC2=C(C=CC(=C2)O)C(=C1)O	{21: 2, 14: 6}
Did not match all atoms present	575-61-1	C1=CC=C(C=C1)C=C2C3=CC=CC=C3C(=O)O2	{28: 1, 14: 9, 6: 1, 15: 1}
Did not match all atoms present	575-74-6	CCCCNC(=O)C1=C(C=C(C=C1)Cl)O	{1: 1, 2: 3, 14: 3, 17: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	575-75-7	CC1=C(C=CC(=C1)N(C)C)[P+](=O)[O-].[Na+]	{1: 3, 29: 2, 14: 3, 33: 1}
Did not match all atoms present	57500-00-2	CSSCC1=CC=CO1	{40: 2, 1: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	57503-74-9	C(C(=O)[O-])(C(=O)[O-])OC(C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 4, 3: 2, 22: 1}
Did not match all atoms present	5751-20-2	CSC1=NC=CC(=O)N1	{32: 1, 1: 1, 35: 1, 40: 1, 14: 2, 25: 1}
Did not match all atoms present	5751-48-4	CC1=CC(=O)C2=CC=CC=C2O1	{1: 1, 25: 1, 14: 5, 23: 1}
Did not match all atoms present	5751-82-6	CCOC(=O)C1=CC=C(S1)Cl	{1: 1, 2: 1, 41: 1, 14: 2, 17: 1, 28: 1}
Did not match all atoms present	57512-42-2	CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N=[N+]=[N-])N=[N+]=[N-].[Br-]	{1: 1, 2: 1, 33: 1, 34: 4, 14: 11, 18: 1}
Did not match all atoms present	57515-95-4	CN(C)C1=CC=C(C=C1)C2C3=C(C=C(C=C3)N(C)C)C(=O)O2	{1: 4, 12: 1, 33: 2, 14: 7, 28: 1}
Did not match all atoms present	57520-29-3	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=CC5=C4C6=C(C=C5)C=CC7=C6C8=C(C=C7)C=CC9=C8C1=CC=CC=C1C=C9)C=C3	{14: 24}
Did not match all atoms present	57525-41-4	C1=CC=C(C=C1)C2=C3C4=CC=CC5=C4C(=CC=C5)C3=C(C2=P(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9	{14: 31}
Did not match all atoms present	57525-48-1	C1=CC=C(C=C1)C2=C3C4=CC=CC5=CC=CC(=C3C(=C2[N+]6=CC=CC7=CC=CC=C76)C8=CC=CC=C8)[C-]54	{33: 1, 14: 23, 15: 3}
Did not match all atoms present	57532-29-3	CC(=O)C(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C(C(=O)C)N=NC2=CC=CC3=C2C(=O)N(C3=O)C4=CC=C(C=C4)Cl)Cl)N=NC5=CC=CC6=C5C(=O)N(C6=O)C7=CC=C(C=C7)Cl	{1: 2, 34: 4, 3: 2, 33: 2, 14: 16, 17: 4, 24: 4, 25: 4, 31: 2}
Did not match all atoms present	57532-33-9	CC/C(=C/C1[NH+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCCS(=O)(=O)[O-])/C=C/4\N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCCCS(=O)(=O)[O-].CC[NH+](CC)CC	{1: 4, 2: 12, 33: 1, 6: 2, 7: 1, 12: 1, 14: 16, 15: 1, 23: 2, 29: 6}
Did not match all atoms present	57539-71-6	C1=CC=C(C=C1)C2=C3C4=CC=CC5=CC=CC(=C3C(=C2[N+]6=CC=CC=C6)C7=CC=CC=C7)[C-]54	{33: 1, 14: 21, 15: 3}
Did not match all atoms present	57542-56-0	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-].[Ag+]	{24: 1, 38: 2, 14: 3}
Did not match all atoms present	57543-54-1	CC(=O)C1=CC2=C(C(=CC=C2)OC)OC1	{1: 2, 11: 1, 14: 4, 15: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	57543-55-2	CC(=O)C1=CC2=C(C=C(C=C2)OC)OC1	{1: 2, 11: 1, 14: 4, 15: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	57543-56-3	CC(=O)C1=CC2=C(C=CC(=C2)OC)OC1	{1: 2, 11: 1, 14: 4, 15: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	57543-57-4	CC(=O)C1=CC2=C(C=CC=C2OC)OC1	{1: 2, 11: 1, 14: 4, 15: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	57543-75-6	CC1C(=CC2=C(O1)C=CC(=C2)OC)C#N	{1: 2, 37: 1, 12: 1, 14: 4, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	57544-34-0	C1C(=CC2=C(O1)C=CC(=C2)Cl)C=O	{11: 1, 14: 4, 15: 1, 17: 1, 23: 1, 26: 1}
Did not match all atoms present	57545-80-9	CC(CSC1=CC=CC=C1N)SC2=CC=CC=C2N	{1: 1, 2: 1, 3: 1, 40: 2, 14: 8, 30: 2}
Did not match all atoms present	57554-34-4	CCN(CC)CCC1=CC=CC=C1C2(CCCC2)C(=O)S.Cl	{1: 2, 2: 4, 33: 1, 11: 4, 13: 1, 14: 4, 17: 1, 24: 1, 39: 1}
Did not match all atoms present	57556-08-8	CC1=CC(=C(S1)C)OC	{1: 3, 22: 1, 14: 1, 41: 1}
Did not match all atoms present	57556-10-2	CC1C(=O)C=C([Se]1)C	{1: 2, 12: 1, 25: 1, 14: 1, 15: 1}
Did not match all atoms present	57556-11-3	CC1=CC(=O)C([Se]1)(C)C	{1: 3, 25: 1, 13: 1, 14: 1, 15: 1}
Did not match all atoms present	57556-12-4	CC1=CC(=C(O1)C)OC	{1: 3, 22: 1, 14: 1, 23: 1}
Did not match all atoms present	57556-13-5	CC1=CC(=C([Se]1)C)OC	{1: 3, 22: 1, 14: 1}
Did not match all atoms present	57556-16-8	CC(C)(C)C1=C(SC=C1)OC	{1: 4, 4: 1, 22: 1, 14: 2, 41: 1}
Did not match all atoms present	57556-17-9	CC1=CC(=C(S1)OC)C	{1: 3, 22: 1, 14: 1, 41: 1}
Did not match all atoms present	57556-20-4	CC1=CC(C(=O)[Se]1)(C)C	{1: 3, 25: 1, 13: 1, 14: 1, 15: 1}
Did not match all atoms present	57558-46-0	CC[NH+](CCCC(=O)C1CCCCC1)C(C)CC2=CC=C(C=C2)OC.[Cl-]	{1: 3, 2: 5, 3: 1, 11: 5, 12: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	5756-55-8	C1=CC=C(C=C1)C2=NN=C(O2)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 15, 35: 2, 4: 7, 14: 5, 23: 1}
Did not match all atoms present	5756-67-2	C1=CC=C(C=C1)C2=NN=C(O2)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 35: 2, 4: 3, 14: 5, 23: 1}
Did not match all atoms present	5756-69-4	CN(N=NC1=CC=CC=C1)O	{1: 1, 34: 2, 20: 1, 14: 5, 33: 1}
Did not match all atoms present	57563-07-2	CCN(CC)C1=CC(=C(C=C1)N=NC2=NC(=C(N2C)C#N)C#N)NC(=O)C	{1: 4, 2: 2, 35: 1, 37: 2, 33: 2, 34: 2, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	57564-13-3	CCN(CC)C1=CC(=C(C=C1)NN=C2N=C(C(=N2)C#N)C#N)NC(=O)C	{1: 3, 2: 2, 35: 2, 37: 2, 33: 1, 34: 1, 14: 3, 15: 3, 24: 1, 31: 2}
Did not match all atoms present	57566-47-9	C/C/1=C/CC2=C(C/C(=C\CC1)/C)OC=C2C	{23: 1, 1: 3, 11: 4, 14: 3, 15: 2}
Did not match all atoms present	57568-60-2	C1=CC=C(C=C1)C(=CC2=CC=CO2)C=O	{26: 1, 23: 1, 14: 8, 6: 1, 7: 1}
Did not match all atoms present	57569-40-1	CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)C)OC(=O)C3=CC=C(C=C3)C(=O)OC4=C(C=C(C=C4C(C)(C)C)C)CC5=C(C(=CC(=C5)C)C(C)(C)C)O	{1: 16, 2: 2, 4: 4, 14: 12, 21: 2, 28: 2}
Did not match all atoms present	57574-09-1	C1CC2=CC=CC=C2C(C3=CC=CC=C31)NCCCCCCC(=O)O	{2: 6, 11: 2, 12: 1, 14: 8, 27: 1, 31: 1}
Did not match all atoms present	57576-44-0	CCC1(CC(C2=C(C1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)OC7CCC(=O)C(O7)C)O)N(C)C)O	{1: 7, 2: 1, 33: 1, 11: 5, 12: 12, 13: 1, 14: 4, 20: 2, 21: 2, 22: 3, 23: 3, 25: 3, 28: 1}
Did not match all atoms present	57583-34-3	CCCCC(CC)COC(=O)CS[Sn](C)(SCC(=O)OCC(CC)CCCC)SCC(=O)OCC(CC)CCCC	{40: 3, 1: 7, 2: 18, 3: 3, 28: 3}
Did not match all atoms present	57583-54-7	C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC(=CC=C3)OP(=O)(OC4=CC=CC=C4)OC5=CC=CC=C5	{22: 6, 14: 24, 29: 2}
Did not match all atoms present	57598-00-2	CC1=CC=CC=C1N/N=C/2\C=CC(=O)C(=C2)C	{1: 2, 34: 1, 14: 7, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	57598-33-1	CC1(COC(=N1)C2=CC=CC=C2OC)C	{1: 3, 35: 1, 11: 1, 13: 1, 14: 4, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	576-15-8	CC(=O)N1C=CC2=CC=CC=C21	{24: 1, 1: 1, 14: 6, 33: 1}
Did not match all atoms present	576-22-7	CC1=C(C(=CC=C1)C)Br	{1: 2, 18: 1, 14: 3}
Did not match all atoms present	576-23-8	CC1=C(C(=CC=C1)Br)C	{1: 2, 18: 1, 14: 3}
Did not match all atoms present	576-24-9	C1=CC(=C(C(=C1)Cl)Cl)O	{17: 2, 21: 1, 14: 3}
Did not match all atoms present	576-26-1	CC1=C(C(=CC=C1)C)O	{1: 2, 21: 1, 14: 3}
Did not match all atoms present	576-28-3	CN1C(=O)C=CNC1=S	{32: 1, 1: 1, 33: 1, 14: 2, 25: 1}
Did not match all atoms present	576-55-6	CC1=C(C(=C(C(=C1Br)Br)Br)Br)O	{1: 1, 18: 4, 21: 1}
Did not match all atoms present	576-82-9	C1=C(C=C(C(=C1Br)Br)Br)F	{16: 1, 18: 3, 14: 2}
Did not match all atoms present	576-83-0	CC1=CC(=C(C(=C1)C)Br)C	{1: 3, 18: 1, 14: 2}
Did not match all atoms present	57606-42-5	O.O.O.[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[Zn+2].[Zn+2].[Mo].[Mo]	{}
Did not match all atoms present	57608-10-3	CCCSP(=O)(OCC)OC1=C(C=C(C=C1Cl)Cl)Cl	{1: 2, 2: 3, 40: 1, 14: 2, 17: 3, 22: 2, 29: 1}
Did not match all atoms present	57609-64-0	C1=CC(=CC=C1C(=O)OCCCOC(=O)C2=CC=C(C=C2)N)N	{2: 3, 28: 2, 30: 2, 14: 8}
Did not match all atoms present	57609-72-0	CCN(CC)C1=CC=C(C=C1)C=CC2=NN(C(C2)C3=CC=C(C=C3)N(CC)CC)C4=CC=CC=C4	{1: 4, 2: 4, 35: 1, 6: 2, 33: 3, 11: 1, 12: 1, 14: 13, 15: 1}
Did not match all atoms present	5761-16-0	C1=CC(=CC=C1C2=CC(=S)SS2)Cl	{17: 1, 14: 5, 41: 2}
Did not match all atoms present	57610-10-3	CC1=C(C=CC(=C1)[N+](=O)[O-])N=O	{1: 1, 34: 1, 38: 1, 29: 1, 14: 3}
Did not match all atoms present	57616-17-8	CCS(=O)(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	57620-29-8	[Be+2].[Be+2].[Be+2].[P-3].[P-3]	{}
Did not match all atoms present	57621-04-2	CC(=O)N1CCC2=CC(=C(C=C2C1=C)OC)OC	{1: 3, 5: 1, 33: 1, 11: 2, 14: 2, 15: 1, 22: 2, 24: 1}
Did not match all atoms present	57625-74-8	CC(C)(C1=CC=CC=C1)C(=O)OC	{1: 3, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	57625-97-5	C1CN=C(N1)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4.C1CN=C(N1)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4.C(CC(=O)O)C(=O)O	{32: 2, 2: 2, 35: 2, 11: 6, 12: 2, 13: 2, 14: 20, 15: 2, 27: 2}
Did not match all atoms present	57626-52-5	CC1=NN(C(=O)N1C)C	{1: 3, 35: 1, 33: 2, 25: 1}
Did not match all atoms present	5763-61-1	COC1=C(C=C(C=C1)CN)OC	{1: 2, 2: 1, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	57631-93-3	CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C=C	{1: 2, 2: 4, 5: 1, 6: 1, 33: 1, 14: 4, 24: 2, 31: 2}
Did not match all atoms present	57644-54-9	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[K+].[K+].[K+].[Bi+3]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	57645-49-5	COC1=CC(=C(C=C1C(=O)NC2CCNCC2)Cl)N	{32: 1, 1: 1, 11: 4, 12: 1, 14: 2, 17: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	57645-91-7	COC1=CC(=C(C=C1C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)Cl)N.C(C(C(=O)[O-])O)C(=O)O	{1: 1, 2: 2, 3: 1, 11: 4, 12: 1, 14: 7, 17: 1, 20: 1, 22: 1, 24: 2, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	57647-13-9	CC[NH+](CC)CCN(CC[NH+](CC)CC)N1C=C(C2=CC=CC=C21)C3=CC=CC=C3.[Cl-].[Cl-]	{1: 4, 2: 8, 33: 2, 14: 10, 17: 2}
Did not match all atoms present	57647-35-5	C[NH+](C)CCN(C)N1C=C(C2=CC=CC=C21)C3=CC=CC=C3.[Cl-]	{1: 3, 2: 2, 33: 2, 14: 10, 17: 1}
Did not match all atoms present	57647-53-7	CC1=CC2=C(C=C1)N(C=C2C3=CC=CC=C3)N(CC[NH+](C)C)CC[NH+](C)C.[Cl-].[Cl-]	{1: 5, 2: 4, 33: 2, 14: 9, 17: 2}
Did not match all atoms present	57648-21-2	C1CN(CCC1N2C3=CC=CC=C3NC2=S)CCCC(=O)C4=CC=C(C=C4)F	{32: 1, 33: 2, 2: 3, 11: 4, 12: 1, 14: 8, 16: 1, 24: 1}
Did not match all atoms present	5765-44-6	CC1=CC=NO1	{1: 1, 35: 1, 14: 2, 23: 1}
Did not match all atoms present	57653-85-7	C1=C2C(=C(C(=C1Cl)Cl)Cl)OC3=CC(=C(C(=C3O2)Cl)Cl)Cl	{17: 6, 14: 2, 23: 2}
Did not match all atoms present	57654-83-8	[15N+](=O)([O-])[O-].[K+]	{}
Did not match all atoms present	57657-11-1	CC(=C)C(=O)OCCOCCOC(=O)C(=C)C.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 4, 5: 2, 7: 2, 14: 4, 22: 1, 28: 4}
Did not match all atoms present	5766-79-0	C1CCN(CC1)C(C#N)C2=CC=CC=C2	{11: 5, 33: 1, 3: 1, 37: 1, 14: 5}
Did not match all atoms present	57665-05-1	C1=CC=NC(=C1)C(=O)[O-].[Na+]	{24: 1, 35: 1, 14: 4}
Did not match all atoms present	57665-49-3	CC[NH+](CC)CCN(CC[NH+](CC)CC)N1C=C(C2=C1C=CC(=C2)Cl)C3=CC=C(C=C3)Cl.[Cl-].[Cl-]	{1: 4, 2: 8, 33: 2, 14: 8, 17: 4}
Did not match all atoms present	57674-17-6	CC(C)CC1=NC=CN=C1Cl	{1: 2, 2: 1, 3: 1, 14: 2, 17: 1, 35: 2}
Did not match all atoms present	57683-71-3	COC(=O)C1=CC=CC=C1S(=O)(=O)N	{1: 1, 30: 1, 28: 1, 29: 2, 14: 4}
Did not match all atoms present	57689-20-0	CCCCCCCCC(C)OS(=O)(=O)[O-].[Na+]	{1: 2, 2: 7, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	57689-21-1	CCCCCCCC[C@@H](C)OS(=O)(=O)[O-].[Na+]	{1: 2, 2: 7, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	5769-11-9	CC(=O)N(C1CCCCC1)C2=CC=CC=C2	{1: 1, 33: 1, 11: 5, 12: 1, 14: 5, 24: 1}
Did not match all atoms present	5769-15-3	C1=CC(=CC=C1S(=O)(=O)N=C=O)Cl	{8: 1, 17: 1, 34: 1, 29: 3, 14: 4}
Did not match all atoms present	57699-45-3	CC(C)(C)OC1=CC=C(C=C1)C=O	{1: 3, 26: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	577-11-7	CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 11, 3: 3, 28: 2, 29: 3}
Did not match all atoms present	577-16-2	CC1=CC=CC=C1C(=O)C	{24: 1, 1: 2, 14: 4}
Did not match all atoms present	577-19-5	C1=CC=C(C(=C1)[N+](=O)[O-])Br	{18: 1, 38: 1, 14: 4}
Did not match all atoms present	577-33-3	C1=CC=C2C(=C1)C=C3C(=C2O)C=CC(=C3O)O	{21: 3, 14: 7}
Did not match all atoms present	577-56-0	CC(=O)C1=CC=CC=C1C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4}
Did not match all atoms present	577-59-3	CC(=O)C1=CC=CC=C1[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 14: 4}
Did not match all atoms present	577-66-2	CCOC1=NC2=C(N1C)C(=O)N(C(=O)N2C)C	{1: 4, 2: 1, 35: 1, 33: 3, 22: 1, 25: 2}
Did not match all atoms present	577-71-9	C1=CC(=C(C=C1O)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 21: 1, 14: 3}
Did not match all atoms present	577-72-0	COC1=C(C=C(C=C1)N)[N+](=O)[O-]	{1: 1, 30: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	577-85-5	C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)O	{25: 1, 21: 1, 14: 9, 23: 1}
Did not match all atoms present	577-91-3	C1=CC=C(C=C1)C(CC2=CC(=C(C(=C2)I)O)I)C(=O)O	{2: 1, 3: 1, 14: 7, 19: 2, 21: 1, 27: 1}
Did not match all atoms present	577-92-4	CC(C)(C)C1=CC(=C(C=C1)O)C2=CC=CC=C2	{1: 3, 4: 1, 21: 1, 14: 8}
Did not match all atoms present	5770-28-5	CCC1=NC2=C(N1)C(=O)N(C(=O)N2C)C	{32: 1, 1: 3, 2: 1, 35: 1, 33: 2, 25: 2}
Did not match all atoms present	5770-58-1	C1=CC=C(C=C1)C2=COC3=CC=CC=C3O2	{23: 2, 14: 10, 15: 1}
Did not match all atoms present	5770-97-8	CN1C(=S)SC(=N1)C2=CC=CC=C2	{1: 1, 35: 1, 41: 1, 14: 5, 33: 1}
Did not match all atoms present	57707-64-9	C(C#N)N=[N+]=[N-]	{2: 1, 34: 2, 37: 1}
Did not match all atoms present	57711-44-1	C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)O[Si](C)(C)C(C)(C)C	{1: 7, 4: 1, 11: 9, 12: 5, 13: 2, 22: 1, 25: 1}
Did not match all atoms present	57711-75-8	CN(C)C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 2, 14: 7, 6: 2, 33: 1}
Did not match all atoms present	57718-18-0	CCCCCCCC#CC1=CC=CC=C1	{1: 1, 2: 6, 10: 2, 14: 5}
Did not match all atoms present	5772-74-7	C(=O)([O-])[O-].[Eu+2]	{24: 1}
Did not match all atoms present	5772-82-7	C(=O)[O-].C(=O)[O-].C(=O)[O-].[Eu+3]	{26: 3}
Did not match all atoms present	57722-40-4	C[Si](C)(C)OC1=CC2CCC1C2	{1: 3, 11: 3, 12: 2, 14: 1, 15: 1, 22: 1}
Did not match all atoms present	57726-65-5	CC1=NN=C(O1)C(CCN2CC3CCC2CC3)(C4=CC=CC=C4)C5=CC=CC=C5	{1: 1, 2: 2, 35: 2, 4: 1, 33: 1, 11: 5, 12: 2, 14: 10, 23: 1}
Did not match all atoms present	57729-79-0	C1=C(C=C(C(=C1[N+](=O)[O-])N)Cl)C(F)(F)F	{4: 1, 38: 1, 14: 2, 16: 3, 17: 1, 30: 1}
Did not match all atoms present	57729-86-9	C1=C(C=C(C(=C1[N+](=O)[O-])NC2=C(C=C(C=C2Br)Br)Br)C(F)(F)F)[N+](=O)[O-]	{4: 1, 38: 2, 14: 4, 16: 3, 18: 3, 31: 1}
Did not match all atoms present	5773-56-8	C1=CC=C(C=C1)C[C@@H](C2=CC=CC=C2)O	{2: 1, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	5774-35-6	CC(C)NP(=O)(N1CC1)N2CC2	{1: 2, 3: 1, 33: 2, 11: 4, 29: 1, 31: 1}
Did not match all atoms present	5775-82-6	CC1=NN(C=C1Br)C	{1: 2, 18: 1, 35: 1, 14: 1, 33: 1}
Did not match all atoms present	5776-49-8	CC(=CCCC1(C=CC2=C(O1)C=CC3=C2C(=O)C(=O)C=C3O)C)C	{1: 3, 2: 2, 6: 1, 7: 1, 13: 1, 14: 5, 15: 1, 20: 1, 23: 1, 25: 2}
Did not match all atoms present	57762-28-4	CC[C+]=O.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sb]	{1: 1, 2: 1, 29: 1, 17: 6}
Did not match all atoms present	57764-54-2	CCOC(=O)C(=O)C1=C(C=C(C=C1)O)O	{1: 1, 2: 1, 14: 3, 21: 2, 24: 1, 28: 1}
Did not match all atoms present	57772-57-3	C1=CC(=C(C=C1O)C(=O)O)I	{27: 1, 19: 1, 21: 1, 14: 3}
Did not match all atoms present	57773-65-6	CCNC(=O)C1CCCN1C(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C(CC4=CC=C(C=C4)O)NC(=O)C(CO)NC(=O)C(CC5=CNC6=CC=CC=C65)NC(=O)C(CC7=CN=CN7)NC(=O)C8CCC(=O)N8	{32: 4, 1: 3, 2: 10, 3: 8, 33: 1, 7: 1, 11: 5, 12: 2, 34: 1, 14: 16, 35: 1, 20: 1, 21: 1, 24: 9, 25: 1, 30: 2, 31: 8}
Did not match all atoms present	57775-22-1	CCC1=NN(C(=O)N1CC)CCCN2CCN(CC2)C3=CC(=CC=C3)Cl.Cl	{1: 2, 2: 5, 35: 1, 33: 4, 11: 4, 14: 4, 17: 2, 25: 1}
Did not match all atoms present	5779-51-1	CCCCN(CCCC)CCC1=CC=CC=C1	{1: 2, 2: 8, 14: 5, 33: 1}
Did not match all atoms present	5779-79-3	C1CC2=CC3=CC4=CC=CC=C4C=C3C5=C2C1=CC=C5	{11: 2, 14: 10}
Did not match all atoms present	5779-94-2	CC1=CC(=C(C=C1)C)C=O	{1: 2, 26: 1, 14: 3}
Did not match all atoms present	5779-95-3	CC1=CC(=CC(=C1)C=O)C	{1: 2, 26: 1, 14: 3}
Did not match all atoms present	578-07-4	C1=CC=C2C(=C1)C=C3C=CC=C(C3=N2)N	{35: 1, 30: 1, 14: 8}
Did not match all atoms present	578-32-5	CN(C)C1=C(C=C(C(=C1)F)N=NC2=C(C=CC(=C2)F)F)F	{16: 4, 1: 2, 34: 2, 14: 5, 33: 1}
Did not match all atoms present	578-36-9	C1=CC=C(C(=C1)C(=O)[O-])O.[K+]	{24: 1, 21: 1, 14: 4}
Did not match all atoms present	578-46-1	CC1=CC(=C(C=C1)[N+](=O)[O-])N	{1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	578-51-8	C1=CC=C(C(=C1)CCl)Br	{17: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	578-54-1	CCC1=CC=CC=C1N	{1: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	578-57-4	COC1=CC=CC=C1Br	{1: 1, 18: 1, 22: 1, 14: 4}
Did not match all atoms present	578-58-5	CC1=CC=CC=C1OC	{1: 2, 22: 1, 14: 4}
Did not match all atoms present	578-66-5	C1=CC2=C(C(=C1)N)N=CC=C2	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	578-67-6	C1=CC(=O)C2=CC=CNC2=C1	{32: 1, 25: 1, 14: 6}
Did not match all atoms present	578-68-7	C1=CC=C2C(=C1)C(=CC=N2)N	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	578-76-7	CN1C=NC2=C1C(=O)N=C(N2)N	{32: 1, 1: 1, 35: 2, 33: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	578-85-8	C1=CC2=C(C=C(C=C2C=C1S(=O)(=O)O)S(=O)(=O)O)O	{20: 2, 21: 1, 14: 5, 29: 4}
Did not match all atoms present	578-94-9	C1=CC=C2C(=C1)NC3=CC=CC=C3[As]2Cl	{32: 1, 17: 1, 14: 8}
Did not match all atoms present	578-95-0	C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2	{32: 1, 25: 1, 14: 8}
Did not match all atoms present	5780-07-4	COC1=CC(=CC2=C1OCO2)C=O	{1: 1, 11: 1, 14: 2, 22: 1, 23: 2, 26: 1}
Did not match all atoms present	5780-36-9	CSC1=CC=CS1	{40: 1, 1: 1, 14: 3, 41: 1}
Did not match all atoms present	5780-66-5	C1=CN=C(C=N1)C=O	{26: 1, 35: 2, 14: 3}
Did not match all atoms present	57801-81-7	CC1=NN=C2N1C3=C(C=C(S3)Br)C(=NC2)C4=CC=CC=C4Cl	{1: 1, 35: 3, 33: 1, 41: 1, 11: 1, 14: 5, 15: 1, 17: 1, 18: 1}
Did not match all atoms present	57804-25-8	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[La+3].[La+3]	{29: 12}
Did not match all atoms present	57807-44-0	CC(C)(C)OOC(C)(C)C1=CC=C(C=C1)C(C)(C)O	{1: 7, 4: 3, 22: 2, 14: 4, 20: 1}
Did not match all atoms present	57808-65-8	CC1=CC(=C(C=C1NC(=O)C2=CC(=CC(=C2O)I)I)Cl)C(C#N)C3=CC=C(C=C3)Cl	{1: 1, 3: 1, 37: 1, 14: 8, 17: 2, 19: 2, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	57808-66-9	C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)CCCN4C5=CC=CC=C5NC4=O	{32: 2, 33: 3, 2: 3, 11: 4, 12: 1, 14: 7, 17: 1, 25: 2}
Did not match all atoms present	5781-02-2	CC1=C(C=C(C=C1)C(C)(C)C)O	{1: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	57816-08-7	C1C2=C(CC3=C1C4=CC=CC=C4C=C3)C5=CC=CC=C5C=C2	{11: 2, 14: 12}
Did not match all atoms present	57820-90-3	C[C-]1[CH-][CH-][C-]([CH-][CH-]1)Cl.CC1=CC=C(C=C1)Cl.[Cr]	{1: 2, 17: 2, 14: 8, 15: 2}
Did not match all atoms present	57820-94-7	[CH-]1[CH-][CH-][C-]([CH-][CH-]1)OC2=CC=CC=C2.C1=CC=C(C=C1)OC2=CC=CC=C2.[Cr]	{22: 2, 14: 20, 15: 1}
Did not match all atoms present	57820-96-9	C[C-]1[CH-][CH-][CH-][C-]([C-]1C)C.CC1=C(C(=CC=C1)C)C.[Cr]	{1: 6, 14: 6, 15: 3}
Did not match all atoms present	57820-98-1	C[C-]1[CH-][C-]([C-]([CH-][C-]1C)C)C.CC1=CC(=C(C=C1C)C)C.[Cr]	{1: 8, 14: 4, 15: 4}
Did not match all atoms present	57821-01-9	[CH-]1[CH-][C-]([CH-][CH-][C-]1C(F)(F)F)F.C1=CC(=CC=C1C(F)(F)F)F.[Cr]	{16: 8, 4: 2, 14: 8, 15: 2}
Did not match all atoms present	57834-33-0	CCOC(=O)C1=CC=C(C=C1)N=CN(C)C2=CC=CC=C2	{1: 2, 2: 1, 6: 1, 33: 1, 34: 1, 14: 9, 28: 1}
Did not match all atoms present	57834-50-1	CCOC(=O)C1=CC=C(C=C1)NC=NC2=CC=C(C=C2)C(=O)OCC	{1: 2, 2: 2, 6: 1, 34: 1, 14: 8, 28: 2, 31: 1}
Did not match all atoms present	57835-92-4	C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	57835-99-1	C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.F[P-](F)(F)(F)(F)F	{16: 6, 14: 15}
Did not match all atoms present	57837-19-1	CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC	{1: 5, 2: 1, 3: 1, 33: 1, 14: 3, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	5784-88-3	COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 2, 38: 2, 14: 6, 17: 4, 22: 2}
Did not match all atoms present	57846-03-4	CC1=CC=C(O1)CBr	{1: 1, 2: 1, 18: 1, 14: 2, 23: 1}
Did not match all atoms present	57848-46-1	C1=CC(=C(C=C1Br)F)C=O	{16: 1, 18: 1, 26: 1, 14: 3}
Did not match all atoms present	5785-06-8	COC1=CC=CC(=C1)C(=O)NN	{1: 1, 14: 4, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	5785-44-4	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.O.O.[Ca+2].[Ca+2].[Ca+2]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	5785-66-0	C1CC1C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{12: 1, 11: 2, 4: 1, 14: 10, 20: 1}
Did not match all atoms present	57852-57-0	CC1C(C(CC(O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=CC=CC=C5C4=O)O)(C(=O)C)O)N)O.Cl	{1: 2, 11: 3, 12: 5, 13: 1, 14: 4, 17: 1, 20: 2, 21: 2, 22: 1, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	57856-11-8	CCOP(C)OCCN(C(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 22: 2, 33: 1}
Did not match all atoms present	57857-78-0	CN(P(OC1=CC=CC=C1)OC2=CC=CC=C2)P(OC3=CC=CC=C3)OC4=CC=CC=C4	{1: 1, 22: 4, 14: 20, 33: 1}
Did not match all atoms present	5786-21-0	CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl	{32: 1, 1: 1, 35: 1, 33: 2, 11: 4, 14: 7, 15: 1, 17: 1}
Did not match all atoms present	5786-68-5	C1CN(CCN1)C2=NC3=CC=CC=C3C=C2.C(=C\C(=O)O)\C(=O)O	{32: 1, 33: 1, 35: 1, 6: 2, 11: 4, 14: 6, 27: 2}
Did not match all atoms present	5786-77-6	CC(C=C(C1=CC=CS1)C2=CC=CS2)[NH+](C)C.[Cl-]	{1: 3, 3: 1, 6: 1, 7: 1, 41: 2, 14: 6, 17: 1}
Did not match all atoms present	57864-56-9	C1CS[Si](S1)(C2=CC=CC=C2)C3=CC=CC=C3	{41: 2, 11: 2, 14: 10}
Did not match all atoms present	57872-78-3	CCCCCCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)O	{1: 1, 2: 5, 35: 3, 33: 1, 12: 4, 14: 2, 20: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	57872-80-7	CCCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)O	{1: 1, 2: 2, 35: 3, 33: 1, 12: 4, 14: 2, 20: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	57876-69-4	CC1=CC2=CC=CC=C2N=C1Cl	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	57877-83-5	B1(N(B(N(N1C)C)C)C(C)(C)C)C	{1: 7, 4: 1, 33: 3}
Did not match all atoms present	57877-84-6	B1(N(B(N(N1C)C)C)[As](C)C)C	{1: 6, 33: 3}
Did not match all atoms present	57877-85-7	B1(NB(SN1C)C)C	{32: 1, 1: 3, 41: 1, 33: 1}
Did not match all atoms present	57877-86-8	B1(NN(B(S1)C)[Si](C)(C)C)C	{32: 1, 1: 5, 41: 1, 33: 1}
Did not match all atoms present	57877-87-9	B1(NB(SS1)C)C	{32: 1, 1: 2, 41: 2}
Did not match all atoms present	57877-88-0	B1(N(B(SS1)C)C)C	{1: 3, 41: 2, 33: 1}
Did not match all atoms present	57877-89-1	B1(N(B(ON1C)C)C)C	{1: 4, 33: 2, 23: 1}
Did not match all atoms present	57877-90-4	B1(N(OB(S1)C)C)C	{1: 3, 41: 1, 33: 1, 23: 1}
Did not match all atoms present	57878-77-0	CN1C(=CN=C1CSSCC2=NC=C(N2C)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 2, 35: 2, 38: 2, 33: 2, 40: 2, 14: 2}
Did not match all atoms present	57878-93-0	CC1=CC(=C(C=C1)N=C=S)Cl	{8: 1, 1: 1, 34: 1, 14: 3, 17: 1}
Did not match all atoms present	5788-49-8	CC1=CN=C(C(=S)N1)C	{32: 1, 1: 2, 35: 1, 14: 1}
Did not match all atoms present	5788-58-9	C1=NNC(=O)C(=C1Br)Br	{32: 1, 25: 1, 18: 2, 35: 1, 14: 1}
Did not match all atoms present	57883-04-2	C1CCC(CC1)C2=C(C(=CC=C2)Cl)O	{17: 1, 11: 5, 12: 1, 21: 1, 14: 3}
Did not match all atoms present	57897-99-1	C(C[Se])N=C(N)N	{2: 2, 34: 1, 30: 2, 7: 1}
Did not match all atoms present	579-07-7	CC(=O)C(=O)C1=CC=CC=C1	{24: 2, 1: 1, 14: 5}
Did not match all atoms present	579-10-2	CC(=O)N(C)C1=CC=CC=C1	{24: 1, 1: 2, 14: 5, 33: 1}
Did not match all atoms present	579-18-0	C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O	{24: 1, 27: 1, 14: 9}
Did not match all atoms present	579-21-5	CN1[C@H](CCC[C@H]1CC(=O)C2=CC=CC=C2)CC(=O)C3=CC=CC=C3	{1: 1, 2: 2, 33: 1, 11: 3, 12: 2, 14: 10, 24: 2}
Did not match all atoms present	579-38-4	CN(C1=CC=C(C=C1)O)C(=O)C(Cl)Cl	{1: 1, 3: 1, 33: 1, 14: 4, 17: 2, 21: 1, 24: 1}
Did not match all atoms present	579-39-5	C1=CC(=CC=C1C(=O)C(=O)C2=CC=C(C=C2)F)F	{16: 2, 24: 2, 14: 8}
Did not match all atoms present	579-43-1	C1=CC=C(C=C1)[C@H]([C@H](C2=CC=CC=C2)O)O	{3: 2, 20: 2, 14: 10}
Did not match all atoms present	579-49-7	C1=CSC(=C1)C(=O)C2=CC=C(C=C2)F	{16: 1, 24: 1, 14: 7, 41: 1}
Did not match all atoms present	579-55-5	C1=CC=C(C=C1)C(C2=CC=CC=C2)F	{16: 1, 3: 1, 14: 10}
Did not match all atoms present	579-56-6	CC(COC1=CC=CC=C1)NC(C)C(C2=CC=C(C=C2)O)O.Cl	{1: 2, 2: 1, 3: 3, 14: 9, 17: 1, 20: 1, 21: 1, 22: 1, 31: 1}
Did not match all atoms present	579-60-2	COC1=CC=CC(=C1O)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	579-66-8	CCC1=C(C(=CC=C1)CC)N	{1: 2, 2: 2, 30: 1, 14: 3}
Did not match all atoms present	579-74-8	CC(=O)C1=CC=CC=C1OC	{24: 1, 1: 2, 22: 1, 14: 4}
Did not match all atoms present	579-75-9	COC1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	579-92-0	C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC=C2C(=O)O	{27: 2, 14: 8, 31: 1}
Did not match all atoms present	579-98-6	CC(=O)N(CC(=O)O)C1=CC=CC=C1	{1: 1, 2: 1, 33: 1, 14: 5, 24: 1, 27: 1}
Did not match all atoms present	5791-64-0	CC1=CC2=C(C=C1)NC3=C(C2=O)C(=O)C4=C(C3=O)C(=O)C5=C(N4)C=CC(=C5)C	{32: 2, 1: 2, 14: 6, 25: 4}
Did not match all atoms present	5792-36-9	CCC(=O)C1=C(C=C(C=C1)O)O	{24: 1, 1: 1, 2: 1, 21: 2, 14: 3}
Did not match all atoms present	5793-84-0	C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ca+2]	{14: 10}
Did not match all atoms present	57933-19-4	CC1=CC2=C(C=C1)NC3C2CN(CC3)CCCC(=O)C4=CC=C(C=C4)F.Cl.Cl	{32: 1, 1: 1, 2: 3, 33: 1, 11: 3, 12: 2, 14: 7, 16: 1, 17: 2, 24: 1}
Did not match all atoms present	57938-86-0	CCOC(=O)/C=C(/C)\NC(C1=CC=C(C=C1)O)C(=O)[O-].[K+]	{1: 2, 2: 1, 3: 1, 6: 1, 7: 1, 14: 4, 21: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	5794-28-5	C(=O)(C(=O)[O-])[O-].O.[Ca+2]	{24: 2}
Did not match all atoms present	5794-88-7	C1=CC(=C(C=C1Br)C(=O)O)N	{18: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	57943-75-6	CCN(CC)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2OC)N=NC3=CC=C(C=C3)[N+](=O)[O-])OC	{1: 4, 2: 2, 38: 1, 33: 1, 34: 4, 14: 10, 22: 2}
Did not match all atoms present	57943-81-4	C1[C@@H]2N(C1=O)[C@H](/C(=C/CO)/O2)C(=O)[O-].[Na+]	{33: 1, 2: 1, 6: 1, 11: 1, 12: 2, 15: 1, 20: 1, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	57946-56-2	C1=CC(=C(C=C1Cl)F)N	{16: 1, 17: 1, 30: 1, 14: 3}
Did not match all atoms present	57946-63-1	C1=CC(=C(C=C1C(F)(F)F)Br)N	{16: 3, 18: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	57947-48-5	C1CN1.NS(=O)(=O)O	{32: 1, 11: 2, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	57948-13-7	CC1=CC(=C(C=C1)[NH-])[NH-].Cl[Pt+2]Cl	{1: 1, 36: 2, 14: 3, 17: 2}
Did not match all atoms present	57958-47-1	CCOC(=O)CCN(CCC1=CC=CC=C1)CCC(=O)OCC	{1: 2, 2: 8, 28: 2, 14: 5, 33: 1}
Did not match all atoms present	5796-07-6	CCCCCCCCCCCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 11, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	5796-14-5	C1=CC(=C(C=C1CC(C(=O)O)[NH3+])O)O.[Cl-]	{2: 1, 3: 1, 14: 3, 17: 1, 21: 2, 27: 1}
Did not match all atoms present	5796-89-4	CCC(=O)OO[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 22: 1}
Did not match all atoms present	5796-93-0	C1=CC2=C3C=CC=C4C3=C(C=CC4=O)C5=C2C(=C1)C(=O)C=C5	{25: 2, 14: 10}
Did not match all atoms present	57962-60-4	CC1=CN=C(N1C2=CC=CC=C2)N3CCCC3	{1: 1, 11: 4, 35: 1, 14: 6, 33: 2}
Did not match all atoms present	57964-01-9	CC(C)(C)C1=CC=C(C=C1)C2=CC(=C(C(=C2)SC3=CC(=CC(=C3O)C(C)(C)C)C4=CC=C(C=C4)C(C)(C)C)O)C(C)(C)C	{40: 1, 1: 12, 4: 4, 21: 2, 14: 12}
Did not match all atoms present	57979-03-0	CCC(CO)(CO)CO.CC1=C(C=CC=C1N=C=O)N=C=O.C1CCC(=O)OCC1	{1: 2, 2: 4, 4: 1, 8: 2, 11: 5, 34: 2, 14: 3, 20: 3, 28: 1, 29: 2}
Did not match all atoms present	5798-75-4	CCOC(=O)C1=CC=C(C=C1)Br	{1: 1, 2: 1, 28: 1, 18: 1, 14: 4}
Did not match all atoms present	5798-79-8	C1=CC=C(C=C1)C(C#N)Br	{18: 1, 3: 1, 37: 1, 14: 5}
Did not match all atoms present	5798-94-7	C1=CC(=C(C=C1Br)C(=O)NO)[O-].[Na+]	{24: 1, 18: 1, 20: 1, 14: 3, 31: 1}
Did not match all atoms present	57980-07-1	CC1=CC(=O)OC2=C1C=CC(=N2)N3CCOCC3	{1: 1, 35: 1, 33: 1, 11: 4, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	57980-95-7	CN(C)C.CN(C)C.OS(=O)(=O)O	{1: 6, 20: 2, 29: 2, 33: 2}
Did not match all atoms present	57981-99-4	CC(=O)OC1=CC(=C(C=C1)OC(=O)C)Cl	{1: 2, 28: 2, 14: 3, 17: 1}
Did not match all atoms present	57982-77-1	CCNC(=O)C1CCCN1C(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(COC(C)(C)C)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CO)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C(CC5=CN=CN5)NC(=O)C6CCC(=O)N6	{32: 3, 1: 6, 2: 10, 3: 8, 4: 1, 33: 1, 7: 1, 11: 5, 12: 2, 34: 1, 14: 11, 35: 1, 20: 1, 21: 1, 22: 1, 24: 9, 25: 1, 30: 2, 31: 8}
Did not match all atoms present	57982-78-2	CC(C)(C)N1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 4: 1, 33: 1, 11: 4, 13: 1, 14: 10}
Did not match all atoms present	57988-58-6	C1CNCCC1(C2=CC=C(C=C2)Br)O	{32: 1, 11: 4, 13: 1, 14: 4, 18: 1, 20: 1}
Did not match all atoms present	57989-34-1	CCCCC(=O)N1C(=O)CC2=CC=CC=C21	{1: 1, 2: 3, 33: 1, 11: 1, 14: 4, 24: 1, 25: 1}
Did not match all atoms present	5799-70-2	C(S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 1, 29: 6}
Did not match all atoms present	58-00-4	CN1CCC2=CC=CC3=C2[C@H]1CC4=C3C(=C(C=C4)O)O	{1: 1, 33: 1, 11: 3, 12: 1, 14: 5, 21: 2}
Did not match all atoms present	58-08-2	CN1C=NC2=C1C(=O)N(C(=O)N2C)C	{1: 3, 35: 1, 33: 3, 14: 1, 25: 2}
Did not match all atoms present	58-14-0	CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl	{1: 1, 2: 1, 35: 2, 14: 4, 17: 1, 30: 2}
Did not match all atoms present	58-15-1	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C	{1: 4, 33: 3, 14: 5, 25: 1}
Did not match all atoms present	58-25-3	CN=C1CN(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)O	{1: 1, 34: 1, 35: 1, 33: 1, 11: 1, 14: 8, 15: 2, 17: 1, 20: 1}
Did not match all atoms present	58-27-5	CC1=CC(=O)C2=CC=CC=C2C1=O	{1: 1, 25: 2, 14: 5, 15: 1}
Did not match all atoms present	58-28-6	CNCCCN1C2=CC=CC=C2CCC3=CC=CC=C31.Cl	{1: 1, 2: 3, 33: 1, 11: 2, 14: 8, 17: 1, 31: 1}
Did not match all atoms present	58-32-2	C1CCN(CC1)C2=NC(=NC3=C2N=C(N=C3N4CCCCC4)N(CCO)CCO)N(CCO)CCO	{33: 4, 2: 8, 11: 10, 20: 4, 35: 4}
Did not match all atoms present	58-33-3	CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)N(C)C.Cl	{1: 3, 2: 1, 3: 1, 33: 2, 41: 1, 14: 8, 17: 1}
Did not match all atoms present	58-36-6	C1=CC=C2C(=C1)OC3=CC=CC=C3[As]2O[As]4C5=CC=CC=C5OC6=CC=CC=C64	{22: 1, 14: 16, 23: 2}
Did not match all atoms present	58-37-7	CN(C)CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)N(C)C	{1: 4, 2: 2, 3: 1, 33: 3, 41: 1, 14: 8}
Did not match all atoms present	58-38-8	CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl	{1: 1, 2: 3, 33: 3, 41: 1, 11: 4, 14: 7, 17: 1}
Did not match all atoms present	58-39-9	C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO	{33: 3, 2: 5, 41: 1, 11: 4, 14: 7, 17: 1, 20: 1}
Did not match all atoms present	58-40-2	CN(C)CCCN1C2=CC=CC=C2SC3=CC=CC=C31	{1: 2, 2: 3, 41: 1, 14: 8, 33: 2}
Did not match all atoms present	58-46-8	CC(C)CC1CN2CCC3=CC(=C(C=C3C2CC1=O)OC)OC	{1: 4, 2: 1, 3: 1, 33: 1, 11: 4, 12: 2, 14: 2, 22: 2, 25: 1}
Did not match all atoms present	58-54-8	CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl	{1: 1, 2: 2, 5: 1, 7: 1, 14: 2, 17: 2, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	58-55-9	CN1C2=C(C(=O)N(C1=O)C)NC=N2	{32: 1, 1: 2, 35: 1, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	58-56-0	CC1=NC=C(C(=C1O)CO)CO.Cl	{1: 1, 2: 2, 35: 1, 14: 1, 17: 1, 20: 2, 21: 1}
Did not match all atoms present	58-58-2	CN(C)C1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)NC(=O)C(CC4=CC=C(C=C4)OC)N)O	{1: 3, 2: 2, 3: 1, 33: 2, 12: 4, 14: 6, 35: 3, 20: 2, 22: 1, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	58-60-6	CN(C)C1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)N)O	{1: 2, 2: 1, 35: 3, 33: 2, 12: 4, 14: 2, 20: 2, 23: 1, 30: 1}
Did not match all atoms present	58-61-7	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	58-63-9	C1=NC(=O)C2=C(N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 2, 20: 3, 23: 1, 25: 1}
Did not match all atoms present	58-64-0	C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 5, 22: 2, 23: 1, 29: 2, 30: 1}
Did not match all atoms present	58-72-0	C1=CC=C(C=C1)C=C(C2=CC=CC=C2)C3=CC=CC=C3	{14: 15, 6: 1, 7: 1}
Did not match all atoms present	58-73-1	CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 2, 3: 1, 33: 1, 14: 10, 22: 1}
Did not match all atoms present	58-74-2	COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC	{1: 4, 2: 1, 35: 1, 22: 4, 14: 7}
Did not match all atoms present	58-82-2	C1C[C@H](N(C1)C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCN=C(N)N)N)C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CO)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O	{33: 3, 2: 10, 3: 5, 7: 2, 11: 9, 12: 3, 34: 2, 14: 10, 20: 1, 24: 8, 27: 1, 30: 5, 31: 5}
Did not match all atoms present	58-90-2	C1=C(C(=C(C(=C1Cl)Cl)Cl)O)Cl	{17: 4, 21: 1, 14: 1}
Did not match all atoms present	58-93-5	C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl	{32: 2, 11: 1, 14: 2, 17: 1, 29: 4, 30: 1}
Did not match all atoms present	58-94-6	C1=C2C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)N=CN2	{32: 1, 35: 1, 14: 3, 17: 1, 29: 4, 30: 1}
Did not match all atoms present	58-95-7	CC1=C2C(=C(C(=C1C)OC(=O)C)C)CC[C@@](O2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C	{1: 9, 2: 9, 3: 3, 11: 2, 13: 1, 23: 1, 28: 1}
Did not match all atoms present	58-97-9	C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O	{32: 1, 33: 1, 2: 1, 12: 4, 14: 2, 20: 4, 22: 1, 23: 1, 25: 2, 29: 1}
Did not match all atoms present	580-02-9	CC(=O)OC1=CC=CC=C1C(=O)OC	{1: 2, 28: 2, 14: 4}
Did not match all atoms present	580-13-2	C1=CC=C2C=C(C=CC2=C1)Br	{18: 1, 14: 7}
Did not match all atoms present	580-15-4	C1=CC2=C(C=CC(=C2)N)N=C1	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	580-16-5	C1=CC2=C(C=CC(=C2)O)N=C1	{35: 1, 21: 1, 14: 6}
Did not match all atoms present	580-17-6	C1=CC=C2C(=C1)C=C(C=N2)N	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	580-18-7	C1=CC=C2C(=C1)C=C(C=N2)O	{35: 1, 21: 1, 14: 6}
Did not match all atoms present	580-19-8	C1=CC2=C(C=C(C=C2)N)N=C1	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	580-20-1	C1=CNC2=CC(=O)C=CC2=C1	{32: 1, 25: 1, 14: 6}
Did not match all atoms present	580-22-3	C1=CC=C2C(=C1)C=CC(=N2)N	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	580-35-8	C1=CC=C(C=C1)C2=CC(=NC(=C2)C3=CC=CC=C3)C4=CC=CC=C4	{35: 1, 14: 17}
Did not match all atoms present	580-48-3	CCN(CC)C1=NC(=NC(=N1)Cl)N(CC)CC	{1: 4, 2: 4, 35: 3, 33: 2, 17: 1}
Did not match all atoms present	580-51-8	C1=CC=C(C=C1)C2=CC(=CC=C2)O	{21: 1, 14: 9}
Did not match all atoms present	580-74-5	[C-]#[N+]/C(=C\C1=CC=C(C=C1)O)/C(=C/C2=CC=C(C=C2)O)/[N+]#[C-]	{34: 2, 21: 2, 14: 8, 6: 2, 7: 2}
Did not match all atoms present	5800-19-1	CC1=CC2=C(C=C1)SC3=CC=CC=C3N=C2N4CCN(CC4)C	{1: 2, 35: 1, 33: 2, 41: 1, 11: 4, 14: 7, 15: 1}
Did not match all atoms present	58002-98-5	C1CC2=CC3=C(CCC4=C(CC3)C=C1C=C4)C=C2	{11: 6, 14: 6}
Did not match all atoms present	58011-68-0	CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=NN2C)C)C(=O)C3=C(C=C(C=C3)Cl)Cl	{1: 3, 35: 1, 33: 1, 14: 7, 17: 2, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	58013-12-0	C1CN(CCN1CC(=O)C2=CN=CC=C2)C3=CC=CC=C3	{33: 2, 2: 1, 35: 1, 11: 4, 14: 9, 24: 1}
Did not match all atoms present	58013-13-1	C1CN(CCN1CC(=O)C2=CN=CC=C2)C3=CC=CC=C3Cl	{33: 2, 2: 1, 35: 1, 11: 4, 14: 8, 17: 1, 24: 1}
Did not match all atoms present	58013-14-2	COC1=CC=CC=C1N2CCN(CC2)CC(=O)C3=CN=CC=C3	{1: 1, 2: 1, 35: 1, 33: 2, 11: 4, 14: 8, 22: 1, 24: 1}
Did not match all atoms present	5802-91-5	CCCCCCCCCCCCCCCCC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{24: 1, 1: 1, 2: 15, 3: 1, 29: 3}
Did not match all atoms present	5802-92-6	CCCCCCCCCCCCC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{24: 1, 1: 1, 2: 11, 3: 1, 29: 3}
Did not match all atoms present	5803-30-5	CCC(=O)C1=C(C=CC(=C1)OC)OC	{24: 1, 1: 3, 2: 1, 22: 2, 14: 3}
Did not match all atoms present	5803-62-3	CCCCCC(C1=C(C=C2C(=C1O)C(=O)C3=C(C=C(C=C3C2=O)O)O)O)O	{1: 1, 2: 4, 3: 1, 14: 3, 20: 1, 21: 4, 25: 2}
Did not match all atoms present	58030-91-4	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4[C@H]([C@@H](C=C5)O)O)C=C2	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	58039-73-9	C1COC(CN1)CCC2=CC=CC=C2OC3=CC=CC=C3.C1COC(CN1)CCC2=CC=CC=C2OC3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O	{32: 2, 2: 4, 6: 2, 11: 6, 12: 2, 14: 18, 22: 2, 23: 2, 27: 2}
Did not match all atoms present	5804-73-9	CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)Cl	{1: 2, 14: 3, 17: 1, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	5804-92-2	C[Si](C)(C)OCCN	{1: 3, 2: 2, 30: 1, 22: 1}
Did not match all atoms present	58048-24-1	CC(=O)O[C@H]1[C@H]([C@@H](O[C@@H]1C(=O)NC2CC2)N3C=NC4=C3N=CN=C4N)OC(=O)C	{1: 2, 35: 3, 33: 1, 11: 2, 12: 5, 14: 2, 23: 1, 24: 1, 28: 2, 30: 1, 31: 1}
Did not match all atoms present	58048-25-2	C1CC1CNC(=O)[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C3N=CN=C4N)O)O	{33: 1, 2: 1, 35: 3, 11: 2, 12: 5, 14: 2, 20: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	58048-26-3	CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)OC(=O)C)OC(=O)C	{1: 3, 2: 1, 35: 3, 33: 1, 12: 4, 14: 2, 23: 1, 24: 1, 28: 2, 30: 1, 31: 1}
Did not match all atoms present	58049-96-0	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])Cl)OC)N(CCOC)CCOC	{1: 4, 2: 4, 37: 1, 38: 1, 33: 1, 34: 2, 14: 4, 17: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	5805-27-6	CCCCCCCCCCCCCCCCCC1=NC2=CC=CC=C2N1	{32: 1, 1: 1, 2: 16, 35: 1, 14: 4}
Did not match all atoms present	5805-39-0	C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)N	{32: 1, 35: 1, 30: 1, 14: 8}
Did not match all atoms present	5805-76-5	CCN1C(=NC2=CC=CC=C21)C	{1: 2, 2: 1, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	5805-95-8	CC1=C(C=CC=C1[N+](=O)[O-])NO	{1: 1, 20: 1, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	58050-46-7	C1=CC=C(C=C1)COC(=O)NCN(CCCl)CCCl	{33: 1, 2: 6, 14: 5, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	5806-00-8	CC1=C(C=CC=C1[N+](=O)[O-])N=[N+](C2=C(C(=CC=C2)[N+](=O)[O-])C)[O-]	{1: 2, 34: 1, 38: 2, 33: 1, 14: 6, 29: 1}
Did not match all atoms present	5806-72-4	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)CC(C)(C)C	{1: 10, 2: 2, 4: 4, 21: 1, 14: 3}
Did not match all atoms present	58065-21-7	CC(C)(CC1=CC=C(C=C1)OC)N.Cl	{1: 3, 2: 1, 4: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	58065-30-8	CC(=O)OCCSC1=C(C2=C(C(=C1Cl)N)C(=O)C3=CC=CC=C3C2=O)N	{1: 1, 2: 2, 40: 1, 14: 4, 17: 1, 25: 2, 28: 1, 30: 2}
Did not match all atoms present	58066-85-6	CCCCCCCCCCCCCCCCOP(=O)([O-])OCC[N+](C)(C)C	{1: 4, 2: 17, 29: 2, 22: 2}
Did not match all atoms present	58066-88-9	COCC[Si](C)(Cl)Cl	{1: 2, 2: 2, 22: 1, 17: 2}
Did not match all atoms present	58066-96-9	CCN(CCO)C1=CC(=C(C=C1)N=O)C	{1: 2, 2: 3, 33: 1, 34: 1, 14: 3, 20: 1, 29: 1}
Did not match all atoms present	58068-97-6	CCO[Si](CCCN1CCN=C1)(OCC)OCC	{1: 3, 2: 6, 35: 1, 33: 1, 11: 2, 14: 1, 22: 3}
Did not match all atoms present	5807-30-7	C1=CC(=C(C=C1CC(=O)O)Cl)Cl	{17: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	5807-64-7	COC(=O)C1=CC=CC=C1C2=CC=CC=C2C(=O)OC	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	5807-94-3	CC[N+](C)(C)CCCOC1=CC=C(C=C1)OCCC[N+](C)(C)CC.[I-].[I-]	{1: 6, 2: 8, 19: 2, 22: 2, 14: 4}
Did not match all atoms present	58070-86-3	CCOC(=O)/C=C/C1=CC=C(C=C1)/C=C/C(=O)OCC.COC(=O)C1=CC(=CC=C1)S(=O)(=O)[N-]S(=O)(=O)C2=CC=CC(=C2)C(=O)OC.C1C(CCC(C1)OCCO)OCCO.[Na+]	{1: 4, 2: 6, 6: 4, 11: 4, 12: 2, 34: 1, 14: 12, 20: 2, 22: 2, 28: 4, 29: 4}
Did not match all atoms present	58085-73-7	CCCCCCCCCC1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 8, 21: 1, 14: 8}
Did not match all atoms present	5809-07-4	CCOC1=CC=CO1	{1: 1, 2: 1, 22: 1, 14: 3, 23: 1}
Did not match all atoms present	5809-23-4	CCN(CC)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O	{1: 2, 2: 2, 33: 1, 14: 7, 21: 1, 24: 1, 27: 1}
Did not match all atoms present	5809-49-4	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Sc+3].[Sc+3]	{24: 3}
Did not match all atoms present	58090-24-7	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	58090-78-1	C1=CC=C(C=C1)C2=C(C2(C3=CC=CC=C3)Cl)C4=CC=CC=C4	{17: 1, 13: 1, 14: 15, 15: 2}
Did not match all atoms present	58090-79-2	C1=CC=C(C=C1)C2=C(C2(C3=CC=CC=C3)I)C4=CC=CC=C4	{19: 1, 13: 1, 14: 15, 15: 2}
Did not match all atoms present	58094-06-7	C1CC(C2=C(C1)SC=C2)NC=O	{41: 1, 11: 3, 12: 1, 14: 2, 26: 1, 31: 1}
Did not match all atoms present	581-08-8	CCOC1=CC=CC=C1NC(=O)C	{1: 2, 2: 1, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	581-12-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)C4=CC=CC=C4)CC=C5[C@@]3(CCC(=O)C5)C	{1: 2, 11: 8, 12: 4, 13: 2, 14: 6, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	581-28-2	C1=CC=C2C(=C1)C=C3C=C(C=CC3=N2)N	{35: 1, 30: 1, 14: 8}
Did not match all atoms present	581-29-3	C1=CC=C2C(=C1)C=C3C=CC(=CC3=N2)N	{35: 1, 30: 1, 14: 8}
Did not match all atoms present	581-40-8	CC1=CC2=CC=CC=C2C=C1C	{1: 2, 14: 6}
Did not match all atoms present	581-42-0	CC1=CC2=C(C=C1)C=C(C=C2)C	{1: 2, 14: 6}
Did not match all atoms present	581-43-1	C1=CC2=C(C=CC(=C2)O)C=C1O	{21: 2, 14: 6}
Did not match all atoms present	581-45-3	C1CNCCC1C2=CC=NC=C2	{32: 1, 35: 1, 11: 4, 12: 1, 14: 4}
Did not match all atoms present	581-46-4	C1=CC(=CN=C1)C2=CN=CC=C2	{35: 2, 14: 8}
Did not match all atoms present	581-47-5	C1=CC=NC(=C1)C2=CC=NC=C2	{35: 2, 14: 8}
Did not match all atoms present	581-49-7	C1C=CCN[C@@H]1C2=CN=CC=C2	{32: 1, 35: 1, 11: 2, 12: 1, 14: 6}
Did not match all atoms present	581-50-0	C1=CC=NC(=C1)C2=CN=CC=C2	{35: 2, 14: 8}
Did not match all atoms present	581-55-5	CC(=O)OC(C1=CC=CC=C1)OC(=O)C	{1: 2, 3: 1, 28: 2, 14: 5}
Did not match all atoms present	581-64-6	C1=CC2=C(C=C1N)SC3=CC(=[NH2+])C=CC3=N2.[Cl-]	{17: 1, 35: 1, 30: 2, 14: 6, 41: 1}
Did not match all atoms present	581-75-9	C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C=C1S(=O)(=O)O	{20: 2, 29: 4, 14: 6}
Did not match all atoms present	581-89-5	C1=CC=C2C=C(C=CC2=C1)[N+](=O)[O-]	{38: 1, 14: 7}
Did not match all atoms present	581-96-4	C1=CC=C2C=C(C=CC2=C1)CC(=O)O	{2: 1, 27: 1, 14: 7}
Did not match all atoms present	5810-42-4	CCC[N+](CCC)(CCC)CCC.[Cl-]	{1: 4, 2: 8, 17: 1}
Did not match all atoms present	5810-88-8	CCCCC(CC)COP(=S)(OCC(CC)CCCC)S	{1: 4, 2: 10, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	58104-34-0	CC1=CC(=CC=C1)NC2=CC=C(C=C2)C(=C3C=CC(=NC4=CC=CC(=C4)C)C=C3)C5=CC=C(C=C5)NC6=CC=CC(=C6)C	{1: 3, 34: 1, 7: 1, 14: 24, 15: 2, 31: 2}
Did not match all atoms present	58104-38-4	CN(CC1=CC=CC=C1)C2=CC=C(C=C2)NN=C3N=CN=N3	{1: 1, 2: 1, 35: 3, 33: 1, 34: 1, 14: 10, 15: 1, 31: 1}
Did not match all atoms present	58104-46-4	C1=CC(=C(C=C1N(CCO)CCO)Cl)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{33: 1, 2: 4, 38: 1, 34: 2, 14: 6, 17: 2, 20: 2}
Did not match all atoms present	58109-40-3	C1=CC=C(C=C1)[I+]C2=CC=CC=C2.F[P-](F)(F)(F)(F)F	{16: 6, 19: 1, 14: 10}
Did not match all atoms present	5811-87-0	C1=CC2=C(C(=C1)C=O)C(=CC=C2)C(=O)O	{26: 1, 27: 1, 14: 6}
Did not match all atoms present	5811-88-1	C1=CC2=C(C(=C1)C(=O)N)C(=CC=C2)C(=O)O	{24: 1, 27: 1, 30: 1, 14: 6}
Did not match all atoms present	5813-86-5	COC1=CC=CC(=C1)C(=O)N	{24: 1, 1: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	5813-89-8	C1=CSC(=C1)C(=O)N	{24: 1, 41: 1, 30: 1, 14: 3}
Did not match all atoms present	58131-55-8	C1=C(C2=[N+](ON=C2C(=C1)[N+](=O)[O-])[O-])N(CCO)CCO	{33: 2, 2: 4, 35: 1, 38: 1, 14: 2, 20: 2, 23: 1}
Did not match all atoms present	58138-08-2	C1C(O1)(CC(Cl)(Cl)Cl)C2=CC(=CC(=C2)Cl)Cl	{2: 1, 4: 1, 11: 1, 13: 1, 14: 3, 17: 5, 23: 1}
Did not match all atoms present	58139-11-0	C1=CC=C(C(=C1)C(=O)C2=CC(=CC=C2)F)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	58139-32-5	CC(C)C1=CC=CC=C1OC(=O)N(C)N=O	{1: 3, 34: 1, 3: 1, 33: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	58139-33-6	CC1=C(C=C(C=C1)OC(=O)N(C)N=O)C	{1: 3, 34: 1, 33: 1, 14: 3, 28: 1, 29: 1}
Did not match all atoms present	58139-34-7	CC1=CC(=CC(=C1)OC(=O)N(C)N=O)C	{1: 3, 34: 1, 33: 1, 14: 3, 28: 1, 29: 1}
Did not match all atoms present	58139-35-8	CC1=CC(=CC=C1)OC(=O)N(C)N=O	{1: 2, 34: 1, 33: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	58139-48-3	C1COCCN1C2=NC(=NC3=CC=CC=C32)C4=CC=C(S4)[N+](=O)[O-]	{33: 1, 35: 2, 38: 1, 41: 1, 11: 4, 14: 6, 23: 1}
Did not match all atoms present	5814-05-1	C1=CC=C(C(=C1)C(=O)NN)Cl	{24: 1, 17: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	5814-06-2	C1=CC(=C(C=C1Cl)Cl)C(=O)NN	{24: 1, 17: 2, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	5814-20-0	C[As+](C)(C)C.[I-]	{1: 4, 19: 1}
Did not match all atoms present	5814-85-7	CC(CC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 14: 10}
Did not match all atoms present	58144-61-9	C1C(ON=C1C2=CC=CC=C2)P(=O)(O)O	{35: 1, 11: 1, 12: 1, 14: 5, 15: 1, 20: 2, 23: 1, 29: 1}
Did not match all atoms present	58149-59-0	C1=CC=C(C=C1)[Hg]OC(=O)C2=CC=CC=C2O	{28: 1, 21: 1, 14: 9}
Did not match all atoms present	58160-99-9	C(CN)C[Si](O)(O)O	{2: 3, 20: 3, 30: 1}
Did not match all atoms present	58161-93-6	CC(C)(C)C(=O)C(C(=O)NC1=C(C=C(C=C1)Cl)Cl)OC2=CC=C(C=C2)C(=O)O	{1: 3, 3: 1, 4: 1, 14: 7, 17: 2, 22: 1, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	58169-97-4	CN(C(=O)OC1=CC=CC=C1Cl)N=O	{1: 1, 34: 1, 33: 1, 14: 4, 17: 1, 28: 1, 29: 1}
Did not match all atoms present	58169-99-6	CC1=C(C(=C(C(=C1Br)Br)Br)O)Br	{1: 1, 18: 4, 21: 1}
Did not match all atoms present	58176-73-1	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].O.[Tm+3].[Tm+3]	{24: 6}
Did not match all atoms present	5818-06-4	C1=CC(=CC(=C1)O)C(=O)NN	{24: 1, 30: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	5818-17-7	CC[N+](C)(CC)CCOC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13	{1: 3, 2: 4, 12: 1, 14: 8, 23: 1, 28: 1}
Did not match all atoms present	5819-08-9	C(CCl)S(=O)CCCl	{17: 2, 2: 4, 29: 1}
Did not match all atoms present	58195-37-2	C1CC=C(C1)C2=CC=CC3=CC=CC=C32	{11: 3, 14: 8, 15: 1}
Did not match all atoms present	58196-33-1	C1CC2=C(C=C(C=C2)O)NC1	{32: 1, 11: 3, 21: 1, 14: 3}
Did not match all atoms present	58197-53-8	C=CC(=O)[O-].C=CC(=O)[O-].[Co+2]	{24: 2, 5: 2, 6: 2}
Did not match all atoms present	582-08-1	C1=CC=C2C=C(C=CC2=C1)N=NC3=CC4=CC=CC=C4C=C3	{34: 2, 14: 14}
Did not match all atoms present	582-16-1	CC1=CC2=C(C=C1)C=CC(=C2)C	{1: 2, 14: 6}
Did not match all atoms present	582-17-2	C1=CC(=CC2=C1C=CC(=C2)O)O	{21: 2, 14: 6}
Did not match all atoms present	582-22-9	CC(CN)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	582-24-1	C1=CC=C(C=C1)C(=O)CO	{24: 1, 2: 1, 20: 1, 14: 5}
Did not match all atoms present	582-25-2	C1=CC=C(C=C1)C(=O)[O-].[K+]	{24: 1, 14: 5}
Did not match all atoms present	582-33-2	CCOC(=O)C1=CC(=CC=C1)N	{1: 1, 2: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	582-36-5	CC1=C(SC=[N+]1CC2=CN=C(NC2=O)C)CCO.[Cl-]	{32: 1, 1: 2, 2: 3, 35: 1, 33: 1, 41: 1, 14: 2, 17: 1, 20: 1, 25: 1}
Did not match all atoms present	582-38-7	CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.OP(=O)(O)[O-]	{1: 2, 2: 3, 35: 2, 33: 1, 41: 1, 14: 2, 20: 3, 29: 2, 30: 1}
Did not match all atoms present	582-60-5	CC1=CC2=C(C=C1C)N=CN2	{32: 1, 1: 2, 35: 1, 14: 3}
Did not match all atoms present	582-61-6	C1=CC=C(C=C1)C(=O)N=[N+]=[N-]	{24: 1, 34: 2, 14: 5}
Did not match all atoms present	582-62-7	CC(C)CC(=O)C1=CC=CC=C1	{24: 1, 1: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	582-69-4	C1=CC(=CC=C1C(=O)O)N=[N+](C2=CC=C(C=C2)C(=O)O)[O-]	{33: 1, 34: 1, 27: 2, 29: 1, 14: 8}
Did not match all atoms present	582-73-0	C1=CC(=CN=C1)C(=O)CC(=O)C(F)(F)F	{2: 1, 35: 1, 4: 1, 14: 4, 16: 3, 24: 2}
Did not match all atoms present	582-77-4	CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	582-78-5	CC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	582-83-2	CCCC(=O)C1=CC=C(C=C1)F	{16: 1, 1: 1, 2: 2, 14: 4, 24: 1}
Did not match all atoms present	5820-22-4	CC(=C)COC1=CC=CC=C1	{1: 1, 2: 1, 5: 1, 7: 1, 14: 5, 22: 1}
Did not match all atoms present	58200-67-2	C1=C(C=C2C(=C1Cl)OC3=C(O2)C(=C(C(=C3Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 2, 23: 2}
Did not match all atoms present	58201-66-4	C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C(F)(F)Br.[Br-]	{16: 2, 18: 2, 4: 1, 14: 15}
Did not match all atoms present	58206-67-0	[Ar].[Xe]	{}
Did not match all atoms present	58209-98-6	C1=CC=C(C=C1)NC(=O)N2C=C(C(=O)NC2=O)F	{32: 1, 33: 1, 14: 6, 16: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	5821-57-8	C1CC2CC1C3=C2C(=O)C4=CC=CC=C4C3=O	{25: 2, 11: 3, 12: 2, 14: 4, 15: 2}
Did not match all atoms present	58211-66-8	CN(C)C1=CC=CC(=C1N(C)C)C(=O)C2=CC=CC=C2	{24: 1, 1: 4, 14: 8, 33: 2}
Did not match all atoms present	58214-96-3	CC(C)CC(=O)OCCOC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	58215-45-5	COC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)NC3=CC(=C(C4=C3C(=O)C5=CC=CC=C5C4=O)N)S(=O)(=O)[O-].[Na+]	{1: 1, 14: 13, 22: 1, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	5822-69-5	C1=CC(=CC=C1N=NC2=C(N=C(N=C2Cl)N)N)Cl	{17: 2, 34: 2, 35: 2, 30: 2, 14: 4}
Did not match all atoms present	58229-88-2	CCCCCCCC[Sn]CCCCCCCC.[SH-]	{1: 2, 2: 14}
Did not match all atoms present	5823-12-1	CCOC(=O)C(P(=O)(OCC)OCC)(Cl)Cl	{1: 3, 2: 3, 4: 1, 17: 2, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	58237-08-4	CC(C)CC(C)OP(=S)(OC(C)CC(C)C)[S-].[Na+]	{1: 6, 2: 2, 3: 4, 22: 2}
Did not match all atoms present	5824-40-8	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N	{4: 1, 30: 1, 14: 15}
Did not match all atoms present	58240-57-6	CCCCC(CC)COC(=O)NC1=CC=CC(=C1)CN=C=O	{1: 2, 2: 6, 3: 1, 8: 1, 34: 1, 14: 4, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	58243-84-8	CCC1=C(C=C2C(=C1)C(CCC2(C)C)(C)C)CCl	{1: 5, 2: 2, 11: 2, 13: 2, 14: 2, 17: 1}
Did not match all atoms present	58243-85-9	CCC1=CC2=C(C=C1C=O)C(CCC2(C)C)(C)C	{1: 5, 2: 1, 11: 2, 13: 2, 14: 2, 26: 1}
Did not match all atoms present	58243-87-1	CCC1=CC2=C(C=C1C#N)C(CCC2(C)C)(C)C	{1: 5, 2: 1, 37: 1, 11: 2, 13: 2, 14: 2}
Did not match all atoms present	58246-20-1	C(C#CCO)O.[N+](=O)(O)[O-].[N+](=O)(O)[O-]	{2: 2, 20: 4, 10: 2}
Did not match all atoms present	58249-73-3	COC1=C(C=C(C(=C1)[N+](=O)[O-])SSC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)OC	{40: 2, 1: 4, 38: 2, 22: 4, 14: 4}
Did not match all atoms present	5825-79-6	CC1=CC(=CC(=C1Cl)C)OCCO	{1: 2, 2: 2, 14: 2, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	58257-01-5	COC1=C(C=C(C(=C1)[N+](=O)[O-])[Se][Se]C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)OC	{1: 4, 38: 2, 22: 4, 14: 4}
Did not match all atoms present	58258-13-2	CCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCCC[Si](OC)(OC)OC	{1: 7, 2: 4, 5: 3, 6: 1, 7: 2, 22: 3, 28: 3}
Did not match all atoms present	58258-49-4	C[Sn]C.C[Sn]C.C[Sn]C.[Se].[Se].[Se]	{1: 6}
Did not match all atoms present	5826-91-5	CCCC1=CC(=NC(=N1)C)OP(=S)(OCC)OCC	{1: 4, 2: 4, 35: 2, 22: 3, 14: 1}
Did not match all atoms present	5827-03-2	CCN(CC)C(=S)SP(=S)(OC(C)C)OC(C)C	{1: 6, 2: 2, 3: 2, 33: 1, 40: 1, 7: 1, 22: 2}
Did not match all atoms present	5827-05-4	CCS(=O)CSP(=S)(OC(C)C)OC(C)C	{1: 5, 2: 2, 3: 2, 40: 1, 22: 2, 29: 1}
Did not match all atoms present	5827-24-7	CP(=S)(Br)Br	{1: 1, 18: 2}
Did not match all atoms present	5827-58-7	CCCCCCCCCCCC[Sn](CCCCCCCCCCCC)(Cl)Cl	{1: 2, 2: 22, 17: 2}
Did not match all atoms present	58270-08-9	CC(C)(CCC#N)/C=N/OC(=O)NC.[Cl-].[Cl-].[Zn+2]	{1: 3, 2: 2, 4: 1, 37: 1, 6: 1, 34: 1, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	58276-69-0	CC1=CC(=CC=C1)CC[Si](Cl)(Cl)Cl	{1: 1, 2: 2, 14: 4, 17: 3}
Did not match all atoms present	58287-34-6	CC1(CC1)C2=C(C2=O)C3(CC3)C	{1: 2, 11: 4, 13: 2, 25: 1}
Did not match all atoms present	58295-79-7	CC1=C(C(=CC=C1)C)O.CC1=C(C(=C(C=C1)C)O)C	{1: 5, 21: 2, 14: 5}
Did not match all atoms present	583-02-8	CCOC(=O)C1=CC=C(C=C1)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 28: 1}
Did not match all atoms present	583-03-9	CCCCC(C1=CC=CC=C1)O	{1: 1, 2: 3, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	583-04-0	C=CCOC(=O)C1=CC=CC=C1	{2: 1, 14: 5, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	583-05-1	CC(=O)CCC(=O)C1=CC=CC=C1	{24: 2, 1: 1, 2: 2, 14: 5}
Did not match all atoms present	583-06-2	C1=CC=C(C=C1)C(=O)C=CC(=O)O	{24: 1, 27: 1, 14: 5, 6: 2}
Did not match all atoms present	583-11-9	CC(=NNC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 34: 1, 31: 1, 14: 10, 7: 1}
Did not match all atoms present	583-15-3	C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Hg+2]	{24: 2, 14: 10}
Did not match all atoms present	583-19-7	CCOC1=CC=CC=C1Br	{1: 1, 2: 1, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	583-33-5	CCCCOC(=O)C1=CC=CO1	{1: 1, 2: 3, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	583-39-1	C1=CC=C2C(=C1)NC(=S)N2	{32: 2, 14: 4}
Did not match all atoms present	583-46-0	C1=CC=C(C=C1)/C=C/2\C(=O)NC(=S)N2	{32: 2, 25: 1, 14: 5, 6: 1, 15: 2}
Did not match all atoms present	583-47-1	C1=CC=C(C=C1)CC2C(=O)OC(=O)N2	{32: 1, 28: 2, 2: 1, 12: 1, 14: 5}
Did not match all atoms present	583-52-8	C(=O)(C(=O)[O-])[O-].[K+].[K+]	{24: 2}
Did not match all atoms present	583-53-9	C1=CC=C(C(=C1)Br)Br	{18: 2, 14: 4}
Did not match all atoms present	583-55-1	C1=CC=C(C(=C1)Br)I	{18: 1, 19: 1, 14: 4}
Did not match all atoms present	583-58-4	CC1=C(C=NC=C1)C	{1: 2, 35: 1, 14: 3}
Did not match all atoms present	583-61-9	CC1=C(N=CC=C1)C	{1: 2, 35: 1, 14: 3}
Did not match all atoms present	583-68-6	CC1=CC(=C(C=C1)N)Br	{1: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	583-69-7	C1=CC(=C(C=C1O)Br)O	{18: 1, 21: 2, 14: 3}
Did not match all atoms present	583-70-0	CC1=CC(=C(C=C1)Br)C	{1: 2, 18: 1, 14: 3}
Did not match all atoms present	583-71-1	CC1=C(C=C(C=C1)Br)C	{1: 2, 18: 1, 14: 3}
Did not match all atoms present	583-75-5	CC1=C(C=CC(=C1)Br)N	{1: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	583-78-8	C1=CC(=C(C=C1Cl)O)Cl	{17: 2, 21: 1, 14: 3}
Did not match all atoms present	583-80-2	CC1=CC(=O)C(=CC=C1)O	{1: 1, 21: 1, 14: 4, 25: 1}
Did not match all atoms present	58306-30-2	COCC(=O)NC1=C(C=CC(=C1)SC2=CC=CC=C2)N/C(=N\C(=O)OC)/NC(=O)OC	{1: 3, 2: 1, 7: 1, 40: 1, 34: 1, 14: 8, 22: 1, 24: 1, 28: 2, 31: 3}
Did not match all atoms present	58306-86-8	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C=C1N.[Na+]	{30: 1, 29: 3, 14: 6}
Did not match all atoms present	5831-08-3	CC1=CCC2=C1C=CC3=C2C=CC4=C3C=CC(=C4)OC	{1: 2, 11: 1, 22: 1, 14: 8, 15: 1}
Did not match all atoms present	5831-09-4	CC1=CCC2=C3C=CC4=CC=CC=C4C3=CC(=C12)C	{1: 2, 11: 1, 14: 8, 15: 1}
Did not match all atoms present	5831-10-7	CC1=CCC2=C3C=CC4=CC=CC=C4C3=C(C=C12)C	{1: 2, 11: 1, 14: 8, 15: 1}
Did not match all atoms present	5831-11-8	CC1=CCC2=C1C(=C(C3=C2C=CC4=CC=CC=C43)C)C	{1: 3, 11: 1, 14: 7, 15: 1}
Did not match all atoms present	5831-12-9	CC1=CCC2=C3C=CC4=CC=CC=C4C3=C(C=C12)OC	{1: 2, 11: 1, 22: 1, 14: 8, 15: 1}
Did not match all atoms present	5831-16-3	CC1CCC2=C3C=CC4=CC=CC=C4C3=C(C=C12)C	{1: 2, 11: 2, 12: 1, 14: 7}
Did not match all atoms present	5831-17-4	CC1CCC2=C1C(=C(C3=C2C=CC4=CC=CC=C43)C)C	{1: 3, 11: 2, 12: 1, 14: 6}
Did not match all atoms present	5831-43-6	CC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C	{1: 4, 14: 16, 7: 2}
Did not match all atoms present	58313-23-8	CCOC(=O)C1=CC(=CC=C1)I	{1: 1, 2: 1, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	5832-44-0	CC1=C(C=NC=C1)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 3}
Did not match all atoms present	58324-80-4	CCOC(=O)C1=CC=C(C=C1)SCC2=CC=CC=C2	{40: 1, 1: 1, 2: 2, 28: 1, 14: 9}
Did not match all atoms present	5833-47-6	C[Si]1(CCCCO1)C	{1: 2, 11: 4, 23: 1}
Did not match all atoms present	58336-35-9	C1CC2=C3C(=C4C(=C2)C=CC(=O)O4)CCCN3C1	{33: 1, 11: 6, 28: 1, 14: 3}
Did not match all atoms present	58336-37-1	CC1C(C2=C(N1C)C=C3C(=C2)C(=CC(=O)N3)C)(C)C	{32: 1, 1: 5, 33: 1, 12: 1, 13: 1, 14: 3, 25: 1}
Did not match all atoms present	58338-59-3	C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)N	{24: 1, 30: 2, 14: 8, 31: 1}
Did not match all atoms present	5834-16-2	CC1=C(SC=C1)C=O	{1: 1, 26: 1, 14: 2, 41: 1}
Did not match all atoms present	5834-17-3	COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)N	{1: 1, 30: 1, 22: 1, 14: 6, 23: 1}
Did not match all atoms present	5834-25-3	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3O2	{24: 1, 1: 1, 31: 1, 14: 7, 23: 1}
Did not match all atoms present	5834-96-8	COP(=S)(OC)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)Cl	{1: 2, 34: 2, 22: 3, 14: 8, 17: 1}
Did not match all atoms present	58344-21-1	CCCCCCCCCCCCCC(=O)OC(/C=C/C1=CC2=C(C=C1)OCO2)C(C)(C)C	{1: 4, 2: 12, 3: 1, 4: 1, 6: 2, 11: 1, 14: 3, 23: 2, 28: 1}
Did not match all atoms present	58344-24-4	CC(C)(C)C(/C=C/C1=CC2=C(C=C1)OCO2)OC(=O)C3=CC=CS3	{1: 3, 3: 1, 4: 1, 6: 2, 41: 1, 11: 1, 14: 6, 23: 2, 28: 1}
Did not match all atoms present	58344-42-6	CC(C)(C)C(/C=C/C1=CC(=C(C=C1)O)OC)O	{1: 4, 3: 1, 4: 1, 6: 2, 14: 3, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	58349-77-2	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=C[N+](=O)[O-]	{38: 1, 14: 9, 6: 2}
Did not match all atoms present	58350-08-6	C1CN/C(=C/[N+](=O)[O-])/CC2=CC=CC=C21	{32: 1, 6: 1, 38: 1, 11: 3, 14: 4, 15: 1}
Did not match all atoms present	58355-86-5	C(F)(F)(F)S(=O)(=O)/N=S\1/N=S=NS1	{34: 1, 35: 2, 4: 1, 41: 2, 16: 3, 29: 2}
Did not match all atoms present	58356-65-3	CC(=O)O.C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)[N-]3.[Mn+2]	{1: 1, 27: 1, 14: 28, 35: 4}
Did not match all atoms present	58359-53-8	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)Cl	{17: 1, 34: 2, 29: 2, 14: 9}
Did not match all atoms present	5836-10-2	CC(C)OC(=O)C(C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)O	{1: 2, 3: 1, 4: 1, 14: 8, 17: 2, 20: 1, 28: 1}
Did not match all atoms present	5836-29-3	C1CC(C2=CC=CC=C2C1)C3=C(C4=CC=CC=C4OC3=O)O	{28: 1, 11: 3, 12: 1, 21: 1, 14: 8}
Did not match all atoms present	5836-73-7	C1=CC(=C(C=C1N/N=N/C(=S)N)Cl)Cl	{34: 2, 7: 1, 14: 3, 17: 2, 30: 1, 31: 1}
Did not match all atoms present	5836-85-1	COC1=C2C(=C3CCC(=O)C3=C1)C=CC4=CC=CC=C42	{1: 1, 11: 2, 22: 1, 14: 7, 25: 1}
Did not match all atoms present	58368-66-4	CCCC(C)OC=O	{1: 2, 2: 2, 3: 1, 26: 1}
Did not match all atoms present	58368-67-5	CCC(CC)OC=O	{1: 2, 2: 2, 3: 1, 26: 1}
Did not match all atoms present	58370-70-0	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)N=NC7=C(C=C(C=C7)N)N)S(=O)(=O)O)S(=O)(=O)O	{32: 1, 34: 5, 35: 1, 14: 17, 15: 2, 20: 2, 25: 1, 29: 4, 30: 3, 31: 1}
Did not match all atoms present	58377-72-3	CC1=CC(=C(C=C1)C)OP(=O)(OC2=C(C=CC(=C2)C)C)Cl	{1: 4, 29: 1, 22: 2, 14: 6, 17: 1}
Did not match all atoms present	58383-35-0	C1=CC=C(C=C1)C2O[C@@H]([C@H](O2)CO)CO	{20: 2, 2: 2, 12: 3, 14: 5, 23: 2}
Did not match all atoms present	58386-20-2	COC1=CC=C(S1)OC	{1: 2, 22: 2, 14: 2, 41: 1}
Did not match all atoms present	584-08-7	C(=O)([O-])[O-].[K+].[K+]	{24: 1}
Did not match all atoms present	584-09-8	C(=O)([O-])[O-].[Rb+].[Rb+]	{24: 1}
Did not match all atoms present	584-10-1	C(=S)(S)S	{39: 2, 7: 1}
Did not match all atoms present	584-12-3	C1=COC(=C1)Br	{18: 1, 14: 3, 23: 1}
Did not match all atoms present	584-26-9	CC(=O)N1CC(=O)NC1=S	{32: 1, 1: 1, 33: 1, 11: 1, 15: 1, 24: 1, 25: 1}
Did not match all atoms present	584-42-9	C1=CC(=CC(=C1)[N+](=O)[O-])N/N=C/2\C=CC(=O)C(=C2)C(=O)[O-].[Na+]	{34: 1, 38: 1, 14: 7, 15: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	584-45-2	C1=CC=C(C=C1)C=C(C(=O)O)C(=O)O	{27: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	584-48-5	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Br	{18: 1, 38: 2, 14: 3}
Did not match all atoms present	584-49-6	C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])Br	{18: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	584-59-8	[B-](F)(F)(F)F.CCN(CC)C1=CC(=C(C=C1)[N+]#N)OCC	{1: 3, 2: 3, 33: 1, 34: 1, 14: 3, 16: 4, 22: 1}
Did not match all atoms present	584-70-3	CC1=CC=CC=C1NC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	584-84-9	CC1=C(C=C(C=C1)N=C=O)N=C=O	{8: 2, 1: 1, 34: 2, 29: 2, 14: 3}
Did not match all atoms present	584-87-2	C1=CC(=C(C=C1C(=O)O)C=O)O	{26: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	584-90-7	CC1=CC=CC=C1N=NC2=CC=CC=C2C	{1: 2, 34: 2, 14: 8}
Did not match all atoms present	5840-22-2	CC1=C(C=CC(=C1)OC)NC(=O)C2=C(C=C3C(=C2)C=CC4=C3NC5=CC=CC=C45)O	{32: 1, 1: 2, 14: 11, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	5840-40-4	CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCO3)Br	{1: 1, 2: 1, 11: 2, 14: 6, 18: 1, 22: 1, 23: 2, 24: 1, 31: 1}
Did not match all atoms present	5840-41-5	C1=CC=C(C=C1)CC2=CC(=CC=C2)[N+](=O)[O-]	{2: 1, 38: 1, 14: 9}
Did not match all atoms present	5840-81-3	C1COC(=S)N1	{23: 1, 32: 1, 11: 2, 15: 1}
Did not match all atoms present	5840-95-9	CCOC(=O)NCCSP(=S)(OC)OC	{1: 3, 2: 3, 40: 1, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	58414-52-1	COC(=O)CC1=CSC=C1	{1: 1, 2: 1, 28: 1, 14: 3, 41: 1}
Did not match all atoms present	58417-15-5	C1=CC(=CC=C1N=C=O)OC(F)F	{34: 1, 3: 1, 8: 1, 14: 4, 16: 2, 22: 1, 29: 1}
Did not match all atoms present	58426-99-6	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3SC=C4	{41: 1, 14: 10}
Did not match all atoms present	58428-34-5	[SeH].[SbH2]	{}
Did not match all atoms present	58429-99-5	CC1=C(C=C2C=C3C(=CC2=C1)C=CC4=CC=CC=C43)C	{1: 2, 14: 10}
Did not match all atoms present	5843-43-6	C1=CC=C(C=C1)OC(=O)N=C=O	{8: 1, 34: 1, 28: 1, 29: 1, 14: 5}
Did not match all atoms present	5843-82-3	CCCCCCCC[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[Br-]	{1: 2, 2: 8, 3: 1, 11: 4, 12: 3, 14: 5, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	58430-00-5	CC1=C(C2=CC3=C(C=C2C=C1)C4=CC=CC=C4C=C3)C	{1: 2, 14: 10}
Did not match all atoms present	58430-01-6	CC1=C(C=C2C(=C1)C(=C3C=CC4=CC=CC=C4C3=N2)C)C	{1: 3, 35: 1, 14: 8}
Did not match all atoms present	58435-21-5	CCCCCCOC(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 5, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	58436-35-4	C1CC2=C1C=CC3=C2CC3	{11: 4, 14: 2}
Did not match all atoms present	58436-39-8	C=CP	{5: 1, 6: 1}
Did not match all atoms present	58438-03-2	C1=CC=C2C=C(C=CC2=C1)C[C@@H](C(=O)O)N	{27: 1, 2: 1, 3: 1, 30: 1, 14: 7}
Did not match all atoms present	58438-04-3	CC(C)(C)OC(=O)N[C@@H](CC1=CC2=CC=CC=C2C=C1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 7, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	5845-26-1	CN(C)CCN1C(=O)CC(SC2=CC=CC=C21)C3=CC=CC=C3	{1: 2, 2: 2, 33: 2, 41: 1, 11: 1, 12: 1, 14: 9, 25: 1}
Did not match all atoms present	58452-00-9	COC1=C(C=C(C=C1)C(=O)O)OCC2=CC=CC=C2	{1: 1, 2: 1, 27: 1, 22: 2, 14: 8}
Did not match all atoms present	58456-86-3	CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C(C3=CCC=CC3)N)SC1)C(=O)O.O.O	{1: 1, 3: 1, 33: 1, 41: 1, 11: 3, 12: 2, 14: 3, 15: 3, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	58464-45-2	C1COCC[NH2+]1.[I-]	{19: 1, 11: 4, 23: 1}
Did not match all atoms present	58468-55-6	CC1=C(SC=C1)/C=C(\C#N)/C(=O)N	{1: 1, 37: 1, 6: 1, 7: 1, 41: 1, 14: 2, 24: 1, 30: 1}
Did not match all atoms present	5847-52-9	CCCC[Sn](CCCC)(CCCC)OC(=O)CCl	{1: 3, 2: 10, 28: 1, 17: 1}
Did not match all atoms present	5847-55-2	CCCCCCCCCCCCCCCCCC(=O)O[Sn](CCCC)(CCCC)OC(=O)CCCCCCCCCCCCCCCCC	{1: 4, 2: 38, 28: 2}
Did not match all atoms present	5847-57-4	C1=C(C(=CC(=C1Cl)O)Cl)[N+](=O)[O-]	{17: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	5847-59-6	C1=CC(=C(C=C1[N+](=O)[O-])Br)O	{18: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	5847-71-2	C1=CC(=CN=C1)/C=C/C2=CC=C(C=C2)Br	{18: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	5847-73-4	COC1=CC=CC(=C1)/C=C/C2=CC=CC=N2	{1: 1, 22: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	5847-74-5	C1=CC(=CN=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-]	{38: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	58470-10-3	CCCOC1=CC(=C(C(=C1)OCCC)C=O)OCCC	{1: 3, 2: 6, 26: 1, 22: 3, 14: 2}
Did not match all atoms present	58470-12-5	CCCOC1=CC(=C(C(=C1)OCCC)C=NC2=C(C=CC(=C2)[N+](=O)[O-])O)OCCC	{1: 3, 2: 6, 38: 1, 6: 1, 34: 1, 14: 5, 21: 1, 22: 3}
Did not match all atoms present	58471-77-5	CCN1C(=CC=CC(=C(C#N)C#N)C2=CC=CC=C2)SC3=C1C4=CC=CC=C4C=C3	{1: 1, 2: 1, 33: 1, 6: 3, 7: 2, 41: 1, 14: 11, 15: 1, 37: 2}
Did not match all atoms present	58473-41-9	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=CC=C(C=C4)C(=O)O)N	{25: 2, 27: 1, 30: 1, 14: 10, 31: 1}
Did not match all atoms present	58473-78-2	CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C4(CCCCC4)C5=CC=C(C=C5)N(C6=CC=C(C=C6)C)C7=CC=C(C=C7)C	{1: 4, 11: 5, 13: 1, 14: 24, 33: 2}
Did not match all atoms present	58479-51-9	C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)N)N)Cl	{24: 1, 17: 1, 30: 2, 14: 7}
Did not match all atoms present	58479-61-1	CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)Cl	{1: 3, 4: 1, 14: 10, 17: 1}
Did not match all atoms present	5848-64-6	CCCN(CCC)P(N(CCC)CCC)N(CCC)CCC	{1: 6, 2: 12, 33: 3}
Did not match all atoms present	5848-65-7	CCCCN(CCCC)P(N(CCCC)CCCC)N(CCCC)CCCC	{1: 6, 2: 18, 33: 3}
Did not match all atoms present	58485-68-0	CC(COC1=CC=CC=C1Cl)O	{1: 1, 2: 1, 3: 1, 14: 4, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	58494-42-1	CN(C(=O)NC1=CNC(=O)NC1=O)N=O	{32: 2, 1: 1, 34: 1, 33: 1, 14: 1, 24: 1, 25: 2, 29: 1, 31: 1}
Did not match all atoms present	58496-67-6	C/C(=N\N=C(N)N)/C=C.C=CC1=CC=CC=C1.C(C(=O)O)O	{1: 1, 2: 1, 5: 2, 6: 2, 7: 2, 34: 2, 14: 5, 20: 1, 27: 1, 30: 2}
Did not match all atoms present	585-08-0	C1=CC=C2C(=C1)C3C(O3)C4=CC=CC=C42	{12: 2, 14: 8, 23: 1}
Did not match all atoms present	585-32-0	CC(C)(C1=CC=CC=C1)N	{1: 2, 4: 1, 30: 1, 14: 5}
Did not match all atoms present	585-34-2	CC(C)(C)C1=CC(=CC=C1)O	{1: 3, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	585-47-7	C1=CC(=CC(=C1)S(=O)(=O)Cl)S(=O)(=O)Cl	{17: 2, 29: 4, 14: 4}
Did not match all atoms present	585-48-8	CC(C)(C)C1=NC(=CC=C1)C(C)(C)C	{1: 6, 35: 1, 4: 2, 14: 3}
Did not match all atoms present	585-70-6	C1=C(OC(=C1)Br)C(=O)O	{18: 1, 27: 1, 14: 2, 23: 1}
Did not match all atoms present	585-71-7	CC(C1=CC=CC=C1)Br	{1: 1, 18: 1, 3: 1, 14: 5}
Did not match all atoms present	585-74-0	CC1=CC=CC(=C1)C(=O)C	{24: 1, 1: 2, 14: 4}
Did not match all atoms present	585-76-2	C1=CC(=CC(=C1)Br)C(=O)O	{18: 1, 27: 1, 14: 4}
Did not match all atoms present	585-79-5	C1=CC(=CC(=C1)Br)[N+](=O)[O-]	{18: 1, 38: 1, 14: 4}
Did not match all atoms present	585-81-9	CC1=CC(=CC(=C1)C(=O)O)O	{1: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	5850-12-4	C1=CC(=CC=C1N/N=C\2/C=C(C=C(C2=O)C(=O)[O-])N=NC3=CC=C(C=C3)S(=O)(=O)[O-])[N+](=O)[O-].[Na+].[Na+]	{34: 3, 38: 1, 14: 10, 15: 3, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	5850-13-5	C1=CC=C(C=C1)N/N=C\2/C(=O)C=C/C(=N\NC3=CC=C(C=C3)S(=O)(=O)[O-])/C2=O.[Na+]	{25: 2, 34: 2, 29: 3, 14: 11, 31: 2}
Did not match all atoms present	5850-33-9	C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=C(C=CC(=C5)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 13, 15: 2, 17: 3, 22: 1, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	5850-34-0	C1=CC=C2C(=C1)C=CC=C2N/N=C\3/C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=C(C=CC(=C5)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 12, 15: 2, 17: 2, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	5850-35-1	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC(=CC=C4)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O	{34: 3, 38: 1, 14: 11, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	5850-37-3	C1=CC(=CC=C1N/N=C\2/C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 3, 38: 1, 14: 10, 15: 2, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	5850-41-9	CC1=C(C=C(C=C1)[N+](=O)[O-])N=NC2=C(C=C3C=C(/C(=N/NC4=CC=CC=C4)/C(=O)C3=C2N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 3, 38: 1, 14: 10, 15: 2, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	5850-87-3	CC1=C(C=CC(=C1)NN=C2C(=O)C=CC3=CC=CC=C32)S(=O)(=O)[O-].CC1=C(C=CC(=C1)NN=C2C(=O)C=CC3=CC=CC=C32)S(=O)(=O)[O-].[Ba+2]	{1: 2, 34: 2, 14: 18, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	5850-93-1	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=CC=CC4=C3C=CC=C4S(=O)(=O)[O-].[Na+]	{34: 1, 14: 12, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	58502-84-4	CC(C)C1=CC(=C(C=C1)C(C)C)CCl	{1: 4, 2: 1, 3: 2, 14: 3, 17: 1}
Did not match all atoms present	58502-85-5	CC1=C(C=CC(=C1)C(C)C)C(C)C	{1: 5, 3: 2, 14: 3}
Did not match all atoms present	58505-58-1	CO[Si](CCCSC(=N)N)(OC)OC.Cl	{1: 3, 2: 3, 36: 1, 7: 1, 40: 1, 17: 1, 22: 3, 30: 1}
Did not match all atoms present	58505-78-5	C1=C(C=C(C=C1C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 9, 14: 9}
Did not match all atoms present	5851-43-4	CC(C)C1=NC2=CC=CC=C2N1	{32: 1, 1: 2, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	58510-12-6	CCCCCCCCCCCCCS(=O)(=O)Cl	{1: 1, 2: 12, 29: 2, 17: 1}
Did not match all atoms present	58513-59-0	CN1CCN(CC1)CC/C=C\2/C3=CC=CC=C3SC4=C2C=C(C=C4)S(=O)(=O)N(C)C.Cl.Cl	{1: 3, 2: 2, 6: 1, 33: 3, 41: 1, 11: 4, 14: 7, 15: 1, 17: 2, 29: 2}
Did not match all atoms present	5852-45-9	[2H]N([2H])CC	{1: 1, 2: 1, 30: 1}
Did not match all atoms present	5852-92-6	CC1C2=CC(=C(C=C2CCN1C)OC)OC	{1: 4, 33: 1, 11: 2, 12: 1, 14: 2, 22: 2}
Did not match all atoms present	5853-29-2	CC[C@H]1C[NH+]2CCC3=CC(=C(C=C3C2CC1C[C@@H]4C5=CC(=C(C=C5CC[NH2+]4)O)OC)OC)OC.[Cl-].[Cl-]	{1: 4, 2: 2, 11: 6, 12: 4, 14: 4, 17: 2, 21: 1, 22: 3}
Did not match all atoms present	58539-27-8	CCCC1=CC(=C(C=C1)OC)O	{1: 2, 2: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	58546-54-6	C[C@@H]1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4C[C@@]1(C)O)OC)OC)OC)OC)OCO3	{1: 6, 11: 3, 12: 1, 13: 1, 14: 2, 20: 1, 22: 4, 23: 2}
Did not match all atoms present	5855-78-7	C1=C(C(=CC(=C1N)S(=O)(=O)O)Cl)C(=O)O	{14: 2, 17: 1, 20: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	5855-86-7	COC1=CC(=C(C=C1C#N)OC)N	{1: 2, 30: 1, 22: 2, 14: 2, 37: 1}
Did not match all atoms present	5855-98-1	CC1=C(C2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)N)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 35: 1, 41: 1, 14: 5, 20: 2, 29: 4, 30: 1}
Did not match all atoms present	58551-83-0	C1=C(C=C(C(=C1F)C=O)F)F	{16: 3, 26: 1, 14: 2}
Did not match all atoms present	58556-60-8	C1=CC2=C3C(=C1)C(=C4C=NC5=C4C=CC=C5C(=O)O)OC(=O)C3=CC=C2.Cl	{35: 1, 14: 10, 15: 1, 17: 1, 27: 1, 28: 1}
Did not match all atoms present	5856-99-5	CC(C)CC1=CC(=C(C(=C1)CC(C)C)O)CC(C)C	{1: 6, 2: 3, 3: 3, 21: 1, 14: 2}
Did not match all atoms present	58560-28-4	CCOC(=O)CCC(C(=O)OCC)N=C=S	{1: 2, 2: 4, 3: 1, 8: 1, 34: 1, 28: 2}
Did not match all atoms present	58566-08-8	CN1C2=CC=CC=C2SC1=CC3CC4(N(C5=CC=CC=C5S4)C)OC6=C3C=CC=C6OC	{1: 3, 6: 1, 33: 2, 41: 2, 11: 1, 12: 1, 13: 1, 14: 11, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	58566-44-2	C1=CC=C(C=C1)C(=O)N(CCO)CCO	{24: 1, 33: 1, 2: 4, 20: 2, 14: 5}
Did not match all atoms present	58567-80-9	CCCC1=CC=C(C=C1)C(C)(C)C	{1: 4, 2: 2, 4: 1, 14: 4}
Did not match all atoms present	5857-37-4	C1=COC(=C1)[Hg]Cl	{17: 1, 14: 3, 23: 1}
Did not match all atoms present	5857-38-5	C1=COC=C1[Hg]Cl	{17: 1, 14: 3, 23: 1}
Did not match all atoms present	5857-39-6	C1=CSC(=C1)[Hg]Cl	{17: 1, 14: 3, 41: 1}
Did not match all atoms present	5857-94-3	C1=C(C=C(C(=C1Cl)O)N)S(=O)(=O)O	{14: 2, 17: 1, 20: 1, 21: 1, 29: 2, 30: 1}
Did not match all atoms present	58573-87-8	CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)Cl	{24: 1, 1: 1, 2: 6, 14: 8, 17: 1}
Did not match all atoms present	58574-03-1	C1=CC(=CC=C1C2=CC=C(C=C2)O)C(=O)O	{27: 1, 21: 1, 14: 8}
Did not match all atoms present	58577-87-0	C1=CC=C(C=C1)COC[C@@H](CO)N	{2: 3, 3: 1, 14: 5, 20: 1, 22: 1, 30: 1}
Did not match all atoms present	5858-07-1	CC1=CC(=CC2=C1C(=O)CS2)Cl	{1: 1, 41: 1, 11: 1, 14: 2, 17: 1, 25: 1}
Did not match all atoms present	5858-17-3	C1=CC(=C(C=C1S)Cl)Cl	{17: 2, 14: 3, 39: 1}
Did not match all atoms present	5858-18-4	C1=CC(=C(C=C1Cl)S)Cl	{17: 2, 14: 3, 39: 1}
Did not match all atoms present	5858-33-3	C1=CC=C2C(=C1)C=CC=C2NN=C3C4=C(C=C(C=C4)S(=O)(=O)O)C=C(C3=O)S(=O)(=O)O	{34: 1, 14: 11, 15: 2, 20: 2, 25: 1, 29: 4, 31: 1}
Did not match all atoms present	5858-53-7	C1=CC=C2C(=C1)C=CC=C2N/N=C/3\C=CC4=C(C3=O)C=CC=C4S(=O)(=O)[O-].[Na+]	{34: 1, 14: 12, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	5858-58-2	C1=CC2=C(C=C/C(=N/NC3=C(C=CC(=C3)[N+](=O)[O-])O)/C2=O)C(=C1)S(=O)(=O)[O-].[Na+]	{34: 1, 38: 1, 14: 8, 15: 1, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	5858-81-1	CC1=CC(=C(C=C1)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	5858-88-8	C1=CC=C(C(=C1)N/N=C\2/C(=O)C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])Cl.C1=CC=C(C(=C1)N/N=C\2/C(=O)C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])Cl.[Ba+2]	{34: 2, 14: 18, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	58580-55-5	C1C[C@H]([C@H](O[C@@H]1CN)O[C@@H]2[C@H](C[C@H]([C@@H]([C@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)O)N)N)N.[O-]S(=O)(=O)[O-]	{2: 2, 11: 3, 12: 13, 20: 4, 22: 2, 23: 2, 29: 4, 30: 5}
Did not match all atoms present	58581-89-8	CN1CCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl	{1: 1, 2: 1, 35: 1, 33: 2, 11: 5, 12: 1, 14: 8, 17: 1, 25: 1}
Did not match all atoms present	58586-81-5	CCOC1=CC=C(C=C1)C(=O)NN	{1: 1, 2: 1, 14: 4, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	58587-12-5	CC1=CC=C(C=C1)O.C=O.C1=CC(=CC=C1C(=O)O)O	{1: 1, 27: 1, 5: 1, 14: 8, 21: 2}
Did not match all atoms present	5859-00-7	C1=CC=C(C=C1)N/N=C/2\C3=C(C=C(C=C3)S(=O)(=O)[O-])C=C(C2=O)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 9, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	58593-17-2	CCCCOC(=O)C=C.CC1=CC=CC=C1C=C	{1: 2, 2: 3, 5: 2, 6: 2, 14: 4, 28: 1}
Did not match all atoms present	58593-78-5	C1=CC(=C(C=C1S)S)Cl	{17: 1, 14: 3, 39: 2}
Did not match all atoms present	58594-77-7	CC(C(=O)OC)OC1=CC=C(C=C1)OC2=CC=C(C=C2)C(F)(F)F	{1: 2, 3: 1, 4: 1, 14: 8, 16: 3, 22: 2, 28: 1}
Did not match all atoms present	58596-05-7	CS(=O)(=O)N(C1=CC=CC2=C1C=CC(=C2OS(=O)(=O)C)S(=O)(=O)Cl)S(=O)(=O)C	{1: 3, 33: 1, 14: 5, 17: 1, 22: 1, 29: 8}
Did not match all atoms present	58596-06-8	CS(=O)(=O)N(C1=CC=CC2=C1C=CC(=C2OS(=O)(=O)C)S(=O)(=O)[O-])S(=O)(=O)C.[Na+]	{1: 3, 33: 1, 22: 1, 14: 5, 29: 9}
Did not match all atoms present	58596-07-9	C1=CC2=C(C=CC(=C2O)S(=O)(=O)O)C(=C1)N	{30: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	58596-09-1	CC(=O)NC1=CC=CC2=C1C=CC(=C2OC(=O)C)S(=O)(=O)Cl	{1: 2, 14: 5, 17: 1, 24: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	58596-10-4	CC(=O)NC1=CC=CC2=C1C=CC(=C2OC(=O)C)S(=O)(=O)[O-].[Na+]	{1: 2, 14: 5, 24: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	586-06-1	CC(C)NCC(C1=CC(=CC(=C1)O)O)O	{1: 2, 2: 1, 3: 2, 14: 3, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	586-11-8	C1=C(C=C(C=C1[N+](=O)[O-])O)[N+](=O)[O-]	{38: 2, 21: 1, 14: 3}
Did not match all atoms present	586-30-1	CC1=C(C=C(C=C1)C(=O)O)O	{1: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	586-35-6	C1=CC(=C(C=C1C(=O)O)Br)C(=O)O	{18: 1, 27: 2, 14: 3}
Did not match all atoms present	586-37-8	CC(=O)C1=CC(=CC=C1)OC	{24: 1, 1: 2, 22: 1, 14: 4}
Did not match all atoms present	586-38-9	COC1=CC=CC(=C1)C(=O)O	{1: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	586-39-0	C=CC1=CC(=CC=C1)[N+](=O)[O-]	{14: 4, 38: 1, 5: 1, 6: 1}
Did not match all atoms present	586-42-5	CC(=O)C1=CC(=CC=C1)C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4}
Did not match all atoms present	586-61-8	CC(C)C1=CC=C(C=C1)Br	{1: 2, 18: 1, 3: 1, 14: 4}
Did not match all atoms present	586-75-4	C1=CC(=CC=C1C(=O)Cl)Br	{24: 1, 17: 1, 18: 1, 14: 4}
Did not match all atoms present	586-76-5	C1=CC(=CC=C1C(=O)O)Br	{18: 1, 27: 1, 14: 4}
Did not match all atoms present	586-77-6	CN(C)C1=CC=C(C=C1)Br	{1: 2, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	586-78-7	C1=CC(=CC=C1[N+](=O)[O-])Br	{18: 1, 38: 1, 14: 4}
Did not match all atoms present	586-84-5	COCC1=CC=C(O1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 2, 22: 1, 23: 1}
Did not match all atoms present	586-89-0	CC(=O)C1=CC=C(C=C1)C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4}
Did not match all atoms present	586-95-8	C1=CN=CC=C1CO	{2: 1, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	586-96-9	C1=CC=C(C=C1)N=O	{34: 1, 29: 1, 14: 5}
Did not match all atoms present	586-98-1	C1=CC=NC(=C1)CO	{2: 1, 35: 1, 20: 1, 14: 4}
Did not match all atoms present	5860-70-8	C1=CC(=C(N=C1)C(=O)N)C(=O)O	{24: 1, 35: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	58602-66-7	C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])NCC2=CN=C3C(=N2)C(=NC(=N3)N)N.[Na+].[Na+]	{2: 3, 3: 1, 14: 5, 35: 4, 24: 3, 30: 2, 31: 2}
Did not match all atoms present	58605-10-0	COC(=O)C1=CC(=CC(=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3	{1: 1, 2: 2, 28: 1, 22: 2, 14: 13}
Did not match all atoms present	58618-39-6	CCOC(=O)C1=CC=CC2=C1C(=CC=C2)C(=O)OCC	{1: 2, 2: 2, 28: 2, 14: 6}
Did not match all atoms present	5862-77-1	CCOC1=C(C=C(C=C1)N)N	{1: 1, 2: 1, 30: 2, 22: 1, 14: 3}
Did not match all atoms present	5863-35-4	COC1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\[N+](=O)[O-])/C3=CC=C(C=C3)OCCN4CCCC4.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 1, 2: 4, 4: 1, 33: 1, 38: 1, 7: 2, 11: 4, 14: 13, 20: 1, 22: 2, 27: 3}
Did not match all atoms present	5863-51-4	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC(=C(C=C2)/C(=C\3/C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3C)/C5=CC=CC=C5Cl)C.[Na+]	{1: 4, 2: 4, 33: 2, 7: 1, 14: 18, 15: 3, 17: 1, 29: 6}
Did not match all atoms present	5863-53-6	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC(=C(C=C2)C(=C3C=CC(=[N+](C)C)C=C3)C4=CC=C(C=C4)N(C)C)S(=O)(=O)[O-].[Na+]	{1: 5, 2: 2, 33: 3, 7: 1, 14: 15, 15: 2, 29: 6}
Did not match all atoms present	5863-54-7	CN(C)C1=CC(=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(CC4=CC=CC=C4)CC5=CC(=CC=C5)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 2: 2, 33: 3, 7: 1, 14: 20, 15: 2, 20: 2, 29: 4}
Did not match all atoms present	5863-95-6	CC(=O)N(C1CCCCC1)C2=CC=C(C=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 33: 1, 11: 5, 12: 1, 14: 8, 15: 1, 24: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	58632-48-7	CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C	{1: 2, 2: 1, 28: 2, 14: 4, 31: 1}
Did not match all atoms present	58632-95-4	CC(C)(C)OC(=O)ON=C(C#N)C1=CC=CC=C1	{1: 3, 34: 1, 4: 1, 37: 1, 7: 1, 14: 5}
Did not match all atoms present	58636-10-5	CCCCCCCCCCCCCCCCCCCCCC(=O)O[Sn](CCCC)(OC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC	{1: 4, 2: 63, 28: 3}
Did not match all atoms present	58639-86-4	CCOC(=O)C=C.CC(=C)C1=CC=CC=C1.C=CC(=O)O	{1: 2, 2: 1, 5: 3, 6: 2, 7: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	58653-71-7	C1C2C=CC1C3=C2C=CC(=C3)F	{16: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	58657-45-7	CCC1(SC2=CC=CC=C2S1)C	{1: 2, 2: 1, 13: 1, 14: 4, 41: 2}
Did not match all atoms present	58658-24-5	CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC4=CC=CC=C42)N	{1: 1, 35: 1, 14: 11, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	58658-27-8	CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)N	{1: 1, 35: 1, 14: 11, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	58661-94-2	CCN1C(=NC=N1)N	{1: 1, 2: 1, 35: 2, 33: 1, 14: 1, 30: 1}
Did not match all atoms present	58661-95-3	CCCN1C=NC(=N1)N	{1: 1, 2: 2, 35: 2, 33: 1, 14: 1, 30: 1}
Did not match all atoms present	58661-96-4	CCCN1C(=NC=N1)N	{1: 1, 2: 2, 35: 2, 33: 1, 14: 1, 30: 1}
Did not match all atoms present	58661-97-5	CCCN1C=NN=C1N	{1: 1, 2: 2, 35: 2, 33: 1, 14: 1, 30: 1}
Did not match all atoms present	5867-45-8	CC(=O)NC1=CN=CC=C1	{24: 1, 1: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	5867-98-1	CCCCCOS(=O)(=O)OCCCCC	{1: 2, 2: 8, 29: 2, 22: 2}
Did not match all atoms present	58672-61-0	[B-](F)(F)(F)F.CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N	{1: 1, 2: 2, 33: 1, 34: 1, 14: 9, 16: 4}
Did not match all atoms present	58673-43-1	C1C2C=CC1C3=C2C=CC=C3[N+](=O)[O-]	{11: 1, 12: 2, 38: 1, 14: 5}
Did not match all atoms present	5868-05-3	C1=CC(=CN=C1)C(=O)OCC(COC(=O)C2=CN=CC=C2)(COC(=O)C3=CN=CC=C3)COC(=O)C4=CN=CC=C4	{28: 4, 2: 4, 35: 4, 4: 1, 14: 16}
Did not match all atoms present	58682-45-4	CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)Br	{1: 1, 35: 1, 14: 11, 18: 1, 29: 2, 31: 2}
Did not match all atoms present	58683-84-4	COC1=C(C=CC(=C1)N=NC2=CC=CC=C2)[N+](=O)[O-]	{1: 1, 34: 2, 38: 1, 22: 1, 14: 8}
Did not match all atoms present	5869-25-0	C1=CC2=C3C(=C1)C4=C(C3=CC=C2)C=C(C=C4)N	{30: 1, 14: 9}
Did not match all atoms present	5869-30-7	C1=CC=C2C3=C4C(=CC2=C1)C5=CC=CC6=C5C7=C(C=C6)C=CC(=C74)C=C3	{14: 14}
Did not match all atoms present	5869-31-8	C1=CC=C2C=C3C4=C5C(=CC3=CC2=C1)C6=CC=CC7=C6C8=C(C=C7)C=CC(=C85)C=C4	{14: 16}
Did not match all atoms present	58690-45-2	C1C(C(CO1)O[N+](=O)[O-])O[N+](=O)[O-]	{11: 2, 12: 2, 22: 2, 23: 1}
Did not match all atoms present	58698-66-1	CC1=C(C=C(C=C1)N=C=O)N=C=O.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{1: 1, 2: 1, 8: 4, 34: 4, 14: 17, 24: 1, 28: 4, 29: 4}
Did not match all atoms present	587-02-0	CCC1=CC(=CC=C1)N	{1: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	587-03-1	CC1=CC(=CC=C1)CO	{1: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	587-04-2	C1=CC(=CC(=C1)Cl)C=O	{17: 1, 26: 1, 14: 4}
Did not match all atoms present	587-15-5	C1CCC(CC1)OP(=O)(OC2CCCCC2)F	{16: 1, 11: 10, 12: 2, 29: 1, 22: 2}
Did not match all atoms present	587-34-8	CN(C)C(=O)NC1=CC(=CC=C1)Cl	{1: 2, 33: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	587-48-4	CC(=O)NC1=CC=CC(=C1)C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	587-49-5	C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)O	{4: 1, 14: 8, 16: 3, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	587-54-2	C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)O	{24: 1, 27: 1, 14: 9, 31: 1}
Did not match all atoms present	587-61-1	CCCOC(=O)CN1C=C(C(=O)C(=C1)I)I	{1: 1, 2: 3, 33: 1, 14: 2, 19: 2, 25: 1, 28: 1}
Did not match all atoms present	587-63-3	COC1=CC(=O)OC(C1)CCC2=CC=CC=C2	{1: 1, 2: 2, 11: 1, 12: 1, 14: 6, 15: 1, 22: 1, 28: 1}
Did not match all atoms present	587-65-5	C1=CC=C(C=C1)NC(=O)CCl	{24: 1, 17: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	587-84-8	C1=CC=C(C=C1)NC2=CC=CC=C2.OS(=O)(=O)O	{20: 2, 29: 2, 14: 10, 31: 1}
Did not match all atoms present	587-85-9	C1=CC=C(C=C1)[Hg]C2=CC=CC=C2	{14: 10}
Did not match all atoms present	587-90-6	C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 38: 2, 14: 8, 31: 2}
Did not match all atoms present	587-98-4	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-].[Na+]	{34: 2, 29: 3, 14: 13, 31: 1}
Did not match all atoms present	5870-29-1	CN(C)CCOC(=O)C(C1=CC=CC=C1)C2(CCCC2)O.Cl	{1: 2, 2: 2, 3: 1, 33: 1, 11: 4, 13: 1, 14: 5, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	5870-38-2	CCOC(=O)C1=CC(=C(C=C1O)C(=O)OCC)O	{1: 2, 2: 2, 28: 2, 21: 2, 14: 2}
Did not match all atoms present	58705-49-0	COC(=O)SC1=NC2=CC=CC=C2N=C1SC(=O)OC	{40: 2, 1: 2, 35: 2, 28: 2, 14: 4}
Did not match all atoms present	5872-08-2	CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C	{1: 2, 2: 1, 11: 3, 12: 1, 13: 2, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	58720-40-4	CC1=C(C(=C(C=C1)C)CCC(=O)C)C	{24: 1, 1: 4, 2: 2, 14: 2}
Did not match all atoms present	58721-74-7	CC1C(C2=C(N1C)C=C3C(=C2)C(=CC(=O)N3C)C(F)(F)F)(C)C	{1: 5, 4: 1, 33: 2, 12: 1, 13: 1, 14: 3, 16: 3, 25: 1}
Did not match all atoms present	58728-64-6	C1=CC=C2C(=C1)C(=CC=C2N)C#N	{30: 1, 14: 6, 37: 1}
Did not match all atoms present	5873-16-5	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=C(C=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C.[Na+]	{1: 4, 2: 2, 14: 7, 23: 1, 29: 6, 31: 2}
Did not match all atoms present	58743-75-2	CCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 1, 37: 1, 14: 8}
Did not match all atoms present	58743-76-3	CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 2, 37: 1, 14: 8}
Did not match all atoms present	58743-77-4	COC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	58743-78-5	CCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 1, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	58743-79-6	CCC1=CC=C(C=C1)C2=CC=C(C=C2)Br	{1: 1, 2: 1, 18: 1, 14: 8}
Did not match all atoms present	58746-82-0	C1CC2=CC3=CC=CC=C3C=C2C=C1	{11: 2, 14: 8}
Did not match all atoms present	58749-16-9	[Mg+2].[Mg+2].[Br-].[Br-].[Br-].[Br-]	{18: 4}
Did not match all atoms present	58749-17-0	[Mg+2].[Mg+2].[I-].[I-].[I-].[I-]	{19: 4}
Did not match all atoms present	5875-06-9	CCCOC1=C(C=C(C=C1)C(=O)OCCN(CC)CC)N.Cl	{1: 3, 2: 6, 33: 1, 14: 3, 17: 1, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	5875-45-6	CC(C)(C)C1=CC(=C(C=C1)C(C)(C)C)O	{1: 6, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	5876-51-7	C1OC2=C(O1)C=C(C=C2)I	{19: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	58763-27-2	CCCOC1=C(C=C(C=C1Cl)C(=O)CCN2CCCCC2)C.Cl	{1: 2, 2: 4, 33: 1, 11: 5, 14: 2, 17: 2, 22: 1, 24: 1}
Did not match all atoms present	58763-31-8	CCCCOC1=C(C=C(C=C1Cl)C(=O)CCN2CCCCC2)C.Cl	{1: 2, 2: 5, 33: 1, 11: 5, 14: 2, 17: 2, 22: 1, 24: 1}
Did not match all atoms present	58763-69-2	CCC#CC=CCCCCCCO[Si](C)(C)C	{1: 4, 2: 7, 22: 1, 10: 2, 6: 2}
Did not match all atoms present	5877-55-4	CC1=CC=CC=C1N=CC2=CC=CC=C2	{1: 1, 34: 1, 14: 9, 6: 1}
Did not match all atoms present	5877-58-7	CC1=CC(=CC=C1)N=CC2=CC=CC=C2	{1: 1, 34: 1, 14: 9, 6: 1}
Did not match all atoms present	58777-49-4	C1=COC(=C1)C(=O)Br	{24: 1, 18: 1, 14: 3, 23: 1}
Did not match all atoms present	5878-61-5	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCl	{1: 2, 2: 2, 35: 1, 33: 3, 14: 1, 17: 1, 25: 2}
Did not match all atoms present	58780-82-8	CNCC1=CC(=C(C(=C1)OC)OC)OC	{1: 4, 2: 1, 22: 3, 14: 2, 31: 1}
Did not match all atoms present	58790-41-3	[F-].[F-].[F-].[F-].[Mg+2].[Mg+2]	{16: 4}
Did not match all atoms present	58792-64-6	CCCCOC(=O)C(=C)C.CC(=C)C1=CC=CC=C1.C=CC1=CC=CC=C1	{1: 3, 2: 3, 5: 3, 6: 1, 7: 2, 14: 10, 28: 1}
Did not match all atoms present	58794-77-7	C1(=NC(=NN1)[N+](=O)[O-])N	{32: 1, 35: 2, 38: 1, 30: 1}
Did not match all atoms present	588-07-8	CC(=O)NC1=CC(=CC=C1)Cl	{24: 1, 1: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	588-16-9	CC(=O)NC1=CC(=CC=C1)OC	{24: 1, 1: 2, 22: 1, 14: 4, 31: 1}
Did not match all atoms present	588-22-7	C1=CC(=C(C=C1OCC(=O)O)Cl)Cl	{17: 2, 2: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	588-32-9	C1=CC(=CC(=C1)Cl)OCC(=O)O	{17: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	588-42-1	C(CO[N+](=O)[O-])N(CCO[N+](=O)[O-])CCO[N+](=O)[O-].OP(=O)(O)O.OP(=O)(O)O	{33: 1, 2: 6, 20: 6, 29: 2, 22: 3}
Did not match all atoms present	588-46-5	CC(=O)NCC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	588-47-6	CC(C)CNC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	588-52-3	CCOC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCC	{1: 2, 2: 2, 34: 2, 22: 2, 14: 8}
Did not match all atoms present	588-63-6	C1=CC=C(C=C1)OCCCBr	{2: 3, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	588-64-7	C1=CC=C(C=C1)C=NNC2=CC=CC=C2	{34: 1, 14: 10, 6: 1, 31: 1}
Did not match all atoms present	588-67-0	CCCCOCC1=CC=CC=C1	{1: 1, 2: 4, 22: 1, 14: 5}
Did not match all atoms present	588-68-1	C1=CC=C(C=C1)/C=N/N=C/C2=CC=CC=C2	{34: 2, 14: 10, 6: 2}
Did not match all atoms present	588-73-8	C1=CC=C(C=C1)/C=C\Br	{18: 1, 14: 5, 6: 2}
Did not match all atoms present	588-93-2	CCCC1=CC=C(C=C1)Br	{1: 1, 2: 2, 18: 1, 14: 4}
Did not match all atoms present	588-96-5	CCOC1=CC=C(C=C1)Br	{1: 1, 2: 1, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	58802-08-7	C1=C2C(=CC(=C1Cl)Cl)OC3=C(O2)C(=CC(=C3Cl)Cl)Cl	{17: 5, 14: 3, 23: 2}
Did not match all atoms present	58808-59-6	C1=CC(=CC=C1C(=O)C(F)(F)F)C(=O)O	{16: 3, 24: 1, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	58809-90-8	CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CC=CC=C2[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 6: 1, 14: 8, 29: 2, 31: 1}
Did not match all atoms present	58810-48-3	CC1=C(C(=CC=C1)C)N(C2CCOC2=O)C(=O)CCl	{1: 2, 2: 1, 33: 1, 11: 2, 12: 1, 14: 3, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	58812-37-6	CC(=O)O[C@@H]1C[C@@H]([C@@]23CO[C@H](C1([C@@H]2C[C@H]([C@@]4([C@@H]3C(=O)[C@@H]([C@@]5([C@]46[C@H](O6)C[C@H]5C7=COC=C7)C)OC(=O)C)C)O)C)O)O	{1: 5, 11: 4, 12: 9, 13: 5, 14: 3, 20: 3, 23: 3, 25: 1, 28: 2}
Did not match all atoms present	58814-86-1	CCCCCCCCCCCCCCCC(=O)NC1CC(C(NC(=O)C2C(C(CN2C(=O)C(NC(=O)C(NC(=O)C3CC(CN3C(=O)C(NC1=O)C(C)O)O)C(C(C4=CC=C(C=C4)O)O)O)C(C)O)C)O)O)O	{32: 4, 1: 4, 2: 14, 3: 4, 33: 2, 11: 4, 12: 11, 14: 4, 20: 8, 21: 1, 24: 1, 25: 6, 31: 1}
Did not match all atoms present	58816-63-0	C1SCS1=O	{41: 1, 11: 2, 29: 1}
Did not match all atoms present	58817-05-3	CCCCCCCCOC(=O)C1=CC=C(C=C1)N(C)C	{1: 3, 2: 7, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	5882-45-1	CCN(CC)C1=CC=CC=C1.Cl	{1: 2, 2: 2, 33: 1, 14: 5, 17: 1}
Did not match all atoms present	5882-48-4	CN(C)C1=CC=C(C=C1)O.Cl	{1: 2, 33: 1, 21: 1, 14: 4, 17: 1}
Did not match all atoms present	58821-98-0	C[C@@H]1C[C@@]2(C(C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)CO)O)C)O)OC(=O)CC5=CC=CC=C5	{1: 4, 2: 2, 11: 2, 12: 4, 13: 4, 14: 7, 15: 2, 20: 3, 25: 1, 28: 1}
Did not match all atoms present	58823-72-6	CCCCC(CC)C(=O)[O-].CC[NH+](CC)CC	{24: 1, 1: 5, 2: 7, 3: 1}
Did not match all atoms present	58823-88-4	C[N+](C)(C)CC(=O)[O-].OP(=O)(O)O	{24: 1, 1: 3, 2: 1, 20: 3, 29: 1}
Did not match all atoms present	58823-91-9	CN(CC(=O)O)/C(=N/P(=O)(O)[O-])/N.[Na+]	{1: 1, 2: 1, 33: 1, 7: 1, 34: 1, 20: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	58845-80-0	C[C@@H]1[C@H](C[C@]2(CC[C@@](O2)(C)C3CC[C@@](O3)(C)[C@H]4[C@H]([C@H]([C@@H](O4)[C@@H]5[C@H]([C@@H]([C@H]([C@@](O5)(C)O)C)OC)C)OC)C)O[C@@H]1[C@@H](C)[C@@H]6[C@@H]([C@@H]([C@H]([C@@](O6)([C@H](C)C(=O)[O-])O)C)OC)C)OC.[Na+]	{1: 15, 3: 2, 11: 5, 12: 16, 13: 5, 20: 2, 22: 4, 23: 6, 24: 1}
Did not match all atoms present	58849-75-5	CCCCCCCCCCCCCCC(C(=O)OC)S(=O)(=O)O	{1: 2, 2: 13, 3: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	58858-91-6	CC(C[O-])O.[Na+]	{1: 1, 2: 1, 3: 1, 20: 1, 29: 1}
Did not match all atoms present	58858-96-1	CCCCC(CC)C(=O)[O-].C[N+](C)(C)C	{24: 1, 1: 6, 2: 4, 3: 1}
Did not match all atoms present	58863-42-6	CC(C)(C)C1=CC=C(C=C1)C(=S)SC	{40: 1, 1: 4, 4: 1, 14: 4, 7: 1}
Did not match all atoms present	58873-44-2	CC(=C)C1=CC2=CC=CC=C2C3=CC=CC=C31	{1: 1, 5: 1, 14: 9, 7: 1}
Did not match all atoms present	58879-33-7	CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2CCC(=O)O2	{1: 1, 2: 1, 11: 2, 12: 1, 14: 4, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	58879-34-8	CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2CCC(=O)O2	{1: 1, 2: 1, 11: 2, 12: 1, 14: 4, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	5888-51-7	CCC1=CC(=C(C=C1)OC)OC	{1: 3, 2: 1, 22: 2, 14: 3}
Did not match all atoms present	5888-52-8	CCCC1=CC(=C(C=C1)OC)OC	{1: 3, 2: 2, 22: 2, 14: 3}
Did not match all atoms present	5888-61-9	C1=CC=C(C=C1)C[As](CC2=CC=CC=C2)CC3=CC=CC=C3	{2: 3, 14: 15}
Did not match all atoms present	58880-37-8	C1CCC(CC1)(C2=CC=C(C=C2)Cl)C(=O)O	{27: 1, 17: 1, 11: 5, 13: 1, 14: 4}
Did not match all atoms present	58888-46-3	C1CCCNCC1.C1=CC=C2C(=C1)NC(=S)S2	{32: 2, 41: 1, 11: 6, 14: 4}
Did not match all atoms present	58888-49-6	CN(C)C1=CC=CC=C1.OS(=O)(=O)O	{1: 2, 20: 2, 29: 2, 14: 5, 33: 1}
Did not match all atoms present	589-08-2	CNCCC1=CC=CC=C1	{1: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	589-09-3	C=CCNC1=CC=CC=C1	{2: 1, 14: 5, 5: 1, 6: 1, 31: 1}
Did not match all atoms present	589-10-6	C1=CC=C(C=C1)OCCBr	{2: 2, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	589-15-1	C1=CC(=CC=C1CBr)Br	{2: 1, 18: 2, 14: 4}
Did not match all atoms present	589-16-2	CCC1=CC=C(C=C1)N	{1: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	589-17-3	C1=CC(=CC=C1CCl)Br	{17: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	589-18-4	CC1=CC=C(C=C1)CO	{1: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	589-21-9	C1=CC(=CC=C1NN)Br	{18: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	589-29-7	C1=CC(=CC=C1CO)CO	{2: 2, 20: 2, 14: 4}
Did not match all atoms present	589-39-9	CCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 2}
Did not match all atoms present	589-40-2	CCC(C)OC=O	{1: 2, 2: 1, 3: 1, 26: 1}
Did not match all atoms present	589-57-1	CCOP(OCC)Cl	{1: 2, 2: 2, 22: 2, 17: 1}
Did not match all atoms present	589-87-7	C1=CC(=CC=C1Br)I	{18: 1, 19: 1, 14: 4}
Did not match all atoms present	589-93-5	CC1=CN=C(C=C1)C	{1: 2, 35: 1, 14: 3}
Did not match all atoms present	5890-18-6	COC1=C(C=C2C[C@H]3C4=C(C2=C1)C(=C(C=C4CCN3)O)OC)O	{32: 1, 1: 2, 11: 3, 12: 1, 14: 3, 21: 2, 22: 2}
Did not match all atoms present	58901-68-1	C/C=C/C=C.CC(=C)C1=CC=CC=C1.C1CC=CC1	{1: 2, 5: 2, 6: 3, 7: 1, 11: 3, 14: 7}
Did not match all atoms present	58911-02-7	C1CNCC2=C1C3=CC=CC=C3N2.Cl	{32: 2, 17: 1, 11: 3, 14: 4}
Did not match all atoms present	58917-85-4	C1=CC=C(C=C1)C[C@H](CO)NC(=O)OCC2=CC=CC=C2	{2: 3, 3: 1, 14: 10, 20: 1, 28: 1, 31: 1}
Did not match all atoms present	58917-91-2	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4[C@H]6[C@H](O6)[C@@H]([C@H]5O)O)C=C2	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	5892-09-1	C1=CC=C(C=C1)C(=O)O[Bi]=O	{28: 1, 29: 1, 14: 5}
Did not match all atoms present	5892-10-4	C(=O)(O[Bi]=O)O[Bi]=O	{29: 2}
Did not match all atoms present	5892-15-9	CCCC[NH+](CCCC)CCCOC(=O)C1=CC=C(C=C1)N.[Cl-]	{1: 2, 2: 9, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	5892-41-1	CCN(CC)CCNC(C1=CC=CC=C1)C(=O)OCCC(C)C.Cl.Cl	{1: 4, 2: 6, 3: 2, 33: 1, 14: 5, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	5892-47-7	CCC(C)C1=CC(=C(C(=C1)C(C)CC)O)C(C)CC	{1: 6, 2: 3, 3: 3, 21: 1, 14: 2}
Did not match all atoms present	58921-31-6	CCOC(=O)C1=C(C(=C(N1)C)Cl)C	{32: 1, 1: 3, 2: 1, 28: 1, 17: 1}
Did not match all atoms present	5893-61-8	C(=O)[O-].C(=O)[O-].O.O.O.O.[Cu+2]	{26: 2}
Did not match all atoms present	58931-94-5	CC(=O)OC=C.C=CC(=O)[O-].[Na+]	{24: 1, 1: 1, 28: 1, 5: 2, 6: 2}
Did not match all atoms present	58932-13-1	CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 8, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	5894-65-5	CC(C)(C)NC(=O)C1=CC=CC=C1	{24: 1, 1: 3, 4: 1, 14: 5, 31: 1}
Did not match all atoms present	5894-79-1	COC(=O)C(C=O)C1=CC=CC=C1	{1: 1, 26: 1, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	5895-45-4	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Pr+3].[Pr+3]	{24: 3}
Did not match all atoms present	5895-47-6	CC1=C(SC2=C1C(=O)N(C(=N2)SCC3=CC=CC=C3)CC=C)C	{1: 2, 2: 2, 35: 1, 5: 1, 6: 1, 33: 1, 40: 1, 41: 1, 14: 5, 25: 1}
Did not match all atoms present	5895-48-7	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Eu+3].[Eu+3]	{24: 3}
Did not match all atoms present	5895-49-8	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Gd+3].[Gd+3]	{24: 3}
Did not match all atoms present	58953-08-5	CC1=CC(=C(C=C1C2=NN(CC2CS(=O)(=O)[O-])C3=CC4=C(C=C3)C(=O)OC4)Cl)Cl.[Na+]	{1: 1, 2: 1, 35: 1, 33: 1, 11: 2, 12: 1, 14: 5, 15: 1, 17: 2, 28: 1, 29: 3}
Did not match all atoms present	58955-81-0	C1N=C(SCO1)C2=CC=C(C=C2)Cl	{35: 1, 41: 1, 11: 2, 14: 4, 15: 1, 17: 1, 23: 1}
Did not match all atoms present	58955-82-1	CC1=CC=C(C=C1)C2=NCOCS2	{1: 1, 35: 1, 41: 1, 11: 2, 14: 4, 15: 1, 23: 1}
Did not match all atoms present	58955-83-2	COC1=CC=C(C=C1)C2=NCOCS2	{1: 1, 35: 1, 41: 1, 11: 2, 14: 4, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	58955-84-3	C1N=C(SCO1)C2=CC=CC=C2	{35: 1, 41: 1, 11: 2, 14: 5, 15: 1, 23: 1}
Did not match all atoms present	58955-85-4	CC1OCN=C(S1)C2=CC=CC=C2	{1: 1, 35: 1, 41: 1, 11: 1, 12: 1, 14: 5, 15: 1, 23: 1}
Did not match all atoms present	58957-92-9	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=CC=CC=C5C4=O)O)(C(=O)C)O)N)O	{1: 2, 11: 3, 12: 5, 13: 1, 14: 4, 20: 2, 21: 2, 22: 1, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	5896-17-3	C1=CC=C(C=C1)COC2=CC=CC=C2C=O	{2: 1, 26: 1, 22: 1, 14: 9}
Did not match all atoms present	5896-55-9	CCCCCCCCCCCCCCC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{24: 1, 1: 1, 2: 13, 3: 1, 29: 3}
Did not match all atoms present	58965-11-0	CCCCC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{1: 1, 2: 3, 14: 9, 20: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	58965-16-5	CCCCOCC(CS(=O)(=O)[O-])O.[Na+]	{1: 1, 2: 5, 3: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	58965-17-6	CCCCCCOCC(CS(=O)(=O)[O-])O.[Na+]	{1: 1, 2: 7, 3: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	58965-18-7	CCCCC(CC)COCC(CS(=O)(=O)[O-])O.[Na+]	{1: 2, 2: 7, 3: 2, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	58966-08-8	C/C(=C/OC)/C1=CC=CC=C1	{1: 2, 22: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	58966-09-9	C/C(=C\OC)/C1=CC=CC=C1	{1: 2, 22: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	5897-16-5	C1CCC(CC1)NS(=O)(=O)[O-].C1CCC(CC1)NS(=O)(=O)[O-].O.O.[Ca+2]	{11: 10, 12: 2, 29: 6, 31: 2}
Did not match all atoms present	5897-76-7	CCC(C(C1=CC=CC=C1)O)N	{1: 1, 2: 1, 3: 2, 14: 5, 20: 1, 30: 1}
Did not match all atoms present	58970-76-6	CC(C)CC(C(=O)O)NC(=O)C(C(CC1=CC=CC=C1)N)O	{1: 2, 2: 2, 3: 4, 14: 5, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	58971-11-2	C1=CC(=CC(=C1)Br)CCN	{2: 2, 30: 1, 18: 1, 14: 4}
Did not match all atoms present	58972-45-5	C[Si](C)(C)C(=[As](C)(C)C)[Si](C)(C)C	{1: 9, 7: 1}
Did not match all atoms present	58984-40-0	[Ne].[Xe]	{}
Did not match all atoms present	58989-02-9	CCN(C1=CC=C(C=C1)N=NC2=CC=CC=C2)O	{1: 1, 2: 1, 33: 1, 34: 2, 14: 9, 20: 1}
Did not match all atoms present	58989-42-7	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)O)NNC3=CC(=C(C=C3Cl)S(=O)(=O)O)Cl	{36: 1, 14: 6, 15: 5, 17: 2, 20: 2, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	5899-45-6	CC(C)(CO)[C@@H](C(=O)NCCC(=O)[O-])O.CC(C)(CO)[C@@H](C(=O)NCCC(=O)[O-])O.C1(C(=O)NC(=O)N1)NC(=O)N.C1(C(=O)NC(=O)N1)NC(=O)N.[Ca+2]	{32: 4, 1: 4, 2: 6, 3: 2, 4: 2, 12: 2, 20: 4, 24: 6, 25: 4, 30: 2, 31: 4}
Did not match all atoms present	59-00-7	C1=CC2=C(C(=C1)O)NC(=CC2=O)C(=O)O	{32: 1, 25: 1, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	59-02-9	CC1=C(C(=C2CC[C@@](OC2=C1C)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C)O	{1: 8, 2: 9, 3: 3, 11: 2, 13: 1, 21: 1, 23: 1}
Did not match all atoms present	59-05-2	CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O	{1: 1, 2: 3, 3: 1, 33: 1, 14: 5, 35: 4, 24: 1, 27: 2, 30: 2, 31: 1}
Did not match all atoms present	59-06-3	CCOC1=C(C=CC(=C1)NC(=O)C)C(=O)OC	{1: 3, 2: 1, 14: 3, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	59-14-3	C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)Br)CO)O	{32: 1, 33: 1, 2: 1, 11: 1, 12: 3, 14: 1, 18: 1, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	59-26-7	CCN(CC)C(=O)C1=CN=CC=C1	{1: 2, 2: 2, 35: 1, 33: 1, 14: 4, 24: 1}
Did not match all atoms present	59-30-3	C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N	{32: 1, 2: 3, 3: 1, 14: 5, 35: 3, 24: 1, 25: 1, 27: 2, 30: 1, 31: 2}
Did not match all atoms present	59-31-4	C1=CC=C2C(=C1)C=CC(=O)N2	{32: 1, 25: 1, 14: 6}
Did not match all atoms present	59-32-5	CN(C)CCN(CC1=CC=C(C=C1)Cl)C2=CC=CC=N2	{1: 2, 2: 3, 35: 1, 33: 2, 14: 8, 17: 1}
Did not match all atoms present	59-33-6	CN(C)CCN(CC1=CC=C(C=C1)OC)C2=CC=CC=N2.C(=CC(=O)O)C(=O)O	{1: 3, 2: 3, 35: 1, 6: 2, 33: 2, 14: 8, 22: 1, 27: 2}
Did not match all atoms present	59-35-8	CC1=CC(=NC(=N1)C2=CC=C(O2)[N+](=O)[O-])C	{1: 2, 35: 2, 38: 1, 14: 3, 23: 1}
Did not match all atoms present	59-39-2	C1CCN(CC1)CC2COC3=CC=CC=C3O2	{33: 1, 2: 1, 11: 6, 12: 1, 14: 4, 23: 2}
Did not match all atoms present	59-40-5	C1=CC=C2C(=C1)N=CC(=N2)NS(=O)(=O)C3=CC=C(C=C3)N	{30: 1, 35: 2, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	59-42-7	CNC[C@@H](C1=CC(=CC=C1)O)O	{1: 1, 2: 1, 3: 1, 14: 4, 20: 1, 21: 1, 31: 1}
Did not match all atoms present	59-43-8	CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.[Cl-]	{1: 2, 2: 3, 35: 2, 33: 1, 41: 1, 14: 2, 17: 1, 20: 1, 30: 1}
Did not match all atoms present	59-46-1	CCN(CC)CCOC(=O)C1=CC=C(C=C1)N	{1: 2, 2: 4, 33: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	59-47-2	CC1=CC=CC=C1OCC(CO)O	{1: 1, 2: 2, 3: 1, 14: 4, 20: 2, 22: 1}
Did not match all atoms present	59-48-3	C1C2=CC=CC=C2NC1=O	{32: 1, 25: 1, 11: 1, 14: 4}
Did not match all atoms present	59-49-4	C1=CC=C2C(=C1)NC(=O)O2	{32: 1, 28: 1, 14: 4}
Did not match all atoms present	59-50-7	CC1=C(C=CC(=C1)O)Cl	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	59-56-3	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)O)O	{2: 1, 12: 5, 20: 6, 22: 1, 23: 1, 29: 1}
Did not match all atoms present	59-58-5	CCCSSC(=C(C)N(CC1=CN=C(N=C1N)C)C=O)CCO	{1: 3, 2: 5, 35: 2, 33: 1, 7: 2, 40: 2, 14: 1, 20: 1, 26: 1, 30: 1}
Did not match all atoms present	59-61-0	CC(C)NCC(C1=CC(=C(C=C1)Cl)Cl)O	{1: 2, 2: 1, 3: 2, 14: 3, 17: 2, 20: 1, 31: 1}
Did not match all atoms present	59-63-2	CC1=CC(=NO1)C(=O)NNCC2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 14: 6, 23: 1, 24: 1, 31: 2}
Did not match all atoms present	59-66-5	CC(=O)NC1=NN=C(S1)S(=O)(=O)N	{1: 1, 35: 2, 41: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	59-67-6	C1=CC(=CN=C1)C(=O)O	{35: 1, 27: 1, 14: 4}
Did not match all atoms present	59-87-0	C1=C(OC(=C1)[N+](=O)[O-])/C=N/NC(=O)N	{34: 1, 38: 1, 6: 1, 14: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	59-88-1	C1=CC=C(C=C1)NN.Cl	{17: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	59-92-7	C1=CC(=C(C=C1C[C@@H](C(=O)O)N)O)O	{2: 1, 3: 1, 14: 3, 21: 2, 27: 1, 30: 1}
Did not match all atoms present	59-96-1	CC(COC1=CC=CC=C1)N(CCCl)CC2=CC=CC=C2	{1: 1, 2: 4, 3: 1, 33: 1, 14: 10, 17: 1, 22: 1}
Did not match all atoms present	59-97-2	C1CN=C(N1)CC2=CC=CC=C2.Cl	{32: 1, 2: 1, 35: 1, 11: 2, 14: 5, 15: 1, 17: 1}
Did not match all atoms present	59-98-3	C1CN=C(N1)CC2=CC=CC=C2	{32: 1, 2: 1, 35: 1, 11: 2, 14: 5, 15: 1}
Did not match all atoms present	59-99-4	CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C	{1: 5, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	590-28-3	C(#N)[O-].[K+]	{29: 1, 37: 1}
Did not match all atoms present	590-29-4	C(=O)[O-].[K+]	{26: 1}
Did not match all atoms present	590-34-1	C=CC[As](=O)(O)O	{2: 1, 20: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	590-42-1	CC(C)(C)N=C=S	{8: 1, 1: 3, 34: 1, 4: 1}
Did not match all atoms present	590-46-5	C[N+](C)(C)CC(=O)O.[Cl-]	{1: 3, 2: 1, 27: 1, 17: 1}
Did not match all atoms present	590-47-6	C[N+](C)(C)CC(=O)[O-].O	{24: 1, 1: 3, 2: 1}
Did not match all atoms present	590-61-4	CCOP(OCC)OP(=O)(N(C)C)OC	{1: 5, 2: 2, 29: 1, 22: 4, 33: 1}
Did not match all atoms present	590-63-6	CC(C[N+](C)(C)C)OC(=O)N.[Cl-]	{1: 4, 2: 1, 3: 1, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	590-69-2	CCCCNP(=O)(NCCCC)F	{16: 1, 1: 2, 2: 6, 29: 1, 31: 2}
Did not match all atoms present	590-72-7	CCCC[As](=O)(O)O	{1: 1, 2: 3, 20: 2, 29: 1}
Did not match all atoms present	590-94-3	CC(C)C[N+]#[C-]	{1: 2, 2: 1, 3: 1, 34: 1}
Did not match all atoms present	59000-84-9	CCNS(=O)(=O)C1=C(C=C(C(=C1)Cl)N)Cl	{1: 1, 2: 1, 14: 2, 17: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	59010-86-5	CCCSP(=O)(OCC)OC1=CC=C(C=C1)SC2=CC=C(C=C2)Cl	{1: 2, 2: 3, 40: 2, 14: 8, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	59017-64-0	CC(=O)N(C)C1=C(C(=C(C(=C1I)C(=O)NCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NCCO)I)I)C(=O)NC)I	{1: 3, 2: 3, 33: 1, 19: 6, 20: 1, 24: 5, 27: 1, 31: 4}
Did not match all atoms present	59019-84-0	C1=CC=C2C(=C1)N=C3C=C(C=CC3=[N+]2[O-])C#N	{33: 1, 35: 1, 29: 1, 14: 7, 37: 1}
Did not match all atoms present	5902-51-2	CC1=C(C(=O)N(C(=O)N1)C(C)(C)C)Cl	{32: 1, 1: 4, 4: 1, 33: 1, 17: 1, 25: 2}
Did not match all atoms present	5902-52-3	CC(C)(C)C1=CC(=C(C=C1)OP(=S)(N)OC)Cl	{1: 4, 4: 1, 14: 3, 17: 1, 22: 2, 30: 1}
Did not match all atoms present	5902-76-1	C[Hg]OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 1, 22: 1, 17: 5}
Did not match all atoms present	5902-85-2	C1=CC=C2C(=C1)NC(=S)S2.C(CO)N	{32: 1, 2: 2, 41: 1, 14: 4, 20: 1, 30: 1}
Did not match all atoms present	5902-95-4	C[As](=O)([O-])[O-].C[As](=O)([O-])[O-].[Ca+2]	{1: 2, 29: 6}
Did not match all atoms present	5902-97-6	C[As](=O)(O)O.C(CO)N(CCO)CCO	{1: 1, 2: 6, 20: 5, 29: 1, 33: 1}
Did not match all atoms present	59021-03-3	CSCC1=NC=CN=C1	{40: 1, 1: 1, 2: 1, 35: 2, 14: 3}
Did not match all atoms present	59021-05-5	C1=COC(=C1)CSCC2=NC=CN=C2	{40: 1, 2: 2, 35: 2, 14: 6, 23: 1}
Did not match all atoms present	59025-55-7	C1=CC(=C(C=C1F)F)N=C=O	{8: 1, 16: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	59026-31-2	CCCC1(C(=O)NCNC1=O)C2=CC=CC=C2	{32: 2, 1: 1, 2: 2, 11: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	59026-32-3	CCC1(C(=O)NCNC1=O)C2=CC=C(C=C2)C	{32: 2, 1: 2, 2: 1, 11: 1, 13: 1, 14: 4, 25: 2}
Did not match all atoms present	5903-13-9	CN(C1=CC=CC2=CC=CC=C21)C(=O)CF	{1: 1, 2: 1, 33: 1, 14: 7, 16: 1, 24: 1}
Did not match all atoms present	59037-64-8	C1CCCCCC(CCCCC1)N=C=S	{8: 1, 34: 1, 11: 11, 12: 1}
Did not match all atoms present	59049-78-4	CC(C)(C)[Hg]C	{1: 4, 4: 1}
Did not match all atoms present	59049-79-5	CC[Hg]C(C)C	{1: 3, 2: 1, 3: 1}
Did not match all atoms present	59049-80-8	CC[Hg]C(C)(C)C	{1: 4, 2: 1, 4: 1}
Did not match all atoms present	59049-81-9	CC(C)[Hg]C(C)(C)C	{1: 5, 3: 1, 4: 1}
Did not match all atoms present	5905-21-5	C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC3=CC4=C(C=C3)C(=O)/C(=N\NC5=C(C=C(C6=C5C=CC(=C6)S(=O)(=O)[O-])N/N=C\7/C=CC(=O)C(=C7)C(=O)[O-])OCC(=O)[O-])/C(=C4)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 1, 34: 2, 14: 20, 15: 4, 22: 1, 24: 3, 25: 2, 29: 6, 31: 4}
Did not match all atoms present	5905-22-6	C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N)C(=O)NC3=CC4=C(C=C3)C(=O)/C(=N\NC5=CC=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])/C(=C4)S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 20, 15: 2, 24: 2, 25: 1, 29: 6, 30: 1, 31: 3}
Did not match all atoms present	5905-48-6	CC[CH2-].CC[CH2-].[Cd+2]	{1: 2, 2: 2, 5: 2}
Did not match all atoms present	5905-52-2	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Fe+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	5906-73-0	CC[Si](C)(C)O	{1: 3, 2: 1, 20: 1}
Did not match all atoms present	5906-76-3	C[SiH](C)O	{1: 2, 20: 1}
Did not match all atoms present	5906-94-5	CC(=C)C(=O)OCC(CS(=O)(=O)[O-])O.[Na+]	{1: 1, 2: 2, 3: 1, 5: 1, 7: 1, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	5907-38-0	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)[O-].O.[Na+]	{1: 3, 2: 1, 33: 3, 14: 5, 25: 1, 29: 3}
Did not match all atoms present	59071-10-2	CCN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 7, 5: 1, 6: 1, 33: 1, 16: 15, 28: 1, 29: 2}
Did not match all atoms present	5908-41-8	C[Si](C)(C)C(=O)C1=CC=CC=C1	{24: 1, 1: 3, 14: 5}
Did not match all atoms present	5908-64-5	CC(=O)[O-].CC(=O)[O-].O.[Ba+2]	{24: 2, 1: 2}
Did not match all atoms present	5908-77-0	CCC(=O)[O-].CCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	5908-81-6	C(C(C(=O)[O-])O)(C(=O)[O-])O.[Ba+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	5908-82-7	C(#N)[S-].C(#N)[S-].O.O.[Ba+2]	{37: 2}
Did not match all atoms present	59080-32-9	C1=CC=C(C=C1)C2=C(C=CC=C2Br)Br	{18: 2, 14: 8}
Did not match all atoms present	59080-40-9	C1=C(C(=CC(=C1Br)Br)Br)C2=CC(=C(C=C2Br)Br)Br	{18: 6, 14: 4}
Did not match all atoms present	5909-25-1	CCOC(=O)C1=CN=C(N=C1SC)SC	{1: 3, 2: 1, 35: 2, 40: 2, 14: 1, 28: 1}
Did not match all atoms present	591-08-2	CC(=O)NC(=S)N	{24: 1, 1: 1, 31: 1, 30: 1, 7: 1}
Did not match all atoms present	591-09-3	CC(=O)O[N+](=O)[O-]	{1: 1, 28: 1}
Did not match all atoms present	591-17-3	CC1=CC(=CC=C1)Br	{1: 1, 18: 1, 14: 4}
Did not match all atoms present	591-18-4	C1=CC(=CC(=C1)I)Br	{18: 1, 19: 1, 14: 4}
Did not match all atoms present	591-19-5	C1=CC(=CC(=C1)Br)N	{18: 1, 30: 1, 14: 4}
Did not match all atoms present	591-20-8	C1=CC(=CC(=C1)Br)O	{18: 1, 21: 1, 14: 4}
Did not match all atoms present	591-22-0	CC1=CC(=CN=C1)C	{1: 2, 35: 1, 14: 3}
Did not match all atoms present	591-27-5	C1=CC(=CC(=C1)O)N	{30: 1, 21: 1, 14: 4}
Did not match all atoms present	591-28-6	C1=CNC(=O)NC1=S	{32: 2, 25: 1, 14: 2}
Did not match all atoms present	591-31-1	COC1=CC=CC(=C1)C=O	{1: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	591-33-3	CCOC1=CC=CC(=C1)NC(=O)C	{1: 2, 2: 1, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	591-35-5	C1=C(C=C(C=C1Cl)Cl)O	{17: 2, 21: 1, 14: 3}
Did not match all atoms present	591-50-4	C1=CC=C(C=C1)I	{19: 1, 14: 5}
Did not match all atoms present	591-51-5	[Li+].C1=CC=[C-]C=C1	{14: 5}
Did not match all atoms present	591-54-8	C1=CN=CN=C1N	{35: 2, 30: 1, 14: 3}
Did not match all atoms present	591-64-0	CC(=O)CCC(=O)[O-].CC(=O)CCC(=O)[O-].[Ca+2]	{24: 4, 1: 2, 2: 4}
Did not match all atoms present	591-65-1	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	591-82-2	CC(C)CN=C=S	{8: 1, 1: 2, 2: 1, 3: 1, 34: 1}
Did not match all atoms present	591-89-9	C(#N)[Hg-2](C#N)(C#N)C#N.[K+].[K+]	{37: 4}
Did not match all atoms present	5910-19-0	CNC1=C(C=CC=C1[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 3, 31: 1}
Did not match all atoms present	5910-25-8	CC(=O)C(C1=CC=CC=C1)C(=O)C	{24: 2, 1: 2, 3: 1, 14: 5}
Did not match all atoms present	5910-32-7	C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)F)/C=C(/C#N)\C(=O)NC4=CC=C(C=C4)Cl	{33: 1, 2: 1, 37: 1, 6: 1, 7: 1, 14: 13, 16: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	5910-89-4	CC1=NC=CN=C1C	{1: 2, 35: 2, 14: 2}
Did not match all atoms present	59118-77-3	CC(=O)OCCS[Sn](C)(SCCOC(=O)C)SCCOC(=O)C	{40: 3, 1: 4, 2: 6, 28: 3}
Did not match all atoms present	59118-81-9	CCCCCCCC[Sn](CCCCCCCC)(SCCOC(=O)CCCCCCC)SCCOC(=O)CCCCCCC	{40: 2, 1: 4, 2: 30, 28: 2}
Did not match all atoms present	59125-49-4	CCCCCCCC/C=C\CCCCCCCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 15, 22: 1, 6: 2, 29: 3}
Did not match all atoms present	59128-97-1	C1COC2(N1CC(=O)NC3=C2C=C(C=C3)Br)C4=CC=CC=C4F	{32: 1, 33: 1, 11: 3, 13: 1, 14: 7, 16: 1, 18: 1, 23: 1, 25: 1}
Did not match all atoms present	5913-06-4	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]	{24: 2, 38: 2, 14: 8}
Did not match all atoms present	5913-76-8	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.O.O.O.OP(=O)(O)O.OP(=O)(O)O	{1: 4, 33: 2, 11: 6, 12: 8, 13: 2, 14: 8, 20: 8, 22: 2, 23: 2, 29: 2}
Did not match all atoms present	5913-82-6	CC1=CC(=CC=C1)CN2CCN(CC2)CC3=C(C=CC(=C3)OC)OC	{1: 3, 2: 2, 33: 2, 11: 4, 14: 7, 22: 2}
Did not match all atoms present	5913-85-9	COC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SCC(=O)OC)N)C#N	{1: 2, 2: 1, 35: 1, 37: 2, 40: 1, 14: 4, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	59133-39-0	CC1=C(C(=C(N1)C2=CC=CC=C2)[NH3+])C(=O)C.[Cl-]	{24: 1, 1: 2, 32: 1, 14: 5, 17: 1}
Did not match all atoms present	59138-84-0	C[N+](C)(C)C.C(=O)[O-]	{1: 4, 26: 1}
Did not match all atoms present	59146-96-2	CC1=C(C(=C(C=C1)[N+](=O)[O-])N)C	{1: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	5915-41-3	CCNC1=NC(=NC(=N1)Cl)NC(C)(C)C	{1: 4, 2: 1, 35: 3, 4: 1, 17: 1, 31: 2}
Did not match all atoms present	59150-16-2	CCN(CC)P(CC)OCC	{1: 4, 2: 4, 22: 1, 33: 1}
Did not match all atoms present	5916-22-3	CC(C1CC2CCC1C2)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC	{1: 4, 3: 1, 11: 4, 12: 3, 14: 2, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	59160-15-5	N1=S=N/S(=N/S(=O)(=O)F)/S1	{16: 1, 41: 2, 34: 1, 35: 2, 29: 2}
Did not match all atoms present	59160-29-1	CC1=C(C(=CC=C1)C)NC(=O)CN(CC(=O)O)CC(=O)O	{1: 2, 2: 3, 33: 1, 14: 3, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	59163-55-2	C[Si](C)(C)CC1=CC=C(C=C1)SC	{40: 1, 1: 4, 2: 1, 14: 4}
Did not match all atoms present	59163-56-3	CSC1=CC=C(C=C1)[Ge](C)(C)C	{40: 1, 1: 4, 14: 4}
Did not match all atoms present	59163-57-4	CSC1=CC=C(C=C1)[Pb](C)(C)C	{40: 1, 1: 4, 14: 4}
Did not match all atoms present	59163-58-5	CSC1=CC=C(C=C1)C[Sn](C)(C)C	{40: 1, 1: 4, 2: 1, 14: 4}
Did not match all atoms present	59163-59-6	C[Sn](C)(C)CSC1=CC=CC=C1	{40: 1, 1: 3, 2: 1, 14: 5}
Did not match all atoms present	59169-69-6	CN(C(=O)C1=CC=CC=C1N)N	{24: 1, 1: 1, 30: 2, 14: 4, 33: 1}
Did not match all atoms present	59169-70-9	CN(C(=O)C1=C(C=CC(=C1)Cl)N)N	{1: 1, 33: 1, 14: 3, 17: 1, 24: 1, 30: 2}
Did not match all atoms present	59178-29-9	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Sn+2].[Sn+2].[Sn+2]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	59178-46-0	OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O.[Cr+3].[Cr+3]	{20: 9, 29: 3}
Did not match all atoms present	59182-63-7	CC(CC1CCCCC1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3.Cl	{1: 1, 2: 3, 3: 2, 11: 5, 12: 1, 14: 10, 17: 1, 31: 1}
Did not match all atoms present	59185-95-4	CCCCCCCC[Sn](CCCCCCCC)(SCCC(=O)OCC(CC)CCCC)SCCC(=O)OCC(CC)CCCC	{40: 2, 1: 6, 2: 28, 3: 2, 28: 2}
Did not match all atoms present	59189-51-4	C1=CC=C(C=C1)C(=O)C2=C(C=CC=C2F)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	5919-26-6	C1=CNC(=C1)[N+](=O)[O-]	{32: 1, 38: 1, 14: 3}
Did not match all atoms present	59190-61-3	CC(=O)OC1=CC(=C(C(=C1)Cl)Cl)Cl	{1: 1, 28: 1, 14: 2, 17: 3}
Did not match all atoms present	59191-99-0	CC(C)(C)C(=O)CC(=O)NC1=C(C=CC(=C1)N)Cl	{1: 3, 2: 1, 4: 1, 14: 3, 17: 1, 24: 2, 30: 1, 31: 1}
Did not match all atoms present	59192-05-1	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=C(C=CC(=C3)Cl)Cl)O	{24: 1, 17: 2, 21: 1, 14: 9, 31: 1}
Did not match all atoms present	592-01-8	[C-]#N.[C-]#N.[Ca+2]	{}
Did not match all atoms present	592-04-1	C(#N)[Hg]C#N	{37: 2}
Did not match all atoms present	592-05-2	C(#N)[Pb]C#N	{37: 2}
Did not match all atoms present	592-09-6	C(C[Si](Cl)(Cl)Cl)C(F)(F)F	{16: 3, 17: 3, 2: 2, 4: 1}
Did not match all atoms present	592-82-5	CCCCN=C=S	{8: 1, 1: 1, 2: 3, 34: 1}
Did not match all atoms present	592-84-7	CCCCOC=O	{1: 1, 2: 3, 26: 1}
Did not match all atoms present	592-87-0	C(#N)S[Pb]SC#N	{40: 2, 37: 2}
Did not match all atoms present	592-89-2	C(=O)[O-].C(=O)[O-].[Sr+2]	{26: 2}
Did not match all atoms present	59201-33-1	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC=C4C5=CC=C6C7=C(C=CC(=C57)C8=C4C3=C2C=C8)C9=C(C6=O)C=C(C=C9)[N+](=O)[O-]	{25: 2, 38: 2, 14: 14}
Did not match all atoms present	59201-36-4	[Br-].[Br-].[Ru+2]	{18: 2}
Did not match all atoms present	59209-40-4	CCCN(C(=O)C(NC(=O)C1=CC=CC=C1)CCC(=O)OCCCN2CCN(CC2)CCOC(=O)CC3=C(N(C4=C3C=C(C=C4)OC)C(=O)C5=CC=C(C=C5)Cl)C)CCC.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O	{1: 4, 2: 12, 3: 1, 6: 4, 33: 4, 11: 4, 14: 12, 17: 1, 22: 1, 24: 3, 27: 4, 28: 2, 31: 1}
Did not match all atoms present	59216-97-6	[Li+].[Li+].[Li+].[I-].[I-].[I-]	{19: 3}
Did not match all atoms present	5922-60-1	C1=CC(=C(C=C1Cl)C#N)N	{17: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	5922-92-9	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[Cl-]	{1: 4, 2: 20, 17: 1}
Did not match all atoms present	59223-29-9	CC1=CC(=C(C=C1Cl)S(=O)(=O)O)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)O)C=CC2=N	{1: 1, 36: 1, 14: 6, 15: 5, 17: 1, 20: 2, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	59229-75-3	CC1=C(C=C(C=C1N)[N+](=O)[O-])N	{1: 1, 38: 1, 30: 2, 14: 2}
Did not match all atoms present	5923-02-4	CC(C)C(C#CC1=CC=CC=C1)O	{1: 2, 10: 2, 3: 2, 20: 1, 14: 5}
Did not match all atoms present	59230-57-8	CC(C)C1=CC=C(C=C1)COC(=O)C	{1: 3, 2: 1, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	59230-81-8	CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C14)CBr	{1: 1, 2: 1, 18: 1, 14: 10}
Did not match all atoms present	5924-63-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O	{24: 1, 25: 2, 14: 16, 31: 1}
Did not match all atoms present	59254-87-4	CC1=CC=CC=C1C=C.C=CC1=CC=CC=C1.C=CC(=O)O	{1: 1, 14: 9, 27: 1, 5: 3, 6: 3}
Did not match all atoms present	59255-95-7	C1=CC(=C(C(=C1)Br)N)[N+](=O)[O-]	{18: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	5926-26-1	CO[Si](CCl)(OC)OC	{1: 3, 2: 1, 22: 3, 17: 1}
Did not match all atoms present	5926-35-2	C[Si](C)(C)C([Si](C)(C)C)Cl	{1: 6, 3: 1, 17: 1}
Did not match all atoms present	5926-38-5	C[Si](C)(C)C(Cl)Cl	{1: 3, 3: 1, 17: 2}
Did not match all atoms present	59261-10-8	CCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)CCC3=CC=C(C=C3)N=CC4=CC=C(C=C4)OCCCC	{1: 2, 34: 2, 6: 2, 2: 8, 14: 16, 22: 2}
Did not match all atoms present	5927-18-4	COC(=O)CP(=O)(OC)OC	{1: 3, 2: 1, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	59276-37-8	COC1=CC(=CC(=C1OC)OC)C(OC)OC	{1: 5, 3: 1, 22: 5, 14: 2}
Did not match all atoms present	59277-89-3	C1=NC2=C(N1COCCO)NC(=NC2=O)N	{32: 1, 33: 1, 2: 3, 35: 2, 14: 1, 20: 1, 22: 1, 25: 1, 30: 1}
Did not match all atoms present	5928-48-3	CC1=C(SC(=C1)C=O)C	{1: 2, 26: 1, 14: 1, 41: 1}
Did not match all atoms present	5928-51-8	C1=CSC(=C1)CCC(=O)O	{41: 1, 2: 2, 27: 1, 14: 3}
Did not match all atoms present	5928-69-8	C1COCCN1CCOC(C2=CC=CC=C2)C3=CC=CC=C3.Cl	{33: 1, 2: 2, 3: 1, 11: 4, 14: 10, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	59280-16-9	CCC[Si](CCC)(CCC)OC1=CC=CC=C1C	{1: 4, 2: 6, 22: 1, 14: 4}
Did not match all atoms present	59280-70-5	CC(=O)NC1=C(C=C(C=C1)Cl)F	{1: 1, 14: 3, 16: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	59283-76-0	CC1=C(C=C(C=C1NO)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 20: 1, 38: 2, 14: 2, 31: 1}
Did not match all atoms present	59290-34-5	C1=CC(=NC=C1[N+](=O)[O-])C(=O)N	{24: 1, 38: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	59291-65-5	C1=C(C=C(C(=C1Cl)Cl)Cl)C2=C(C=C(C=C2Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	59293-67-3	C1=CC(=C(C=C1Cl)Cl)CS	{17: 2, 2: 1, 14: 3, 39: 1}
Did not match all atoms present	593-04-4	B(F)(F)F.CCCCOCCCC	{16: 3, 1: 2, 2: 6, 22: 1}
Did not match all atoms present	593-26-0	CCCCCCCCCCCCCCCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 14}
Did not match all atoms present	593-29-3	CCCCCCCCCCCCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 16}
Did not match all atoms present	593-54-4	CP	{1: 1}
Did not match all atoms present	593-59-9	CC[As]	{1: 1, 2: 1}
Did not match all atoms present	593-68-0	CCP	{1: 1, 2: 1}
Did not match all atoms present	593-74-8	C[Hg]C	{1: 2}
Did not match all atoms present	593-75-9	C[N+]#[C-]	{1: 1, 34: 1}
Did not match all atoms present	593-79-3	C[Se]C	{1: 2}
Did not match all atoms present	593-80-6	C[Te]C	{1: 2}
Did not match all atoms present	593-88-4	C[As](C)C	{1: 3}
Did not match all atoms present	593-89-5	C[As](Cl)Cl	{1: 1, 17: 2}
Did not match all atoms present	593-90-8	B(C)(C)C	{1: 3}
Did not match all atoms present	593-91-9	C[Bi](C)C	{1: 3}
Did not match all atoms present	5930-28-9	C1=C(C=C(C(=C1Cl)O)Cl)N	{17: 2, 30: 1, 21: 1, 14: 2}
Did not match all atoms present	5930-71-2	COP(=S)(OC)SSP(=S)(OC)OC	{40: 2, 1: 4, 22: 4}
Did not match all atoms present	5930-98-3	CC(=O)C#C[Si](C)(C)C	{24: 1, 1: 4, 10: 2}
Did not match all atoms present	59303-05-8	CC1=CC=C(O1)CS	{1: 1, 2: 1, 39: 1, 14: 2, 23: 1}
Did not match all atoms present	59303-07-0	CC1=NC=CN=C1SCC2=CC=CO2	{1: 1, 2: 1, 35: 2, 40: 1, 14: 5, 23: 1}
Did not match all atoms present	59303-09-2	CC1=CN=CC(=N1)SCC2=CC=CO2	{1: 1, 2: 1, 35: 2, 40: 1, 14: 5, 23: 1}
Did not match all atoms present	59305-32-7	C[Si](C)(C)CC1=CC(=CC(=C1)C[Si](C)(C)C)C[Si](C)(C)C	{1: 9, 2: 3, 14: 3}
Did not match all atoms present	59313-55-2	O[Si]=O	{20: 1, 29: 1}
Did not match all atoms present	5932-30-9	CCOC(=O)C1=CC(=NN1)C2=CC=CC=C2	{32: 1, 1: 1, 2: 1, 35: 1, 14: 6, 28: 1}
Did not match all atoms present	5932-68-3	C/C=C/c1ccc(O)c(OC)c1	{1: 2, 22: 1, 14: 3, 6: 2, 21: 1}
Did not match all atoms present	5933-32-4	C1=CC(=CC=C1C(=O)NN)Br	{24: 1, 18: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	5933-35-7	C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC=C2[N+](=O)[O-]	{27: 1, 38: 1, 14: 8, 31: 1}
Did not match all atoms present	5933-40-4	C[C@H](C1=CC=CC=C1)NC	{1: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	59330-98-2	C1CCC(CC1)C2=C(C(=CC=C2)Cl)Cl	{17: 2, 11: 5, 12: 1, 14: 3}
Did not match all atoms present	59333-90-3	CC(C)NCC(COC1=CC=CC=C1C2CCCCC2)O.Cl	{1: 2, 2: 2, 3: 2, 11: 5, 12: 1, 14: 4, 17: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	59337-89-2	C1=CSC(=C1Cl)C(=O)O	{17: 1, 27: 1, 14: 2, 41: 1}
Did not match all atoms present	59337-93-8	COC(=O)C1=C(C=CS1)S(=O)(=O)N	{1: 1, 41: 1, 14: 2, 28: 1, 29: 2, 30: 1}
Did not match all atoms present	5934-20-3	CN(C)CCN1C2=CC=CC=C2SC3=CC=CC=C31.Cl	{1: 2, 2: 2, 33: 2, 41: 1, 14: 8, 17: 1}
Did not match all atoms present	5934-69-0	C1C2CC3CC1CC(C2)(C3)/C(=C/[N+]#N)/[O-]	{34: 1, 6: 1, 7: 1, 11: 6, 12: 3, 13: 1}
Did not match all atoms present	59344-32-0	CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)Cl)C	{1: 2, 11: 2, 13: 1, 14: 5, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	59352-90-8	CC1=C(C=C(C(=N1)N)N)Br	{1: 1, 18: 1, 35: 1, 30: 2, 14: 1}
Did not match all atoms present	59358-70-2	C1CCC(C1)(C2=CC=CC=C2)C3(CCCC3)C4=CC=CC=C4	{11: 8, 13: 2, 14: 10}
Did not match all atoms present	59358-71-3	C1CCC(CC1)(C2=CC=CC=C2)C3(CCCCC3)C4=CC=CC=C4	{11: 10, 13: 2, 14: 10}
Did not match all atoms present	59358-73-5	C1CCCC(CCC1)(C2=CC=CC=C2)C3(CCCCCCC3)C4=CC=CC=C4	{11: 14, 13: 2, 14: 10}
Did not match all atoms present	5936-28-7	CN1CCC2=CC3=C(C=C2[C@@H]1[C@@H]4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3.Cl	{1: 3, 33: 1, 11: 3, 12: 2, 14: 4, 17: 1, 22: 2, 23: 2, 28: 1}
Did not match all atoms present	59373-54-5	COC1=CC2=C(C=C1)OC3=CC=C4C5=C(C=CC2=C35)C(=O)N(C4=O)CCS(=O)(=O)O	{1: 1, 2: 2, 33: 1, 14: 7, 20: 1, 22: 1, 23: 1, 25: 2, 29: 2}
Did not match all atoms present	59376-64-6	C[Si](C)(C)/C=C/CO	{1: 3, 2: 1, 20: 1, 6: 2}
Did not match all atoms present	59377-19-4	C1=CC=C(C=C1)OC2=CC=C(C=C2)N=C=O	{8: 1, 34: 1, 22: 1, 14: 9, 29: 1}
Did not match all atoms present	59377-20-7	C1=CC=C(C=C1)OC2=CC=CC=C2N=C=O	{8: 1, 34: 1, 22: 1, 14: 9, 29: 1}
Did not match all atoms present	5938-85-2	C1=CC(=CC=C1C(=O)NC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])N.[Na+].[Na+]	{34: 3, 14: 16, 15: 2, 24: 1, 25: 1, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	59382-51-3	CC(C)(C)CC(C)(C)OOC(=O)COC1=CC=CC=C1	{1: 5, 2: 2, 4: 2, 14: 5, 22: 2, 28: 1}
Did not match all atoms present	59388-58-8	CC1CC(NC2=C1C=CC(=C2)C)(C)C	{32: 1, 1: 4, 11: 1, 12: 1, 13: 1, 14: 3}
Did not match all atoms present	5939-37-7	CN(CC1=NC2=C(NC1=O)N=C(N=C2N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O	{32: 1, 1: 1, 2: 3, 3: 1, 33: 1, 14: 4, 35: 3, 24: 1, 25: 1, 27: 2, 30: 2, 31: 1}
Did not match all atoms present	59392-53-9	C[C@@H](CC=C)[C@H](C)C[C@H]([C@@H]([C@@H]1CC[C@@]2([C@@H](O1)C[C@@H]3[C@@](O2)(C[C@@]4([C@@H](O3)C[C@@H]5[C@@H](O4)/C=C\C[C@@H]6[C@@H](O5)C[C@@]7([C@@H](O6)C[C@@H]8[C@@](O7)(CC[C@@]9([C@@H](O8)C[C@@]1([C@@H](O9)C[C@H]([C@](O1)(C)[C@H]1C[C@@H]2[C@H](C[C@]3(C[C@@H]4[C@](CC[C@@H]5[C@@](O4)(C[C@@H]4[C@@](O5)([C@H]([C@@H]5[C@@](O4)(C[C@H]([C@@H](O5)[C@H]4[C@@H](C[C@H]5[C@@H](O4)[C@@H]([C@H]([C@@H](O5)C[C@@H](C[C@H]([C@H]4[C@@H](C[C@H]5[C@@H](O4)[C@@H]([C@H]([C@@H](O5)[C@H]4[C@@H]([C@H]([C@H]5[C@H](O4)[C@@H]([C@@H]4[C@@H](O5)C[C@@H]5[C@@H](O4)C[C@@H]4[C@@H](O5)[C@H]([C@H]([C@@H](O4)C[C@@H]([C@H]([C@@H]4[C@@H](C[C@@H]5[C@@H](O4)[C@@H]([C@@H]4[C@@](O5)(C[C@@H]5[C@@H](O4)C[C@@H]4[C@@](O5)(C[C@H]([C@@H]5[C@@H](O4)[C@H]([C@H]([C@@H](O5)[C@H](C)C[C@H](C)[C@@H](C[C@@H]([C@@H]([C@H](C)C[C@H](C(=C)/C(=C/CO)/C)O)O)OS(=O)(=O)[O-])O)O)O)O)C)C)O)O)O)O)OS(=O)(=O)[O-])O)O)O)O)O)O)O)O)O)O)O)O)O)C)O)C)C)(O[C@@H]3O2)C)C)OC1)O)C)C)C)C)C)C)C)O)O.[Na+].[Na+]	{1: 21, 2: 9, 3: 15, 5: 2, 6: 2, 7: 2, 11: 28, 12: 68, 13: 15, 14: 2, 20: 28, 22: 2, 23: 32, 29: 6}
Did not match all atoms present	594-03-6	CC(=S)S	{1: 1, 39: 1, 7: 1}
Did not match all atoms present	594-09-2	CP(C)C	{1: 3}
Did not match all atoms present	594-10-5	C[Sb](C)C	{1: 3}
Did not match all atoms present	594-19-4	[Li+].C[C-](C)C	{1: 3, 7: 1}
Did not match all atoms present	594-27-4	C[Sn](C)(C)C	{1: 4}
Did not match all atoms present	594-31-0	C1=CC=C(C=C1)[Sb](C2=CC=CC=C2)(C3=CC=CC=C3)(Cl)Cl	{17: 2, 14: 15}
Did not match all atoms present	594-43-4	CCS(=O)(=O)C	{1: 2, 2: 1, 29: 2}
Did not match all atoms present	594-44-5	CCS(=O)(=O)Cl	{1: 1, 2: 1, 29: 2, 17: 1}
Did not match all atoms present	594-45-6	CCS(=O)(=O)O	{1: 1, 2: 1, 20: 1, 29: 2}
Did not match all atoms present	59400-23-6	[CH3-].[CH3-].CO[PH+](OC)OC.CO[PH+](OC)OC.[Pt+2]	{1: 6, 22: 6}
Did not match all atoms present	59411-08-4	C1=CC=C(C=C1)[Se][Se]C2=CC=CC=C2.II	{19: 2, 14: 10}
Did not match all atoms present	59411-71-1	COC1=CC(=C(C=C1N2CCOCC2)OC)[N+](=O)[O-]	{1: 2, 38: 1, 33: 1, 11: 4, 14: 2, 22: 2, 23: 1}
Did not match all atoms present	59413-14-8	CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCO	{1: 2, 2: 3, 35: 1, 33: 3, 14: 1, 20: 1, 25: 2}
Did not match all atoms present	59413-34-2	C[Si](C)(C1=CC=CC=C1)[O-].[K+]	{1: 2, 29: 1, 14: 5}
Did not match all atoms present	59414-23-2	COC=CC(=C)O[Si](C)(C)C	{1: 4, 22: 2, 5: 1, 6: 2, 7: 1}
Did not match all atoms present	59417-86-6	C1=CC=C2C(=C1)C3=C4C(=C2F)C=CC5=CC=CC(=C54)C=C3	{16: 1, 14: 11}
Did not match all atoms present	59419-71-5	C(C[N-]CC[NH-])[NH-].OO.OO.[Cr+3]	{36: 2, 2: 4, 20: 4, 34: 1}
Did not match all atoms present	5942-95-0	C1CCN(CC1)C2(CCN(CC2)CCCN3C4=CC=CC=C4CCC5=CC=CC=C53)C(=O)N	{33: 3, 2: 3, 11: 11, 13: 1, 14: 8, 24: 1, 30: 1}
Did not match all atoms present	59425-37-5	C1=CC=C(C=C1)N=CNC#N	{34: 1, 37: 1, 14: 5, 6: 1, 31: 1}
Did not match all atoms present	5943-40-8	CC(C)(C)N=C=[Se]	{8: 1, 1: 3, 34: 1, 4: 1}
Did not match all atoms present	59431-98-0	CCCCCCC(C)OC(=O)C1=CC(=C(C=C1)C(=O)OC(C)CCCCCC)C(=O)OC(C)CCCCCC	{1: 6, 2: 15, 3: 3, 28: 3, 14: 3}
Did not match all atoms present	59434-05-8	C1=C(SC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{41: 1, 38: 2, 14: 2}
Did not match all atoms present	5944-41-2	CC(C)(C)C1=CC=CC=N1	{1: 3, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	59443-94-6	C1=CC(=CC=C1C(=O)CC#N)N	{24: 1, 2: 1, 30: 1, 14: 4, 37: 1}
Did not match all atoms present	59445-85-1	CC(=O)NC1=COC=C1	{24: 1, 1: 1, 31: 1, 14: 3, 23: 1}
Did not match all atoms present	5945-33-5	CC(C)(C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)OP(=O)(OC5=CC=CC=C5)OC6=CC=CC=C6	{1: 2, 4: 1, 22: 6, 14: 28, 29: 2}
Did not match all atoms present	59454-35-2	CCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 9, 37: 1, 14: 8}
Did not match all atoms present	59459-46-0	CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@@H](CC5=CNC6=CC=CC=C65)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC7=CN=CN7)NC(=O)[C@H](CCSC)NC(=O)[C@H](CS)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)CNC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CC8=CC=C(C=C8)O)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC9=CC=C(C=C9)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N)N	{32: 3, 1: 19, 2: 59, 3: 55, 36: 4, 33: 2, 7: 4, 40: 1, 11: 6, 12: 2, 14: 32, 35: 1, 20: 8, 21: 5, 24: 56, 39: 6, 27: 7, 30: 9, 31: 54}
Did not match all atoms present	59464-43-6	C1/C=C\CC/C=C\C1.C1=CC=C(C=C1)N.[Cl-].[Rh]	{17: 1, 11: 4, 30: 1, 14: 9}
Did not match all atoms present	59467-70-8	CC1=NC=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4F	{1: 1, 35: 2, 33: 1, 11: 1, 14: 8, 15: 1, 16: 1, 17: 1}
Did not match all atoms present	5947-50-2	CNS(=O)(=O)C1=C(C=CC(=C1OC)C(=O)O)N	{1: 2, 14: 2, 22: 1, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	59473-45-9	C1=CC=C(C(=C1)CCl)I	{17: 1, 2: 1, 19: 1, 14: 4}
Did not match all atoms present	59480-26-1	C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O.C(COCCO)O	{2: 4, 14: 3, 20: 2, 22: 1, 27: 1, 28: 2}
Did not match all atoms present	59483-61-3	C1=CC(=CC=C1NCl)[N+](=O)[O-]	{17: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	5949-18-8	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)[O-].[Na+]	{24: 1, 35: 1, 14: 10}
Did not match all atoms present	5949-29-1	C(C(=O)O)C(CC(=O)O)(C(=O)O)O.O	{20: 1, 2: 2, 27: 3, 4: 1}
Did not match all atoms present	595-57-3	C[C@]12CCC(=O)C=C1CCC3C2([C@H](C[C@]4(C3CC[C@]4(CCC(=O)[O-])O)C)O)F.[K+]	{1: 2, 2: 2, 11: 7, 12: 3, 13: 4, 14: 1, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1}
Did not match all atoms present	595-89-1	C1=CC=C(C=C1)[Pb](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{14: 20}
Did not match all atoms present	595-90-4	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{14: 20}
Did not match all atoms present	595-91-5	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)O	{27: 1, 4: 1, 14: 15}
Did not match all atoms present	5950-69-6	C1=CC=C2C(=C1)C(=O)C(C2(O)O)(C3(C(=O)C4=CC=CC=C4C3(O)O)O)O	{25: 2, 20: 6, 13: 4, 14: 8}
Did not match all atoms present	59504-34-6	CC1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]	{1: 1, 11: 4, 38: 1, 14: 3, 33: 1}
Did not match all atoms present	5951-19-9	C(=S)=[Se]	{8: 1}
Did not match all atoms present	59512-21-9	CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)N(C)C	{24: 2, 1: 3, 3: 1, 14: 9, 33: 1}
Did not match all atoms present	59514-43-1	CCCC[P+](CCCC)(CCCC)CCCC.COC(=O)C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)OC	{1: 6, 2: 12, 28: 2, 29: 3, 14: 3}
Did not match all atoms present	59518-84-2	CC(C)(CO)CO.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O.C(CO)N1C(=O)N(C(=O)N(C1=O)CCO)CCO	{1: 2, 2: 12, 4: 1, 33: 3, 14: 3, 20: 5, 25: 3, 27: 3, 28: 2}
Did not match all atoms present	5952-41-0	CC(=O)OC(C(Cl)(Cl)Cl)P(=O)(OC)OC	{1: 3, 3: 1, 4: 1, 17: 3, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	59528-29-9	CCCCOC1=CC=C(C=C1)CN.Cl	{1: 1, 2: 4, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	59534-55-3	C(C[Al](Cl)Cl)[Al](Cl)Cl	{17: 4, 2: 2}
Did not match all atoms present	5954-90-5	CP(=S)(OC1=CC=CC=C1)OC2=CC=C(C=C2)C#N	{1: 1, 22: 2, 14: 9, 37: 1}
Did not match all atoms present	59558-23-5	CCCCCCCC(=O)OC1=CC=C(C=C1)C	{1: 2, 2: 6, 28: 1, 14: 4}
Did not match all atoms present	5956-60-5	COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.O.O.[Cl-]	{1: 2, 33: 1, 11: 3, 14: 6, 17: 1, 22: 2, 23: 2}
Did not match all atoms present	5956-63-8	COC1=C(C=C2C(=C1O)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)OC2=O)O.O	{1: 1, 2: 1, 12: 5, 14: 1, 20: 3, 21: 2, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	5956-87-6	CN1C2C3=C(CCN2C(=O)C4=CC=CC=C41)C5=CC=CC=C5N3	{32: 1, 1: 1, 33: 2, 11: 2, 12: 1, 14: 8, 25: 1}
Did not match all atoms present	59567-49-6	CCCCCCCCCCCCCCCCCC[N+](C)(C)C(C=C)C1=CC=CC=C1.[Cl-]	{1: 3, 2: 17, 3: 1, 5: 1, 6: 1, 14: 5, 17: 1}
Did not match all atoms present	59568-25-1	Cl[Sn+]	{17: 1}
Did not match all atoms present	5957-17-5	CC[N+](CC)(CC)CCO.[I-]	{1: 3, 2: 5, 19: 1, 20: 1}
Did not match all atoms present	5957-75-5	CCCCCC1=CC2=C(C3CC(=CCC3C(O2)(C)C)C)C(=C1)O	{1: 4, 2: 4, 11: 2, 12: 2, 13: 1, 14: 3, 15: 1, 21: 1, 23: 1}
Did not match all atoms present	5958-25-8	C1(=C(C(=NC(=C1Cl)F)F)Cl)Cl	{16: 2, 17: 3, 35: 1}
Did not match all atoms present	59581-76-9	CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O	{24: 1, 1: 1, 2: 11, 27: 1, 14: 8}
Did not match all atoms present	59587-07-4	C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=C(N=C2N)N=[N+]=[N-]	{33: 1, 2: 1, 35: 3, 12: 4, 34: 2, 14: 1, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	5959-42-2	C1=CC=C(C=C1)C(C(C2=CC=CC=C2)O)[NH3+].[Cl-]	{17: 1, 3: 2, 20: 1, 14: 10}
Did not match all atoms present	5959-52-4	C1=CC=C2C=C(C(=CC2=C1)C(=O)O)N	{27: 1, 30: 1, 14: 6}
Did not match all atoms present	5959-56-8	C1=CC=C2C(=C1)C(=CC=C2O)N.Cl	{17: 1, 30: 1, 21: 1, 14: 6}
Did not match all atoms present	5959-98-8	CC1=C(C=CC=N1)CCCl.Cl	{1: 1, 2: 2, 35: 1, 14: 3, 17: 2}
Did not match all atoms present	596-01-0	C1=CC=C2C(=C1)C(=CC=C2O)C3(C4=CC=CC=C4C(=O)O3)C5=CC=C(C6=CC=CC=C65)O	{28: 1, 13: 1, 14: 16, 21: 2}
Did not match all atoms present	596-03-2	C1=CC=C2C(=C1)C(=O)OC23C4=C(C(=C(C=C4)O)Br)OC5=C3C=CC(=C5Br)O	{13: 1, 14: 8, 18: 2, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	596-09-8	CC(=O)OC1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)OC(=O)C)C5=CC=CC=C5C(=O)O3	{1: 2, 28: 3, 13: 1, 14: 10, 23: 1}
Did not match all atoms present	596-11-2	CO[C@@H]1C[C@]23C4=C(CC[NH+]2CC=C3C=C1)COC(=O)C4.[Cl-]	{1: 1, 11: 6, 12: 1, 13: 1, 14: 3, 15: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	596-27-0	CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4)O)C)O	{1: 2, 28: 1, 13: 1, 14: 10, 21: 2}
Did not match all atoms present	596-28-1	C1=CC=C2C(=C1)C(=O)OC2(C3=CC(=C(C=C3)O)O)C4=CC(=C(C=C4)O)O	{28: 1, 13: 1, 14: 10, 21: 4}
Did not match all atoms present	596-29-2	C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC=CC=C4	{28: 1, 13: 1, 14: 14}
Did not match all atoms present	596-30-5	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OOC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{4: 2, 22: 2, 14: 30}
Did not match all atoms present	596-31-6	COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 4: 1, 22: 1, 14: 15}
Did not match all atoms present	596-38-3	C1=CC=C(C=C1)C2(C3=CC=CC=C3OC4=CC=CC=C42)O	{20: 1, 13: 1, 14: 13, 23: 1}
Did not match all atoms present	596-42-9	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)(C3=CC=CC=C3Cl)O	{1: 4, 4: 1, 33: 2, 14: 12, 17: 1, 20: 1}
Did not match all atoms present	596-43-0	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Br	{18: 1, 4: 1, 14: 15}
Did not match all atoms present	596-48-5	C1=CC(=CC=C1C(C2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=C(C=C3)[N+](=O)[O-])O)[N+](=O)[O-]	{20: 1, 4: 1, 38: 3, 14: 12}
Did not match all atoms present	596-49-6	CCN(CC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CC)CC)(C3=CC=C(C=C3)N(CC)CC)O	{1: 6, 2: 6, 4: 1, 33: 3, 14: 12, 20: 1}
Did not match all atoms present	596-51-0	C[N+]1(CCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)C	{1: 2, 4: 1, 11: 7, 12: 2, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	5960-69-0	CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3C=C2	{24: 1, 1: 1, 14: 9}
Did not match all atoms present	59607-71-5	COC1=CC(=C(C=C1)SC#N)[N+](=O)[O-]	{1: 1, 37: 1, 38: 1, 40: 1, 14: 3, 22: 1}
Did not match all atoms present	59608-97-8	C1=C(N=C(S1)N)CCl.Cl	{2: 1, 35: 1, 41: 1, 14: 1, 17: 2, 30: 1}
Did not match all atoms present	59609-05-1	CC1(COP(OC1)OCC(C)(C)COP2OCC(CO2)(C)C)C	{1: 6, 2: 2, 4: 1, 11: 4, 13: 2, 22: 2, 23: 4}
Did not match all atoms present	59609-12-0	C1C2(COP(=O)(O1)C3=CC=CC=C3)COP(=O)(OC2)C4=CC=CC=C4	{11: 4, 29: 2, 13: 1, 14: 10, 23: 4}
Did not match all atoms present	5961-33-1	CC1(CNC1)C2=CC=CC=C2	{32: 1, 1: 1, 11: 2, 13: 1, 14: 5}
Did not match all atoms present	5961-55-7	COC1=CC=C(C2=CC=CC=C21)C#N	{1: 1, 22: 1, 14: 6, 37: 1}
Did not match all atoms present	5961-59-1	CNC1=CC=C(C=C1)OC	{1: 2, 22: 1, 14: 4, 31: 1}
Did not match all atoms present	5961-88-6	C1CS(=O)(=O)OC1=O	{11: 2, 28: 1, 29: 2}
Did not match all atoms present	5962-42-5	C(CP(=O)(O)O)C(=O)O	{2: 2, 27: 1, 20: 2, 29: 1}
Did not match all atoms present	59633-97-5	CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC(=CC(=C1)O)O	{1: 3, 4: 1, 5: 1, 14: 8, 21: 3}
Did not match all atoms present	59639-91-7	C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)[O-].[K+]	{24: 1, 17: 1, 38: 1, 14: 3}
Did not match all atoms present	5964-09-0	C(C[P+](=O)CCC#N)C#N	{2: 4, 29: 1, 37: 2}
Did not match all atoms present	5964-35-2	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[K+].[K+].[K+].[K+]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	59640-46-9	CSCC1=CC(=O)NC(=O)N1	{32: 2, 1: 1, 2: 1, 40: 1, 14: 1, 25: 2}
Did not match all atoms present	59642-75-0	C[N+]1=CC=CC=C1N=NC2=CC=C(C=C2)N.COS(=O)(=O)[O-]	{1: 2, 34: 2, 33: 1, 14: 8, 22: 1, 29: 3, 30: 1}
Did not match all atoms present	59643-44-6	CC(C)C[Hg]C	{1: 3, 2: 1, 3: 1}
Did not match all atoms present	59643-45-7	CC(C)C[Hg]CC(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1}
Did not match all atoms present	59643-84-4	CCCOC1=CC=CC=C1C(=O)N	{1: 1, 2: 2, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	59646-36-5	CC1=CC=CC(=C1)C(=O)NNC(=O)C2=CC(=CC=C2)C	{24: 2, 1: 2, 14: 8, 31: 2}
Did not match all atoms present	59647-78-8	CC(C=NO)C1=CC=CC=C1	{1: 1, 34: 1, 3: 1, 6: 1, 14: 5, 20: 1}
Did not match all atoms present	5965-13-9	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](CC4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 2, 3: 2, 33: 1, 11: 5, 12: 4, 13: 1, 14: 2, 20: 3, 22: 1, 23: 1, 27: 2}
Did not match all atoms present	5965-33-3	C(=O)(C(=O)O[Sb](OC(=O)C(=O)[O-])OC(=O)C(=O)[O-])[O-].[K+].[K+].[K+]	{24: 3, 28: 3}
Did not match all atoms present	5965-83-3	C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O.O	{27: 1, 20: 1, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	59652-20-9	CC1=C2C(=NC3=C1C4=CC=CC=C4C=C3)C=CC5=CC=CC=C52	{1: 1, 35: 1, 14: 12}
Did not match all atoms present	59652-21-0	CC1=C2C=CC3=CC=CC=C3C2=NC4=C1C=CC5=CC=CC=C54	{1: 1, 35: 1, 14: 12}
Did not match all atoms present	59656-20-1	CCCCCCCCCC(C)(C)SSC1=NN=C(S1)SSC(C)(C)CCCCCCCCC	{1: 6, 2: 16, 35: 2, 4: 2, 40: 4, 41: 1}
Did not match all atoms present	59662-27-0	CCCCCCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2	{24: 1, 1: 1, 2: 5, 14: 9}
Did not match all atoms present	59662-31-6	CCCCCCC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 2: 5, 14: 9}
Did not match all atoms present	59662-32-7	CCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 2: 6, 14: 9}
Did not match all atoms present	59664-42-5	C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)C=O	{16: 6, 26: 1, 4: 2, 14: 3}
Did not match all atoms present	59666-16-9	CC1=CC(=NC2=C1C=CC(=C2)Cl)Cl	{1: 1, 35: 1, 14: 4, 17: 2}
Did not match all atoms present	5967-09-9	CCCC[Sn](CCCC)(OC(=O)C)O[Sn](CCCC)(CCCC)OC(=O)C	{1: 6, 2: 12, 28: 2, 22: 1}
Did not match all atoms present	5967-84-0	CN1C2=C(C(=O)N(C1=O)C)NC=N2.O	{32: 1, 1: 2, 35: 1, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	5968-11-6	C(=O)([O-])[O-].O.[Na+].[Na+]	{24: 1}
Did not match all atoms present	5968-79-6	CCCCN(CCCC)CC1C2=C(C(=C(C=C2C(=O)O1)O)O)O.Cl	{1: 2, 2: 7, 33: 1, 12: 1, 14: 1, 17: 1, 21: 3, 28: 1}
Did not match all atoms present	5968-88-7	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Mn+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	59690-88-9	C1=CC(=CC(=C1)NC(=O)N)N.Cl	{24: 1, 17: 1, 30: 2, 14: 4, 31: 1}
Did not match all atoms present	59697-12-0	CC[N+](C)(C)CCOCC[N+](CC)(CC)CC.[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O.[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O	{1: 6, 2: 8, 3: 4, 20: 4, 22: 1, 24: 2, 27: 2}
Did not match all atoms present	597-25-1	COP(=O)(N1CCOCC1)OC	{1: 2, 33: 1, 11: 4, 22: 2, 23: 1, 29: 1}
Did not match all atoms present	597-35-3	CCS(=O)(=O)CC	{1: 2, 2: 2, 29: 2}
Did not match all atoms present	597-50-2	CCP(=O)(CC)CC	{1: 3, 2: 3, 29: 1}
Did not match all atoms present	597-51-3	CCP(=S)(CC)CC	{1: 3, 2: 3}
Did not match all atoms present	597-52-4	CC[Si](CC)(CC)O	{1: 3, 2: 3, 20: 1}
Did not match all atoms present	597-55-7	CCOC(=O)C(CC1=CC=CC=C1)(CC2=CC=CC=C2)C(=O)OCC	{1: 2, 2: 4, 4: 1, 14: 10, 28: 2}
Did not match all atoms present	597-63-7	CC[Ge](CC)(CC)CC	{1: 4, 2: 4}
Did not match all atoms present	597-64-8	CC[Sn](CC)(CC)CC	{1: 4, 2: 4}
Did not match all atoms present	597-67-1	CCO[Si](CC)(CC)CC	{1: 4, 2: 4, 22: 1}
Did not match all atoms present	597-84-2	CC1=CC=C(C=C1)OP(=S)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C	{1: 3, 22: 3, 14: 12}
Did not match all atoms present	597-88-6	CCOP(=O)(OC1=CC=C(C=C1)[N+](=O)[O-])SCC	{1: 2, 2: 2, 38: 1, 40: 1, 14: 4, 22: 2, 29: 1}
Did not match all atoms present	597-97-7	CCC(C)(C)N=C=S	{8: 1, 1: 3, 2: 1, 4: 1, 34: 1}
Did not match all atoms present	5970-44-5	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.[Y+3].[Y+3]	{24: 3}
Did not match all atoms present	5970-45-6	CC(=O)[O-].CC(=O)[O-].O.O.[Zn+2]	{24: 2, 1: 2}
Did not match all atoms present	5970-62-7	C(=O)[O-].C(=O)[O-].O.O.[Zn+2]	{26: 2}
Did not match all atoms present	59701-66-5	COC1=CC(=C(C=C1)O)C(=O)CCC(=O)OC	{1: 2, 2: 2, 14: 3, 21: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	59701-69-8	COC1=CC=CC2=C1OC3C2(CCC3)O	{1: 1, 11: 3, 12: 1, 13: 1, 14: 3, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	59707-21-0	CCCCCCCCOP(=O)(O)OCCCCCCCC.C(CO)NCCO	{1: 2, 2: 18, 20: 3, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	59709-07-8	CCN(CC[N+]1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl.CC(=O)[O-]	{1: 2, 2: 3, 38: 1, 33: 2, 34: 2, 14: 11, 17: 2, 24: 1}
Did not match all atoms present	5971-93-7	[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Rb+]	{14: 20}
Did not match all atoms present	5972-07-6	CN(C)C1=C2C(=C(C=C1)N(C)C)C(=O)NC2=O	{32: 1, 1: 4, 33: 2, 14: 2, 25: 2}
Did not match all atoms present	5972-09-8	CNC1=CC=CC2=C1C(=O)NC2=O	{32: 1, 1: 1, 31: 1, 14: 3, 25: 2}
Did not match all atoms present	5972-71-4	C(C(C(=O)O)O)C(=O)[O-].[NH4+]	{24: 1, 27: 1, 2: 1, 3: 1, 20: 1}
Did not match all atoms present	5972-72-5	C(=O)(C(=O)[O-])O.[NH4+]	{24: 1, 27: 1}
Did not match all atoms present	5972-76-9	CCCCCCCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 6}
Did not match all atoms present	59729-31-6	CC(C)N1CCC(CC1)N(C2=CC=C(C=C2)Cl)C(=O)CC3=CC=CC=C3	{1: 2, 2: 1, 3: 1, 33: 2, 11: 4, 12: 1, 14: 9, 17: 1, 24: 1}
Did not match all atoms present	59729-32-7	CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F.Br	{1: 2, 2: 3, 37: 1, 33: 1, 11: 1, 13: 1, 14: 7, 16: 1, 18: 1, 23: 1}
Did not match all atoms present	59729-33-8	CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F	{1: 2, 2: 3, 37: 1, 33: 1, 11: 1, 13: 1, 14: 7, 16: 1, 23: 1}
Did not match all atoms present	5973-17-1	C1=CC=C(C=C1)[O-].[NH4+]	{14: 5}
Did not match all atoms present	5973-71-7	CC1=C(C=C(C=C1)C=O)C	{1: 2, 26: 1, 14: 3}
Did not match all atoms present	59734-85-9	CCC(C)C1=CC=CC=C1Br	{1: 2, 2: 1, 3: 1, 18: 1, 14: 4}
Did not match all atoms present	59736-00-4	C1=CC(=CC(=C1)N)CC(=O)N.Cl	{24: 1, 17: 1, 2: 1, 30: 2, 14: 4}
Did not match all atoms present	59736-98-0	CC1(C2=CC=CC=C2[N+](=C1C=CNC3=C(C=C(C=C3)OC)OC)C)C.C(=O)[O-]	{1: 5, 6: 2, 33: 1, 13: 1, 14: 7, 15: 1, 22: 2, 26: 1, 31: 1}
Did not match all atoms present	59737-00-7	CC(=O)[O-].CC1(C2=CC=CC=C2[N+](=C1C=CNC3=C(C=C(C=C3)OC)OC)C)C	{1: 6, 6: 2, 33: 1, 13: 1, 14: 7, 15: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	5974-19-6	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)CC4=CC=CC=C4.[Cl-]	{1: 5, 2: 1, 33: 3, 7: 1, 14: 17, 15: 2, 17: 1}
Did not match all atoms present	59741-04-7	CC1=CC(=C(C=C1)OC)N=C=O	{1: 2, 34: 1, 8: 1, 14: 3, 22: 1, 29: 1}
Did not match all atoms present	59748-32-2	CCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCC	{1: 2, 2: 5, 28: 1, 14: 12}
Did not match all atoms present	59748-34-4	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCC	{1: 2, 2: 7, 28: 1, 14: 12}
Did not match all atoms present	59748-37-7	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)Cl	{24: 1, 1: 1, 2: 4, 14: 8, 17: 1}
Did not match all atoms present	59748-90-2	C1=CC(=C(C=C1Br)Cl)C(=O)O	{17: 1, 18: 1, 27: 1, 14: 3}
Did not match all atoms present	59749-17-6	COC(=O)[C@@H]1CCC(=O)N1CC2=CC=C(C=C2)F	{1: 1, 2: 1, 33: 1, 11: 2, 12: 1, 14: 4, 16: 1, 25: 1, 28: 1}
Did not match all atoms present	59749-18-7	COC(=O)[C@@H]1CCC(=O)N1CC2=CC=C(C=C2)Cl	{1: 1, 2: 1, 33: 1, 11: 2, 12: 1, 14: 4, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	59749-19-8	COC(=O)[C@@H]1CCC(=O)N1CC2=CC(=C(C=C2)Cl)Cl	{1: 1, 2: 1, 33: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 28: 1}
Did not match all atoms present	59749-20-1	COC(=O)[C@@H]1CCC(=O)N1CC2=C(C=CC=C2Cl)Cl	{1: 1, 2: 1, 33: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 28: 1}
Did not match all atoms present	59749-21-2	C1CC(=O)N([C@@H]1C(=O)O)CC2=CC=C(C=C2)F	{33: 1, 2: 1, 11: 2, 12: 1, 14: 4, 16: 1, 25: 1, 27: 1}
Did not match all atoms present	59749-22-3	C1CC(=O)N([C@@H]1C(=O)O)CC2=CC=C(C=C2)Cl	{33: 1, 2: 1, 11: 2, 12: 1, 14: 4, 17: 1, 25: 1, 27: 1}
Did not match all atoms present	59749-23-4	C1CC(=O)N([C@@H]1C(=O)O)CC2=CC(=C(C=C2)Cl)Cl	{33: 1, 2: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 27: 1}
Did not match all atoms present	59749-24-5	C1CC(=O)N([C@@H]1C(=O)O)CC2=C(C=C(C=C2)Cl)Cl	{33: 1, 2: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 27: 1}
Did not match all atoms present	59749-27-8	C1CC(=O)N([C@@H]1C(=O)[O-])CC2=CC=C(C=C2)F.[NH4+]	{33: 1, 2: 1, 11: 2, 12: 1, 14: 4, 16: 1, 24: 1, 25: 1}
Did not match all atoms present	59749-28-9	C1CC(=O)N([C@@H]1C(=O)[O-])CC2=CC=C(C=C2)Cl.[NH4+]	{33: 1, 2: 1, 11: 2, 12: 1, 14: 4, 17: 1, 24: 1, 25: 1}
Did not match all atoms present	59749-29-0	CC(C)NCC1=CC=CC=C1.C1CC(=O)N([C@@H]1C(=O)O)CC2=CC=C(C=C2)F	{1: 2, 2: 2, 3: 1, 33: 1, 11: 2, 12: 1, 14: 9, 16: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	59749-30-3	CC(C)NC(C)C.C1CC(=O)N([C@@H]1C(=O)O)CC2=CC=C(C=C2)F	{1: 4, 2: 1, 3: 2, 33: 1, 11: 2, 12: 1, 14: 4, 16: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	59749-31-4	CCNCC.C1CC(=O)N([C@@H]1C(=O)O)CC2=CC=C(C=C2)F	{1: 2, 2: 3, 33: 1, 11: 2, 12: 1, 14: 4, 16: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	59749-33-6	CC(C)NC(C)C.C1CC(=O)N([C@@H]1C(=O)O)CC2=CC=C(C=C2)Cl	{1: 4, 2: 1, 3: 2, 33: 1, 11: 2, 12: 1, 14: 4, 17: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	59749-34-7	CC(C)NCC1=CC=CC=C1.C1CC(=O)N([C@@H]1C(=O)O)CC2=CC=C(C=C2)Cl	{1: 2, 2: 2, 3: 1, 33: 1, 11: 2, 12: 1, 14: 9, 17: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	59749-35-8	CC(C)N.C1CC(=O)N([C@@H]1C(=O)O)CC2=CC(=C(C=C2)Cl)Cl	{1: 2, 2: 1, 3: 1, 33: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 27: 1, 30: 1}
Did not match all atoms present	59749-36-9	CC(C)NC(C)C.C1CC(=O)N([C@@H]1C(=O)O)CC2=CC(=C(C=C2)Cl)Cl	{1: 4, 2: 1, 3: 2, 33: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	59749-37-0	C1CC(=O)N([C@@H]1C(=O)O)CC2=C(C=CC=C2Cl)Cl	{33: 1, 2: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 27: 1}
Did not match all atoms present	59749-38-1	CC(C)NC(C)C.C1CC(=O)N([C@@H]1C(=O)O)CC2=C(C=CC=C2Cl)Cl	{1: 4, 2: 1, 3: 2, 33: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	59749-39-2	CC(C)N.C1CC(=O)N([C@@H]1C(=O)O)CC2=C(C=CC=C2Cl)Cl	{1: 2, 2: 1, 3: 1, 33: 1, 11: 2, 12: 1, 14: 3, 17: 2, 25: 1, 27: 1, 30: 1}
Did not match all atoms present	59749-40-5	CC1(OCC(O1)COC(=O)[C@@H]2CCC(=O)N2CC3=CC=C(C=C3)F)C	{1: 2, 2: 2, 33: 1, 11: 3, 12: 2, 13: 1, 14: 4, 16: 1, 23: 2, 25: 1, 28: 1}
Did not match all atoms present	59749-42-7	CN(C)CCOC(=O)[C@@H]1CCC(=O)N1CC2=CC=C(C=C2)F.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 3, 6: 2, 33: 2, 11: 2, 12: 1, 14: 4, 16: 1, 25: 1, 27: 2, 28: 1}
Did not match all atoms present	59749-44-9	CN(C)CCOC(=O)[C@@H]1CCC(=O)N1CC2=CC=C(C=C2)Cl.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 3, 6: 2, 33: 2, 11: 2, 12: 1, 14: 4, 17: 1, 25: 1, 27: 2, 28: 1}
Did not match all atoms present	59749-45-0	C1CC(=O)N([C@@H]1C(=O)OCC2=CC(=O)C3=CC=CC=C3O2)CC4=CC=C(C=C4)F	{33: 1, 2: 2, 11: 2, 12: 1, 14: 9, 16: 1, 23: 1, 25: 2, 28: 1}
Did not match all atoms present	59749-46-1	C1CC(=O)N(C1C(=O)N)CC2=CC=C(C=C2)F	{33: 1, 2: 1, 11: 2, 12: 1, 14: 4, 16: 1, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	59749-49-4	C1CC(=O)N(C1C(=O)NC2=CC(=O)C3=CC=CC=C3O2)C(=O)NC4=CC(=O)C5=CC=CC=C5O4	{33: 1, 11: 2, 12: 1, 14: 10, 23: 2, 24: 2, 25: 3, 31: 2}
Did not match all atoms present	59749-50-7	C1CC(=O)N(C1C(=O)NC2=CC(=O)C3=CC=CC=C3O2)CC4=CC=C(C=C4)F	{33: 1, 2: 1, 11: 2, 12: 1, 14: 9, 16: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	59749-51-8	C1CC(=O)N(C1C(=O)NC2=CC=CC(=C2)C(F)(F)F)CC3=CC=C(C=C3)F	{33: 1, 2: 1, 4: 1, 11: 2, 12: 1, 14: 8, 16: 4, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	59756-57-9	C1=CC=C(C=C1)CC(=O)CC2=CC(=CC=C2)C(F)(F)F	{16: 3, 24: 1, 2: 2, 4: 1, 14: 9}
Did not match all atoms present	59756-60-4	CN1C=C(C(=O)C(=C1)C2=CC(=CC=C2)C(F)(F)F)C3=CC=CC=C3	{1: 1, 4: 1, 33: 1, 14: 11, 16: 3, 25: 1}
Did not match all atoms present	5976-61-4	CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4O)O	{1: 1, 11: 6, 12: 4, 13: 1, 14: 2, 20: 1, 21: 2}
Did not match all atoms present	59766-02-8	C1=CC=C(C=C1)CC2=C3C=CC4=CC=CC=C4C3=C(C5=C2C6=CC=CC=C6C=C5)CC7=CC=CC=C7	{2: 2, 14: 22}
Did not match all atoms present	59766-31-3	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[K+].[K+].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4]	{}
Did not match all atoms present	5977-35-5	CC1=C(C=C(C=C1)C(=O)O)N(CCCl)CCCl	{1: 1, 2: 4, 33: 1, 14: 3, 17: 2, 27: 1}
Did not match all atoms present	5977-85-5	CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)OC)O)OC	{1: 4, 2: 1, 33: 1, 11: 2, 12: 1, 14: 5, 21: 1, 22: 3}
Did not match all atoms present	59777-67-2	COC(=O)C1=CC(=CC=C1)S(=O)(=O)N	{1: 1, 30: 1, 28: 1, 29: 2, 14: 4}
Did not match all atoms present	59779-45-2	NN.NN.OP(=O)(O)O	{20: 3, 29: 1, 30: 4}
Did not match all atoms present	5978-44-9	C1C2=CC=CC=C2C3=CC=CC=C31.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 11: 1, 21: 1, 14: 10}
Did not match all atoms present	5978-92-7	C1CN(CCN1CCOCCOC(=O)C2=CC3=CC=CC=C3C(=C2O)CC4=C(C(=CC5=CC=CC=C54)C(=O)O)O)C(C6=CC=CC=C6)C7=CC=C(C=C7)Cl	{33: 2, 2: 5, 3: 1, 11: 4, 14: 19, 17: 1, 21: 2, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	59788-14-6	CN1C=C2C=C3C=CC=CC3=CC2=C1	{1: 1, 14: 8, 33: 1}
Did not match all atoms present	59788-15-7	CN1C=C2C3=CC=CC=C3C4=CC=CC=C4C2=C1	{1: 1, 14: 10, 33: 1}
Did not match all atoms present	59789-51-4	C1=CC(=O)N(C1=O)C2=C(C=C(C=C2Br)Br)Br	{25: 2, 18: 3, 14: 4, 33: 1}
Did not match all atoms present	5979-31-7	C1=CC(=CC(=C1)N)C(=O)NC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 16, 15: 2, 24: 1, 25: 1, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	59792-78-8	[Cd+2].[OH-]	{}
Did not match all atoms present	598-02-7	CCOP(=O)(O)OCC	{1: 2, 2: 2, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	598-03-8	CCCS(=O)(=O)CCC	{1: 2, 2: 4, 29: 2}
Did not match all atoms present	598-04-9	CCCCS(=O)(=O)CCCC	{1: 2, 2: 6, 29: 2}
Did not match all atoms present	598-05-0	CCCOS(=O)(=O)OCCC	{1: 2, 2: 4, 29: 2, 22: 2}
Did not match all atoms present	598-14-1	CC[As](Cl)Cl	{1: 1, 2: 1, 17: 2}
Did not match all atoms present	598-30-1	[Li+].CC[CH-]C	{1: 2, 2: 1, 6: 1}
Did not match all atoms present	598-45-8	CC(C)[N+]#[C-]	{1: 2, 34: 1, 3: 1}
Did not match all atoms present	598-52-7	CNC(=S)N	{1: 1, 31: 1, 30: 1, 7: 1}
Did not match all atoms present	598-54-9	CC(=O)[O-].[Cu+]	{24: 1, 1: 1}
Did not match all atoms present	598-58-3	CO[N+](=O)[O-]	{1: 1, 22: 1}
Did not match all atoms present	598-62-9	C(=O)([O-])[O-].[Mn+2]	{24: 1}
Did not match all atoms present	598-63-0	C(=O)([O-])[O-].[Pb+2]	{24: 1}
Did not match all atoms present	598-64-1	C[NH2+]C.CN(C)C(=S)[S-]	{1: 4, 33: 1, 7: 1}
Did not match all atoms present	5980-33-6	CC1=CC(=O)OC2=C1C=CC(=C2)[O-].[Na+]	{1: 1, 28: 1, 14: 4}
Did not match all atoms present	5980-86-9	C(=C/[Hg]Cl)\Cl	{17: 2, 6: 2}
Did not match all atoms present	5980-89-2	C1=CSC(=C1)[Hg]C2=CC=CS2	{41: 2, 14: 6}
Did not match all atoms present	5980-96-1	CC1=CC(=C(C(=C1)C)C(C)C)C	{1: 5, 3: 1, 14: 2}
Did not match all atoms present	59803-32-6	CCOC(=O)C(=CC1=CC=CC=C1Br)C#N	{1: 1, 2: 1, 37: 1, 6: 1, 7: 1, 14: 4, 18: 1, 28: 1}
Did not match all atoms present	59803-98-4	C1CN=C(N1)NC2=C(C3=NC=CN=C3C=C2)Br	{32: 1, 35: 3, 11: 2, 14: 4, 15: 1, 18: 1, 31: 1}
Did not match all atoms present	59804-37-4	CN1C(=C(C2=C(S1(=O)=O)C=CS2)O)C(=O)NC3=CC=CC=N3	{1: 1, 35: 1, 33: 1, 41: 1, 14: 6, 15: 2, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	59804-88-5	C[N+]1=CC=CC(=C1)C2=C(C3=CC=CC=C3C2=O)[O-]	{1: 1, 25: 1, 33: 1, 14: 8, 15: 2}
Did not match all atoms present	5981-09-9	C1=CC(=CC=C1N)N(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N	{33: 1, 30: 3, 14: 12}
Did not match all atoms present	59820-43-8	C1=CC(=C(C=C1[N+](=O)[O-])OCCO)NCCO	{2: 4, 38: 1, 14: 3, 20: 2, 22: 1, 31: 1}
Did not match all atoms present	59822-54-7	C=CC(=O)N.C=CN1CCCC1=O.C=CS(=O)(=O)[O-].[Na+]	{33: 1, 5: 3, 6: 3, 11: 3, 24: 1, 25: 1, 29: 3, 30: 1}
Did not match all atoms present	59823-94-8	CC(=O)[O-].CC(=O)[O-].[Eu+2]	{24: 2, 1: 2}
Did not match all atoms present	5984-97-4	C1=C(C(=O)NC(=S)N1)I	{32: 2, 25: 1, 19: 1, 14: 1}
Did not match all atoms present	59843-58-2	C1=CC(=CC=C1C2=CC=NN2)Cl	{32: 1, 17: 1, 35: 1, 14: 6}
Did not match all atoms present	59843-75-3	CC1=CC=C(C=C1)C2=CC=NN2	{32: 1, 1: 1, 35: 1, 14: 6}
Did not match all atoms present	5985-24-0	COC(=O)C1=CC(=C(C=C1)O)C(=O)OC	{1: 2, 28: 2, 21: 1, 14: 3}
Did not match all atoms present	5985-35-3	CN1CCC23CCCCC2C1CC4=C3C=C(C=C4)O	{1: 1, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	59863-13-7	C[Si](C)(C)N([Si](C)(C)C)[Sn]N([Si](C)(C)C)[Si](C)(C)C	{1: 12, 33: 2}
Did not match all atoms present	59864-79-8	C(CCCCCC(=O)[O-])CCCCC(=O)[O-].[NH4+].[NH4+]	{24: 2, 2: 10}
Did not match all atoms present	59866-75-0	CCCCN(CCCC)C1=NC(=S)NC(=S)[N-]1.[Na+]	{32: 1, 1: 2, 2: 6, 35: 2, 33: 1}
Did not match all atoms present	5987-82-6	CCCCOC1=C(C=CC(=C1)C(=O)OCCN(CC)CC)N.Cl	{1: 3, 2: 7, 33: 1, 14: 3, 17: 1, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	59871-73-7	C1=C(C=C(C(=C1O)[O-])O)C(=O)O.C1=C(C=C(C(=C1O)[O-])O)C(=O)O.C1=C(C=C(C(=C1O)[O-])O)C(=O)O.C1=C(C=C(C(=C1O)[O-])O)C(=O)O.C1=C(C=C(C(=C1O)[O-])O)C(=O)O.[Mg+2].[Al+3]	{27: 5, 21: 10, 14: 10}
Did not match all atoms present	5988-31-8	CC(C)[NH+](CCOC(=O)C1=CC=C(C=C1)N)C(C)C.[Cl-]	{1: 4, 2: 2, 3: 2, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	5989-77-5	C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@@H]5C[C@H]6[C@@H](CC7=CNC8=CC=CC6=C78)N(C5)C.C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@@H]5C[C@H]6[C@@H](CC7=CNC8=CC=CC6=C78)N(C5)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{32: 2, 1: 4, 2: 2, 3: 2, 33: 6, 11: 12, 12: 10, 13: 4, 14: 18, 20: 4, 23: 2, 24: 2, 25: 4, 27: 2, 31: 2}
Did not match all atoms present	5989-81-1	C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O.O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
Did not match all atoms present	59893-28-6	CCC(C)C1=CC(=C(C=C1)O)C=O	{1: 2, 2: 1, 3: 1, 14: 3, 21: 1, 26: 1}
Did not match all atoms present	599-61-1	C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)N)N	{30: 2, 29: 2, 14: 8}
Did not match all atoms present	599-62-2	CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2	{1: 2, 29: 2, 14: 9, 33: 1}
Did not match all atoms present	599-64-4	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)O	{1: 2, 4: 1, 21: 1, 14: 9}
Did not match all atoms present	599-66-6	CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C	{1: 2, 29: 2, 14: 8}
Did not match all atoms present	599-67-7	CC(C1=CC=CC=C1)(C2=CC=CC=C2)O	{1: 1, 4: 1, 14: 10, 20: 1}
Did not match all atoms present	599-69-9	CC1=CC=C(C=C1)S(=O)(=O)N(C)C	{1: 3, 29: 2, 14: 4, 33: 1}
Did not match all atoms present	599-70-2	CCS(=O)(=O)C1=CC=CC=C1	{1: 1, 2: 1, 29: 2, 14: 5}
Did not match all atoms present	599-71-3	C1=CC=C(C=C1)S(=O)(=O)NO	{20: 1, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	599-79-1	C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N/N=C/3\C=CC(=O)C(=C3)C(=O)O	{34: 1, 35: 1, 14: 11, 15: 2, 25: 1, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	599-86-0	CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C	{1: 2, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	599-89-3	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)Cl	{1: 1, 29: 2, 22: 1, 14: 8, 17: 1}
Did not match all atoms present	599-91-7	CCCOS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 2, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	599-94-0	C1=CC=C(C=C1)S(=O)(=O)CCS(=O)(=O)C2=CC=CC=C2	{2: 2, 29: 4, 14: 10}
Did not match all atoms present	5990-35-2	C(=O)([O-])[O-].O.O.O.O.O.[Zr].[Zr].[Zr]	{24: 1}
Did not match all atoms present	59901-91-6	C1C(O1)C(C2=CC3=C(C=C2)OCO3)O	{3: 1, 11: 2, 12: 1, 14: 3, 20: 1, 23: 3}
Did not match all atoms present	5991-71-9	C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)C(=O)[O-].[K+]	{32: 1, 35: 1, 12: 1, 14: 8, 15: 1, 17: 1, 24: 1, 25: 1}
Did not match all atoms present	5991-91-3	CCN(CC)C1=CC=C(C=C1)NC2=CC(=NC(=O)C)C(=O)C=C2	{1: 3, 2: 2, 33: 1, 34: 1, 14: 7, 15: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	59916-30-2	CC1=CC(=C(C=C1N=NC2=CC(=CC=C2)S(=O)(=O)O)OC)N	{1: 2, 34: 2, 14: 6, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	59917-39-4	CC[C@@]1(C[C@@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)N)O)O)CC)OC)C(=O)OC)O.OS(=O)(=O)O	{32: 1, 1: 5, 2: 2, 33: 3, 11: 9, 12: 4, 13: 5, 14: 8, 20: 5, 22: 1, 24: 1, 28: 1, 29: 2, 30: 1}
Did not match all atoms present	59919-41-4	CCC1=CC2=C(C=C1)C=C(C=C2)CC	{1: 2, 2: 2, 14: 6}
Did not match all atoms present	59921-42-5	CN(C)C1=NC(=O)N(C=C1)C2C(C(C(O2)COC)OC)OC	{1: 5, 2: 1, 35: 1, 33: 2, 12: 4, 14: 2, 22: 3, 23: 1, 25: 1}
Did not match all atoms present	59928-80-2	CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C.COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)C(Cl)(Cl)Cl	{1: 7, 2: 2, 3: 2, 4: 1, 14: 9, 17: 3, 35: 2, 22: 5}
Did not match all atoms present	59935-47-6	C1C2=CC=CC=C2C3=C1C=C(C=C3)NC(=O)CCC(=O)O	{2: 2, 11: 1, 14: 7, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	5994-45-6	CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)C(=O)[O-].[Na+]	{24: 2, 1: 1, 2: 17, 14: 4, 31: 1}
Did not match all atoms present	59942-19-7	CC1=C(C=CC=C1N=C=O)N=C=O.CC(COCC(C)O)O	{1: 3, 2: 2, 3: 2, 8: 2, 34: 2, 14: 3, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	59943-31-6	CN1CCN(CC1)C2=NS(=O)(=O)C3=C(N2)C=CC(=C3)Cl	{32: 1, 1: 1, 35: 1, 33: 2, 11: 4, 14: 3, 15: 1, 17: 1, 29: 2}
Did not match all atoms present	5995-29-9	CCCCCCN(CP(=O)(O)O)CP(=O)(O)O	{1: 1, 2: 7, 20: 4, 29: 2, 33: 1}
Did not match all atoms present	5995-42-6	C(CO)N(CP(=O)(O)O)CP(=O)(O)O	{33: 1, 2: 4, 20: 5, 29: 2}
Did not match all atoms present	59950-10-6	C1=CC=C(C=C1)OCCCSC2=CC=CC=C2	{40: 1, 2: 3, 22: 1, 14: 10}
Did not match all atoms present	59950-11-7	C1=CC=C(C=C1)OCCCCSC2=CC=CC=C2	{40: 1, 2: 4, 22: 1, 14: 10}
Did not match all atoms present	59950-12-8	C1=CC=C(C=C1)OCCCCCSC2=CC=CC=C2	{40: 1, 2: 5, 22: 1, 14: 10}
Did not match all atoms present	59950-13-9	C1=CC=C(C=C1)OCCCCCCSC2=CC=CC=C2	{40: 1, 2: 6, 22: 1, 14: 10}
Did not match all atoms present	59950-40-2	C1CN2CCCN(C1)C3=CC=CC4=C3C2=CC=C4	{33: 2, 11: 6, 14: 6}
Did not match all atoms present	59950-41-3	C1CN2CCN1C3=CC=CC4=C3C2=CC=C4	{33: 2, 11: 4, 14: 6}
Did not match all atoms present	5996-10-1	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O.O	{20: 5, 2: 1, 12: 5, 23: 1}
Did not match all atoms present	5996-17-8	C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)OP(=O)([O-])[O-].[K+].[K+]	{2: 1, 3: 4, 20: 4, 22: 1, 26: 1, 29: 3}
Did not match all atoms present	59960-90-6	CCN(CC)CC(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 2, 2: 3, 3: 1, 33: 1, 14: 10, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	59962-29-7	CC1=CC(=C(C=C1Cl)C)S	{1: 2, 39: 1, 14: 2, 17: 1}
Did not match all atoms present	59965-27-4	CCC1=CC2=C(C3=CC=CC=C3C=C2)C4=CC=CC=C41	{1: 1, 2: 1, 14: 11}
Did not match all atoms present	59970-88-6	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 11, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	59972-95-1	CCCCCCCCCCCCCCOP(=O)(C1=CC=CC=C1)OCCCCCCCCCCCCCC	{1: 2, 2: 26, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	59978-65-3	[S-2].[S-2].[S-2].[S-2].[Fe+3].[Ni+2].[Ni+2].[Ni+2].[Ni+2]	{}
Did not match all atoms present	59986-55-9	CCCCCCCCCC1=C/C(=C(/C2=CC=CC=C2)\NO)/C(=O)C(=C1)Cl	{1: 1, 2: 8, 7: 1, 14: 7, 15: 3, 17: 1, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	59988-01-1	CCS(=O)(=O)NC1=CC(=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)OC.CS(=O)(=O)O	{1: 3, 2: 1, 35: 1, 14: 11, 20: 1, 22: 1, 29: 4, 31: 2}
Did not match all atoms present	59991-56-9	CC(=O)C=C(C(F)(F)F)[O-].CC(=O)C=C(C(F)(F)F)[O-].CC(=O)C=C(C(F)(F)F)[O-].[Pr+3]	{1: 3, 4: 3, 6: 3, 7: 3, 16: 9, 24: 3}
Did not match all atoms present	59994-21-7	CC(=O)CC(=O)NC1=CC=CC(=C1)N.Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 2, 30: 1, 31: 1}
Did not match all atoms present	60-02-6	C1CCCN(CCC1)CCN=C(N)N.C1CCCN(CCC1)CCN=C(N)N.OS(=O)(=O)O	{33: 2, 2: 4, 7: 2, 11: 14, 34: 2, 20: 2, 29: 2, 30: 4}
Did not match all atoms present	60-09-3	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N	{34: 2, 30: 1, 14: 9}
Did not match all atoms present	60-10-6	C1=CC=C(C=C1)NNC(=S)N=NC2=CC=CC=C2	{34: 2, 31: 2, 14: 10, 7: 1}
Did not match all atoms present	60-11-7	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 2, 34: 2, 14: 9, 33: 1}
Did not match all atoms present	60-12-8	C1=CC=C(C=C1)CCO	{2: 2, 20: 1, 14: 5}
Did not match all atoms present	60-18-4	C1=CC(=CC=C1C[C@@H](C(=O)O)N)O	{2: 1, 3: 1, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	60-19-5	C1=CC(=CC=C1CCN)O.Cl	{17: 1, 2: 2, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	60-25-3	C[N+](C)(C)CCCCCC[N+](C)(C)C.[Cl-].[Cl-]	{1: 6, 2: 6, 17: 2}
Did not match all atoms present	60-26-4	C[N+](C)(C)CCCCCC[N+](C)(C)C	{1: 6, 2: 6}
Did not match all atoms present	60-31-1	CC(=O)OCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 2, 28: 1, 17: 1}
Did not match all atoms present	60-41-3	C1CN2CC3=CCOC4CC(=O)N5C6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75.C1CN2CC3=CCOC4CC(=O)N5C6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75.OS(=O)(=O)O	{33: 4, 11: 12, 12: 10, 13: 2, 14: 10, 15: 2, 20: 2, 23: 2, 25: 2, 29: 2}
Did not match all atoms present	60-44-6	CC[N+](C)(CC)CCOC(=O)C(C1CCCC1)(C2=CC=CS2)O.[Br-]	{1: 3, 2: 4, 4: 1, 41: 1, 11: 4, 12: 1, 14: 3, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	60-46-8	CC(CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)N(C)C	{1: 3, 2: 1, 3: 1, 4: 1, 33: 1, 14: 10, 24: 1, 30: 1}
Did not match all atoms present	60-49-1	CC[N+](CC)(CC)CCC(C1CCCCC1)(C2=CC=CC=C2)O	{1: 3, 2: 5, 4: 1, 11: 5, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	60-51-5	CNC(=O)CSP(=S)(OC)OC	{1: 3, 2: 1, 40: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	60-54-8	C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O	{1: 3, 33: 1, 11: 1, 12: 3, 13: 2, 14: 3, 15: 4, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	60-56-0	CN1C=CNC1=S	{32: 1, 1: 1, 14: 2, 33: 1}
Did not match all atoms present	60-70-8	C[C@H]1C[C@H]([C@@H](NC1)[C@@H](C)C2=C(C3=C(C=C2)[C@@H]4CC=C5C[C@H](CC[C@@]5([C@H]4C3)C)O)C)O	{32: 1, 1: 4, 3: 1, 11: 7, 12: 6, 13: 1, 14: 3, 15: 1, 20: 2}
Did not match all atoms present	60-79-7	C[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C	{32: 1, 1: 2, 2: 1, 3: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	60-80-0	CC1=CC(=O)N(N1C)C2=CC=CC=C2	{1: 2, 33: 2, 14: 6, 25: 1}
Did not match all atoms present	60-81-1	C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O	{2: 3, 12: 5, 14: 6, 20: 4, 21: 3, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	60-82-2	C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)O	{24: 1, 2: 2, 21: 4, 14: 6}
Did not match all atoms present	60-87-7	CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)N(C)C	{1: 3, 2: 1, 3: 1, 33: 2, 41: 1, 14: 8}
Did not match all atoms present	60-89-9	CN1CCCC(C1)CN2C3=CC=CC=C3SC4=CC=CC=C42	{1: 1, 2: 1, 33: 2, 41: 1, 11: 4, 12: 1, 14: 8}
Did not match all atoms present	60-91-3	CCN(CC)CCN1C2=CC=CC=C2SC3=CC=CC=C31	{1: 2, 2: 4, 41: 1, 14: 8, 33: 2}
Did not match all atoms present	60-92-4	C1C2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)OP(=O)(O1)O	{33: 1, 35: 3, 11: 1, 12: 4, 14: 2, 20: 2, 23: 3, 29: 1, 30: 1}
Did not match all atoms present	60-99-1	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)OC)CN(C)C	{1: 4, 2: 2, 3: 1, 33: 2, 41: 1, 14: 7, 22: 1}
Did not match all atoms present	600-28-2	CC1=C(NC=C1)C	{32: 1, 1: 2, 14: 2}
Did not match all atoms present	600-29-3	CC1=CC=CN1C	{1: 2, 14: 3, 33: 1}
Did not match all atoms present	6000-44-8	C(C(=O)[O-])N.[Na+]	{24: 1, 2: 1, 30: 1}
Did not match all atoms present	60006-11-3	CC1=C(C=C(C=C1)NC(=O)N2CCCC2)NC(=O)N3CCCC3	{1: 1, 33: 2, 11: 8, 14: 3, 24: 2, 31: 2}
Did not match all atoms present	60010-51-7	C(C(Cl)(Cl)Cl)OP(Cl)Cl	{17: 5, 2: 1, 4: 1, 22: 1}
Did not match all atoms present	60033-54-7	CCCCCCCCCCCC(=O)C1=CC(=C(C=C1)C)NC(=O)C2=C/C(=N\NC3=CC=C(C=C3)S(=O)(=O)N(CC)C4=CC(=CC(=C4)C(=O)OC)C(=O)OC)/C5=CC=CC=C5C2=O	{1: 5, 2: 11, 33: 1, 34: 1, 14: 15, 15: 2, 24: 2, 25: 1, 28: 2, 29: 2, 31: 2}
Did not match all atoms present	60034-28-8	C/C=C/C(=O)N=C=S	{8: 1, 1: 1, 34: 1, 6: 2, 24: 1}
Did not match all atoms present	60037-51-6	COCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)OC)OC	{1: 3, 2: 1, 35: 3, 33: 1, 12: 4, 14: 2, 22: 3, 23: 1, 30: 1}
Did not match all atoms present	6004-24-6	CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.O.[Cl-]	{1: 1, 2: 15, 33: 1, 14: 5, 17: 1}
Did not match all atoms present	6004-98-4	C[N+]1(CCN(CC1)CC(C2CCCCC2)(C3=CC=CC=C3)O)C	{1: 2, 2: 1, 4: 1, 33: 1, 11: 9, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	60040-13-3	CCCCC1=CC=C(C=C1)C2=CC=C(C=C2)N	{1: 1, 2: 3, 30: 1, 14: 8}
Did not match all atoms present	60041-25-0	CC([Sn](C)(C)C)[Sn](C)(C)C	{1: 7, 3: 1}
Did not match all atoms present	60044-33-9	CCCCCCCCCC1=CC(=C(C=C1)O)Cl	{1: 1, 2: 8, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	60045-27-4	C1=CC=C(C=C1)CCCOC(=O)CCC2=CC=CC=C2	{2: 5, 28: 1, 14: 10}
Did not match all atoms present	60050-37-5	C1COCCN1CN2C(=O)CC(C2=O)C3=CC(=CC=C3)Br	{33: 2, 2: 1, 11: 5, 12: 1, 14: 4, 18: 1, 23: 1, 25: 2}
Did not match all atoms present	60058-13-1	C1CC2=CC=CC3=C2C=CC=C3CCC4=CC=C1C=C4	{11: 4, 14: 10}
Did not match all atoms present	6006-90-2	CCCCCCCCCCCCC(CCCCCCCCCCCC)C1=CC=CC=C1	{1: 2, 2: 22, 3: 1, 14: 5}
Did not match all atoms present	60062-60-4	CCCC12CO[Sb](OC1)OC2	{1: 1, 2: 2, 11: 3, 13: 1, 23: 3}
Did not match all atoms present	6007-71-2	CC1C=CCS1(=O)=O	{1: 1, 11: 1, 12: 1, 29: 2, 14: 2}
Did not match all atoms present	60073-67-8	B(NP(F)F)(F)F	{16: 4, 31: 1}
Did not match all atoms present	60075-23-2	COC1=C(C=C(C=C1)CC(=O)NN)OC	{1: 2, 2: 1, 14: 3, 22: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	60075-64-1	CCOC(=O)OCC1=CC=C(C=C1)I	{1: 1, 2: 2, 19: 1, 14: 4}
Did not match all atoms present	60075-65-2	CC(C)COC(=O)OCC1=CC=C(C=C1)I	{19: 1, 1: 2, 2: 2, 3: 1, 14: 4}
Did not match all atoms present	60075-67-4	CCCCCOC(=O)OCC1=CC=C(C=C1)I	{1: 1, 2: 5, 19: 1, 14: 4}
Did not match all atoms present	60075-68-5	CCCCCCOC(=O)OCC1=CC=C(C=C1)I	{1: 1, 2: 6, 19: 1, 14: 4}
Did not match all atoms present	60075-70-9	CC(C)CC(C)OC(=O)OCC1=CC=C(C=C1)I	{19: 1, 1: 3, 2: 2, 3: 2, 14: 4}
Did not match all atoms present	60075-76-5	CCOC(=O)OCCC1=CC=C(C=C1)I	{1: 1, 2: 3, 19: 1, 14: 4}
Did not match all atoms present	60075-83-4	CC(C)OC(=O)OCCC(C)C1=CC=C(C=C1)I	{19: 1, 1: 3, 2: 2, 3: 2, 14: 4}
Did not match all atoms present	60075-86-7	CCCCOC(=O)OCC(CC)CC1=CC=C(C=C1)I	{19: 1, 1: 2, 2: 6, 3: 1, 14: 4}
Did not match all atoms present	6008-36-2	CCCCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 7, 14: 5}
Did not match all atoms present	60084-10-8	C1=C(N=C(S1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)C(=O)N	{2: 1, 35: 1, 41: 1, 12: 4, 14: 1, 20: 3, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	60086-22-8	CN1CCC(=C2C3=CC=CC=C3OC4=C2C=C(C=C4)Cl)CC1.CS(=O)(=O)O	{1: 2, 33: 1, 11: 4, 14: 7, 15: 2, 17: 1, 20: 1, 23: 1, 29: 2}
Did not match all atoms present	6009-67-2	CCN(CC)CCC1(C2=CC=CC=C2OC1=O)C3=CC=CC=C3	{1: 2, 2: 4, 33: 1, 13: 1, 14: 9, 28: 1}
Did not match all atoms present	6009-70-7	C(=O)(C(=O)[O-])[O-].[NH4+].[NH4+].O	{24: 2}
Did not match all atoms present	6009-81-0	CN1CCC23C4C1CC5=C2C(=C(C=C5)O)OC3C(C=C4)O.O	{1: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	60093-93-8	C1=C(C=C(C(=C1Cl)OCOCOC2=C(C=C(C=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 2: 2, 22: 3, 14: 4}
Did not match all atoms present	60096-27-7	CC1(CC2=CC=CC=C2[Se]1)C	{1: 2, 11: 1, 13: 1, 14: 4}
Did not match all atoms present	601-84-3	C1=CC(=C(C(=C1)Br)C(=O)O)Br	{18: 2, 27: 1, 14: 3}
Did not match all atoms present	601-88-7	C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])Cl	{17: 2, 38: 1, 14: 3}
Did not match all atoms present	601-89-8	C1=CC(=C(C(=C1)O)[N+](=O)[O-])O	{38: 1, 21: 2, 14: 3}
Did not match all atoms present	60108-72-7	C1=CC=C(C=C1)C2=CC(=C(C=C2)Br)Br	{18: 2, 14: 8}
Did not match all atoms present	60111-69-5	C[Si](C)(C)C([Si](C)(C)C)[GeH2]C([Si](C)(C)C)[Si](C)(C)C	{1: 12, 3: 2}
Did not match all atoms present	60112-98-3	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1CC(CC(C1)CN)CN.C1C(O1)CCl	{1: 2, 2: 3, 4: 1, 11: 5, 12: 3, 14: 8, 17: 1, 21: 2, 23: 1, 30: 2}
Did not match all atoms present	6012-97-1	C1(=C(SC(=C1Cl)Cl)Cl)Cl	{17: 4, 41: 1}
Did not match all atoms present	60131-40-0	[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O.[Na+]	{24: 1, 27: 1, 3: 2, 20: 2}
Did not match all atoms present	60135-06-0	CN1C2=C(C(=O)N(C1=O)C)NC=N2.COC(CC1=CC=CC2=C1OC(=O)C(=C2)C(=O)[O-])C[Hg].O.[Na+]	{32: 1, 1: 3, 2: 2, 3: 1, 33: 2, 14: 5, 35: 1, 22: 1, 24: 1, 25: 2, 28: 1}
Did not match all atoms present	60135-93-5	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(COCCO)O	{2: 4, 27: 2, 20: 2, 22: 1, 14: 4}
Did not match all atoms present	60143-55-7	CC(=O)C(C(=O)NC1=C(C=C(C=C1)OC)OC)N=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)O	{1: 3, 34: 4, 3: 1, 14: 11, 20: 1, 22: 2, 24: 2, 29: 2, 31: 1}
Did not match all atoms present	60144-50-5	C1CC2=C3CCC4=C1C5=C6CCC(=C2CC5)C7=C3CCC4=C6CC7	{11: 12}
Did not match all atoms present	60145-20-2	C1=CC(=C(C(=C1)Cl)Cl)C2=CC(=CC(=C2Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	60145-23-5	C1=C(C=C(C(=C1Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 14: 3}
Did not match all atoms present	60148-52-9	CC1(C(C12C=CC3=CC=CC=C23)C(=O)OC(C#N)C4=CC(=CC=C4)OC5=CC=CC=C5)C	{1: 2, 3: 1, 37: 1, 12: 1, 13: 2, 14: 15, 22: 1, 28: 1}
Did not match all atoms present	6016-51-9	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC=C(C=C2)N3C(=O)C(C(=N3)OCC)SC4=NN=NN4C5=CC=CC=C5	{1: 3, 2: 16, 3: 1, 33: 2, 40: 1, 12: 1, 14: 13, 15: 1, 35: 4, 22: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	60162-06-3	C[Si]1(O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)C.C[Si](C)(C=C)O[Si](C)(C)C=C	{1: 12, 22: 1, 5: 2, 6: 2, 23: 4}
Did not match all atoms present	60163-90-8	CCCCC(CC)COC(=O)C(=C)C.CC(=C)C(=O)OC.C=CC1=CC=CC=C1	{1: 5, 2: 5, 3: 1, 5: 3, 6: 1, 7: 2, 14: 5, 28: 2}
Did not match all atoms present	60166-93-0	C[C@@H](C(=O)NC1=C(C(=C(C(=C1I)C(=O)NC(CO)CO)I)C(=O)NC(CO)CO)I)O	{1: 1, 2: 4, 3: 3, 19: 3, 20: 5, 24: 3, 31: 3}
Did not match all atoms present	60168-88-9	C1=CC=C(C(=C1)C(C2=CC=C(C=C2)Cl)(C3=CN=CN=C3)O)Cl	{17: 2, 35: 2, 4: 1, 14: 11, 20: 1}
Did not match all atoms present	60172-03-4	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CCCCCC(=O)NC3=CC=C(C=C3)NC4=CC=[N+](C=C4)CC.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O	{1: 2, 2: 7, 33: 2, 14: 16, 17: 2, 24: 2, 29: 8, 31: 4}
Did not match all atoms present	60172-05-6	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CCCCCCC(=O)NC3=CC=C(C=C3)NC4=CC=[N+](C=C4)CC.[Br-].[Br-]	{1: 2, 2: 8, 33: 2, 14: 16, 18: 2, 24: 2, 31: 4}
Did not match all atoms present	60172-15-8	CCC[N+]1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C34CCC(CC3)(CC4)C(=O)NC5=CC=C(C=C5)C(=O)NC6=CC=[N+](C=C6)CCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 11: 6, 13: 2, 14: 24, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	60172-61-4	[Mg+2].[OH-]	{}
Did not match all atoms present	60175-01-1	[F-].[Mg+2].[Cl-]	{16: 1, 17: 1}
Did not match all atoms present	6018-32-2	CC(=O)NC1=CC(=CC=C1)[As](=O)(O)[O-].[Na+]	{1: 1, 14: 4, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	6018-41-3	COC(=O)C1=COC(=O)C=C1	{1: 1, 28: 2, 14: 3}
Did not match all atoms present	6018-89-9	CC(=O)[O-].CC(=O)[O-].O.O.O.O.[Ni+2]	{24: 2, 1: 2}
Did not match all atoms present	6018-94-6	C(=O)(C(=O)[O-])[O-].O.O.[Ni+2]	{24: 2}
Did not match all atoms present	60187-22-6	C=[Ni]	{5: 1}
Did not match all atoms present	60189-99-3	O[As](O)[O-].[Na+]	{20: 2, 29: 1}
Did not match all atoms present	60196-94-3	CC1=C(C=C(C=C1)NC(=O)N(CCCl)N=O)NC(=O)N(CCCl)N=O	{1: 1, 2: 4, 33: 2, 34: 2, 14: 3, 17: 2, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	602-01-7	CC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 3}
Did not match all atoms present	602-03-9	C1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])N	{38: 2, 30: 1, 14: 3}
Did not match all atoms present	602-27-7	CC1=CC(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])C)[N+](=O)[O-]	{1: 2, 38: 3, 14: 1}
Did not match all atoms present	602-29-9	CC1=C(C(=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 2}
Did not match all atoms present	602-37-9	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=CC=C2)Cl	{17: 1, 38: 1, 14: 6}
Did not match all atoms present	602-38-0	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=CC=C2)[N+](=O)[O-]	{38: 2, 14: 6}
Did not match all atoms present	602-41-5	CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O	{1: 4, 2: 1, 40: 1, 11: 2, 12: 6, 14: 4, 20: 4, 22: 3, 23: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	602-52-8	CC[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=CC=C4)N)N.[Cl-]	{1: 1, 2: 1, 33: 1, 14: 11, 17: 1, 30: 2}
Did not match all atoms present	602-55-1	C1=CC=C(C=C1)C2=C3C=CC=CC3=CC4=CC=CC=C42	{14: 14}
Did not match all atoms present	602-56-2	C1=CC=C(C=C1)C2=C3C=CC=CC3=NC4=CC=CC=C42	{35: 1, 14: 13}
Did not match all atoms present	602-60-8	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	602-64-2	C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)O	{25: 2, 21: 3, 14: 5}
Did not match all atoms present	602-65-3	C1=CC2=C(C=C1O)C(=O)C3=C(C2=O)C=CC(=C3O)O	{25: 2, 21: 3, 14: 5}
Did not match all atoms present	602-82-4	C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)C(=O)O)C(=O)O	{24: 1, 27: 2, 14: 8}
Did not match all atoms present	602-85-7	CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)CO	{32: 1, 1: 1, 2: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 20: 1}
Did not match all atoms present	602-87-9	C1CC2=CC=CC3=C(C=CC1=C23)[N+](=O)[O-]	{11: 2, 38: 1, 14: 5}
Did not match all atoms present	602-88-0	C1=CC=C(C=C1)C(=O)N(C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3	{24: 3, 33: 1, 14: 15}
Did not match all atoms present	602-94-8	C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)O	{16: 5, 27: 1}
Did not match all atoms present	602-96-0	CC1=C(C(=C(C(=C1[N+](=O)[O-])C)[N+](=O)[O-])C)[N+](=O)[O-]	{1: 3, 38: 3}
Did not match all atoms present	602-99-3	CC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O)[N+](=O)[O-]	{1: 1, 38: 3, 21: 1, 14: 1}
Did not match all atoms present	6020-87-7	CN(CC(=O)O)C(=N)N.O	{1: 1, 2: 1, 36: 1, 33: 1, 7: 1, 27: 1, 30: 1}
Did not match all atoms present	60207-90-1	CCCC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)Cl)Cl	{1: 1, 2: 3, 35: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 5, 17: 2, 23: 2}
Did not match all atoms present	60207-93-4	CCC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)Cl)Cl	{1: 1, 2: 2, 35: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 5, 17: 2, 23: 2}
Did not match all atoms present	60211-57-6	C1=C(C=C(C=C1Cl)Cl)CO	{17: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	6022-22-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3C4=CC(=C(C5=C4C(=O)C6=CC=CC=C6C5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{25: 4, 30: 2, 29: 6, 14: 10}
Did not match all atoms present	60222-99-3	CCOCCCC1=CC=CC=C1	{1: 1, 2: 4, 22: 1, 14: 5}
Did not match all atoms present	60223-52-1	COC1=CC2=C3C4=C(C=CC(=C4)OC)C5=C(C3=C6C=C(C=CC6=C2C=C1)OC)C=C(C=C5)OC	{1: 4, 22: 4, 14: 12}
Did not match all atoms present	6023-26-3	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].[K+]	{1: 1, 33: 1, 11: 1, 14: 7, 24: 1, 29: 1}
Did not match all atoms present	6023-29-6	CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCOCC2.CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCOCC2.Cl[Zn-2](Cl)(Cl)Cl	{1: 4, 2: 4, 33: 2, 11: 8, 34: 2, 14: 4, 17: 4, 22: 4, 23: 2}
Did not match all atoms present	6023-46-7	C1=CC=C(C=C1)CC(C#N)(C#N)C#N	{2: 1, 4: 1, 37: 3, 14: 5}
Did not match all atoms present	60232-85-1	C1CCC(CC1)(C2=CC=CC=C2)N3CCC(CC3)O	{33: 1, 11: 9, 12: 1, 13: 1, 14: 5, 20: 1}
Did not match all atoms present	60233-24-1	C1=CC(=CC(=C1)Cl)C2=C(C=C(C=C2Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	60233-31-0	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)N3C=NC(=N3)Cl)C(C)(C)CC	{1: 9, 2: 5, 3: 1, 4: 3, 33: 1, 14: 7, 17: 2, 35: 2, 22: 1, 24: 3, 31: 2}
Did not match all atoms present	60233-65-0	C1=C(C=C2C(=C1Cl)NN=NC2=O)Cl	{32: 1, 17: 2, 35: 2, 14: 2, 25: 1}
Did not match all atoms present	60240-47-3	COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC.C(CNC(=S)[S-])NC(=S)[S-].C(CNC(=S)[S-])NC(=S)[S-].[Mn+2].[Zn+2]	{1: 2, 2: 4, 7: 6, 14: 4, 28: 2, 31: 8}
Did not match all atoms present	60246-14-2	C1=CC=C2C(=C1)C(=CN=N2)C=CC3=CC(=CC=C3)[N+](=O)[O-]	{38: 1, 35: 2, 14: 9, 6: 2}
Did not match all atoms present	60247-55-4	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)OC3=CC=C(C=C3)C(=O)O	{1: 5, 2: 15, 3: 2, 4: 1, 14: 11, 17: 1, 22: 2, 24: 3, 27: 1, 31: 2}
Did not match all atoms present	6025-45-2	C1=CC(=CC(=C1)[O-])[O-].[Na+].[Na+]	{14: 4}
Did not match all atoms present	6025-53-2	CC(=CCNC1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)CO	{1: 1, 2: 3, 35: 3, 33: 1, 6: 1, 7: 1, 12: 4, 14: 2, 20: 4, 23: 1, 31: 1}
Did not match all atoms present	6025-60-1	C1=CC=C(C(=C1)N)N2C=CC=C2	{33: 1, 30: 1, 14: 8}
Did not match all atoms present	60254-95-7	COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(C3=CC=CC=C3)O	{32: 1, 1: 1, 3: 1, 14: 8, 35: 1, 20: 1, 28: 1, 31: 1}
Did not match all atoms present	6026-42-2	CC(C)N[Si](C)(C)NC(C)C	{1: 6, 3: 2, 31: 2}
Did not match all atoms present	6026-43-3	CCCCN[Si](C)(C)NCCCC	{1: 4, 2: 6, 31: 2}
Did not match all atoms present	6026-63-7	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Tm+3].[Tm+3]	{24: 3}
Did not match all atoms present	60268-12-4	CC(C)(C[Sn](=O)CC(C)(C)C1=CC=CC=C1)C2=CC=CC=C2	{1: 4, 2: 2, 4: 2, 29: 1, 14: 10}
Did not match all atoms present	6027-28-7	CCCC[NH2+]CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 2, 2: 4, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	60273-78-1	CCCCC(=NNC(=S)SC)CCCC	{1: 3, 2: 6, 7: 2, 40: 1, 34: 1, 31: 1}
Did not match all atoms present	60278-98-0	CN(CC1=CC=CC=C1)CC(CO)O	{1: 1, 2: 3, 3: 1, 33: 1, 14: 5, 20: 2}
Did not match all atoms present	6028-89-3	CC1=CC=C(C=C1)C(=O)C=CC2=CC=CS2	{24: 1, 1: 1, 14: 7, 6: 2, 41: 1}
Did not match all atoms present	6028-92-8	C1=CSC(=C1)C=CC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{24: 1, 41: 1, 38: 1, 14: 7, 6: 2}
Did not match all atoms present	60285-31-6	C1=CC=C(C=C1)NC(=O)N(C2=CC=CC=C2)N=O	{33: 1, 34: 1, 14: 10, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	603-00-9	CC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)O	{1: 3, 2: 1, 3: 1, 33: 3, 14: 1, 35: 1, 20: 1, 25: 2}
Did not match all atoms present	603-02-1	CC1=C(C(=C(C=C1)[N+](=O)[O-])C)[N+](=O)[O-]	{1: 2, 38: 2, 14: 2}
Did not match all atoms present	603-11-2	C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O	{27: 2, 38: 1, 14: 3}
Did not match all atoms present	603-13-4	C1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 3}
Did not match all atoms present	603-15-6	CC1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 2}
Did not match all atoms present	603-17-8	CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)OC/C=C(\C)/CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(=O)OC)C	{32: 2, 1: 11, 2: 13, 3: 3, 5: 1, 6: 2, 7: 1, 12: 3, 14: 3, 35: 2, 25: 1, 28: 2}
Did not match all atoms present	603-32-7	C1=CC=C(C=C1)[As](C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	603-33-8	C1=CC=C(C=C1)[Bi](C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	603-34-9	C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC=C3	{33: 1, 14: 15}
Did not match all atoms present	603-35-0	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	603-36-1	C1=CC=C(C=C1)[Sb](C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	603-37-2	CC1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 3: 1, 14: 14}
Did not match all atoms present	603-38-3	C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)N	{3: 1, 30: 1, 14: 14}
Did not match all atoms present	603-44-1	C1=CC(=CC=C1C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)O	{3: 1, 21: 3, 14: 12}
Did not match all atoms present	603-45-2	C1=CC(=O)C=CC1=C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O	{25: 1, 15: 1, 21: 2, 14: 12, 7: 1}
Did not match all atoms present	603-48-5	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C	{1: 6, 3: 1, 14: 12, 33: 3}
Did not match all atoms present	603-50-9	CC(=O)OC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC(=O)C)C3=CC=CC=N3	{1: 2, 3: 1, 28: 2, 14: 12, 35: 1}
Did not match all atoms present	603-51-0	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NN	{24: 1, 33: 1, 30: 1, 14: 10, 31: 1}
Did not match all atoms present	603-52-1	CCOC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 28: 1, 14: 10, 33: 1}
Did not match all atoms present	603-53-2	C1=CC=C(C=C1)N=C(N)N(C2=CC=CC=C2)C3=CC=CC=C3	{33: 1, 34: 1, 30: 1, 14: 15, 7: 1}
Did not match all atoms present	603-54-3	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)N	{24: 1, 33: 1, 30: 1, 14: 10}
Did not match all atoms present	603-62-3	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)NC2=O	{32: 1, 25: 2, 38: 1, 14: 3}
Did not match all atoms present	603-71-4	CC1=CC(=C(C(=C1)C)[N+](=O)[O-])C	{1: 3, 38: 1, 14: 2}
Did not match all atoms present	603-72-5	C1=CC2=C3C(=C1)NS(=O)(=O)C3=CC=C2	{32: 1, 29: 2, 14: 6}
Did not match all atoms present	603-76-9	CN1C=CC2=CC=CC=C21	{1: 1, 14: 6, 33: 1}
Did not match all atoms present	603-79-2	CC1=CC=CC(=C1C)C(=O)O	{1: 2, 27: 1, 14: 3}
Did not match all atoms present	603-81-6	C1=CC(=C(C(=C1)N)N)C(=O)O	{27: 1, 30: 2, 14: 3}
Did not match all atoms present	603-83-8	CC1=C(C=CC=C1[N+](=O)[O-])N	{1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	603-85-0	C1=CC(=C(C(=C1)O)N)[N+](=O)[O-]	{30: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	603-86-1	C1=CC(=C(C(=C1)Cl)O)[N+](=O)[O-]	{17: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	6030-03-1	CCC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N(C)C)C	{1: 4, 2: 1, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	6030-80-4	C[C@]12CC[C@H]3C(=CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5)[C@@H]1CCC2=O	{1: 1, 11: 5, 12: 2, 13: 1, 14: 9, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	60302-02-5	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NC3=CC=CC4=CC=CC=C43	{24: 1, 33: 1, 14: 17, 31: 1}
Did not match all atoms present	60306-50-5	CCCCCCCC/C=C\CCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 21, 6: 2, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	6031-02-3	CCCCC(C)C1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5}
Did not match all atoms present	6031-41-0	CCC(C)[Sn](C(C)CC)(C(C)CC)C(C)CC	{1: 8, 2: 4, 3: 4}
Did not match all atoms present	6031-86-3	CN1CC[C@]23CCCCC2[C@H]1CC4=C3C=C(C=C4)OC	{1: 2, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 22: 1}
Did not match all atoms present	60311-02-6	C1CC2=C3C(=C4C(=C2)C(=C5C=C6CCC[N+]7=C6C(=C5O4)CCC7)C8=C(C=C(C=C8)S(=O)(=O)O)S(=O)(=O)[O-])CCCN3C1	{33: 2, 11: 12, 14: 5, 15: 1, 20: 1, 23: 1, 29: 5}
Did not match all atoms present	60315-52-8	CN1CCC2=C1N(C3=CC=CC=C3C2=O)CC(=O)C4=CC=C(C=C4)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 33: 2, 11: 2, 14: 8, 24: 1, 25: 1}
Did not match all atoms present	60316-43-0	CNC1=CC=CC2=C1C(=O)C3=C(C2=O)C=CC=C3NC	{1: 2, 31: 2, 14: 6, 25: 2}
Did not match all atoms present	60317-40-0	CCCCCCCCCCCC[Si](C)(OCC)OCC	{1: 4, 2: 13, 22: 2}
Did not match all atoms present	60323-52-6	C1CC2=C3CCC3=C4CCC4=C21	{11: 6}
Did not match all atoms present	60324-59-6	CNC/C=C(/C1=CC=C(C=C1)Br)\C2=CN=CC=C2	{1: 1, 2: 1, 35: 1, 6: 1, 7: 1, 14: 8, 18: 1, 31: 1}
Did not match all atoms present	60325-46-4	CS(=O)(=O)NC(=O)CCC/C=C\C[C@@H]1[C@H]([C@@H](CC1=O)O)/C=C/[C@H](COC2=CC=CC=C2)O	{1: 1, 2: 5, 3: 1, 6: 4, 11: 1, 12: 3, 14: 5, 20: 2, 22: 1, 24: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	6033-07-4	CCN(CC)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 6, 2: 2, 33: 1, 14: 4, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	60345-95-1	C1(=NN=N[N-]1)[N+](=O)[O-].C1(=NN=N[N-]1)[N+](=O)[O-].[Hg+2]	{35: 8, 38: 2}
Did not match all atoms present	60345-97-3	C1=CC(=CC(=C1)OCCO)C=O	{2: 2, 26: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	60347-66-2	[NH4+].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ag+]	{}
Did not match all atoms present	60348-60-9	C1=CC(=C(C=C1Br)Br)OC2=CC(=C(C=C2Br)Br)Br	{18: 5, 22: 1, 14: 5}
Did not match all atoms present	6035-40-1	CN1CCC2=CC3=C(C(=C2C1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OC)OCO3	{1: 4, 33: 1, 11: 3, 12: 2, 14: 3, 22: 3, 23: 2, 28: 1}
Did not match all atoms present	6035-49-0	COC1=C(C(=C2C(=C1)C=CC(=O)O2)OC)OC	{1: 3, 28: 1, 22: 3, 14: 3}
Did not match all atoms present	6035-52-5	C([C@@H]([C@@H]([C@H](C(=O)COP(=O)([O-])[O-])O)O)O)OP(=O)([O-])[O-].[Ba+2].[Ba+2]	{2: 2, 3: 3, 20: 3, 22: 2, 24: 1, 29: 6}
Did not match all atoms present	6035-54-7	C([C@H]([C@H]([C@@H](C(=O)CO)O)O)O)OP(=O)([O-])[O-].[Ba+2]	{2: 2, 3: 3, 20: 4, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	6035-55-8	C([C@H]([C@H]([C@@H](C(=O)CO)O)O)O)OP(=O)([O-])[O-].[Mg+2]	{2: 2, 3: 3, 20: 4, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	6035-94-5	CC(=O)O.C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N	{1: 1, 36: 1, 7: 1, 14: 12, 15: 2, 27: 1, 30: 2}
Did not match all atoms present	60350-49-4	CCOC(=O)C=C.CC(=C)C(=O)O.COC(=O)C=C.C=CC(=O)[O-].[NH4+]	{1: 3, 2: 1, 5: 4, 6: 3, 7: 1, 24: 1, 27: 1, 28: 2}
Did not match all atoms present	60354-76-9	C1=CC=C2C(=C1)C3=C4C2=CC=CC4=C(C=C3)N5C(=O)C=CC5=O	{25: 2, 14: 11, 33: 1}
Did not match all atoms present	60357-67-7	[C-]#[N+]C1=CC(=CC(=C1)Cl)Cl	{17: 2, 34: 1, 14: 3}
Did not match all atoms present	6036-64-2	C1(=C(N=C(N=C1Cl)N)N)[N+](=O)[O-]	{17: 1, 35: 2, 38: 1, 30: 2}
Did not match all atoms present	6036-95-9	CN(C)CCN(CC1=CC=C(C=C1)OC)C2=CC=CC=N2.Cl	{1: 3, 2: 3, 35: 1, 33: 2, 14: 8, 17: 1, 22: 1}
Did not match all atoms present	6037-49-6	CO[Si](CC(CCN)CN)(OC)OC	{1: 3, 2: 4, 3: 1, 30: 2, 22: 3}
Did not match all atoms present	60376-08-1	CC(O)(P(=O)(O)[O-])P(=O)([O-])[O-].[K+].[K+].[K+]	{1: 1, 4: 1, 29: 5, 20: 2}
Did not match all atoms present	60378-89-4	CCO[Si](CCP(=O)(OCC)OCC)(OCC)OCC.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CO)O	{1: 5, 2: 9, 14: 4, 20: 2, 22: 5, 27: 2, 29: 1}
Did not match all atoms present	60385-06-0	CC1=C(C=CC(=C1)OC)N=C=O	{1: 2, 34: 1, 8: 1, 14: 3, 22: 1, 29: 1}
Did not match all atoms present	60387-29-3	C[As](C)[Si](F)(F)F	{16: 3, 1: 2}
Did not match all atoms present	60388-20-7	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)C(=O)O	{1: 2, 27: 1, 29: 3, 14: 8, 33: 1}
Did not match all atoms present	60388-24-1	CCN(CC)C1=CC=C(C=C1)N=NC2=NC3=C(C=CC=C3S2)C(F)(F)F	{1: 2, 2: 2, 35: 1, 4: 1, 33: 1, 41: 1, 34: 2, 14: 7, 16: 3}
Did not match all atoms present	60388-36-5	C1=CC(=C2C(=C1)SC(=N2)N)C(F)(F)F	{35: 1, 4: 1, 41: 1, 14: 3, 16: 3, 30: 1}
Did not match all atoms present	60388-53-6	CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O	{1: 1, 2: 3, 3: 1, 33: 1, 14: 5, 35: 4, 24: 1, 27: 2, 30: 2, 31: 1}
Did not match all atoms present	60397-73-1	CN(CCS(=O)(=O)O)C1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)OCCOC)N(C)CCS(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)OCCOC	{1: 4, 2: 8, 35: 6, 6: 2, 33: 2, 14: 6, 20: 4, 22: 4, 29: 8, 31: 2}
Did not match all atoms present	60398-22-3	CC[N+](C)(CC)C1=CC(=CC=C1)OC(=O)NC.[I-]	{1: 4, 2: 2, 14: 4, 19: 1, 28: 1, 31: 1}
Did not match all atoms present	60399-02-2	CNCC1=CC=CC=C1O.Cl	{1: 1, 2: 1, 14: 4, 17: 1, 21: 1, 31: 1}
Did not match all atoms present	604-32-0	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C5=CC=CC=C5)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 6, 15: 1, 28: 1}
Did not match all atoms present	604-44-4	C1=CC=C2C(=C1)C(=CC=C2Cl)O	{17: 1, 21: 1, 14: 6}
Did not match all atoms present	604-45-5	C1=CC=C(C=C1)N=C2N(C(=NC3=CC=CC=C3)N(C(=NC4=CC=CC=C4)N2C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7	{33: 3, 34: 3, 14: 30}
Did not match all atoms present	604-51-3	CN1C2CCC1CC(C2)OC3C4=CC=CC=C4CCC5=CC=CC=C35	{1: 1, 33: 1, 11: 6, 12: 4, 14: 8, 22: 1}
Did not match all atoms present	604-53-5	C1=CC=C2C(=C1)C=CC=C2C3=CC=CC4=CC=CC=C43	{14: 14}
Did not match all atoms present	604-58-0	C[C@]12CCC3=C([C@@H]1CCC2=O)C=CC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5	{1: 1, 11: 4, 12: 1, 13: 1, 14: 10, 25: 1, 28: 1}
Did not match all atoms present	604-59-1	C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C4=CC=CC=C4C=C3	{25: 1, 14: 12, 23: 1}
Did not match all atoms present	604-61-5	CCOC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	604-63-7	CCOCCOC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2	{1: 1, 2: 3, 14: 9, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	604-75-1	C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)O	{32: 1, 35: 1, 12: 1, 14: 8, 15: 1, 17: 1, 20: 1, 25: 1}
Did not match all atoms present	604-83-1	CC1=C(C2=CC=CC=C2C3=CC=CC=C13)C	{1: 2, 14: 8}
Did not match all atoms present	604-84-2	C1=CC=C2C(=C1)C3=CC=CC=C3C(=C2O)O	{21: 2, 14: 8}
Did not match all atoms present	604-88-6	CCC1=C(C(=C(C(=C1CC)CC)CC)CC)CC	{1: 6, 2: 6}
Did not match all atoms present	60404-18-4	C1=C(SC(=C1Br)Cl)Cl	{17: 2, 18: 1, 14: 1, 41: 1}
Did not match all atoms present	6041-28-7	C1=CSC(=C1)C=CC#N	{41: 1, 14: 3, 6: 2, 37: 1}
Did not match all atoms present	60413-57-2	CC(C)(C1=CC(=C(C(=C1)Br)OCCOC2=C(C=C(C=C2Br)Br)Br)Br)C3=CC(=C(C(=C3)Br)OCCOC4=C(C=C(C=C4Br)Br)Br)Br	{1: 2, 2: 4, 4: 1, 14: 8, 18: 10, 22: 4}
Did not match all atoms present	60427-18-1	COC1=CC2=C(C=C1CCC3=C(C=C(CC2)C(=C3)C#N)C#N)OC	{1: 2, 11: 4, 22: 2, 14: 4, 37: 2}
Did not match all atoms present	60431-34-7	C[C@H]1[C@H]([C@H]([C@@H](C(O1)O)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4	{1: 1, 2: 3, 12: 5, 14: 15, 20: 1, 22: 3, 23: 1}
Did not match all atoms present	60431-65-4	C1=CC=C2C(=C1)N(C(=S)S2)CNC3=CC=C(C=C3)[N+](=O)[O-]	{33: 1, 2: 1, 38: 1, 41: 1, 14: 8, 31: 1}
Did not match all atoms present	60434-71-1	CC1=CC=C(C=C1)S(=O)(=O)OCC(C)OS(=O)(=O)C2=CC=C(C=C2)C	{1: 3, 2: 1, 3: 1, 14: 8, 22: 2, 29: 4}
Did not match all atoms present	60434-95-9	C1=CC(=CC=C1C=NCCN=CC2=CC=C(C=C2)Cl)Cl	{17: 2, 2: 2, 34: 2, 14: 8, 6: 2}
Did not match all atoms present	6044-66-2	CCCCCCCCC1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)CCCCCCCC)CC4=CC=CC=C4	{1: 2, 2: 15, 41: 1, 14: 11, 33: 1}
Did not match all atoms present	60444-92-0	CCCCOC1=CC=CC=C1C(=O)N	{1: 1, 2: 3, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	60448-09-1	N[P+](N)(F)F	{16: 2, 30: 2}
Did not match all atoms present	60448-19-3	C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C6C(C5=CC=C4)O6	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	60450-78-4	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CCCCCC(=O)O)CCCCC(=O)O.C(CCO)CO	{2: 14, 27: 6, 20: 2, 14: 8}
Did not match all atoms present	60452-14-4	CCN(CC)CCN1C2=C(N=C1C(C3=CC=CC=C3)O)N(C(=O)N(C2=O)C)C.Cl	{1: 4, 2: 4, 3: 1, 33: 4, 14: 5, 17: 1, 35: 1, 20: 1, 25: 2}
Did not match all atoms present	60453-87-4	CNC1=CC=C(C=C1)[N+]#N.F[P-](F)(F)(F)(F)F	{16: 6, 1: 1, 34: 1, 14: 4, 31: 1}
Did not match all atoms present	60454-88-8	CC1CO1.C1CO1.OS(=O)(=O)O.OS(=O)(=O)O	{1: 1, 11: 3, 12: 1, 20: 4, 23: 2, 29: 4}
Did not match all atoms present	60459-08-7	O.[O-]S(=O)(=O)[O-].[Co+2]	{29: 4}
Did not match all atoms present	6046-93-1	CC(=O)[O-].CC(=O)[O-].O.[Cu+2]	{24: 2, 1: 2}
Did not match all atoms present	60462-51-3	C1=CC=C(C=C1)C=CC2=CC=C(C=C2)NO	{20: 1, 14: 9, 6: 2, 31: 1}
Did not match all atoms present	60468-54-4	CC1=C(C=CC=C1[N+](=O)[O-])CCl	{1: 1, 2: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	6047-01-4	C1=C(NC(=O)N=C1)N.Cl	{32: 1, 35: 1, 14: 2, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	6047-17-2	CCCCOCCCOC(=O)CCOC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 8, 14: 2, 17: 3, 22: 2, 28: 1}
Did not match all atoms present	6047-25-2	C(=O)(C(=O)[O-])[O-].O.O.[Fe+2]	{24: 2}
Did not match all atoms present	6047-29-6	C1CC2=CC=CC=C2NC(=O)C3=CC=CC=C31	{32: 1, 25: 1, 11: 2, 14: 8}
Did not match all atoms present	6047-69-4	CC=CCCC1=CC=CC=C1C	{1: 2, 2: 2, 14: 4, 6: 2}
Did not match all atoms present	6047-91-2	C1=COC(=C1)C(=O)C#N	{24: 1, 37: 1, 14: 3, 23: 1}
Did not match all atoms present	60474-62-6	CCCCCCCCCC1=CC(=C(C=C1)OC(=O)O)C2CCC3(C4CCC5(C(C4CC=C3C2)CCC5C(C)CCCC(C)C)C)C	{1: 6, 2: 11, 3: 2, 11: 8, 12: 5, 13: 2, 14: 4, 15: 1, 27: 1}
Did not match all atoms present	60476-40-6	CCCCCCCCCO.OP(=O)(O)O	{1: 1, 2: 8, 20: 4, 29: 1}
Did not match all atoms present	60479-65-4	C[C@@H](CO)N(CC1=CC=CC=C1)CC2=CC=CC=C2	{1: 1, 2: 3, 3: 1, 33: 1, 14: 10, 20: 1}
Did not match all atoms present	60479-97-2	CCCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C.C(=C\C(=O)O)\C(=O)O	{1: 3, 2: 5, 6: 2, 33: 2, 41: 1, 14: 7, 24: 1, 27: 2}
Did not match all atoms present	6048-29-9	C1=CC=C(C=C1)C(=O)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{24: 1, 2: 1, 18: 1, 14: 20}
Did not match all atoms present	6048-82-4	CCCCCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 8, 14: 5}
Did not match all atoms present	6048-83-5	COC(=O)C12CCCCC1CN(C2)CC3=CC=CC=C3	{1: 1, 2: 1, 33: 1, 11: 6, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	60485-76-9	CCN1C(=CC(=CC2=[N+](C3=C(S2)C=CC4=CC=CC=C43)CC)C)SC5=C1C6=CC=CC=C6C=C5.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 6: 2, 7: 1, 41: 2, 14: 16, 15: 1, 29: 3}
Did not match all atoms present	60487-81-2	C=C(C1=CC=CC=C1)C(OCC=CC2=CC=CC=C2)OCC=CC3=CC=CC=C3	{2: 2, 3: 1, 5: 1, 6: 4, 7: 1, 14: 15, 22: 2}
Did not match all atoms present	60494-19-1	CCCCCCCC[Sn](OC(=O)/C=C\C(=O)OC)(OC(=O)/C=C\C(=O)OC)CCCCCCCC	{1: 4, 2: 14, 28: 4, 6: 4}
Did not match all atoms present	605-01-6	CCC1=CC(=C(C(=C1CC)CC)CC)CC	{1: 5, 2: 5, 14: 1}
Did not match all atoms present	605-02-7	C1=CC=C(C=C1)C2=CC=CC3=CC=CC=C32	{14: 12}
Did not match all atoms present	605-03-8	C1=CC=C(C=C1)C2=CC=NC3=CC=CC=C23	{35: 1, 14: 11}
Did not match all atoms present	605-04-9	C1=CC=C(C=C1)C2=CC=CC3=C2N=CC=C3	{35: 1, 14: 11}
Did not match all atoms present	605-27-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]	{25: 2, 38: 1, 14: 7}
Did not match all atoms present	605-32-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)O	{25: 2, 21: 1, 14: 7}
Did not match all atoms present	605-36-7	C1=CC=C2C(C(C(C(C2=C1)Cl)Cl)Cl)Cl	{17: 4, 12: 4, 14: 4}
Did not match all atoms present	605-37-8	C1=CC2=C(C(=O)C(=O)C(=C2C=C1)O)O	{25: 2, 20: 2, 14: 4, 15: 2}
Did not match all atoms present	605-39-0	CC1=CC=CC=C1C2=CC=CC=C2C	{1: 2, 14: 8}
Did not match all atoms present	605-44-7	C1=CC2=C(C=C1N)C(=O)C3=C(C2=O)C=CC(=C3)N	{25: 2, 30: 2, 14: 6}
Did not match all atoms present	605-45-8	CC(C)OC(=O)C1=CC=CC=C1C(=O)OC(C)C	{1: 4, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	605-48-1	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2Cl)Cl	{17: 2, 14: 8}
Did not match all atoms present	605-50-5	CC(C)CCOC(=O)C1=CC=CC=C1C(=O)OCCC(C)C	{1: 4, 2: 4, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	605-54-9	CCOCCOC(=O)C1=CC=CC=C1C(=O)OCCOCC	{1: 2, 2: 6, 28: 2, 22: 2, 14: 4}
Did not match all atoms present	605-59-4	CC[N+]1=CC=C(C2=CC=CC=C21)C.[I-]	{1: 2, 2: 1, 19: 1, 14: 6, 33: 1}
Did not match all atoms present	605-60-7	C1=CC=C2C(=C1)C(=CC=C2O)N=O	{34: 1, 21: 1, 14: 6, 29: 1}
Did not match all atoms present	605-65-2	CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)Cl	{1: 2, 33: 1, 29: 2, 14: 6, 17: 1}
Did not match all atoms present	605-69-6	C1=CC=C2C(=C1)C(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 21: 1, 14: 5}
Did not match all atoms present	605-70-9	C1=CC=C2C(=C1)C(=CC=C2C(=O)O)C(=O)O	{27: 2, 14: 6}
Did not match all atoms present	605-71-0	C1=CC2=C(C=CC=C2[N+](=O)[O-])C(=C1)[N+](=O)[O-]	{38: 2, 14: 6}
Did not match all atoms present	605-75-4	CN1CCN(CC1)CCCN2C3=C(SC4=CC=CC=C24)C=CC(=C3)C(F)(F)F.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O	{1: 1, 2: 3, 4: 1, 6: 4, 33: 3, 41: 1, 11: 4, 14: 7, 16: 3, 27: 4}
Did not match all atoms present	605-79-8	C1=CC=C2C(=C1)C=CC=C2C3=C(C=CC4=CC=CC=C43)C=O	{26: 1, 14: 13}
Did not match all atoms present	605-82-3	CCC1C2=CC=CC=C2CC3=CC=CC=C13	{1: 1, 2: 1, 11: 1, 12: 1, 14: 8}
Did not match all atoms present	605-85-6	C1=CC=C(C=C1)CC(=O)C2=CC=CC3=CC=CC=C32	{24: 1, 2: 1, 14: 12}
Did not match all atoms present	605-91-4	CCN1C(=CC=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41.[I-]	{1: 2, 2: 2, 6: 3, 33: 2, 14: 12, 15: 1, 19: 1}
Did not match all atoms present	605-99-2	CN1C2=C(C(=O)NC1=O)NC(=O)N2	{32: 3, 1: 1, 33: 1, 25: 3}
Did not match all atoms present	6050-13-1	C1=CC=C2C(=C1)C3=CC=CC=C3C(=O)OC2=O	{28: 2, 14: 8}
Did not match all atoms present	60504-00-9	C1=CC=C(C=C1)C=CC(Cl)(Cl)Cl	{17: 3, 4: 1, 14: 5, 6: 2}
Did not match all atoms present	60504-57-6	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O)N(C)C)O	{1: 5, 2: 1, 33: 1, 11: 2, 12: 6, 13: 1, 14: 4, 20: 2, 21: 2, 22: 1, 23: 1, 25: 2, 28: 1}
Did not match all atoms present	60504-95-2	CCCC[C@@H]1[C@H]([C@@H](OC(=O)[C@H]([C@H](OC1=O)C)NC(=O)C2=C(C(=CC=C2)NC=O)O)C)O	{1: 3, 2: 3, 12: 5, 14: 3, 20: 1, 21: 1, 24: 1, 26: 1, 28: 2, 31: 2}
Did not match all atoms present	60508-97-6	CN[C@@H](C1=CC=CC=C1)[C@H](C2=CC=CC=C2)NC	{1: 2, 3: 2, 14: 10, 31: 2}
Did not match all atoms present	6051-41-8	C1=CC(=CC=C1C=O)C(=O)N	{24: 1, 26: 1, 30: 1, 14: 4}
Did not match all atoms present	6051-43-0	C1=CC(=CC=C1C(=O)N)C(=O)O	{24: 1, 27: 1, 30: 1, 14: 4}
Did not match all atoms present	6051-87-2	C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC4=CC=CC=C43	{25: 1, 14: 12, 23: 1}
Did not match all atoms present	60510-57-8	CC1=CC=CC=C1C2=NC(=NN2)C3=CC=CC=C3	{32: 1, 1: 1, 35: 2, 14: 9}
Did not match all atoms present	60518-05-0	CC1=CC(=CC=C1)NC2=CC=C(C=C2)C(=C3C=CC(=[NH+]C4=CC=CC(=C4)C)C=C3)C5=CC=C(C=C5)NC6=CC=CC(=C6)C.CC1=CC(=CC=C1)NC2=CC=C(C=C2)C(=C3C=CC(=[NH+]C4=CC=CC(=C4)C)C=C3)C5=CC=C(C=C5)NC6=CC=CC(=C6)C.OS(=O)(=O)O	{1: 6, 7: 2, 14: 48, 15: 4, 20: 2, 29: 2, 31: 6}
Did not match all atoms present	6052-13-7	CCN(C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 4, 14: 2, 33: 1}
Did not match all atoms present	6052-20-6	CCCCCCCCCCCCCCCCS(=O)(=O)C1=CC=C(C=C1)N	{1: 1, 2: 15, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	6052-68-2	C1C(NCC2=C1C3=CC=CC=C3N2)C(=O)O	{27: 1, 32: 2, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	6052-82-0	CCC1(C(O1)(CC)C2=CC=C(C=C2)O)C3=CC=C(C=C3)O	{1: 2, 2: 2, 13: 2, 14: 8, 21: 2, 23: 1}
Did not match all atoms present	60520-30-1	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)N3C=NC(=N3)N4CCOCC4)C(C)(C)CC	{1: 9, 2: 5, 3: 1, 4: 3, 33: 2, 11: 4, 14: 7, 17: 1, 35: 2, 22: 1, 23: 1, 24: 3, 31: 2}
Did not match all atoms present	60525-15-7	CN(C)CC=C(C1=CC=C(C=C1)Br)C2=CN=CC=C2.Cl.Cl	{1: 2, 2: 1, 35: 1, 33: 1, 6: 1, 7: 1, 14: 8, 17: 2, 18: 1}
Did not match all atoms present	60531-63-7	O=[Pr+]	{29: 1}
Did not match all atoms present	60539-20-0	CC(CN1CCN(CC1)CCOCCO)CN2C3=CC=CC=C3SC4=CC=CC=C42.Cl.Cl	{1: 1, 2: 6, 3: 1, 33: 3, 41: 1, 11: 4, 14: 8, 17: 2, 20: 1, 22: 1}
Did not match all atoms present	6054-86-0	CC1=NN(C(=O)C1N/N=C/2\C=C(C=C(C2=O)S(=O)(=O)[O-])[N+](=O)[O-])C3=CC=CC=C3.[Na+]	{1: 1, 34: 1, 35: 1, 38: 1, 33: 1, 12: 1, 14: 7, 15: 4, 25: 2, 29: 3, 31: 1}
Did not match all atoms present	6054-97-3	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C=C1N/N=C/3\C=CC(=O)C(=C3)C(=O)[O-].[Na+].[Na+]	{34: 1, 14: 9, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	6054-98-4	C1=CC(=C(C=C1NN=C2C=CC(=O)C(=C2)C(=O)O)C(=O)[O-])[O-].[Na+].[Na+]	{34: 1, 14: 6, 15: 2, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	60548-62-1	C(CCOS(=O)(=O)N)COS(=O)(=O)N	{2: 4, 30: 2, 29: 4, 22: 2}
Did not match all atoms present	6055-19-2	C1CNP(=O)(OC1)N(CCCl)CCCl.O	{32: 1, 33: 1, 2: 4, 11: 3, 17: 2, 23: 1, 29: 1}
Did not match all atoms present	6055-69-2	CC[NH+]1CC2([C@H]3C(C4[C@@H]1C3([C@@H]5CC6(C(C5[C@@]4(C(C6OC)O)OC(=O)C)OC(=O)C7=CC=CC=C7)O)C(CC2O)OC)OC)COC.[Cl-]	{1: 6, 2: 2, 11: 3, 12: 11, 13: 4, 14: 5, 17: 1, 20: 3, 22: 4, 28: 2}
Did not match all atoms present	60550-91-6	CNC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2	{24: 1, 1: 1, 11: 1, 14: 7, 31: 2}
Did not match all atoms present	6056-35-5	C1C2CC(C1C=C2)C(=O)C3=CC=CC=C3	{24: 1, 11: 2, 12: 3, 14: 7}
Did not match all atoms present	60561-17-3	CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCC3=CC=CS3)COC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 6, 4: 1, 33: 2, 41: 1, 11: 4, 13: 1, 14: 8, 20: 1, 22: 1, 24: 1, 27: 3}
Did not match all atoms present	60563-13-5	CCOC(=O)CC1=CC(=C(C=C1)O)OC	{1: 2, 2: 2, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	60568-41-4	CC1(C2=CC=CC=C2[N+](=C1/C=N/N(C)C3=CC=CC=C3)C)C.COS(=O)(=O)[O-]	{1: 5, 34: 1, 6: 1, 33: 2, 13: 1, 14: 9, 15: 1, 22: 1, 29: 3}
Did not match all atoms present	60568-54-9	CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)C(=O)O)NC(=O)C	{1: 3, 2: 2, 33: 1, 34: 2, 14: 7, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	6057-60-9	C1=CC=C(C=C1)C2=CC=C(C=C2)CCCC(=O)O	{2: 3, 27: 1, 14: 9}
Did not match all atoms present	60573-88-8	C1=C(ONC1=O)C(C(=O)O)N.O	{32: 1, 3: 1, 14: 1, 23: 1, 25: 1, 27: 1, 30: 1}
Did not match all atoms present	60577-30-2	CC1=C(C=CC(=C1)I)O	{1: 1, 19: 1, 21: 1, 14: 3}
Did not match all atoms present	60582-10-7	C1CC2=C(C1)C=C3CCC3=C2	{11: 5, 14: 2}
Did not match all atoms present	60582-11-8	C1CC2=C(C1)C3=C(CC3)C=C2	{11: 5, 14: 2}
Did not match all atoms present	60585-57-1	CCCCCCCCC=CCCCCCCCC(=O)NCCC[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 2: 17, 6: 2, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	60589-06-2	COC1=CC=CC=C1N2C(=O)OC(=N2)OC	{1: 2, 35: 1, 33: 1, 14: 4, 22: 2, 28: 1}
Did not match all atoms present	60593-02-4	C(COC1=C(C(=C(C(=C1Br)Br)Br)Br)Br)O	{2: 2, 20: 1, 18: 5, 22: 1}
Did not match all atoms present	606-00-8	COC(=O)C1=CC(=CC(=C1N)Br)Br	{1: 1, 18: 2, 28: 1, 30: 1, 14: 2}
Did not match all atoms present	606-07-5	CCC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 1, 2: 1, 17: 5}
Did not match all atoms present	606-12-2	C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)O)O	{24: 1, 21: 2, 14: 8}
Did not match all atoms present	606-14-4	C1=CC(=C(C(=C1)O)N)C(=O)C[C@@H](C(=O)O)N	{2: 1, 3: 1, 14: 3, 21: 1, 24: 1, 27: 1, 30: 2}
Did not match all atoms present	606-17-7	C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I	{2: 4, 14: 2, 19: 6, 24: 2, 27: 2, 31: 2}
Did not match all atoms present	606-18-8	C1=CC(=C(C(=C1)[N+](=O)[O-])N)C(=O)O	{38: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	606-20-2	CC1=C(C=CC=C1[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 3}
Did not match all atoms present	606-21-3	C1=CC(=C(C(=C1)[N+](=O)[O-])Cl)[N+](=O)[O-]	{17: 1, 38: 2, 14: 3}
Did not match all atoms present	606-22-4	C1=CC(=C(C(=C1)[N+](=O)[O-])N)[N+](=O)[O-]	{38: 2, 30: 1, 14: 3}
Did not match all atoms present	606-23-5	C1C(=O)C2=CC=CC=C2C1=O	{25: 2, 11: 1, 14: 4}
Did not match all atoms present	606-27-9	COC(=O)C1=CC=CC=C1[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	606-28-0	COC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 28: 1, 14: 9}
Did not match all atoms present	606-34-8	C1=C(C=C(C(=C1[N+](=O)[O-])C=O)[N+](=O)[O-])[N+](=O)[O-]	{26: 1, 38: 3, 14: 2}
Did not match all atoms present	606-35-9	COC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 22: 1, 14: 2}
Did not match all atoms present	606-37-1	C1=CC=C2C(=C1)C=C(C=C2[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 6}
Did not match all atoms present	606-38-2	CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(=O)C)C	{24: 1, 1: 3, 38: 1, 14: 2, 31: 1}
Did not match all atoms present	606-43-9	CN1C(=O)C=CC2=CC=CC=C21	{1: 1, 33: 1, 14: 6, 25: 1}
Did not match all atoms present	606-45-1	COC1=CC=CC=C1C(=O)OC	{1: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	606-46-2	CCN(CC)C1=CC=CC=C1C	{1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	606-55-3	CC[N+]1=C(C=CC2=CC=CC=C21)C.[I-]	{1: 2, 2: 1, 19: 1, 14: 6, 33: 1}
Did not match all atoms present	606-58-6	C1=C(C2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=CN=C2N)C#N	{33: 1, 2: 1, 35: 2, 37: 1, 12: 4, 14: 2, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	606-81-5	C1=CC=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	606-83-7	C1=CC=C(C=C1)C(CC(=O)O)C2=CC=CC=C2	{27: 1, 2: 1, 3: 1, 14: 10}
Did not match all atoms present	606-86-0	C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3	{24: 1, 2: 1, 3: 1, 14: 15}
Did not match all atoms present	606-87-1	C1=CC=C(C=C1)CN(C2=CC=CC=C2)C3=CC=CC=C3	{33: 1, 2: 1, 14: 15}
Did not match all atoms present	606-88-2	C1=CC=C(C=C1)NN(C2=CC=CC=C2)C3=CC=CC=C3	{33: 1, 14: 15, 31: 1}
Did not match all atoms present	606-90-6	CN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3.CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl	{32: 1, 1: 3, 3: 1, 33: 3, 11: 4, 12: 1, 14: 10, 17: 1, 35: 1, 22: 1, 25: 2}
Did not match all atoms present	606-93-9	CC[N+]1=C(C=CC2=C1C=CC(=C2)C)C.[I-]	{1: 3, 2: 1, 19: 1, 14: 5, 33: 1}
Did not match all atoms present	606-99-5	CCN(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 14: 10, 33: 1}
Did not match all atoms present	60607-34-3	C1CN(CCN1CCCN2C3=CC=CC=C3NC2=O)C(C4=CC=CC=C4)C5=CC=CC=C5	{32: 1, 33: 3, 2: 3, 3: 1, 11: 4, 14: 14, 25: 1}
Did not match all atoms present	60608-99-3	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 8, 27: 4, 20: 2, 14: 4}
Did not match all atoms present	60611-24-7	C1=CC(=C(C(=C1)F)C=O)C(F)(F)F	{16: 4, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	60613-17-4	CCCSC1=C(C(=NC=C1Cl)Cl)Cl	{1: 1, 2: 2, 35: 1, 40: 1, 14: 1, 17: 3}
Did not match all atoms present	6062-26-6	CC1=C(C=CC(=C1)Cl)OCCCC(=O)[O-].[Na+]	{1: 1, 2: 3, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	60628-17-3	CCCCCCCCCCCCCOP(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 12, 22: 3, 14: 10}
Did not match all atoms present	60628-96-8	C1=CC=C(C=C1)C2=CC=C(C=C2)C(C3=CC=CC=C3)N4C=CN=C4	{33: 1, 3: 1, 14: 17, 35: 1}
Did not match all atoms present	6063-60-1	CC[Al](CC)OC(C)C	{1: 4, 2: 2, 3: 1, 22: 1}
Did not match all atoms present	6063-72-5	C[Si](C)(C)N=P(C)(C)C	{1: 6, 34: 1}
Did not match all atoms present	60632-40-8	COC1=C(C=C(C(=C1)C=O)Br)O	{1: 1, 14: 2, 18: 1, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	60633-25-2	COC1=C(C=C(C=C1)Cl)Br	{1: 1, 18: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	60634-59-5	CCOC1=CC=C(C2=CC=CC=C21)C(=O)COC(=O)CCC(=O)O	{1: 1, 2: 4, 14: 6, 22: 1, 24: 1, 27: 1, 28: 1}
Did not match all atoms present	60635-32-7	O=[Ti+]	{29: 1}
Did not match all atoms present	6064-83-1	C1=CC=C(C(=C1)C(=O)O)OP(=O)(O)O	{27: 1, 20: 2, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	60644-91-9	C1=CC=C2C(=C1)C=C(C(=N2)C3C(=O)C4=C(C3=O)C=C5C(=C4)C(=C(C(=C5Br)Br)Br)Br)O	{35: 1, 12: 1, 14: 7, 18: 4, 21: 1, 25: 2}
Did not match all atoms present	60646-30-2	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2[C@@H](C(F)(F)F)O	{16: 3, 20: 1, 3: 1, 4: 1, 14: 9}
Did not match all atoms present	60656-63-5	CC(=O)NC1=NC(=O)C=C(N1)C=O	{32: 1, 1: 1, 35: 1, 14: 1, 24: 1, 25: 1, 26: 1, 31: 1}
Did not match all atoms present	60656-87-3	C1=CC=C(C=C1)COCC=O	{2: 2, 26: 1, 22: 1, 14: 5}
Did not match all atoms present	60659-61-2	CCCCCCCCCCCCCOC(=O)/C=C\C(=O)O[Sn](OC(=O)/C=C\C(=O)OCCCCCCCCCCCCC)(CCCC)CCCC	{1: 4, 2: 30, 28: 4, 6: 4}
Did not match all atoms present	6066-49-5	CCCCC1C2=CC=CC=C2C(=O)O1	{1: 1, 2: 3, 12: 1, 14: 4, 28: 1}
Did not match all atoms present	60662-79-5	CCS(=O)(=O)C(CC(C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 10, 17: 1, 29: 2}
Did not match all atoms present	6067-35-2	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Er+3].[Er+3]	{24: 3}
Did not match all atoms present	60676-83-7	C1CC1NC(=O)C2=CC(=C(C(=C2)Cl)N)Cl	{11: 2, 12: 1, 14: 2, 17: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	60676-90-6	CC(C(=O)O)[O-].CC(C(=O)O)[O-].CC(C(=O)O)[O-].CC(C(=O)O)[O-].[Zr+4]	{27: 4, 1: 4, 3: 4, 29: 4}
Did not match all atoms present	60679-72-3	C1=C(C=C(C(=C1O)Br)O)C(=O)N(CCO)CCO	{33: 1, 2: 4, 14: 2, 18: 1, 20: 2, 21: 2, 24: 1}
Did not match all atoms present	6068-28-6	CCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 15, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	6068-69-5	CCC(C)NC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	6068-72-0	C1=CC(=CC=C1C#N)C(=O)Cl	{24: 1, 17: 1, 37: 1, 14: 4}
Did not match all atoms present	60686-64-8	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(C(F)(F)F)O	{16: 3, 20: 1, 3: 1, 4: 1, 14: 9}
Did not match all atoms present	6069-38-1	CN1CCN(P1N(C)C)C	{1: 4, 11: 2, 33: 3}
Did not match all atoms present	6069-97-2	CC1=CC=C(C=C1)C2CC(N3C(=N2)C(=CN3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)F)C(F)(F)F	{32: 1, 1: 1, 35: 1, 4: 1, 33: 3, 11: 5, 12: 2, 14: 9, 15: 2, 16: 4, 24: 1}
Did not match all atoms present	60694-92-0	C1=CC(=CC=C1C#N)C(=O)CI	{24: 1, 2: 1, 19: 1, 37: 1, 14: 4}
Did not match all atoms present	607-00-1	C1=CC=C(C=C1)N(C=O)C2=CC=CC=C2	{33: 1, 26: 1, 14: 10}
Did not match all atoms present	607-01-2	CCP(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 14: 10}
Did not match all atoms present	607-04-5	C1=CC=C(C=C1)C2=CC=CC=C2OCCCl	{17: 1, 2: 2, 22: 1, 14: 9}
Did not match all atoms present	607-07-8	C1=CC=C(C=C1)C2=CC=CC=C2OCCOC3=CC=CC=C3C4=CC=CC=C4	{2: 2, 22: 2, 14: 18}
Did not match all atoms present	607-12-5	C1=CC=C(C=C1)C2=C(C=CC(=C2)Cl)O	{17: 1, 21: 1, 14: 8}
Did not match all atoms present	607-23-8	C1=CC=C2C(=C1)C=CC(=C2N)[N+](=O)[O-]	{38: 1, 30: 1, 14: 6}
Did not match all atoms present	607-24-9	C1=CC=C2C(=C1)C=CC(=C2O)[N+](=O)[O-]	{38: 1, 21: 1, 14: 6}
Did not match all atoms present	607-30-7	C1=CC=C2C(=C1)C=CC=C2NO	{20: 1, 14: 7, 31: 1}
Did not match all atoms present	607-31-8	COC1=CC=NC2=CC=CC=C21	{1: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	607-32-9	C1=CC2=C(C=CN=C2)C(=C1)[N+](=O)[O-]	{35: 1, 38: 1, 14: 6}
Did not match all atoms present	607-34-1	C1=CC2=C(C=CC=N2)C(=C1)[N+](=O)[O-]	{35: 1, 38: 1, 14: 6}
Did not match all atoms present	607-35-2	C1=CC2=C(C(=C1)[N+](=O)[O-])N=CC=C2	{35: 1, 38: 1, 14: 6}
Did not match all atoms present	607-42-1	C1=CC=C2C=C3C(=CC2=C1)C=CC=C3C(=O)O	{27: 1, 14: 9}
Did not match all atoms present	607-52-3	C1=CC=C2C(=C1)C=CC=C2OC3=CC=CC4=CC=CC=C43	{22: 1, 14: 14}
Did not match all atoms present	607-53-4	C1=CC=C2C(=C1)C=CC=C2SC3=CC=CC4=CC=CC=C43	{40: 1, 14: 14}
Did not match all atoms present	607-55-6	C1=CC=C(C=C1)C(=O)OC2=CC=CC3=CC=CC=C32	{28: 1, 14: 12}
Did not match all atoms present	607-56-7	C1=CC=C2C(=C1)C=CC=C2NC(=O)NC3=CC=CC4=CC=CC=C43	{24: 1, 14: 14, 31: 2}
Did not match all atoms present	607-57-8	C1C2=CC=CC=C2C3=C1C=C(C=C3)[N+](=O)[O-]	{11: 1, 38: 1, 14: 7}
Did not match all atoms present	607-58-9	C1=CC=C(C=C1)COC2=CC=CC3=CC=CC=C32	{2: 1, 22: 1, 14: 12}
Did not match all atoms present	607-59-0	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC3=CC=CC=C32	{1: 2, 34: 2, 14: 11, 33: 1}
Did not match all atoms present	607-66-9	CC1=CC(=O)NC2=CC=CC=C12	{32: 1, 1: 1, 14: 5, 25: 1}
Did not match all atoms present	607-67-0	CC1=CC(=O)C2=CC=CC=C2N1	{32: 1, 1: 1, 14: 5, 25: 1}
Did not match all atoms present	607-71-6	CC1=CC(=O)OC2=CC=CC=C12	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	607-81-8	CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC	{1: 2, 2: 3, 3: 1, 28: 2, 14: 5}
Did not match all atoms present	607-85-2	CC(C)OC(=O)C1=CC=CC=C1O	{1: 2, 3: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	607-86-3	CC1=CC=CC=C1C(=O)OC(=O)C2=CC=CC=C2C	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	607-88-5	CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O	{1: 1, 28: 1, 21: 1, 14: 8}
Did not match all atoms present	607-90-9	CCCOC(=O)C1=CC=CC=C1O	{1: 1, 2: 2, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	607-91-0	COC1=CC(=CC2=C1OCO2)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 11: 1, 14: 2, 22: 1, 23: 2}
Did not match all atoms present	607-92-1	CC1=C(C(=CC=C1)C)NC=O	{1: 2, 26: 1, 14: 3, 31: 1}
Did not match all atoms present	607-96-5	CC1=CC(=O)C=C(C1=NNC2=CC=C(C=C2)[N+](=O)[O-])O	{1: 1, 34: 1, 38: 1, 14: 6, 15: 3, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	607-99-8	COC1=C(C=C(C=C1Br)Br)Br	{1: 1, 18: 3, 22: 1, 14: 2}
Did not match all atoms present	60702-69-4	C1=CC(=C(C=C1F)Cl)C#N	{16: 1, 17: 1, 37: 1, 14: 3}
Did not match all atoms present	60703-00-6	[2H]C(=O)OC(C)C	{1: 2, 26: 1, 3: 1}
Did not match all atoms present	60704-88-3	O[Ti](=O)O[Ti](=O)[O-].[Na+]	{20: 1, 29: 3, 22: 1}
Did not match all atoms present	60705-62-6	CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)C(C)(C)C)C2)O)C(C)(C)C)C(C)(C)C)O	{1: 12, 11: 4, 4: 4, 21: 4, 14: 8}
Did not match all atoms present	60706-43-6	CN1CCN(CC1)CCN2C3=CC=CC=C3SC4=CC=CC=C42	{1: 1, 2: 2, 33: 3, 41: 1, 11: 4, 14: 8}
Did not match all atoms present	60706-49-2	CN1CCCCC1CN2C3=CC=CC=C3C4=CC=CC=C42	{1: 1, 2: 1, 33: 2, 11: 4, 12: 1, 14: 8}
Did not match all atoms present	60706-52-7	CN1CCCCC1CC2=C3C(=CC=C2)SC4=CC=CC=C4N3	{32: 1, 1: 1, 2: 1, 33: 1, 41: 1, 11: 4, 12: 1, 14: 7}
Did not match all atoms present	60706-63-0	CC1=CC(=C(C(=C1C)S(=O)(=O)Cl)C)C	{1: 4, 29: 2, 14: 1, 17: 1}
Did not match all atoms present	60710-39-6	CC1=C(C=C(C=C1)O)Br	{1: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	60711-47-9	CCC(C)O[Si](OC(C)CC)(OC(C)CC)O[Si](C)(O[Si](OC(C)CC)(OC(C)CC)OC(C)CC)O[Si](OC(C)CC)(OC(C)CC)OC(C)CC	{1: 19, 2: 9, 3: 9, 22: 12}
Did not match all atoms present	60711-74-2	CCCCCCCCCCCCCCCCCCN1C2=CC=CC=C2OC1=CC=CC3=[N+](C4=CC=CC=C4O3)CCCCCCCCCCCCCCCCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 34, 6: 3, 33: 2, 14: 12, 15: 1, 23: 2, 29: 3}
Did not match all atoms present	60719-83-7	CC(C(=O)OC(C)(C)CC1=CC=C(C=C1)Cl)N.Cl	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 17: 2, 28: 1, 30: 1}
Did not match all atoms present	60719-84-8	C1=CN=CC=C1C2=CNC(=O)C(=C2)N	{32: 1, 25: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	6072-57-7	CC1CC(=O)C2=CC=CC=C12	{1: 1, 11: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	60722-92-1	CC(C)C1=CC=CC=C1OP(=O)(Cl)Cl	{1: 2, 3: 1, 14: 4, 17: 2, 22: 1, 29: 1}
Did not match all atoms present	60723-51-5	C[N+]12CCC34[C@@H]1C[C@@H]5[C@@H]6[C@@H]3N(C(=O)C[C@@H]6OCC=C5C2)C7=CC(=C(C=C47)OC)OC.[I-]	{1: 3, 33: 1, 11: 6, 12: 5, 13: 1, 14: 3, 15: 1, 19: 1, 22: 2, 23: 1, 25: 1}
Did not match all atoms present	6073-20-7	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)N	{1: 5, 2: 1, 4: 2, 14: 3, 21: 1, 30: 1}
Did not match all atoms present	60731-46-6	C[C@H]([C@H]1C(=O)NC(CCCCCC(=O)OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CO)CC(C)C)CC(=O)N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CN=CN2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N5CCC[C@H]5C(=O)N)O	{32: 6, 1: 19, 2: 31, 3: 31, 36: 1, 33: 2, 7: 1, 11: 12, 12: 8, 14: 6, 35: 1, 20: 6, 21: 1, 24: 29, 25: 5, 27: 2, 28: 1, 30: 8, 31: 24}
Did not match all atoms present	60731-73-9	C1=CC(=C(C(=C1)F)C(=O)N=C=O)F	{34: 1, 8: 1, 14: 3, 16: 2, 24: 1, 29: 1}
Did not match all atoms present	60735-64-0	CCN(CC)C(C)C(=O)C1=CC=C(C=C1)NS(=O)(=O)C.Cl	{1: 4, 2: 2, 3: 1, 33: 1, 14: 4, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	60736-70-1	C1=CC=C(C=C1)COC2=C(C=C(C=C2)CC(=O)O)Cl	{17: 1, 2: 2, 27: 1, 22: 1, 14: 8}
Did not match all atoms present	60736-71-2	CC1=C(C=CC(=C1)CCl)OC	{1: 2, 2: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	6074-84-6	CC[O-].CC[O-].CC[O-].CC[O-].CC[O-].[Ta+5]	{1: 5, 2: 5, 29: 5}
Did not match all atoms present	60743-07-9	C1SCS1(=O)=O	{41: 1, 11: 2, 29: 2}
Did not match all atoms present	60743-08-0	C1S(=O)CS1=O	{11: 2, 29: 2}
Did not match all atoms present	60743-10-4	C1S(=O)CS1(=O)=O	{11: 2, 29: 3}
Did not match all atoms present	60748-45-0	CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CS)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@@H](CC6=CN=CN6)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC7=CN=CN7)C(=O)NCC(=O)N8CCC[C@H]8C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC9=CNC1=CC=CC=C19)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)CN	{32: 5, 1: 19, 2: 50, 3: 45, 36: 1, 33: 4, 7: 1, 11: 12, 12: 4, 14: 19, 35: 2, 20: 6, 24: 49, 39: 6, 27: 3, 30: 8, 31: 43}
Did not match all atoms present	6076-64-8	B1(NCCN1C)C2=CC=CC=C2	{32: 1, 1: 1, 11: 2, 14: 5, 33: 1}
Did not match all atoms present	60763-16-8	C(#N)[S-].C(#N)[S-].[K+].[Ag+]	{37: 2}
Did not match all atoms present	60763-49-7	CC(C)(C(=O)O)OC1=CC=C(C=C1)Cl.C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4	{1: 2, 2: 1, 3: 1, 4: 1, 6: 2, 33: 2, 11: 4, 14: 19, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	60764-83-2	CCO[Si](CS)(OCC)OCC	{1: 3, 2: 4, 22: 3, 39: 1}
Did not match all atoms present	60767-85-3	CCCC[P+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)[P+](=O)[O-]	{1: 4, 2: 12, 29: 2, 14: 5}
Did not match all atoms present	6077-10-7	C1=CC=C(C=C1)C#C[Hg]C#CC2=CC=CC=C2	{10: 4, 14: 10}
Did not match all atoms present	60772-80-7	CC1=C(C(=CC=C1)C(C)(C)C)OC	{1: 5, 4: 1, 22: 1, 14: 3}
Did not match all atoms present	60778-99-6	OS(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Mg+2].[Al+3]	{20: 1, 29: 11}
Did not match all atoms present	6078-07-5	C[C@H]1[C@H](CC[C@@H](O1)O[C@]23C(=O)C[C@@](C[C@]2(C=CC4=C3C(=O)C5=C(C4=O)C(=C(C=C5)[C@H]6C[C@H]([C@@H]([C@H](O6)C)O)O[C@H]7CC[C@@H]([C@@H](O7)C)O[C@H]8C[C@H]([C@@H]([C@H](O8)C)O)O)O)O)(C)O)O	{1: 5, 11: 8, 12: 14, 13: 3, 14: 4, 15: 2, 20: 6, 21: 1, 22: 3, 23: 4, 25: 3}
Did not match all atoms present	6078-26-8	CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@]5(C[C@@H]([C@]6(C[C@@H]4[C@@H]5[C@H]6OC(=O)C7=CC(=C(C=C7)OC)OC)O)OC)OC(=O)C)OC)OC)COC	{1: 8, 2: 2, 33: 1, 11: 5, 12: 9, 13: 4, 14: 3, 20: 1, 22: 6, 28: 2}
Did not match all atoms present	60781-83-1	C1=CC=C(C=C1)C2=CC(=NC=C2)N	{35: 1, 30: 1, 14: 8}
Did not match all atoms present	60787-82-8	CC1CO1.CC1=C(C=C(C=C1)N=C=O)N=C=O.C1CO1	{1: 2, 34: 2, 8: 2, 11: 3, 12: 1, 14: 3, 23: 2, 29: 2}
Did not match all atoms present	60789-54-0	C1=CC=C(C=C1)COCCCCBr	{2: 5, 22: 1, 18: 1, 14: 5}
Did not match all atoms present	60789-89-1	CC1=CC(=NO1)C(=O)NNC(C)CC2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 14: 6, 35: 1, 23: 1, 24: 1, 31: 2}
Did not match all atoms present	608-05-9	CC1=CC2=C(C=C1)NC(=O)C2=O	{32: 1, 1: 1, 14: 3, 25: 2}
Did not match all atoms present	608-07-1	COC1=CC2=C(C=C1)NC=C2CCN	{32: 1, 1: 1, 2: 2, 14: 4, 22: 1, 30: 1}
Did not match all atoms present	608-08-2	CC(=O)OC1=CNC2=CC=CC=C21	{32: 1, 1: 1, 28: 1, 14: 5}
Did not match all atoms present	608-10-6	C1=NC2=C(N1)C(=NC=N2)SCCC(=O)O	{32: 1, 2: 2, 35: 3, 40: 1, 14: 2, 27: 1}
Did not match all atoms present	608-21-9	C1=CC(=C(C(=C1)Br)Br)Br	{18: 3, 14: 3}
Did not match all atoms present	608-23-1	CC1=C(C(=CC=C1)Cl)C	{1: 2, 14: 3, 17: 1}
Did not match all atoms present	608-25-3	CC1=C(C=CC=C1O)O	{1: 1, 21: 2, 14: 3}
Did not match all atoms present	608-26-4	CC1=C(C(=CC=C1)O)Cl	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	608-27-5	C1=CC(=C(C(=C1)Cl)Cl)N	{17: 2, 30: 1, 14: 3}
Did not match all atoms present	608-28-6	CC1=C(C(=CC=C1)C)I	{1: 2, 19: 1, 14: 3}
Did not match all atoms present	608-29-7	C1=CC(=C(C(=C1)I)I)I	{19: 3, 14: 3}
Did not match all atoms present	608-30-0	C1=CC(=C(C(=C1)Br)N)Br	{18: 2, 30: 1, 14: 3}
Did not match all atoms present	608-31-1	C1=CC(=C(C(=C1)Cl)N)Cl	{17: 2, 30: 1, 14: 3}
Did not match all atoms present	608-32-2	C1=CC(=C(C(=C1)N)N)N	{30: 3, 14: 3}
Did not match all atoms present	608-33-3	C1=CC(=C(C(=C1)Br)O)Br	{18: 2, 21: 1, 14: 3}
Did not match all atoms present	608-43-5	CC1=C(C=CC(=C1C)O)O	{1: 2, 21: 2, 14: 2}
Did not match all atoms present	608-44-6	C1=CC(=C(C(=C1O)Cl)Cl)O	{17: 2, 21: 2, 14: 2}
Did not match all atoms present	608-50-4	CC1=CC(=C(C(=C1[N+](=O)[O-])C)[N+](=O)[O-])C	{1: 3, 38: 2, 14: 1}
Did not match all atoms present	608-71-9	C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)O	{18: 5, 21: 1}
Did not match all atoms present	608-72-0	CC1=C(C(=C(C(=C1Br)C)Br)C)Br	{1: 3, 18: 3}
Did not match all atoms present	608-74-2	C1(=C(C(=C(C(=C1I)I)I)I)I)I	{19: 6}
Did not match all atoms present	608-80-0	C1(=C(C(=C(C(=C1O)O)O)O)O)O	{21: 6}
Did not match all atoms present	608-90-2	C1=C(C(=C(C(=C1Br)Br)Br)Br)Br	{18: 5, 14: 1}
Did not match all atoms present	608-93-5	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{17: 5, 14: 1}
Did not match all atoms present	608-94-6	C1=C(C(=C(C(=C1Cl)O)Cl)Cl)O	{17: 3, 21: 2, 14: 1}
Did not match all atoms present	608-96-8	C1=C(C(=C(C(=C1I)I)I)I)I	{19: 5, 14: 1}
Did not match all atoms present	608-98-0	CC1=CC(=C(C(=C1O)C)O)C	{1: 3, 21: 2, 14: 1}
Did not match all atoms present	6080-56-4	CC(=O)[O-].CC(=O)[O-].O.O.O.[Pb+2]	{24: 2, 1: 2}
Did not match all atoms present	60805-12-1	C(S(=O)(=O)C(F)(F)F)(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F	{16: 9, 3: 1, 4: 3, 29: 6}
Did not match all atoms present	60806-48-6	CC1=CC=CC=C1C.CC(C)(C)C1=CC=C(C=C1)O.C=O	{1: 5, 4: 1, 5: 1, 14: 8, 21: 1}
Did not match all atoms present	60806-49-7	CC1=CC=CC=C1C.C=O.C1CCC(CC1)C2=CC=C(C=C2)O	{1: 2, 5: 1, 11: 5, 12: 1, 14: 8, 21: 1}
Did not match all atoms present	60811-18-9	C1=CC(=C(C=C1Br)F)Cl	{16: 1, 17: 1, 18: 1, 14: 3}
Did not match all atoms present	60811-21-4	C1=CC(=C(C=C1Br)Cl)F	{16: 1, 17: 1, 18: 1, 14: 3}
Did not match all atoms present	60811-23-6	C1=CC(=C(C=C1S)Cl)F	{16: 1, 17: 1, 14: 3, 39: 1}
Did not match all atoms present	60813-12-9	CCCN(CCC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CCC)CCC)C3=CC=C(C=C3)N(CCC)CCC	{1: 6, 2: 12, 3: 1, 14: 12, 33: 3}
Did not match all atoms present	60814-29-1	CC1=CC2=NC=C(N=C2C=C1)C	{1: 2, 35: 2, 14: 4}
Did not match all atoms present	60818-94-2	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Ir+4]	{17: 6}
Did not match all atoms present	60835-69-0	C1COCCOC2=C(C=C(C=C2)[N+](=O)[O-])OCCOCCO1	{11: 8, 38: 1, 14: 3, 23: 5}
Did not match all atoms present	60835-72-5	C1COCCOC2=C(C=C(C=C2)Br)OCCOCCO1	{18: 1, 11: 8, 14: 3, 23: 5}
Did not match all atoms present	60835-75-8	C1COCCOCCOC2=C(C=CC(=C2)C(=O)O)OCCOCCO1	{27: 1, 11: 10, 14: 3, 23: 6}
Did not match all atoms present	60842-44-6	CCC(CC)(COC1=C(OC2=C1C=CC(=C2)OC)C3=CC=CC=C3)[NH+]4CCCC4.[Cl-]	{1: 3, 2: 3, 4: 1, 11: 4, 14: 8, 17: 1, 22: 2, 23: 1}
Did not match all atoms present	60846-15-3	CCOC(=O)C(=NOC)C1=CSC(=N1)N	{1: 2, 2: 1, 35: 1, 7: 1, 41: 1, 34: 1, 14: 1, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	6085-59-2	CN(C)C1=C(C=C(C=C1)N)Cl	{1: 2, 33: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	60851-34-5	C1=C2C3=CC(=C(C(=C3OC2=C(C(=C1Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 2, 23: 1}
Did not match all atoms present	60858-07-3	CCC=CCCC1=CC=C(O1)C	{1: 2, 2: 3, 14: 2, 6: 2, 23: 1}
Did not match all atoms present	60860-22-2	C1C2(COP(O1)OCCCl)COP(OC2)OCCCl	{2: 4, 11: 4, 13: 1, 17: 2, 22: 2, 23: 4}
Did not match all atoms present	60864-26-8	I[Tm]I	{19: 2}
Did not match all atoms present	60865-39-6	CC1=C(C=CC=C1N=C=O)N=C=O.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{1: 1, 2: 9, 8: 4, 34: 4, 14: 11, 20: 2, 27: 2, 29: 4}
Did not match all atoms present	60869-69-4	CCN(CC)C1=CC(=C(C=C1)[N+]#N)C.CCN(CC)C1=CC(=C(C=C1)[N+]#N)C.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 6, 2: 4, 33: 2, 34: 2, 14: 6, 17: 4}
Did not match all atoms present	6087-53-2	CCN(CC)C1=CC(=C(C=C1)[N+]#N)OCC.Cl[Zn-](Cl)Cl	{1: 3, 2: 3, 33: 1, 34: 1, 14: 3, 17: 3, 22: 1}
Did not match all atoms present	6087-58-7	CCN(CC)C1=CC(=C(C=C1)[N+]#N)C.Cl[Zn-](Cl)Cl	{1: 3, 2: 2, 33: 1, 34: 1, 14: 3, 17: 3}
Did not match all atoms present	6087-59-8	[B-](F)(F)(F)F.CCNC1=C(C=C(C=C1)[N+]#N)C	{1: 2, 2: 1, 34: 1, 14: 3, 16: 4, 31: 1}
Did not match all atoms present	60871-83-2	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Mg+2]	{16: 6, 4: 2, 29: 6}
Did not match all atoms present	60871-86-5	CS(=O)(=O)N1CCN(CC1)C2CCN(CC2)CC3=CC=CC=C3	{1: 1, 2: 1, 33: 3, 11: 8, 12: 1, 14: 5, 29: 2}
Did not match all atoms present	60875-16-3	CC1=NN(C(=O)C1)C2=CC=C(C=C2)C(=O)O	{1: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	60878-87-7	C[N+]1=C(SCC1)C=CNC2=CC=CC=C2.[I-]	{1: 1, 6: 2, 33: 1, 41: 1, 11: 2, 14: 5, 15: 1, 19: 1, 31: 1}
Did not match all atoms present	6088-51-3	C1=CC2=C(C=CC(=C2)SSC3=CC4=C(C=C3)C=C(C=C4)O)C=C1O	{40: 2, 21: 2, 14: 12}
Did not match all atoms present	60883-64-9	[Be+2].C(=O)([O-])[O-].O.O.O.O	{24: 1}
Did not match all atoms present	60883-74-1	CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Br)C3=CC=C(C=C3)OCC	{1: 2, 2: 2, 7: 2, 14: 13, 18: 1, 22: 2}
Did not match all atoms present	6089-44-7	CC1=C(SC(=C1C(=O)OC)NC(=O)C)C(=CC#N)C	{1: 4, 37: 1, 6: 1, 7: 1, 41: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	60899-29-8	CCC1(CC(C2=CC=CC=C21)(C)C)C	{1: 4, 2: 1, 11: 1, 13: 2, 14: 4}
Did not match all atoms present	60899-39-0	CCCCCCCCCCCCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 11, 14: 7}
Did not match all atoms present	609-19-8	C1=C(C=C(C(=C1Cl)Cl)Cl)O	{17: 3, 21: 1, 14: 2}
Did not match all atoms present	609-20-1	C1=C(C=C(C(=C1Cl)N)Cl)N	{17: 2, 30: 2, 14: 2}
Did not match all atoms present	609-21-2	C1=C(C=C(C(=C1Br)O)Br)N	{18: 2, 30: 1, 21: 1, 14: 2}
Did not match all atoms present	609-22-3	CC1=CC(=CC(=C1O)Br)Br	{1: 1, 18: 2, 21: 1, 14: 2}
Did not match all atoms present	609-23-4	C1=C(C=C(C(=C1I)O)I)I	{19: 3, 21: 1, 14: 2}
Did not match all atoms present	609-25-6	CC1=CC(=C(C(=C1)O)O)O	{1: 1, 21: 3, 14: 2}
Did not match all atoms present	609-38-1	C1=COC(=C1)C(=O)N	{24: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	609-39-2	C1=COC(=C1)[N+](=O)[O-]	{38: 1, 14: 3, 23: 1}
Did not match all atoms present	609-40-5	C1=CSC(=C1)[N+](=O)[O-]	{41: 1, 38: 1, 14: 3}
Did not match all atoms present	609-54-1	CC1=CC(=C(C=C1)C)S(=O)(=O)O	{1: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	609-60-9	CC1=CC(=C(C=C1)S(=O)(=O)Cl)C	{1: 2, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	609-65-4	C1=CC=C(C(=C1)C(=O)Cl)Cl	{24: 1, 17: 2, 14: 4}
Did not match all atoms present	609-66-5	C1=CC=C(C(=C1)C(=O)N)Cl	{24: 1, 17: 1, 30: 1, 14: 4}
Did not match all atoms present	609-67-6	C1=CC=C(C(=C1)C(=O)Cl)I	{24: 1, 17: 1, 19: 1, 14: 4}
Did not match all atoms present	609-71-2	C1=CNC(=O)C(=C1)C(=O)O	{32: 1, 25: 1, 27: 1, 14: 3}
Did not match all atoms present	609-72-3	CC1=CC=CC=C1N(C)C	{1: 3, 14: 4, 33: 1}
Did not match all atoms present	609-73-4	C1=CC=C(C(=C1)[N+](=O)[O-])I	{19: 1, 38: 1, 14: 4}
Did not match all atoms present	609-74-5	CC1=CC(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 2}
Did not match all atoms present	609-85-8	C1=C(C=C(C(=C1Br)N)C(=O)O)Br	{18: 2, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	609-86-9	C1=C(C=C(C(=C1I)N)C(=O)O)I	{27: 1, 19: 2, 30: 1, 14: 2}
Did not match all atoms present	609-89-2	C1=C(C=C(C(=C1Cl)O)[N+](=O)[O-])Cl	{17: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	609-93-8	CC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]	{1: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	609-99-4	C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-]	{38: 2, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	60902-45-6	CCCCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{1: 1, 2: 8, 18: 1, 14: 15}
Did not match all atoms present	60903-51-7	CC1=C(C=C(C=C1)NC(=O)NC)NC(=O)NC	{24: 2, 1: 3, 14: 3, 31: 4}
Did not match all atoms present	60903-69-7	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[La+3]	{24: 3, 1: 3, 2: 18}
Did not match all atoms present	60909-47-9	[As]#[Zr]	{}
Did not match all atoms present	6091-58-3	CC(C)(C(C)(C)O)O.O.O.O.O.O.O	{1: 4, 4: 2, 20: 2}
Did not match all atoms present	6091-64-1	CCOC(=O)C1=CC=CC=C1Br	{1: 1, 2: 1, 28: 1, 18: 1, 14: 4}
Did not match all atoms present	60911-92-4	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N.CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sn+4]	{1: 2, 2: 4, 33: 2, 34: 2, 14: 18, 17: 6}
Did not match all atoms present	60917-67-1	CC(CC1=CC(=C(C=C1OC)OC)Br)N	{1: 3, 2: 1, 3: 1, 14: 2, 18: 1, 22: 2, 30: 1}
Did not match all atoms present	6092-64-4	CN(C)N=NC1=CC=C(C=C1)C2=CC=C(C=C2)N=NN(C)C	{1: 4, 34: 4, 14: 8, 33: 2}
Did not match all atoms present	60921-61-1	C.[Mn].[Mn].[Mn]	{}
Did not match all atoms present	60921-93-9	[SH-].[SH-].[Fe].[Fe+2]	{}
Did not match all atoms present	6093-67-0	C1=CC2=C(C=CC(=O)O2)C(=C1)O	{28: 1, 21: 1, 14: 5}
Did not match all atoms present	6093-68-1	C1=CC2=C(C=CC(=O)O2)C=C1O	{28: 1, 21: 1, 14: 5}
Did not match all atoms present	6094-60-6	C1CN(CCC1(C#N)O)CC2=CC=CC=C2	{33: 1, 2: 1, 37: 1, 11: 4, 13: 1, 14: 5, 20: 1}
Did not match all atoms present	60940-34-3	C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3[Se]2	{25: 1, 14: 9, 33: 1}
Did not match all atoms present	60942-21-4	C1CC1C(C2=CC=CS2)O	{3: 1, 41: 1, 11: 2, 12: 1, 14: 3, 20: 1}
Did not match all atoms present	60946-69-2	CC1(C2=CC=CC=C2N3C1(NC(=O)CC3)C=CC4=CC=C(C=C4)N(C)C)C	{32: 1, 1: 4, 6: 2, 33: 2, 11: 2, 13: 2, 14: 8, 25: 1}
Did not match all atoms present	60948-99-4	C1=CC2=C(C(=C1)CS)C(=CC=C2)CS	{2: 2, 14: 6, 39: 2}
Did not match all atoms present	6095-42-7	CCCCCCOP(OCCCCCC)OCCCCCC	{1: 3, 2: 15, 22: 3}
Did not match all atoms present	6095-82-5	CC1=CC(=C(C(=C1)C)N=C=S)C	{8: 1, 1: 3, 34: 1, 14: 2}
Did not match all atoms present	60956-23-2	CC1=CC(=C(C=C1)Br)Br	{1: 1, 18: 2, 14: 3}
Did not match all atoms present	60956-24-3	C1=CC(=C(C=C1Cl)Br)Br	{17: 1, 18: 2, 14: 3}
Did not match all atoms present	60956-26-5	CC1=C(C=C(C=C1)Br)[N+](=O)[O-]	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	60956-33-4	OOCCCc1ccccc1	{2: 3, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	60965-26-6	COC1=CC(=C(C=C1)C(=O)CBr)OC	{1: 2, 2: 1, 14: 3, 18: 1, 22: 2, 24: 1}
Did not match all atoms present	60965-60-8	CC1=CC=C(O1)S	{1: 1, 39: 1, 14: 2, 23: 1}
Did not match all atoms present	60967-89-7	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=C[C@H]([C@@H]4O)O	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	60967-90-0	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@H]([C@@H](C=C4)O)O	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	60968-01-6	C1CC2=C(C=C1)C3=CC4=CC=CC=C4C=C3C=C2	{11: 2, 14: 10}
Did not match all atoms present	60968-08-3	C1CC2=C(C=C1)C=CC3=CC4=CC=CC=C4C=C23	{11: 2, 14: 10}
Did not match all atoms present	60969-19-9	F[P-](F)(F)(F)(F)F.[Tl+]	{16: 6}
Did not match all atoms present	6097-32-1	CC(=O)CC1=CC(=C(C=C1)Cl)Cl	{24: 1, 1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	6098-44-8	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)OC(=O)C	{1: 2, 33: 1, 11: 1, 14: 7, 24: 1, 28: 1}
Did not match all atoms present	6098-53-9	[B-](F)(F)(F)F.CCN(CC)C1=CC(=C(C=C1)[N+]#N)C	{1: 3, 2: 2, 33: 1, 34: 1, 14: 3, 16: 4}
Did not match all atoms present	60981-61-5	C[Hg]C1CC2CCC1C2	{1: 1, 11: 4, 12: 3}
Did not match all atoms present	60981-62-6	C[Hg][C@@H]1CC2CCC1C2	{1: 1, 11: 4, 12: 3}
Did not match all atoms present	6099-03-2	COC1=CC=CC=C1/C=C/C(=O)O	{1: 1, 22: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	6099-04-3	COC1=CC=CC(=C1)/C=C/C(=O)O	{1: 1, 22: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	6099-79-2	CCC(C)C1=CC(=CC(=C1OC)[N+](=O)[O-])[N+](=O)[O-]	{1: 3, 2: 1, 3: 1, 38: 2, 14: 2, 22: 1}
Did not match all atoms present	6099-88-3	C(CCl)N=C=S	{8: 1, 17: 1, 2: 2, 34: 1}
Did not match all atoms present	60996-85-2	C[N+]1(CCCCC1)CCN(C2CCCCC2)C3CCCCC3.[Cl-]	{1: 1, 2: 2, 33: 1, 11: 15, 12: 2, 17: 1}
Did not match all atoms present	61-00-7	CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN(C)C	{1: 3, 2: 3, 33: 2, 41: 1, 14: 7, 24: 1}
Did not match all atoms present	61-01-8	CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)OC	{1: 3, 2: 3, 33: 2, 41: 1, 14: 7, 22: 1}
Did not match all atoms present	61-12-1	CCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)NCCN(CC)CC.Cl	{1: 3, 2: 7, 35: 1, 33: 1, 14: 5, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	61-15-4	CC(C)NC(C)C(C1=C(C=CC(=C1)OC)OC)O	{1: 5, 3: 3, 14: 3, 20: 1, 22: 2, 31: 1}
Did not match all atoms present	61-16-5	CC(C(C1=C(C=CC(=C1)OC)OC)O)N.Cl	{1: 3, 3: 2, 14: 3, 17: 1, 20: 1, 22: 2, 30: 1}
Did not match all atoms present	61-19-8	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 4, 22: 1, 23: 1, 29: 1, 30: 1}
Did not match all atoms present	61-25-6	COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl	{1: 4, 2: 1, 35: 1, 14: 7, 17: 1, 22: 4}
Did not match all atoms present	61-28-9	CCN1C(=O)CC2=CC=CC=C21	{1: 1, 2: 1, 33: 1, 11: 1, 14: 4, 25: 1}
Did not match all atoms present	61-31-4	C1=CC=C2C(=C1)C=CC=C2CC(=O)[O-].[Na+]	{24: 1, 2: 1, 14: 7}
Did not match all atoms present	61-33-6	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C	{1: 2, 2: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	61-49-4	CNCCC1=CNC2=CC=CC=C21	{32: 1, 1: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	61-50-7	CN(C)CCC1=CNC2=CC=CC=C21	{32: 1, 1: 2, 2: 2, 14: 5, 33: 1}
Did not match all atoms present	61-51-8	CCN(CC)CCC1=CNC2=CC=CC=C21	{32: 1, 1: 2, 2: 4, 14: 5, 33: 1}
Did not match all atoms present	61-54-1	C1=CC=C2C(=C1)C(=CN2)CCN	{32: 1, 2: 2, 30: 1, 14: 5}
Did not match all atoms present	61-56-3	C1CCS(=O)(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N	{33: 1, 30: 1, 11: 4, 29: 4, 14: 4}
Did not match all atoms present	61-57-4	C1CN(C(=O)N1)C2=NC=C(S2)[N+](=O)[O-]	{32: 1, 33: 1, 35: 1, 38: 1, 41: 1, 11: 2, 14: 1, 25: 1}
Did not match all atoms present	61-67-6	CC1=C(C(=NC=C1CO)C)O	{1: 2, 2: 1, 35: 1, 14: 1, 20: 1, 21: 1}
Did not match all atoms present	61-68-7	CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)O)C	{1: 2, 27: 1, 14: 7, 31: 1}
Did not match all atoms present	61-72-3	CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O	{1: 3, 35: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 4, 17: 1, 23: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	61-73-4	CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-]	{1: 4, 35: 1, 33: 2, 41: 1, 14: 6, 17: 1}
Did not match all atoms present	61-75-6	CC[N+](C)(C)CC1=CC=CC=C1Br.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 18: 1, 14: 8, 29: 3}
Did not match all atoms present	61-78-9	C1=CC(=CC=C1C(=O)NCC(=O)O)N	{2: 1, 14: 4, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	61-80-3	C1=CC2=C(C=C1Cl)N=C(O2)N	{17: 1, 35: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	61-82-5	C1=NNC(=N1)N	{32: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	610-02-6	C1=CC(=C(C(=C1C(=O)O)O)O)O	{27: 1, 21: 3, 14: 2}
Did not match all atoms present	610-04-8	C1=CC(=C(C(=C1)C(=O)O)O)C=O	{26: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	610-14-0	C1=CC=C(C(=C1)C(=O)Cl)[N+](=O)[O-]	{24: 1, 17: 1, 38: 1, 14: 4}
Did not match all atoms present	610-15-1	C1=CC=C(C(=C1)C(=O)N)[N+](=O)[O-]	{24: 1, 38: 1, 30: 1, 14: 4}
Did not match all atoms present	610-16-2	CN(C)C1=CC=CC=C1C(=O)O	{1: 2, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	610-17-3	CN(C)C1=CC=CC=C1[N+](=O)[O-]	{1: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	610-20-8	C(C(C(=O)O)O[N+](=O)[O-])(C(=O)O)O[N+](=O)[O-]	{27: 2, 3: 2, 22: 2}
Did not match all atoms present	610-22-0	COC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC	{1: 2, 28: 2, 38: 1, 14: 3}
Did not match all atoms present	610-23-1	CC1=CC(=C(C=C1C)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 2, 14: 2}
Did not match all atoms present	610-25-3	CC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 2}
Did not match all atoms present	610-27-5	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)C(=O)O	{27: 2, 38: 1, 14: 3}
Did not match all atoms present	610-28-6	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)[N+](=O)[O-]	{27: 1, 38: 2, 14: 3}
Did not match all atoms present	610-29-7	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O	{27: 2, 38: 1, 14: 3}
Did not match all atoms present	610-30-0	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)O	{27: 1, 38: 2, 14: 3}
Did not match all atoms present	610-31-1	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 3}
Did not match all atoms present	610-34-4	CCOC(=O)C1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	610-35-5	C1=CC(=C(C=C1O)C(=O)O)C(=O)O	{27: 2, 21: 1, 14: 3}
Did not match all atoms present	610-39-9	CC1=CC(=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 3}
Did not match all atoms present	610-40-2	C1=CC(=C(C=C1Cl)[N+](=O)[O-])[N+](=O)[O-]	{17: 1, 38: 2, 14: 3}
Did not match all atoms present	610-41-3	C1=CC(=C(C=C1N)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 30: 1, 14: 3}
Did not match all atoms present	610-46-8	CC1=CC2=CC3=CC=CC=C3C=C2C(=C1)C	{1: 2, 14: 8}
Did not match all atoms present	610-48-0	CC1=CC=CC2=CC3=CC=CC=C3C=C12	{1: 1, 14: 9}
Did not match all atoms present	610-49-1	C1=CC=C2C=C3C(=CC2=C1)C=CC=C3N	{30: 1, 14: 9}
Did not match all atoms present	610-50-4	C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O	{21: 1, 14: 9}
Did not match all atoms present	610-53-7	CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 1: 1, 38: 2, 14: 3, 31: 1}
Did not match all atoms present	610-54-8	CCOC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 2, 22: 1, 14: 3}
Did not match all atoms present	610-66-2	C1=CC=C(C(=C1)CC#N)[N+](=O)[O-]	{2: 1, 38: 1, 37: 1, 14: 4}
Did not match all atoms present	610-67-3	CCOC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	610-69-5	CC(=O)OC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	610-71-9	C1=CC(=C(C=C1Br)C(=O)O)Br	{18: 2, 27: 1, 14: 3}
Did not match all atoms present	610-72-0	CC1=CC(=C(C=C1)C)C(=O)O	{1: 2, 27: 1, 14: 3}
Did not match all atoms present	610-74-2	C1=CC(=C(C=C1N)C(=O)O)N	{27: 1, 30: 2, 14: 3}
Did not match all atoms present	610-81-1	C1=CC(=C(C=C1O)[N+](=O)[O-])N	{30: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	610-91-3	CC1=CC(=C(C=C1C)[N+](=O)[O-])C	{1: 3, 38: 1, 14: 2}
Did not match all atoms present	610-93-5	C1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O1	{11: 1, 28: 1, 38: 1, 14: 3}
Did not match all atoms present	610-94-6	COC(=O)C1=CC=CC=C1Br	{1: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	610-96-8	COC(=O)C1=CC=CC=C1Cl	{1: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	610-97-9	COC(=O)C1=CC=CC=C1I	{1: 1, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	610-99-1	CCC(=O)C1=CC=CC=C1O	{24: 1, 1: 1, 2: 1, 21: 1, 14: 4}
Did not match all atoms present	6100-05-6	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.[K+].[K+].[K+]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	61001-31-8	C1CN2C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C41	{33: 1, 11: 2, 14: 10, 35: 1}
Did not match all atoms present	61001-36-3	C1=CC=C(C=C1)C2=NN3C=CC4=CC=CC=C4C3=C2	{33: 1, 35: 1, 14: 12}
Did not match all atoms present	61001-40-9	C1CN2C(=C(C(=N2)C3=CC=CC=C3)CO)C4=CC=CC=C41	{33: 1, 2: 1, 35: 1, 11: 2, 14: 9, 20: 1}
Did not match all atoms present	61001-42-1	C1C2=CC=CC=C2C3=CC(=NN31)C4=CC=CC=C4	{33: 1, 11: 1, 14: 10, 35: 1}
Did not match all atoms present	61003-61-0	[OH-].[Tl+2]	{}
Did not match all atoms present	61005-12-7	CCC(C)C1=CC=CC=C1OC(=O)N	{1: 2, 2: 1, 3: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	61012-91-7	CN1CN(N(CN1CC2=CC=CC=C2)C)CC3=CC=CC=C3	{1: 2, 2: 2, 11: 2, 14: 10, 33: 4}
Did not match all atoms present	61019-03-2	CC1=CC(=CC(=C1[N+](=O)[O-])C)OC	{1: 3, 38: 1, 22: 1, 14: 2}
Did not match all atoms present	6102-28-9	CCCCCCCCCCCCCCNCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 15, 31: 1}
Did not match all atoms present	61020-03-9	CC(=C)C=C.C=CC1=CC=CC=C1C=C	{1: 1, 14: 4, 5: 4, 6: 3, 7: 1}
Did not match all atoms present	6103-33-9	CC1=CC2=C(C=C1)OC3=CC=CC=C3S2	{1: 1, 41: 1, 14: 7, 23: 1}
Did not match all atoms present	61033-71-4	C1CN=C(N1)C2=CC=C(C=C2)N	{32: 1, 35: 1, 11: 2, 14: 4, 15: 1, 30: 1}
Did not match all atoms present	61034-40-0	CC1CN(CC(N1C(=O)C2=CC=CC=C2)C)N=O	{1: 2, 34: 1, 33: 2, 11: 2, 12: 2, 14: 5, 24: 1, 29: 1}
Did not match all atoms present	61036-64-4	CCCCC/C=C/CCC(=O)NC1C(C(C(OC1OC2=C3C=C4C=C2OC5=C(C=C(C=C5)C(C6C(=O)NC(C7=CC(=CC(=C7C8=C(C=CC(=C8)C(C(=O)N6)NC(=O)C4NC(=O)C9C1=CC(=C(C(=C1)O)C)OC1=C(C=CC(=C1)C(C(=O)NC(C(C1=CC(=C(O3)C=C1)Cl)O)C(=O)N9)N)O)O)OC1C(C(C(C(O1)CO)O)O)O)O)C(=O)OC)OC1C(C(C(C(O1)CO)O)O)NC(=O)C)Cl)CO)O)O	{32: 6, 1: 4, 2: 9, 6: 2, 12: 24, 14: 18, 17: 2, 20: 11, 21: 4, 22: 3, 23: 6, 24: 2, 25: 6, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	61038-96-8	CC(=O)NC1=CC(=CC=C1)N(CCC(=O)OC)CCC(=O)OC	{1: 3, 2: 4, 33: 1, 14: 4, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	61038-97-9	CC(=O)NC1=C(C=CC(=C1)N(CCC(=O)OC)CCC(=O)OC)N=NC2=CC=C(C=C2)C(=O)OC	{1: 4, 2: 4, 33: 1, 34: 2, 14: 7, 24: 1, 28: 3, 31: 1}
Did not match all atoms present	6104-56-9	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC(=O)C5=CC=C(C=C5)N)S(=O)(=O)[O-])N=NC6=CC7=C(C=C(C=C7C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 3, 14: 20, 15: 2, 24: 2, 25: 1, 29: 9, 30: 1, 31: 3}
Did not match all atoms present	61048-75-7	CC(C)CC(C)OCC(CS(=O)(=O)[O-])O.[Na+]	{1: 3, 2: 3, 3: 3, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	61049-90-9	CCCCN(CCO)C1=CC=C(C=C1)N=NC2=NC(=NS2)C3=CC=CC=C3	{1: 1, 2: 5, 35: 2, 33: 1, 41: 1, 34: 2, 14: 9, 20: 1}
Did not match all atoms present	61050-17-7	COC1=CC=C(C=C1)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=C(C=CC(=C4)OC)OC	{1: 3, 34: 1, 14: 12, 15: 2, 22: 3, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	61050-19-9	CCOC1=CC=CC=C1N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=C(C=CC(=C4)OC)OC	{1: 3, 2: 1, 34: 1, 14: 12, 15: 2, 22: 3, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	61050-21-3	COC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC=CC=C4OC)/C2=O	{1: 3, 34: 1, 14: 12, 15: 2, 22: 3, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	61050-22-4	CCOC1=CC=C(C=C1)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=C(C=CC(=C4)OC)OC	{1: 3, 2: 1, 34: 1, 14: 12, 15: 2, 22: 3, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	61050-41-7	CCC1=CC=C(C=C1)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=C(C=C4)OC	{1: 2, 2: 1, 34: 1, 14: 13, 15: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	61050-46-2	CCC1=CC=CC=C1N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=C(C=CC(=C4)OC)OC	{1: 3, 2: 1, 34: 1, 14: 12, 15: 2, 22: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	6106-07-6	C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)C[C@@H](C(=O)[O-])N.O.O.O.O.O.[Na+]	{2: 1, 3: 1, 14: 4, 19: 4, 21: 1, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	6106-18-9	CC1=C2C(C(CCC2(C=CC1=O)C)C(C)C(=O)[O-])O.[Na+]	{1: 3, 3: 1, 11: 2, 12: 2, 13: 1, 14: 2, 15: 2, 20: 1, 24: 1, 25: 1}
Did not match all atoms present	6106-24-7	C(C(C(=O)[O-])O)(C(=O)[O-])O.O.O.[Na+].[Na+]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	6106-41-8	CCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 3}
Did not match all atoms present	6106-46-3	C[N+]1(C2CC(CC1C3C2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.[N+](=O)([O-])[O-]	{1: 2, 2: 1, 3: 1, 11: 2, 12: 5, 14: 5, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	6106-81-6	C[N+]1(C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4)[O-].Br	{1: 1, 2: 1, 3: 1, 11: 2, 12: 5, 14: 5, 18: 1, 20: 1, 23: 1, 28: 1, 29: 1}
Did not match all atoms present	61066-82-8	CCCC(=O)OC(C#N)C1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 37: 1, 14: 5, 28: 1}
Did not match all atoms present	61066-88-4	CC(C)(C)CC(=O)OCC1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	6107-56-8	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 12}
Did not match all atoms present	61072-56-8	C1=CC(=C(C=C1Cl)F)C=O	{16: 1, 17: 1, 26: 1, 14: 3}
Did not match all atoms present	61079-72-9	C1=CC(=C(C(=C1C(=O)O)F)F)F	{16: 3, 27: 1, 14: 2}
Did not match all atoms present	6108-17-4	[Li+].CC(=O)[O-].O.O	{24: 1, 1: 1}
Did not match all atoms present	6108-23-2	[Li+].C(=O)[O-].O	{26: 1}
Did not match all atoms present	6109-22-4	C1CCC2=C(C1)C=C3CCC=CC3=C2	{11: 6, 14: 4}
Did not match all atoms present	6109-97-3	CCN1C2=C(C=C(C=C2)N)C3=CC=CC=C31.Cl	{1: 1, 2: 1, 33: 1, 14: 7, 17: 1, 30: 1}
Did not match all atoms present	6109-98-4	CC1=CC(=NC(=O)C2=CC=CC=C2)C(=O)C(=C1)NNC3=CC(=CC(=C3O)S(=O)(=O)O)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 14: 9, 15: 3, 20: 1, 21: 1, 24: 1, 25: 1, 29: 2, 31: 2}
Did not match all atoms present	61090-86-6	C(C(CCl)(CBr)CBr)OP(=O)(Cl)Cl	{2: 4, 4: 1, 17: 3, 18: 2, 22: 1, 29: 1}
Did not match all atoms present	61090-89-9	C1C2(COP(=O)(O1)OCC(CBr)(CBr)CBr)COP(=O)(OC2)OCC(CBr)(CBr)CBr	{2: 8, 4: 2, 11: 4, 13: 1, 18: 6, 22: 2, 23: 4, 29: 2}
Did not match all atoms present	61096-00-2	C[C@@]12[C@H]3C[C@@H]([C@@H]1C(=O)OC2=O)C=C3.CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4	{1: 3, 2: 2, 4: 1, 11: 3, 12: 5, 13: 1, 14: 10, 22: 2, 23: 2, 28: 2}
Did not match all atoms present	611-00-7	C1=CC(=C(C=C1Br)Br)C(=O)O	{18: 2, 27: 1, 14: 3}
Did not match all atoms present	611-01-8	CC1=CC(=C(C=C1)C(=O)O)C	{1: 2, 27: 1, 14: 3}
Did not match all atoms present	611-03-0	C1=CC(=C(C=C1N)N)C(=O)O	{27: 1, 30: 2, 14: 3}
Did not match all atoms present	611-05-2	CC1=C(C=CC(=C1)N)[N+](=O)[O-]	{1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	611-06-3	C1=CC(=C(C=C1Cl)Cl)[N+](=O)[O-]	{17: 2, 38: 1, 14: 3}
Did not match all atoms present	611-07-4	C1=CC(=C(C=C1Cl)O)[N+](=O)[O-]	{17: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	611-08-5	C1=C(C(=O)NC(=O)N1)[N+](=O)[O-]	{32: 2, 25: 2, 38: 1, 14: 1}
Did not match all atoms present	611-09-6	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2	{32: 1, 25: 2, 38: 1, 14: 3}
Did not match all atoms present	611-13-2	COC(=O)C1=CC=CO1	{1: 1, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	611-14-3	CCC1=CC=CC=C1C	{1: 2, 2: 1, 14: 4}
Did not match all atoms present	611-15-4	CC1=CC=CC=C1C=C	{1: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	611-17-6	C1=CC=C(C(=C1)CBr)Cl	{17: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	611-19-8	C1=CC=C(C(=C1)CCl)Cl	{17: 2, 2: 1, 14: 4}
Did not match all atoms present	611-20-1	C1=CC=C(C(=C1)C#N)O	{21: 1, 14: 4, 37: 1}
Did not match all atoms present	611-21-2	CC1=CC=CC=C1NC	{1: 2, 14: 4, 31: 1}
Did not match all atoms present	611-22-3	CC1=CC=CC=C1NO	{1: 1, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	611-23-4	CC1=CC=CC=C1N=O	{1: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	611-24-5	CNC1=CC=CC=C1O	{1: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	611-32-5	CC1=CC=CC2=C1N=CC=C2	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	611-33-6	C1=CC2=C(C(=C1)Cl)N=CC=C2	{17: 1, 35: 1, 14: 6}
Did not match all atoms present	611-34-7	C1=CC2=C(C=CC=N2)C(=C1)N	{35: 1, 30: 1, 14: 6}
Did not match all atoms present	611-35-8	C1=CC=C2C(=C1)C(=CC=N2)Cl	{17: 1, 35: 1, 14: 6}
Did not match all atoms present	611-36-9	C1=CC=C2C(=C1)C(=O)C=CN2	{32: 1, 25: 1, 14: 6}
Did not match all atoms present	611-38-1	C1=CC=C(C=C1)C([N+](=O)[O-])[N+](=O)[O-]	{3: 1, 38: 2, 14: 5}
Did not match all atoms present	611-43-8	CC1=CC=CC(=C1)C2=CC=CC=C2C	{1: 2, 14: 8}
Did not match all atoms present	611-45-0	C1=CC=C(C=C1)CC2=CC=CC3=CC=CC=C32	{2: 1, 14: 12}
Did not match all atoms present	611-48-3	C1=CC=C2C=C(C=CC2=C1)CC3=CC=CC4=CC=CC=C43	{2: 1, 14: 14}
Did not match all atoms present	611-49-4	C1=CC=C2C=C(C=CC2=C1)OC3=CC=CC4=CC=CC=C43	{22: 1, 14: 14}
Did not match all atoms present	611-59-6	CN1C=NC2=C1C(=O)N(C(=O)N2)C	{32: 1, 1: 2, 35: 1, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	611-61-0	CC1=CC=C(C=C1)C2=CC=CC=C2C	{1: 2, 14: 8}
Did not match all atoms present	611-62-1	C1=CC=C(C(=C1)C2=CC=C(C=C2)O)O	{21: 2, 14: 8}
Did not match all atoms present	611-64-3	CC1=C2C=CC=CC2=NC3=CC=CC=C13	{1: 1, 35: 1, 14: 8}
Did not match all atoms present	611-69-8	CC(C)C(C1=CC=CC=C1)O	{1: 2, 3: 2, 20: 1, 14: 5}
Did not match all atoms present	611-70-1	CC(C)C(=O)C1=CC=CC=C1	{24: 1, 1: 2, 3: 1, 14: 5}
Did not match all atoms present	611-71-2	C1=CC=C(C=C1)[C@H](C(=O)O)O	{27: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	611-73-4	C1=CC=C(C=C1)C(=O)C(=O)O	{24: 1, 27: 1, 14: 5}
Did not match all atoms present	611-74-5	CN(C)C(=O)C1=CC=CC=C1	{24: 1, 1: 2, 14: 5, 33: 1}
Did not match all atoms present	611-75-6	CN(CC1=CC(=CC(=C1N)Br)Br)C2CCCCC2.Cl	{1: 1, 2: 1, 33: 1, 11: 5, 12: 1, 14: 2, 17: 1, 18: 2, 30: 1}
Did not match all atoms present	611-79-0	C1=CC(=CC(=C1)N)C(=O)C2=CC(=CC=C2)N	{24: 1, 30: 2, 14: 8}
Did not match all atoms present	611-91-6	C1=CC=C(C=C1)C(C(C(=O)C2=CC=CC=C2)Br)Br	{24: 1, 18: 2, 3: 2, 14: 10}
Did not match all atoms present	611-92-7	CN(C1=CC=CC=C1)C(=O)N(C)C2=CC=CC=C2	{24: 1, 1: 2, 14: 10, 33: 2}
Did not match all atoms present	611-94-9	COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9}
Did not match all atoms present	611-95-0	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)O	{24: 1, 27: 1, 14: 9}
Did not match all atoms present	611-97-2	CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C	{24: 1, 1: 2, 14: 8}
Did not match all atoms present	611-98-3	C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)N)N	{24: 1, 30: 2, 14: 8}
Did not match all atoms present	611-99-4	C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)O)O	{24: 1, 21: 2, 14: 8}
Did not match all atoms present	61109-39-5	CC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])C.[Na+]	{1: 2, 14: 8, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	6111-63-3	[2H]C#CC([2H])([2H])[2H]	{1: 1, 10: 1, 9: 1}
Did not match all atoms present	6111-78-0	CC1=CC=CC2=CC3=C(C=C12)C4=CC=CC=C4C=C3	{1: 1, 14: 11}
Did not match all atoms present	6111-99-5	CCOC(=C(C)[N+]#N)[O-]	{1: 2, 2: 1, 34: 1, 22: 1, 7: 2}
Did not match all atoms present	61113-98-2	CC(C)(C)C1=CC2=C3NC(=C2C(=C1)N(C)C)NC4=C5C=C(C=C(C5=C([N-]4)NC6=C7C=C(C=C(C7=C(N6)NC8=C9C=C(C=C(C9=C(N3)[N-]8)N(C)C)C(C)(C)C)N(C)C)C(C)(C)C)N(C)C)C(C)(C)C.[Cu+2]	{32: 6, 1: 20, 35: 2, 4: 4, 33: 4, 14: 8}
Did not match all atoms present	61114-01-0	CC(C)(C)C1=CC2=C3NC(=C2C(=C1)N(C)C)NC4=C5C=C(C=C(C5=C([N-]4)NC6=C7C=C(C=C(C7=C(N6)NC8=C9C=C(C=C(C9=C(N3)[N-]8)N(C)C)C(C)(C)C)N(C)C)C(C)(C)C)N(C)C)C(C)(C)C.O=[V+2]	{32: 6, 1: 20, 35: 2, 4: 4, 33: 4, 14: 8, 29: 1}
Did not match all atoms present	61114-28-1	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Mg+2].[Ca+2].[Sr+2]	{29: 8}
Did not match all atoms present	61115-29-5	[Na].[Au]	{}
Did not match all atoms present	6112-39-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CSC2=CC=CC=C21	{1: 2, 41: 1, 29: 3, 14: 9, 33: 1}
Did not match all atoms present	6112-71-6	C1=C(NC(=NC1=O)NC#N)N	{32: 1, 35: 1, 37: 1, 14: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	61121-86-6	[2H]C1CC(CC(C1)O)[2H]	{20: 1, 11: 5, 12: 1}
Did not match all atoms present	61128-14-1	CC1=CC=C(C=C1)C=C.CC(=C)C	{1: 3, 14: 4, 5: 2, 6: 1, 7: 1}
Did not match all atoms present	61128-47-0	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)OC6=O.C1=CC(=CC=C1N)N	{1: 2, 4: 1, 14: 18, 22: 2, 28: 4, 30: 2}
Did not match all atoms present	61133-37-7	C=CCOC1C2=CC=CC=C2C(=O)O1	{2: 1, 5: 1, 6: 1, 12: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	61133-38-8	C#CCOC1C2=CC=CC=C2C(=O)O1	{2: 1, 9: 1, 10: 1, 12: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	61134-37-0	C=C=[Se]	{8: 1, 5: 1}
Did not match all atoms present	61135-78-2	C1CC2=CC(=C(CCC3=CC=C1C=C3)C=C2C#N)C#N	{11: 4, 37: 2, 14: 6}
Did not match all atoms present	61136-68-3	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Mn+2].[Mn+2].[Mn+2]	{29: 8}
Did not match all atoms present	6114-58-5	CN(C)C1=CC=C(C=C1)C2CC2(C#N)C3=CC=CC=C3	{1: 2, 37: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 9}
Did not match all atoms present	61141-66-0	CCC1=C(C=C(C=C1)C2=CC=CC=C2)CC	{1: 2, 2: 2, 14: 8}
Did not match all atoms present	61142-81-2	S1[SbH]S[SbH]1	{41: 2}
Did not match all atoms present	61151-88-0	CCOC(=O)C1=C(OC(=N1)C)C(=O)OCC	{1: 3, 2: 2, 35: 1, 28: 2, 23: 1}
Did not match all atoms present	61164-97-4	C1=CC=C(C=C1)C2=C3C(=C(S2)C4=CC=CC=C4)N=S=C3C5=CC=CC=C5	{41: 2, 35: 1, 14: 15, 15: 1}
Did not match all atoms present	61166-00-5	C1=CC(=CC(=C1)OCCOC2=CC=CC(=C2)O)O	{2: 2, 22: 2, 21: 2, 14: 8}
Did not match all atoms present	61166-04-9	CN1C2=C(C=C(C=C2)N)C3=CC=CC=C31	{1: 1, 30: 1, 14: 7, 33: 1}
Did not match all atoms present	61166-05-0	CN1C2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C31	{1: 1, 38: 1, 14: 7, 33: 1}
Did not match all atoms present	61167-58-6	CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)C)OC(=O)C=C	{1: 8, 2: 1, 4: 2, 5: 1, 6: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	61168-62-5	CCOS(=O)(=O)C1=CC=CC=C1.[NH4+]	{1: 1, 2: 1, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	61169-15-1	C/C=C/C=P(C)(C)C	{1: 4, 6: 3}
Did not match all atoms present	61169-16-2	CP(=C/C=C/C1=CC=CC=C1)(C)C	{1: 3, 14: 5, 6: 3}
Did not match all atoms present	61177-45-5	C1[C@@H]2N(C1=O)[C@H](/C(=C/CO)/O2)C(=O)[O-].[K+]	{33: 1, 2: 1, 6: 1, 11: 1, 12: 2, 15: 1, 20: 1, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	6118-19-0	[2H]C([2H])([2H])CN	{1: 1, 2: 1, 30: 1}
Did not match all atoms present	6118-65-6	CC(=O)NC1=CC=CC2=C1C(=O)NC2=O	{32: 1, 1: 1, 14: 3, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	61181-02-0	CC(=C)C(=O)OCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 3, 5: 1, 7: 1, 17: 1, 28: 1}
Did not match all atoms present	61183-51-5	C=PCl	{17: 1, 5: 1}
Did not match all atoms present	61188-13-4	CCCCC(CC)CN.CC(C)CCCCCOP(=O)(O)O	{1: 4, 2: 10, 3: 2, 20: 2, 22: 1, 29: 1, 30: 1}
Did not match all atoms present	61188-14-5	CCCCC(CC)CN.CC(C)CCCCCOP(=O)(O)OCCCCCC(C)C	{1: 6, 2: 15, 3: 3, 20: 1, 22: 2, 29: 1, 30: 1}
Did not match all atoms present	61190-10-1	CCOC(CNCC1=CC=CC=C1)OCC	{1: 2, 2: 4, 3: 1, 14: 5, 22: 2, 31: 1}
Did not match all atoms present	61197-07-7	CCSSC1=C(OC=C1)C	{40: 2, 1: 2, 2: 1, 14: 2, 23: 1}
Did not match all atoms present	612-00-0	CC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 3: 1, 14: 10}
Did not match all atoms present	612-01-1	CN(C1=CC=CC=C1)C(=O)NC2=CC=CC=C2	{24: 1, 1: 1, 33: 1, 14: 10, 31: 1}
Did not match all atoms present	612-03-3	CC1=CC=C(C=C1)N(C)C(=O)C	{24: 1, 1: 3, 14: 4, 33: 1}
Did not match all atoms present	612-08-8	CC[As](CC)(CC)(CC)[As]	{1: 4, 2: 4}
Did not match all atoms present	612-12-4	C1=CC=C(C(=C1)CCl)CCl	{17: 2, 2: 2, 14: 4}
Did not match all atoms present	612-13-5	C1=CC=C(C(=C1)CCl)C#N	{17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	612-14-6	C1=CC=C(C(=C1)CO)CO	{2: 2, 20: 2, 14: 4}
Did not match all atoms present	612-15-7	COC1=CC=CC=C1C=C	{1: 1, 14: 4, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	612-16-8	COC1=CC=CC=C1CO	{1: 1, 2: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	612-17-9	C1C=CCC2=CC=CC=C21	{11: 2, 14: 6}
Did not match all atoms present	612-19-1	CCC1=CC=CC=C1C(=O)O	{1: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	612-22-6	CCC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	612-23-7	C1=CC=C(C(=C1)CCl)[N+](=O)[O-]	{17: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	612-24-8	C1=CC=C(C(=C1)C#N)[N+](=O)[O-]	{38: 1, 37: 1, 14: 4}
Did not match all atoms present	612-25-9	C1=CC=C(C(=C1)CO)[N+](=O)[O-]	{2: 1, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	612-28-2	CNC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	612-29-3	C1=CC=C(C(=C1)N=O)[N+](=O)[O-]	{34: 1, 38: 1, 29: 1, 14: 4}
Did not match all atoms present	612-35-1	C1=CC=C(C=C1)CC2=CC=CC=C2C(=O)O	{2: 1, 27: 1, 14: 9}
Did not match all atoms present	612-37-3	CN1C2=C(NC(=O)NC2=O)NC1=O	{32: 3, 1: 1, 33: 1, 25: 3}
Did not match all atoms present	612-40-8	C1=CC=C(C(=C1)/C=C/C(=O)O)C(=O)O	{27: 2, 14: 4, 6: 2}
Did not match all atoms present	612-41-9	C1=CC=C(C(=C1)/C=C/C(=O)O)[N+](=O)[O-]	{38: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	612-42-0	C1=CC=C(C(=C1)C(=O)O)NCC(=O)O	{2: 1, 27: 2, 14: 4, 31: 1}
Did not match all atoms present	612-45-3	CC1=CC(=C(C=C1)NC(=O)C)[N+](=O)[O-]	{24: 1, 1: 2, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	612-55-5	C1=CC=C2C=C(C=CC2=C1)I	{19: 1, 14: 7}
Did not match all atoms present	612-57-7	C1=CC2=C(C=CC(=C2)Cl)N=C1	{17: 1, 35: 1, 14: 6}
Did not match all atoms present	612-58-8	CC1=CC2=CC=CC=C2N=C1	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	612-60-2	CC1=CC2=C(C=CC=N2)C=C1	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	612-61-3	C1=CC2=C(C=C(C=C2)Cl)N=C1	{17: 1, 35: 1, 14: 6}
Did not match all atoms present	612-62-4	C1=CC=C2C(=C1)C=CC(=N2)Cl	{17: 1, 35: 1, 14: 6}
Did not match all atoms present	612-64-6	CCN(C1=CC=CC=C1)N=O	{1: 1, 2: 1, 33: 1, 34: 1, 14: 5, 29: 1}
Did not match all atoms present	612-69-1	COC1=CC(=CC(=C1O)OC)C2=CC(=C(C(=C2)OC)O)OC	{1: 4, 22: 4, 21: 2, 14: 4}
Did not match all atoms present	612-71-5	C1=CC=C(C=C1)C2=CC(=CC(=C2)C3=CC=CC=C3)C4=CC=CC=C4	{14: 18}
Did not match all atoms present	612-75-9	CC1=CC=CC(=C1)C2=CC(=CC=C2)C	{1: 2, 14: 8}
Did not match all atoms present	612-76-0	C1=CC(=CC(=C1)O)C2=CC(=CC=C2)O	{21: 2, 14: 8}
Did not match all atoms present	612-78-2	C1=CC=C2C=C(C=CC2=C1)C3=CC4=CC=CC=C4C=C3	{14: 14}
Did not match all atoms present	612-81-7	C1=CC=C2C(=C1)C=CC(=N2)C3=CC4=CC=CC=C4N=C3	{35: 2, 14: 12}
Did not match all atoms present	612-82-8	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N.Cl.Cl	{1: 2, 30: 2, 14: 6, 17: 2}
Did not match all atoms present	612-83-9	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)Cl)Cl)N.Cl.Cl	{17: 4, 30: 2, 14: 6}
Did not match all atoms present	612-84-0	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)O)C)O	{1: 2, 21: 2, 14: 6}
Did not match all atoms present	612-94-2	C1=CC=C(C=C1)C2=CC3=CC=CC=C3C=C2	{14: 12}
Did not match all atoms present	612-95-3	C1=CC=C(C=C1)C2=CC3=C(C=C2)N=CC=C3	{35: 1, 14: 11}
Did not match all atoms present	612-96-4	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2	{35: 1, 14: 11}
Did not match all atoms present	612-98-6	C1=CC=C(C=C1)CN(C2=CC=CC=C2)N=O	{33: 1, 2: 1, 34: 1, 29: 1, 14: 10}
Did not match all atoms present	6120-10-1	CC1=CC(=CC(=C1N(C)C)C)O	{1: 4, 21: 1, 14: 2, 33: 1}
Did not match all atoms present	6120-95-2	C1CC1(C2=CC=CC=C2)C(=O)O	{27: 1, 11: 2, 13: 1, 14: 5}
Did not match all atoms present	61203-99-4	CCCC1CCC(CC1)C2=CC=C(C=C2)C#N	{1: 1, 2: 2, 37: 1, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	61204-00-0	CCCCC1CCC(CC1)C2=CC=C(C=C2)C#N	{1: 1, 2: 3, 37: 1, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	61204-01-1	CCCCCC1CCC(CC1)C2=CC=C(C=C2)C#N	{1: 1, 2: 4, 37: 1, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	61204-03-3	CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C#N	{1: 1, 2: 6, 37: 1, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	61213-25-0	C1C(C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)Cl)CCl	{33: 1, 2: 1, 4: 1, 11: 1, 12: 2, 14: 4, 16: 3, 17: 2, 25: 1}
Did not match all atoms present	61214-51-5	CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]3CCCN3C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC4=CC=CC=C4)NC(=O)CNC(=O)CNC(=O)[C@H](CC5=CC=C(C=C5)O)N	{1: 16, 2: 43, 3: 35, 33: 1, 40: 1, 11: 3, 12: 1, 14: 18, 20: 5, 21: 2, 24: 33, 27: 3, 30: 9, 31: 29}
Did not match all atoms present	61219-63-4	[CH2]C1=CC(=CC=C1)[N+](=O)[O-]	{38: 1, 5: 1, 14: 4}
Did not match all atoms present	61222-49-9	CCCCOP(=O)(C(C1=CC=CC=C1)O)OCCCC	{1: 2, 2: 6, 3: 1, 14: 5, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	61227-05-2	CC1=NC=C(C(=N1)N)CN(/C(=C(\SS/C(=C(\N(C=O)CC2=CN=C(N=C2N)C)/C)/CCO)/CCO)/C)C=O.C1=C(NC(=O)NC1=O)C(=O)O	{32: 2, 1: 4, 2: 6, 35: 4, 33: 2, 7: 4, 40: 2, 14: 3, 20: 2, 25: 2, 26: 2, 27: 1, 30: 2}
Did not match all atoms present	6123-87-1	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NCCO	{33: 1, 2: 2, 14: 10, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	6123-88-2	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NCCNC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4	{24: 2, 33: 2, 2: 2, 14: 20, 31: 2}
Did not match all atoms present	61231-45-6	C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC4=CC=CC=C43	{33: 1, 14: 17}
Did not match all atoms present	61235-67-4	CCCC[Sn]1(SCC(S1)C)CCCC	{1: 3, 2: 6, 11: 1, 12: 1, 41: 2}
Did not match all atoms present	61247-57-2	C1CCOC1.C1CCOC1.Cl[Nb](Cl)(Cl)Cl	{17: 4, 11: 8, 23: 2}
Did not match all atoms present	61248-61-1	CC1=CC(=C(C(=C1)C)OC(C)(C)C)C	{1: 6, 4: 1, 22: 1, 14: 2}
Did not match all atoms present	61248-63-3	CCOC1=C(C=C(C=C1C)C)C	{1: 4, 2: 1, 22: 1, 14: 2}
Did not match all atoms present	6125-24-2	C1=CC=C(C=C1)CC[N+](=O)[O-]	{2: 2, 38: 1, 14: 5}
Did not match all atoms present	61257-43-0	CC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)C=CC4=CC=C(C=C4)C(=O)O	{1: 1, 35: 1, 6: 2, 14: 11, 23: 1, 27: 1}
Did not match all atoms present	6126-22-3	C1=C(NNC1=O)N	{32: 2, 25: 1, 30: 1, 14: 1}
Did not match all atoms present	61260-04-6	[2H]C([2H])([2H])C([2H])([2H])SCC	{40: 1, 1: 2, 2: 2}
Did not match all atoms present	61260-32-0	CC(C)C1=CC=C(C=C1)[O-].[Na+]	{1: 2, 3: 1, 14: 4}
Did not match all atoms present	61262-53-1	C(COC1=C(C(=C(C(=C1Br)Br)Br)Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br	{2: 2, 18: 10, 22: 2}
Did not match all atoms present	6127-20-4	CC1=C(C2=C(N1)C=CC=C2Cl)CC(=O)O	{32: 1, 1: 1, 2: 1, 14: 3, 17: 1, 27: 1}
Did not match all atoms present	61279-70-7	B(=O)O[AlH2]	{29: 1, 22: 1}
Did not match all atoms present	61279-79-6	O[U](=O)=O	{20: 1, 29: 2}
Did not match all atoms present	61286-62-2	COC1=CC(=C(C=C1)OC)[N+]#N.F[P-](F)(F)(F)(F)F	{16: 6, 1: 2, 34: 1, 22: 2, 14: 3}
Did not match all atoms present	61286-65-5	COC1=CC(=C(C=C1)[N+]#N)OC.F[P-](F)(F)(F)(F)F	{16: 6, 1: 2, 34: 1, 22: 2, 14: 3}
Did not match all atoms present	6129-15-3	C[C@H](C1=CC=CC=C1)N2C(=O)C=CC2=O	{1: 1, 3: 1, 33: 1, 14: 7, 25: 2}
Did not match all atoms present	61290-31-1	[Li+].CCC(COC1=CC=C(C=C1)N=NC2=C(C=C(C(=C2)C)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])OC)O	{1: 3, 2: 2, 3: 1, 34: 4, 14: 10, 20: 1, 22: 2, 29: 3}
Did not match all atoms present	61292-90-8	CCOC(=O)CCC1=CC(=C(C=C1)O)OC	{1: 2, 2: 3, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	61295-75-8	CN(C(=O)NCCC1=CC=C(C=C1)OC(=O)N(C)N=O)N=O	{1: 2, 2: 2, 33: 2, 34: 2, 14: 4, 24: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	613-03-6	CC(=O)OC1=CC(=C(C=C1)OC(=O)C)OC(=O)C	{1: 3, 28: 3, 14: 3}
Did not match all atoms present	613-08-1	C1=CC=C2C=C3C=C(C=CC3=CC2=C1)C(=O)O	{27: 1, 14: 9}
Did not match all atoms present	613-12-7	CC1=CC2=CC3=CC=CC=C3C=C2C=C1	{1: 1, 14: 9}
Did not match all atoms present	613-13-8	C1=CC=C2C=C3C=C(C=CC3=CC2=C1)N	{30: 1, 14: 9}
Did not match all atoms present	613-14-9	C1=CC=C2C=C3C=C(C=CC3=CC2=C1)O	{21: 1, 14: 9}
Did not match all atoms present	613-15-0	CC1=CC2=CC3=CC=CC=C3N=C2C=C1	{1: 1, 35: 1, 14: 8}
Did not match all atoms present	613-21-8	CC1=NC2=C(C=C1)C=C(C=C2)O	{1: 1, 35: 1, 21: 1, 14: 5}
Did not match all atoms present	613-28-5	CCCN(CCC)C1=CC=C(C=C1)C=O	{1: 2, 2: 4, 26: 1, 14: 4, 33: 1}
Did not match all atoms present	613-29-6	CCCCN(CCCC)C1=CC=CC=C1	{1: 2, 2: 6, 14: 5, 33: 1}
Did not match all atoms present	613-30-9	CC1=NC2=C(C=C1)C=C(C=C2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	613-31-0	C1C2=CC=CC=C2CC3=CC=CC=C31	{11: 2, 14: 8}
Did not match all atoms present	613-33-2	CC1=CC=C(C=C1)C2=CC=C(C=C2)C	{1: 2, 14: 8}
Did not match all atoms present	613-35-4	CC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C	{24: 2, 1: 2, 14: 8, 31: 2}
Did not match all atoms present	613-37-6	COC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 22: 1, 14: 9}
Did not match all atoms present	613-39-8	C1CN(CCN1C2=CC=CC=C2)C3=CC=CC=C3	{33: 2, 11: 4, 14: 10}
Did not match all atoms present	613-42-3	C1=CC=C(C=C1)CC2=CC=C(C=C2)C3=CC=CC=C3	{2: 1, 14: 14}
Did not match all atoms present	613-43-4	CCOC1=CC=CC=C1N=NC2=CC=CC=C2OCC	{1: 2, 2: 2, 34: 2, 22: 2, 14: 8}
Did not match all atoms present	613-45-6	COC1=CC(=C(C=C1)C=O)OC	{1: 2, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	613-46-7	C1=CC=C2C=C(C=CC2=C1)C#N	{37: 1, 14: 7}
Did not match all atoms present	613-47-8	C1=CC=C2C=C(C=CC2=C1)NO	{20: 1, 14: 7, 31: 1}
Did not match all atoms present	613-48-9	CCN(CC)C1=CC=C(C=C1)C	{1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	613-50-3	C1=CC2=C(C=CC(=C2)[N+](=O)[O-])N=C1	{35: 1, 38: 1, 14: 6}
Did not match all atoms present	613-51-4	C1=CC2=C(C=C(C=C2)[N+](=O)[O-])N=C1	{35: 1, 38: 1, 14: 6}
Did not match all atoms present	613-53-6	C1=CC=C2C(=C1)C=CC(=N2)C(Br)(Br)Br	{18: 3, 35: 1, 4: 1, 14: 6}
Did not match all atoms present	613-54-7	C1=CC=C2C=C(C=CC2=C1)C(=O)CBr	{24: 1, 2: 1, 18: 1, 14: 7}
Did not match all atoms present	613-59-2	C1=CC=C(C=C1)CC2=CC3=CC=CC=C3C=C2	{2: 1, 14: 12}
Did not match all atoms present	613-62-7	C1=CC=C(C=C1)COC2=CC3=CC=CC=C3C=C2	{2: 1, 22: 1, 14: 12}
Did not match all atoms present	613-65-0	CN(C)C1=CC=C(C=C1)N=NC2=CC3=CC=CC=C3C=C2	{1: 2, 34: 2, 14: 11, 33: 1}
Did not match all atoms present	613-69-4	CCOC1=CC=CC=C1C=O	{1: 1, 2: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	613-70-7	CC(=O)OC1=CC=CC=C1OC	{1: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	613-73-0	C1=CC=C(C(=C1)CC#N)CC#N	{2: 2, 37: 2, 14: 4}
Did not match all atoms present	613-75-2	CC(=O)OC(C1=CC=CO1)OC(=O)C	{1: 2, 3: 1, 28: 2, 14: 3, 23: 1}
Did not match all atoms present	613-77-4	C1=CC(=CC2=C1C=CC(=N2)Cl)Cl	{17: 2, 35: 1, 14: 5}
Did not match all atoms present	613-80-9	C1=CC=C2C=C(C=CC2=C1)OC3=CC4=CC=CC=C4C=C3	{22: 1, 14: 14}
Did not match all atoms present	613-81-0	C1=CC=C2C=C(C=CC2=C1)SC3=CC4=CC=CC=C4C=C3	{40: 1, 14: 14}
Did not match all atoms present	613-84-3	CC1=CC(=C(C=C1)O)C=O	{1: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	613-87-6	CC[C@@H](C1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	613-89-8	C1=CC=C(C=C1)C(=O)CN	{24: 1, 2: 1, 30: 1, 14: 5}
Did not match all atoms present	613-90-1	C1=CC=C(C=C1)C(=O)C#N	{24: 1, 37: 1, 14: 5}
Did not match all atoms present	613-91-2	CC(=NO)C1=CC=CC=C1	{1: 1, 34: 1, 20: 1, 14: 5, 7: 1}
Did not match all atoms present	613-93-4	CNC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 31: 1}
Did not match all atoms present	613-94-5	C1=CC=C(C=C1)C(=O)NN	{24: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	613-97-8	CCN(C)C1=CC=CC=C1	{1: 2, 2: 1, 14: 5, 33: 1}
Did not match all atoms present	6130-01-4	CCNC1=C(C=C(C=C1)C)[N+]#N.Cl[Zn-](Cl)Cl	{1: 2, 2: 1, 34: 1, 14: 3, 17: 3, 31: 1}
Did not match all atoms present	6130-75-2	COC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	6131-90-4	CC(=O)[O-].O.O.O.[Na+]	{24: 1, 1: 1}
Did not match all atoms present	6131-99-3	C[As](=O)(C)[O-].O.O.O.[Na+]	{1: 2, 29: 2}
Did not match all atoms present	61312-35-4	CC(=O)CC(=O)OCC1=CC=C(C=C1)OC	{1: 2, 2: 2, 14: 4, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	61315-63-7	C1COC(=O)C1N=C=S	{8: 1, 28: 1, 34: 1, 11: 2, 12: 1}
Did not match all atoms present	61318-58-9	COC1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=CC=C(C=C3)N=C4C=CC(=O)C=C4	{1: 1, 34: 1, 14: 16, 15: 1, 22: 1, 25: 1, 31: 2}
Did not match all atoms present	61318-91-0	C1=CC(=CC=C1CSC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-]	{33: 1, 2: 2, 3: 1, 40: 1, 14: 10, 17: 3, 35: 1, 20: 1}
Did not match all atoms present	6132-02-1	C(=O)([O-])[O-].O.O.O.O.O.O.O.O.O.O.[Na+].[Na+]	{24: 1}
Did not match all atoms present	6132-04-3	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	61332-89-6	[CH-]1C=CC=C1.[Co]	{14: 5}
Did not match all atoms present	61332-95-4	[CH-]1C=CC=C1.[Ni]	{14: 5}
Did not match all atoms present	61336-70-7	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)C(=O)O)C.O.O.O	{1: 2, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 4, 21: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	61341-86-4	C1CC2=CC=CC=C2[C@H]1N	{11: 2, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	61342-05-0	C[Si](C)(C)CC1=CC=C(C=C1)C2=CC=C(C=C2)C[Si](C)(C)C	{1: 6, 2: 2, 14: 8}
Did not match all atoms present	61346-78-9	CC(=O)C1=CC2=C(C=C1)C3CC2C=C3	{24: 1, 1: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	61346-79-0	C1C2C=CC1C3=C(C=CC=C23)C#N	{11: 1, 12: 2, 37: 1, 14: 5}
Did not match all atoms present	61346-80-3	C1C2C=CC1C3=C2C=CC=C3N	{11: 1, 12: 2, 30: 1, 14: 5}
Did not match all atoms present	61346-81-4	C1C2C=CC1C3=C2C=CC=C3F	{16: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	61349-32-4	[O-][W](=O)[O-].[Ba+2]	{29: 3}
Did not match all atoms present	61349-43-7	O=[Mo]1O[Mo](=O)(=O)O[Mo](=O)(=O)O1	{29: 5, 23: 3}
Did not match all atoms present	61349-45-9	[SH-].S1[SbH]S[Sb]S[SbH]1	{41: 3}
Did not match all atoms present	61349-47-1	S1[Sb]S[Sb]2S[Sb]S[Sb]1S2	{41: 5}
Did not match all atoms present	61354-93-6	CCN1C(=CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C=CC3=CC=CC=C31	{1: 1, 2: 1, 38: 2, 6: 1, 33: 1, 14: 9, 15: 1}
Did not match all atoms present	6136-67-0	COC1=CC=CC(=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9}
Did not match all atoms present	6136-68-1	CC(=O)C1=CC=CC(=C1)C#N	{24: 1, 1: 1, 37: 1, 14: 4}
Did not match all atoms present	61372-56-3	COCCCOC1=CC=CC=C1	{1: 1, 2: 3, 22: 2, 14: 5}
Did not match all atoms present	61372-57-4	COCCCCCOC1=CC=CC=C1	{1: 1, 2: 5, 22: 2, 14: 5}
Did not match all atoms present	61372-58-5	COCCCCCCOC1=CC=CC=C1	{1: 1, 2: 6, 22: 2, 14: 5}
Did not match all atoms present	61374-51-4	CC1=[C-]CC=C1.CC1=[C-]CC=C1.[Cl-].[Cl-].[Nb+2]	{1: 2, 11: 2, 17: 2, 14: 4, 15: 2}
Did not match all atoms present	61377-19-3	CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C(=O)C2=O)C=C(C1=O)C(C)(C)C	{1: 12, 4: 4, 25: 4, 14: 4, 15: 6}
Did not match all atoms present	61379-65-5	C[C@H]1/C=C/C=C(\C(=O)NC\2=C(C3=C(C(=C4C(=C3C(=O)/C2=C/NN5CCN(CC5)C6CCCC6)C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)/C	{32: 1, 1: 9, 6: 1, 33: 2, 11: 8, 12: 9, 13: 1, 14: 5, 15: 4, 20: 3, 21: 1, 22: 1, 23: 2, 25: 3, 28: 1, 31: 1}
Did not match all atoms present	6138-56-3	CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=N2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 5, 35: 1, 4: 1, 33: 2, 14: 9, 20: 1, 27: 3}
Did not match all atoms present	61393-36-0	[I-].[I-].[Nd]	{19: 2}
Did not match all atoms present	614-00-6	CN(C1=CC=CC=C1)N=O	{1: 1, 34: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	614-14-2	CCCC(C1=CC=CC=C1)O	{1: 1, 2: 2, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	614-16-4	C1=CC=C(C=C1)C(=O)CC#N	{24: 1, 2: 1, 37: 1, 14: 5}
Did not match all atoms present	614-17-5	CCNC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	614-18-6	CCOC(=O)C1=CN=CC=C1	{1: 1, 2: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	614-19-7	C1=CC=C(C=C1)C(CC(=O)O)N	{27: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	614-21-1	C1=CC=C(C=C1)C(=O)C[N+](=O)[O-]	{24: 1, 2: 1, 38: 1, 14: 5}
Did not match all atoms present	614-26-6	C1=CC(=CC=C1N=[N+](C2=CC=C(C=C2)Cl)[O-])Cl	{17: 2, 34: 1, 29: 1, 14: 8, 33: 1}
Did not match all atoms present	614-27-7	COC(=O)CC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	614-28-8	C1=CC=C(C=C1)C(=O)NC(=O)C2=CC=CC=C2	{24: 2, 14: 10, 31: 1}
Did not match all atoms present	614-29-9	C1=CC=C(C=C1)CC(C2=CC=CC=C2)O	{2: 1, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	614-30-2	CN(CC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 14: 10, 33: 1}
Did not match all atoms present	614-31-3	C1=CC=C(C=C1)CN(C2=CC=CC=C2)N	{33: 1, 2: 1, 30: 1, 14: 10}
Did not match all atoms present	614-32-4	CC1=CC(=CC=C1)OC(=O)C2=CC=CC=C2	{1: 1, 28: 1, 14: 9}
Did not match all atoms present	614-33-5	C1=CC=C(C=C1)C(=O)OCC(COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3	{2: 2, 3: 1, 28: 3, 14: 15}
Did not match all atoms present	614-34-6	CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2	{1: 1, 28: 1, 14: 9}
Did not match all atoms present	614-39-1	CCN(CC)CCNC(=O)C1=CC=C(C=C1)N.Cl	{1: 2, 2: 4, 33: 1, 14: 4, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	614-45-9	CC(C)(C)OOC(=O)C1=CC=CC=C1	{1: 3, 4: 1, 22: 1, 14: 5, 28: 1}
Did not match all atoms present	614-48-2	C1=CC=C(C=C1)C(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9, 6: 2}
Did not match all atoms present	614-54-0	CCCCCCC(C1=CC=CC=C1)O	{1: 1, 2: 5, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	614-57-3	C1=CC=C(C=C1)/C=C/C=C/C(=O)C2=CC=CC=C2	{24: 1, 14: 10, 6: 4}
Did not match all atoms present	614-60-8	C1=CC=C(C(=C1)/C=C/C(=O)O)O	{27: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	614-61-9	C1=CC=C(C(=C1)OCC(=O)O)Cl	{17: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	614-65-3	C1=CC=C(C=C1)NNC=C2C=CC=CC2=O	{25: 1, 31: 2, 14: 9, 6: 1, 15: 1}
Did not match all atoms present	614-68-6	CC1=CC=CC=C1N=C=O	{8: 1, 1: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	614-69-7	CC1=CC=CC=C1N=C=S	{8: 1, 1: 1, 34: 1, 14: 4}
Did not match all atoms present	614-71-1	CCOC1=CC=CC=C1C	{1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	614-72-2	CCOC1=CC=CC=C1Cl	{1: 1, 2: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	614-73-3	CCOC1=CC=CC=C1I	{1: 1, 2: 1, 19: 1, 22: 1, 14: 4}
Did not match all atoms present	614-75-5	C1=CC=C(C(=C1)CC(=O)O)O	{2: 1, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	614-76-6	CC(=O)NC1=CC=CC=C1Br	{24: 1, 1: 1, 18: 1, 14: 4, 31: 1}
Did not match all atoms present	614-77-7	CC1=CC=CC=C1NC(=O)N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	614-78-8	CC1=CC=CC=C1NC(=S)N	{1: 1, 31: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	614-80-2	CC(=O)NC1=CC=CC=C1O	{24: 1, 1: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	614-82-4	C1=CC(=C(C=C1O)O)CC(=O)O	{2: 1, 27: 1, 21: 2, 14: 3}
Did not match all atoms present	614-83-5	CC1=CC(=C(C=C1)NC(=O)C)Br	{24: 1, 1: 2, 18: 1, 14: 3, 31: 1}
Did not match all atoms present	614-90-4	CC1=C(C=CC(=C1)N=C=O)N=C=O	{8: 2, 1: 1, 34: 2, 29: 2, 14: 3}
Did not match all atoms present	614-94-8	COC1=C(C=C(C=C1)N)N.Cl.Cl	{1: 1, 30: 2, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	614-96-0	CC1=CC2=C(C=C1)NC=C2	{32: 1, 1: 1, 14: 5}
Did not match all atoms present	614-97-1	CC1=CC2=C(C=C1)N=CN2	{32: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	614-98-2	CCOC(=O)C1=COC=C1	{1: 1, 2: 1, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	614-99-3	CCOC(=O)C1=CC=CO1	{1: 1, 2: 1, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	6140-17-6	CC1=CC=C(C=C1)C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4}
Did not match all atoms present	6141-57-7	CC1=C(OC=C1)C(=O)OC	{1: 2, 28: 1, 14: 2, 23: 1}
Did not match all atoms present	6141-58-8	CC1=C(C=CO1)C(=O)OC	{1: 2, 28: 1, 14: 2, 23: 1}
Did not match all atoms present	6141-68-0	CC1=COC(=C1)C(C)(C)C	{1: 4, 4: 1, 14: 2, 23: 1}
Did not match all atoms present	61413-38-5	CC1=CC2=CC=CC=C2C3=C1C4=CC=CC=C4C(=C3)F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	61413-39-6	COC1=CC2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3	{1: 1, 22: 1, 14: 11}
Did not match all atoms present	61413-54-5	COC1=C(C=C(C=C1)C2CC(=O)NC2)OC3CCCC3	{32: 1, 1: 1, 11: 6, 12: 2, 14: 3, 22: 2, 25: 1}
Did not match all atoms present	61417-04-7	COC1=CC=CC2=NC3=CC=CC=C3C(=C21)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 2, 35: 1, 14: 11, 22: 1, 29: 2, 31: 2}
Did not match all atoms present	61417-05-8	COC1=CC=CC2=C(C3=CC=CC=C3N=C21)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 2, 35: 1, 14: 11, 22: 1, 29: 2, 31: 2}
Did not match all atoms present	61417-08-1	CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)Cl	{1: 1, 35: 1, 14: 11, 17: 1, 29: 2, 31: 2}
Did not match all atoms present	61417-10-5	CS(=O)(=O)NC1=CC(=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)N	{1: 1, 35: 1, 14: 11, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	61417-50-3	CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)O.C1=CC(=CC=C1C(=O)O)N.C1=CC(=CC=C1C(=O)O)N.[Ti]	{1: 4, 2: 14, 3: 2, 14: 8, 20: 1, 27: 3, 30: 2}
Did not match all atoms present	61417-52-5	CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.C(CO)O.[Ti]	{27: 2, 1: 4, 2: 30, 3: 2, 20: 2}
Did not match all atoms present	6142-15-0	CC1=CSC(=N1)N.Cl	{1: 1, 35: 1, 41: 1, 14: 1, 17: 1, 30: 1}
Did not match all atoms present	6142-90-1	[2H]C1=C(OC(=C1[2H])[2H])[2H]	{14: 4, 23: 1}
Did not match all atoms present	6142-95-6	CCOC(C#CC1=CC=CC=C1)OCC	{1: 2, 2: 2, 3: 1, 10: 2, 14: 5, 22: 2}
Did not match all atoms present	61420-92-6	[O-]S(=O)[O-].[O-]S(=O)[O-].[Pt+4]	{29: 6}
Did not match all atoms present	61422-45-5	CCCCCCNC(=O)N1C=C(C(=O)NC1=O)F	{32: 1, 1: 1, 2: 5, 33: 1, 14: 1, 16: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	61424-57-5	CCC(CO)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{1: 1, 2: 4, 4: 1, 14: 7, 20: 3, 27: 3, 28: 2}
Did not match all atoms present	6143-30-2	C1C2CC(C1C=C2)C3=CC=CC=C3	{11: 2, 12: 3, 14: 7}
Did not match all atoms present	6143-68-6	CCN[Si](C)(C)NCC	{1: 4, 2: 2, 31: 2}
Did not match all atoms present	61431-08-1	C[Si]1(C2=CC=CC=C2SC3=CC=CC=C31)C	{1: 2, 14: 8, 41: 1}
Did not match all atoms present	61432-55-1	CC(C)(C1=CC=CC=C1)SC(=O)N2CCCCC2	{1: 2, 4: 1, 33: 1, 40: 1, 11: 5, 14: 5, 24: 1}
Did not match all atoms present	61433-43-0	CNC1=CC2=C(C=C1)C(=O)C(=NNC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)O)S(=O)(=O)O)C(=C2)S(=O)(=O)O	{1: 1, 34: 1, 14: 9, 15: 2, 20: 3, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	61433-54-3	CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(N=CC=C3)C(=O)O)C	{1: 2, 2: 1, 35: 1, 33: 1, 14: 7, 24: 1, 27: 1}
Did not match all atoms present	61434-46-6	CC(C)C1=CC=C(C=C1)C2=CC(=CC=C2)C(C)C	{1: 4, 3: 2, 14: 8}
Did not match all atoms present	61435-02-7	C1=CC=C(C=C1)OC2=CC=C(C=C2)OCCCl	{17: 1, 2: 2, 22: 2, 14: 9}
Did not match all atoms present	61436-49-5	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC	{1: 2, 2: 8, 28: 1, 14: 12}
Did not match all atoms present	61437-85-2	CC1=CC(=C(C=C1N)Cl)C(C#N)C2=CC=C(C=C2)Cl	{1: 1, 3: 1, 37: 1, 14: 6, 17: 2, 30: 1}
Did not match all atoms present	61440-32-2	C1=CC=C(C=C1)CCCCCCCCCl	{17: 1, 2: 8, 14: 5}
Did not match all atoms present	61440-88-8	CC1=CC(=C(C(=C1)C)C2=C(C2=O)C3=C(C=C(C=C3C)C)C)C	{1: 6, 14: 4, 25: 1}
Did not match all atoms present	61443-57-0	CCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCC	{1: 2, 2: 24, 3: 1, 20: 1, 22: 2, 28: 2, 29: 1, 30: 1}
Did not match all atoms present	61445-93-0	CCN(CC)C1=CC=C(C=C1)C=CC(=O)C=CC2=CC=C(C=C2)N(CC)CC	{1: 4, 2: 4, 6: 4, 33: 2, 14: 8, 24: 1}
Did not match all atoms present	6145-29-5	C(P(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{2: 1, 29: 6}
Did not match all atoms present	6145-31-9	C(CP(=O)(O)O)P(=O)(O)O	{2: 2, 20: 4, 29: 2}
Did not match all atoms present	6145-73-9	CC(COP(=O)(OCC(C)Cl)OCC(C)Cl)Cl	{1: 3, 2: 3, 3: 3, 17: 3, 22: 3, 29: 1}
Did not match all atoms present	6146-52-7	C1=CC2=C(C=CN2)C=C1[N+](=O)[O-]	{32: 1, 38: 1, 14: 5}
Did not match all atoms present	61462-73-5	CS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC4=CC=CC=C42)Cl	{1: 1, 35: 1, 14: 11, 17: 1, 29: 2, 31: 2}
Did not match all atoms present	61466-87-3	CCC1=CC(=C(C=C1)O)C(=O)C2=CC(=C(C=C2)Cl)Cl	{1: 1, 2: 1, 14: 6, 17: 2, 21: 1, 24: 1}
Did not match all atoms present	61467-64-9	C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.[N+](=O)(O)[O-]	{36: 1, 7: 1, 14: 12, 15: 2, 20: 1, 30: 2}
Did not match all atoms present	61467-81-0	CCCCCCCC[Sn](OC(=O)CCCCCCC/C=C\C[C@H](O)CCCCCC)(OC(=O)CCCCCCC/C=C\C[C@H](O)CCCCCC)CCCCCCCC	{1: 4, 2: 40, 3: 2, 6: 4, 20: 2, 28: 2}
Did not match all atoms present	6147-14-4	C1=CC=C(C=C1)N/N=C/C(C(C(C(CO)O)O)O)O	{2: 1, 3: 4, 6: 1, 34: 1, 14: 5, 20: 5, 31: 1}
Did not match all atoms present	6147-43-9	CC(=CCCC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C)C	{1: 3, 2: 2, 38: 2, 6: 1, 7: 2, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	6147-53-1	CC(=O)[O-].CC(=O)[O-].O.O.O.O.[Co+2]	{24: 2, 1: 2}
Did not match all atoms present	61470-33-5	CCCCOC(=O)CC[Sn](CCC(=O)OCCCC)(Cl)Cl	{1: 2, 2: 10, 28: 2, 17: 2}
Did not match all atoms present	61470-34-6	CCCCOC(=O)CC[Sn](Cl)(Cl)Cl	{1: 1, 2: 5, 28: 1, 17: 3}
Did not match all atoms present	61470-70-0	CCN1C(=O)C(=C(C(=NNC2=CC(=CC=C2)P(=O)(O)O)C1=O)C)C(=O)N	{1: 2, 2: 1, 33: 1, 34: 1, 14: 4, 15: 3, 20: 2, 24: 1, 25: 2, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	61471-62-3	CC(CC1=CC(=CC=C1)C(F)(F)F)NC	{1: 2, 2: 1, 3: 1, 4: 1, 14: 4, 16: 3, 31: 1}
Did not match all atoms present	61477-04-1	C1CC2=CC3=C4CCC5=C(CC3)C=C1C=C5CCC4=C2	{11: 8, 14: 4}
Did not match all atoms present	61477-94-9	C[C@@H]1CCC[C@@H](N1CCCC(C2=CC=CC=C2)(C3=CC=CC=N3)O)C.Cl	{1: 2, 2: 3, 35: 1, 4: 1, 33: 1, 11: 3, 12: 2, 14: 9, 17: 1, 20: 1}
Did not match all atoms present	61477-96-1	CCN1CCN(C(=O)C1=O)C(=O)N[C@H](C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O	{1: 3, 2: 1, 3: 1, 33: 3, 41: 1, 11: 2, 12: 3, 13: 1, 14: 5, 24: 2, 25: 3, 27: 1, 31: 2}
Did not match all atoms present	61478-28-2	CC(C)(C)OC(=O)N1C[C@H](C[C@H]1CP(C2=CC=CC=C2)C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5	{1: 3, 2: 1, 4: 1, 33: 1, 11: 2, 12: 2, 14: 20, 28: 1}
Did not match all atoms present	61478-29-3	C1C(CNC1CP(C2=CC=CC=C2)C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5	{32: 1, 2: 1, 11: 2, 12: 2, 14: 20}
Did not match all atoms present	6148-34-1	CC1=CC(=C(O1)C)C(=O)OC	{1: 3, 28: 1, 14: 1, 23: 1}
Did not match all atoms present	6148-48-7	C[Pb](C)(C)Br	{1: 3, 18: 1}
Did not match all atoms present	6148-64-7	CCOC(=O)CC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 2, 28: 1}
Did not match all atoms present	6148-75-0	CC1=CC(=C(C(=C1)C)S(=O)(=O)[O-])C.[Na+]	{1: 3, 29: 3, 14: 2}
Did not match all atoms present	6148-95-4	CCCCCCCCCCC(C(=O)OCC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 10, 3: 1, 28: 1, 29: 3}
Did not match all atoms present	61481-19-4	CC(C)(C)C12COP(=O)(OC1)OC2	{1: 3, 4: 1, 11: 3, 13: 1, 23: 3, 29: 1}
Did not match all atoms present	61485-47-0	CSC(=S)C(=S)SC	{40: 2, 1: 2, 7: 2}
Did not match all atoms present	61486-72-4	C1(=C(C1=O)F)F	{16: 2, 25: 1}
Did not match all atoms present	61488-78-6	C1=CC(=C(C=C1N=NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)NCCC#N	{2: 2, 35: 1, 37: 1, 38: 1, 41: 1, 34: 2, 14: 6, 17: 1, 31: 1}
Did not match all atoms present	6149-33-3	C1=CC(=CC=C1N)OC2=CC=C(C=C2)[N+](=O)[O-]	{30: 1, 38: 1, 22: 1, 14: 8}
Did not match all atoms present	61495-04-3	CC1=CC=CC=C1NC(=O)C(C)(C)C	{24: 1, 1: 4, 4: 1, 14: 4, 31: 1}
Did not match all atoms present	61495-96-3	CC(=O)[O-].CC(=O)[O-].N.N.N.N.[Pd+2]	{24: 2, 1: 2}
Did not match all atoms present	61499-10-3	C1=CC=C(C=C1)CCCCN=C=S	{8: 1, 2: 4, 34: 1, 14: 5}
Did not match all atoms present	61499-22-7	CC(=O)OC1=CC=C(C=C1)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 4, 28: 1}
Did not match all atoms present	615-05-4	COC1=C(C=C(C=C1)N)N	{1: 1, 30: 2, 22: 1, 14: 3}
Did not match all atoms present	615-09-8	CCOC(=O)CC(=O)C1=CC=CO1	{1: 1, 2: 2, 14: 3, 23: 1, 24: 1, 28: 1}
Did not match all atoms present	615-10-1	CCCOC(=O)C1=CC=CO1	{1: 1, 2: 2, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	615-11-2	C1=COC(=C1)COC(=O)C2=CC=CO2	{2: 1, 28: 1, 14: 6, 23: 2}
Did not match all atoms present	615-12-3	CC(C)CCOC(=O)C1=CC=CO1	{1: 2, 2: 2, 3: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	615-13-4	C1C(=O)CC2=CC=CC=C21	{25: 1, 11: 2, 14: 4}
Did not match all atoms present	615-15-6	CC1=NC2=CC=CC=C2N1	{32: 1, 1: 1, 35: 1, 14: 4}
Did not match all atoms present	615-16-7	C1=CC=C2C(=C1)NC(=O)N2	{32: 2, 25: 1, 14: 4}
Did not match all atoms present	615-18-9	C1=CC=C2C(=C1)N=C(O2)Cl	{17: 1, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	615-20-3	C1=CC=C2C(=C1)N=C(S2)Cl	{17: 1, 35: 1, 14: 4, 41: 1}
Did not match all atoms present	615-21-4	C1=CC=C2C(=C1)N=C(S2)NN	{41: 1, 35: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	615-22-5	CSC1=NC2=CC=CC=C2S1	{40: 1, 1: 1, 35: 1, 14: 4, 41: 1}
Did not match all atoms present	615-28-1	C1=CC=C(C(=C1)N)N.Cl.Cl	{17: 2, 30: 2, 14: 4}
Did not match all atoms present	615-36-1	C1=CC=C(C(=C1)N)Br	{18: 1, 30: 1, 14: 4}
Did not match all atoms present	615-37-2	CC1=CC=CC=C1I	{1: 1, 19: 1, 14: 4}
Did not match all atoms present	615-41-8	C1=CC=C(C(=C1)Cl)I	{17: 1, 19: 1, 14: 4}
Did not match all atoms present	615-42-9	C1=CC=C(C(=C1)I)I	{19: 2, 14: 4}
Did not match all atoms present	615-43-0	C1=CC=C(C(=C1)N)I	{19: 1, 30: 1, 14: 4}
Did not match all atoms present	615-45-2	CC1=C(C=CC(=C1)N)N.Cl.Cl	{1: 1, 30: 2, 14: 3, 17: 2}
Did not match all atoms present	615-46-3	C1=CC(=C(C=C1N)Cl)N.Cl.Cl	{17: 3, 30: 2, 14: 3}
Did not match all atoms present	615-47-4	C1=CC(=C(C=C1N)N)N.Cl.Cl	{17: 2, 30: 3, 14: 3}
Did not match all atoms present	615-48-5	C1=CC(=C(C=C1Cl)[NH3+])S.[Cl-]	{17: 2, 14: 3, 39: 1}
Did not match all atoms present	615-50-9	CC1=C(C=CC(=C1)N)N.OS(=O)(=O)O	{1: 1, 30: 2, 20: 2, 29: 2, 14: 3}
Did not match all atoms present	615-54-3	C1=CC(=C(C=C1Br)Br)Br	{18: 3, 14: 3}
Did not match all atoms present	615-55-4	C1=CC(=C(C=C1N)Br)Br	{18: 2, 30: 1, 14: 3}
Did not match all atoms present	615-57-6	C1=CC(=C(C=C1Br)Br)N	{18: 2, 30: 1, 14: 3}
Did not match all atoms present	615-58-7	C1=CC(=C(C=C1Br)Br)O	{18: 2, 21: 1, 14: 3}
Did not match all atoms present	615-59-8	CC1=C(C=CC(=C1)Br)Br	{1: 1, 18: 2, 14: 3}
Did not match all atoms present	615-60-1	CC1=C(C=C(C=C1)Cl)C	{1: 2, 14: 3, 17: 1}
Did not match all atoms present	615-62-3	CC1=C(C=C(C=C1)O)Cl	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	615-65-6	CC1=CC(=C(C=C1)N)Cl	{1: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	615-66-7	C1=CC(=C(C=C1N)Cl)N	{17: 1, 30: 2, 14: 3}
Did not match all atoms present	615-67-8	C1=CC(=C(C=C1O)Cl)O	{17: 1, 21: 2, 14: 3}
Did not match all atoms present	615-68-9	C1=CC(=C(C=C1I)I)I	{19: 3, 14: 3}
Did not match all atoms present	615-71-4	C1=CC(=C(C=C1N)N)N	{30: 3, 14: 3}
Did not match all atoms present	615-74-7	CC1=CC(=C(C=C1)Cl)O	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	615-76-9	CC1=NNC(=S)NC1=O	{32: 2, 1: 1, 35: 1, 25: 1}
Did not match all atoms present	615-78-1	CN1C=CC(=O)NC1=S	{32: 1, 1: 1, 33: 1, 14: 2, 25: 1}
Did not match all atoms present	615-87-2	CC1=CC(=C(C=C1Br)Br)C	{1: 2, 18: 2, 14: 2}
Did not match all atoms present	615-89-4	CC1=CC(=C(C=C1O)O)C	{1: 2, 21: 2, 14: 2}
Did not match all atoms present	615-90-7	CC1=CC(=C(C=C1O)C)O	{1: 2, 21: 2, 14: 2}
Did not match all atoms present	6150-82-9	C(=O)[O-].C(=O)[O-].O.O.[Mg+2]	{26: 2}
Did not match all atoms present	6150-88-5	C(=O)(C(=O)[O-])[O-].O.O.[Mg+2]	{24: 2}
Did not match all atoms present	6150-94-3	C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].O.O.O.O.[Hg+2]	{27: 2, 14: 8}
Did not match all atoms present	61502-56-5	COC(C#N)(C1=CC=CC=C1)C(C#N)(C2=CC=CC=C2)OC	{1: 2, 4: 2, 22: 2, 14: 10, 37: 2}
Did not match all atoms present	61509-77-1	CP(=[Se])(C)Cl	{1: 2, 17: 1}
Did not match all atoms present	6151-25-3	C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O.O.O	{25: 1, 21: 5, 14: 5, 23: 1}
Did not match all atoms present	61519-00-4	CCCCCCCOC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)CCCCC	{1: 2, 2: 10, 40: 1, 14: 8, 22: 1, 24: 1}
Did not match all atoms present	6152-73-4	CC(CNC)C1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	6153-33-9	CN1CCC2=C(C1)C3=CC=CC=C3N2CC4=CC=CC=C4.CN1CCC2=C(C1)C3=CC=CC=C3N2CC4=CC=CC=C4.C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O	{1: 2, 2: 2, 33: 4, 11: 6, 14: 24, 20: 2, 29: 4}
Did not match all atoms present	6153-39-5	CC1=CC(=CC(=C1)O)O.O	{1: 1, 21: 2, 14: 3}
Did not match all atoms present	6153-44-2	COC(=O)C1=CC(=O)NC(=O)N1	{32: 2, 1: 1, 28: 1, 14: 1, 25: 2}
Did not match all atoms present	6153-56-6	C(=O)(C(=O)O)O.O.O	{27: 2}
Did not match all atoms present	6153-89-5	C1=CC=C(C=C1)C2=C3C=CC=NC3=C4C(=C2)C=CC=N4	{35: 2, 14: 12}
Did not match all atoms present	6153-92-0	C1=CC=C(C=C1)C2=CC(=NC=C2)C3=NC=CC(=C3)C4=CC=CC=C4	{35: 2, 14: 16}
Did not match all atoms present	61532-76-1	C1CN(C(=C[N+](=O)[O-])N1)CC2=CC=CC=C2	{32: 1, 33: 1, 2: 1, 38: 1, 6: 1, 11: 2, 14: 5, 15: 1}
Did not match all atoms present	61535-21-5	CC1=C(C(=CC=C1)OCC2=CC=CC=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 22: 1, 14: 8}
Did not match all atoms present	6154-04-7	CN1N=C(N=N1)N	{1: 1, 35: 3, 30: 1, 33: 1}
Did not match all atoms present	61548-33-2	CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)O.CC(=C)C(=O)O.CC(=C)C(=O)O.[Ti]	{1: 6, 2: 14, 3: 2, 5: 2, 7: 2, 20: 1, 27: 3}
Did not match all atoms present	6155-44-8	CCCCCCCCCCCCC(C(C)C(=O)[O-])C(=O)O.[Na+]	{24: 1, 1: 2, 2: 11, 3: 2, 27: 1}
Did not match all atoms present	6155-57-3	C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.O.O.[Na+]	{25: 1, 35: 1, 29: 2, 14: 4}
Did not match all atoms present	6155-81-3	[Li+].CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)[NH-]	{1: 2, 35: 1, 36: 1, 14: 4, 23: 1, 29: 2, 31: 1}
Did not match all atoms present	61550-02-5	C[Si](C)(C)OC1=CC=CO1	{1: 3, 22: 1, 14: 3, 23: 1}
Did not match all atoms present	61550-72-9	CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)OC)OC)C3=CC=CC=C3	{1: 3, 34: 2, 35: 1, 33: 1, 12: 1, 14: 8, 15: 1, 22: 2, 25: 1}
Did not match all atoms present	61550-76-3	CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2OC)Cl)OC)C3=CC=CC=C3	{1: 3, 34: 2, 35: 1, 33: 1, 12: 1, 14: 7, 15: 1, 17: 1, 22: 2, 25: 1}
Did not match all atoms present	61551-49-3	C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)Cl	{17: 1, 11: 4, 29: 2, 14: 3}
Did not match all atoms present	61551-61-9	CCCCCCCCCCCCC1=CC=CC=C1C[S+](C)C.[Cl-]	{1: 3, 2: 12, 14: 4, 17: 1}
Did not match all atoms present	61552-88-3	CC(=C)C(=O)OCCN(C)C.CC(=C)C(=O)OCCN(C)C.OS(=O)(=O)O	{1: 6, 2: 4, 5: 2, 7: 2, 20: 2, 33: 2, 28: 2, 29: 2}
Did not match all atoms present	61556-47-6	CCCCNC(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 7, 37: 1, 38: 1, 33: 1, 34: 2, 14: 8, 28: 1, 31: 1}
Did not match all atoms present	61556-82-9	C[NH+](C)N(C)C.[Cl-]	{1: 4, 33: 1, 17: 1}
Did not match all atoms present	6156-78-1	CC(=O)[O-].CC(=O)[O-].O.O.O.O.[Mn+2]	{24: 2, 1: 2}
Did not match all atoms present	61563-25-5	CC1=C(C(=CC=C1)Br)Br	{1: 1, 18: 2, 14: 3}
Did not match all atoms present	61566-34-5	CC(C)CC1=CC=C(C=C1)C(C)C(=O)OC	{1: 4, 2: 1, 3: 2, 28: 1, 14: 4}
Did not match all atoms present	61578-04-9	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC3CO3	{1: 2, 2: 1, 4: 1, 11: 1, 12: 1, 14: 9, 22: 1, 23: 1}
Did not match all atoms present	6158-45-8	CC(C)C1=CC=CC2=CC=CC=C21	{1: 2, 3: 1, 14: 7}
Did not match all atoms present	6158-54-9	COC(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 28: 1, 14: 9}
Did not match all atoms present	6158-73-2	C1=CC=C(C=C1)[Se+](C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{17: 1, 14: 15}
Did not match all atoms present	6158-77-6	CC(=O)NC1=NNN=N1	{24: 1, 1: 1, 35: 3, 32: 1, 31: 1}
Did not match all atoms present	61580-09-4	CC12COP(O1)OC2	{1: 1, 11: 2, 13: 1, 23: 3}
Did not match all atoms present	61583-29-7	C1=CC=C2C=C(C(=CC2=C1)N)N.Cl[Pt]Cl	{17: 2, 30: 2, 14: 6}
Did not match all atoms present	61583-30-0	C1=CC(=C(C=C1Cl)N)N.[Cl-].[Cl-].[Pt+2]	{17: 3, 30: 2, 14: 3}
Did not match all atoms present	6159-05-3	CCCCCCC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CCCCCCC.[Br-].[Br-]	{1: 2, 2: 12, 18: 2, 14: 8, 33: 2}
Did not match all atoms present	61594-31-8	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)OC6=O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)N)N	{1: 2, 4: 1, 14: 22, 22: 2, 28: 6, 30: 2}
Did not match all atoms present	61594-32-9	CC(C)(C1=CC=C(C=C1)OC2=CC=CC3=C2C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)OC6=O.C1=CC(=CC(=C1)N)N	{1: 2, 4: 1, 14: 18, 22: 2, 28: 4, 30: 2}
Did not match all atoms present	61594-33-0	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)OC6=O.CC(C)(C1=CC=C(C=C1)OC2=CC=CC3=C2C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)OC6=O.C1=CC(=CC(=C1)N)N	{1: 4, 4: 2, 14: 32, 22: 4, 28: 8, 30: 2}
Did not match all atoms present	61599-28-8	CC(CCCCCOC(=O)/C=C\C(=O)O[Sn](OC(=O)/C=C\C(=O)OCCCCCC(C)C)(C)C)C	{1: 6, 2: 10, 3: 2, 28: 4, 6: 4}
Did not match all atoms present	616-38-6	COC(=O)OC	{1: 2}
Did not match all atoms present	616-42-2	COS(=O)OC	{1: 2, 29: 1, 22: 2}
Did not match all atoms present	616-43-3	CC1=CNC=C1	{32: 1, 1: 1, 14: 3}
Did not match all atoms present	616-44-4	CC1=CSC=C1	{1: 1, 14: 3, 41: 1}
Did not match all atoms present	616-46-6	C1=CSC(=C1)N	{41: 1, 30: 1, 14: 3}
Did not match all atoms present	616-52-4	CC(C(C)(C)C)OP(=O)(C)O	{1: 5, 3: 1, 4: 1, 20: 1, 22: 1, 29: 1}
Did not match all atoms present	616-55-7	CC1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)O	{1: 7, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	616-68-2	CCN(CC)CC(=O)NC1=C(C=C(C=C1C)C)C	{1: 5, 2: 3, 33: 1, 14: 2, 24: 1, 31: 1}
Did not match all atoms present	616-72-8	CC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C	{1: 2, 38: 2, 14: 2}
Did not match all atoms present	616-73-9	CC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O	{1: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	616-74-0	C1=C(C(=CC(=C1[N+](=O)[O-])O)O)[N+](=O)[O-]	{38: 2, 21: 2, 14: 2}
Did not match all atoms present	616-75-1	C1=CC=C(C=C1)CC(C(=O)O)C(=O)O	{27: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	616-76-2	C1=CC(=C(C=C1C=O)C(=O)O)O	{26: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	616-79-5	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)N	{38: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	616-82-0	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])O	{38: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	616-84-2	C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])N	{30: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	616-86-4	CCOC1=CC(=C(C=C1)N)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	616-97-7	CCOC(=O)S/C(=C(\C)/N(CC1=CN=C(N=C1N)C)C=O)/CCO.Cl	{1: 3, 2: 4, 35: 2, 33: 1, 7: 2, 40: 1, 14: 1, 17: 1, 20: 1, 26: 1, 28: 1, 30: 1}
Did not match all atoms present	6160-65-2	C1=CN(C=N1)C(=S)N2C=CN=C2	{33: 2, 35: 2, 14: 6, 7: 1}
Did not match all atoms present	61604-32-8	C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Ru+3].[Ru+3]	{16: 12, 24: 4, 4: 4}
Did not match all atoms present	6161-50-8	COC1=CC=CC(=C1)C2=CC(=CC=C2)OC	{1: 2, 22: 2, 14: 8}
Did not match all atoms present	6161-67-7	CCC1=C(C=CC(=C1)O)C	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	6161-81-5	CCCCCCCCOP(=O)(OCCCCCCCC)OC1=CC=CC=C1	{1: 2, 2: 14, 22: 3, 14: 5, 29: 1}
Did not match all atoms present	6161-86-0	CC1=CC=CC=C1OCCO	{1: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	6161-87-1	C1=C(C=C(C(=C1Cl)OCCO)Cl)Cl	{17: 3, 2: 2, 20: 1, 22: 1, 14: 2}
Did not match all atoms present	61614-55-9	C[Si]1O[Si](O[Si](O[Si](O1)C)(C)CCCOCC2CO2)C	{1: 4, 2: 4, 11: 1, 12: 1, 22: 1, 23: 5}
Did not match all atoms present	61614-62-8	CCC(C)C1=CC(=CC(=C1OC(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 4, 14: 5}
Did not match all atoms present	61615-77-8	C=CC[O-].C=CC(=O)O.[Na+]	{2: 1, 27: 1, 5: 2, 6: 2, 29: 1}
Did not match all atoms present	61621-35-0	C1=CC=C2C(=C1)C=C(C=N2)NN.Cl.Cl	{17: 2, 35: 1, 30: 1, 14: 6, 31: 1}
Did not match all atoms present	6163-58-2	CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C	{1: 3, 14: 12}
Did not match all atoms present	6163-75-3	CCP(=O)(OC)OC	{1: 3, 2: 1, 29: 1, 22: 2}
Did not match all atoms present	61630-88-4	C1=CC=C2C(=C1)C(=O)OC2=O.C(CO)O.C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)OC2=O	{17: 4, 2: 2, 20: 2, 14: 4, 28: 4}
Did not match all atoms present	61630-89-5	C1=CC=C2C(=C1)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O.C(CO)O.C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)OC2=O	{2: 6, 14: 4, 17: 4, 20: 2, 27: 2, 28: 4}
Did not match all atoms present	6164-78-9	C1=CN=C(C(=N1)C(=O)N)C(=O)N	{24: 2, 35: 2, 30: 2, 14: 2}
Did not match all atoms present	6164-79-0	COC(=O)C1=NC=CN=C1	{1: 1, 35: 2, 28: 1, 14: 3}
Did not match all atoms present	6164-98-3	CC1=C(C=CC(=C1)Cl)N=CN(C)C	{1: 3, 34: 1, 6: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	6165-01-1	CCCCN1C=NC2=C1NC=NC2=S	{32: 1, 1: 1, 2: 3, 35: 2, 33: 1, 14: 2}
Did not match all atoms present	6165-51-1	CC1=CC(=C(C=C1)C)C(C)C2=CC=CC=C2	{1: 3, 3: 1, 14: 8}
Did not match all atoms present	6165-52-2	CC1=CC(=C(C=C1)C(C)C2=CC=CC=C2)C	{1: 3, 3: 1, 14: 8}
Did not match all atoms present	6165-55-5	CC1Cc2ccccc2S1	{1: 1, 11: 1, 12: 1, 14: 4, 41: 1}
Did not match all atoms present	6165-68-0	B(C1=CC=CS1)(O)O	{41: 1, 20: 2, 14: 3}
Did not match all atoms present	6165-69-1	B(C1=CSC=C1)(O)O	{41: 1, 20: 2, 14: 3}
Did not match all atoms present	6165-75-9	C#CCOS(=O)(=O)C1=CC=CC=C1	{2: 1, 9: 1, 10: 1, 14: 5, 22: 1, 29: 2}
Did not match all atoms present	61652-81-1	CCCCCCCCCCS(=O)(=O)Cl	{1: 1, 2: 9, 29: 2, 17: 1}
Did not match all atoms present	6166-86-5	C[Si]1O[Si](O[Si](O[Si](O[Si](O1)C)C)C)C	{1: 5, 23: 5}
Did not match all atoms present	61660-12-6	CCN(CCC[Si](OC)(OC)OC)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 4, 2: 4, 4: 8, 33: 1, 16: 17, 22: 3, 29: 2}
Did not match all atoms present	61667-33-2	CO[Si]1(CC=CC1)OC	{1: 2, 11: 2, 22: 2, 14: 2}
Did not match all atoms present	61670-11-9	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(/C(=N/NC5=CC(=CC(=C5O)[N+](=O)[O-])S(=O)(=O)O)/C4=O)S(=O)(=O)O	{34: 2, 38: 1, 14: 11, 15: 3, 20: 3, 21: 1, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	61676-62-8	B1(OC(C(O1)(C)C)(C)C)OC(C)C	{1: 6, 3: 1, 13: 2, 22: 1, 23: 2}
Did not match all atoms present	61680-52-2	C=O.C1(=NC(=NC(=N1)N)N)N.C(=O)(N)N.Cl	{24: 1, 17: 1, 35: 3, 5: 1, 30: 5}
Did not match all atoms present	61681-02-5	CC1=CC2=C(C=C1C)N(C=N2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 33: 1, 14: 7, 24: 1}
Did not match all atoms present	6169-94-4	C1CCCCC2=CC=C(CC3=CC=C(CCC1)C=C3)C=C2	{11: 9, 14: 8}
Did not match all atoms present	61691-82-5	CC(=O)OC(C=C)C1=CC=C(C=C1)OC	{1: 2, 3: 1, 5: 1, 6: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	61691-97-2	C1=CC=C2C(=C1)N=NN2CN(CCO)CCO	{33: 2, 2: 5, 35: 2, 20: 2, 14: 4}
Did not match all atoms present	61695-12-3	CC(C)(C)P1P(P1C(C)(C)C)C(C)(C)C	{1: 9, 4: 3}
Did not match all atoms present	61695-69-0	C1C(O1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C6=CC=CC=C62	{11: 1, 12: 1, 14: 11, 23: 1}
Did not match all atoms present	61695-70-3	C=CC1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC=C41	{14: 11, 5: 1, 6: 1}
Did not match all atoms present	61695-72-5	C1C(O1)C2=C3C=CC4=CC=CC=C4C3=CC5=CC=CC=C52	{11: 1, 12: 1, 14: 11, 23: 1}
Did not match all atoms present	61695-73-6	C1C(O1)C2=C3C=CC=CC3=CC4=CC=CC=C42	{11: 1, 12: 1, 14: 9, 23: 1}
Did not match all atoms present	61695-74-7	C1C(O1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2	{11: 1, 12: 1, 14: 9, 23: 1}
Did not match all atoms present	61698-32-6	C1=CC=C(C=C1)C2=NC(=C(N2)CO)CO	{32: 1, 2: 2, 35: 1, 20: 2, 14: 5}
Did not match all atoms present	61699-62-5	CC(C)OC1=C(C(=O)C1=O)OC(C)C	{1: 4, 3: 2, 22: 2, 25: 2}
Did not match all atoms present	617-00-5	CC1=CC=CC=C1NC2=CC=CC=C2C	{1: 2, 14: 8, 31: 1}
Did not match all atoms present	617-02-7	CC1=CC=CC=C1OC(=O)C2=CC=CC=C2	{1: 1, 28: 1, 14: 9}
Did not match all atoms present	617-05-0	CCOC(=O)C1=CC(=C(C=C1)O)OC	{1: 2, 2: 1, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	617-07-2	CC1=CC=CC=C1NC(=O)NC2=CC=CC=C2C	{24: 1, 1: 2, 14: 8, 31: 2}
Did not match all atoms present	617-09-4	CC1=CC=CC=C1OC(=O)OC2=CC=CC=C2C	{1: 2, 14: 8}
Did not match all atoms present	617-22-1	CC1=CC=CC=C1NNC2=CC=CC=C2C	{1: 2, 14: 8, 31: 2}
Did not match all atoms present	617-38-9	CCSC(=S)N(C)C	{40: 1, 1: 3, 2: 1, 33: 1, 7: 1}
Did not match all atoms present	617-75-4	CC[As](CC)CC	{1: 3, 2: 3}
Did not match all atoms present	617-77-6	CC[Bi](CC)CC	{1: 3, 2: 3}
Did not match all atoms present	617-85-6	CC[Sb](CC)CC	{1: 3, 2: 3}
Did not match all atoms present	617-86-7	CC[Si](CC)CC	{1: 3, 2: 3}
Did not match all atoms present	617-88-9	C1=COC(=C1)CCl	{17: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	617-89-0	C1=COC(=C1)CN	{2: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	617-90-3	C1=COC(=C1)C#N	{37: 1, 14: 3, 23: 1}
Did not match all atoms present	617-94-7	CC(C)(C1=CC=CC=C1)O	{1: 2, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	617-99-2	C1=C(C=C(C=C1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{20: 3, 29: 6, 14: 3}
Did not match all atoms present	61702-43-0	C1=CC(=C(C=C1[N+](=O)[O-])N)[O-].[Na+]	{38: 1, 30: 1, 14: 3}
Did not match all atoms present	61702-44-1	C1=CC(=C(C=C1N)Cl)N.OS(=O)(=O)O	{17: 1, 30: 2, 20: 2, 29: 2, 14: 3}
Did not match all atoms present	61702-45-2	C1=CC=C2C(=C1)C3=CC(=C(C=C3N2)O)C(=O)[O-].[Na+]	{24: 1, 32: 1, 21: 1, 14: 6}
Did not match all atoms present	61702-53-2	CCCCCCCCCCOP(=O)(O)OCCCCCCCCCC.C1COCCN1	{32: 1, 1: 2, 2: 18, 11: 4, 20: 1, 22: 2, 23: 1, 29: 1}
Did not match all atoms present	61702-68-9	CCCCCC[C@H](C/C=C\CCCCCCCC(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 13, 3: 1, 6: 2, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	61702-81-6	CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C	{1: 3, 2: 12, 3: 1, 28: 2, 14: 4}
Did not match all atoms present	61702-92-9	CCCCCC1=CC2=CC=CC=C2C(=C1CCCCC)S(=O)(=O)[O-].[NH4+]	{1: 2, 2: 8, 29: 3, 14: 5}
Did not match all atoms present	61702-94-1	CC(C)CCC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=C2CCC(C)C	{1: 4, 2: 4, 3: 2, 14: 5, 20: 1, 29: 2}
Did not match all atoms present	61706-44-3	CC(C1=CC=CC=C1)(C2=CC=C(C=C2)N)C(=O)N	{24: 1, 1: 1, 4: 1, 30: 2, 14: 9}
Did not match all atoms present	61709-37-3	CC(C)(C)C1=CC(=C(C=C1)O)C(=O)C2=C(C=C(C=C2)Cl)Cl	{1: 3, 4: 1, 14: 6, 17: 2, 21: 1, 24: 1}
Did not match all atoms present	61718-82-9	COCCCC/C(=N\OCCN)/C1=CC=C(C=C1)C(F)(F)F.C(=C\C(=O)O)\C(=O)O	{1: 1, 2: 6, 4: 1, 6: 2, 7: 1, 34: 1, 14: 4, 16: 3, 22: 2, 27: 2, 30: 1}
Did not match all atoms present	61725-50-6	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.OOP(=O)(O)[O-].O[W](=O)=O	{1: 4, 33: 2, 7: 1, 14: 13, 15: 2, 20: 3, 22: 1, 29: 4}
Did not match all atoms present	61735-77-1	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=CC6=C(C=CC(=C6)F)C(=C54)C=C3	{16: 1, 14: 13}
Did not match all atoms present	61735-78-2	C1=CC2=CC3=C(C=CC(=C3)F)C4=C2C5=C(C=C4)C6=C(C=CC(=C6)F)C=C51	{16: 2, 14: 12}
Did not match all atoms present	61736-79-6	CCCCCCCCCCCCCCCO[Si](C)(C)C	{1: 4, 2: 14, 22: 1}
Did not match all atoms present	6174-86-3	CC1=C(C(=O)OC2=C1C=CC(=C2)O)Cl	{1: 1, 28: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	61740-00-9	COC1=C2C3=C([C@@H](CC3)O)C(=O)OC2=C4[C@@H]5C=CO[C@@H]5OC4=C1	{1: 1, 11: 2, 12: 3, 14: 3, 20: 1, 22: 1, 23: 2, 28: 1}
Did not match all atoms present	61741-09-1	CCCCCCCCC=CCCCCCCCC1=NCC[N+]1(CC)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 18, 35: 1, 6: 2, 11: 2, 15: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	61744-43-2	CC1=NC(=CC=C1)CCCO	{1: 1, 2: 3, 35: 1, 20: 1, 14: 3}
Did not match all atoms present	6175-45-7	CCOC(C(=O)C1=CC=CC=C1)OCC	{1: 2, 2: 2, 3: 1, 14: 5, 22: 2, 24: 1}
Did not match all atoms present	61750-69-4	CCC1=NC=C(C=C1)OC/C=C(\C)/CCC=C(C)C	{1: 4, 2: 4, 35: 1, 6: 2, 7: 2, 14: 3, 22: 1}
Did not match all atoms present	61752-67-8	CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O[NH-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 36: 1, 14: 9, 22: 1, 24: 1, 25: 2, 29: 5, 31: 2}
Did not match all atoms present	61752-99-6	CCP(=O)(C=C)Cl	{1: 1, 2: 1, 5: 1, 6: 1, 17: 1, 29: 1}
Did not match all atoms present	61757-59-3	CCCCCCCCCCCCCOCCOCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 15, 22: 2}
Did not match all atoms present	61759-55-5	C=CC=CNC(=O)OC1=CC=CC=C1	{14: 5, 28: 1, 5: 1, 6: 3, 31: 1}
Did not match all atoms present	61759-58-8	C=CC=CNC(=O)SC1=CC=CC=C1	{5: 1, 6: 3, 40: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	61778-83-4	CC(=C)C(=O)OC.CC(=C)C(=O)OCCOC(=O)C(=C)C.C=CCOC(=O)OCCOCCOC(=O)OCC=C	{1: 4, 2: 8, 5: 5, 6: 2, 7: 3, 22: 1, 28: 3}
Did not match all atoms present	6178-32-1	CCCCCCCCCC1=CC=C(C=C1)OCC2CO2	{1: 1, 2: 9, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	6178-53-6	CCCCCS(=O)(=O)C	{1: 2, 2: 4, 29: 2}
Did not match all atoms present	61783-87-7	CCCC1=C(C=CC(=C1)O)C	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	61785-70-4	C1CN(CCN1C2=CC=CC=C2)C3=CC=C(C4=NO[N+](=C34)[O-])[N+](=O)[O-]	{33: 3, 35: 1, 38: 1, 11: 4, 14: 7, 23: 1}
Did not match all atoms present	61785-72-6	COC1=CC=CC(=C1)N2CCN(CC2)C3=CC=C(C4=NO[N+](=C34)[O-])[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 33: 3, 11: 4, 14: 6, 22: 1, 23: 1}
Did not match all atoms present	61785-73-7	CC1=CC(=CC=C1)N2CCN(CC2)C3=CC=C(C4=NO[N+](=C34)[O-])[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 33: 3, 11: 4, 14: 6, 23: 1}
Did not match all atoms present	61788-32-7	C1CC=CC(C1)C2=CC=C(C=C2)C3CCC=CC3	{11: 6, 12: 2, 14: 8}
Did not match all atoms present	61789-36-4	C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].[Ca+2]	{24: 2, 14: 14}
Did not match all atoms present	61789-38-6	C[N+](C)(CCCN)CC(=O)[O-].[NH4+]	{24: 1, 1: 2, 2: 4, 30: 1}
Did not match all atoms present	61789-51-3	C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].[Co+2]	{24: 2, 14: 14}
Did not match all atoms present	61789-65-9	CC(C)C1=CC2=CCC3[C@@]([C@H]2CC1)(CCC[C@]3(C)C(=O)[O-])C.CC(C)C1=CC2=CCC3[C@@]([C@H]2CC1)(CCC[C@]3(C)C(=O)[O-])C.CC(C)C1=CC2=CCC3[C@@]([C@H]2CC1)(CCC[C@]3(C)C(=O)[O-])C.[Al+3]	{1: 12, 3: 3, 11: 18, 12: 6, 13: 6, 14: 6, 15: 6, 24: 3}
Did not match all atoms present	61790-14-5	C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].C1=CC=C2C=C(C=CC2=C1)C(=O)[O-].[Pb+2]	{24: 2, 14: 14}
Did not match all atoms present	61791-62-6	CCC(C(=O)[O-])N.[Na+]	{24: 1, 1: 1, 2: 1, 3: 1, 30: 1}
Did not match all atoms present	61791-76-2	CCN(CC)C1=CC(=C(C=C1)N=O)OCC	{1: 3, 2: 3, 33: 1, 34: 1, 14: 3, 22: 1, 29: 1}
Did not match all atoms present	61791-78-4	CC1=CC(=C(C=C1CC2COCCN2)C)O.Cl	{32: 1, 1: 2, 2: 1, 11: 3, 12: 1, 14: 2, 17: 1, 21: 1, 23: 1}
Did not match all atoms present	61791-80-8	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=C6C(=C(C=C5)NC7=CC=CC8=C7C(=O)C9=C(C8=O)C(=CC=C9)NC(=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1C6=O	{24: 2, 25: 6, 14: 28, 31: 4}
Did not match all atoms present	61791-91-1	CCCCCCCCC(CCCCCCCCC(=O)OC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 15, 3: 1, 28: 1, 29: 3}
Did not match all atoms present	61792-00-5	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OC2=C3C(=C(C=C2)[N+](=O)[O-])C(=O)C4=C(C=CC(=C4C3=O)OC5=C(C=C(C=C5)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{25: 2, 38: 6, 22: 2, 14: 10}
Did not match all atoms present	61792-05-0	C1=CC(=C(C=C1[Hg])[N+](=O)[O-])O.O	{38: 1, 21: 1, 14: 3}
Did not match all atoms present	61792-07-2	CCC(C)OC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 2, 3: 1, 14: 2, 17: 3, 22: 1, 28: 1}
Did not match all atoms present	61792-21-0	CC1=NN(C(=O)C1)C2=CC=CC=C2S(=O)(=S)[O-].[Na+]	{1: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 25: 1, 29: 2}
Did not match all atoms present	61792-40-3	CCCCCCCCCCOP(=O)(O)OCCCCCCCC	{1: 2, 2: 16, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	61792-45-8	CCCCC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)N	{1: 2, 2: 3, 3: 1, 33: 1, 14: 9, 30: 1}
Did not match all atoms present	61792-58-3	C=O.C1=CC=C(C(=C1)O)S(=O)(=O)O	{29: 2, 20: 1, 5: 1, 14: 4, 21: 1}
Did not match all atoms present	61795-20-8	CC=CS(=O)(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 29: 2, 6: 2}
Did not match all atoms present	61798-68-3	CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=[N+](C=C1)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 8, 33: 1, 14: 9, 16: 17, 29: 3}
Did not match all atoms present	61798-69-4	C[N+](C)(CCCNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCC(=O)[O-]	{1: 2, 2: 7, 4: 6, 16: 13, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	61798-70-7	C1=CC(=C(C(=C1)Cl)Cl)C2=C(C(=C(C=C2Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	618-03-1	CC1=C(C=C(C=C1)S(=O)(=O)O)N	{1: 1, 30: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	618-07-5	C1=CC(=CC(=C1)[As](=O)(O)O)[N+](=O)[O-]	{38: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	618-25-7	C1=CC(=CC=C1NCC(=O)N)[As](=O)(O)O	{2: 1, 14: 4, 20: 2, 24: 1, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	618-32-6	C1=CC=C(C=C1)C(=O)Br	{24: 1, 18: 1, 14: 5}
Did not match all atoms present	618-36-0	CC(C1=CC=CC=C1)N	{1: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	618-38-2	C1=CC=C(C=C1)C(=O)I	{24: 1, 19: 1, 14: 5}
Did not match all atoms present	618-40-6	CN(C1=CC=CC=C1)N	{1: 1, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	618-41-7	C1=CC=C(C=C1)S(=O)O	{20: 1, 29: 1, 14: 5}
Did not match all atoms present	618-45-1	CC(C)C1=CC(=CC=C1)O	{1: 2, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	618-46-2	C1=CC(=CC(=C1)Cl)C(=O)Cl	{24: 1, 17: 2, 14: 4}
Did not match all atoms present	618-47-3	CC1=CC=CC(=C1)C(=O)N	{24: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	618-48-4	C1=CC(=CC(=C1)Cl)C(=O)N	{24: 1, 17: 1, 30: 1, 14: 4}
Did not match all atoms present	618-51-9	C1=CC(=CC(=C1)I)C(=O)O	{27: 1, 19: 1, 14: 4}
Did not match all atoms present	618-56-4	C1=C(C=C(C=C1N)N)C(=O)O.Cl.Cl	{17: 2, 27: 1, 30: 2, 14: 3}
Did not match all atoms present	618-58-6	C1=C(C=C(C=C1Br)Br)C(=O)O	{18: 2, 27: 1, 14: 3}
Did not match all atoms present	618-62-2	C1=C(C=C(C=C1Cl)Cl)[N+](=O)[O-]	{17: 2, 38: 1, 14: 3}
Did not match all atoms present	618-65-5	C1=CC=C(C(=C1)C=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O	{2: 1, 12: 5, 14: 4, 20: 4, 22: 1, 23: 1, 26: 1}
Did not match all atoms present	618-68-8	C1=CC=C(C=C1)CC(CC2=CC=CC=C2)C(=O)O	{27: 1, 2: 2, 3: 1, 14: 10}
Did not match all atoms present	618-71-3	CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	618-73-5	C1=C(C=C(C(=C1O)O)O)C(=O)N	{24: 1, 30: 1, 21: 3, 14: 2}
Did not match all atoms present	618-76-8	C1=C(C=C(C(=C1I)O)I)C(=O)O	{27: 1, 19: 2, 21: 1, 14: 2}
Did not match all atoms present	618-80-4	C1=C(C=C(C(=C1Cl)O)Cl)[N+](=O)[O-]	{17: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	618-83-7	C1=C(C=C(C=C1C(=O)O)O)C(=O)O	{27: 2, 21: 1, 14: 3}
Did not match all atoms present	618-84-8	C1=C(C=C(C=C1N)[N+](=O)[O-])C(=O)O	{38: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	618-85-9	CC1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 3}
Did not match all atoms present	618-87-1	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N	{38: 2, 30: 1, 14: 3}
Did not match all atoms present	618-88-2	C1=C(C=C(C=C1C(=O)O)[N+](=O)[O-])C(=O)O	{27: 2, 38: 1, 14: 3}
Did not match all atoms present	618-89-3	COC(=O)C1=CC(=CC=C1)Br	{1: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	618-91-7	COC(=O)C1=CC(=CC=C1)I	{1: 1, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	618-94-0	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NN	{24: 1, 38: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	618-95-1	COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	618-97-3	CCC(C1=CC(=CC=C1)C(F)(F)F)O	{1: 1, 2: 1, 3: 1, 4: 1, 14: 4, 16: 3, 20: 1}
Did not match all atoms present	618-98-4	CCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	618-99-5	C1=CC(=C(C=C1[N+](=O)[O-])Cl)[NH3+].[Cl-]	{17: 2, 38: 1, 14: 3}
Did not match all atoms present	6180-61-6	C1=CC=C(C=C1)OCCCO	{2: 3, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	6180-99-0	[2H][Sn](CCCC)(CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	61803-98-3	CCCCOC(=O)C(=C)C.CC(=C)C(=O)OCCC[Si](OC)(OC)OC	{1: 6, 2: 6, 5: 2, 7: 2, 22: 3, 28: 2}
Did not match all atoms present	61804-30-6	COCC1=CC=C(C=C1)COC.C1=CC=C(C=C1)O.C1=CC=C(C=C1)OC2=CC=CC=C2	{1: 2, 2: 2, 22: 3, 21: 1, 14: 19}
Did not match all atoms present	61810-04-6	CCCCCCC(=O)[O-].CCCCCCC(=O)[O-].[Mn+2]	{24: 2, 1: 2, 2: 10}
Did not match all atoms present	61810-55-7	CCCCCCCCCC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 10, 28: 1, 14: 5}
Did not match all atoms present	61813-38-5	CC(=O)N(C1=CC=CC=C1)OCN	{1: 1, 2: 1, 33: 1, 14: 5, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	61813-43-2	CCN(CCCl)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 2: 3, 38: 1, 33: 1, 34: 2, 14: 7, 17: 2}
Did not match all atoms present	61813-45-4	CCCCCCCCCCCCCCCCCCN1C2=C(C=C(C=C2)S(=O)(=O)O)N=C1C3=CC=C(C=C3)[N+](=O)[O-]	{1: 1, 2: 17, 35: 1, 38: 1, 33: 1, 14: 7, 20: 1, 29: 2}
Did not match all atoms present	61813-46-5	C1=CC=C(C=C1)N/N=C/2\C=CC(=C3C2=CC(=O)C=C3)N	{34: 1, 14: 10, 15: 4, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	61813-50-1	CCN(CC)C1=C(C=C(C=C1)N)Cl.Cl	{1: 2, 2: 2, 33: 1, 14: 3, 17: 2, 30: 1}
Did not match all atoms present	61813-58-9	CCOC1=C(C=C(C=C1)CO)OC	{1: 2, 2: 2, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	61827-44-9	CC(C)(C)[CH-]C(C)(C)C1=CC=CC=C1[O-].C=O.[Ca+2]	{1: 5, 14: 4, 4: 2, 5: 1, 6: 1}
Did not match all atoms present	61827-64-3	CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(C)C	{1: 4, 2: 6, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	61827-71-2	C1=CC2=C(C=C1Cl)SC(=N2)N.Cl	{17: 2, 35: 1, 30: 1, 14: 3, 41: 1}
Did not match all atoms present	61827-75-6	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O)OC)N	{1: 2, 34: 2, 14: 7, 20: 2, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	61827-80-3	CCN(CC1=CC=CC=C1S(=O)(=O)[O-])C2=CC=C(C=C2)N=NC3=CC=C(C=C3)N=NC4=CC=CC=C4.[Na+]	{1: 1, 2: 2, 33: 1, 34: 4, 14: 17, 29: 3}
Did not match all atoms present	61827-85-8	CCCC1=C(C=C(C=C1)C)C	{1: 3, 2: 2, 14: 3}
Did not match all atoms present	61827-86-9	CCc1ccc(C)c(C)c1C	{1: 4, 2: 1, 14: 2}
Did not match all atoms present	61827-87-0	CCc1c(C)ccc(C)c1C	{1: 4, 2: 1, 14: 2}
Did not match all atoms present	61837-66-9	CCC1(C(=O)NC(=O)N1)C2=CC=C(C=C2)O	{32: 2, 1: 1, 2: 1, 13: 1, 14: 4, 21: 1, 25: 2}
Did not match all atoms present	61838-78-6	CC(C)C(=O)C1=CC=CC2=CC=CC=C21	{24: 1, 1: 2, 3: 1, 14: 7}
Did not match all atoms present	61842-44-2	C1=C(C=C(C=C1C(=O)Cl)O)C(=O)Cl	{24: 2, 17: 2, 21: 1, 14: 3}
Did not match all atoms present	6185-26-8	C=C(C(=O)[O-])OP(=O)([O-])[O-].[K+].[K+].[K+]	{24: 1, 29: 3, 5: 1, 22: 1, 7: 1}
Did not match all atoms present	61852-40-2	CCCCN(CCC#N)C1=CC=CC=C1	{1: 1, 2: 5, 37: 1, 14: 5, 33: 1}
Did not match all atoms present	61852-41-3	CCCCN(CCC#N)C1=CC=C(C=C1)N=NC2=NC3=CC(=C(C=C3S2)Cl)Cl	{1: 1, 2: 5, 35: 1, 37: 1, 33: 1, 41: 1, 34: 2, 14: 6, 17: 2}
Did not match all atoms present	61856-47-1	CN1C=CC=C(C1=S)C=O	{1: 1, 26: 1, 14: 3, 33: 1}
Did not match all atoms present	61857-55-4	C(=O)=[Si]=C=O	{8: 2, 29: 2}
Did not match all atoms present	61859-84-5	COC(=O)/C=C/C1=CN=CC=C1	{1: 1, 35: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	6186-22-7	CC(=O)CC1=CC=C(C=C1)Br	{24: 1, 1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	61866-12-4	CS(=O)(=O)OCCNC(=O)N(CCCl)N=O	{1: 1, 2: 4, 33: 1, 34: 1, 17: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	61869-08-7	C1CNC[C@H]([C@@H]1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4	{32: 1, 2: 1, 11: 4, 12: 2, 14: 7, 16: 1, 22: 1, 23: 2}
Did not match all atoms present	6188-30-3	CC1=CC=CC2=NC(=CN12)C	{1: 2, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	61886-21-3	C1=CC(=C(C=C1Cl)C(F)(F)F)[N+]#N	{16: 3, 17: 1, 34: 1, 4: 1, 14: 3}
Did not match all atoms present	61886-29-1	C1CCC(CC1)CCCC(=O)[O-].[Na+]	{24: 1, 2: 3, 11: 5, 12: 1}
Did not match all atoms present	61886-33-7	C1=CC(=C(C=C1S(=O)(=O)N)N)O.Cl	{17: 1, 30: 2, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	61886-35-9	C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C=C1O.N	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	61886-39-3	CC(C)OC1=CC(=C(C=C1)OC(C)C)Cl	{1: 4, 3: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	61886-41-7	C1=CC(=CC=C1N)OCCO.Cl	{2: 2, 14: 4, 17: 1, 20: 1, 22: 1, 30: 1}
Did not match all atoms present	61886-43-9	C1C(=O)C2=C(C=CC(=C2S1)Cl)Cl	{17: 2, 11: 1, 41: 1, 14: 2, 25: 1}
Did not match all atoms present	61886-46-2	CCCCCCCC/C=C/CCCCCCCCOS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 19, 6: 2, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	61886-48-4	CCCCCCCCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 12, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	61886-53-1	C1=CC=C(C(=C1)O)S(=O)(=O)[O-].[NH4+]	{21: 1, 14: 4, 29: 3}
Did not match all atoms present	61886-59-7	CCCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1.C(CO)N(CCO)CCO	{1: 1, 2: 18, 33: 1, 14: 5, 20: 3, 22: 1, 29: 2}
Did not match all atoms present	61886-60-0	CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C	{1: 3, 2: 19, 3: 1, 28: 2, 14: 4}
Did not match all atoms present	61886-67-7	CCCCCCCCCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 8, 14: 7}
Did not match all atoms present	61886-71-3	CCC1=CC=CC2=C1C(=CC=C2)C	{1: 2, 2: 1, 14: 6}
Did not match all atoms present	61891-20-1	CC(=CC1=[N+](C2=C(S1)C=CC(=C2)OC)CCCO)C=C3N(C4=C(S3)C=CC(=C4)OC)CCCO.[Br-]	{1: 3, 2: 6, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 18: 1, 20: 2, 22: 2}
Did not match all atoms present	61894-02-8	CCCCCCCCCCCCCCCCCCN([C@@H](CC(=O)[O-])C(=O)[O-])C(=O)C=CC(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 2: 18, 3: 1, 6: 2, 33: 1, 24: 4}
Did not match all atoms present	61894-66-4	CCCCCCCCCCOCCOS(=O)(=O)O	{1: 1, 2: 11, 20: 1, 29: 2, 22: 2}
Did not match all atoms present	619-04-5	CC1=C(C=C(C=C1)C(=O)O)C	{1: 2, 27: 1, 14: 3}
Did not match all atoms present	619-05-6	C1=CC(=C(C=C1C(=O)O)N)N	{27: 1, 30: 2, 14: 3}
Did not match all atoms present	619-08-9	C1=CC(=C(C=C1[N+](=O)[O-])Cl)O	{17: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	619-12-5	C1=CC(=C(C=C1C(=O)O)O)C=O	{26: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	619-14-7	C1=CC(=C(C=C1C(=O)O)O)[N+](=O)[O-]	{38: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	619-15-8	CC1=C(C=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 14: 3}
Did not match all atoms present	619-17-0	C1=CC(=C(C=C1[N+](=O)[O-])N)C(=O)O	{38: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	619-18-1	C1=CC(=C(C=C1[N+](=O)[O-])N)[N+](=O)[O-]	{38: 2, 30: 1, 14: 3}
Did not match all atoms present	619-19-2	C1=CC(=C(C=C1[N+](=O)[O-])O)C(=O)O	{38: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	619-20-5	CCC1=CC=CC(=C1)C(=O)O	{1: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	619-21-6	C1=CC(=CC(=C1)C(=O)O)C=O	{26: 1, 27: 1, 14: 4}
Did not match all atoms present	619-23-8	C1=CC(=CC(=C1)[N+](=O)[O-])CCl	{17: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	619-24-9	C1=CC(=CC(=C1)[N+](=O)[O-])C#N	{38: 1, 37: 1, 14: 4}
Did not match all atoms present	619-25-0	C1=CC(=CC(=C1)[N+](=O)[O-])CO	{2: 1, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	619-31-8	CN(C)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	619-41-0	CC1=CC=C(C=C1)C(=O)CBr	{24: 1, 1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	619-42-1	COC(=O)C1=CC=C(C=C1)Br	{1: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	619-44-3	COC(=O)C1=CC=C(C=C1)I	{1: 1, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	619-45-4	COC(=O)C1=CC=C(C=C1)N	{1: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	619-50-1	COC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	619-55-6	CC1=CC=C(C=C1)C(=O)N	{24: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	619-56-7	C1=CC(=CC=C1C(=O)N)Cl	{24: 1, 17: 1, 30: 1, 14: 4}
Did not match all atoms present	619-58-9	C1=CC(=CC=C1C(=O)O)I	{27: 1, 19: 1, 14: 4}
Did not match all atoms present	619-60-3	CN(C)C1=CC=C(C=C1)O	{1: 2, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	619-64-7	CCC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	619-65-8	C1=CC(=CC=C1C#N)C(=O)O	{27: 1, 37: 1, 14: 4}
Did not match all atoms present	619-66-9	C1=CC(=CC=C1C=O)C(=O)O	{26: 1, 27: 1, 14: 4}
Did not match all atoms present	619-67-0	C1=CC(=CC=C1C(=O)O)NN	{27: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	619-72-7	C1=CC(=CC=C1C#N)[N+](=O)[O-]	{38: 1, 37: 1, 14: 4}
Did not match all atoms present	619-73-8	C1=CC(=CC=C1CO)[N+](=O)[O-]	{2: 1, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	619-75-0	C1=CC(=CC=C1C(Br)Br)[N+](=O)[O-]	{18: 2, 3: 1, 38: 1, 14: 4}
Did not match all atoms present	619-80-7	C1=CC(=CC=C1C(=O)N)[N+](=O)[O-]	{24: 1, 38: 1, 30: 1, 14: 4}
Did not match all atoms present	619-84-1	CN(C)C1=CC=C(C=C1)C(=O)O	{1: 2, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	619-86-3	CCOC1=CC=C(C=C1)C(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	619-89-6	C1=CC(=CC=C1C=CC(=O)O)[N+](=O)[O-]	{38: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	619-90-9	CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	619-91-0	C1=CC(=CC=C1NCC(=O)O)[N+](=O)[O-]	{2: 1, 27: 1, 38: 1, 14: 4, 31: 1}
Did not match all atoms present	6190-70-1	CCCCCCCCCCCCOS(=O)(=O)O.C(CO)N	{1: 1, 2: 13, 20: 2, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	61900-99-0	CC(C)C1=C(C2=C3C(=CC=C2)C(=O)C4=CC=CC=C4C3=C1)N5C6=CC=CC7=C6C(=N5)C8=C(C7=O)C=CC(=C8)Cl	{1: 2, 3: 1, 33: 1, 14: 14, 17: 1, 35: 1, 25: 2}
Did not match all atoms present	61901-02-8	CCCCCCCCCCCC1=NCCN1CCOCCC(=O)[O-].[Na+]	{1: 1, 2: 14, 35: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1}
Did not match all atoms present	61907-30-0	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)[N+](=O)[O-])C(=O)C4=C(C3=O)C=CC=C4[N+](=O)[O-]	{24: 1, 25: 2, 38: 2, 14: 10, 31: 1}
Did not match all atoms present	61909-18-0	CCCCCCCC[N+](CCC)(CCCCCCCC)CCCCCCCC.[I-]	{1: 4, 2: 23, 19: 1}
Did not match all atoms present	61912-76-3	CC1C(C(C(C(O1)OC\2CC(C(C(CC(CC(CC(CC(CC(CC(CC(CC(=O)OC(C/C=C/C=C/C=C/C=C/C=C/C=C/C=C2)C(CC(=O)C3=CC=C(C=C3)NC)O)O)O)O)O)O)O)O)O)C(=O)O)O)O)N)O	{1: 2, 2: 1, 3: 1, 11: 10, 12: 17, 14: 18, 20: 12, 22: 1, 23: 1, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	6192-13-8	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.O.O.[Nd+3]	{24: 3, 1: 3}
Did not match all atoms present	6192-44-5	CC(=O)OCCOC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	6192-52-5	CC1=CC=C(C=C1)S(=O)(=O)O.O	{1: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	61922-29-0	CCCCC(CC)COC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 7, 2: 8, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1}
Did not match all atoms present	61924-25-2	CC1=CC(=CC=C1)CN=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	61924-46-7	CCCCCC1=CC=C(C=C1)OC(=O)C=CC2=CC=C(C=C2)C#N	{1: 1, 2: 4, 37: 1, 6: 2, 14: 8, 28: 1}
Did not match all atoms present	61925-55-1	COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-]	{1: 2, 34: 2, 38: 2, 14: 12, 22: 2, 29: 6}
Did not match all atoms present	61925-70-0	CC(C)(C)C1CCC(CC1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3.Cl	{1: 3, 2: 2, 3: 1, 4: 1, 11: 4, 12: 2, 14: 10, 17: 1, 31: 1}
Did not match all atoms present	61925-87-9	CC(=O)OC1=C(C=CC(=C1Cl)Cl)Cl	{1: 1, 28: 1, 14: 2, 17: 3}
Did not match all atoms present	61925-89-1	CC(=O)OC1=C(C(=C(C=C1)Cl)Cl)Cl	{1: 1, 28: 1, 14: 2, 17: 3}
Did not match all atoms present	61926-31-6	CCCS(=O)C=C	{1: 1, 2: 2, 5: 1, 6: 1, 29: 1}
Did not match all atoms present	6193-47-1	C1CC1C(=O)C2=CC=CS2	{24: 1, 41: 1, 11: 2, 12: 1, 14: 3}
Did not match all atoms present	61931-61-1	C1=CC=C2C(=C1)C3=CC4=C5C6=C(C=CC(=C36)C2=O)C(=C7C5=C(C=C4)C(=O)C8=CC(=C(C(=C87)Br)Br)Br)Br	{25: 2, 18: 4, 14: 10}
Did not match all atoms present	61931-68-8	CC1=NC2=C(O1)C=CC(=C2)C3=CC=CC=C3	{1: 1, 35: 1, 14: 8, 23: 1}
Did not match all atoms present	61931-70-2	C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC3=CC=CC=C32)S(=O)(=O)[O-].[Na+]	{22: 1, 14: 11, 29: 5}
Did not match all atoms present	61931-71-3	CCOC(=O)C1=CC=CC=C1C(C2=CC(=C(C(=C2)Br)O)Br)C3=CC(=C(C(=C3)Br)O)Br	{1: 1, 2: 1, 3: 1, 14: 8, 18: 4, 21: 2, 28: 1}
Did not match all atoms present	61931-76-8	CCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 16, 33: 1, 14: 4, 20: 4, 29: 2}
Did not match all atoms present	61931-82-6	CC(C)CC(C)N(C1=CC=CC=C1)C2=CC=C(C=C2)N	{1: 3, 2: 1, 3: 2, 33: 1, 14: 9, 30: 1}
Did not match all atoms present	61931-83-7	CC1=C/C(=N\NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C)/C(=O)C(=C1)[N+](=O)[O-].[Na+]	{1: 2, 34: 1, 35: 1, 38: 1, 33: 1, 12: 1, 14: 6, 15: 4, 25: 2, 29: 3, 31: 1}
Did not match all atoms present	61941-56-8	C1=CC=C(C=C1)C(=O)C2=C(C(=CC=C2)CC(=O)[O-])N.[Na+]	{24: 2, 2: 1, 30: 1, 14: 8}
Did not match all atoms present	61947-30-6	CC(C)C[Sn](=O)CC(C)C	{1: 4, 2: 2, 3: 2, 29: 1}
Did not match all atoms present	61948-85-4	COC1=C(C(=C(C(=C1)C(=O)O)N)OC)OC	{1: 3, 30: 1, 27: 1, 22: 3, 14: 1}
Did not match all atoms present	61949-76-6	CC1([C@H]([C@H]1C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C	{1: 2, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	61949-77-7	CC1([C@@H]([C@H]1C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Cl)Cl)C	{1: 2, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	61950-37-6	C1=CC=C(C=C1)N=NC2=C(C(=C(C=C2)N)S(=O)(=O)[O-])S(=O)(=O)O.[Na+]	{30: 1, 34: 2, 20: 1, 29: 5, 14: 7}
Did not match all atoms present	61951-98-2	CC1=CC(=C(C=C1N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC5=C(C=C4)NC(=O)N5)OC)S(=O)(=O)NC	{32: 2, 1: 3, 34: 1, 14: 10, 15: 2, 22: 1, 24: 1, 25: 2, 29: 2, 31: 3}
Did not match all atoms present	61966-14-1	CC1=CC(=C(C=C1)N=NC2=CC(=C(C=C2C)[N+]#N)OC)[N+](=O)[O-].CC1=CC(=C(C=C1)N=NC2=CC(=C(C=C2C)[N+]#N)OC)[N+](=O)[O-].Cl[Zn-2](Cl)(Cl)Cl	{1: 6, 34: 6, 38: 2, 14: 10, 17: 4, 22: 2}
Did not match all atoms present	61969-42-4	C1=CC2=C(C(=C1)Cl)C=C/C(=N\NC3=C(C=C(C=C3)[N+](=O)[O-])[O-])/C2=O.C1=CC2=C(C(=C1)Cl)C=C/C(=N\NC3=C(C=C(C=C3)[N+](=O)[O-])[O-])/C2=O.[Co+2]	{34: 2, 38: 2, 14: 16, 15: 2, 17: 2, 25: 2, 31: 2}
Did not match all atoms present	6197-30-4	CCCCC(CC)COC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C#N	{1: 2, 2: 5, 3: 1, 37: 1, 7: 2, 14: 10, 28: 1}
Did not match all atoms present	61971-91-3	CC1=CC=C(C=C1)C(=O)CC(C)C	{24: 1, 1: 3, 2: 1, 3: 1, 14: 4}
Did not match all atoms present	61981-10-0	[O-][Si]([O-])([O-])[O-].[Pb+2].[Pb+2]	{29: 4}
Did not match all atoms present	61981-24-6	C1C(O1)CCl.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CNCCN)N	{2: 5, 11: 1, 12: 1, 14: 4, 17: 1, 23: 1, 27: 2, 30: 2, 31: 1}
Did not match all atoms present	6199-00-4	C[Ge](C)(C)S[Ge](C)(C)C	{40: 1, 1: 6}
Did not match all atoms present	61994-26-1	CC1=C(C=CC2=CC=CC=C12)C(C)C	{1: 3, 3: 1, 14: 6}
Did not match all atoms present	61994-66-9	CCN(CCO)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-])C	{1: 2, 2: 3, 38: 1, 33: 1, 34: 2, 14: 7, 20: 1}
Did not match all atoms present	61995-51-5	CC(=O)N1CCC2=C1C=CC(=C2)I	{1: 1, 33: 1, 11: 2, 14: 3, 19: 1, 24: 1}
Did not match all atoms present	62-23-7	C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]	{27: 1, 38: 1, 14: 4}
Did not match all atoms present	62-26-0	C1=CC=C(C=C1)COC(=O)C=CC(=O)OCC2=CC=CC=C2	{2: 2, 28: 2, 14: 10, 6: 2}
Did not match all atoms present	62-31-7	C1=CC(=C(C=C1CCN)O)O.Cl	{17: 1, 2: 2, 30: 1, 21: 2, 14: 3}
Did not match all atoms present	62-32-8	CNCCC1=CC(=C(C=C1)O)O.Cl	{1: 1, 2: 2, 14: 3, 17: 1, 21: 2, 31: 1}
Did not match all atoms present	62-37-3	COC(CNC(=O)N)C[Hg]Cl	{1: 1, 2: 2, 3: 1, 17: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	62-38-4	CC(=O)O[Hg]C1=CC=CC=C1	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	62-44-2	CCOC1=CC=C(C=C1)NC(=O)C	{1: 2, 2: 1, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	62-49-7	C[N+](C)(C)CCO	{1: 3, 2: 2, 20: 1}
Did not match all atoms present	62-50-0	CCOS(=O)(=O)C	{1: 2, 2: 1, 29: 2, 22: 1}
Did not match all atoms present	62-51-1	CC(C[N+](C)(C)C)OC(=O)C.[Cl-]	{1: 5, 2: 1, 3: 1, 28: 1, 17: 1}
Did not match all atoms present	62-53-3	C1=CC=C(C=C1)N	{30: 1, 14: 5}
Did not match all atoms present	62-54-4	CC(=O)[O-].CC(=O)[O-].[Ca+2]	{24: 2, 1: 2}
Did not match all atoms present	62-55-5	CC(=S)N	{1: 1, 30: 1, 7: 1}
Did not match all atoms present	62-56-6	C(=S)(N)N	{30: 2, 7: 1}
Did not match all atoms present	62-67-9	C=CCN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O	{33: 1, 2: 1, 5: 1, 6: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	62-68-0	CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN(CC)CC.Cl	{1: 3, 2: 6, 4: 1, 33: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	62-73-7	COP(=O)(OC)OC=C(Cl)Cl	{1: 2, 6: 1, 7: 1, 17: 2, 22: 3, 29: 1}
Did not match all atoms present	62-74-8	C(C(=O)[O-])F.[Na+]	{16: 1, 24: 1, 2: 1}
Did not match all atoms present	62-76-0	C(=O)(C(=O)[O-])[O-].[Na+].[Na+]	{24: 2}
Did not match all atoms present	62-90-8	CC12CCC3C(C1CCC2OC(=O)CCC4=CC=CC=C4)CCC5=CC(=O)CCC35	{1: 1, 2: 2, 11: 8, 12: 5, 13: 1, 14: 6, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	62-97-5	C[N+]1(CCC(=C(C2=CC=CC=C2)C3=CC=CC=C3)CC1)C.COS(=O)(=O)[O-]	{1: 3, 7: 1, 11: 4, 14: 10, 15: 1, 22: 1, 29: 3}
Did not match all atoms present	620-02-0	CC1=CC=C(O1)C=O	{1: 1, 26: 1, 14: 2, 23: 1}
Did not match all atoms present	620-05-3	C1=CC=C(C=C1)CI	{2: 1, 19: 1, 14: 5}
Did not match all atoms present	620-08-6	COC1=CC=NC=C1	{1: 1, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	620-12-2	C(C(CO)O[N+](=O)[O-])O	{2: 2, 3: 1, 20: 2, 22: 1}
Did not match all atoms present	620-13-3	CC1=CC(=CC=C1)CBr	{1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	620-14-4	CCC1=CC=CC(=C1)C	{1: 2, 2: 1, 14: 4}
Did not match all atoms present	620-16-6	CCC1=CC(=CC=C1)Cl	{1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	620-17-7	CCC1=CC(=CC=C1)O	{1: 1, 2: 1, 21: 1, 14: 4}
Did not match all atoms present	620-18-8	C=CC1=CC(=CC=C1)O	{14: 4, 5: 1, 6: 1, 21: 1}
Did not match all atoms present	620-19-9	CC1=CC(=CC=C1)CCl	{1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	620-20-2	C1=CC(=CC(=C1)Cl)CCl	{17: 2, 2: 1, 14: 4}
Did not match all atoms present	620-22-4	CC1=CC=CC(=C1)C#N	{1: 1, 37: 1, 14: 4}
Did not match all atoms present	620-23-5	CC1=CC=CC(=C1)C=O	{1: 1, 26: 1, 14: 4}
Did not match all atoms present	620-24-6	C1=CC(=CC(=C1)O)CO	{2: 1, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	620-26-8	CC1=CC(=CC=C1)N=O	{1: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	620-27-9	C1=CC=C(C=C1)C[As](=O)(O)O	{2: 1, 20: 2, 29: 1, 14: 5}
Did not match all atoms present	620-32-6	C1=CC=C(C=C1)CS(=O)(=O)CC2=CC=CC=C2	{2: 2, 29: 2, 14: 10}
Did not match all atoms present	620-40-6	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)CC3=CC=CC=C3	{33: 1, 2: 3, 14: 15}
Did not match all atoms present	620-42-8	CC1=CC=C(C=C1)OP(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C	{1: 3, 22: 3, 14: 12}
Did not match all atoms present	620-47-3	CC1=CC(=CC=C1)CC2=CC=CC=C2	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	620-50-8	CC1=CC(=CC=C1)NC(=O)NC2=CC=CC(=C2)C	{24: 1, 1: 2, 14: 8, 31: 2}
Did not match all atoms present	620-55-3	C1=CC=C(C=C1)OC2=CC=CC(=C2)[N+](=O)[O-]	{38: 1, 22: 1, 14: 9}
Did not match all atoms present	620-71-3	CCC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	620-72-4	C1=CC=C(C=C1)OC(=O)CBr	{2: 1, 28: 1, 18: 1, 14: 5}
Did not match all atoms present	620-73-5	C1=CC=C(C=C1)OC(=O)CCl	{17: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	620-79-1	CCOC(=O)C(CC1=CC=CC=C1)C(=O)C	{1: 2, 2: 2, 3: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	620-80-4	CCOC(=O)C(=CC1=CC=CC=C1)C(=O)C	{1: 2, 2: 1, 6: 1, 7: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	620-81-5	C1=CC=C(C=C1)NC(=O)C(=O)NC2=CC=CC=C2	{24: 2, 14: 10, 31: 2}
Did not match all atoms present	620-83-7	CC1=CC=C(C=C1)CC2=CC=CC=C2	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	620-84-8	CC1=CC=C(C=C1)NC2=CC=CC=C2	{1: 1, 14: 9, 31: 1}
Did not match all atoms present	620-85-9	CCC1=CC=C(C=C1)CC2=CC=CC=C2	{1: 1, 2: 2, 14: 9}
Did not match all atoms present	620-86-0	C1=CC=C(C=C1)CC2=CC=C(C=C2)C(=O)O	{2: 1, 27: 1, 14: 9}
Did not match all atoms present	620-87-1	C1=CC=NC(=C1)CC2=CC=C(C=C2)[N+](=O)[O-]	{2: 1, 35: 1, 38: 1, 14: 8}
Did not match all atoms present	620-88-2	C1=CC=C(C=C1)OC2=CC=C(C=C2)[N+](=O)[O-]	{38: 1, 22: 1, 14: 9}
Did not match all atoms present	620-92-8	C1=CC(=CC=C1CC2=CC=C(C=C2)O)O	{2: 1, 21: 2, 14: 8}
Did not match all atoms present	620-93-9	CC1=CC=C(C=C1)NC2=CC=C(C=C2)C	{1: 2, 14: 8, 31: 1}
Did not match all atoms present	620-94-0	CC1=CC=C(C=C1)SC2=CC=C(C=C2)C	{40: 1, 1: 2, 14: 8}
Did not match all atoms present	620-95-1	C1=CC=C(C=C1)CC2=CN=CC=C2	{2: 1, 35: 1, 14: 9}
Did not match all atoms present	620-99-5	CCOC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)OCC)C.Cl	{1: 3, 2: 2, 7: 1, 34: 1, 14: 8, 17: 1, 22: 2, 31: 1}
Did not match all atoms present	62009-59-0	CC1=C(C=C(C=C1)N=C=O)N=C=O.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{1: 1, 2: 1, 8: 4, 34: 4, 14: 20, 24: 1, 27: 1, 28: 6, 29: 4}
Did not match all atoms present	6201-64-5	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=C3C=CC(=O)C=C3	{25: 1, 34: 1, 31: 1, 14: 13, 15: 1}
Did not match all atoms present	62010-10-0	[O-2].[O-]S(=O)(=O)[O-].[Zr+4]	{29: 4}
Did not match all atoms present	6202-04-6	COC(=O)C1=CC(=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)Cl)C(=O)OC	{1: 2, 6: 2, 14: 7, 17: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	6202-23-9	CN(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31.Cl	{1: 2, 2: 2, 6: 1, 33: 1, 14: 10, 15: 1, 17: 1}
Did not match all atoms present	6202-48-8	C[Si](C)(C)OC1=CC=CC2=CC=CC=C21	{1: 3, 22: 1, 14: 7}
Did not match all atoms present	6203-18-5	CN(C)C1=CC=C(C=C1)/C=C/C=O	{1: 2, 26: 1, 14: 4, 6: 2, 33: 1}
Did not match all atoms present	62030-34-6	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OCCO[N+](=O)[O-]	{2: 2, 38: 2, 22: 2, 14: 3}
Did not match all atoms present	62030-36-8	CC(CC1=CC=CC=C1)(CO)[N+](=O)[O-]	{1: 1, 2: 2, 4: 1, 38: 1, 14: 5, 20: 1}
Did not match all atoms present	62030-37-9	CN(C1=C(C(=C(C(=C1[N+](=O)[O-])N(C)[N+](=O)[O-])[N+](=O)[O-])N(C)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 3, 38: 6, 33: 3}
Did not match all atoms present	62037-06-3	C1=CC(=CC(=C1)Cl)C(Br)Br	{17: 1, 18: 2, 3: 1, 14: 4}
Did not match all atoms present	62037-49-4	CN/N=C\C1=CC=CC=C1CCCl	{1: 1, 2: 2, 6: 1, 34: 1, 14: 4, 17: 1, 31: 1}
Did not match all atoms present	62054-70-0	CN(C)NC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 3, 33: 1, 14: 2, 31: 1}
Did not match all atoms present	62057-26-5	C=O.C1=CC=C(C=C1)O.C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O	{2: 1, 3: 4, 5: 1, 14: 5, 20: 5, 21: 1, 26: 1}
Did not match all atoms present	62059-61-4	CCCCCC(=O)C#CC1=CC=CC=C1	{24: 1, 1: 1, 2: 4, 10: 2, 14: 5}
Did not match all atoms present	62064-66-8	CC(CC1=CC(=CC=C1)C(F)(F)F)NCC2=CC=CC=C2	{1: 1, 2: 2, 3: 1, 4: 1, 14: 9, 16: 3, 31: 1}
Did not match all atoms present	6207-41-6	CC[Ge](CC)(CC)C=C	{1: 3, 2: 3, 5: 1, 6: 1}
Did not match all atoms present	62078-98-2	CCN(CCCl)CC1=CC=CC=C1Br	{1: 1, 2: 4, 33: 1, 14: 4, 17: 1, 18: 1}
Did not match all atoms present	6208-26-0	CC(C)C[Sn](CC(C)C)(CC(C)C)O[Sn](CC(C)C)(CC(C)C)CC(C)C	{1: 12, 2: 6, 3: 6, 22: 1}
Did not match all atoms present	62086-04-8	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Sn+2]	{16: 6, 4: 2, 29: 6}
Did not match all atoms present	62093-52-1	C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)C4=CC(=CC=C4)Cl	{24: 1, 17: 1, 11: 1, 14: 11}
Did not match all atoms present	62094-90-0	CC1=CC(=C(C=C1O)C(C)C)N=O	{1: 3, 34: 1, 3: 1, 14: 2, 21: 1, 29: 1}
Did not match all atoms present	621-00-1	CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C	{24: 1, 1: 2, 14: 8, 31: 2}
Did not match all atoms present	621-03-4	C1=CC=C(C=C1)NC(=O)CC#N	{24: 1, 2: 1, 37: 1, 14: 5, 31: 1}
Did not match all atoms present	621-04-5	CCNC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5, 31: 2}
Did not match all atoms present	621-07-8	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)O	{33: 1, 2: 2, 20: 1, 14: 10}
Did not match all atoms present	621-08-9	C1=CC=C(C=C1)CS(=O)CC2=CC=CC=C2	{2: 2, 29: 1, 14: 10}
Did not match all atoms present	621-09-0	CC(=NC1=CC=CC=C1)NC2=CC=CC=C2	{1: 1, 34: 1, 31: 1, 14: 10, 7: 1}
Did not match all atoms present	621-10-3	C1=CC=C(C=C1)NC(=O)CC(=O)NC2=CC=CC=C2	{24: 2, 2: 1, 14: 10, 31: 2}
Did not match all atoms present	621-12-5	C1=CC=C(C=C1)NC(=O)NNC2=CC=CC=C2	{24: 1, 14: 10, 31: 3}
Did not match all atoms present	621-14-7	C1=CC=C(C=C1)OC(=O)CCC(=O)OC2=CC=CC=C2	{2: 2, 28: 2, 14: 10}
Did not match all atoms present	621-15-8	CCCCCC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 2: 4, 14: 5, 31: 1}
Did not match all atoms present	621-23-8	COC1=CC(=CC(=C1)OC)OC	{1: 3, 22: 3, 14: 3}
Did not match all atoms present	621-27-2	CCCC1=CC(=CC=C1)O	{1: 1, 2: 2, 21: 1, 14: 4}
Did not match all atoms present	621-29-4	CC1=CC(=CC=C1)N=C=O	{8: 1, 1: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	621-30-7	CC1=CC(=CC=C1)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4}
Did not match all atoms present	621-31-8	CCNC1=CC(=CC=C1)O	{1: 1, 2: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	621-32-9	CCOC1=CC=CC(=C1)C	{1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	621-33-0	CCOC1=CC=CC(=C1)N	{1: 1, 2: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	621-34-1	CCOC1=CC=CC(=C1)O	{1: 1, 2: 1, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	621-35-2	CC(=O)NC1=CC=CC(=C1)N.Cl	{1: 1, 14: 4, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	621-36-3	CC1=CC(=CC=C1)CC(=O)O	{1: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	621-37-4	C1=CC(=CC(=C1)O)CC(=O)O	{2: 1, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	621-38-5	CC(=O)NC1=CC(=CC=C1)Br	{24: 1, 1: 1, 18: 1, 14: 4, 31: 1}
Did not match all atoms present	621-42-1	CC(=O)NC1=CC(=CC=C1)O	{24: 1, 1: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	621-44-3	C1=CC(=C(C=C1C[C@@H](C(=O)O)N)[N+](=O)[O-])O	{2: 1, 3: 1, 38: 1, 14: 3, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	621-50-1	C1=CC(=CC(=C1)[N+](=O)[O-])CC#N	{2: 1, 38: 1, 37: 1, 14: 4}
Did not match all atoms present	621-51-2	CCOC1=CC=CC(=C1)C(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	621-52-3	CCOC1=CC=CC(=C1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	621-54-5	C1=CC(=CC(=C1)O)CCC(=O)O	{2: 2, 27: 1, 21: 1, 14: 4}
Did not match all atoms present	621-59-0	COC1=C(C=C(C=C1)C=O)O	{1: 1, 22: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	621-65-8	C(C(CO[N+](=O)[O-])O[N+](=O)[O-])O	{2: 2, 3: 1, 20: 1, 22: 2}
Did not match all atoms present	621-66-9	CC1=CC(=NNC2=CC=CC=C2)C=CC1=O	{1: 1, 34: 1, 14: 8, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	621-72-7	C1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2	{32: 1, 2: 1, 35: 1, 14: 9}
Did not match all atoms present	621-78-3	B(OCCCCC)(OCCCCC)OCCCCC	{1: 3, 2: 12, 22: 3}
Did not match all atoms present	621-79-4	C1=CC=C(C=C1)/C=C/C(=O)N	{24: 1, 30: 1, 14: 5, 6: 2}
Did not match all atoms present	621-83-0	C1=CC=C(C=C1)CNC(=S)N	{2: 1, 31: 1, 30: 1, 14: 5, 7: 1}
Did not match all atoms present	621-84-1	C1=CC=C(C=C1)COC(=O)N	{2: 1, 28: 1, 30: 1, 14: 5}
Did not match all atoms present	621-87-4	CC(=O)COC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	621-88-5	C1=CC=C(C=C1)OCC(=O)N	{24: 1, 2: 1, 30: 1, 22: 1, 14: 5}
Did not match all atoms present	621-90-9	CNC1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 1, 34: 2, 14: 9, 31: 1}
Did not match all atoms present	621-91-0	C1=CC=C(C=C1)COC2=CC=C(C=C2)OCC3=CC=CC=C3	{2: 2, 22: 2, 14: 14}
Did not match all atoms present	621-92-1	C1=CC=C(C=C1)C[NH2+]C2=CC=C(C=C2)O.[Cl-]	{17: 1, 2: 1, 21: 1, 14: 9}
Did not match all atoms present	621-95-4	C1=CC(=CC=C1CCC2=CC=C(C=C2)N)N	{2: 2, 30: 2, 14: 8}
Did not match all atoms present	621-96-5	C1=CC(=CC=C1C=CC2=CC=C(C=C2)N)N	{30: 2, 14: 8, 6: 2}
Did not match all atoms present	62106-17-6	C1=CC=C2C(=C1)C=CC=C2N/N=C\3/C(=CC4=CC(=CC(=C4C3=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 1, 14: 10, 15: 2, 20: 2, 21: 1, 25: 1, 29: 4, 31: 1}
Did not match all atoms present	62106-21-2	CC\1=NN(C(=N)/C1=N\NC2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl)C3=CC=CC=C3.C(CO)N(CCO)CCO	{1: 1, 2: 6, 35: 1, 36: 1, 33: 2, 34: 1, 14: 7, 15: 3, 17: 2, 20: 4, 29: 2, 31: 1}
Did not match all atoms present	6211-24-1	C1=CC=C(C=C1)NC2=CC=C(C=C2)S(=O)(=O)[O-].C1=CC=C(C=C1)NC2=CC=C(C=C2)S(=O)(=O)[O-].[Ba+2]	{29: 6, 14: 18, 31: 2}
Did not match all atoms present	6211-32-1	COC(=O)[C@@H]1[C@H](CC[C@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O.Cl	{32: 1, 1: 1, 33: 1, 11: 6, 12: 5, 14: 4, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	62119-81-7	CC(CC1=CC=CS1)O	{1: 1, 2: 1, 3: 1, 41: 1, 14: 3, 20: 1}
Did not match all atoms present	62125-16-0	C1=CC(=CC=C1CC(=O)O)[As](=O)(O)O	{2: 1, 27: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	62129-39-9	CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)Br)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	6213-19-0	CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])Cl	{1: 2, 38: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	6213-94-1	C[Si](C)(C)OC=C	{1: 3, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	62133-36-2	[B](B(CC)CC)CC	{1: 3, 2: 3}
Did not match all atoms present	62134-44-5	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)[O-])NNC3=C(C=C(C=C3)N)Cl.[Na+]	{36: 1, 14: 7, 15: 5, 17: 1, 25: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	6214-20-6	COS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	6214-44-4	CCOC1=CC=C(C=C1)CO	{1: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	6214-45-5	CCCCOC1=CC=C(C=C1)CO	{1: 1, 2: 4, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	62154-77-2	CCC1=CC(=CC=C1)S	{1: 1, 2: 1, 14: 4, 39: 1}
Did not match all atoms present	62154-79-4	C(=N[N+](=O)[O-])(N)N=[N+]=[N-]	{34: 3, 38: 1, 30: 1, 7: 1}
Did not match all atoms present	62155-41-3	CCCC1=CC=C(C=C1)CC2=CC=CC=C2	{1: 1, 2: 3, 14: 9}
Did not match all atoms present	62155-44-6	CCCCC1=CC=C(C=C1)CC2=CC=CC=C2	{1: 1, 2: 4, 14: 9}
Did not match all atoms present	62158-73-0	COC1=CC(=C(C=C1N)S(=O)(=O)CCOS(=O)(=O)O)OC	{1: 2, 2: 2, 14: 2, 20: 1, 22: 3, 29: 4, 30: 1}
Did not match all atoms present	6216-91-7	CCCN(CCC)C1=C(C=C(C=C1)[N+](=O)[O-])Cl	{1: 2, 2: 4, 38: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	62163-33-1	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=CC(=C2)Cl)C#N)NC(=O)CCC(=O)O	{1: 2, 2: 4, 37: 1, 33: 1, 34: 2, 14: 6, 17: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	6217-24-9	C1=CC=C(C=C1)[As](C2=CC=CC=C2)O	{20: 1, 14: 10}
Did not match all atoms present	6217-68-1	C1=CC(=CC=C1[N+](=O)[O-])OS(=O)(=O)[O-].[K+]	{38: 1, 22: 1, 14: 4, 29: 3}
Did not match all atoms present	62178-60-3	CC1=C(C(=C(C=C1)OC(=O)N(C)N=O)C)C	{1: 4, 34: 1, 33: 1, 14: 2, 28: 1, 29: 1}
Did not match all atoms present	6219-66-5	CCC1=C(C2=C(C(=C1C(=O)C)O)C(=O)C3=C(C(=C(C=C3C2=O)O)C(=O)O)C(=O)O)O	{1: 2, 2: 1, 14: 1, 21: 3, 24: 1, 25: 2, 27: 2}
Did not match all atoms present	6219-89-2	CC1=C(C=CC(=C1)NC2=CC=C(C=C2)O)N	{1: 1, 30: 1, 21: 1, 14: 7, 31: 1}
Did not match all atoms present	6219-97-2	C1=CC=C(C=C1)C(=O)NC2=C3C(=C4C(=C2)C(=O)C5=C(N4)C=C(C=C5)C(F)(F)F)C(=O)C6=CC=CC=C6C3=O	{32: 1, 4: 1, 14: 13, 16: 3, 24: 1, 25: 3, 31: 1}
Did not match all atoms present	622-00-4	C1=CC=C(C=C1)COC(=O)[C@@H]([C@H](C(=O)OCC2=CC=CC=C2)O)O	{28: 2, 2: 2, 3: 2, 20: 2, 14: 10}
Did not match all atoms present	622-03-7	C1=CC=C(C=C1)NNC(=S)NNC2=CC=CC=C2	{31: 4, 14: 10, 7: 1}
Did not match all atoms present	622-04-8	C1=CC=C(C=C1)OCC(COC2=CC=CC=C2)O	{2: 2, 3: 1, 20: 1, 22: 2, 14: 10}
Did not match all atoms present	622-08-2	C1=CC=C(C=C1)COCCO	{2: 3, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	622-14-0	C1=CC=C(C=C1)NCNC2=CC=CC=C2	{2: 1, 14: 10, 31: 2}
Did not match all atoms present	622-15-1	C1=CC=C(C=C1)NC=NC2=CC=CC=C2	{34: 1, 14: 10, 6: 1, 31: 1}
Did not match all atoms present	622-16-2	C1=CC=C(C=C1)N=C=NC2=CC=CC=C2	{8: 1, 34: 2, 14: 10}
Did not match all atoms present	622-20-8	C1=CC=C(C=C1)SCCSC2=CC=CC=C2	{40: 2, 2: 2, 14: 10}
Did not match all atoms present	622-21-9	C1=CC=C(C=C1)C=CC=CC(=O)C=CC=CC2=CC=CC=C2	{24: 1, 14: 10, 6: 8}
Did not match all atoms present	622-22-0	C1=CC=C(C=C1)COCCOCC2=CC=CC=C2	{2: 4, 22: 2, 14: 10}
Did not match all atoms present	622-24-2	C1=CC=C(C=C1)CCCl	{17: 1, 2: 2, 14: 5}
Did not match all atoms present	622-29-7	CN=CC1=CC=CC=C1	{1: 1, 34: 1, 14: 5, 6: 1}
Did not match all atoms present	622-32-2	C1=CC=C(C=C1)/C=N\O	{34: 1, 20: 1, 14: 5, 6: 1}
Did not match all atoms present	622-33-3	C1=CC=C(C=C1)CON	{2: 1, 30: 1, 22: 1, 14: 5}
Did not match all atoms present	622-36-6	CNNC1=CC=CC=C1	{1: 1, 14: 5, 31: 2}
Did not match all atoms present	622-37-7	C1=CC=C(C=C1)N=[N+]=[N-]	{34: 2, 14: 5}
Did not match all atoms present	622-38-8	CCSC1=CC=CC=C1	{40: 1, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	622-39-9	CCCC1=CC=CC=N1	{1: 1, 2: 2, 35: 1, 14: 4}
Did not match all atoms present	622-42-4	C1=CC=C(C=C1)C[N+](=O)[O-]	{2: 1, 38: 1, 14: 5}
Did not match all atoms present	622-44-6	C1=CC=C(C=C1)N=C(Cl)Cl	{17: 2, 34: 1, 14: 5, 7: 1}
Did not match all atoms present	622-46-8	C1=CC=C(C=C1)OC(=O)N	{28: 1, 30: 1, 14: 5}
Did not match all atoms present	622-47-9	CC1=CC=C(C=C1)CC(=O)O	{1: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	622-50-4	CC(=O)NC1=CC=C(C=C1)I	{24: 1, 1: 1, 19: 1, 14: 4, 31: 1}
Did not match all atoms present	622-51-5	CC1=CC=C(C=C1)NC(=O)N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	622-56-0	CCCCCCCCCCCCCC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 2: 12, 14: 5, 31: 1}
Did not match all atoms present	622-57-1	CCNC1=CC=C(C=C1)C	{1: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	622-58-2	CC1=CC=C(C=C1)N=C=O	{8: 1, 1: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	622-59-3	CC1=CC=C(C=C1)N=C=S	{8: 1, 1: 1, 34: 1, 14: 4}
Did not match all atoms present	622-60-6	CCOC1=CC=C(C=C1)C	{1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	622-61-7	CCOC1=CC=C(C=C1)Cl	{1: 1, 2: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	622-62-8	CCOC1=CC=C(C=C1)O	{1: 1, 2: 1, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	622-63-9	CCSC1=CC=C(C=C1)C	{40: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	622-68-4	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[As](=O)(O)O	{1: 2, 34: 2, 33: 1, 14: 8, 20: 2, 29: 1}
Did not match all atoms present	622-73-1	COC1=CC=C(C=C1)C=NNC2=CC=CC=C2	{1: 1, 34: 1, 6: 1, 14: 9, 22: 1, 31: 1}
Did not match all atoms present	622-75-3	C1=CC(=CC=C1CC#N)CC#N	{2: 2, 37: 2, 14: 4}
Did not match all atoms present	622-76-4	CCC#CC1=CC=CC=C1	{1: 1, 2: 1, 10: 2, 14: 5}
Did not match all atoms present	622-78-6	C1=CC=C(C=C1)CN=C=S	{8: 1, 2: 1, 34: 1, 14: 5}
Did not match all atoms present	622-79-7	C1=CC=C(C=C1)CN=[N+]=[N-]	{2: 1, 34: 2, 14: 5}
Did not match all atoms present	622-80-0	CCCNC1=CC=CC=C1	{1: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	622-82-2	CCNNC1=CC=CC=C1	{1: 1, 2: 1, 14: 5, 31: 2}
Did not match all atoms present	622-84-4	C1=CC=C(C=C1)NNC=O	{26: 1, 14: 5, 31: 2}
Did not match all atoms present	622-85-5	CCCOC1=CC=CC=C1	{1: 1, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	622-86-6	C1=CC=C(C=C1)OCCCl	{17: 1, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	622-87-7	C1=CC=C(C=C1)OCCOCCOC2=CC=CC=C2	{2: 4, 22: 3, 14: 10}
Did not match all atoms present	622-88-8	C1=CC(=CC=C1NN)Br.Cl	{17: 1, 18: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	622-95-7	C1=CC(=CC=C1CBr)Cl	{17: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	622-96-8	CCC1=CC=C(C=C1)C	{1: 2, 2: 1, 14: 4}
Did not match all atoms present	622-97-9	CC1=CC=C(C=C1)C=C	{1: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	622-98-0	CCC1=CC=C(C=C1)Cl	{1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	6220-49-1	CNC1=NC(=O)N(C=C1)C	{1: 2, 35: 1, 33: 1, 14: 2, 25: 1, 31: 1}
Did not match all atoms present	6220-50-4	CC1=CC(=NC(=O)N1)N	{32: 1, 1: 1, 35: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	62205-27-0	COC1=CC=CC=C1/C=C\C2=CC=CC=N2	{1: 1, 22: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	62209-22-7	C[N+]1(CCC[C@@H]1CC(=O)C[C@@H]2CCC[N+]2(C)C)C.[I-].[I-]	{1: 4, 2: 2, 11: 6, 12: 2, 19: 2, 24: 1}
Did not match all atoms present	62209-53-4	C1(=NN=N[N-]1)N[N+](=O)[O-].[Na+]	{35: 4, 38: 1, 31: 1}
Did not match all atoms present	62209-60-3	C(CO[N+](=O)[O-])N(C(=O)C(=O)N(CCO[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{24: 2, 33: 2, 2: 4, 38: 2, 22: 2}
Did not match all atoms present	6221-88-1	CCCCCCCCCCCCO[Si](C)(C)C	{1: 4, 2: 11, 22: 1}
Did not match all atoms present	6221-89-2	CC(C)N1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=O)C4=CC=CC=C4O3	{1: 3, 3: 1, 33: 1, 41: 1, 11: 3, 14: 5, 23: 1, 24: 1, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	6221-90-5	CCCCCCCCCCCCCCCCO[Si](C)(C)C	{1: 4, 2: 15, 22: 1}
Did not match all atoms present	6221-98-3	CC1=CC(=C(C=C1)C)NC(=O)C(C)SC2=CC=CC=C2	{1: 3, 3: 1, 40: 1, 14: 8, 24: 1, 31: 1}
Did not match all atoms present	6222-06-6	C1CC1NC(=O)C(=O)NCC(C2=CC=CC=C2)O	{2: 1, 3: 1, 11: 2, 12: 1, 14: 5, 20: 1, 24: 2, 31: 2}
Did not match all atoms present	6222-16-8	CCCCCCCCCCCCCCOS(=O)(=O)C	{1: 2, 2: 13, 29: 2, 22: 1}
Did not match all atoms present	6222-22-6	C[Si](C)(C)OCCCCCCO[Si](C)(C)C	{1: 6, 2: 6, 22: 2}
Did not match all atoms present	6222-44-2	C1=CC(=C(C=C1Cl)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{34: 1, 14: 6, 15: 2, 17: 1, 21: 1, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	6222-65-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)N)S(=O)(=O)O)N	{14: 9, 20: 1, 25: 2, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	62229-08-7	[O-]S(=O)[O-].[Pb+2]	{29: 3}
Did not match all atoms present	6223-60-5	CCC1=NC(=S)C2=C(N1)N(C=N2)CC	{32: 1, 1: 2, 2: 2, 35: 2, 33: 1, 14: 1}
Did not match all atoms present	6223-83-2	C1=CC=C2C(=C1)C3=C(C2=O)C=CC=C3C(=O)O	{25: 1, 27: 1, 14: 7}
Did not match all atoms present	62231-08-7	CCOC1(C2=CC=CC=C2OC1=O)C3=CC=CC=C3	{1: 1, 2: 1, 13: 1, 14: 9, 22: 1, 28: 1}
Did not match all atoms present	62232-46-6	C[NH2+]CCCCOC1=CC=CC=C1CC2=CC=CC=C2.[Cl-]	{1: 1, 2: 5, 22: 1, 14: 9, 17: 1}
Did not match all atoms present	62232-91-1	CCC(C)(C=CC1=CC=CC=C1)O	{1: 2, 2: 1, 4: 1, 6: 2, 14: 5, 20: 1}
Did not match all atoms present	6224-55-1	CC1=CC2=CC=CC=C2S1(=O)=O	{1: 1, 29: 2, 14: 5, 15: 1}
Did not match all atoms present	6224-63-1	CC1=CC(=CC=C1)P(C2=CC=CC(=C2)C)C3=CC=CC(=C3)C	{1: 3, 14: 12}
Did not match all atoms present	6224-91-5	CC#C[Si](C)(C)C	{1: 4, 10: 2}
Did not match all atoms present	62244-44-4	CO[Si](C)(C)C1=CC=C(C=C1)Cl	{1: 3, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	62244-45-5	CO[Si](C)(C)C1=CC(=CC=C1)Cl	{1: 3, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	62244-46-6	CO[Si](C)(C)C1=CC(=CC=C1)Br	{1: 3, 18: 1, 22: 1, 14: 4}
Did not match all atoms present	62244-47-7	CC1=CC(=CC=C1)[Si](C)(C)OC	{1: 4, 22: 1, 14: 4}
Did not match all atoms present	62244-48-8	COC1=CC=C(C=C1)[Si](C)(C)OC	{1: 4, 22: 2, 14: 4}
Did not match all atoms present	62244-49-9	CN(C)C1=CC=C(C=C1)[Si](C)(C)OC	{1: 5, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	62244-50-2	CO[Si](C)(C)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	62244-51-3	C[Si](C)(C1=CC=C(C=C1)Cl)F	{16: 1, 1: 2, 14: 4, 17: 1}
Did not match all atoms present	62244-52-4	C[Si](C)(C1=CC(=CC=C1)Cl)F	{16: 1, 1: 2, 14: 4, 17: 1}
Did not match all atoms present	62244-53-5	C[Si](C)(C1=CC=C(C=C1)Br)F	{16: 1, 1: 2, 18: 1, 14: 4}
Did not match all atoms present	62244-54-6	C[Si](C)(C1=CC(=CC=C1)Br)F	{16: 1, 1: 2, 18: 1, 14: 4}
Did not match all atoms present	62244-55-7	COC1=CC=C(C=C1)[Si](C)(C)F	{16: 1, 1: 3, 22: 1, 14: 4}
Did not match all atoms present	62244-56-8	CN(C)C1=CC=C(C=C1)[Si](C)(C)F	{16: 1, 1: 4, 14: 4, 33: 1}
Did not match all atoms present	62244-57-9	C[Si](C)(C1=CC=C(C=C1)[N+](=O)[O-])F	{16: 1, 1: 2, 38: 1, 14: 4}
Did not match all atoms present	62257-17-4	CC(=O)NC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 2: 4, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	62258-26-8	CN(C)C1=CC=C(C=C1)/C=N/N(C)CCCl	{1: 3, 2: 2, 6: 1, 33: 2, 34: 1, 14: 4, 17: 1}
Did not match all atoms present	6226-78-4	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C\3/C4=C(C=C(C=C4)S(=O)(=O)[O-])C=C(C3=O)S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 13, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	6226-80-8	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)NN=C3C4=C(C=C(C=C4)S(=O)(=O)[O-])C=C(C3=O)S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 34: 3, 14: 11, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	6226-87-5	C1CCC(CC1)NC2CCCCC2.C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)O)S(=O)(=O)O	{34: 3, 11: 10, 12: 2, 14: 13, 15: 1, 20: 2, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	6226-90-0	C1CCC(CC1)NC2CCCCC2.C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C\3/C4=C(C=C(C=C4C=C(C3=O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 3, 11: 10, 12: 2, 14: 12, 15: 2, 20: 3, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	62266-82-4	C1=CC2=C(C=C1Br)SC(=O)N2	{32: 1, 25: 1, 18: 1, 14: 3, 41: 1}
Did not match all atoms present	62268-71-7	CCCCCCC1=CC=C(C=C1)C2CCCCC2	{1: 1, 2: 5, 11: 5, 12: 1, 14: 4}
Did not match all atoms present	6227-10-7	CC1=CC(=C(C(=C1)S(=O)(=O)[O-])N=NC2=C(C=C(C(=C2)C)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC5=CC=CC=C5)S(=O)(=O)[O-])C)C.[Na+].[Na+]	{1: 4, 34: 3, 14: 13, 15: 2, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	6227-20-9	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\4/C(=CC5=C(C4=O)C=CC(=C5)NC6=CC=CC=C6)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 3, 14: 16, 15: 2, 22: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	62271-81-2	CC(C)C(C(C)(C)CO)O.CC(C)(CO)COC(=O)C(C)(C)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O	{1: 8, 2: 14, 3: 2, 4: 3, 14: 4, 20: 6, 27: 4, 28: 1}
Did not match all atoms present	623-00-7	C1=CC(=CC=C1C#N)Br	{18: 1, 37: 1, 14: 4}
Did not match all atoms present	623-03-0	C1=CC(=CC=C1C#N)Cl	{17: 1, 37: 1, 14: 4}
Did not match all atoms present	623-04-1	C1=CC(=CC=C1CO)N	{2: 1, 20: 1, 30: 1, 14: 4}
Did not match all atoms present	623-05-2	C1=CC(=CC=C1CO)O	{2: 1, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	623-07-4	C1=CC(=CC=C1O)[Hg]Cl	{17: 1, 21: 1, 14: 4}
Did not match all atoms present	623-08-5	CC1=CC=C(C=C1)NC	{1: 2, 14: 4, 31: 1}
Did not match all atoms present	623-09-6	CNC1=CC=C(C=C1)N	{1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	623-10-9	CC1=CC=C(C=C1)NO	{1: 1, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	623-11-0	CC1=CC=C(C=C1)N=O	{1: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	623-12-1	COC1=CC=C(C=C1)Cl	{1: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	623-13-2	CC1=CC=C(C=C1)SC	{40: 1, 1: 2, 14: 4}
Did not match all atoms present	623-15-4	CC(=O)C=CC1=CC=CO1	{24: 1, 1: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	623-17-6	CC(=O)OCC1=CC=CO1	{1: 1, 2: 1, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	623-18-7	COC(=O)/C=C/C1=CC=CO1	{1: 1, 28: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	623-19-8	CCC(=O)OCC1=CC=CO1	{1: 1, 2: 2, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	623-21-2	CCCC(=O)OCC1=CC=CO1	{1: 1, 2: 3, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	623-22-3	CCCOC(=O)C=CC1=CC=CO1	{1: 1, 2: 2, 6: 2, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	623-24-5	C1=CC(=CC=C1CBr)CBr	{2: 2, 18: 2, 14: 4}
Did not match all atoms present	623-25-6	C1=CC(=CC=C1CCl)CCl	{17: 2, 2: 2, 14: 4}
Did not match all atoms present	623-26-7	C1=CC(=CC=C1C#N)C#N	{37: 2, 14: 4}
Did not match all atoms present	623-27-8	C1=CC(=CC=C1C=O)C=O	{26: 2, 14: 4}
Did not match all atoms present	623-30-3	C1=COC(=C1)/C=C/C=O	{26: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	623-53-0	CCOC(=O)OC	{1: 2, 2: 1}
Did not match all atoms present	623-73-4	CCOC(=C[N+]#N)[O-]	{1: 1, 2: 1, 6: 1, 7: 1, 34: 1, 22: 1}
Did not match all atoms present	623-79-0	CCOC(=S)SCC	{40: 1, 1: 2, 2: 2, 22: 1, 7: 1}
Did not match all atoms present	623-81-4	CCOS(=O)OCC	{1: 2, 2: 2, 29: 1, 22: 2}
Did not match all atoms present	623-87-0	C(C(CO[N+](=O)[O-])O)O[N+](=O)[O-]	{2: 2, 3: 1, 20: 1, 22: 2}
Did not match all atoms present	623-96-1	CCCOC(=O)OCCC	{1: 2, 2: 4}
Did not match all atoms present	623-97-2	C(CCl)OC(=O)OCCCl	{17: 2, 2: 4}
Did not match all atoms present	623-98-3	CCCOS(=O)OCCC	{1: 2, 2: 4, 29: 1, 22: 2}
Did not match all atoms present	6230-11-1	COC1=CC=C(C=C1)C[C@@H](C(=O)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	62303-19-9	C1CSC(=NNC(=O)C2=CC=CC=C2)S1	{34: 1, 41: 2, 11: 2, 14: 5, 15: 1, 24: 1, 31: 1}
Did not match all atoms present	62306-04-1	CC1=NC2=CC(=C(C=C2S1)OC)OC	{1: 3, 35: 1, 22: 2, 14: 2, 41: 1}
Did not match all atoms present	6231-18-1	COC1=NC(=CC=C1)OC	{1: 2, 35: 1, 22: 2, 14: 3}
Did not match all atoms present	6231-76-1	C[Si](C)(C)CC[Si](C)(C)C	{1: 6, 2: 2}
Did not match all atoms present	62312-12-3	CCCCC(CC)C(=O)O[Sn](C)(OC(=O)C(CC)CCCC)OC(=O)C(CC)CCCC	{1: 7, 2: 12, 3: 3, 28: 3}
Did not match all atoms present	62314-67-4	CC1=CN(C(=O)NC1=O)[C@@H]2C[C@@H]([C@H](C2)O)CO	{32: 1, 1: 1, 2: 1, 33: 1, 11: 2, 12: 3, 14: 1, 20: 2, 25: 2}
Did not match all atoms present	62314-89-0	CN(C)S(=O)(=O)C1=CC=C(C=C1)[O-].[Na+]	{1: 2, 29: 2, 14: 4, 33: 1}
Did not match all atoms present	62317-12-8	CCC(C)CO[P+](=O)OCC(C)CC	{1: 4, 2: 4, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	6232-48-0	C1CC2=CC3=CC=CC=C3C4=C2C1=CC=C4	{11: 2, 14: 8}
Did not match all atoms present	6232-49-1	C1=CC(=C(C=C1N/N=C\2/C=C(C(=O)C=C2)C(=O)[O-])S(=O)(=O)[O-])C3=C(C=C(C=C3)N/N=C\4/C=C(C(=O)C=C4)C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 12, 15: 4, 24: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	6232-51-5	C1=CC=C2C(=C1)C\3=C(O2)C=CC(=O)/C3=N\NC4=CC(=CC(=C4O)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]	{34: 1, 38: 1, 14: 8, 15: 1, 21: 1, 23: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	6232-55-9	CC1=CC(=NNC2C(=NN(C2=O)C3=CC=CC=C3)C)C(=O)C(=C1)S(=O)(=O)[O-].[Na+]	{1: 2, 34: 1, 35: 1, 33: 1, 12: 1, 14: 7, 15: 4, 25: 2, 29: 3, 31: 1}
Did not match all atoms present	6232-57-1	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)N)OC)N	{1: 2, 30: 2, 34: 2, 22: 1, 14: 6}
Did not match all atoms present	6232-82-2	CC1=NNC(=S)N1C2=CC=CC=C2	{32: 1, 1: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	6232-88-8	C1=CC(=CC=C1CBr)C(=O)O	{2: 1, 27: 1, 18: 1, 14: 4}
Did not match all atoms present	62325-35-3	C(#N)C(C#N)C1=C(C2=C(C(=C1F)F)C(=C(C(=C2F)F)F)F)F	{16: 7, 3: 1, 37: 2}
Did not match all atoms present	6233-20-1	C(CCl)[Si](Cl)(Cl)Cl	{17: 4, 2: 2}
Did not match all atoms present	62331-46-8	C1=CC(=CC=C1N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)N(CCC#N)CCO	{33: 1, 2: 4, 37: 1, 38: 1, 34: 2, 14: 6, 17: 2, 20: 1}
Did not match all atoms present	62335-85-7	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)S(=O)(=O)CCO)Cl)NC(=O)C	{1: 3, 2: 4, 33: 1, 34: 2, 14: 6, 17: 1, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	62346-96-7	CC1=CC(=C(C=C1)COC(=O)C)C	{1: 3, 2: 1, 28: 1, 14: 3}
Did not match all atoms present	62347-03-9	CC1=CC(=C(CC1C[Si](C)(C)C)C[Si](C)(C)C)C	{1: 8, 2: 2, 11: 1, 12: 1, 14: 1, 15: 3}
Did not match all atoms present	62348-13-4	C1=C(ON=C1)C(=O)Cl	{24: 1, 17: 1, 35: 1, 14: 2, 23: 1}
Did not match all atoms present	62350-91-8	C[Al]C.O	{1: 2}
Did not match all atoms present	62351-05-7	CC(=C)C(=O)OCC[N+](C)(C)CC1CO1.[Cl-]	{1: 3, 2: 3, 5: 1, 7: 1, 11: 1, 12: 1, 17: 1, 23: 1, 28: 1}
Did not match all atoms present	62353-80-4	C1=CC=C2C(=C1)C=CC(=C2O)C(=O)N	{24: 1, 30: 1, 21: 1, 14: 6}
Did not match all atoms present	62355-03-7	C[N+]1(CCCC1CC(=O)CC2CCC[N+]2(C)C)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 11: 6, 12: 2, 14: 10, 24: 1, 29: 6}
Did not match all atoms present	62356-27-8	CC1=C(C=CC=C1Br)Cl	{1: 1, 18: 1, 14: 3, 17: 1}
Did not match all atoms present	6236-62-0	CCOC(=O)C=CC1=CC=CC=C1O	{1: 1, 2: 1, 6: 2, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	62362-59-8	CC(C)CCCCCCCCCCCCC(=O)NCC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1[C@H](CO)O)NC2=NC=NC3=C2NC=N3)O)O	{32: 1, 1: 2, 2: 14, 3: 2, 12: 5, 14: 2, 35: 3, 20: 4, 23: 1, 24: 2, 31: 3}
Did not match all atoms present	6237-23-6	C[NH+](C)CCC[NH2+]C1=C2C=C(C=CC2=NC3=CC=CC=C31)[N+](=O)[O-].[Cl-].[Cl-]	{1: 2, 2: 3, 35: 1, 38: 1, 14: 7, 17: 2}
Did not match all atoms present	6237-59-8	COC(=O)C1=C(C(=C(C(=C1C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC	{1: 6, 28: 6}
Did not match all atoms present	6237-95-2	CCC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])Cl	{1: 1, 2: 1, 35: 2, 38: 1, 17: 2}
Did not match all atoms present	6237-96-3	CCC1=NC(=C(C(=N1)Cl)N)Cl	{1: 1, 2: 1, 35: 2, 30: 1, 17: 2}
Did not match all atoms present	6237-97-4	CCC1=NC(=C(C(=N1)Cl)N)N	{1: 1, 2: 1, 35: 2, 30: 2, 17: 1}
Did not match all atoms present	6237-98-5	CCC1=NC(=C(C(=N1)Cl)N)NCC	{1: 2, 2: 2, 35: 2, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	62373-80-2	COC1=CC=C(C=C1)OC2=CC=CC(=C2)C=O	{1: 1, 26: 1, 22: 2, 14: 8}
Did not match all atoms present	62374-32-7	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)[Si](C)(C)C	{1: 5, 35: 1, 33: 3, 14: 1, 25: 2}
Did not match all atoms present	62374-53-2	C(C#C[Hg]C#CCO)O	{2: 2, 20: 2, 10: 4}
Did not match all atoms present	62374-67-8	CC1=C(C=CC(=C1)NC(=O)C)S(=O)(=O)Cl	{1: 2, 14: 3, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	6238-65-9	C1=CC=C(C(=C1)C(=O)C2=CC=CC=N2)F	{16: 1, 24: 1, 35: 1, 14: 8}
Did not match all atoms present	62385-63-1	CCOC(=O)C=C.CC(=C)C(=O)OCC[N+](C)(C)CC1CO1.[Cl-]	{1: 4, 2: 4, 5: 2, 6: 1, 7: 1, 11: 1, 12: 1, 17: 1, 23: 1, 28: 2}
Did not match all atoms present	62386-33-8	CC(C)(C1=CC(=C(C=C1)O)CC=C)C2=CC(=C(C=C2)O)CC=C.C1=CC(=CC=C1CC2=CC=C(C=C2)N3C(=O)C=CC3=O)N4C(=O)C=CC4=O	{1: 2, 2: 3, 4: 1, 5: 2, 6: 2, 33: 2, 14: 18, 21: 2, 25: 4}
Did not match all atoms present	62394-61-0	CCCCO[Si](C)(C)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 3, 2: 3, 22: 1}
Did not match all atoms present	62394-62-1	CCC(C)O[Si](C)(C)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 4, 2: 1, 3: 1, 22: 1}
Did not match all atoms present	62395-94-2	CC(=C)C(=O)O.CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl	{1: 4, 2: 1, 4: 1, 5: 2, 7: 2, 11: 1, 12: 1, 14: 8, 17: 1, 21: 2, 23: 1, 27: 2}
Did not match all atoms present	62397-61-9	COC1=CC(=C(C=C1)OC)CCC(=O)OC	{1: 3, 2: 2, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	62399-48-8	C[N+](=CNC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)C.[Cl-]	{1: 2, 6: 1, 33: 1, 14: 7, 17: 1, 25: 2, 31: 1}
Did not match all atoms present	624-18-0	C1=CC(=CC=C1N)N.Cl.Cl	{17: 2, 30: 2, 14: 4}
Did not match all atoms present	624-19-1	C1=CC(=CC=C1[NH3+])Br.[Cl-]	{17: 1, 18: 1, 14: 4}
Did not match all atoms present	624-28-2	C1=CC(=NC=C1Br)Br	{18: 2, 35: 1, 14: 3}
Did not match all atoms present	624-31-7	CC1=CC=C(C=C1)I	{1: 1, 19: 1, 14: 4}
Did not match all atoms present	624-38-4	C1=CC(=CC=C1I)I	{19: 2, 14: 4}
Did not match all atoms present	624-43-1	C(C(CO[N+](=O)[O-])O)O	{2: 2, 3: 1, 20: 2, 22: 1}
Did not match all atoms present	624-60-2	CC[NH2+]C.[Cl-]	{1: 2, 2: 1, 17: 1}
Did not match all atoms present	624-79-3	CC[N+]#[C-]	{1: 1, 2: 1, 34: 1}
Did not match all atoms present	624-90-8	CN=[N+]=[N-]	{1: 1, 34: 2}
Did not match all atoms present	6240-55-7	C1=CC=C2C(=C1)C=C(C(=C2Cl)Cl)[N+](=O)[O-]	{17: 2, 38: 1, 14: 5}
Did not match all atoms present	62417-69-0	CC/C(=C/C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCS(=O)(=O)[O-])/C=C/4\N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCCS(=O)(=O)[O-].[K+]	{1: 1, 2: 7, 33: 2, 6: 2, 7: 1, 14: 16, 15: 1, 23: 2, 29: 6}
Did not match all atoms present	62418-35-3	COCCNC1=CC(=C2C(=C1O)C(=O)C3=CC=CC=C3C2=O)O	{1: 1, 2: 2, 14: 5, 21: 2, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	62421-98-1	C[C@]1(C[C@H](C2=C([C@@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=C5C(=C4C3=O)O[C@H]6[C@@H]([C@@H]([C@@H]([C@@]5(O6)C)O)N(C)C)O)OC)O)O	{1: 6, 33: 1, 11: 1, 12: 6, 13: 2, 14: 2, 20: 4, 21: 1, 22: 1, 23: 2, 25: 2, 28: 1}
Did not match all atoms present	62422-00-8	CC1(CCC2=C(C1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=C5C(=C4C3=O)OC6C(C(C(C5(O6)C)O)N(C)C)O)O)O	{1: 5, 33: 1, 11: 2, 12: 5, 13: 2, 14: 2, 20: 3, 21: 2, 23: 2, 25: 2, 28: 1}
Did not match all atoms present	6243-71-6	CC(C)C(=NNC1=CC=CC=C1)C	{1: 3, 34: 1, 3: 1, 7: 1, 14: 5, 31: 1}
Did not match all atoms present	62435-37-4	CCCCCCCCOC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 7, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	62436-46-8	[Si]1([Si]([Si]([Si]([Si]1(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 10}
Did not match all atoms present	62436-47-9	[Si]1([Si]([Si]([Si]([Si]([Si]1(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 12}
Did not match all atoms present	62439-33-2	CCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 2, 37: 1, 11: 4, 12: 2, 14: 4, 28: 1}
Did not match all atoms present	62439-34-3	CCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 3, 37: 1, 11: 4, 12: 2, 14: 4, 28: 1}
Did not match all atoms present	62439-35-4	CCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C#N	{1: 1, 2: 4, 37: 1, 11: 4, 12: 2, 14: 4, 28: 1}
Did not match all atoms present	62441-54-7	C1=CC(=C(C=C1C(F)(F)F)NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])Cl	{4: 2, 38: 2, 14: 5, 16: 6, 17: 1, 31: 1}
Did not match all atoms present	62450-06-0	CC1=C(N=C(C2=C1NC3=CC=CC=C32)C)N	{32: 1, 1: 2, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	62450-07-1	CC1=C2C3=CC=CC=C3NC2=CC(=N1)N	{32: 1, 1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	62458-20-2	C=C1C(=C)OC(=O)O1	{28: 2, 5: 2}
Did not match all atoms present	62462-47-9	O.[Eu].[Eu]	{}
Did not match all atoms present	62462-49-1	[SH-].[Eu].[Eu]	{}
Did not match all atoms present	62462-59-3	O.[Ho].[Ho]	{}
Did not match all atoms present	62462-78-6	O.O.[Tb].[Tb]	{}
Did not match all atoms present	6247-00-3	C=CCN(CC=C)C1=CC=CC=C1	{33: 1, 2: 2, 14: 5, 5: 2, 6: 2}
Did not match all atoms present	6247-36-5	CC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 14: 8, 20: 2, 25: 2, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	6247-46-7	COC1=C2C(=C(C=C1)NC(=O)C3=CC=CC=C3)C(=O)C4=C(C2=O)C5=C(C=C4)C6=CC(=C7C(=C6N5)C(=O)C8=CC=CC=C8C7=O)NC(=O)C9=CC=CC=C9	{32: 1, 1: 1, 14: 19, 22: 1, 24: 2, 25: 4, 31: 2}
Did not match all atoms present	6247-55-8	C1CSC2=CC=CC=C2S1	{41: 2, 11: 2, 14: 4}
Did not match all atoms present	62470-53-5	C1=C(C=C2C(=C1Cl)OC3=C(C=C(C=C3O2)Cl)Cl)Cl	{17: 4, 14: 4, 23: 2}
Did not match all atoms present	62476-15-7	CCNC1=C(C=C(C=C1)Cl)N	{1: 1, 2: 1, 14: 3, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	62476-56-6	C1=CC(=NC(=C1N)Cl)Cl	{17: 2, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	62476-57-7	C1=CC(=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]	{4: 1, 38: 1, 14: 7, 16: 3, 17: 1, 22: 1}
Did not match all atoms present	62476-59-9	C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-].[Na+]	{4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	62476-60-2	CC1=CC(=C(C=C1NC(=O)C)[N+](=O)[O-])C	{24: 1, 1: 3, 38: 1, 14: 2, 31: 1}
Did not match all atoms present	62484-76-8	CC1=CC(=C2C(=C1)OC=C(C2=O)C=O)C	{1: 2, 26: 1, 25: 1, 14: 3, 23: 1}
Did not match all atoms present	6249-65-6	CC[N+](C)(CC)C1=CC(=CC=C1)OC(=O)N(C)C.[I-]	{1: 5, 2: 2, 33: 1, 14: 4, 19: 1, 28: 1}
Did not match all atoms present	6249-76-9	CCCCCN(CCCCC)C1=CC=CC=C1	{1: 2, 2: 8, 14: 5, 33: 1}
Did not match all atoms present	62493-32-7	CCCCCCCCC=C[Al](CCCCCCCC)CCCCCCCC	{1: 3, 2: 21, 6: 2}
Did not match all atoms present	62498-20-8	[C@@H]([C@H](C(=O)[O-])[O-])(C(=O)[O-])O.[Cr+3]	{24: 2, 3: 2, 20: 1, 29: 1}
Did not match all atoms present	625-01-4	CCOS(=O)(=O)Cl	{1: 1, 2: 1, 29: 2, 22: 1, 17: 1}
Did not match all atoms present	625-22-9	CCCCOS(=O)(=O)OCCCC	{1: 2, 2: 6, 29: 2, 22: 2}
Did not match all atoms present	625-53-6	CCNC(=S)N	{1: 1, 2: 1, 31: 1, 30: 1, 7: 1}
Did not match all atoms present	625-55-8	CC(C)OC=O	{1: 2, 26: 1, 3: 1}
Did not match all atoms present	625-57-0	CCOC(=S)N	{1: 1, 2: 1, 30: 1, 22: 1, 7: 1}
Did not match all atoms present	625-58-1	CCO[N+](=O)[O-]	{1: 1, 2: 1, 22: 1}
Did not match all atoms present	625-82-1	CC1=CC(=CN1)C	{32: 1, 1: 2, 14: 2}
Did not match all atoms present	625-84-3	CC1=CC=C(N1)C	{32: 1, 1: 2, 14: 2}
Did not match all atoms present	625-86-5	CC1=CC=C(O1)C	{1: 2, 14: 2, 23: 1}
Did not match all atoms present	625-88-7	C1=C(SC(=C1)I)I	{41: 1, 19: 2, 14: 2}
Did not match all atoms present	625-92-3	C1=C(C=NC=C1Br)Br	{18: 2, 35: 1, 14: 3}
Did not match all atoms present	625-95-6	CC1=CC(=CC=C1)I	{1: 1, 19: 1, 14: 4}
Did not match all atoms present	625-98-9	C1=CC(=CC(=C1)Cl)F	{16: 1, 17: 1, 14: 4}
Did not match all atoms present	625-99-0	C1=CC(=CC(=C1)I)Cl	{17: 1, 19: 1, 14: 4}
Did not match all atoms present	6250-80-2	CCC1=C(NC(=C1C)C=O)C	{32: 1, 1: 3, 2: 1, 26: 1}
Did not match all atoms present	62500-94-1	CC(=C)C(=O)OC.C=CC#N.C=CC1=CC=CC=C1.C=CC1=CC=CC=C1C=C	{1: 2, 5: 5, 6: 4, 7: 1, 14: 9, 28: 1, 37: 1}
Did not match all atoms present	62501-40-0	COC(=O)NN=C(CO)C1=CC=CC=C1	{1: 1, 2: 1, 7: 1, 34: 1, 14: 5, 20: 1, 28: 1, 31: 1}
Did not match all atoms present	62509-87-9	CC[N+]1=C(OC2=C1C=C(C(=C2)C)C)C.[I-]	{1: 4, 2: 1, 33: 1, 14: 2, 19: 1, 23: 1}
Did not match all atoms present	6251-01-0	C1=CC(=C(C#N)C#N)C=C2C1=CC(=C(C#N)C#N)C=C2	{37: 4, 14: 6, 7: 2}
Did not match all atoms present	6251-07-6	C1=CC2=C(C=C(C=C2C=C1S(=O)(=O)O)S(=O)(=O)O)N	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	62512-11-2	CC(C)(CO)N.CS(=O)(=O)O	{1: 3, 2: 1, 4: 1, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	62518-65-4	CC(CC1=CC(=CC=C1)C(C)(C)C)C=O	{1: 4, 2: 1, 3: 1, 4: 1, 14: 4, 26: 1}
Did not match all atoms present	62524-93-0	COC(=O)C(CCC=CCC1C(CC(C1C=CC(COC2=CC=CC=C2)OC3CCCCO3)OC4CCCCO4)OC5CCCCO5)[Se]C6=CC=CC=C6	{1: 1, 2: 4, 3: 2, 6: 4, 11: 13, 12: 7, 14: 10, 22: 4, 23: 3, 28: 1}
Did not match all atoms present	62533-93-1	[O-2].OP(=O)=O.[Na+].[Na+]	{20: 1, 29: 2}
Did not match all atoms present	62535-60-8	CC1=CC=C(C=C1)N2C(=CC(=N2)C)N	{1: 2, 35: 1, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	6254-98-4	COC1=CC=C(C=C1)NC2=CC=C(C=C2)N.COC1=CC=C(C=C1)NC2=CC=C(C=C2)N.OS(=O)(=O)O	{1: 2, 14: 16, 20: 2, 22: 2, 29: 2, 30: 2, 31: 2}
Did not match all atoms present	62546-75-2	CC(CSCCSCC(C)C(=O)OCC(C)(C)CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)OCC(C)(C)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C	{1: 18, 2: 8, 3: 2, 4: 6, 40: 2, 14: 4, 21: 2, 28: 2}
Did not match all atoms present	62548-83-8	CC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O.C(C(CO)(CO)CO)O	{1: 2, 2: 10, 4: 2, 14: 4, 20: 6, 27: 2, 28: 2}
Did not match all atoms present	6255-58-9	C1=CC=C2C(=C1)OS(=O)O2	{29: 1, 14: 4, 23: 2}
Did not match all atoms present	62554-36-3	C1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=CC=C(C=C4)[N+](=O)[O-])O	{22: 1, 38: 1, 28: 1, 21: 1, 14: 14}
Did not match all atoms present	62559-75-5	COC(=O)C(CCC=CCC1C(CC(C1C=CC(COC2=CC(=CC=C2)Cl)OC3CCCCO3)OC4CCCCO4)OC5CCCCO5)[Se]C6=CC=CC=C6	{1: 1, 2: 4, 3: 2, 6: 4, 11: 13, 12: 7, 14: 9, 17: 1, 22: 4, 23: 3, 28: 1}
Did not match all atoms present	6256-31-1	CC(C)(CC1=CC=CC=C1Cl)O	{1: 2, 2: 1, 4: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	62561-75-5	C1=CC(=CC=C1C[C@H](C(=O)O)N)I	{2: 1, 3: 1, 14: 4, 19: 1, 27: 1, 30: 1}
Did not match all atoms present	62563-16-0	CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC(=O)CC(=O)C(C)(C)C	{1: 4, 2: 16, 4: 1, 14: 3, 17: 1, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	62568-43-8	CCCCCCCCCC1=CC(=C(C(=C1)CN(C)CC(=O)[O-])O)CN(C)CC(=O)[O-].[Na+].[Na+]	{1: 3, 2: 12, 33: 2, 14: 2, 21: 1, 24: 2}
Did not match all atoms present	6257-64-3	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 4, 34: 2, 14: 8, 33: 2}
Did not match all atoms present	62570-24-5	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC(=C(C=C4)NC5=CC=C(C=C5)NN=C6C=CC(=O)C=C6)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 4, 14: 18, 15: 3, 20: 3, 25: 2, 29: 6, 30: 1, 31: 3}
Did not match all atoms present	62570-47-2	CC1=C(C=CC(=C1)N)N=NC2=CC=C(C=C2)S(=O)(=O)[O-].[Na+]	{1: 1, 30: 1, 34: 2, 29: 3, 14: 7}
Did not match all atoms present	62570-50-7	CCNC1=C2C(=C(C(=C1)C#N)N)C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 1, 37: 1, 14: 5, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	62573-57-3	CCC(CC)C1=CC(=CC=C1)OC(=O)N(C)N=O	{1: 3, 2: 2, 3: 1, 33: 1, 34: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	62576-04-9	C1=CC=C2C(=C1)SC(=O)S2	{25: 1, 14: 4, 41: 2}
Did not match all atoms present	6258-06-6	C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)N)S(=O)(=O)[O-])Br.[Na+]	{25: 2, 18: 1, 30: 1, 29: 3, 14: 5}
Did not match all atoms present	6258-30-6	CC(C)(C1=CC=C(C=C1)Cl)C(=O)O	{1: 2, 27: 1, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	6258-60-2	COC1=CC=C(C=C1)CS	{1: 1, 2: 1, 22: 1, 14: 4, 39: 1}
Did not match all atoms present	6258-63-5	C1=CSC(=C1)CS	{41: 1, 2: 1, 14: 3, 39: 1}
Did not match all atoms present	6258-66-8	C1=CC(=CC=C1CS)Cl	{17: 1, 2: 1, 14: 4, 39: 1}
Did not match all atoms present	6258-73-7	CC(=CC(C)(C)C1=CC=CC=C1)C2=CC=CC=C2	{1: 3, 4: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	62587-03-5	COC1=CC=C(C=C1)C(C2CC2)(C3=CC=CC=C3)O	{1: 1, 4: 1, 11: 2, 12: 1, 14: 9, 20: 1, 22: 1}
Did not match all atoms present	62587-74-0	CS(=O)(=O)NC1=CC=CC2=C1C=CC(=C2OS(=O)(=O)C)S(=O)(=O)[O-].[Na+]	{1: 2, 31: 1, 22: 1, 14: 5, 29: 7}
Did not match all atoms present	6259-38-7	C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)N.Cl	{17: 2, 30: 1, 22: 1, 14: 8}
Did not match all atoms present	6259-39-8	C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)N)Cl.Cl	{17: 3, 30: 1, 22: 1, 14: 7}
Did not match all atoms present	6259-76-3	CCCCCCOC(=O)C1=CC=CC=C1O	{1: 1, 2: 5, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	6259-77-4	CCCCCCCOC(=O)C1=CC=CC=C1O	{1: 1, 2: 6, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	62592-39-6	CC1=CC(=C(C=C1S(=O)(=O)O)OC)NC(=O)CC(=O)C	{1: 3, 2: 1, 14: 2, 20: 1, 22: 1, 24: 2, 29: 2, 31: 1}
Did not match all atoms present	62592-55-6	COC1=C(C=C(C=C1)S(=O)(=O)Cl)N=NC2C(=NN(C2=O)C3=CC=CC=C3)C#N	{1: 1, 34: 2, 35: 1, 37: 1, 33: 1, 12: 1, 14: 8, 15: 1, 17: 1, 22: 1, 25: 1, 29: 2}
Did not match all atoms present	62592-57-8	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)CNC(=O)C2=C(C3=CC=CC=C3C(=C2)N)O	{1: 2, 2: 16, 3: 1, 14: 9, 21: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	62592-60-3	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=CC(=C4)NS(=O)(=O)C5=CC(=C(C=C5)OC)N=NC6C(=NN(C6=O)C7=CC=CC=C7)C#N)O)C(C)(C)CC	{1: 7, 2: 6, 35: 1, 4: 2, 37: 1, 33: 1, 12: 1, 34: 2, 14: 20, 15: 1, 21: 1, 22: 2, 24: 1, 25: 1, 29: 4, 31: 3}
Did not match all atoms present	62593-17-3	C1=C(C=C(C(=C1Cl)N)C(F)(F)F)Cl	{16: 3, 17: 2, 4: 1, 30: 1, 14: 2}
Did not match all atoms present	62593-23-1	CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)N=O)C	{1: 3, 34: 1, 33: 1, 11: 1, 13: 1, 14: 3, 23: 1, 28: 1, 29: 1}
Did not match all atoms present	626-00-6	C1=CC(=CC(=C1)I)I	{19: 2, 14: 4}
Did not match all atoms present	626-01-7	C1=CC(=CC(=C1)I)N	{19: 1, 30: 1, 14: 4}
Did not match all atoms present	626-02-8	C1=CC(=CC(=C1)I)O	{19: 1, 21: 1, 14: 4}
Did not match all atoms present	626-03-9	C1=CNC(=O)C=C1O	{32: 1, 25: 1, 21: 1, 14: 3}
Did not match all atoms present	626-04-0	C1=CC(=CC(=C1)S)S	{14: 4, 39: 2}
Did not match all atoms present	626-05-1	C1=CC(=NC(=C1)Br)Br	{18: 2, 35: 1, 14: 3}
Did not match all atoms present	626-06-2	C1=CC(=O)NC(=C1)O	{32: 1, 25: 1, 21: 1, 14: 3}
Did not match all atoms present	626-13-1	CC1=CC(=CC=C1)NC2=CC=CC(=C2)C	{1: 2, 14: 8, 31: 1}
Did not match all atoms present	626-15-3	C1=CC(=CC(=C1)CBr)CBr	{2: 2, 18: 2, 14: 4}
Did not match all atoms present	626-16-4	C1=CC(=CC(=C1)CCl)CCl	{17: 2, 2: 2, 14: 4}
Did not match all atoms present	626-17-5	C1=CC(=CC(=C1)C#N)C#N	{37: 2, 14: 4}
Did not match all atoms present	626-18-6	C1=CC(=CC(=C1)CO)CO	{2: 2, 20: 2, 14: 4}
Did not match all atoms present	626-19-7	C1=CC(=CC(=C1)C=O)C=O	{26: 2, 14: 4}
Did not match all atoms present	626-20-0	COC1=CC=CC(=C1)C=C	{1: 1, 14: 4, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	626-21-1	CCC1=CC(=NC=C1)CC	{1: 2, 2: 2, 35: 1, 14: 3}
Did not match all atoms present	626-22-2	C1=CC(=CC(=C1)CC#N)CC#N	{2: 2, 37: 2, 14: 4}
Did not match all atoms present	626-39-1	C1=C(C=C(C=C1Br)Br)Br	{18: 3, 14: 3}
Did not match all atoms present	626-40-4	C1=C(C=C(C=C1Br)Br)N	{18: 2, 30: 1, 14: 3}
Did not match all atoms present	626-41-5	C1=C(C=C(C=C1Br)Br)O	{18: 2, 21: 1, 14: 3}
Did not match all atoms present	626-43-7	C1=C(C=C(C=C1Cl)Cl)N	{17: 2, 30: 1, 14: 3}
Did not match all atoms present	626-44-8	C1=C(C=C(C=C1I)I)I	{19: 3, 14: 3}
Did not match all atoms present	626-48-2	CC1=CC(=O)NC(=O)N1	{32: 2, 1: 1, 14: 1, 25: 2}
Did not match all atoms present	626-55-1	C1=CC(=CN=C1)Br	{18: 1, 35: 1, 14: 4}
Did not match all atoms present	626-60-8	C1=CC(=CN=C1)Cl	{17: 1, 35: 1, 14: 4}
Did not match all atoms present	626-61-9	C1=CN=CC=C1Cl	{17: 1, 35: 1, 14: 4}
Did not match all atoms present	626-84-6	C1=COC(=C1)C=CC(=O)N	{24: 1, 30: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	626-85-7	CCCCOS(=O)OCCCC	{1: 2, 2: 6, 29: 1, 22: 2}
Did not match all atoms present	62601-48-3	[F-].[F-].[F-].[Mg+2].[K+]	{16: 3}
Did not match all atoms present	62602-94-2	CC1=NC=C(C(=C1O)CO)CO.C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)N.C([C@@H]([C@@H]1C(=C(C(=O)O1)O)O)O)O.Cl	{32: 1, 1: 1, 2: 4, 3: 2, 12: 1, 14: 6, 15: 2, 17: 1, 35: 1, 20: 6, 21: 1, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	62603-73-0	CCOC(=O)N(C1=CC=CC=C1)C(C)(C)C	{1: 4, 2: 1, 4: 1, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	62604-62-0	CC(C)(CC(C)(CC(=C)C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 2: 2, 4: 2, 5: 1, 7: 1, 14: 15}
Did not match all atoms present	62607-26-5	CC(=O)NC1=C(C=C(C=C1N=NC2=C(C=C(C=C2I)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCOC)CCOC	{1: 4, 2: 4, 38: 2, 33: 1, 34: 2, 14: 4, 19: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	62609-81-8	CCCCOC(=O)C=C.CC(=C)C(=O)OCCOC(=O)CC(=O)C.CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.[Na+]	{1: 5, 2: 7, 4: 1, 5: 3, 6: 2, 7: 1, 24: 2, 28: 3, 29: 3, 31: 1}
Did not match all atoms present	62609-82-9	C(C(CN(CC(=O)O)CC(=O)[O-])O)N(CC(=O)O)CC(=O)O.[Na+]	{33: 2, 2: 6, 3: 1, 20: 1, 24: 1, 27: 3}
Did not match all atoms present	62609-83-0	CC1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C=CC=C3C(C4=CC=CC=C4N3C)(C)C)N(C)C5=CC=CC=C5)C6=CC=C(C=C6)C.[I-]	{1: 6, 6: 3, 33: 3, 13: 1, 14: 19, 15: 1, 19: 1}
Did not match all atoms present	62609-84-1	CC(C)(C)C(=O)C(C(=O)NC1=C(C=C(C=C1)Cl)Cl)OC2=CC=C(C=C2)C(=O)OC	{1: 4, 3: 1, 4: 1, 14: 7, 17: 2, 22: 1, 24: 2, 28: 1, 31: 1}
Did not match all atoms present	62609-85-2	CC(C)(C)C(=O)C(C(=O)NC1=C(C=C(C=C1)Cl)Cl)Cl	{1: 3, 3: 1, 4: 1, 14: 3, 17: 3, 24: 2, 31: 1}
Did not match all atoms present	62609-86-3	C1C(=O)N(C(=S)N1CC(=O)O)C2=CC=CC=C2	{33: 2, 2: 1, 11: 1, 14: 5, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	62609-88-5	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)Cl	{1: 2, 2: 15, 3: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	62609-89-6	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)N	{1: 2, 2: 15, 3: 1, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	62609-90-9	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)CN	{1: 2, 2: 16, 3: 1, 14: 4, 22: 1, 30: 1}
Did not match all atoms present	62609-93-2	CCN(CC)CC.CC1=C/C(=C/2\C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C)/CC(C1)(C)C	{1: 7, 2: 3, 35: 1, 33: 2, 11: 2, 13: 1, 14: 5, 15: 4, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	62609-94-3	CC1=C/C(=C/2\C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C)/CC(C1)(C)C.C1CCNCC1	{32: 1, 1: 4, 35: 1, 33: 1, 11: 7, 13: 1, 14: 5, 15: 4, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	62609-97-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=C(C2=CC=CC=C2N1)/C(=C/C3=[N+](C4=C(S3)C=CC5=CC=CC=C54)C)/C	{32: 1, 1: 4, 33: 1, 6: 1, 7: 1, 41: 1, 14: 14, 29: 3}
Did not match all atoms present	62610-77-9	C/C(=C\OP(=S)(OC)OC)/C(=O)OC	{1: 4, 28: 1, 22: 3, 6: 1, 7: 1}
Did not match all atoms present	6262-21-1	C1=CC2=C(C=C1O)OC3=C(C24C5=C(C(=C(C(=C5Cl)Cl)Cl)Cl)C(=O)O4)C=CC(=C3)O	{13: 1, 14: 6, 17: 4, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	6262-87-9	CC(C)C1=CC=CC=C1S	{1: 2, 3: 1, 14: 4, 39: 1}
Did not match all atoms present	62622-42-8	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N	{1: 1, 2: 4, 28: 1, 37: 1, 14: 16}
Did not match all atoms present	62622-57-5	C1=CC=C(C=C1)C=CC=CC=CC=CC=CC=CC=CC2=CC=CC=C2	{14: 10, 6: 14}
Did not match all atoms present	62625-13-2	CSCCC(C(=O)O)NC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 3, 3: 1, 40: 1, 14: 3, 17: 2, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	62625-14-3	C1=C(C=C(C(=C1[NH3+])O)Cl)[N+](=O)[O-].[Cl-]	{17: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	62625-15-4	CCCC(=O)OC1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)OC(=O)CCC	{1: 2, 2: 4, 28: 3, 13: 1, 14: 12}
Did not match all atoms present	62625-24-5	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CBr	{24: 1, 2: 1, 34: 2, 18: 1, 14: 9}
Did not match all atoms present	62625-29-0	CC1=C(C=CC(=C1)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4)[O-])C)O.[Na+]	{1: 2, 13: 1, 14: 10, 21: 1, 23: 1, 29: 2}
Did not match all atoms present	6263-37-2	CNC(=O)N(C1=CC(=C(C=C1)Cl)Cl)O	{1: 1, 33: 1, 14: 3, 17: 2, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	6263-62-3	CCSCC1=CC=CC=C1	{40: 1, 1: 1, 2: 2, 14: 5}
Did not match all atoms present	6263-65-6	CC(C1=CC=CC=C1)S	{1: 1, 3: 1, 14: 5, 39: 1}
Did not match all atoms present	6263-83-8	C1=CC=C(C=C1)C(=O)CCCC(=O)C2=CC=CC=C2	{24: 2, 2: 3, 14: 10}
Did not match all atoms present	6263-84-9	C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)CC(=O)C3=CC=CC=C3	{24: 2, 2: 2, 3: 1, 14: 15}
Did not match all atoms present	62630-92-6	CCN(CC)C1=C(C=C(C=C1)[N+]#N)Cl.CCN(CC)C1=C(C=C(C=C1)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 4, 33: 2, 34: 2, 14: 6, 17: 6}
Did not match all atoms present	62635-46-5	CC(=S)NC1=CC=CC=C1Br	{1: 1, 18: 1, 31: 1, 14: 4, 7: 1}
Did not match all atoms present	62635-47-6	CC(C)NC(=O)NC1=CC=CC=C1Cl	{1: 2, 3: 1, 14: 4, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	62635-48-7	CC(C)(C)NC(=O)NC1=CC=CC=C1Cl	{1: 3, 4: 1, 14: 4, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	62635-49-8	CC(C)NC(=S)NC1=CC=CC=C1Cl	{1: 2, 3: 1, 7: 1, 14: 4, 17: 1, 31: 2}
Did not match all atoms present	62635-50-1	CC(C)(C)NC(=S)NC1=CC=CC=C1Cl	{1: 3, 4: 1, 7: 1, 14: 4, 17: 1, 31: 2}
Did not match all atoms present	62635-51-2	CC(C)CC(=O)NC1=CC=CC=C1Cl	{1: 2, 2: 1, 3: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	62635-52-3	C1=CC=C(C(=C1)NC(=S)N)I	{31: 1, 19: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	62635-53-4	CCNC(=O)NC1=CC=CC=C1Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	62635-54-5	CC(C)(C)CC(=S)NC1=CC=CC=C1Cl	{1: 3, 2: 1, 4: 1, 7: 1, 14: 4, 17: 1, 31: 1}
Did not match all atoms present	62637-86-9	CC(=O)OOC(=O)/C=C/C=C/C1=CC=CC=C1.C=CO.C1=CC=C(C=C1)C=O	{1: 1, 5: 1, 6: 5, 14: 10, 20: 1, 26: 1, 28: 2}
Did not match all atoms present	62637-88-1	C=CC1=CC=CC=C1.C=CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N	{34: 1, 5: 2, 6: 2, 14: 14, 29: 2, 31: 1}
Did not match all atoms present	62637-89-2	CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)[O-])C(C)C)C(C)C)[O-].[Na+].[Na+]	{1: 6, 3: 2, 28: 1, 13: 1, 14: 8}
Did not match all atoms present	62637-91-6	CCOC(=O)C1=CC=CC=C1C(=C2C=C(C(=O)C(=C2)Br)Br)C3=CC(=C(C(=C3)Br)[O-])Br.[K+]	{1: 1, 2: 1, 7: 1, 14: 8, 15: 3, 18: 4, 25: 1, 28: 1}
Did not match all atoms present	62637-93-8	C[N+](C)(C)[O-].O.O	{1: 3, 29: 1}
Did not match all atoms present	62637-94-9	CC=CCOC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 4, 3: 2, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1}
Did not match all atoms present	62637-98-3	CC(=O)OC1=C(C=CC2=CC=CC=C21)N=NC3=CC=CC=C3	{1: 1, 34: 2, 28: 1, 14: 11}
Did not match all atoms present	62637-99-4	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Pb+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	62638-00-0	[Li+].C1CCC(CC1)CCCC(=O)[O-]	{24: 1, 2: 3, 11: 5, 12: 1}
Did not match all atoms present	62638-02-2	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Hg+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	62638-03-3	C1CCC(CC1)CCCC(=O)[O-].[K+]	{24: 1, 2: 3, 11: 5, 12: 1}
Did not match all atoms present	62638-04-4	C1CCC(CC1)CCCC(=O)[O-].[Ag+]	{24: 1, 2: 3, 11: 5, 12: 1}
Did not match all atoms present	62638-05-5	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Sr+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	6264-40-0	CSC1=NNC(=S)S1	{32: 1, 1: 1, 35: 1, 41: 1, 40: 1}
Did not match all atoms present	6264-93-3	C1=CC=C(C(=O)C=C1)N	{25: 1, 30: 1, 14: 5}
Did not match all atoms present	6264-98-8	CC1=CC=CC=C1NC2=CC(=CC=C2)O	{1: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	62641-06-9	C1=CC=C2C(=C1)C(=O)N(C2=O)CCC[Si](Cl)(Cl)Cl	{17: 3, 2: 3, 33: 1, 14: 4, 25: 2}
Did not match all atoms present	6265-01-6	C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)N)S(=O)(=O)O	{30: 1, 20: 1, 14: 8, 6: 2, 29: 2}
Did not match all atoms present	6265-74-3	C1=CN=CC=C1C(=O)NCCO	{2: 2, 35: 1, 14: 4, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	62654-05-1	C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.F[Cr+2]	{16: 1, 35: 8, 14: 16}
Did not match all atoms present	62654-06-2	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)OCC(F)(F)F)C)C	{1: 5, 2: 4, 3: 2, 4: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 16: 3}
Did not match all atoms present	62654-07-3	CN(C)C1=CC=CC=C1N.Cl.Cl	{1: 2, 33: 1, 30: 1, 14: 4, 17: 2}
Did not match all atoms present	62654-08-4	CC1=CC(=C(C2=CC(=C(C=C2)[O-])C)C3=CC=CC=C3C(=O)[O-])C=CC1=O.[Na+].[Na+]	{1: 2, 7: 1, 14: 10, 15: 2, 24: 1, 25: 1}
Did not match all atoms present	62654-10-8	CN(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N3C(=O)C=CC3=O	{1: 2, 33: 2, 14: 10, 6: 2, 25: 2}
Did not match all atoms present	62654-12-0	C[N+](C)(C)C1=CC=C(C=C1)N.Cl.[I-]	{1: 3, 19: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	62654-13-1	CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].[La+3]	{24: 3, 1: 3, 2: 24}
Did not match all atoms present	62654-16-4	CCCCCCCCN1C(=NN=N1)N	{1: 1, 2: 7, 35: 3, 30: 1, 33: 1}
Did not match all atoms present	62654-17-5	C1=CC(=CC=C1N)N.C(=O)(C(=O)O)O	{27: 2, 30: 2, 14: 4}
Did not match all atoms present	62654-18-6	C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].[Th+4]	{17: 4, 25: 4, 15: 8}
Did not match all atoms present	62658-92-8	CSC1=C(C=CC=N1)C=O	{40: 1, 1: 1, 26: 1, 35: 1, 14: 3}
Did not match all atoms present	62662-49-1	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C=C5C=C6C=CC7=CC8=CC9=C(C=C8C=C7C6=CC5=C4)C1=CC=CC=C1C1=CC=CC=C19	{14: 26}
Did not match all atoms present	62662-74-2	CC(C)(C)C(=O)NC1=CC=CC=C1Cl	{1: 3, 4: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	62666-20-0	C1=CC(=CC=C1/C(=C\2/C=C(C=CC2=O)F)/NCCCC(=O)N)Cl	{2: 3, 7: 1, 14: 7, 15: 2, 16: 1, 17: 1, 24: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	62669-60-7	CCNC1=CC2=C(C=C1C)N=C3C4=CC=CC=C4C(=[NH+]CC)C=C3O2.[O-]Cl(=O)(=O)=O	{1: 3, 2: 2, 35: 1, 14: 7, 17: 1, 23: 1, 29: 4, 31: 2}
Did not match all atoms present	62669-62-9	COC(=O)CCCN\1C2=CC3=CC=CC=C3C=C2S/C1=C/C=C/4\CCC(=C4N(C5=CC=CC=C5)C6=CC=CC=C6)/C=C/C7=[N+](C8=CC9=CC=CC=C9C=C8S7)CCCC(=O)OC.[O-]Cl(=O)(=O)=O	{1: 2, 2: 6, 6: 4, 33: 3, 41: 2, 11: 2, 14: 22, 15: 4, 17: 1, 28: 2, 29: 4}
Did not match all atoms present	62669-65-2	C1CCC(CC1)CCCC(=O)[O-].C1CCC(CC1)CCCC(=O)[O-].[Ba+2]	{24: 2, 2: 6, 11: 10, 12: 2}
Did not match all atoms present	62669-66-3	CCN(CC)C1=C(C=C2C(=C1)OC3=CC(=[N+](CC)CC)C(=CC3=C2C4=CC=CC=C4C(=O)O)C)C.[O-]Cl(=O)(=O)=O	{1: 6, 2: 4, 33: 2, 14: 8, 17: 1, 23: 1, 27: 1, 29: 4}
Did not match all atoms present	62669-67-4	C=CS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{5: 1, 6: 1, 14: 9, 20: 1, 25: 2, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	62669-69-6	CCN(CC)C1=CC2=C(C=C1)C=C3C=CC(=[N+](CC)CC)C=C3O2.[O-]Cl(=O)(=O)=O	{1: 4, 2: 4, 33: 2, 14: 7, 17: 1, 23: 1, 29: 4}
Did not match all atoms present	62669-70-9	COC(=O)C1=CC=CC=C1C2=C3C=CC(=[NH2+])C=C3OC4=C2C=CC(=C4)N.[Cl-]	{1: 1, 14: 10, 17: 1, 23: 1, 28: 1, 30: 2}
Did not match all atoms present	62669-73-2	CC1=CC(=O)OC2=CC3=C(CCCN3)C=C12	{32: 1, 1: 1, 11: 3, 28: 1, 14: 3}
Did not match all atoms present	62669-74-3	CN(C)C1=CC2=C(C=C1)C3=C(CCC3)C(=O)O2	{1: 2, 11: 3, 28: 1, 14: 3, 33: 1}
Did not match all atoms present	62669-75-4	CC(C)(C)OC(=O)C1=CC2=CC3=C4C(=C2OC1=O)CCCN4CCC3	{1: 3, 4: 1, 33: 1, 11: 6, 14: 2, 28: 2}
Did not match all atoms present	62669-77-6	CNC1=CC2=C(C=C1)C(=C3C=CC(=[NH+]C)C=C3O2)C4=CC=CC=C4C(=O)O.[O-]Cl(=O)(=O)=O	{1: 2, 14: 10, 17: 1, 23: 1, 27: 1, 29: 4, 31: 2}
Did not match all atoms present	6267-02-3	CC1(C2=CC=CC=C2NC3=CC=CC=C31)C	{32: 1, 1: 2, 13: 1, 14: 8}
Did not match all atoms present	6267-21-6	CCCO/N=C\C1=CC=NC=C1	{1: 1, 34: 1, 35: 1, 6: 1, 2: 2, 14: 4, 22: 1}
Did not match all atoms present	6267-27-2	[H-].C1=CC(=CC=C1N)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)O.[Na+]	{30: 1, 20: 1, 29: 4, 14: 8, 31: 1}
Did not match all atoms present	6268-05-9	COC1=CC(=C(C=C1N)OC)NC(=O)C2=CC=CC=C2	{1: 2, 14: 7, 22: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6268-06-0	C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)C(=O)O)C(=O)O)N.Cl.Cl	{17: 2, 2: 1, 27: 2, 30: 2, 14: 6}
Did not match all atoms present	6268-14-0	CC1=CC=CC=C1N=C(N)NC2=CC=CC=C2	{1: 1, 34: 1, 7: 1, 14: 9, 30: 1, 31: 1}
Did not match all atoms present	6268-32-2	C1=CC=C(C=C1)N(C(=O)N)N=O	{33: 1, 34: 1, 14: 5, 24: 1, 29: 1, 30: 1}
Did not match all atoms present	6268-37-7	C1=CC=C(C=C1)CC=CCl	{17: 1, 2: 1, 14: 5, 6: 2}
Did not match all atoms present	6268-68-4	C1=CC=C2C(=C1)C3=CC=CC=C3N2.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 38: 3, 14: 11}
Did not match all atoms present	62681-98-5	C1=CC=C(C(=C1)C2=NN=C(O2)C3=CC=CC=C3F)F	{16: 2, 35: 2, 14: 8, 23: 1}
Did not match all atoms present	6269-50-7	C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[As](=O)(O)O	{38: 2, 20: 2, 21: 1, 14: 2, 29: 1}
Did not match all atoms present	6269-89-2	C1CN(CCN1)C2=CC=C(C=C2)[N+](=O)[O-]	{32: 1, 33: 1, 11: 4, 38: 1, 14: 4}
Did not match all atoms present	6269-99-4	C1=CC=C(C=C1)CC(=O)NCCO	{24: 1, 2: 3, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	62692-40-4	C=C(CCC1=CC=CC=C1)Br	{2: 2, 18: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	62697-16-9	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4[C@@H]([C@@H]([C@@H]([C@H]5O)O)O)O)C=C2	{20: 4, 12: 4, 14: 8}
Did not match all atoms present	62698-50-4	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)[O-].[K+]	{24: 1, 14: 9}
Did not match all atoms present	62698-51-5	CC(=S)[O-].C[N+](C)(C)C	{1: 5, 7: 1}
Did not match all atoms present	62698-52-6	C1=CC=C(C=C1)OP(=O)([O-])[O-].[Mg+2]	{22: 1, 14: 5, 29: 3}
Did not match all atoms present	62698-53-7	CC(=CC1=CC=C(C=C1)N)C(=O)O.Cl	{1: 1, 6: 1, 7: 1, 14: 4, 17: 1, 27: 1, 30: 1}
Did not match all atoms present	62698-58-2	C1=CC=C2C(=C1)C(=O)OC2(C3=CC(=C(C=C3)O)CN(CC(=O)O)CC(=O)O)C4=CC(=C(C=C4)O)CN(CC(=O)O)CC(=O)O	{33: 2, 2: 6, 13: 1, 14: 10, 21: 2, 27: 4, 28: 1}
Did not match all atoms present	627-13-4	CCCO[N+](=O)[O-]	{1: 1, 2: 2, 22: 1}
Did not match all atoms present	627-34-9	C(=C=S)=C=S	{8: 3}
Did not match all atoms present	627-36-1	CCC[N+]#[C-]	{1: 1, 2: 2, 34: 1}
Did not match all atoms present	627-44-1	CC[Hg]CC	{1: 2, 2: 2}
Did not match all atoms present	627-49-6	CCPCC	{1: 2, 2: 2}
Did not match all atoms present	627-53-2	CC[Se]CC	{1: 2, 2: 2}
Did not match all atoms present	627-54-3	CC[Te]CC	{1: 2, 2: 2}
Did not match all atoms present	6270-04-8	CC(=O)OCCC(C1=CC=CC=C1)OC(=O)C	{1: 2, 2: 2, 3: 1, 28: 2, 14: 5}
Did not match all atoms present	6270-07-1	CC(=O)NCCC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	6270-34-4	CC(C)OC(=O)C1=CC=CO1	{1: 2, 3: 1, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	6270-46-8	CC1=C(C(=O)NC(=O)N1)N	{32: 2, 1: 1, 30: 1, 25: 2}
Did not match all atoms present	6270-55-9	CC(C)C(=O)OCC1=CC=CO1	{1: 2, 2: 1, 3: 1, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	6270-56-0	CCOCC1=CC=CO1	{1: 1, 2: 2, 22: 1, 14: 3, 23: 1}
Did not match all atoms present	6270-81-1	CCN1C(=CC2=C3C=C(C=CC3=[N+](C=C2)CC)C)C=CC4=C1C=CC(=C4)C.[I-]	{1: 4, 2: 2, 6: 1, 33: 2, 14: 10, 15: 1, 19: 1}
Did not match all atoms present	62700-64-5	CSC1=NC(=O)C2=NSNC2=N1	{32: 1, 1: 1, 35: 3, 40: 1, 41: 1, 25: 1}
Did not match all atoms present	62708-52-5	CN1CC(=O)N=C1N.CN1CC(=O)N=C1N.[Cl-].[Cl-].[Zn+2]	{1: 2, 35: 2, 33: 2, 11: 2, 15: 2, 17: 2, 25: 2, 30: 2}
Did not match all atoms present	62708-54-7	CN(C)C1=CC=C(C2=CC=CC=C21)N.Cl.Cl	{1: 2, 33: 1, 30: 1, 14: 6, 17: 2}
Did not match all atoms present	62708-58-1	C1=CC(=C(C=C1C=O)S(=O)(=O)[O-])O.[Na+]	{26: 1, 21: 1, 14: 3, 29: 3}
Did not match all atoms present	62714-59-4	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=[N+](C2=NC3=CC=CC=C3N=C2N1C)C	{1: 4, 35: 2, 29: 3, 14: 8, 33: 2}
Did not match all atoms present	62718-63-2	CCCCCOC1=CC=C(C=C1)C=CC(=O)O	{1: 1, 2: 4, 6: 2, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	6272-27-1	C1C(=O)C2=C(O1)C(=C(C=C2)O)O	{25: 1, 11: 1, 21: 2, 14: 2, 23: 1}
Did not match all atoms present	6272-36-2	C1=CC=C(C=C1)S(=O)(=O)NNS(=O)(=O)C2=CC=CC=C2	{29: 4, 14: 10, 31: 2}
Did not match all atoms present	6272-38-4	C1=CC=C(C=C1)COC2=CC=CC=C2O	{2: 1, 22: 1, 21: 1, 14: 9}
Did not match all atoms present	6272-40-8	C1=CC=C(C=C1)C(=O)C2=CC3=CC=CC=C3O2	{24: 1, 14: 10, 23: 1}
Did not match all atoms present	62720-29-0	C1=C(C=C(C(=C1Br)I)Br)F	{16: 1, 18: 2, 19: 1, 14: 2}
Did not match all atoms present	62725-49-9	C1=CC=C(C=C1)[Si]2(O[Si](O[Si](O[Si](O2)(O)O)(O)O)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5	{20: 4, 14: 20, 23: 4}
Did not match all atoms present	62732-44-9	C1CCC2=C(C1)C(=C3CCCC3=N2)N	{35: 1, 11: 7, 30: 1}
Did not match all atoms present	6274-27-7	C1=CC(=C(C=C1Cl)SCC(=O)O)Cl	{40: 1, 17: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	6274-83-5	CCN(CC)C1=CC(=C(C=C1)CC2=C(C=C(C=C2)N(CC)CC)O)O	{1: 4, 2: 5, 21: 2, 14: 6, 33: 2}
Did not match all atoms present	62742-50-1	CC[C@@H](C)COC(=O)/C=C/C1=CC=C(C=C1)N	{1: 2, 2: 2, 3: 1, 6: 2, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	62744-21-2	CC(=O)C1=CC=CC=C1[O-].CC(=O)C1=CC=CC=C1[O-].CC(=O)C1=CC=CC=C1[O-].[Cr+3]	{24: 3, 1: 3, 14: 12}
Did not match all atoms present	62744-22-3	C1=CC(=C(C=C1[N+](=O)[O-])C=O)[O-].C1=CC(=C(C=C1[N+](=O)[O-])C=O)[O-].C1=CC(=C(C=C1[N+](=O)[O-])C=O)[O-].O.O.O.[Eu+3]	{26: 3, 38: 3, 14: 9}
Did not match all atoms present	62744-23-4	CCN(CC)C1=CC(=O)/C(=N/NC2=CC=CC=N2)/C=C1.[Cl-].[Cl-].[Zn+2]	{1: 2, 2: 2, 35: 1, 33: 1, 34: 1, 14: 7, 15: 2, 17: 2, 25: 1, 31: 1}
Did not match all atoms present	62748-01-0	CC1=C2C=CC=C(C2=NC=C1)N	{1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	62758-14-9	CN(C)C1=CC=C(C2=CC=CC=C21)N=NC3=C(C=CC(=C3)S(=O)(=O)O)OC	{1: 3, 34: 2, 33: 1, 14: 9, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	6276-04-6	C1=C(C=C(C=C1[N+](=O)[O-])I)[N+](=O)[O-]	{19: 1, 38: 2, 14: 3}
Did not match all atoms present	6276-48-8	CC1=NC2=CC=CC=C2NC(=O)C1	{32: 1, 1: 1, 35: 1, 11: 1, 14: 4, 15: 1, 25: 1}
Did not match all atoms present	6276-62-6	CCOC1=CC=C(C=C1)C2=CC(=O)C=CC2=O	{1: 1, 2: 1, 14: 7, 15: 1, 22: 1, 25: 2}
Did not match all atoms present	6276-99-9	C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)(COC(=O)C3=CC=CC=C3)O)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5	{2: 2, 12: 3, 13: 1, 14: 20, 20: 1, 23: 1, 28: 4}
Did not match all atoms present	62763-89-7	CC1=NC2=CC=CC=C2C=C1.Cl	{1: 1, 35: 1, 14: 6, 17: 1}
Did not match all atoms present	62764-70-9	CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC(=O)C	{1: 2, 2: 4, 14: 4, 24: 2, 28: 1, 31: 1}
Did not match all atoms present	6277-38-9	CC(=O)C1=CC(=C(C=C1)OC)[N+](=O)[O-]	{24: 1, 1: 2, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	6277-53-8	C1=NC2=C(C(=N1)NN)N=CN2CC(=O)NN	{33: 1, 2: 1, 35: 3, 14: 2, 24: 1, 30: 2, 31: 2}
Did not match all atoms present	62778-13-6	CN(C)CCCNC(=S)C(=S)NCCCN(C)C	{1: 4, 2: 6, 31: 2, 33: 2, 7: 2}
Did not match all atoms present	62778-15-8	CCCCNS(=O)(=O)C1=CC(=C(C=C1)OC)[N+]#N.CCCCNS(=O)(=O)C1=CC(=C(C=C1)OC)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 6, 34: 2, 14: 6, 17: 4, 22: 2, 29: 4, 31: 2}
Did not match all atoms present	62778-16-9	CCOP(=O)(CC1=CC=CC=C1C)OCC	{1: 3, 2: 3, 22: 2, 14: 4, 29: 1}
Did not match all atoms present	62778-17-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NNN=N3	{32: 1, 35: 3, 14: 9}
Did not match all atoms present	62778-18-1	CC1=CC(=C(C(=C1C)I)O)I	{1: 2, 19: 2, 21: 1, 14: 1}
Did not match all atoms present	62778-19-2	C1=C(C=C(C(=C1Cl)I)Cl)[N+](=O)[O-]	{17: 2, 19: 1, 38: 1, 14: 2}
Did not match all atoms present	62778-20-5	C(C1C(C(C(C(O1)[S-])O)O)O)O.[Na+]	{20: 4, 2: 1, 12: 5, 23: 1}
Did not match all atoms present	62778-21-6	COC1=CC=C(C=C1)COC(=O)SC2=CC=CC=C2	{1: 1, 2: 1, 40: 1, 14: 9, 22: 1, 28: 1}
Did not match all atoms present	62778-22-7	C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)OC3=CC(=C(C=C3Cl)Cl)Cl	{17: 3, 3: 1, 14: 12}
Did not match all atoms present	62778-23-8	CCCCOCCOC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 8, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 22: 1}
Did not match all atoms present	62778-24-9	CC1=CC=C(C=C1)NC2=CC3=C(C=C2)C=C(C=C3)S(=O)(=O)Cl	{1: 1, 31: 1, 29: 2, 14: 10, 17: 1}
Did not match all atoms present	62778-25-0	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)OCC=CC5=CC=CC=C5)C)C	{1: 5, 2: 4, 3: 2, 6: 2, 11: 8, 12: 5, 13: 2, 14: 6, 15: 1}
Did not match all atoms present	62778-26-1	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)OCC5=CC=CO5)C)C	{1: 5, 2: 4, 3: 2, 11: 8, 12: 5, 13: 2, 14: 4, 15: 1, 23: 1}
Did not match all atoms present	62780-67-0	C1=C(C(=CC(=C1Cl)Cl)[N+](=O)[O-])NCCCO	{2: 3, 38: 1, 14: 2, 17: 2, 20: 1, 31: 1}
Did not match all atoms present	62780-89-6	C1=CC=C2C(=C1)NC(=O)N2CCCCl	{32: 1, 33: 1, 2: 3, 14: 4, 17: 1, 25: 1}
Did not match all atoms present	62782-05-2	CCCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 1, 2: 12, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	62782-96-1	C[Se]C1=C(C(=O)C1=O)[Se]C	{1: 2, 25: 2}
Did not match all atoms present	62783-48-6	CC1=CC=CC=C1CN(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	62783-49-7	CC1=CC(=CC=C1)CN(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	62783-50-0	CC1=CC=C(C=C1)CN(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	62786-89-4	CC1=CC2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)CCC(=O)OC)C	{32: 2, 1: 7, 2: 6, 35: 2, 14: 5, 28: 3}
Did not match all atoms present	6279-05-6	CC1=CC(=C(C=C1)O)C(=O)C2=CC=C(C=C2)Cl	{24: 1, 1: 1, 21: 1, 14: 7, 17: 1}
Did not match all atoms present	6279-48-7	CC(=O)NC1=C(C=CC(=C1)C2=CC=CC=C2)OC	{24: 1, 1: 2, 22: 1, 14: 8, 31: 1}
Did not match all atoms present	6279-54-5	CCCCOC(=O)C1=CC(=C(C=C1)O)CN(C)C	{1: 3, 2: 4, 33: 1, 14: 3, 21: 1, 28: 1}
Did not match all atoms present	6279-87-4	C1=CC=C(C(=C1)C(=O)OCCCl)C(=O)OCCCl	{17: 2, 2: 4, 28: 2, 14: 4}
Did not match all atoms present	6279-88-5	CC1=C(CCC2=CC=CC=C12)C(=O)O	{27: 1, 1: 1, 11: 2, 14: 4, 15: 2}
Did not match all atoms present	6279-98-7	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CCCCCCC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{2: 6, 38: 4, 14: 6}
Did not match all atoms present	62790-50-5	CC1=CC(=CC(=C1N)[N+](=O)[O-])Cl	{1: 1, 38: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	62790-75-4	CC1=CC(=CC=C1)O[Si](C)(C)C(C)(C)C	{1: 6, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	62792-06-7	CC(CP(C1=CC=CC=C1)C2=CC=CC=C2)(CP(C3=CC=CC=C3)C4=CC=CC=C4)CP(C5=CC=CC=C5)C6=CC=CC=C6.[Cl-].[Cl-].[Cl-].[Rh+3]	{1: 1, 2: 3, 4: 1, 14: 30, 17: 3}
Did not match all atoms present	62796-23-0	CCCCN1C(=O)C(=CC=CC=C2N(C3=CC=CC=C3O2)CCCS(=O)(=O)[O-])C(=O)N(C1=S)CCCC.[Na+]	{1: 2, 2: 9, 6: 4, 33: 3, 14: 4, 15: 3, 23: 1, 25: 2, 29: 3}
Did not match all atoms present	62796-24-1	C[N+](C)(C)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2N.[I-]	{1: 3, 19: 1, 28: 1, 30: 1, 14: 8}
Did not match all atoms present	62796-29-6	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=C(C=C(C=C4)S(=O)(=O)Cl)S(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 14: 9, 17: 1, 23: 1, 29: 5}
Did not match all atoms present	62796-32-1	CC[C@H](C)CC1=CC=C(C=C1)C(=O)Cl	{1: 2, 2: 2, 3: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	62796-65-0	C1=CC=C(C(=C1)C2=C(C=C(C=C2Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	628-03-5	CC(C)CCN=C=S	{8: 1, 1: 2, 2: 2, 3: 1, 34: 1}
Did not match all atoms present	628-30-8	CCCN=C=S	{8: 1, 1: 1, 2: 2, 34: 1}
Did not match all atoms present	628-35-3	C(COC=O)O	{2: 2, 20: 1, 26: 1}
Did not match all atoms present	628-39-7	CC[Se][Se]CC	{1: 2, 2: 2}
Did not match all atoms present	628-52-4	CC(=O)[O-].CC(=O)[O-].[Cr+2]	{24: 2, 1: 2}
Did not match all atoms present	628-82-0	COCCOC=O	{1: 1, 2: 2, 26: 1, 22: 1}
Did not match all atoms present	628-85-3	CCC[Hg]CCC	{1: 2, 2: 4}
Did not match all atoms present	628-96-6	C(CO[N+](=O)[O-])O[N+](=O)[O-]	{2: 2, 22: 2}
Did not match all atoms present	6280-00-8	CC1=CC=C(C=C1)C(=O)CCCCC(=O)C2=CC=C(C=C2)C	{24: 2, 1: 2, 2: 4, 14: 8}
Did not match all atoms present	6280-01-9	CC1=CC(=C(C=C1)C(=O)CCCC(=O)C2=C(C=C(C=C2)C)C)C	{24: 2, 1: 4, 2: 3, 14: 6}
Did not match all atoms present	6280-33-7	C=CCN(CC=C)C1=NNN=N1	{32: 1, 33: 1, 2: 2, 35: 3, 5: 2, 6: 2}
Did not match all atoms present	6280-48-4	CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2Cl	{1: 1, 28: 1, 14: 8, 17: 1}
Did not match all atoms present	6280-54-2	CC1=CC(=C(C=C1)O)C(=O)C2=CC(=CC=C2)Cl	{24: 1, 1: 1, 21: 1, 14: 7, 17: 1}
Did not match all atoms present	6280-75-7	CC(C1=CC=CC=C1)NCCNC(C)C2=CC=CC=C2	{1: 2, 2: 2, 3: 2, 14: 10, 31: 2}
Did not match all atoms present	6280-80-4	C1=CC=C(C(=C1)C=O)OCC(=O)O	{27: 1, 2: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	6280-88-2	C1=CC(=C(C=C1Cl)[N+](=O)[O-])C(=O)O	{17: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	6280-96-2	CCCOC1=CC=CC=C1O	{1: 1, 2: 2, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	6280-98-4	CCCOC1=CC=CC=C1OCCC	{1: 2, 2: 4, 22: 2, 14: 4}
Did not match all atoms present	6281-23-8	C1=C(OC(=C1)[N+](=O)[O-])C=CC(=O)O	{38: 1, 27: 1, 14: 2, 6: 2, 23: 1}
Did not match all atoms present	6281-24-9	C1=C(OC(=C1)[N+](=O)[O-])COC(=O)CBr	{2: 2, 38: 1, 14: 2, 18: 1, 23: 1, 28: 1}
Did not match all atoms present	6281-75-0	CC1=C(C(=C(C(=O)N1)C#N)COC)[N+](=O)[O-]	{32: 1, 1: 2, 2: 1, 37: 1, 38: 1, 22: 1, 25: 1}
Did not match all atoms present	6281-88-5	C1CCN(CC1)C(C2=CC=CC=C2)C(C(=O)C3=CC=CC=C3)N4CCCCC4	{11: 10, 24: 1, 3: 2, 14: 10, 33: 2}
Did not match all atoms present	62812-90-2	CCN(CC)CC.C1=CC(=CC=C1NC(=S)S)O	{1: 3, 2: 3, 33: 1, 7: 1, 39: 1, 14: 4, 21: 1, 31: 1}
Did not match all atoms present	62816-35-7	C1=CC=C(C(=C1)C(=O)[O-])N/N=C/2\C=CC(=O)C3=C2C=CC=N3.[Na+]	{34: 1, 35: 1, 14: 9, 15: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	6282-02-6	C1=CC=C(C=C1)C(=O)NCO	{24: 1, 2: 1, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	62822-49-5	CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCC(CC4)O	{1: 1, 2: 3, 33: 2, 41: 1, 11: 4, 12: 1, 14: 7, 20: 1, 24: 1}
Did not match all atoms present	6283-24-5	CC(=O)O[Hg]C1=CC=C(C=C1)N	{1: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	6283-25-6	C1=CC(=C(C=C1[N+](=O)[O-])N)Cl	{17: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	6283-27-8	C(C(C(=O)O)O)C(=O)O.N	{27: 2, 2: 1, 3: 1, 20: 1}
Did not match all atoms present	6283-63-2	CCN(CC)C1=CC=C(C=C1)N.OS(=O)(=O)O	{1: 2, 2: 2, 33: 1, 14: 4, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	6284-79-3	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)Cl)Cl	{24: 1, 17: 2, 14: 8}
Did not match all atoms present	6284-80-6	C1=CC=C2C(=C1)C(C3=CC=CC=C32)CC(=O)O	{2: 1, 27: 1, 12: 1, 14: 8}
Did not match all atoms present	6284-83-9	C1=C(C(=C(C(=C1Cl)[N+](=O)[O-])Cl)[N+](=O)[O-])Cl	{17: 3, 38: 2, 14: 1}
Did not match all atoms present	6284-98-6	CCC(C)(C)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 2: 1, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	6285-05-8	CCC(=O)C1=CC=C(C=C1)Cl	{24: 1, 1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	6285-34-3	CCCCCCCCCCOC1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCCCCCCCCC)O	{1: 2, 2: 18, 14: 7, 21: 1, 22: 2, 24: 1}
Did not match all atoms present	6285-54-7	CCOC(=O)C1=C(C(=C(N1)C)CC2=C(NC(=C2C)C(=O)OCC)C)C	{32: 2, 1: 6, 2: 3, 28: 2}
Did not match all atoms present	6285-57-0	C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)N	{38: 1, 41: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	6285-64-9	C1=CC=C(C=C1)N=NC(C(=N)N)C(=O)N.Cl	{34: 2, 3: 1, 36: 1, 7: 1, 14: 5, 17: 1, 24: 1, 30: 2}
Did not match all atoms present	62850-32-2	CN(C)C(=O)SCCCCOC1=CC=CC=C1	{1: 2, 2: 4, 33: 1, 40: 1, 14: 5, 22: 1, 24: 1}
Did not match all atoms present	6286-28-8	CC1=CC(=C(C(=C1)C(C)(C)CC(C)(C)C)O)C	{1: 7, 2: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	6286-30-2	C1=CC=C(C=C1)C(C(C(=O)O)Br)Br	{27: 1, 18: 2, 3: 2, 14: 5}
Did not match all atoms present	6286-32-4	C1=C(SC(=C1[N+](=O)[O-])Cl)[N+](=O)[O-]	{17: 1, 38: 2, 14: 1, 41: 1}
Did not match all atoms present	62865-36-5	CC1=C(C=C(C=C1Cl)C2=NNC(=O)C=C2)Cl	{32: 1, 1: 1, 35: 1, 14: 4, 17: 2, 25: 1}
Did not match all atoms present	6287-38-3	C1=CC(=C(C=C1C=O)Cl)Cl	{17: 2, 26: 1, 14: 3}
Did not match all atoms present	6288-38-6	CC[Si](CC)CC.CC[Ge](CC)CC	{1: 6, 2: 6}
Did not match all atoms present	6288-93-3	CCCSC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 2, 35: 3, 40: 1, 14: 2}
Did not match all atoms present	62882-00-2	CC1=CC=CC2=C1C=NC=C2	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	6289-54-9	CC=CC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	62893-20-3	CCN1CCN(C(=O)C1=O)C(=O)N[C@H](C2=CC=C(C=C2)O)C(=O)N[C@H]3[C@@H]4N(C3=O)C(=C(CS4)CSC5=NN=NN5C)C(=O)[O-].[Na+]	{1: 2, 2: 2, 3: 1, 33: 4, 40: 1, 41: 1, 11: 3, 12: 2, 14: 4, 15: 2, 35: 3, 21: 1, 24: 3, 25: 3, 31: 2}
Did not match all atoms present	62893-24-7	CCN1CCN(C(=O)C1=O)C(=O)N[C@H](C2=CC=C(C=C2)O)C(=O)O	{1: 1, 2: 1, 3: 1, 33: 2, 11: 2, 14: 4, 21: 1, 24: 1, 25: 2, 27: 1, 31: 1}
Did not match all atoms present	629-12-9	CCCCCN=C=S	{8: 1, 1: 1, 2: 4, 34: 1}
Did not match all atoms present	629-13-0	C(CN=[N+]=[N-])N=[N+]=[N-]	{2: 2, 34: 4}
Did not match all atoms present	629-15-2	C(COC=O)OC=O	{2: 2, 26: 2}
Did not match all atoms present	629-25-4	CCCCCCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 10}
Did not match all atoms present	629-33-4	CCCCCCOC=O	{1: 1, 2: 5, 26: 1}
Did not match all atoms present	629-35-6	CCCC[Hg]CCCC	{1: 2, 2: 6}
Did not match all atoms present	629-39-0	CCCCCCCCO[N+](=O)[O-]	{1: 1, 2: 7, 22: 1}
Did not match all atoms present	6290-24-0	CCOC1=CC=CC=C1C(=O)OCC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	6290-37-5	CCCCCC(=O)OCCC1=CC=CC=C1	{1: 1, 2: 6, 28: 1, 14: 5}
Did not match all atoms present	62905-81-1	O=[Bi+]	{29: 1}
Did not match all atoms present	62907-78-2	CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)N	{1: 2, 2: 2, 3: 4, 14: 6, 35: 2, 20: 5, 22: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	6291-06-1	C1=CC=C(C=C1)CC(=O)NCO	{24: 1, 2: 2, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	6291-23-2	C1COCCN1C2=CC=C(C=C2)O	{33: 1, 11: 4, 21: 1, 14: 4, 23: 1}
Did not match all atoms present	62912-45-2	CC[N+](C)(C)CCOCCCCCOCC[N+](C)(C)CC.[I-].[I-]	{1: 6, 2: 11, 19: 2, 22: 2}
Did not match all atoms present	62912-47-4	CC[N+](CC)(CC)CCOCCCCCOCC[N+](CC)(CC)CC.[I-].[I-]	{1: 6, 2: 15, 19: 2, 22: 2}
Did not match all atoms present	62912-51-0	CC[N+](CC)(CC)CCOCCOCCOCC[N+](CC)(CC)CC.[I-].[I-]	{1: 6, 2: 14, 19: 2, 22: 3}
Did not match all atoms present	6292-01-9	C=CC(=O)[O-].C=CC(=O)[O-].[Ca+2]	{24: 2, 5: 2, 6: 2}
Did not match all atoms present	6292-55-3	CC(=O)NC1=CC2=C(CC3=CC=CC=C32)C=C1	{24: 1, 1: 1, 11: 1, 14: 7, 31: 1}
Did not match all atoms present	6292-91-7	CC(CC1=CC2=C(C=C1)OCO2)N.Cl	{1: 1, 2: 1, 3: 1, 11: 1, 14: 3, 17: 1, 23: 2, 30: 1}
Did not match all atoms present	62922-39-8	CCCCOC(C)COC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 2: 5, 3: 1, 14: 2, 17: 3, 22: 2, 28: 1}
Did not match all atoms present	62924-70-3	CCN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]	{1: 1, 2: 2, 4: 1, 38: 2, 33: 1, 14: 5, 16: 4, 17: 1}
Did not match all atoms present	62926-66-3	C1=CC(=O)C(=C1[O-])[N+]#N	{25: 1, 34: 1, 14: 2, 15: 2}
Did not match all atoms present	62929-02-6	CC1(CC(C2=C1C=C(C=C2)N)(C)C3=CC=C(C=C3)N)C.C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{1: 3, 11: 1, 13: 2, 14: 13, 24: 1, 28: 4, 30: 2}
Did not match all atoms present	62929-91-3	CC[C@@H]([C@@H](C1=C2C=CC(=O)NC2=C(C=C1)O)O)NC(C)C.Cl	{32: 1, 1: 3, 2: 1, 3: 3, 14: 4, 17: 1, 20: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	6293-52-3	C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C1=C(NC=N1)CO	{32: 1, 2: 1, 35: 1, 38: 3, 14: 4, 20: 1, 21: 1}
Did not match all atoms present	62936-23-6	COC1=C(C(=CC(=C1)C(=O)O)Cl)O	{1: 1, 14: 2, 17: 1, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	6294-34-4	C(CCl)OP(=O)(CCCl)OCCCl	{17: 3, 2: 6, 29: 1, 22: 2}
Did not match all atoms present	6294-93-5	C1=CC(=C(C=C1O)C(F)(F)F)Cl	{16: 3, 17: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	62942-09-0	CC1CN1P(N2CC2C)N3CC3C.C(CCC(=O)O)CC(=O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 3, 2: 4, 3: 2, 33: 3, 11: 3, 12: 3, 20: 2, 27: 4}
Did not match all atoms present	62942-43-2	C1=CC=C(C=C1)[P+](CC=O)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{17: 1, 2: 1, 26: 1, 14: 15}
Did not match all atoms present	62943-62-8	C[Se]C#C[Se]C	{1: 2, 10: 2}
Did not match all atoms present	62947-40-4	N(O)(S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 1, 20: 1, 29: 6}
Did not match all atoms present	6295-12-1	C1=CC=C2C(=C1)O[Sb]O2.O	{14: 4, 23: 2}
Did not match all atoms present	6295-57-4	C1=CC=C2C(=C1)N=C(S2)SCC(=O)O	{2: 1, 35: 1, 40: 1, 41: 1, 14: 4, 27: 1}
Did not match all atoms present	62952-06-1	CC(=O)OC1=CC=CC=C1C(=O)[O-].C(CC[NH3+])CC(C(=O)O)N	{1: 1, 2: 4, 3: 1, 14: 4, 24: 1, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	62959-43-7	CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].[Mg+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	62967-27-5	C1=CC(=CC=C1NC2=CC=C(C=C2)[N+](=O)[O-])N=C=O	{34: 1, 38: 1, 8: 1, 14: 8, 29: 1, 31: 1}
Did not match all atoms present	62973-76-6	CN1C(=CN=C1/C=C/C2=NC(=NC=C2)N)[N+](=O)[O-]	{1: 1, 35: 3, 38: 1, 6: 2, 33: 1, 14: 3, 30: 1}
Did not match all atoms present	62974-93-0	[Ba].[Ba].[Pb]	{}
Did not match all atoms present	6298-16-4	C1=CC(=CN=C1)/C=N/NC2=NC=NC3=C2NC=N3	{32: 1, 34: 1, 35: 4, 6: 1, 14: 6, 31: 1}
Did not match all atoms present	6298-19-7	C1=CC(=C(N=C1)Cl)N	{17: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	6298-37-9	C1=CC2=NC=CN=C2C=C1N	{35: 2, 30: 1, 14: 5}
Did not match all atoms present	6298-52-8	COC1=NC=NC2=C1N=CN2CC(=O)O	{1: 1, 2: 1, 35: 3, 33: 1, 14: 2, 22: 1, 27: 1}
Did not match all atoms present	6298-72-2	CC1=CC(=C(C=C1CCl)C)CCl	{1: 2, 2: 2, 14: 2, 17: 2}
Did not match all atoms present	6299-02-1	CC(C1=CC=C(C=C1)Cl)N	{1: 1, 3: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	6299-25-8	CSC1=NC(=CC(=N1)Cl)Cl	{40: 1, 1: 1, 35: 2, 14: 1, 17: 2}
Did not match all atoms present	63-12-7	CCN(CC)C(=O)C1CN2CCC3=CC(=C(C=C3C2CC1OC(=O)C)OC)OC	{1: 5, 2: 2, 33: 2, 11: 4, 12: 3, 14: 2, 22: 2, 24: 1, 28: 1}
Did not match all atoms present	63-25-2	CNC(=O)OC1=CC=CC2=CC=CC=C21	{1: 1, 28: 1, 14: 7, 31: 1}
Did not match all atoms present	63-37-6	C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 2, 20: 4, 22: 1, 23: 1, 25: 1, 29: 1, 30: 1}
Did not match all atoms present	63-45-6	CC(CCCN)NC1=C2C(=CC(=C1)OC)C=CC=N2.OP(=O)(O)O.OP(=O)(O)O	{1: 2, 2: 3, 3: 1, 14: 5, 35: 1, 20: 6, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	63-56-9	CN(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CC=N2.Cl	{1: 3, 2: 3, 35: 2, 33: 2, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	63-69-4	CC(=O)O/N=C(/C1=CC=C(O1)[N+](=O)[O-])\N	{1: 1, 34: 1, 38: 1, 7: 1, 14: 2, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	63-74-1	C1=CC(=CC=C1N)S(=O)(=O)N	{30: 2, 29: 2, 14: 4}
Did not match all atoms present	63-84-3	C1=CC(=C(C=C1CC(C(=O)O)N)O)O	{2: 1, 3: 1, 14: 3, 21: 2, 27: 1, 30: 1}
Did not match all atoms present	63-91-2	C1=CC=C(C=C1)C[C@@H](C(=O)O)N	{27: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	63-92-3	CC(COC1=CC=CC=C1)N(CCCl)CC2=CC=CC=C2.Cl	{1: 1, 2: 4, 3: 1, 33: 1, 14: 10, 17: 2, 22: 1}
Did not match all atoms present	63-98-9	C1=CC=C(C=C1)CC(=O)NC(=O)N	{24: 2, 2: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	63-99-0	CC1=CC(=CC=C1)NC(=O)N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	630-08-0	[C-]#[O+]	{29: 1}
Did not match all atoms present	630-10-4	C(=N)(N)[Se]	{36: 1, 30: 1, 7: 1}
Did not match all atoms present	630-76-2	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{4: 1, 14: 20}
Did not match all atoms present	630-88-6	C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)Cl)OC5=C3C=CC(=C5)Cl	{17: 2, 28: 1, 13: 1, 14: 10, 23: 1}
Did not match all atoms present	630-95-5	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC4=CC=CC=C43)O	{20: 1, 4: 1, 14: 17}
Did not match all atoms present	6300-18-1	[H-].C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)O.[Na+]	{34: 2, 38: 1, 14: 9, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	6300-23-8	C1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=C(C=C2)N)S(=O)(=O)[O-].[Na+]	{30: 1, 34: 2, 29: 3, 14: 10}
Did not match all atoms present	6300-24-9	C1=CC=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)[O-].[Na+]	{34: 1, 14: 9, 15: 2, 25: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	6300-37-4	CC1=CC(=NNC2=CC=C(C=C2)N=NC3=CC=CC=C3)C=CC1=O	{1: 1, 34: 3, 14: 12, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	6300-53-4	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N/N=C/3\C=C(C4=CC=CC=C4C3=O)S(=O)(=O)O)C	{1: 2, 34: 3, 14: 12, 15: 2, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	6300-80-7	CN(C)C1=CC=C(C=C1)/C=N/NC2=NC=NC3=C2NC=N3	{32: 1, 1: 2, 34: 1, 35: 3, 6: 1, 33: 1, 14: 6, 31: 1}
Did not match all atoms present	63000-06-6	C=C[Te]C=C	{5: 2, 6: 2}
Did not match all atoms present	63006-93-9	C1C(NCC2=CC=CC=C21)CO	{32: 1, 2: 1, 11: 2, 12: 1, 14: 4, 20: 1}
Did not match all atoms present	63007-70-5	C1CC1COC2=C(C=C(C=C2)CC(=O)O)Cl.C(CCN)C[C@@H](C(=O)O)N	{2: 6, 3: 1, 11: 2, 12: 1, 14: 3, 17: 1, 22: 1, 27: 2, 30: 2}
Did not match all atoms present	63007-83-0	CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ce+4]	{1: 8, 3: 4, 29: 4}
Did not match all atoms present	63009-74-5	C1[C@H]([C@@H]1N=C=O)C2=CC=CC=C2	{34: 1, 8: 1, 11: 1, 12: 2, 14: 5, 29: 1}
Did not match all atoms present	6301-12-8	C1=CC(=CC(=C1)[N+](=O)[O-])/C=C\2/C(=O)NC(=S)S2	{32: 1, 6: 1, 38: 1, 41: 1, 14: 4, 15: 2, 25: 1}
Did not match all atoms present	63018-40-6	COC(=O)CC1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC=C41	{1: 1, 2: 1, 28: 1, 14: 11}
Did not match all atoms present	63018-49-5	C1=CC=C2C=C3C4=CC=CC=C4C(=CC3=CC2=C1)NC(=O)NCC(=O)O	{24: 1, 2: 1, 27: 1, 14: 11, 31: 2}
Did not match all atoms present	63018-50-8	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)NC(=O)NCC(=O)O	{24: 1, 2: 1, 27: 1, 14: 11, 31: 2}
Did not match all atoms present	63018-56-4	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)N=C=O	{8: 1, 34: 1, 29: 1, 14: 11}
Did not match all atoms present	63018-57-5	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)S	{14: 11, 39: 1}
Did not match all atoms present	63018-59-7	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)CS	{2: 1, 14: 11, 39: 1}
Did not match all atoms present	63018-62-2	CC(=O)OCC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C41)COC(=O)C	{1: 2, 2: 2, 28: 2, 14: 10}
Did not match all atoms present	63018-63-3	CC1=C2C=CC3=CC=CC=C3C2=C(C4=C1C(=CC=C4)Br)C	{1: 2, 18: 1, 14: 9}
Did not match all atoms present	63018-64-4	CCCCC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21	{1: 1, 2: 3, 14: 11}
Did not match all atoms present	63018-67-7	CC1=C2C(=CC3=C1C=CC4=CC=CC=C43)C=CC=C2Cl	{1: 1, 14: 10, 17: 1}
Did not match all atoms present	63018-68-8	CC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC(=C14)C#N)C	{1: 2, 37: 1, 14: 9}
Did not match all atoms present	63018-69-9	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)CC#N	{2: 1, 37: 1, 14: 11}
Did not match all atoms present	63018-70-2	CC1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC(=C14)C#N	{1: 1, 37: 1, 14: 10}
Did not match all atoms present	63018-94-0	CC1=CC2=C(C3=CC=CC=C3C(=C2C=C1)C)C	{1: 3, 14: 7}
Did not match all atoms present	63018-98-4	CC(=O)C1=CC2=C(C3=CC=CC=C3C=C2)C4=CC=CC=C41	{24: 1, 1: 1, 14: 11}
Did not match all atoms present	63018-99-5	CCCCCC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21	{1: 1, 2: 4, 14: 11}
Did not match all atoms present	63019-08-9	CCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)/C(=C(\CC)/C2=CC=C(C=C2)OC(=O)CCCCCCCCCCCCCCC)/CC	{1: 4, 2: 30, 28: 2, 14: 8, 7: 2}
Did not match all atoms present	63019-09-0	CC1=CC=CC=C1C=CC2=CC=C(C=C2)N(C)C	{1: 3, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	63019-14-7	CN(C)C1=CC=C(C=C1)C=CC2=CC=CC3=CC=CC=C32	{1: 2, 14: 11, 6: 2, 33: 1}
Did not match all atoms present	63019-23-8	CC1=CC=CC2=C1C3=C(C=C2)C4=CC=CC=C4C=C3C	{1: 2, 14: 10}
Did not match all atoms present	63019-25-0	CC12C3=C(C4=CC=CC=C4C=C3)C(O1)(C5=CC=CC=C25)C	{1: 2, 13: 2, 14: 10, 23: 1}
Did not match all atoms present	63019-29-4	CCOCC1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC=C41	{1: 1, 2: 2, 22: 1, 14: 11}
Did not match all atoms present	63019-32-9	CCCCCCCC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21	{1: 1, 2: 6, 14: 11}
Did not match all atoms present	63019-34-1	CCCCCCC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21	{1: 1, 2: 5, 14: 11}
Did not match all atoms present	63019-50-1	CN(C)C1=CC=C(C=C1)/[N+](=C/C2=C3C=CC4=CC=CC=C4C3=NC5=CC=CC=C52)/[O-]	{1: 2, 35: 1, 6: 1, 33: 2, 14: 14, 29: 1}
Did not match all atoms present	63019-52-3	CC1=C2C=CC(=C(C2=NC3=C1C4=CC=CC=C4C=C3)C)Cl	{1: 2, 35: 1, 14: 8, 17: 1}
Did not match all atoms present	63019-53-4	CCC1=C2C=CC3=CC=CC=C3C2=NC4=C1C=CC(=C4C)Cl	{1: 2, 2: 1, 35: 1, 14: 8, 17: 1}
Did not match all atoms present	63019-59-0	CN(C)C1=CC=C(C=C1)/C=C\C2=C3C(=NC4=CC=CC=C42)C=CC5=CC=CC=C53	{1: 2, 35: 1, 14: 14, 6: 2, 33: 1}
Did not match all atoms present	63019-60-3	CN(C)C1=CC=C(C=C1)/C=C\C2=C3C=CC4=CC=CC=C4C3=NC5=CC=CC=C52	{1: 2, 35: 1, 14: 14, 6: 2, 33: 1}
Did not match all atoms present	63019-65-8	CC(=O)N(C1=CC=CC2=C1CC3=CC=CC=C32)C(=O)C	{24: 2, 1: 2, 11: 1, 14: 7, 33: 1}
Did not match all atoms present	63019-67-0	C1C2=CC=CC=C2C3=C1C=C(C=C3)NC(=O)CN	{2: 1, 11: 1, 14: 7, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	63019-68-1	CNC1=CC2=C(C=C1)C3=CC=CC=C3C2	{1: 1, 11: 1, 14: 7, 31: 1}
Did not match all atoms present	63019-69-2	COC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21	{1: 1, 22: 1, 14: 11}
Did not match all atoms present	63019-70-5	CC1=C(C=C2C(=C3C(=C(C2=C1)C)C=CC4=CC=CC=C43)C)C	{1: 4, 14: 8}
Did not match all atoms present	63019-72-7	COC1=CC2=C(C=C3C=CC4=CC=CC=C4C3=C2)C5=CC=CC=C51	{1: 1, 22: 1, 14: 13}
Did not match all atoms present	63019-73-8	C1=CC=C(C=C1)/C=C/C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C6=CC=CC=C62	{14: 16, 6: 2}
Did not match all atoms present	63019-76-1	CN(C)C(=O)NC1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 2, 34: 2, 33: 1, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	63019-77-2	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)CN=NC5=CC=C(C=C5)[N+](=O)[O-]	{38: 1, 2: 1, 35: 1, 34: 2, 14: 14}
Did not match all atoms present	63019-78-3	CC1=NC=CC(=C1)N=NC2=CC=C(C=C2)N(C)C	{1: 3, 34: 2, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	63019-81-8	C1=CC(=CC=C1C2=CC(=C(C=C2)[NH3+])O)[N+](=O)[O-].[Cl-]	{17: 1, 38: 1, 21: 1, 14: 7}
Did not match all atoms present	63019-82-9	CN(C)C1=CC=C(C=C1)N=NC2=CC=NC=C2	{1: 2, 34: 2, 35: 1, 14: 8, 33: 1}
Did not match all atoms present	63019-93-2	CN(C)C1=C(C=C(C=C1)C2=CC=CC=C2)O	{1: 2, 21: 1, 14: 8, 33: 1}
Did not match all atoms present	63019-98-7	CC1=C(C=CC(=C1)C2=CC=CC=C2)N	{1: 1, 30: 1, 14: 8}
Did not match all atoms present	63020-03-1	COC1=C(C=CC2=CC=CC=C21)[NH3+].[Cl-]	{1: 1, 22: 1, 14: 6, 17: 1}
Did not match all atoms present	63020-21-3	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3S2=O	{24: 1, 1: 1, 29: 1, 14: 7, 31: 1}
Did not match all atoms present	63020-25-7	CC1=C2C(=C(C3=CC=CC=C13)C#N)C=CC4=CC=CC=C42	{1: 1, 37: 1, 14: 10}
Did not match all atoms present	63020-27-9	CCOCC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C41)C	{1: 2, 2: 2, 22: 1, 14: 10}
Did not match all atoms present	63020-32-6	CCCC1=CC2=C(C3=CC=CC=C3C=C2)C4=CC=CC=C41	{1: 1, 2: 2, 14: 11}
Did not match all atoms present	63020-33-7	CCCC1=CC=CC2=C1C(=C3C=CC4=CC=CC=C4C3=C2C)C	{1: 3, 2: 2, 14: 9}
Did not match all atoms present	63020-37-1	CC1=CC2=C(CCCC2)C3=CC4=CC=CC=C4C=C13	{1: 1, 11: 4, 14: 7}
Did not match all atoms present	63020-39-3	CC1=C(C2=C(C3=C(C(=C2C=C1)C)C4=CC=CC=C4C=C3)C)C	{1: 4, 14: 8}
Did not match all atoms present	63020-45-1	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)CCO	{2: 2, 20: 1, 14: 11}
Did not match all atoms present	63020-47-3	CC(C)C1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21	{1: 2, 3: 1, 14: 11}
Did not match all atoms present	63020-48-4	CC(C)C1=CC2=C(C=C1)C=C3C(=C2)C=CC4=CC=CC=C43	{1: 2, 3: 1, 14: 11}
Did not match all atoms present	63020-53-1	CC(C)C1=CC2=C(C3=CC=CC=C3C=C2)C4=CC=CC=C41	{1: 2, 3: 1, 14: 11}
Did not match all atoms present	63020-60-0	CCC1=C2C=C(C3=CC=CC=C3C2=CC4=CC=CC=C41)OC	{1: 2, 2: 1, 22: 1, 14: 10}
Did not match all atoms present	63020-61-1	CC1=C2C(=CC3=C1C=CC4=CC=CC=C43)C=CC=C2OC	{1: 2, 22: 1, 14: 10}
Did not match all atoms present	63020-69-9	CC1=C(C2=C(C=CC3=CC=CC=C32)C4=C1CCC4)C	{1: 2, 11: 3, 14: 6}
Did not match all atoms present	63020-76-8	CC1=CC2=CC=CC=C2C3=C1C4=C(CCC4)C=C3	{1: 1, 11: 3, 14: 7}
Did not match all atoms present	63020-91-7	CN(C)C1=CC=C(C=C1)C=CC2=CC=CC=C2Cl	{1: 2, 33: 1, 14: 8, 6: 2, 17: 1}
Did not match all atoms present	63021-32-9	CCC1=C2C=CC3=CC=CC=C3C2=NC4=CC=CC=C41	{1: 1, 2: 1, 35: 1, 14: 10}
Did not match all atoms present	63021-33-0	CCC1=CC=CC2=C1C3=C(C=C2)N=C4C(=C3)C=CC5=CC=CC=C54	{1: 1, 2: 1, 35: 1, 14: 12}
Did not match all atoms present	63021-35-2	CCC1=CC=CC2=C1C3=C(C=C2)N=C4C=CC5=CC=CC=C5C4=C3	{1: 1, 2: 1, 35: 1, 14: 12}
Did not match all atoms present	63021-45-4	C1CN1C(=O)C2=CC3=CC=CC=C3C=C2	{24: 1, 33: 1, 11: 2, 14: 7}
Did not match all atoms present	63021-46-5	C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4C(=C32)/C=C\C5=CC(=CC=C5)[N+](=O)[O-]	{38: 1, 35: 1, 14: 14, 6: 2}
Did not match all atoms present	63021-47-6	C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4C(=C32)/C=C\C5=CC=CC=C5[N+](=O)[O-]	{38: 1, 35: 1, 14: 14, 6: 2}
Did not match all atoms present	63021-48-7	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)/C=C\C5=CC(=CC=C5)[N+](=O)[O-]	{38: 1, 35: 1, 14: 14, 6: 2}
Did not match all atoms present	63021-49-8	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)/C=C\C5=CC=CC=C5[N+](=O)[O-]	{38: 1, 35: 1, 14: 14, 6: 2}
Did not match all atoms present	63021-50-1	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)/C=C\C5=CC=C(C=C5)[N+](=O)[O-]	{38: 1, 35: 1, 14: 14, 6: 2}
Did not match all atoms present	63021-62-5	CC(=O)N([O-])C1=CC=C(C=C1)/C=C/C2=CC=CC=C2.CC(=O)N([O-])C1=CC=C(C=C1)/C=C/C2=CC=CC=C2.[Cu+2]	{1: 2, 6: 4, 33: 2, 14: 18, 24: 2, 29: 2}
Did not match all atoms present	63021-67-0	C1CC2=CC=CC=C2C3C1CC4C(C3)C=CC5=CC=CC=C45	{11: 4, 12: 4, 14: 10}
Did not match all atoms present	63021-88-5	CCCCC1=C(C(=C(C(=C1)C2=CC=CC=C2)S(=O)(=O)O[O-])S(=O)(=O)[O-])CCCC.[Na+].[Na+]	{1: 2, 2: 6, 22: 1, 14: 6, 29: 6}
Did not match all atoms present	63022-08-2	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.OP(=O)(O)O.O[W](=O)(=O)[O-]	{1: 5, 2: 3, 14: 8, 20: 4, 23: 1, 28: 1, 29: 4, 31: 2}
Did not match all atoms present	63024-77-1	C1=CC(=CC(=C1)CCl)C(=O)Cl	{24: 1, 17: 2, 2: 1, 14: 4}
Did not match all atoms present	63026-01-7	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Eu+3]	{}
Did not match all atoms present	6303-21-5	O=PO	{20: 1, 29: 1}
Did not match all atoms present	6303-88-4	CN1C2=C(CCCC2)C3=CC=CC=C31	{1: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	63038-83-5	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@@H]5[C@@H](O5)[C@H]([C@@H]4O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	63039-89-4	CCC1=C2C=CC3=CC=CC=C3C2=NC4=C1C=C(C=C4)C	{1: 2, 2: 1, 35: 1, 14: 9}
Did not match all atoms present	63039-90-7	CCC1CN(CCC1(C2=CC=CC=C2)OC(=O)CC)C.Cl	{1: 3, 2: 2, 33: 1, 11: 3, 12: 1, 13: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	63039-95-2	CC(C)CCC(CCN1CCCCC1)(C2=CC=CC=C2)O.Cl	{1: 2, 2: 4, 3: 1, 4: 1, 33: 1, 11: 5, 14: 5, 17: 1, 20: 1}
Did not match all atoms present	6304-07-0	CC[NH+](CC)CC(=O)NC1=CC=CC=C1C.[Cl-]	{1: 3, 2: 3, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	6304-18-3	CC(C)C1=CN=CC=C1	{1: 2, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	6304-31-0	CCCCC1=NC=CC(=C1)C	{1: 2, 2: 3, 35: 1, 14: 3}
Did not match all atoms present	6304-33-2	C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C#N	{37: 1, 14: 15, 7: 2}
Did not match all atoms present	6304-89-8	CC(=O)OC1=CC=CC(=C1)C(=O)O	{1: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	63040-01-7	CC1=CC2=C(C=C1)C3=C(C=C2)N=C4C(=CC=CC4=C3C)C	{1: 3, 35: 1, 14: 8}
Did not match all atoms present	63040-02-8	CC1=C(C=C2C(=C1)C(=C3C(=N2)C=CC4=CC=CC=C43)C)C	{1: 3, 35: 1, 14: 8}
Did not match all atoms present	63040-05-1	CC1=CC=CC2=C(C3=C(C4=CC=CC=C4C(=C3)C)N=C12)C	{1: 3, 35: 1, 14: 8}
Did not match all atoms present	63040-09-5	CC1=C2CCC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 11: 2, 38: 3, 14: 12}
Did not match all atoms present	63040-20-0	CC(=O)N(C1=CC=NC2=CC=CC=C21)O	{1: 1, 35: 1, 33: 1, 14: 6, 20: 1, 24: 1}
Did not match all atoms present	63040-21-1	C1=CC=C2C(=C1)C3=C4C=CC=CC4=NC5=NC6=CC=CC=C6C(=N2)N35.[N+](=O)(O)[O-]	{33: 1, 35: 3, 20: 1, 14: 12}
Did not match all atoms present	63040-24-4	COC1=CC=C(C=C1)C2=CC(=C(C=C2)N)O	{1: 1, 22: 1, 30: 1, 21: 1, 14: 7}
Did not match all atoms present	63040-25-5	COC1=CC=C(C=C1)C2=CC(=C(C=C2)[NH3+])O.[Cl-]	{1: 1, 22: 1, 21: 1, 14: 7, 17: 1}
Did not match all atoms present	63040-27-7	CN(C)C1=CC=C(C=C1)C=CC2=CC(=CC=C2)Cl	{1: 2, 33: 1, 14: 8, 6: 2, 17: 1}
Did not match all atoms present	63040-30-2	CC1=C(C=CC(=C1)C2=CC=CC=C2)NC(=O)C	{24: 1, 1: 2, 14: 8, 31: 1}
Did not match all atoms present	63040-32-4	CC1=CC=CC(=C1)C=CC2=CC=C(C=C2)N(C)C	{1: 3, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	63040-49-3	COC1=C(C2=C(C=C3C=CC4=CC=CC=C4C3=C2)C5=CC=CC=C51)OC	{1: 2, 22: 2, 14: 12}
Did not match all atoms present	63040-53-9	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C(C6=CC=CC=C6C(=C54)C=C3)C=O	{26: 1, 14: 13}
Did not match all atoms present	63040-54-0	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=C(C6=CC=CC=C56)C=O)C=C3	{26: 1, 14: 13}
Did not match all atoms present	63040-55-1	C1=CC2=C3C(=C1)C=C4C=CC5=C6C4=C3C(=C(C6=CC=C5)C=O)C=C2	{26: 1, 14: 11}
Did not match all atoms present	63040-56-2	CC1=C2C=CC3=C(C4=CC=CC=C4C5=C3C2=C(C=C5)C6=CC=CC=C16)C=O	{1: 1, 26: 1, 14: 12}
Did not match all atoms present	63040-57-3	CC1=C2C=CC3=C4C2=C(C=CC4=C(C5=CC=CC=C35)C=O)C6=CC=CC=C16	{1: 1, 26: 1, 14: 12}
Did not match all atoms present	63040-58-4	CC1=C2C=CC3=C4C2=C5C(=C(C4=CC=C3)C=O)C=CC6=C5C1=CC=C6	{1: 1, 26: 1, 14: 10}
Did not match all atoms present	63040-63-1	CN(C)C1=CC=C(C=C1)N=NC2=CN=CC3=CC=CC=C32	{1: 2, 34: 2, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	63040-64-2	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC3=C2C=CN=C3	{1: 2, 34: 2, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	63040-65-3	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC3=C2C=NC=C3	{1: 2, 34: 2, 35: 1, 14: 10, 33: 1}
Did not match all atoms present	63040-98-2	CC1=CC=C(C=C1)S(=O)(=O)N(CC2CO2)CC3CO3	{1: 1, 2: 2, 33: 1, 11: 2, 12: 2, 14: 4, 23: 2, 29: 2}
Did not match all atoms present	63041-00-9	C1=CC=C2C(=C1)C3=NC4=C(C=C(C=C4)Br)C5=NC6=CC=CC=C6C(=N2)N35	{33: 1, 18: 1, 35: 3, 14: 11}
Did not match all atoms present	63041-14-5	CC1=CC=CC2=C1N=C3C4=CC=CC=C4N=C5N3C2=NC6=CC=CC=C65	{1: 1, 35: 3, 14: 11, 33: 1}
Did not match all atoms present	63041-15-6	CC1=C2C(=CC=C1)N=C3C4=CC=CC=C4N=C5N3C2=NC6=CC=CC=C65	{1: 1, 35: 3, 14: 11, 33: 1}
Did not match all atoms present	63041-19-0	C1=CN=CC=C1C(=O)NN=C(CCC(=O)O)CCC(=O)O	{2: 4, 35: 1, 7: 1, 34: 1, 14: 4, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	63041-23-6	CC1=CC2=C(C=C1)N=C3C4=C(C=CC(=C4)C)N=C5N3C2=NC6=C5C=C(C=C6)C	{1: 3, 35: 3, 14: 9, 33: 1}
Did not match all atoms present	63041-30-5	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=CC=CC=C5C4=C3N	{30: 1, 14: 13}
Did not match all atoms present	63041-43-0	C1=CC=C2C(=C1)C=CC3=C2C4C(C(C3C5=C4C=CC6=CC=CC=C65)C(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 12: 4, 14: 12}
Did not match all atoms present	63041-44-1	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=CC=CC=C5C4=C3NC(=O)NCC(=O)O	{24: 1, 2: 1, 27: 1, 14: 13, 31: 2}
Did not match all atoms present	63041-48-5	CCCCC1=C2C=CC3=CC=CC=C3C2=C(C4=C1C5=CC=CC=C5C=C4)CCCC	{1: 2, 2: 6, 14: 12}
Did not match all atoms present	63041-49-6	C1CC2=CC=CC3=C2C1C4=C(C3)C5=CC=CC=C5C=C4	{11: 3, 12: 1, 14: 9}
Did not match all atoms present	63041-50-9	CC1=C2CCC3C2=C(CC4=C3C=CC5=CC=CC=C45)C=C1	{1: 1, 11: 3, 12: 1, 14: 8}
Did not match all atoms present	63041-56-5	CCCC1(C2=C(C3=CC=CC=C3C=C2)C(C4=C1C5=CC=CC=C5C=C4)(CCC)O)O	{1: 2, 2: 4, 20: 2, 13: 2, 14: 12}
Did not match all atoms present	63041-61-2	CC1CC2=C(C=CC3=CC4=C(C1=C23)C=CC5=CC=CC=C54)C	{1: 2, 11: 1, 12: 1, 14: 9}
Did not match all atoms present	63041-62-3	CC1CC2=C3C1=C(C=CC3=CC4=C2C=CC5=CC=CC=C54)C	{1: 2, 11: 1, 12: 1, 14: 9}
Did not match all atoms present	63041-70-3	CC(C)C1=C2CCC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1	{11: 2, 1: 2, 3: 1, 14: 9}
Did not match all atoms present	63041-72-5	COC1=C2C(=CC3=C1C=CC4=CC=CC=C43)C=CC5=CC=CC=C52	{1: 1, 22: 1, 14: 13}
Did not match all atoms present	63041-77-0	CC1=CC=CC2=C1C=C3C=CC4=C5C3=C2C=CC5=CC=C4	{1: 1, 14: 11}
Did not match all atoms present	63041-78-1	CC1=C2C=C3C(=C4C2=C(CC4)C=C1)C=CC5=CC=CC=C53	{1: 1, 11: 2, 14: 9}
Did not match all atoms present	63041-80-5	CC1=C2C(C(C3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1)O)O.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 12: 2, 14: 11, 20: 2, 21: 1}
Did not match all atoms present	63041-83-8	CC1=CC2=C(C=C1)C=CC3=CC4=C(C=CC5=CC=CC=C54)C=C32	{1: 1, 14: 13}
Did not match all atoms present	63041-84-9	CC1=CC2=C(C=C1)C3=CC4=C(C=C3C=C2)C5=CC=CC=C5C=C4	{1: 1, 14: 13}
Did not match all atoms present	63041-85-0	CC1=CC2=CC=CC=C2C3=C1C=C4C(=C3)C=CC5=CC=CC=C54	{1: 1, 14: 13}
Did not match all atoms present	63041-88-3	CC1=C2C=CC3=C4C2=C(CC4=CC=C3)C5=CC=CC=C15	{1: 1, 11: 1, 14: 9}
Did not match all atoms present	63041-90-7	C1=CC=C2C(=C1)C3=C4C(=C2[N+](=O)[O-])C=CC5=CC=CC(=C54)C=C3	{38: 1, 14: 11}
Did not match all atoms present	63041-92-9	C1CCC2=C(C1)C=C3CCC4=C3C2=CC5=CC=CC=C45	{11: 6, 14: 6}
Did not match all atoms present	63041-95-2	CC1=CC2=C(C=C1)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C6=CC=CC=C63	{1: 1, 14: 13}
Did not match all atoms present	63042-08-0	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)OC(=O)OC)C	{1: 3, 34: 2, 14: 7}
Did not match all atoms present	63042-11-5	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)NC(=O)C(=O)O)C	{1: 2, 34: 2, 14: 7, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	63042-19-3	CCCC(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4OC(=O)C5=CC=CC=C5)C	{1: 2, 2: 2, 11: 6, 12: 4, 13: 1, 14: 8, 28: 2}
Did not match all atoms present	63042-22-8	CCCCCCCC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)O)C	{1: 2, 2: 6, 11: 6, 12: 4, 13: 1, 14: 3, 21: 1, 28: 1}
Did not match all atoms present	63042-50-2	CC1=C2C(=C(C3=C1C=CC4=CC=CC=C43)C)C5=CC=CC=C5S2	{1: 2, 14: 10, 41: 1}
Did not match all atoms present	63044-60-0	CC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]	{1: 3, 35: 1, 6: 1, 33: 2, 14: 8, 15: 2, 25: 1, 29: 3}
Did not match all atoms present	6305-04-0	C1=CC(=CC=C1C(=O)CCl)O	{24: 1, 17: 1, 2: 1, 21: 1, 14: 4}
Did not match all atoms present	6305-18-6	COC1=CC=C(C=C1)C(=O)C2=CC=CC=N2	{24: 1, 1: 1, 35: 1, 22: 1, 14: 8}
Did not match all atoms present	6305-95-9	CC(=O)CC1=CC=CC=C1Cl	{24: 1, 1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	6305-99-3	CC1=C(C(=NC(=S)N1)N)N	{32: 1, 1: 1, 35: 1, 30: 2}
Did not match all atoms present	63052-08-4	C1=CC=C(C(=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2)Cl	{32: 1, 35: 1, 37: 1, 6: 1, 7: 1, 14: 8, 17: 1}
Did not match all atoms present	63052-10-8	C1=CC=C2C(=C1)NC(=C(/C=C/3\C=CC=CC3=O)C#N)N2	{32: 2, 37: 1, 6: 1, 7: 1, 14: 8, 15: 2, 25: 1}
Did not match all atoms present	63059-32-5	C1=CC=C2C=C(C(=CC2=C1)N)Br.Cl	{17: 1, 18: 1, 30: 1, 14: 6}
Did not match all atoms present	63059-34-7	CC(C)(C)NS(=O)(=O)C1=C(C2=C(C=C1)C(=CC=C2)NS(=O)(=O)C)O	{1: 4, 4: 1, 14: 5, 21: 1, 29: 4, 31: 2}
Did not match all atoms present	63059-38-1	C(C(=O)[O-])OC(=S)SCC(=O)N.[Na+]	{2: 2, 7: 1, 40: 1, 22: 1, 24: 2, 30: 1}
Did not match all atoms present	63059-39-2	CCOC(=O)C1=C2C3=CC=CC=C3C(=O)C4=C(C=CC(=C42)N(C1=O)C)NC5=CC=C(C=C5)C	{1: 3, 2: 1, 33: 1, 14: 10, 25: 2, 28: 1, 31: 1}
Did not match all atoms present	63059-40-5	CC1=C(C(=O)N2C(=N1)N=C(N2)SC)C(=O)O	{32: 1, 1: 2, 35: 2, 33: 1, 40: 1, 25: 1, 27: 1}
Did not match all atoms present	63059-42-7	CCC(=CC1=NC2=C(S1)C=CC(=C2)Cl)C=C3N(C4=C(S3)C=CC(=C4)Cl)CC	{1: 2, 2: 2, 35: 1, 33: 1, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 17: 2}
Did not match all atoms present	63059-43-8	CCN1C2=C(C=C(C=C2)Cl)N(C1=CC=CC3=[N+](C4=CC=CC=C4O3)CC)CCN5CCOCC5.[I-]	{1: 2, 2: 4, 6: 3, 33: 4, 11: 4, 14: 7, 15: 1, 17: 1, 19: 1, 23: 2}
Did not match all atoms present	63059-44-9	CCC(C(=O)NC1=CC=CC(=C1)C(=O)C(C(=O)NC2=CC=CC=C2OC)Cl)OC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC	{1: 8, 2: 3, 3: 2, 4: 2, 14: 11, 17: 1, 22: 2, 24: 3, 31: 2}
Did not match all atoms present	63059-47-2	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=CC=C(C=C4)N/N=C\5/C(=CC6=CC(=CC(=C6C5=O)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-])O)C(C)(C)CC.[Na+].[Na+]	{1: 7, 2: 6, 4: 2, 34: 1, 14: 15, 15: 2, 21: 1, 22: 2, 24: 2, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	63059-48-3	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)CNC(=O)C2=C(C3=CC=CC=C3C=C2)O	{1: 2, 2: 16, 3: 1, 14: 10, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	63059-49-4	CCC(C(=O)NC1=CC=C(C=C1)N2C(=O)CC(=N2)N3CCCC3)OC4=C(C=C(C=C4)C(C)(C)CC)C(C)(C)CC.Cl.Cl	{1: 7, 2: 3, 3: 1, 4: 2, 33: 2, 11: 5, 14: 7, 15: 1, 17: 2, 35: 1, 22: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	63059-51-8	CCC(C(=O)NC1=CC=C(C=C1)NC2=NN(C(=O)C2N=NC3=CC=C(C=C3)OC)C4=C(C=C(C=C4Cl)Cl)Cl)OC5=C(C=C(C=C5)C(C)(C)CC)C(C)(C)CC	{1: 8, 2: 3, 3: 1, 4: 2, 33: 1, 12: 1, 34: 2, 14: 13, 15: 1, 17: 3, 35: 1, 22: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	63059-54-1	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=CC(=C4)S(=O)(=O)/N=C/5\C=CC(=O)C6=C5C(=CC=C6)NNC7=C(C=C(C=C7)[N+](=O)[O-])S(=O)(=O)C)O)C(C)(C)CC	{1: 7, 2: 6, 4: 2, 38: 1, 34: 1, 14: 20, 15: 1, 21: 1, 22: 1, 24: 1, 25: 1, 29: 6, 31: 4}
Did not match all atoms present	63059-55-2	CCCCC(C(=O)Cl)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 5, 3: 1, 4: 2, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	63059-56-3	CCNC1=CC(=C(C=C1[N+](=O)[O-])Cl)Cl	{1: 1, 2: 1, 38: 1, 14: 2, 17: 2, 31: 1}
Did not match all atoms present	63059-58-5	CCN(CC)C1=CC(=C(C=C1)N=C2C=C(C(=O)C3=CC=CC=C32)C(=O)NCCC4=CC=CC=C4NC(=O)C)C	{1: 4, 2: 4, 33: 1, 34: 1, 14: 12, 15: 2, 24: 2, 25: 1, 31: 2}
Did not match all atoms present	63059-64-3	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)C	{1: 3, 33: 1, 29: 3, 14: 12, 23: 1}
Did not match all atoms present	63059-65-4	CC1=NN(C(=O)C1=C2CC(CC(=C2)C=CC=C3N(C4=CC=CC=C4O3)CCCS(=O)(=O)O)(C)C)C5=CC=C(C=C5)S(=O)(=O)O	{1: 3, 2: 3, 35: 1, 6: 3, 33: 2, 11: 2, 13: 1, 14: 9, 15: 5, 20: 2, 23: 1, 25: 1, 29: 4}
Did not match all atoms present	63059-68-7	COC1=C2C=CC3=CC4=CC=CC=C4C5=C3C2=C(C=C5)C=C1	{1: 1, 22: 1, 14: 11}
Did not match all atoms present	6306-07-6	C1C(C2=CC=CC3=C2C1=CC=C3)O	{20: 1, 11: 1, 12: 1, 14: 6}
Did not match all atoms present	6306-30-5	CCCC(C1=CC=CC=C1)C(=O)C	{24: 1, 1: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	6306-54-3	CC(C)[C@@H](C(=O)O)N1C(=O)C2=CC=CC=C2C1=O	{1: 2, 3: 2, 33: 1, 14: 4, 25: 2, 27: 1}
Did not match all atoms present	6306-60-1	C1=CC(=C(C=C1Cl)Cl)CC#N	{17: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	6307-17-1	C1=CC=C(C=C1)/C=C/C2=C(N=CN2)[N+](=O)[O-]	{32: 1, 38: 1, 35: 1, 14: 6, 6: 2}
Did not match all atoms present	6307-35-3	CC1=C(C(=O)N=C(N1)N)Br	{32: 1, 1: 1, 35: 1, 18: 1, 25: 1, 30: 1}
Did not match all atoms present	6307-82-0	COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 1, 28: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	63074-08-8	COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4CCCO4)N)OC.Cl	{1: 2, 35: 2, 33: 2, 11: 7, 12: 1, 14: 2, 17: 1, 22: 2, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	63075-06-9	CCCCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	63076-62-0	CCCCCOC1=C(C=C(C=C1)Br)Br	{1: 1, 2: 4, 22: 1, 18: 2, 14: 3}
Did not match all atoms present	63077-00-9	C1CC2=C(C3=CC=CC=C31)NC4=C2C5=CC=CC=C5C=C4	{32: 1, 11: 2, 14: 10}
Did not match all atoms present	63077-09-8	C1=CC=C2C(=C1)C=CC(=C2OP(=O)([O-])OC3=C(C=CC4=CC=CC=C43)N)N.[Na+]	{30: 2, 22: 2, 14: 12, 29: 2}
Did not match all atoms present	63079-67-4	C1COCCN1.OP(=O)(O)O	{32: 1, 11: 4, 20: 3, 29: 1, 23: 1}
Did not match all atoms present	6308-38-9	CC1=CC(=S)NC(=S)N1	{32: 2, 1: 1, 14: 1}
Did not match all atoms present	6308-98-1	C1=CC=C(C=C1)CCNCCC2=CC=CC=C2	{2: 4, 14: 10, 31: 1}
Did not match all atoms present	63081-22-1	CC1=C(C(=CC=C1)S(=O)(=O)O)C.C(CO)N	{1: 2, 2: 2, 14: 3, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	63084-13-9	CC1C(C2=C(C1(C)C)C=C(C(=C2)C)C#N)(C)C	{1: 6, 12: 1, 13: 2, 14: 2, 37: 1}
Did not match all atoms present	63089-50-9	CC1=CC(=C(C=C1)C#N)C#N	{1: 1, 37: 2, 14: 3}
Did not match all atoms present	63089-83-8	CCCCCCCCCCCCC(C(=O)NC1=CC(=C(C=C1)Cl)NC2=NN(C(=O)C2N=NC3=CC=CC4=CC=CC=C43)C5=C(C=C(C=C5Cl)Cl)Cl)OC6=CC(=C(C=C6)O)C(C)(C)C	{1: 4, 2: 11, 3: 1, 4: 1, 33: 1, 12: 1, 34: 2, 14: 15, 15: 1, 17: 4, 35: 1, 21: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	631-07-2	CCC1(C(=O)NC(=O)N1)C2=CC=CC=C2	{32: 2, 1: 1, 2: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	631-27-6	C1CCN(C1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl	{33: 1, 11: 4, 14: 4, 17: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	631-36-7	CC[Si](CC)(CC)CC	{1: 4, 2: 4}
Did not match all atoms present	631-40-3	CCC[N+](CCC)(CCC)CCC.[I-]	{1: 4, 2: 8, 19: 1}
Did not match all atoms present	631-41-4	C(CO)[N+](CCO)(CCO)CCO.[OH-]	{2: 8, 20: 4}
Did not match all atoms present	631-60-7	CC(=O)[O-].[Hg+]	{24: 1, 1: 1}
Did not match all atoms present	631-61-8	CC(=O)[O-].[NH4+]	{24: 1, 1: 1}
Did not match all atoms present	631-67-4	CC(=S)N(C)C	{1: 3, 33: 1, 7: 1}
Did not match all atoms present	6310-09-4	CC(=O)C1=CC=C(S1)Cl	{24: 1, 1: 1, 41: 1, 14: 2, 17: 1}
Did not match all atoms present	6310-21-0	CC(C)(C)C1=CC=CC=C1N	{1: 3, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	6310-99-2	C1=C(C=C(C(=C1[N+](=O)[O-])Br)[N+](=O)[O-])Br	{18: 2, 38: 2, 14: 2}
Did not match all atoms present	63104-32-5	CC1=CC=CC2=CC3=C4C(=C12)C=CC5=CC=CC(=C54)C=C3	{1: 1, 14: 11}
Did not match all atoms present	63105-52-2	COC(=O)C1=CC(=C(C=C1[N+](=O)[O-])Cl)Cl	{1: 1, 28: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	63105-53-3	COC(=O)C1=CC(=C(C(=C1)Cl)Cl)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	63105-54-4	COC(=O)C1=CC(=CC(=C1Cl)Cl)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	63105-60-2	COC(=O)C1=C(C=CC(=C1Cl)Cl)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	63105-61-3	COC(=O)C1=CC(=C(C=C1Cl)[N+](=O)[O-])Cl	{1: 1, 28: 1, 38: 1, 14: 2, 17: 2}
Did not match all atoms present	6311-27-9	C1CN1C2=NC(=O)C3=C(N2)N(C=N3)CC4=CC=CC=C4	{32: 1, 33: 2, 2: 1, 35: 2, 11: 2, 14: 6, 25: 1}
Did not match all atoms present	6311-60-0	C1=C(C=C(C=C1Br)Br)[N+](=O)[O-]	{18: 2, 38: 1, 14: 3}
Did not match all atoms present	6312-66-9	C1=NC2=C(N1)C(=NC=N2)N(CCO)CCO	{32: 1, 33: 1, 2: 4, 35: 3, 14: 2, 20: 2}
Did not match all atoms present	63122-43-0	C1=CNC(=C1)C2=CC=CO2	{32: 1, 14: 6, 23: 1}
Did not match all atoms present	63123-17-1	CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)C(C)(C)CC	{1: 6, 2: 2, 4: 2, 38: 1, 14: 6, 22: 1, 27: 1}
Did not match all atoms present	63123-20-6	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)C)OCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 1, 6: 1, 7: 1, 14: 12, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	63123-21-7	CCOC(=O)C1=C(N=C2N=C(NN2C1=O)SC)C	{32: 1, 1: 3, 2: 1, 35: 2, 33: 1, 40: 1, 25: 1, 28: 1}
Did not match all atoms present	63123-22-8	CCN1C2=CC=CC=C2SC1=C3C(=O)N(C(=S)S3)CCS(=O)(=O)[O-].[K+]	{1: 1, 2: 3, 33: 2, 41: 2, 14: 4, 15: 3, 25: 1, 29: 3}
Did not match all atoms present	63123-23-9	CCCCCCCN1C(=O)C(=CC=C2N(C3=CC=CC=C3O2)CC)OC1=S	{1: 2, 2: 7, 6: 2, 33: 2, 14: 4, 15: 3, 23: 2, 25: 1}
Did not match all atoms present	63123-24-0	CCN1C(=S)SC2C1(C3=CC=CC=C3CC2)O	{1: 1, 2: 1, 33: 1, 41: 1, 11: 2, 12: 1, 13: 1, 14: 4, 15: 1, 20: 1}
Did not match all atoms present	63123-25-1	CCN1C2=C(CCC3=CC=CC=C32)SC1=S	{1: 1, 2: 1, 33: 1, 41: 1, 11: 2, 14: 4}
Did not match all atoms present	63123-26-2	CCN1C2=CC=CC=C2OC1=CC(=C3C(=O)N(C(=S)S3)CC)C	{1: 3, 2: 2, 33: 2, 6: 1, 7: 1, 41: 1, 14: 4, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	63123-27-3	CCN1C2=CC=CC=C2OC1=CC3=[N+](C4=CC=CC=C4C=C3)CC.[I-]	{1: 2, 2: 2, 6: 1, 33: 2, 14: 10, 15: 1, 19: 1, 23: 1}
Did not match all atoms present	63123-29-5	CCN1C(=CC(=O)C)SC2=C1C3=CC=CC=C3C=C2	{1: 2, 2: 1, 6: 1, 33: 1, 41: 1, 14: 6, 15: 1, 24: 1}
Did not match all atoms present	63123-35-3	C1=C/C(=C\2/C=C(C3=C(N2)C=CC4=C3C=CC(=C4)S(=O)(=O)[O-])C(=O)[O-])/C(=O)C=C1.[Na+].[Na+]	{32: 1, 14: 10, 15: 3, 24: 1, 25: 1, 29: 3}
Did not match all atoms present	63123-36-4	CC(=CC1=[N+](C2=C(S1)C=CC(=C2)OC)CCCO)C=C3N(C4=C(S3)C=CC(=C4)OC)CCCO.[I-]	{1: 3, 2: 6, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 19: 1, 20: 2, 22: 2}
Did not match all atoms present	63123-38-6	CC1=NN(C(=O)C1=C(C)C)C2=CC=C(C=C2)S(=O)(=O)O.C1CCNCC1	{32: 1, 1: 3, 35: 1, 33: 1, 7: 1, 11: 5, 14: 4, 15: 2, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	63123-39-7	CC(=O)SCC(=O)NC1=NC2=CC=CC=C2S1	{1: 1, 2: 1, 35: 1, 40: 1, 41: 1, 14: 4, 24: 2, 31: 1}
Did not match all atoms present	63123-42-2	[B-](F)(F)(F)F.CO[N+]1=CC=C(C=C1)C2=CC=CC=C2	{16: 4, 1: 1, 22: 1, 14: 9, 33: 1}
Did not match all atoms present	63123-44-4	CCCCCCCCCCCCC(C(=O)OC)OC1=CC=C(C=C1)N	{1: 2, 2: 11, 3: 1, 14: 4, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	63124-33-4	CN(C(=O)CSP(=S)(OC)OC)N=O	{1: 3, 2: 1, 33: 1, 40: 1, 34: 1, 22: 2, 24: 1, 29: 1}
Did not match all atoms present	63126-87-4	CC1=CC=C(C=C1)CC[Si](C)(Cl)Cl	{1: 2, 2: 2, 14: 4, 17: 2}
Did not match all atoms present	6313-17-3	C1=C(C=C(C=C1[N+](=O)[O-])I)C(=O)O	{27: 1, 19: 1, 38: 1, 14: 3}
Did not match all atoms present	6313-37-7	COC1=CC(=C(C=C1N)OC)[N+](=O)[O-]	{1: 2, 30: 1, 38: 1, 22: 2, 14: 2}
Did not match all atoms present	6313-49-1	CCN(CC)CC(CNCC1=CC=CC=C1)O	{1: 2, 2: 5, 3: 1, 33: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	6313-88-8	CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 11, 14: 4}
Did not match all atoms present	63131-29-3	COC(=O)CC(=O)C1=CC=C(C=C1)F	{1: 1, 2: 1, 14: 4, 16: 1, 24: 1, 28: 1}
Did not match all atoms present	63133-73-3	CC(=O)NC1=CC(=C(C=C1)OC)NCC(CO)O	{1: 2, 2: 2, 3: 1, 14: 3, 20: 2, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	63133-74-4	CCN(CC#N)C1=CC=CC(=C1)C	{1: 2, 2: 2, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	63133-76-6	C1CC(=O)N(C1=O)CCN(CCC#N)C2=CC=CC=C2	{33: 2, 2: 4, 37: 1, 11: 2, 14: 5, 25: 2}
Did not match all atoms present	63133-77-7	CCN(CCN1C(=O)CCC1=O)C2=CC(=C(C=C2)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl)C	{1: 2, 2: 3, 38: 1, 33: 2, 11: 2, 34: 2, 14: 5, 17: 2, 25: 2}
Did not match all atoms present	63133-78-8	CC(=O)NC1=CC=CC2=C1C=CC(=C2O)C(=O)O	{1: 1, 14: 5, 21: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	63133-80-2	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC(=C(C=C2)Cl)NC(=O)CC(=O)C(C)(C)C	{1: 5, 2: 16, 3: 1, 4: 1, 14: 7, 17: 1, 22: 1, 24: 3, 31: 2}
Did not match all atoms present	63133-82-4	CC1=CC(=C(C(=C1)Cl)N)C	{1: 2, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	63133-83-5	COC1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)[N+](=O)[O-])O	{1: 1, 38: 1, 14: 8, 21: 2, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	63133-86-8	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[K+]	{1: 1, 14: 9, 25: 2, 29: 5, 30: 1, 31: 1}
Did not match all atoms present	63133-89-1	CCOC(=O)CC(C1=CC=C(C=C1)C(CC(=O)OCC)O)O	{1: 2, 2: 4, 3: 2, 14: 4, 20: 2, 28: 2}
Did not match all atoms present	63133-90-4	CC(CCO)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 2, 3: 1, 20: 1, 29: 3}
Did not match all atoms present	63133-91-5	CCCCCCCC(=O)OC1=CC=C(C=C1)O	{1: 1, 2: 6, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	63133-93-7	C1=CC(=CC=C1OCCCC(=O)[O-])S(=O)(=O)O.[Na+]	{2: 3, 14: 4, 20: 1, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	63133-94-8	CCN(CCN1C(=O)C2=CC=CC=C2C1=O)C3=CC(=C(C=C3)N=NC4=C(C=C(C=C4)[N+](=O)[O-])Cl)C	{1: 2, 2: 3, 38: 1, 33: 2, 34: 2, 14: 10, 17: 1, 25: 2}
Did not match all atoms present	63133-95-9	CN1C(=NC=[N+]1C)N=NC2=C(N=C3N2C=CS3)C4=CC=CC=C4.[Cl-]	{1: 2, 34: 2, 35: 2, 33: 3, 41: 1, 14: 8, 17: 1}
Did not match all atoms present	63133-96-0	CCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(CC1(C)C)C	{1: 4, 2: 1, 38: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 3}
Did not match all atoms present	63133-97-1	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]	{1: 2, 2: 15, 3: 1, 38: 1, 14: 7, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	63133-98-2	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC(=C(C=C2)Cl)N	{1: 2, 2: 15, 3: 1, 14: 7, 17: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	63133-99-3	CCN(CC1=CC=CC=C1)C2=CC=CC(=C2)NC(=O)CN=NC3=C(C=C(C=C3)S(=O)(=O)C)Cl	{1: 2, 2: 3, 33: 1, 34: 2, 14: 12, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	63134-02-1	CCN(CCNC(=O)C)C1=CC(=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)C)C	{1: 4, 2: 3, 35: 1, 33: 1, 41: 1, 34: 2, 14: 6, 24: 1, 31: 1}
Did not match all atoms present	63134-04-3	CCNC1=C(C=CC(=C1)NC(=O)C)C	{24: 1, 1: 3, 2: 1, 14: 3, 31: 2}
Did not match all atoms present	63134-08-7	C1=CC(=CC=C1OCCCC(=O)OCCO)S(=O)(=O)[O-].[Na+]	{2: 5, 14: 4, 20: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	63134-09-8	CCC(=O)NC1=CC2=C(C=C1)C(CC(N2CC)(C)C)C	{1: 5, 2: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	63134-11-2	CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 2: 15, 38: 1, 14: 3, 17: 1, 29: 2, 31: 1}
Did not match all atoms present	63134-14-5	CCNC1=C(C=CC(=C1)N)C	{1: 2, 2: 1, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	63134-16-7	CCNC1=CC(=C(C=C1N)Cl)Cl	{1: 1, 2: 1, 14: 2, 17: 2, 30: 1, 31: 1}
Did not match all atoms present	63134-19-0	CCCCCCCCCCCCC(C(=O)OC)OC1=CC=C(C=C1)NC(=O)C	{1: 3, 2: 11, 3: 1, 14: 4, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	63134-20-3	CCN(CCOC)C1=CC(=C(C=C1)N=O)C	{1: 3, 2: 3, 33: 1, 34: 1, 14: 3, 22: 1, 29: 1}
Did not match all atoms present	63134-21-4	C1=CC2=C(C=CC=C2O)C(=C1)N.Cl	{17: 1, 30: 1, 21: 1, 14: 6}
Did not match all atoms present	63134-22-5	CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)Cl)C(C)(C)CC	{1: 6, 2: 2, 4: 2, 38: 1, 14: 6, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	63134-23-6	CCN(CC)C1=CC=CC(=C1)CC#N	{1: 2, 2: 3, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	63134-25-8	C1C(=NN(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]	{33: 1, 35: 1, 38: 1, 11: 1, 14: 6, 15: 1, 17: 3, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	63134-26-9	C1=CC(=CC=C1[N+](=O)[O-])OCCOCCOCCO	{2: 6, 38: 1, 20: 1, 22: 3, 14: 4}
Did not match all atoms present	63134-27-0	CCCCCCCCC1=C(C=C(C(=C1)O)C(=O)CCCCCCC)O	{24: 1, 1: 2, 2: 13, 21: 2, 14: 2}
Did not match all atoms present	63134-28-1	COC1=CC=CC=C1NC(=O)CC(=O)C2=CC(=CC=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 8, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	63134-29-2	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(C)(C)CC	{1: 6, 2: 5, 4: 2, 38: 1, 14: 6, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	63134-30-5	CC1=CC(=C(C(=C1)Cl)NN)C.Cl	{1: 2, 31: 1, 30: 1, 14: 2, 17: 2}
Did not match all atoms present	63134-31-6	CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)NNC(=O)C)C(C)(C)CC	{1: 7, 2: 2, 4: 2, 38: 1, 14: 10, 22: 1, 24: 2, 31: 3}
Did not match all atoms present	63134-32-7	CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)N)C(=O)NC3=CC=C(C=C3)NNC(=O)C)C(C)(C)CC	{1: 7, 2: 2, 4: 2, 14: 10, 22: 1, 24: 2, 30: 1, 31: 3}
Did not match all atoms present	63134-33-8	C1=CC=C(C=C1)COC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O	{2: 1, 22: 1, 21: 1, 14: 13, 29: 2}
Did not match all atoms present	63134-34-9	CC(C)(C)C(=O)CC(=O)NC1=C(C=C(C=C1)Cl)Cl	{1: 3, 2: 1, 4: 1, 14: 3, 17: 2, 24: 2, 31: 1}
Did not match all atoms present	63139-21-9	B(C1=CC=C(C=C1)CC)(O)O	{1: 1, 2: 1, 20: 2, 14: 4}
Did not match all atoms present	6314-22-3	CCOC(=O)C1=C(NC(=C1C)C(=O)C)C	{24: 1, 1: 4, 2: 1, 28: 1, 32: 1}
Did not match all atoms present	6314-28-9	C1=CC=C2C(=C1)C=C(S2)C(=O)O	{41: 1, 27: 1, 14: 5}
Did not match all atoms present	6314-42-7	C1=CC=C2C(=C1)C=C(S2)C(=O)N	{24: 1, 41: 1, 30: 1, 14: 5}
Did not match all atoms present	63140-62-5	C1(=NN=C(S1)C(Br)(Br)Br)C(Br)(Br)Br	{41: 1, 18: 6, 35: 2, 4: 2}
Did not match all atoms present	63141-79-7	CC(=CC(C#C)C1=CC=C(C=C1)O)C	{1: 2, 3: 1, 6: 1, 7: 1, 9: 1, 10: 1, 14: 4, 21: 1}
Did not match all atoms present	63147-14-8	C1=CC2=C3C(=C1)C=CC3=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 21: 1, 14: 10}
Did not match all atoms present	63147-42-2	C1=CC(=CC=C1NN=C2C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)O)N=NC4=CC=C(C=C4)S(=O)(=O)O	{34: 3, 14: 12, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	63148-61-8	CC[Si](CC)(O)O	{1: 2, 2: 2, 20: 2}
Did not match all atoms present	63148-77-6	CC(C)(C)NS(=O)(=O)C1=CC(=NNC2=CC=C(C=C2)S(=O)(=O)O)C3=C(C1=O)C=CC=C3NS(=O)(=O)C	{1: 4, 34: 1, 4: 1, 14: 8, 15: 2, 20: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	63148-78-7	C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)NNC=O	{26: 1, 31: 4, 14: 9, 7: 1}
Did not match all atoms present	63148-79-8	CC1=C(SC(=N1)SC(=O)OCC2=CC=CC=C2)C(=O)C	{1: 2, 2: 1, 35: 1, 40: 1, 41: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	63148-80-1	CC1=CC(=C(C=C1Cl)NC(=O)CSC(=O)C)O	{1: 2, 2: 1, 40: 1, 14: 2, 17: 1, 21: 1, 24: 2, 31: 1}
Did not match all atoms present	63148-81-2	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC(=C(C=C3)OC)S(=O)(=O)[O-]	{1: 5, 33: 2, 7: 1, 14: 11, 15: 2, 22: 1, 29: 3}
Did not match all atoms present	63148-83-4	CC(CC[N+]1=C(SC2=CC3=CC=CC=C3C=C21)C=CC=CNC4=CC=CC=C4)S(=O)(=O)[O-]	{1: 1, 2: 2, 3: 1, 6: 4, 33: 1, 41: 1, 14: 11, 29: 3, 31: 1}
Did not match all atoms present	63148-84-5	CC(CC[N+]1=C(SC2=CC3=CC=CC=C3C=C21)C=CC=CN(C4=CC=CC=C4)C(=O)C)S(=O)(=O)[O-]	{1: 2, 2: 2, 3: 1, 6: 4, 33: 2, 41: 1, 14: 11, 24: 1, 29: 3}
Did not match all atoms present	63148-85-6	CC[N+]1=C(OC2=C1C=C(C=C2)S(=O)(=O)[O-])C=CC=CN(C3=CC=CC=C3)C(=O)C	{1: 2, 2: 1, 6: 4, 33: 2, 14: 8, 23: 1, 24: 1, 29: 3}
Did not match all atoms present	63148-86-7	CCN1C2=CC(=C(C=C2[N+](=C1C=CNC3=CC=CC=C3)CCC(C)S(=O)(=O)[O-])Cl)Cl	{1: 2, 2: 3, 3: 1, 6: 2, 33: 2, 14: 7, 17: 2, 29: 3, 31: 1}
Did not match all atoms present	63148-87-8	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)Cl)CCCS(=O)(=O)[O-])C=C3N(C4=C(O3)C=CC(=C4)Cl)CC	{1: 2, 2: 5, 33: 2, 6: 2, 7: 1, 14: 6, 15: 1, 17: 2, 23: 2, 29: 3}
Did not match all atoms present	63148-88-9	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCC(C)S(=O)(=O)O)C=C3N(C4=C(S3)C=CC(=C4)Cl)CCC(C)S(=O)(=O)[O-].CCN(CC)CC	{1: 6, 2: 8, 3: 2, 33: 3, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 17: 2, 20: 1, 29: 5}
Did not match all atoms present	63148-94-7	CCN\1C2=CC(=C(C=C2N(/C1=C/C=C/C3=[N+](C4=C(S3)C=CC5=CC=CC=C54)CCCS(=O)(=O)[O-])CCC(C)S(=O)(=O)O)Cl)Cl.CCN(CC)CC	{1: 5, 2: 9, 3: 1, 6: 3, 33: 4, 41: 1, 14: 8, 15: 1, 17: 2, 20: 1, 29: 5}
Did not match all atoms present	63148-95-8	CC1=[N+](C2=CC(=C(C=C2S1)OC)OC)CCCS(=O)(=O)[O-]	{1: 3, 2: 3, 33: 1, 41: 1, 14: 2, 22: 2, 29: 3}
Did not match all atoms present	63148-98-1	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCC(C)S(=O)(=O)[O-])OCC	{1: 3, 2: 4, 3: 1, 33: 1, 6: 1, 7: 1, 14: 8, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	63148-99-2	CC[N+]1=C(OC2=C1C=C(C=C2)S(=O)(=O)[O-])C	{1: 2, 2: 1, 33: 1, 14: 3, 23: 1, 29: 3}
Did not match all atoms present	63149-00-8	CC[N+]1=C(OC2=C1C=C(C=C2)S(=O)(=O)[O-])C=CC=CNC3=CC=CC=C3	{1: 1, 2: 1, 6: 4, 33: 1, 14: 8, 23: 1, 29: 3, 31: 1}
Did not match all atoms present	63149-03-1	CC1=[N+](C2=CC=CC=C2S1)CCC(C)S(=O)(=O)[O-]	{1: 2, 2: 2, 3: 1, 33: 1, 41: 1, 14: 4, 29: 3}
Did not match all atoms present	63149-04-2	CC1=[N+](C2=CC3=CC=CC=C3C=C2S1)CCC(C)S(=O)(=O)[O-]	{1: 2, 2: 2, 3: 1, 33: 1, 41: 1, 14: 6, 29: 3}
Did not match all atoms present	63149-05-3	CSC1=[N+](C2=CC=CC=C2S1)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 40: 1, 41: 1, 14: 4, 29: 3}
Did not match all atoms present	63149-06-4	C1=CC=C(C=C1)SC2=CC=[N+](C=C2)CCCCS(=O)(=O)[O-]	{40: 1, 33: 1, 2: 4, 29: 3, 14: 9}
Did not match all atoms present	63149-09-7	COC1=CC=CC=C1C2=NC3=C(S2)N=C(S3)C4=CC=CC=C4OC	{1: 2, 35: 2, 22: 2, 14: 8, 41: 2}
Did not match all atoms present	63149-10-0	CCOC(=O)C1=C2C3=CC=CC=C3C(=O)C4=C(C=CC(=C42)N(C1=O)C)NC5=C(C=C(C=C5)Cl)S(=O)(=O)O	{1: 2, 2: 1, 33: 1, 14: 9, 17: 1, 20: 1, 25: 2, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	63149-11-1	CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4C=C3)O	{1: 3, 4: 1, 14: 14, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	63149-18-8	CCN(CC)C1=CC(=C(C=C1)N=C2C=C(C(=O)C3=CC=CC=C32)C(=O)NC4=CC(=CC=C4)OC)C	{1: 4, 2: 2, 33: 1, 34: 1, 14: 12, 15: 2, 22: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	63149-20-2	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)SC	{1: 3, 33: 1, 40: 1, 41: 1, 14: 10, 29: 3}
Did not match all atoms present	63149-21-3	CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CCCO)C=CC4=CC=CC=C41.[I-]	{1: 1, 2: 4, 6: 1, 33: 2, 14: 12, 15: 1, 19: 1, 20: 1}
Did not match all atoms present	63149-22-4	CCN1C(=CC(=C1C)C=CC2=[N+](C3=CC=CC=C3O2)CC)C.[Cl-]	{1: 4, 2: 2, 6: 2, 33: 2, 14: 5, 17: 1, 23: 1}
Did not match all atoms present	63149-23-5	CCCCCCCCCCCCCCCC1=C(C=CC(=C1)OC(=O)C(CC)NC2=C(C=CC(=C2)NC(=O)CC(=O)C(C)(C)C)Cl)S(=O)(=O)[O-].[Na+]	{1: 5, 2: 16, 3: 1, 4: 1, 14: 6, 17: 1, 24: 2, 28: 1, 29: 3, 31: 2}
Did not match all atoms present	63149-24-6	CC1=[N+](C2=C(C1(C)C)C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-]	{1: 3, 2: 4, 33: 1, 13: 1, 14: 6, 15: 1, 29: 3}
Did not match all atoms present	63149-25-7	CC1=[N+](C2=CC=CC=C2[Se]1)CCC(C)S(=O)(=O)[O-]	{1: 2, 2: 2, 3: 1, 33: 1, 14: 4, 29: 3}
Did not match all atoms present	63149-29-1	CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C2=CC=CC=C2SC1=CC=[N+]3CCCCC3	{1: 2, 6: 2, 33: 2, 41: 1, 11: 5, 14: 8, 15: 1, 29: 3}
Did not match all atoms present	63149-31-5	CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])O)C(C)(C)CC	{1: 6, 2: 6, 4: 2, 38: 1, 14: 12, 21: 1, 22: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	63149-33-7	C1CC2=C3C(=C(C(=C2)C=O)O)CCCN3C1	{33: 1, 26: 1, 11: 6, 21: 1, 14: 1}
Did not match all atoms present	63149-36-0	C1=CC=C2C(=C1)C=CC3=C2[N+](=C(S3)C=C4N(C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])CCCS(=O)(=O)[O-].[Na+]	{33: 2, 2: 6, 6: 1, 41: 2, 14: 10, 15: 1, 29: 6}
Did not match all atoms present	63149-38-2	CCOC(=O)N1CCN(CC1)C2=C(CCC2=CNC3=CC=CC=C3)C=NC4=CC=CC=C4	{1: 1, 2: 1, 6: 2, 33: 2, 11: 6, 34: 1, 14: 10, 15: 3, 28: 1, 31: 1}
Did not match all atoms present	63149-40-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C(=[N+](C2=NC3=CC=CC=C3N=C21)C)CC4N(C5=NC6=C(C=C(C=C6)Cl)N=C5N4C7=CC=CC=C7)C8=CC=CC=C8	{1: 3, 2: 1, 35: 4, 33: 4, 12: 1, 14: 21, 17: 1, 29: 3}
Did not match all atoms present	63149-46-2	C1=CC(=CC(=C1)S(=O)(=O)F)S(=O)(=O)NC2=CC=CC3=C2C=CC=C3O	{16: 1, 31: 1, 21: 1, 14: 10, 29: 4}
Did not match all atoms present	63149-65-5	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.C(CNCCNCCN)N	{1: 2, 2: 6, 4: 1, 5: 1, 14: 8, 21: 2, 30: 2, 31: 2}
Did not match all atoms present	6315-03-3	CC(C)COC(=O)C1=CC=C(C=C1)C(C)C	{1: 4, 2: 1, 3: 2, 28: 1, 14: 4}
Did not match all atoms present	6315-71-5	C1=CC2=C(OC(=C2C=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl	{17: 2, 14: 12, 23: 1}
Did not match all atoms present	6315-89-5	COC1=C(C=C(C=C1)N)OC	{1: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	6315-96-4	CCC(=O)C1=CC2=CC=CC=C2C=C1	{24: 1, 1: 1, 2: 1, 14: 7}
Did not match all atoms present	63150-12-9	CC(C)(C)C1=CC=C(C=C1)O.CNC.C=O	{1: 5, 4: 1, 5: 1, 14: 4, 21: 1, 31: 1}
Did not match all atoms present	6316-30-9	CCCCCCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 10, 28: 1, 14: 5}
Did not match all atoms present	63163-95-1	C1=CC2=C(C=CC(=C2O)C(=O)O)C(=C1)N.Cl	{17: 1, 30: 1, 27: 1, 21: 1, 14: 5}
Did not match all atoms present	63163-96-2	CC(C)(C)C(=O)CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 3, 2: 1, 4: 1, 38: 1, 14: 3, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	63163-97-3	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C#N	{1: 2, 2: 15, 3: 1, 37: 1, 14: 4, 22: 1}
Did not match all atoms present	63165-94-6	CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C2=C4C(=O)C5=CC=CC=C5C4=O)C=C(C1=O)C(C)(C)C	{1: 12, 4: 4, 25: 4, 14: 8, 15: 10}
Did not match all atoms present	63166-73-4	C[C@@H]1CO[C@]2(C[C@@H]1OC(=O)/C=C/C3=CC=CC=C3)[C@]4(CO4)[C@@H]5CC[C@@H](C[C@@H]5O2)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C)O)OC(=O)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C)O)OC(=O)C)O	{1: 5, 6: 2, 11: 6, 12: 15, 13: 2, 14: 5, 20: 3, 22: 1, 23: 5, 28: 4}
Did not match all atoms present	6317-54-0	C1CN(CC1OC(=O)N)C2=CC(=CC=C2)Cl	{33: 1, 11: 3, 12: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	6317-85-7	CN(C)C1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)O	{1: 2, 3: 1, 33: 1, 14: 9, 20: 1, 24: 1}
Did not match all atoms present	63175-24-6	COC(=O)C(=C(C#N)C1=CC=C(C=C1)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3)C#N	{1: 1, 2: 4, 37: 2, 33: 1, 7: 2, 14: 14, 28: 3}
Did not match all atoms present	63175-99-5	CCCCCCCCC1=CC=CC=C1OCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 9, 22: 2, 14: 4, 29: 3}
Did not match all atoms present	63179-81-7	C[C@@H](C(=O)[O-])O.C[C@@H](C(=O)[O-])O.[Zn+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	6318-16-7	C1=CC=C(C=C1)N=CC/C=C/C=NC2=CC=CC=C2.Cl	{17: 1, 2: 1, 34: 2, 14: 10, 6: 4}
Did not match all atoms present	6318-17-8	C1=CC=C(C=C1)C2(C3=CC=CC=C3C(C4=CC=CC=C42)(C5=CC=CC=C5)O)O	{20: 2, 13: 2, 14: 18}
Did not match all atoms present	6318-37-2	C1=CC(=CC=C1/C=C\2/C(=O)NC(=S)S2)Cl	{32: 1, 6: 1, 41: 1, 14: 4, 15: 2, 17: 1, 25: 1}
Did not match all atoms present	6318-43-0	C1=CN=CC=C1CCC(=O)O	{35: 1, 2: 2, 27: 1, 14: 4}
Did not match all atoms present	6318-57-6	C1=CC(=C(C=C1N)O)[As](=O)(O)O	{30: 1, 20: 2, 21: 1, 14: 3, 29: 1}
Did not match all atoms present	63181-82-8	CCCCCCCCCCCCCCCC1=C(C=CC(=C1)OC(CC)C(=O)NC2=NN(C(=O)C2)C3=C(C=C(C=C3Cl)C)C)S(=O)(=O)O	{1: 4, 2: 15, 3: 1, 33: 1, 11: 1, 14: 5, 15: 1, 17: 1, 35: 1, 20: 1, 22: 1, 24: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	63181-92-0	CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C.C[N+](C)(C)CC1=CC=CC=C1C=C.C=CC1=CC=CC=C1C=C.[Cl-]	{1: 7, 2: 5, 4: 1, 5: 6, 6: 3, 7: 3, 14: 8, 17: 1, 28: 3}
Did not match all atoms present	63181-98-6	CN(CC1=CC=CC=C1C=C)C([C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)O.C=CC1=CC=CC=C1C=C	{1: 1, 2: 2, 3: 5, 5: 3, 6: 3, 33: 1, 14: 8, 20: 6}
Did not match all atoms present	63182-13-8	COC(=O)C=C.C=CCCO/C=C/O/C=C/OCCC=C.C=CC#N.C=CC1=CC=CC=C1C=C	{1: 1, 2: 4, 5: 6, 6: 10, 14: 4, 22: 3, 28: 1, 37: 1}
Did not match all atoms present	63182-18-3	CCCCCCCCC1=CC(=C(C=C1)O)N.Cl	{1: 1, 2: 7, 14: 3, 17: 1, 21: 1, 30: 1}
Did not match all atoms present	63182-21-8	C(=O)[O-].C(=O)[O-].C(=O)[O-].C(=O)[O-].[Na+].[Cr+3]	{26: 4}
Did not match all atoms present	63182-23-0	COC1=C(C=CC(=C1)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O)N	{1: 1, 34: 2, 14: 8, 20: 2, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	63182-24-1	C1=CC2=C(C=CC(=C2C(=C1)O)N=O)S(=O)(=O)[O-].[Na+]	{34: 1, 21: 1, 14: 5, 29: 4}
Did not match all atoms present	6319-21-7	COC1=CC=CC=C1N=NC2=CC=CC=C2	{1: 1, 34: 2, 22: 1, 14: 9}
Did not match all atoms present	6319-40-0	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])Br	{18: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	6319-85-3	CC1=C(C=C(C=C1C(C)C)C(C)C)C(C)C	{1: 7, 3: 3, 14: 2}
Did not match all atoms present	632-00-8	CC1=NSC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 1, 41: 1, 14: 5, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	632-02-0	CC1=CC=C(C=C1)S(=O)(=O)OCCCCl	{1: 1, 2: 3, 14: 4, 17: 1, 22: 1, 29: 2}
Did not match all atoms present	632-15-5	CC1=CSC=C1C	{1: 2, 14: 2, 41: 1}
Did not match all atoms present	632-16-6	CC1=C(SC=C1)C	{1: 2, 14: 2, 41: 1}
Did not match all atoms present	632-24-6	C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)N	{30: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	632-25-7	C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)O	{27: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	632-46-2	CC1=C(C(=CC=C1)C)C(=O)O	{1: 2, 27: 1, 14: 3}
Did not match all atoms present	632-47-3	CN1CCC2=CC3=C(C4=C2C1CC5=C4C(=C(C=C5)OC)O)OCO3.Cl	{1: 2, 33: 1, 11: 4, 12: 1, 14: 3, 17: 1, 21: 1, 22: 1, 23: 2}
Did not match all atoms present	632-50-8	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4	{3: 2, 14: 20}
Did not match all atoms present	632-51-9	C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{14: 20, 7: 2}
Did not match all atoms present	632-52-0	C1=CC=C(C=C1)N(C2=CC=CC=C2)N(C3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 14: 20}
Did not match all atoms present	632-58-6	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)O)C(=O)O	{17: 4, 27: 2}
Did not match all atoms present	632-77-9	C1=CC(=C(C2=C1C(=O)C3=C(C2=O)C=CC(=C3O)O)O)O	{25: 2, 21: 4, 14: 4}
Did not match all atoms present	632-79-1	C12=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)OC2=O	{18: 4, 28: 2}
Did not match all atoms present	632-80-4	C12=C(C(=C(C(=C1I)I)I)I)C(=O)OC2=O	{19: 4, 28: 2}
Did not match all atoms present	632-83-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Br	{25: 2, 18: 1, 14: 7}
Did not match all atoms present	632-89-3	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)N(C3=CC=CC=C3)C4=CC=CC=C4	{24: 1, 33: 2, 14: 20}
Did not match all atoms present	632-92-8	CC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C)[N+](=O)[O-]	{1: 2, 38: 3, 14: 1}
Did not match all atoms present	632-99-5	CC1=CC(=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N)C=CC1=N.Cl	{1: 1, 36: 1, 7: 1, 14: 11, 15: 3, 17: 1, 30: 2}
Did not match all atoms present	6320-01-0	C1=CC(=CC(=C1)Br)S	{18: 1, 14: 4, 39: 1}
Did not match all atoms present	6320-02-1	C1=CC=C(C(=C1)S)Br	{18: 1, 14: 4, 39: 1}
Did not match all atoms present	6320-03-2	C1=CC=C(C(=C1)S)Cl	{17: 1, 14: 4, 39: 1}
Did not match all atoms present	6320-14-5	CC1(C2=CC=CC=C2[N+](=C1C=CC=C3C(C4=CC=CC=C4N3C)(C)C)C)C.[Cl-]	{1: 6, 6: 3, 33: 2, 13: 2, 14: 8, 15: 2, 17: 1}
Did not match all atoms present	6320-40-7	CC1=C(C=C(C=C1Br)Br)Br	{1: 1, 18: 3, 14: 2}
Did not match all atoms present	6320-51-0	COC1=CC=C(C=C1)C=C2C(=O)NC(=O)S2	{32: 1, 1: 1, 6: 1, 41: 1, 14: 4, 15: 1, 22: 1, 25: 2}
Did not match all atoms present	63207-60-3	CCCCC[C@H]([NH3+])P(=O)([O-])[O-]	{1: 1, 2: 4, 3: 1, 29: 3}
Did not match all atoms present	63213-29-6	CCOC1=CC(=C(C=C1C(=O)C)OCC)OCC	{24: 1, 1: 4, 2: 3, 22: 3, 14: 2}
Did not match all atoms present	63216-82-0	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N)N=NC3=CC(=C(C=C3)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)O)S(=O)(=O)O)C	{1: 2, 34: 4, 14: 15, 20: 2, 24: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	63216-83-1	CC1=CC(=C(C=C1N=NC2=CC(=C(C=C2)OC)S(=O)(=O)O)OC)N	{1: 3, 34: 2, 14: 5, 20: 1, 22: 2, 29: 2, 30: 1}
Did not match all atoms present	63216-84-2	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC5=CC=CC=C5)S(=O)(=O)O)OC)N/N=C\6/C7=C(C=C(C=C7)S(=O)(=O)O)C=C(C6=O)S(=O)(=O)O	{1: 2, 34: 2, 14: 19, 15: 4, 20: 3, 22: 2, 25: 2, 29: 6, 31: 3}
Did not match all atoms present	63216-86-4	C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)C=CC5=C(C=C(C=C5)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{33: 1, 35: 2, 6: 2, 14: 11, 20: 3, 29: 6, 30: 1}
Did not match all atoms present	63216-87-5	C1=CC2=C(C(=C1)NC(=O)C(=O)O)C(=O)C3=C(C2=O)C=CC=C3NC(=O)C(=O)O	{24: 2, 25: 2, 27: 2, 14: 6, 31: 2}
Did not match all atoms present	63216-88-6	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)SC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O	{40: 1, 38: 2, 20: 2, 29: 4, 14: 6}
Did not match all atoms present	63216-89-7	C1=CC=C2C(=C1)C=CC3=C2C=CC(=N3)C4C(=O)C5=CC=CC=C5C4=O	{25: 2, 35: 1, 12: 1, 14: 12}
Did not match all atoms present	63216-91-1	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC(=C(C=C3)Cl)S(=O)(=O)O	{34: 2, 14: 12, 17: 1, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	63216-92-2	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)NC5=C(C(=O)C(=C(C5=O)Cl)NC6=C7C=CC8=CC=CC9=C8C7=C(C=C9)C=C6)Cl	{17: 2, 31: 2, 25: 2, 14: 18, 15: 4}
Did not match all atoms present	63216-93-3	CCCCCCCCCCCCC1=C/C(=N\NC2=CC=CC=C2[N+](=O)[O-])/C(=O)C=C1	{1: 1, 2: 11, 38: 1, 34: 1, 14: 7, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	63216-94-4	CC(C)(C)CC(C)(C)C1=C/C(=N/NC2=C(C=CC3=CC=CC=C32)N)/C(=O)C=C1	{1: 5, 2: 1, 4: 2, 34: 1, 14: 9, 15: 2, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	63216-95-5	CCNC(=O)OCCN(CCC#N)C1=CC=CC=C1	{1: 1, 2: 5, 37: 1, 33: 1, 14: 5, 28: 1, 31: 1}
Did not match all atoms present	63216-97-7	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N\NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N/N=C\5/C(=CC6=CC(=CC(=C6C5=O)N)S(=O)(=O)O)S(=O)(=O)O)OC)OC)/C2=O)S(=O)(=O)O	{1: 3, 34: 2, 14: 12, 15: 4, 20: 4, 22: 2, 24: 1, 25: 2, 29: 8, 30: 1, 31: 3}
Did not match all atoms present	63216-98-8	CC\1=CC(=O)C=C/C1=N\NC2=CC=C(C=C2)N	{1: 1, 34: 1, 14: 7, 15: 2, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	63216-99-9	CC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)NN=C3C=CC(=O)C=C3	{1: 1, 34: 3, 14: 11, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	63217-11-8	CCCCCCCCCCCCC1=CC=C(C=C1)OCCOCCOP(=O)(O)O	{1: 1, 2: 15, 14: 4, 20: 2, 22: 3, 29: 1}
Did not match all atoms present	63217-12-9	CCCCCCOCCOCCOCCOCCOP(=O)(O)O	{1: 1, 2: 13, 20: 2, 29: 1, 22: 5}
Did not match all atoms present	63217-14-1	CCCCC/C=C\C/C=C\CCCCCCCC(=O)N(C)CCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 14, 6: 4, 33: 1, 24: 1, 29: 3}
Did not match all atoms present	63217-16-3	CCCCCCCCCCCCCC(=O)N(CCS(=O)(=O)[O-])C1CCCCC1.[Na+]	{1: 1, 2: 14, 33: 1, 11: 5, 12: 1, 24: 1, 29: 3}
Did not match all atoms present	63217-24-3	CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)C(C(=O)C(C)(C)C)OC3=CC=C(C=C3)C(=O)OC)C(C)(C)CC	{1: 10, 2: 5, 3: 1, 4: 3, 14: 10, 17: 1, 22: 2, 24: 3, 28: 1, 31: 2}
Did not match all atoms present	63217-25-4	CCC(C)(C)C1=CC(=C(C=C1)OCCCCCl)C(C)(C)CC	{1: 6, 2: 6, 4: 2, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	63217-26-5	CC1=CC=C(C=C1)N(CCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)N	{1: 1, 2: 3, 33: 1, 14: 13, 29: 2, 30: 1}
Did not match all atoms present	63217-35-6	CCCCCCCCCCCCCCCCCCN1C2=C(C=C(C=C2)S(=O)(=O)O)N=C1C3=CC=C(C=C3)N	{1: 1, 2: 17, 35: 1, 33: 1, 14: 7, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	63217-37-8	CCCCCCCCCCCCCCCCCCNC1=CC(=CC(=C1)C(=O)OC)C(=O)OC	{1: 3, 2: 17, 28: 2, 14: 3, 31: 1}
Did not match all atoms present	63217-38-9	C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C3C=C(C=CC3=C2)S(=O)(=O)N)OS(=O)(=O)C4=CC=CC=C4	{30: 1, 22: 2, 14: 15, 29: 6}
Did not match all atoms present	63217-39-0	C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C3C=C(C=CC3=C2)S(=O)(=O)Cl)OS(=O)(=O)C4=CC=CC=C4	{17: 1, 22: 2, 14: 15, 29: 6}
Did not match all atoms present	63217-46-9	CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)NC3=NN(C(=O)C3)C4=C(C=C(C=C4Cl)Cl)Cl)C(C)(C)CC.Cl	{1: 6, 2: 3, 35: 1, 4: 2, 33: 1, 11: 1, 14: 9, 15: 1, 17: 4, 22: 1, 24: 2, 25: 1, 31: 2}
Did not match all atoms present	6322-37-8	C1=CC2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)N.[Na+]	{30: 1, 29: 3, 14: 6}
Did not match all atoms present	6322-56-1	CC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]	{24: 1, 1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	63224-35-1	C1COCCN1CCN=C=S	{33: 1, 2: 2, 8: 1, 11: 4, 34: 1, 23: 1}
Did not match all atoms present	63224-44-2	CCCCCCCCCCCCCC(=O)ON(C1=CC2=C(C=C1)C3=CC=CC=C3C2)C(=O)C	{1: 2, 2: 12, 33: 1, 11: 1, 14: 7, 24: 1, 28: 1}
Did not match all atoms present	63224-45-3	CCCCCCCCCCCCCC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)OC(=O)C	{1: 2, 2: 12, 33: 1, 11: 1, 14: 7, 24: 1, 28: 1}
Did not match all atoms present	63226-13-1	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC4=C(C=C(C=C4)N(CC)CC)OC3=O	{1: 4, 2: 4, 33: 2, 14: 8, 24: 1, 28: 2}
Did not match all atoms present	63227-27-0	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)N(C6=O)C	{1: 4, 4: 1, 33: 2, 14: 14, 22: 2, 25: 4}
Did not match all atoms present	63227-28-1	CN1C(=O)C2=C(C1=O)C=C(C=C2)OC3=CC=C(C=C3)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)N(C6=O)C	{1: 2, 33: 2, 22: 2, 14: 14, 25: 4}
Did not match all atoms present	6323-76-8	CCNC(=O)OCCN(CCOC(=O)NCC)C1=CC(=CC=C1)Cl	{1: 2, 2: 6, 33: 1, 14: 4, 17: 1, 28: 2, 31: 2}
Did not match all atoms present	6323-77-9	CCNC(=O)OCCN(CCOC(=O)NCC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl	{1: 2, 2: 6, 38: 1, 33: 1, 34: 2, 14: 6, 17: 2, 28: 2, 31: 2}
Did not match all atoms present	6323-97-3	CC(N)P(=O)(O)O	{1: 1, 3: 1, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	6323-99-5	C(CP(=O)(O)O)C(C(=O)O)N	{2: 2, 3: 1, 20: 2, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	63238-49-3	CC1=CC(=C)C(=CC1=C)C	{1: 2, 5: 2, 14: 2}
Did not match all atoms present	6324-50-1	C1=C(C=C(C(=C1Cl)I)Cl)Cl	{17: 3, 19: 1, 14: 2}
Did not match all atoms present	6324-65-8	CC1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3C)C(=O)C	{24: 1, 1: 3, 4: 1, 14: 13}
Did not match all atoms present	6324-98-7	C1=CC(=CC=C1C=CC(=O)O)N=[N+](C2=CC=C(C=C2)C=CC(=O)O)[O-]	{33: 1, 34: 1, 6: 4, 14: 8, 27: 2, 29: 1}
Did not match all atoms present	63243-76-5	CCOC(=O)C1=C(C=CC(=C1)Br)N	{1: 1, 2: 1, 14: 3, 18: 1, 28: 1, 30: 1}
Did not match all atoms present	63245-28-3	CCC1=C(C(=CC=C1)CC)NC(=O)CN(CC(=O)O)CC(=O)O	{1: 2, 2: 5, 33: 1, 14: 3, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	63245-38-5	C1=CC=C(C(=C1)C(=O)NNC(=O)CCCCCCCCCCC(=O)NNC(=O)C2=CC=CC=C2O)O	{24: 4, 2: 10, 21: 2, 14: 8, 31: 4}
Did not match all atoms present	6325-54-8	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)CCl	{17: 1, 2: 1, 14: 11}
Did not match all atoms present	6325-91-3	C1=CC2=C(C=C1[N+](=O)[O-])NC(=S)N2	{32: 2, 38: 1, 14: 3}
Did not match all atoms present	6325-93-5	C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)N	{30: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	63250-25-9	CC(C)C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2	{24: 2, 1: 2, 2: 1, 3: 1, 14: 9}
Did not match all atoms present	63251-40-1	C1=CC(=CC=C1N)N2N=C3C=CC4=C(C=C(C=C4C3=N2)S(=O)(=O)O)S(=O)(=O)O	{33: 1, 35: 2, 14: 8, 20: 2, 29: 4, 30: 1}
Did not match all atoms present	63251-41-2	CC1=C/C(=N\NC2=CC=C(C3=CC=CC=C32)N=NC4=CC(=CC=C4)S(=O)(=O)O)/C(=O)C=C1	{1: 1, 34: 3, 14: 13, 15: 2, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	63254-06-8	CC(C)N1C=CC=C(C1=S)C=O	{1: 2, 26: 1, 3: 1, 14: 3, 33: 1}
Did not match all atoms present	6326-72-3	CNP(=O)(NC)NC	{1: 3, 29: 1, 31: 3}
Did not match all atoms present	6326-83-6	C(C(=O)O)SC(=S)SCC(=O)O	{40: 2, 2: 2, 27: 2, 7: 1}
Did not match all atoms present	63262-93-1	CC(C)(C)[Si](C)(C)[Si](C)(C)C(C)(C)C	{1: 10, 4: 2}
Did not match all atoms present	63264-73-3	C=CCOCC(COP(=O)(O)O)Br	{2: 3, 3: 1, 5: 1, 6: 1, 18: 1, 20: 2, 22: 2, 29: 1}
Did not match all atoms present	63264-80-2	C1(C2=C(C3=C1C(=C(C(=C3F)F)F)F)C(=C(C(=C2F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F	{16: 13, 12: 1}
Did not match all atoms present	6327-52-2	CCCCCCCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 7, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	6327-79-3	COC1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2	{24: 2, 1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	6327-98-6	CN1C(=O)C=CN=C1SC	{1: 2, 35: 1, 33: 1, 40: 1, 14: 2, 25: 1}
Did not match all atoms present	63270-67-7	C1=C(NC=N1)CC(C(=O)[O-])N.C1=C(NC=N1)CC(C(=O)[O-])N.[Mn+2]	{32: 2, 2: 2, 3: 2, 14: 4, 35: 2, 24: 2, 30: 2}
Did not match all atoms present	63278-33-1	CCC(=O)OCC(=NCCC1=CC=CC=C1)CC(=O)NCCC2=CC=CC=C2	{1: 1, 2: 7, 7: 1, 34: 1, 14: 10, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	6328-44-5	CCC(=O)OC1=CC=CC=C1C(=O)O	{1: 1, 2: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	6328-48-9	C1=CC=C(C=C1)COCCC#N	{2: 3, 22: 1, 14: 5, 37: 1}
Did not match all atoms present	6328-74-1	C1=CC=C(C=C1)OC2=CC=C(C=C2)CC(=O)O	{2: 1, 27: 1, 22: 1, 14: 9}
Did not match all atoms present	63281-03-8	CC1=C(C(=NC(=C1N=NC2=C(C=C(C=C2)N=NC3=CC=CC=C3)Cl)NCCCOCCOC4=CC=CC=C4)NCCCOCCOC5=CC=CC=C5)C#N	{1: 1, 2: 10, 35: 1, 37: 1, 34: 4, 14: 18, 17: 1, 22: 4, 31: 2}
Did not match all atoms present	63281-05-0	CC1=C(C(=NC(=C1N=NC2=CC=C(C=C2)N=NC3=CC=CC=C3)NCCCOCCOC4=CC=CC=C4)NCCCOCCOC5=CC=CC=C5)C#N	{1: 1, 2: 10, 35: 1, 37: 1, 34: 4, 14: 19, 22: 4, 31: 2}
Did not match all atoms present	63284-71-9	C1=CC=C(C(=C1)C(C2=CC=C(C=C2)F)(C3=CN=CN=C3)O)Cl	{35: 2, 4: 1, 14: 11, 16: 1, 17: 1, 20: 1}
Did not match all atoms present	63286-53-3	C1C2=C(C=CS2)C3=C(CO1)SC=C3	{41: 2, 11: 2, 14: 4, 23: 1}
Did not match all atoms present	63286-55-5	C1C2=C(C=CS2)C3=C(CS1)SC=C3	{41: 3, 11: 2, 14: 4}
Did not match all atoms present	63289-85-0	C1C(C1(Cl)Cl)SC2=CC=CC=C2	{40: 1, 11: 1, 12: 1, 13: 1, 14: 5, 17: 2}
Did not match all atoms present	6329-01-7	CC1CCOC(O1)C2=CC(=C(C=C2)O)OC	{1: 2, 11: 2, 12: 2, 14: 3, 21: 1, 22: 1, 23: 2}
Did not match all atoms present	6329-46-0	C[C@@]12CC[C@H]3C(=O)O[C@@H](C[C@]3([C@@H]1[C@@H]4C=C[C@]2(C(=O)O4)O)C)C5=COC=C5	{1: 2, 11: 3, 12: 4, 13: 3, 14: 5, 20: 1, 23: 1, 28: 2}
Did not match all atoms present	63294-54-2	CCCCCCOCCOP(=O)(O)O	{1: 1, 2: 7, 20: 2, 29: 1, 22: 2}
Did not match all atoms present	63297-21-2	CC1=CC2=C(C(=C(C(=C(C2=C1)C)C)C)C)C	{1: 6, 14: 2}
Did not match all atoms present	633-03-4	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=CC=C3.OS(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 7: 1, 14: 13, 15: 2, 20: 1, 29: 3}
Did not match all atoms present	633-59-0	C1CN(CCN1CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO.Cl.Cl	{33: 2, 2: 4, 6: 1, 41: 1, 11: 4, 14: 7, 15: 1, 17: 3, 20: 1}
Did not match all atoms present	633-65-8	COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[Cl-]	{1: 2, 33: 1, 11: 3, 14: 6, 17: 1, 22: 2, 23: 2}
Did not match all atoms present	633-96-5	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]	{34: 1, 14: 10, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	6330-82-1	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N)N=NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 2, 14: 12, 24: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	6330-95-6	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C=C1N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC(=O)NC5=CC6=CC(=CC(=C6C=C5)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 14: 15, 15: 2, 21: 1, 24: 1, 25: 1, 29: 9, 31: 3}
Did not match all atoms present	6330-98-9	CN1C=CC(=O)N=C1SC	{1: 2, 35: 1, 33: 1, 40: 1, 14: 2, 25: 1}
Did not match all atoms present	63302-43-2	CC(C)CCC(C)NC1=CC=C(C=C1)N	{1: 3, 2: 2, 3: 2, 14: 4, 30: 1, 31: 1}
Did not match all atoms present	63302-49-8	CCCCCCCCCC1=CC=C(C=C1)OP(OC2=CC=C(C=C2)CCCCCCCCC)Cl	{1: 2, 2: 16, 22: 2, 14: 8, 17: 1}
Did not match all atoms present	63302-50-1	CC(C)(C)N.C1=CC=C2C(=C1)NC(=S)S2	{32: 1, 1: 3, 4: 1, 41: 1, 14: 4, 30: 1}
Did not match all atoms present	63302-58-9	CC(CC(C)(C)C1=CC=CC=C1)C2CCCCC2	{1: 3, 2: 1, 3: 1, 4: 1, 11: 5, 12: 1, 14: 5}
Did not match all atoms present	63302-76-1	CC1CNCC(O1)C.C1=CC=C2C(=C1)NC(=S)S2	{32: 2, 1: 2, 41: 1, 11: 2, 12: 2, 14: 4, 23: 1}
Did not match all atoms present	63302-94-3	CCCCCCCCCC1=CC=CC=C1OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3CCCCCCCCC	{1: 2, 2: 16, 22: 3, 14: 13, 29: 1}
Did not match all atoms present	63302-95-4	CC(C)(C1=CC=CC=C1)C2=CC=CC=C2OP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4C(C)(C)C5=CC=CC=C5	{1: 4, 4: 2, 22: 3, 14: 23, 29: 1}
Did not match all atoms present	63303-00-4	CCCCCCCCCCCCC1=CC=C(C=C1)C2CO2.CC1CO1	{1: 2, 2: 11, 11: 2, 12: 2, 14: 4, 23: 2}
Did not match all atoms present	63307-29-9	C1CC[C@@]23CCN([C@@H]([C@@H]2C1)CC4=C3C=C(C=C4)O)CCC5=CC=C(C=C5)N	{33: 1, 2: 2, 11: 7, 12: 2, 13: 1, 14: 7, 21: 1, 30: 1}
Did not match all atoms present	6331-04-0	CC1=CC(=C(C=C1)CC(=O)O)C	{1: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	6331-63-1	C1CC(CC2=CC=CC=C21)(C(=O)O)N	{27: 1, 30: 1, 11: 3, 13: 1, 14: 4}
Did not match all atoms present	6331-71-1	CN(C)C(=O)C1=CC=C(C=C1)N	{24: 1, 1: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	6331-91-5	CCCOC1=NC(=NC2=C1NC=N2)N	{32: 1, 1: 1, 2: 2, 35: 3, 14: 1, 22: 1, 30: 1}
Did not match all atoms present	63313-46-2	C12=C(N=C(N=C1ON)N)N=C([N+]2(N)N)N.[Cl-].[Cl-].[Cl-].[Ru+3]	{17: 3, 35: 3, 30: 5, 22: 1, 15: 1}
Did not match all atoms present	6332-56-5	C1=CNC(=O)C(=C1)[N+](=O)[O-]	{32: 1, 25: 1, 38: 1, 14: 3}
Did not match all atoms present	6332-68-9	C1=CC=C(C=C1)COP(=O)([O-])OCC2=CC=CC=C2.C1=CC=C(C=C1)COP(=O)([O-])OCC2=CC=CC=C2.[Ba+2]	{2: 4, 22: 4, 14: 20, 29: 4}
Did not match all atoms present	63323-31-9	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4[C@@H]6[C@@H](O6)[C@H]([C@@H]5O)O)C=C2	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	63325-76-8	C1=CC2=NC=NC3=NC=CC(=C1)N23	{33: 1, 35: 3, 14: 6}
Did not match all atoms present	63329-53-3	C1=CC=C(C(=C1)C(=O)O)NC2=C(C=CC(=C2)Cl)C(=O)O	{17: 1, 27: 2, 14: 7, 31: 1}
Did not match all atoms present	6333-07-9	C1=CC=C(C=C1)C(=O)C2=C(C=CC3=CC=CC=C32)O	{24: 1, 21: 1, 14: 11}
Did not match all atoms present	6333-15-9	C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 38: 2, 14: 8, 31: 1}
Did not match all atoms present	63331-05-5	CN1C=C(C=NC1=O)F	{1: 1, 35: 1, 33: 1, 14: 2, 16: 1, 25: 1}
Did not match all atoms present	63331-06-6	CN1C=C(C=NC1=O)Cl	{1: 1, 35: 1, 33: 1, 14: 2, 17: 1, 25: 1}
Did not match all atoms present	63333-32-4	CN(C1=CC=CC=C1)C2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 4: 1, 38: 2, 33: 1, 14: 7, 16: 3}
Did not match all atoms present	63333-35-7	CN(C1=C(C=C(C=C1C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])C2=C(C=C(C=C2Br)Br)Br	{1: 1, 4: 1, 38: 2, 33: 1, 14: 4, 16: 3, 18: 3}
Did not match all atoms present	63339-68-4	C[C@@H]1[C@@H](SC2=CC=CC3=C2C1=CN3)C(=O)O	{32: 1, 1: 1, 41: 1, 12: 2, 14: 4, 27: 1}
Did not match all atoms present	63339-99-1	CC(C)C1(CC1)C2=CC=CC=C2	{11: 2, 1: 2, 3: 1, 13: 1, 14: 5}
Did not match all atoms present	6334-11-8	CC1=CC(=C(C(=C1)C)N)C.Cl	{1: 3, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	6334-18-5	C1=CC(=C(C(=C1)Cl)Cl)C=O	{17: 2, 26: 1, 14: 3}
Did not match all atoms present	6334-30-1	C1=C(C=C(C(=C1N)O)N)N.Cl.Cl.Cl	{17: 3, 30: 3, 21: 1, 14: 2}
Did not match all atoms present	6334-97-0	CC(=O)NC1=CC2=CC(=CC(=C2C=C1)O)S(=O)(=O)O	{1: 1, 14: 5, 20: 1, 21: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	63340-00-1	CC(C)(C)C1(CC1)C2=CC=CC=C2	{1: 3, 11: 2, 4: 1, 13: 1, 14: 5}
Did not match all atoms present	63340-01-2	CC1(CC1)C2=CC=C(C=C2)OC	{1: 2, 22: 1, 11: 2, 13: 1, 14: 4}
Did not match all atoms present	63340-02-3	CCC1(CC1)C2=CC=C(C=C2)OC	{1: 2, 2: 1, 11: 2, 13: 1, 14: 4, 22: 1}
Did not match all atoms present	63340-03-4	CC(C)C1(CC1)C2=CC=C(C=C2)OC	{1: 3, 3: 1, 11: 2, 13: 1, 14: 4, 22: 1}
Did not match all atoms present	63340-04-5	CC(C)(C)C1(CC1)C2=CC=C(C=C2)OC	{1: 4, 4: 1, 11: 2, 13: 1, 14: 4, 22: 1}
Did not match all atoms present	63340-05-6	CC1(CC1)C2=CC=C(C=C2)Cl	{1: 1, 11: 2, 13: 1, 14: 4, 17: 1}
Did not match all atoms present	63340-06-7	CCC1(CC1)C2=CC=C(C=C2)Cl	{1: 1, 2: 1, 11: 2, 13: 1, 14: 4, 17: 1}
Did not match all atoms present	63340-07-8	CC(C)C1(CC1)C2=CC=C(C=C2)Cl	{1: 2, 3: 1, 11: 2, 13: 1, 14: 4, 17: 1}
Did not match all atoms present	63340-08-9	CC(C)(C)C1(CC1)C2=CC=C(C=C2)Cl	{1: 3, 4: 1, 11: 2, 13: 1, 14: 4, 17: 1}
Did not match all atoms present	63346-21-4	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC=C(C=C1)/C=C/C(=O)O	{1: 2, 2: 1, 4: 1, 6: 2, 11: 1, 12: 1, 14: 13, 17: 1, 21: 2, 23: 1, 27: 1}
Did not match all atoms present	63346-49-6	CC1=C(C(=CC(=C1)C2=NC3=CC=CC=C3S2)S(=O)(=O)[O-])N=[N+](C4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)[N+](=NC6=C(C=C(C=C6S(=O)(=O)[O-])C7=NC8=CC=CC=C8S7)C)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 35: 2, 6: 2, 33: 2, 41: 2, 14: 18, 29: 14}
Did not match all atoms present	63346-70-3	C=C(C1=CC=C(C=C1)F)C2=CC=CC=N2	{16: 1, 35: 1, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	6335-07-5	C1=CC=C(C=C1)COC(=O)C(COC(=O)CCl)NC(=O)OCC2=CC=CC=C2	{2: 4, 3: 1, 14: 10, 17: 1, 28: 3, 31: 1}
Did not match all atoms present	6335-41-7	COC1=CC=C(C=C1)NC(=O)/C=N/O	{1: 1, 34: 1, 6: 1, 14: 4, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	6335-42-8	COC1=CC=CC=C1NC(=O)C=NO	{1: 1, 34: 1, 6: 1, 14: 4, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	6335-83-7	C1=CC=C(C=C1)CCC2=CC=C(C=C2)O	{2: 2, 21: 1, 14: 9}
Did not match all atoms present	6335-90-6	C1OC2=C(O1)C=C3C(=C2)C=CC(=O)N3	{32: 1, 25: 1, 11: 1, 14: 4, 23: 2}
Did not match all atoms present	63351-73-5	CCCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 16, 22: 5, 14: 4, 29: 3}
Did not match all atoms present	63353-75-3	CN([PH+](F)F)[PH+](F)F.CN([PH+](F)F)[PH+](F)F.CN([PH+](F)F)[PH+](F)F.[Mo]	{16: 12, 1: 3, 33: 3}
Did not match all atoms present	63357-19-7	CC(C)(C)[Si]1([Si]([Si]([Si]1(C)C(C)(C)C)(C)C(C)(C)C)(C)C(C)(C)C)C	{1: 16, 4: 4}
Did not match all atoms present	63359-60-4	CC1=CC=C([Se]1)S	{1: 1, 14: 2, 39: 1}
Did not match all atoms present	63359-61-5	CC1=CC(=C([Se]1)C)S	{1: 2, 14: 1, 39: 1}
Did not match all atoms present	63359-62-6	CC1=CC=C([Se]1)SC	{40: 1, 1: 2, 14: 2}
Did not match all atoms present	63359-63-7	CC1=CC(=C(O1)C)SC	{40: 1, 1: 3, 14: 1, 23: 1}
Did not match all atoms present	63359-64-8	CC1=CC(=C(S1)C)SC	{40: 1, 1: 3, 14: 1, 41: 1}
Did not match all atoms present	63366-67-6	B1(C2CCCC1CCC2)N(C)C	{1: 2, 11: 6, 12: 2, 33: 1}
Did not match all atoms present	63368-36-5	CC1=CC=CC=C1C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{1: 1, 2: 1, 14: 19, 17: 1}
Did not match all atoms present	63369-86-8	C1CSC(=N1)[Se]	{35: 1, 11: 2, 41: 1, 15: 1}
Did not match all atoms present	6337-33-3	CC1(CC2=CC=CC=C2O1)C	{1: 2, 11: 1, 13: 1, 14: 4, 23: 1}
Did not match all atoms present	63371-85-7	CN([PH+](F)F)[PH+](F)F.CN([PH+](F)F)[PH+](F)F.CN([PH+](F)F)[PH+](F)F.[W]	{16: 12, 1: 3, 33: 3}
Did not match all atoms present	63374-10-7	C[C-]1[CH-][CH-][CH-][CH-]1.C[C-]1C=CC=C1.Cl[Mo]Cl	{1: 2, 14: 8, 17: 2}
Did not match all atoms present	63378-84-7	CCCN(C1=CC=CC=C1)N(CCC)C2=CC=CC=C2	{1: 2, 2: 4, 14: 10, 33: 2}
Did not match all atoms present	63378-85-8	CC(C)N(C1=CC=CC=C1)N(C2=CC=CC=C2)C(C)C	{1: 4, 3: 2, 14: 10, 33: 2}
Did not match all atoms present	63378-86-9	C1CN(N(C1)C2=CC=CC=C2)C3=CC=CC=C3	{33: 2, 11: 3, 14: 10}
Did not match all atoms present	63378-87-0	C1CCN(N(C1)C2=CC=CC=C2)C3=CC=CC=C3	{33: 2, 11: 4, 14: 10}
Did not match all atoms present	63378-88-1	C1CCC2CN(N(CC2C1)C3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 11: 6, 12: 2, 14: 10}
Did not match all atoms present	63378-89-2	C1CCN(N(CC1)C2=CC=CC=C2)C3=CC=CC=C3	{33: 2, 11: 5, 14: 10}
Did not match all atoms present	63378-90-5	C1CC2CCC1N(N2C3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 11: 4, 12: 2, 14: 10}
Did not match all atoms present	6338-45-0	CC1=CN(C=N1)C	{1: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	6338-68-7	CCS(=O)(=O)N(C)C	{1: 3, 2: 1, 29: 2, 33: 1}
Did not match all atoms present	6338-70-1	C1CS(=O)(=O)CC1N	{11: 3, 12: 1, 29: 2, 30: 1}
Did not match all atoms present	6339-38-4	CC1=CC(=C(C(=O)N1)C#N)COC	{32: 1, 1: 2, 2: 1, 37: 1, 14: 1, 22: 1, 25: 1}
Did not match all atoms present	6339-52-2	C1=CC(=CC=C1NC(=O)CCl)SSC2=CC=C(C=C2)NC(=O)CCl	{2: 2, 40: 2, 14: 8, 17: 2, 24: 2, 31: 2}
Did not match all atoms present	6339-70-4	C1=CC(=C(C=C1Cl)Cl)OCCOC2=C(C=C(C=C2)Cl)Cl	{17: 4, 2: 2, 22: 2, 14: 6}
Did not match all atoms present	6339-79-3	C1=CC(=CC=C1/C=C\2/C(=O)NC(=S)S2)O	{32: 1, 6: 1, 41: 1, 14: 4, 15: 2, 21: 1, 25: 1}
Did not match all atoms present	63394-05-8	CC(C)(C(=O)NC(=O)NCN1CCOCC1)OC2=CC=C(C=C2)Cl	{1: 2, 2: 1, 4: 1, 33: 1, 11: 4, 14: 4, 17: 1, 22: 1, 23: 1, 24: 2, 31: 2}
Did not match all atoms present	63394-81-0	CC1=CC(=C([Se]1)C)SC	{40: 1, 1: 3, 14: 1}
Did not match all atoms present	63395-37-9	C1=CC(=O)/C(=N\NC2=C(C3=C(C=C(C=C3C(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])/C4=CC(=CC(=C41)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{34: 1, 14: 7, 15: 1, 25: 1, 29: 12, 31: 1}
Did not match all atoms present	634-03-7	C[C@H]1[C@@H](OCCN1C)C2=CC=CC=C2	{1: 2, 33: 1, 11: 2, 12: 2, 14: 5, 23: 1}
Did not match all atoms present	634-19-5	C1CCC2=C(C1)C3=CC=CC=C3C2=O	{25: 1, 11: 4, 14: 4, 15: 2}
Did not match all atoms present	634-20-8	CC(=O)OC1=CC=CC=C1C(OC(=O)C)OC(=O)C	{1: 3, 3: 1, 28: 3, 14: 4}
Did not match all atoms present	634-21-9	CCN1C(=CC2=CC=[N+](C3=CC=CC=C23)CC)C=CC4=CC=CC=C41.[I-]	{1: 2, 2: 2, 6: 1, 33: 2, 14: 12, 15: 1, 19: 1}
Did not match all atoms present	634-35-5	CC[N+]1=CC=CC2=CC=CC=C21.[I-]	{1: 1, 2: 1, 19: 1, 14: 7, 33: 1}
Did not match all atoms present	634-36-6	COC1=C(C(=CC=C1)OC)OC	{1: 3, 22: 3, 14: 3}
Did not match all atoms present	634-43-5	CC1=CC=C(C=C1)NC2=CC=CC3=CC=CC=C32	{1: 1, 14: 11, 31: 1}
Did not match all atoms present	634-47-9	CC1=CC(=NC2=CC=CC=C12)Cl	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	634-60-6	C1=CC(=C(C(=C1)O)N)O.Cl	{17: 1, 30: 1, 21: 2, 14: 3}
Did not match all atoms present	634-66-2	C1=CC(=C(C(=C1Cl)Cl)Cl)Cl	{17: 4, 14: 2}
Did not match all atoms present	634-67-3	C1=CC(=C(C(=C1N)Cl)Cl)Cl	{17: 3, 30: 1, 14: 2}
Did not match all atoms present	634-68-4	C1=CC(=C(C(=C1I)I)I)I	{19: 4, 14: 2}
Did not match all atoms present	634-83-3	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)N	{17: 4, 30: 1, 14: 1}
Did not match all atoms present	634-89-9	C1=C(C=C(C(=C1Br)Br)Br)Br	{18: 4, 14: 2}
Did not match all atoms present	634-90-2	C1=C(C=C(C(=C1Cl)Cl)Cl)Cl	{17: 4, 14: 2}
Did not match all atoms present	634-91-3	C1=C(C=C(C(=C1Cl)Cl)Cl)N	{17: 3, 30: 1, 14: 2}
Did not match all atoms present	634-93-5	C1=C(C=C(C(=C1Cl)N)Cl)Cl	{17: 3, 30: 1, 14: 2}
Did not match all atoms present	634-97-9	C1=CNC(=C1)C(=O)O	{32: 1, 27: 1, 14: 3}
Did not match all atoms present	6340-79-0	C1=CC(=CC=C1C(=O)CCC(=O)O)Br	{24: 1, 2: 2, 27: 1, 18: 1, 14: 4}
Did not match all atoms present	63400-06-6	CCCCCCCCCCCCCCC(=O)O.[Pb]	{1: 1, 2: 13, 27: 1}
Did not match all atoms present	63400-64-6	C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)O)N=NC3=C(C=CC(=C3)N)S(=O)(=O)O)S(=O)(=O)O	{33: 1, 34: 2, 35: 1, 12: 1, 14: 7, 15: 1, 20: 2, 25: 1, 27: 1, 29: 4, 30: 1}
Did not match all atoms present	63402-26-6	C1=CC(=CC=C1N)NNC=O	{26: 1, 30: 1, 14: 4, 31: 2}
Did not match all atoms present	63404-40-0	CN([PH+](F)F)[PH+](F)F.CN([PH+](F)F)[PH+](F)F.CN([PH+](F)F)[PH+](F)F.[Cr]	{16: 12, 1: 3, 33: 3}
Did not match all atoms present	6341-24-8	C1=C(NC=N1)C[C@H](C(=O)O)N.Cl	{32: 1, 2: 1, 3: 1, 14: 2, 17: 1, 35: 1, 27: 1, 30: 1}
Did not match all atoms present	6341-28-2	CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])N)OC.[Na+].[Na+]	{1: 2, 34: 2, 14: 7, 22: 1, 29: 6, 30: 1}
Did not match all atoms present	6341-60-2	CCOC(=O)C(C1=CC=CC2=CC=CC=C21)C(=O)OCC	{1: 2, 2: 2, 3: 1, 28: 2, 14: 7}
Did not match all atoms present	63410-51-5	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCC(=O)O)CCCC(=O)O.C(CCCN)CCN.C(CCC(=O)O)CC(=O)O	{2: 17, 27: 6, 30: 2, 14: 4}
Did not match all atoms present	63412-06-6	CN(C(=O)C1=CC=CC=C1)N=O	{1: 1, 34: 1, 33: 1, 14: 5, 24: 1, 29: 1}
Did not match all atoms present	6342-77-4	COC1=CC=CC=C1CCC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	63421-88-5	COC1=CC(=CC(=C1OC)OC)C(=O)/C=C\C2=CC=C(O2)[N+](=O)[O-]	{1: 3, 38: 1, 6: 2, 14: 4, 22: 3, 23: 1, 24: 1}
Did not match all atoms present	63421-91-0	C1=CC=C2C=C(C=CC2=C1)C(=O)/C=C/C3=CC=C(O3)[N+](=O)[O-]	{24: 1, 38: 1, 14: 9, 6: 2, 23: 1}
Did not match all atoms present	63422-71-9	CCN1CCN(C(=O)C1=O)C(=O)N[C@H](C2=CC=CC=C2)C(=O)O	{1: 1, 2: 1, 3: 1, 33: 2, 11: 2, 14: 5, 24: 1, 25: 2, 27: 1, 31: 1}
Did not match all atoms present	63424-48-6	CCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	63424-49-7	CCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 2}
Did not match all atoms present	63425-46-7	CCN1C(=COC1=CC2=[N+](C3=CC=CC=C3C=C2)CC)C4=CC=CC=C4.[I-]	{1: 2, 2: 2, 6: 1, 33: 2, 14: 12, 15: 2, 19: 1, 23: 1}
Did not match all atoms present	63428-98-8	CC(C1=CC=CC=C1)C2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)O	{1: 7, 3: 1, 4: 2, 21: 1, 14: 7}
Did not match all atoms present	63428-99-9	C1=CC=C2C(=C1)C(=O)N(C2=O)NC(=O)C(=O)NN3C(=O)C4=CC=CC=C4C3=O	{24: 2, 25: 4, 33: 2, 14: 8, 31: 2}
Did not match all atoms present	63429-99-2	COC1=C(C=C(C=C1)Cl)N=C=S	{1: 1, 34: 1, 8: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	6343-54-0	C1=CC=C(C=C1)CNC=O	{2: 1, 26: 1, 14: 5, 31: 1}
Did not match all atoms present	6343-76-6	C1=CC=C(C=C1)NC(=NC2=CC=CC=C2)C#N	{34: 1, 31: 1, 37: 1, 14: 10, 7: 1}
Did not match all atoms present	6343-88-0	C[N+](C)(C)CCOCC[N+](C)(C)C	{1: 6, 2: 4, 22: 1}
Did not match all atoms present	6343-93-7	COC1=CC=C(C=C1)CC(=O)N	{1: 1, 2: 1, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	63430-57-9	CCN(C1=CC=C(C=C1)C)C2=CC3=C(C=C2)C4(C5=CC=CC=C5C(=O)O4)C6=CC(=C(C=C6O3)C)NC7=CC=C(C=C7)C	{1: 4, 2: 1, 33: 1, 13: 1, 14: 17, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	63434-97-9	CN1CCCN(C(=S)C1=S)C	{1: 2, 11: 3, 33: 2, 15: 2}
Did not match all atoms present	63435-16-5	COC(=O)C1=CC(=C(C=C1)N)O	{1: 1, 30: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	6344-27-0	C1=CC(=C(C=C1N2C(=O)C=CC2=O)N3C(=O)C=CC3=O)O	{25: 4, 21: 1, 14: 7, 33: 2}
Did not match all atoms present	6344-28-1	COC1=C(C=CC(=C1)C(=O)CCl)O	{1: 1, 2: 1, 14: 3, 17: 1, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	6344-60-1	C1=CC=C2C(=C1)C3=C(C2=O)C(=CC=C3)O	{25: 1, 21: 1, 14: 7}
Did not match all atoms present	6344-63-4	C1C2=CC=CC=C2C3=C1C(=CC=C3)N	{11: 1, 30: 1, 14: 7}
Did not match all atoms present	6344-66-7	C1C2=C(C=C(C=C2)N)C3=CC=CC=C31	{11: 1, 30: 1, 14: 7}
Did not match all atoms present	6344-72-5	CC1=CC2=NC=CN=C2C=C1	{1: 1, 35: 2, 14: 5}
Did not match all atoms present	63444-51-9	COC1=CC2=C(C=C1)C=C(C=C2)C=C	{1: 1, 14: 6, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	63444-56-4	CC(C)CC1=CC=C(C=C1)C=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 14: 4}
Did not match all atoms present	63447-23-4	C[Ge]1(C2=CC=CC=C2SC3=CC=CC=C31)C	{1: 2, 14: 8, 41: 1}
Did not match all atoms present	63449-41-2	CCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 10, 14: 5, 17: 1}
Did not match all atoms present	63449-47-8	CCCCC(C)(C)O[Si](OC(C)(C)CCCC)(OC(C)(C)CCCC)OC(C)(C)CCCC	{1: 12, 2: 12, 4: 4, 22: 4}
Did not match all atoms present	63449-52-5	CC(=O)OC1=CC=C(C=C1)C=CC2=CC=C(C=C2)OC(=O)C	{1: 2, 28: 2, 14: 8, 6: 2}
Did not match all atoms present	63449-56-9	COC(=O)COCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 2, 28: 1, 22: 1}
Did not match all atoms present	63449-72-9	CC(C)NC(C)C.OS(=O)(=O)O	{1: 4, 3: 2, 20: 2, 29: 2, 31: 1}
Did not match all atoms present	63449-87-6	CCCC[N+](CC)(CCCC)CCCC.[OH-]	{1: 4, 2: 10}
Did not match all atoms present	63449-93-4	CC(CC1=CC=CC=C1)C(C)OC=O	{1: 2, 2: 1, 3: 2, 26: 1, 14: 5}
Did not match all atoms present	6345-63-7	CC(=O)OC(C1=CC=CC=C1[N+](=O)[O-])OC(=O)C	{1: 2, 3: 1, 28: 2, 38: 1, 14: 4}
Did not match all atoms present	63450-00-0	CC(=O)OC1=CC=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C	{1: 2, 2: 2, 28: 2, 14: 8}
Did not match all atoms present	63450-26-0	CC(C)CCC(C)COP(=O)(O)OC1=CC=CC=C1	{1: 3, 2: 3, 3: 2, 14: 5, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	63450-44-2	CC(=O)C1=C(C2=CC=CC=C2C=C1)OC(=O)C3=CC=CC=C3	{24: 1, 1: 1, 28: 1, 14: 11}
Did not match all atoms present	63450-45-3	C1=CC=C(C=C1)C(=O)CC(=O)C2=C(C3=CC=CC=C3C=C2)O	{24: 2, 2: 1, 21: 1, 14: 11}
Did not match all atoms present	63450-46-4	CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 28: 2, 31: 1}
Did not match all atoms present	63450-49-7	COC1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=CC=C(C=C3)N=C4C=CC(=O)C=C4.Cl	{1: 1, 34: 1, 14: 16, 15: 1, 17: 1, 22: 1, 25: 1, 31: 2}
Did not match all atoms present	63450-50-0	C1C(=NN(C1=O)C2=C(C=C(C=C2Cl)Cl)Cl)NC3=CC=C(C=C3)N	{33: 1, 35: 1, 11: 1, 14: 6, 15: 1, 17: 3, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	63450-54-4	C1=C/C(=C\2/C=C(C3=C(N2)C=CC4=C3C=CC(=C4)S(=O)(=O)[O-])C(=O)O)/C(=O)C=C1.[Na+]	{32: 1, 14: 10, 15: 3, 25: 1, 27: 1, 29: 3}
Did not match all atoms present	63450-59-9	C1=CC=C(C(=C1)C(CC(=O)C(=O)O)NC2=CC3=C(C=C2)C(=CC=C3)S(=O)(=O)[O-])O.[Na+]	{2: 1, 3: 1, 14: 10, 21: 1, 24: 1, 27: 1, 29: 3, 31: 1}
Did not match all atoms present	63450-61-3	CC[N+]1=C(SC2=CC=CC=C21)C=C3CC(CC(=C3)C)(C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 1, 6: 1, 33: 1, 41: 1, 11: 2, 13: 1, 14: 9, 15: 2, 29: 3}
Did not match all atoms present	63450-66-8	CC(=O)[N+](=CC=CC=CC=C1C(C2=C(N1CCCCS(=O)(=O)[O-])C=CC3=CC=CC=C32)(C)C)C4=CC=CC=C4	{1: 3, 2: 4, 6: 6, 33: 2, 13: 1, 14: 11, 15: 1, 24: 1, 29: 3}
Did not match all atoms present	63450-67-9	CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])C=CC=CC=CC=C4C(C5=C(N4CCCCS(=O)(=O)[O-])C=CC6=CC=CC=C65)(C)C)C.[Na+].[Na+].[I-]	{1: 4, 2: 8, 6: 7, 33: 2, 13: 2, 14: 12, 15: 2, 19: 1, 29: 6}
Did not match all atoms present	63450-69-1	CCCCCCS(=O)(=O)S(=O)(=O)CCCCCC	{1: 2, 2: 10, 29: 4}
Did not match all atoms present	63450-70-4	CCCCCCS(=O)S(=O)CCCCCC	{1: 2, 2: 10, 29: 2}
Did not match all atoms present	63450-71-5	CCCCCCCCS(=O)S(=O)CCCCCCCC	{1: 2, 2: 14, 29: 2}
Did not match all atoms present	63450-76-0	C1=CC=C(C=C1)N=NN(C2=CC=CC=C2)C3=CC=CC=C3.Cl	{17: 1, 34: 2, 14: 15, 33: 1}
Did not match all atoms present	63450-84-0	COC(=O)C1=CC=C(C=C1)N.Cl	{1: 1, 28: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	63450-87-3	C1=CC=C2C(=C1)C=CC(=N2)I.I	{35: 1, 19: 2, 14: 6}
Did not match all atoms present	63450-88-4	CO[C@H](C1=CC=CC=C1)C(=O)[O-].[Na+]	{24: 1, 1: 1, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	63450-91-9	C1=CC(=NC(=C1)C(=O)[O-])C(=O)[O-].[K+].[K+]	{24: 2, 35: 1, 14: 3}
Did not match all atoms present	63450-94-2	C1=CC2=C(C=C1Br)SC(=N2)N.Br	{41: 1, 18: 2, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	63450-95-3	CCC1=NC=CN=C1Cl	{1: 1, 2: 1, 35: 2, 14: 2, 17: 1}
Did not match all atoms present	63450-99-7	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)CCC(=O)[O-].[Na+]	{24: 2, 2: 2, 14: 9}
Did not match all atoms present	63451-37-6	CC(=O)C.C1=CC(=CC(=C1)O)O	{24: 1, 1: 2, 21: 2, 14: 4}
Did not match all atoms present	63451-43-4	C1C(COP(=O)(O1)OCCCl)(CO)CO	{2: 4, 11: 2, 13: 1, 17: 1, 20: 2, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	63451-45-6	C(CCl)OP(=O)(OCCCl)OCC(CO)(CO)COP(=O)(OCCCl)OCCCl	{2: 12, 4: 1, 17: 4, 20: 2, 22: 6, 29: 2}
Did not match all atoms present	63451-46-7	C1C2(COP(=O)(O1)OC2)COP(=O)(OCCCl)OCCCl	{2: 5, 11: 3, 13: 1, 17: 2, 22: 3, 23: 3, 29: 2}
Did not match all atoms present	63451-47-8	CC(=C)C(=O)O.O.[Zn]	{1: 1, 27: 1, 5: 1, 7: 1}
Did not match all atoms present	63451-48-9	C1C(COP(=O)(O1)OCCCl)(CO)COP(=O)(OCCCl)OCCCl	{2: 8, 11: 2, 13: 1, 17: 3, 20: 1, 22: 4, 23: 2, 29: 2}
Did not match all atoms present	63451-49-0	CCCCCCCCCC1=CC=C(C=C1)NC2=CC=CC3=CC=CC=C32	{1: 1, 2: 8, 14: 11, 31: 1}
Did not match all atoms present	63451-51-4	CCCCCCCCCCCCCCC(C)C1=CC(=C(C=C1O)C(C)CCCCCCCCCCCCCC)O	{1: 4, 2: 26, 3: 2, 21: 2, 14: 2}
Did not match all atoms present	63451-53-6	CCCCCCCCCCCCCCC(C)C1=C(C=C(C(=C1)O)C(C)CCCCCCCCCCCC)O	{1: 4, 2: 24, 3: 2, 21: 2, 14: 2}
Did not match all atoms present	63453-89-4	CN(C)C.C=CC1=CC=CC=C1CCl.C=CC1=CC=CC=C1C=C	{1: 3, 2: 1, 5: 3, 6: 3, 33: 1, 14: 8, 17: 1}
Did not match all atoms present	6346-05-0	COC1=C(C=C(C=C1)C=O)OCC2=CC=CC=C2	{1: 1, 2: 1, 26: 1, 22: 2, 14: 8}
Did not match all atoms present	63462-42-0	[B-]([S+](C)C)(Cl)Cl	{1: 2, 17: 2}
Did not match all atoms present	63466-98-8	COCCNC1=C2C(=C(C=C1)NCCOC)C(=O)C3=CC=CC=C3C2=O	{1: 2, 2: 4, 14: 6, 22: 2, 25: 2, 31: 2}
Did not match all atoms present	63466-99-9	COCCNC1=C2C(=C(C=C1)NCCO)C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 4, 14: 6, 20: 1, 22: 1, 25: 2, 31: 2}
Did not match all atoms present	63467-01-6	CCN(CCC#N)C1=CC=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C	{1: 2, 2: 3, 35: 1, 37: 1, 33: 1, 41: 1, 34: 2, 14: 7, 29: 2}
Did not match all atoms present	63467-02-7	CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N=NC3=CC=C(C=C3)N(CCO)CCO	{1: 1, 2: 4, 35: 1, 33: 1, 41: 1, 34: 2, 14: 7, 20: 2, 29: 2}
Did not match all atoms present	63467-06-1	CC1(CC(=O)C(C(=O)C1)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C	{1: 2, 34: 2, 38: 1, 11: 2, 12: 1, 13: 1, 14: 3, 17: 1, 25: 2}
Did not match all atoms present	63467-08-3	CC(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C	{1: 2, 2: 4, 37: 1, 38: 1, 33: 1, 34: 2, 14: 7, 28: 1, 29: 2}
Did not match all atoms present	63467-10-7	CC(=O)NC1=C(C=CC(=C1OC)NCC(CO)O)N=NC2=NC=C(S2)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 38: 1, 41: 1, 34: 2, 14: 3, 35: 1, 20: 2, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	63467-11-8	CCN(CCC#N)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)C	{1: 2, 2: 3, 37: 1, 38: 1, 33: 1, 34: 2, 14: 5, 17: 2}
Did not match all atoms present	63467-13-0	CC1=C(C=CC(=C1)NCCN2C(=O)C3=CC=CC=C3C2=O)N=NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C	{1: 2, 2: 2, 35: 1, 33: 1, 41: 1, 34: 2, 14: 10, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	63467-14-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCC4=CC=C(C=C4)CCO)N	{2: 4, 14: 9, 20: 1, 21: 1, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	63467-16-3	CC1=C(C=CC(=C1)N(CCC#N)C(C)N2C(=O)CCC2=O)N=NC3=CC=C(C=C3)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 37: 1, 38: 1, 33: 2, 11: 2, 34: 2, 14: 7, 25: 2}
Did not match all atoms present	63467-17-4	CCN(CC)C1=CC(=C(C=C1)N)CCS(=O)(=O)NC.Cl	{1: 3, 2: 4, 33: 1, 14: 3, 17: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	63467-22-1	CCN(CC(CO)O)C1=CC=CC(=C1)NC(=O)C	{1: 2, 2: 3, 3: 1, 33: 1, 14: 4, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	63467-23-2	CCN(CC(CO)O)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)NC(=O)C	{1: 2, 2: 3, 3: 1, 38: 1, 33: 1, 34: 2, 14: 5, 18: 2, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	63467-25-4	CCN(CCN1C(=O)CCC1=O)C2=CC(=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Br)NC(=O)C	{1: 2, 2: 3, 38: 1, 33: 2, 11: 2, 34: 2, 14: 6, 18: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	63467-26-5	CCC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])NN=C2C(=O)C=CC3=CC=CC=C32.[Na+]	{1: 1, 2: 1, 34: 1, 14: 8, 15: 1, 17: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	63467-28-7	CCOC(=O)CC(=NNC1=CC=C(C=C1)[N+](=O)[O-])C	{1: 2, 2: 2, 38: 1, 7: 1, 34: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	63467-30-1	CC(=NNC(=NC(=S)NC1=CC=CC=C1)N)C	{1: 2, 34: 2, 7: 3, 14: 5, 30: 1, 31: 2}
Did not match all atoms present	63467-32-3	CC1=NC2=C(S1)C=CC3=C2CCC=C3.Br	{1: 1, 35: 1, 41: 1, 11: 2, 14: 4, 18: 1}
Did not match all atoms present	63467-34-5	CO[N+]1=CC=C(C=C1)C2=CC=CC=C2.[I-]	{1: 1, 19: 1, 22: 1, 14: 9, 33: 1}
Did not match all atoms present	63467-35-6	CNCCS(=O)(=O)[O-].[Na+].Cl	{1: 1, 2: 2, 31: 1, 29: 3, 17: 1}
Did not match all atoms present	63467-36-7	CC1=CC(=CC=C1)N(C=CC=C(C#N)C#N)C(=O)C	{1: 2, 37: 2, 6: 3, 33: 1, 7: 1, 14: 4, 24: 1}
Did not match all atoms present	63467-37-8	CC1=NC2=C(S1)C=CC3=C2CCC=C3	{1: 1, 11: 2, 41: 1, 14: 4, 35: 1}
Did not match all atoms present	63467-43-6	CC(CCO)S(=O)(=O)O	{1: 1, 2: 2, 3: 1, 20: 2, 29: 2}
Did not match all atoms present	63467-44-7	C1=CC=C(C=C1)C2=CC(=C(C=C2)[O-])N=NC3=CC=CC=C3.[Na+]	{34: 2, 14: 13}
Did not match all atoms present	63467-59-4	C1=CC=C(C=C1)C2=CC3=CC=CC=C3[N-]2.[K+]	{35: 1, 14: 10}
Did not match all atoms present	63467-70-9	CN(C)C1=CC(=CC=C1)[N+](=O)[O-].Br	{1: 2, 18: 1, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	63467-74-3	C1=CC(=CC=C1N(NS(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-].[K+].[K+]	{33: 1, 38: 1, 29: 6, 14: 4, 31: 1}
Did not match all atoms present	63467-76-5	CC[NH+](CC)CC.CC(=NC1=CC(=CC=C1)NC(=S)S)[O-]	{1: 4, 2: 3, 7: 2, 39: 1, 34: 1, 14: 4, 31: 1}
Did not match all atoms present	63467-78-7	C1=CC(=C(C=C1S)C(=O)[O-])[N+](=O)[O-].[Na+]	{24: 1, 38: 1, 14: 3, 39: 1}
Did not match all atoms present	63467-92-5	CC[N+]1=C(OC2=CC=CC=C21)C=CC=CNC3=CC=CC=C3.[I-]	{1: 1, 2: 1, 6: 4, 33: 1, 14: 9, 19: 1, 23: 1, 31: 1}
Did not match all atoms present	63467-97-0	CC(C)CCNN(C)C1=CC=CC=N1	{1: 3, 2: 2, 3: 1, 33: 1, 14: 4, 35: 1, 31: 1}
Did not match all atoms present	63467-99-2	CC[N+]1=C(OC2=C1C=C(C=C2)C3=CC=CC=C3)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 33: 1, 14: 12, 23: 1, 29: 3}
Did not match all atoms present	63468-27-9	CCOC(=NC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)OCC	{1: 2, 2: 3, 38: 1, 7: 1, 34: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	63468-52-0	CC1=CC(=O)OC2=C1C=CC(=C2)OP(=O)(Cl)Cl	{1: 1, 14: 4, 17: 2, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	63468-54-2	C1=CC(=C(C=C1C=O)S(=O)(=O)[O-])O.C1=CC(=C(C=C1C=O)S(=O)(=O)[O-])O.[Ca+2]	{26: 2, 21: 2, 14: 6, 29: 6}
Did not match all atoms present	63468-57-5	C1=CC=C(C(=C1)S(=O)(=O)[O-])Br.[Na+]	{18: 1, 29: 3, 14: 4}
Did not match all atoms present	63468-58-6	C1=CC=C(C(=C1)S(=O)(=O)[O-])Br.[K+]	{18: 1, 29: 3, 14: 4}
Did not match all atoms present	63468-73-5	C1=CC=C(C=C1)[As](C2=CC=CC=C2)(C3=CC=CC=C3)(C4=CC=CC=C4)[O-].[Mg+2].[Br-]	{18: 1, 29: 1, 14: 20}
Did not match all atoms present	63468-74-6	CC(=NOCC(=O)[O-])C.[Na+]	{1: 2, 2: 1, 7: 1, 34: 1, 22: 1, 24: 1}
Did not match all atoms present	63468-79-1	CC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)C)S(=O)(=O)O)S(=O)(=O)O	{40: 2, 1: 2, 20: 2, 29: 4, 14: 6}
Did not match all atoms present	63468-80-4	CC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)C)S(=O)(=O)O)S(=O)(=O)O.C1=CC=C(C=C1)N.C1=CC=C(C=C1)N	{1: 2, 40: 2, 14: 16, 20: 2, 29: 4, 30: 2}
Did not match all atoms present	63468-81-5	CC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)C)S(=O)(=O)Cl)S(=O)(=O)Cl	{40: 2, 1: 2, 29: 4, 14: 6, 17: 2}
Did not match all atoms present	63468-90-6	C1=CC=C(C=C1)C(=O)C(=O)[O-].[K+]	{24: 2, 14: 5}
Did not match all atoms present	63468-95-1	CN(C)C1=CC(=C(C=C1)CC2=C(C=C(C=C2)N(C)C)O)O	{1: 4, 2: 1, 21: 2, 14: 6, 33: 2}
Did not match all atoms present	63468-96-2	C1=CC2=C3C(=C(C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])C=CC4=C(C=C(C1=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ca+2].[Ca+2]	{29: 12, 14: 6}
Did not match all atoms present	63468-98-4	CCOC(=O)C1=CC=C(C=C1)[N+]#N.CCOC(=O)C1=CC=C(C=C1)[N+]#N.[O-]S(=O)(=O)[O-]	{1: 2, 2: 2, 34: 2, 14: 8, 28: 2, 29: 4}
Did not match all atoms present	63469-10-3	CC1=CC=C(C=C1)S(=O)(=O)O.C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)SC(=N)N)C)C	{1: 6, 2: 3, 3: 2, 36: 1, 7: 1, 40: 1, 11: 8, 12: 5, 13: 2, 14: 5, 15: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	63469-11-4	CCCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 4, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	63469-13-6	C1=CC2=C(C=C1N=C=S)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O.Cl	{34: 1, 8: 1, 13: 1, 14: 9, 17: 1, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	63469-14-7	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC(=NNC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)OC)N=NC(=NNC5=CC=C(C=C5)[N+](=O)[O-])C6=CC=CC=C6	{1: 2, 34: 6, 38: 2, 7: 2, 14: 24, 22: 2, 31: 2}
Did not match all atoms present	63469-15-8	C1=CC=C(C=C1)C(CCC(C2=CC=CC=C2)(C3=CC=CC=C3)O)(C4=CC=CC=C4)O	{20: 2, 2: 2, 4: 2, 14: 20}
Did not match all atoms present	63472-69-5	CC(C)(C)OOC(=O)C1=CC(=C(C=C1C(=O)OOC(C)(C)C)C(=O)OOC(C)(C)C)C(=O)OOC(C)(C)C	{1: 12, 4: 4, 22: 4, 14: 2, 28: 4}
Did not match all atoms present	63482-60-0	CC(CC1N(C(=O)C2=C(O1)C=CC(=C2)Cl)O)Cl	{1: 1, 2: 1, 3: 1, 33: 1, 12: 1, 14: 3, 17: 2, 20: 1, 23: 1, 25: 1}
Did not match all atoms present	63494-13-3	CC(=O)NC1=CC(=C(C=C1)OC)NCCO	{1: 2, 2: 2, 14: 3, 20: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	63494-56-4	CCNC1=CC(=C(C=C1NC(=O)C)Cl)Cl	{1: 2, 2: 1, 14: 2, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	63494-84-8	CC(C)C=NNC(=O)C1=CC=CC=C1	{1: 2, 34: 1, 3: 1, 6: 1, 14: 5, 24: 1, 31: 1}
Did not match all atoms present	63498-62-4	CC1=C(C(=C(C(=C1Cl)Cl)Cl)C(Cl)Cl)Cl	{1: 1, 3: 1, 17: 6}
Did not match all atoms present	635-10-9	COC(=O)C1=CC(=C(C=C1C(=O)OC)C(=O)OC)C(=O)OC	{1: 4, 28: 4, 14: 2}
Did not match all atoms present	635-11-0	CC(C)c1cc(C(C)C)c(C(C)C)cc1C(C)C	{1: 8, 3: 4, 14: 2}
Did not match all atoms present	635-12-1	C1=CC=C2C=C3C(=O)C=CC(=O)C3=CC2=C1	{25: 2, 14: 8}
Did not match all atoms present	635-21-2	C1=CC(=C(C=C1Cl)C(=O)O)N	{17: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	635-22-3	C1=CC(=C(C=C1N)[N+](=O)[O-])Cl	{17: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	635-27-8	C1=CC2=C(C=CC=N2)C(=C1)Cl	{17: 1, 35: 1, 14: 6}
Did not match all atoms present	635-39-2	C1=NC2=C(N1)C(=O)N=C(N2)N.Cl	{32: 2, 35: 2, 14: 1, 17: 1, 25: 1, 30: 1}
Did not match all atoms present	635-41-6	COC1=CC(=CC(=C1OC)OC)C(=O)N2CCOCC2	{1: 3, 33: 1, 11: 4, 14: 2, 22: 3, 23: 1, 24: 1}
Did not match all atoms present	635-46-1	C1CC2=CC=CC=C2NC1	{32: 1, 11: 3, 14: 4}
Did not match all atoms present	635-51-8	C1=CC=C(C=C1)C(CC(=O)O)C(=O)O	{27: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	635-53-0	C1=CC=C(C(=C1)C(=O)O)OCC(=O)O	{2: 1, 27: 2, 22: 1, 14: 4}
Did not match all atoms present	635-65-4	CC1=C(NC(=C1CCC(=O)O)CC2=C(C(=C(N2)C=C3C(=C(C(=O)N3)C)C=C)C)CCC(=O)O)C=C4C(=C(C(=O)N4)C=C)C	{32: 4, 1: 4, 2: 5, 5: 2, 6: 4, 15: 6, 25: 2, 27: 2}
Did not match all atoms present	635-67-6	CC(=O)OC1=CC=CC=C1OC(=O)C	{1: 2, 28: 2, 14: 4}
Did not match all atoms present	635-81-4	CCC1=CC(=C(C=C1CC)CC)CC	{1: 4, 2: 4, 14: 2}
Did not match all atoms present	635-84-7	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCl	{24: 1, 17: 1, 2: 1, 14: 9}
Did not match all atoms present	635-85-8	COC1=C(C=C(C=C1)CCN)OC.Cl	{1: 2, 2: 2, 14: 3, 17: 1, 22: 2, 30: 1}
Did not match all atoms present	635-88-1	CC(C)CCOC1=CC2=CC=CC=C2C=C1	{1: 2, 2: 2, 3: 1, 22: 1, 14: 7}
Did not match all atoms present	635-90-5	C1=CC=C(C=C1)N2C=CC=C2	{33: 1, 14: 9}
Did not match all atoms present	635-93-8	C1=CC(=C(C=C1Cl)C=O)O	{17: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	63502-93-2	CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Al+3]	{24: 3, 1: 3, 2: 60}
Did not match all atoms present	63503-60-6	B(C1=CC(=CC=C1)Cl)(O)O	{17: 1, 20: 2, 14: 4}
Did not match all atoms present	63503-96-8	C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 1, 35: 2, 6: 2, 14: 11, 29: 9, 30: 1}
Did not match all atoms present	63504-15-4	C1=CC(=C(C(=C1)Cl)C/C(=N/C(=O)N)/N)Cl.Cl	{2: 1, 7: 1, 34: 1, 14: 3, 17: 3, 24: 1, 30: 2}
Did not match all atoms present	63509-77-3	CC(=O)C1=C2C3CC(C2=CC=C1)C=C3	{24: 1, 1: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	63509-78-4	C1C2C=CC1C3=C2C=CC(=C3)I	{19: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	6351-10-6	C1CC2=CC=CC=C2C1O	{20: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	63512-20-9	CC[N+]1=C(OC2=C1C=C(C=C2)Cl)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 33: 1, 14: 7, 17: 1, 23: 1, 29: 3}
Did not match all atoms present	63512-33-4	CCCCCCCC/C=C\CCCCCCCCOS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 19, 6: 2, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	63512-41-4	C1=CC(=C(C=C1O)[O-])[N+](=O)[O-].[Na+]	{38: 1, 21: 1, 14: 3}
Did not match all atoms present	63512-52-7	CC[N+]1=CC=C(C=C1)SC2=CC=CC=C2.[I-]	{1: 1, 2: 1, 33: 1, 40: 1, 14: 9, 19: 1}
Did not match all atoms present	63512-53-8	CCCCCCCN1C(=O)COC1=S	{1: 1, 2: 6, 33: 1, 11: 1, 15: 1, 23: 1, 25: 1}
Did not match all atoms present	63512-54-9	C1=CC=C2C(=C1)C=CC(=C2N)S	{30: 1, 14: 6, 39: 1}
Did not match all atoms present	63512-55-0	CN1C2=CC=CC=C2SC1=CC=[N+]3CCCCC3.[Cl-]	{1: 1, 6: 2, 33: 2, 41: 1, 11: 5, 14: 4, 15: 1, 17: 1}
Did not match all atoms present	63512-57-2	CC[N+]1=C(C=CC2=C1C=CC(=C2)C)SC3=CC=CC=C3.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 33: 1, 40: 1, 14: 14, 29: 3}
Did not match all atoms present	63512-58-3	CCCCCCCCCCCCCCCC1=C(C=CC(=C1)OC(CC)C(=O)O)S(=O)(=O)O	{1: 2, 2: 15, 3: 1, 14: 3, 20: 1, 22: 1, 27: 1, 29: 2}
Did not match all atoms present	63512-59-4	CC1=CC(=CC=C1)C(Br)Br	{1: 1, 18: 2, 3: 1, 14: 4}
Did not match all atoms present	63512-61-8	CC1=[N+](C2=CC=CC=C2C=C1)CCCO.[I-]	{1: 1, 2: 3, 33: 1, 14: 6, 19: 1, 20: 1}
Did not match all atoms present	63516-07-4	C[N+]1([C@@H]2CC[C@@H]1CC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)CCF.[Br-]	{1: 1, 2: 2, 4: 1, 11: 4, 12: 3, 14: 10, 16: 1, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	63521-15-3	CC1=NN=C(S1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)CN4C=C(C(=O)C(=C4)Cl)Cl)SC2)C(=O)[O-].[Na+]	{1: 1, 2: 2, 35: 2, 33: 2, 40: 1, 41: 2, 11: 1, 12: 2, 14: 2, 15: 2, 17: 2, 24: 2, 25: 2, 31: 1}
Did not match all atoms present	63527-52-6	CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C(=NOC)C3=CSC(=N3)N)SC1)C(=O)O	{1: 2, 2: 1, 35: 1, 33: 1, 7: 1, 41: 2, 11: 1, 12: 2, 34: 1, 14: 1, 15: 2, 22: 1, 24: 1, 25: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	63528-82-5	CC/C(=C(/CC)\C1=CC=C(C=C1)[O-])/C2=CC=C(C=C2)[O-].[Na+].[Na+]	{1: 2, 2: 2, 14: 8, 7: 2}
Did not match all atoms present	63528-97-2	C=O.C(CO)NCCO.C(=O)(N)N	{2: 4, 5: 1, 20: 2, 24: 1, 30: 2, 31: 1}
Did not match all atoms present	63534-59-8	CCOC(=O)N(C1=CC(=CC=C1)N(C2=CC(=CC=C2)OC)C(=O)OCC)C3=CC(=CC=C3)OC	{1: 4, 2: 2, 33: 2, 14: 12, 22: 2, 28: 2}
Did not match all atoms present	63543-86-2	CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N4N=C5C=C(C6=CC=CC=C6C5=N4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 3: 1, 6: 2, 33: 1, 14: 15, 35: 2, 22: 1, 24: 2, 29: 9, 31: 1}
Did not match all atoms present	63548-92-5	CC1=CC(=C(C(=C1)C)CO)C.CC(=O)O	{1: 4, 2: 1, 27: 1, 20: 1, 14: 2}
Did not match all atoms present	63549-10-0	COC1=CC=CC(=C1)OC2=CC=CC(=C2)OC3=CC=CC=C3	{1: 1, 22: 3, 14: 13}
Did not match all atoms present	63549-11-1	CC1CCC2=C(C1)OS(=O)(=O)C(=C2)C	{1: 2, 11: 3, 12: 1, 14: 1, 15: 3, 23: 1, 29: 2}
Did not match all atoms present	63549-13-3	CS(=O)(=O)[O-].C1=CC=C(C(=C1)C2=C3C=C(C(=CC3=[O+]C4=CC(=O)C(=CC42)Cl)O)Cl)C(=O)O	{1: 1, 12: 1, 14: 8, 15: 3, 17: 2, 21: 1, 23: 1, 25: 1, 27: 1, 29: 3}
Did not match all atoms present	63549-18-8	C1=CC=C2C(=C1)N=C(C(=N2)SC(=N)N)SC(=N)N.Cl.Cl	{35: 2, 36: 2, 7: 2, 40: 2, 14: 4, 17: 2, 30: 2}
Did not match all atoms present	63549-25-7	COC1=C([O+]=C2C=C(C=CC2=C1)O)C3=C(C=C(C=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5.[Cl-]	{1: 1, 2: 2, 14: 17, 17: 1, 21: 1, 22: 3, 23: 1}
Did not match all atoms present	63549-26-8	COC1=C([O+]=C2C=C(C=CC2=C1)O)C3=C(C=C(C=C3)O)O.[Cl-]	{1: 1, 14: 7, 17: 1, 21: 3, 22: 1, 23: 1}
Did not match all atoms present	63549-33-7	CC1=C(C=C(C=C1)Cl)C(=O)CCCl	{24: 1, 1: 1, 2: 2, 14: 3, 17: 2}
Did not match all atoms present	63549-34-8	CC1=CC(=C(C=C1)Cl)C(=O)CCCl	{24: 1, 1: 1, 2: 2, 14: 3, 17: 2}
Did not match all atoms present	63549-35-9	CC1=C2CCCC2=C(C=C1)C(=N)C3=CC=CC4=CC=CC=C43.Cl	{1: 1, 36: 1, 7: 1, 11: 3, 14: 9, 17: 1}
Did not match all atoms present	63549-41-7	CC1=NN(C(=C1[N+](=O)[O-])O[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 2, 33: 1, 14: 4, 22: 1}
Did not match all atoms present	63549-42-8	CC1=NN(C(=O)C1=NO[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 34: 1, 35: 1, 38: 1, 33: 1, 14: 4, 15: 2, 22: 1, 25: 1}
Did not match all atoms present	63549-43-9	C1CC2=CC(=C(C3=C2N(C1)CCC3)O)C(C4=C(C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O)C5=C(C6=C7C(=C5)CCCN7CCC6)O	{33: 2, 3: 1, 11: 12, 14: 5, 20: 2, 21: 2, 29: 4}
Did not match all atoms present	63549-46-2	C1=CC=C(C(=C1)C2=C3C=CC(=[NH2+])C=C3OC4=C2C=CC(=C4)N)C(=O)O.OS(=O)(=O)[O-]	{14: 10, 20: 1, 23: 1, 27: 1, 29: 3, 30: 2}
Did not match all atoms present	63549-51-9	C1N(C(=NN1C2=CC=CC=C2)NC3=CC=CC=C3)C4=CC=CC=C4	{33: 2, 35: 1, 11: 1, 14: 15, 15: 1, 31: 1}
Did not match all atoms present	63555-50-0	COC(=O)C1=CC(=CC=C1)S(=O)(=O)Cl	{1: 1, 28: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	63556-21-8	CCCCCCCCCCCCCC(=O)NCCN(CCO)CC(=O)[O-].[Na+]	{1: 1, 2: 17, 33: 1, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	63560-73-6	COP(=O)(Br)Br	{1: 1, 18: 2, 29: 1, 22: 1}
Did not match all atoms present	63562-33-4	C1=CC=C2C(=C1)C3=CC=CC=C3P(=O)(O2)CC(CC(=O)O)C(=O)O	{2: 2, 3: 1, 14: 8, 23: 1, 27: 2, 29: 1}
Did not match all atoms present	63562-34-5	C1=CC=C2C(=C1)C3=CC=CC=C3P(=O)(O2)CC(CC(=O)OCCO)C(=O)OCCO	{2: 6, 3: 1, 14: 8, 20: 2, 23: 1, 28: 2, 29: 1}
Did not match all atoms present	63568-27-4	CC(C)CCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCC(C)C)S(=O)(=O)O.C(CNCCN)N	{1: 4, 2: 16, 3: 2, 14: 5, 20: 1, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	63568-31-0	CC(C)CCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)S(=O)(=O)O)CCCCCCC(C)C.CN(C)CCO	{1: 6, 2: 14, 3: 2, 33: 1, 14: 4, 20: 3, 29: 4}
Did not match all atoms present	63568-33-2	CCN(CC)CC.CC(C)CCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)S(=O)(=O)O)CCCCCCC(C)C	{1: 7, 2: 15, 3: 2, 33: 1, 14: 4, 20: 2, 29: 4}
Did not match all atoms present	63568-36-5	CC(C)CCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)S(=O)(=O)O)CCCCCCC(C)C.C(CO)N(CCO)CCO	{1: 4, 2: 18, 3: 2, 33: 1, 14: 4, 20: 5, 29: 4}
Did not match all atoms present	63568-37-6	CC(C)CCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])CCCCCCC(C)C.[NH4+].[NH4+]	{1: 4, 2: 12, 3: 2, 29: 6, 14: 4}
Did not match all atoms present	6357-75-1	C1=CC(=CC=C1NC2=C3C=CC(=CC3=C(C=C2)N)S(=O)(=O)O)O	{14: 9, 20: 1, 21: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	6357-85-3	C1=CC=C2C(=C1)C=C(C=C2S(=O)(=O)O)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	63573-57-9	CCCCCCCCCCCCC(C(=O)O)OC1=CC=C(C=C1)NS(=O)(=O)CCCC	{1: 2, 2: 14, 3: 1, 14: 4, 22: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	6358-06-1	C1=CC(=C(C=C1N)O)Cl	{17: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	6358-07-2	C1=C(C(=CC(=C1Cl)[N+](=O)[O-])O)N	{17: 1, 30: 1, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	6358-15-2	C1=C(C(=C(C(=C1Cl)Cl)N)O)Cl	{17: 3, 30: 1, 21: 1, 14: 1}
Did not match all atoms present	6358-22-1	CN(C)C1=CC=C(C=C1)NC2=CC=C(C=C2)O	{1: 2, 33: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	6358-29-8	CCOC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N/N=C/4\C(=O)C=CC5=CC(=CC(=C54)S(=O)(=O)O)S(=O)(=O)O)C)C	{1: 3, 2: 1, 34: 3, 14: 14, 15: 1, 20: 2, 22: 1, 25: 1, 29: 4, 31: 1}
Did not match all atoms present	6358-40-3	CC1=C(C=C(C=C1)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-].[Mn+2]	{1: 1, 34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	6358-53-8	COC1=CC(=C(C=C1)OC)N/N=C/2\C(=O)C=CC3=CC=CC=C32	{1: 2, 34: 1, 14: 9, 15: 1, 22: 2, 25: 1, 31: 1}
Did not match all atoms present	6358-63-0	CC(=O)NC1=C(C(=CC(=C1)[N+](=O)[O-])N)O	{1: 1, 38: 1, 14: 2, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6358-64-1	COC1=CC(=C(C=C1N)OC)Cl	{1: 2, 30: 1, 22: 2, 14: 2, 17: 1}
Did not match all atoms present	6358-69-6	C1=CC2=C3C(=C(C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])C=CC4=C(C=C(C1=C43)O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{21: 1, 14: 6, 29: 9}
Did not match all atoms present	6358-80-1	CC1=CC=CC=C1NC\2=CC(=O)C=C/C2=N\NC3=CC=C(C=C3)C4=CC=C(C=C4)N=NC5=C(C=C6C=C(/C(=N\NC7=CC=C(C=C7)S(=O)(=O)[O-])/C(=O)C6=C5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 4, 14: 21, 15: 4, 25: 2, 29: 9, 30: 1, 31: 3}
Did not match all atoms present	6358-83-4	COC1=C(C=C(C=C1)N=NC2=C(C=C(C=C2)N)N)N=NC3=C(C=C(C=C3)N)N	{1: 1, 30: 4, 34: 4, 22: 1, 14: 9}
Did not match all atoms present	6358-85-6	CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4)Cl)Cl	{1: 2, 34: 4, 3: 2, 14: 16, 17: 2, 24: 4, 31: 2}
Did not match all atoms present	6358-88-9	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC(C(=O)C)C(=O)NC3=CC=CC=C3)C)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4	{1: 4, 34: 4, 3: 2, 14: 16, 24: 4, 31: 2}
Did not match all atoms present	63589-05-9	CC1=NN(C(=O)C1)C2=C(C=C(C=C2)S(=O)(=O)[O-])C.[Na+]	{1: 2, 35: 1, 33: 1, 11: 1, 14: 3, 15: 1, 25: 1, 29: 3}
Did not match all atoms present	63589-07-1	CC1=CC(=O)N(C(=C1C#N)[O-])C.[Na+]	{1: 2, 37: 1, 33: 1, 14: 1, 25: 1}
Did not match all atoms present	63589-08-2	CCCCC(CC)CNC(=O)C1=CC=C(C=C1)N.Cl	{1: 2, 2: 5, 3: 1, 14: 4, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	63589-09-3	C1=CC=C(C=C1)N(CCC#N)CCO.Cl	{33: 1, 2: 4, 37: 1, 14: 5, 17: 1, 20: 1}
Did not match all atoms present	63589-11-7	C1=CC(=CC=C1N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC4=CC(=C(C=C4O)O)N=NC5=C(C=C(C=C5O)[N+](=O)[O-])[N+](=O)[O-])O)[N+](=O)[O-].[Na+].[Na+]	{34: 6, 38: 3, 21: 4, 14: 11, 29: 6}
Did not match all atoms present	63589-12-8	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)[O-])N/N=C/3\C=C(C(=CC3=O)O)N/N=C\4/C(=CC(=CC4=O)[N+](=O)[O-])[N+](=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+]	{34: 2, 38: 2, 14: 8, 15: 6, 20: 1, 21: 1, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	63589-13-9	C1=C(C=C(C(=C1[N+](=O)[O-])N)[O-])[N+](=O)[O-].[Na+]	{38: 2, 30: 1, 14: 2}
Did not match all atoms present	63589-15-1	CC(=O)OCCN(CCC#N)C1=CC=CC=C1.Cl	{1: 1, 2: 4, 37: 1, 33: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	63589-16-2	CCN(CCO)C1=CC=CC=C1.OS(=O)(=O)O	{1: 1, 2: 3, 33: 1, 14: 5, 20: 3, 29: 2}
Did not match all atoms present	63589-17-3	COC1=CC2=C(C=C1)N=C(S2)N.OS(=O)(=O)O	{1: 1, 35: 1, 41: 1, 14: 3, 20: 2, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	63589-18-4	C1=CC=C(C(=C1)C#N)NN	{37: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	63589-19-5	C1=CC=C(C(=C1)C#N)N.OS(=O)(=O)O	{30: 1, 20: 2, 29: 2, 14: 4, 37: 1}
Did not match all atoms present	63589-20-8	C1=CSC(=N1)N.OS(=O)(=O)O	{35: 1, 41: 1, 14: 2, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	63589-21-9	C1=CC2=C(C(=CC(=C2C=C1[N+](=O)[O-])S(=O)(=O)[O-])[O-])NN=O.[Na+].[Na+]	{34: 1, 38: 1, 29: 4, 14: 4, 31: 1}
Did not match all atoms present	63589-22-0	C1=C/C(=N\NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C=C3O)S(=O)(=O)[O-])/C(=CC1=O)O.[Na+].[Na+]	{34: 1, 14: 7, 15: 2, 20: 1, 21: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	63589-26-4	COCCCNC(=O)C1=CC(=C2C(=C1[N+](=O)[O-])C(=O)C3=CC=CC=C3C2=O)N	{1: 1, 2: 3, 38: 1, 14: 5, 22: 1, 24: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	63589-27-5	CC(C)NC(=O)NC(C)C.O=S(=O)=O	{24: 1, 1: 4, 3: 2, 29: 3, 31: 2}
Did not match all atoms present	63589-28-6	C1=CC(=CC=C1NN=C2N=CC=N2)Cl	{34: 1, 35: 2, 14: 6, 15: 1, 17: 1, 31: 1}
Did not match all atoms present	63589-29-7	CCN(CC)C1=CC=C(C=C1)N/N=C\2/C3=CC=CC=C3N=N2	{1: 2, 2: 2, 35: 2, 33: 1, 34: 1, 14: 8, 15: 1, 31: 1}
Did not match all atoms present	63589-30-0	CC1(C2=CC=CC=C2N=C1C=NNC3=CC4=CC=CC=C4C=C3)C	{1: 2, 34: 1, 35: 1, 6: 1, 13: 1, 14: 11, 15: 1, 31: 1}
Did not match all atoms present	63589-32-2	CN1C=C[N+](=C1N=NC2=CC=C(C=C2)Cl)C.COS(=O)(=O)[O-]	{1: 3, 34: 2, 33: 2, 14: 6, 17: 1, 22: 1, 29: 3}
Did not match all atoms present	63589-33-3	CN1C=C[N+](=C1N=NC2=CC=C(C=C2)N(C)C)C.COS(=O)(=O)[O-]	{1: 5, 34: 2, 33: 3, 14: 6, 22: 1, 29: 3}
Did not match all atoms present	63589-34-4	C1=C(C=C(C(=C1Cl)[NH3+])Br)[N+](=O)[O-].C1=C(C=C(C(=C1Cl)[NH3+])Br)[N+](=O)[O-].[O-]S(=O)(=O)[O-]	{17: 2, 18: 2, 38: 2, 29: 4, 14: 4}
Did not match all atoms present	63589-35-5	C1=CC(=CC(=C1)Cl)N(CCO)CCO.Cl	{17: 2, 2: 4, 20: 2, 14: 4, 33: 1}
Did not match all atoms present	63589-36-6	C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)[N+](=O)[O-])C(=O)Cl)N	{38: 1, 14: 5, 17: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	63589-37-7	CCCCN(CCC#N)C1=CC=CC=C1.Cl	{1: 1, 2: 5, 37: 1, 33: 1, 14: 5, 17: 1}
Did not match all atoms present	63589-38-8	CCN(CCOC(=O)C)C1=CC=CC=C1.Cl	{1: 2, 2: 3, 33: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	63589-39-9	CCN(CCC#N)C1=CC=CC=C1.Cl	{1: 1, 2: 3, 37: 1, 33: 1, 14: 5, 17: 1}
Did not match all atoms present	63589-40-2	C1=CC(=C(C=C1CC2=CC(=C(C=C2)N/N=C\3/C=CC(=O)C=C3[O-])C(=O)O)C(=O)O)N/N=C/4\C=CC(=O)C=C4[O-].[Na+].[Na+]	{2: 1, 34: 2, 14: 12, 15: 4, 25: 2, 27: 2, 31: 2}
Did not match all atoms present	63589-41-3	C1=CC(=C(C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{30: 1, 29: 6, 14: 3}
Did not match all atoms present	63589-45-7	CCCCN(CCC#N)C1=CC=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)OC	{1: 2, 2: 5, 35: 1, 37: 1, 33: 1, 41: 1, 34: 2, 14: 7, 22: 1}
Did not match all atoms present	63589-93-5	C1=CC=C2C3C(C4C(C2=C1)C5(C(=C(C4(C5(Cl)Cl)Cl)Cl)Cl)Cl)C6(C(=C(C3(C6(Cl)Cl)Cl)Cl)Cl)Cl	{17: 12, 12: 4, 13: 6, 14: 4, 15: 4}
Did not match all atoms present	6359-22-4	CCN(CC)C1=CC2=C(C=C1)C(=C3C=C(C(=O)C=C3C(=O)O)C(=O)O)C4=C(O2)C=C(C=C4)N(CC)CC	{1: 4, 2: 4, 33: 2, 14: 8, 15: 4, 23: 1, 25: 1, 27: 2}
Did not match all atoms present	6359-29-1	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=C(C(=C5)C(=O)O)O	{1: 2, 2: 2, 33: 1, 13: 1, 14: 9, 21: 1, 23: 1, 27: 1, 28: 1}
Did not match all atoms present	6359-82-6	CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 9, 15: 1, 25: 1, 29: 3}
Did not match all atoms present	6359-86-0	CC1=NN(C(=O)C1N/N=C/2\C=C(C=CC2=O)[N+](=O)[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 1, 35: 1, 38: 1, 33: 1, 12: 1, 14: 7, 15: 3, 25: 2, 29: 3, 31: 1}
Did not match all atoms present	6359-88-2	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N/N=C\3/C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C.[Na+]	{1: 2, 34: 1, 35: 1, 33: 1, 14: 12, 15: 2, 22: 1, 25: 1, 29: 5, 31: 1}
Did not match all atoms present	6359-91-7	CC1=NN(C(=O)C1=NNC2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3)C4=C(C=CC(=C4)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 34: 1, 35: 1, 33: 1, 14: 12, 15: 2, 17: 1, 25: 1, 29: 5, 31: 2}
Did not match all atoms present	6359-96-2	CC1=NN(C(=O)C1N/N=C\2/C=C(C=C(C2=O)S(=O)(=O)[O-])[N+](=O)[O-])C3=CC(=CC=C3)Cl.[Na+]	{1: 1, 34: 1, 35: 1, 38: 1, 33: 1, 12: 1, 14: 6, 15: 4, 17: 1, 25: 2, 29: 3, 31: 1}
Did not match all atoms present	63597-33-1	C(C(=O)[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[K+].[K+].[K+].[Co+2]	{24: 1, 33: 1, 2: 3, 29: 6}
Did not match all atoms present	63597-34-2	C(C(=O)[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[K+].[K+].[K+].[Ni+2]	{24: 1, 33: 1, 2: 3, 29: 6}
Did not match all atoms present	636-04-4	C1=CC=C(C=C1)C(=S)NC2=CC=CC=C2	{31: 1, 14: 10, 7: 1}
Did not match all atoms present	636-09-9	CCOC(=O)C1=CC=C(C=C1)C(=O)OCC	{1: 2, 2: 2, 28: 2, 14: 4}
Did not match all atoms present	636-13-5	C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Mn+2]	{24: 2, 14: 10}
Did not match all atoms present	636-21-5	CC1=CC=CC=C1N.Cl	{1: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	636-23-7	CC1=C(C=C(C=C1)N)N.Cl.Cl	{1: 1, 30: 2, 14: 3, 17: 2}
Did not match all atoms present	636-26-0	CC1=CNC(=S)NC1=O	{32: 2, 1: 1, 14: 1, 25: 1}
Did not match all atoms present	636-28-2	C1=C(C(=CC(=C1Br)Br)Br)Br	{18: 4, 14: 2}
Did not match all atoms present	636-30-6	C1=C(C(=CC(=C1Cl)Cl)Cl)N	{17: 3, 30: 1, 14: 2}
Did not match all atoms present	636-31-7	C1=C(C(=CC(=C1I)I)I)I	{19: 4, 14: 2}
Did not match all atoms present	636-36-2	CCOC1=CC(=C(C=C1)C=C2C(=O)N(C(=S)N(C2=O)C)C)OCC	{1: 4, 2: 2, 6: 1, 33: 2, 14: 3, 15: 2, 22: 2, 25: 2}
Did not match all atoms present	636-41-9	CC1=CC=CN1	{32: 1, 1: 1, 14: 3}
Did not match all atoms present	636-46-4	C1=CC(=C(C=C1C(=O)O)C(=O)O)O	{27: 2, 21: 1, 14: 3}
Did not match all atoms present	636-47-5	CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=N)N)C)C)NC=O	{1: 3, 2: 2, 36: 1, 33: 3, 7: 1, 14: 6, 24: 3, 26: 1, 30: 1, 31: 4}
Did not match all atoms present	636-53-3	CCOC(=O)C1=CC(=CC=C1)C(=O)OCC	{1: 2, 2: 2, 28: 2, 14: 4}
Did not match all atoms present	636-72-6	C1=CSC(=C1)CO	{41: 1, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	636-73-7	C1=CC(=CN=C1)S(=O)(=O)O	{35: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	636-76-0	C1=CC(=CC(=C1)S(=O)(=O)N)C(=O)O	{30: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	636-79-3	C1=CC(=CN=C1)C(=O)O.Cl	{17: 1, 27: 1, 14: 4, 35: 1}
Did not match all atoms present	636-80-6	C1=CC=NC(=C1)C(=O)O.Cl	{17: 1, 27: 1, 14: 4, 35: 1}
Did not match all atoms present	636-86-2	C1=CC=C(C(=C1)/C=C\2/C(=O)NC(=S)N2)O	{32: 2, 6: 1, 14: 4, 15: 2, 21: 1, 25: 1}
Did not match all atoms present	636-93-1	COC1=C(C=C(C=C1)[N+](=O)[O-])O	{1: 1, 22: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	636-97-5	C1=CC(=CC=C1C(=O)NN)[N+](=O)[O-]	{24: 1, 38: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	636-98-6	C1=CC(=CC=C1[N+](=O)[O-])I	{19: 1, 38: 1, 14: 4}
Did not match all atoms present	636-99-7	C1=CC(=CC=C1NN)[N+](=O)[O-].Cl	{17: 1, 38: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	6360-04-9	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)[O-])NNC3=C(C=C(C=C3)N)S(=O)(=O)[O-].[Na+].[Na+]	{36: 1, 14: 7, 15: 5, 25: 1, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	6360-29-8	C1=CC(=CC=C1C2=CC=C(C=C2)N=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C6C=C(C=CC6=C(C=C5)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C\7/C=CC(=O)C(=C7)C(=O)[O-].[Na+].[Na+].[Na+]	{34: 5, 14: 21, 15: 2, 24: 1, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	6360-54-9	CC1=C/C(=N/NC2=CC=C(C=C2)C3=CC=C(C=C3)N=NC4=C(C(=CC(=C4N)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])C)N)/C=C(C1=O)C(=O)[O-].[Na+].[Na+]	{1: 2, 34: 5, 14: 15, 15: 3, 24: 1, 25: 1, 29: 3, 30: 2, 31: 1}
Did not match all atoms present	63605-22-1	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)[O-].[Na+].[Na+]	{25: 2, 29: 6, 14: 6}
Did not match all atoms present	63608-69-5	C1C2C=CC1C3=C2C=CC=C3I	{19: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	6361-21-3	C1=CC(=C(C=C1[N+](=O)[O-])C=O)Cl	{17: 1, 26: 1, 38: 1, 14: 3}
Did not match all atoms present	6361-23-5	C1=CC(=C(C=C1Cl)C=O)Cl	{17: 2, 26: 1, 14: 3}
Did not match all atoms present	6361-29-1	CCN(C1=CC=CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)N	{1: 1, 2: 1, 33: 1, 14: 11, 24: 1, 30: 1}
Did not match all atoms present	6361-46-2	CC1=C(C=CC(=C1)C(=O)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O)N	{1: 1, 14: 8, 20: 1, 21: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	6361-49-5	C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)O	{14: 9, 20: 2, 21: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	63610-07-1	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCCO)C)C.[Cl-]	{1: 4, 2: 4, 14: 8, 17: 1, 20: 1, 23: 1, 28: 1, 31: 2}
Did not match all atoms present	63617-61-8	CCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)C#N	{1: 1, 2: 3, 35: 2, 37: 1, 14: 10}
Did not match all atoms present	6362-40-9	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=C(C=CC(=C5)Cl)Cl.[Na+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 19, 15: 2, 17: 2, 29: 6}
Did not match all atoms present	6362-44-3	CC1=CC(=CC=C1)N/N=C\2/C(=CC3=C(C=CC(=C3C2=O)NC(=O)C4=CC=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 12, 15: 2, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	6362-46-5	C1CCC(CC1)C2=CC=C(C=C2)N/N=C/3\C(=CC4=C(C=CC(=C4C3=O)NC(=O)C5=C(C=CC(=C5)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 11: 5, 12: 1, 14: 10, 15: 2, 17: 2, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	6362-79-4	C1=C(C=C(C=C1C(=O)[O-])S(=O)(=O)[O-])C(=O)[O-]	{24: 2, 29: 3, 14: 3}
Did not match all atoms present	6362-80-7	CC(C)(CC(=C)C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 1, 4: 1, 5: 1, 7: 1, 14: 10}
Did not match all atoms present	6362-87-4	CC1CCOP(O1)Cl	{23: 2, 1: 1, 11: 2, 12: 1, 17: 1}
Did not match all atoms present	63635-84-7	CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 9, 38: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	63638-90-4	COC1=CC(=C2C(=C1)C=C(O2)C3CCNCC3)Br.Cl	{32: 1, 1: 1, 11: 4, 12: 1, 14: 3, 17: 1, 18: 1, 22: 1, 23: 1}
Did not match all atoms present	6364-19-8	C1=CC2=C3C(=C1)C(=CC=C3C4=C5C2=CC=C(C5=CC=C4)C(=O)O)C(=O)O	{27: 2, 14: 10}
Did not match all atoms present	6364-35-8	CC1=CC=CC=C1N=NC2=C(C=C(C=C2)N)N.Cl	{1: 1, 34: 2, 30: 2, 14: 7, 17: 1}
Did not match all atoms present	6364-39-2	CC1=CC(=C(C=C1N)N)N=NC2=CC=CC3=CC=CC=C32	{1: 1, 34: 2, 30: 2, 14: 9}
Did not match all atoms present	63641-77-0	CC1CNCCN1.CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O	{32: 2, 1: 3, 34: 2, 8: 2, 11: 4, 12: 2, 14: 3, 23: 1, 29: 2}
Did not match all atoms present	63641-78-1	CC1CNCCN1.CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C1CO1	{32: 2, 1: 3, 34: 2, 8: 2, 11: 6, 12: 2, 14: 3, 23: 2, 29: 2}
Did not match all atoms present	63641-79-2	CCC(CO)(CO)CO.CC1CNCCN1.CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C1CO1	{32: 2, 1: 4, 2: 4, 4: 1, 8: 2, 11: 6, 12: 2, 34: 2, 14: 3, 20: 3, 23: 2, 29: 2}
Did not match all atoms present	6365-50-0	C1=CC=C2C(=C1)C=CC(=N2)C=C3C4=CC=CC=C4C(=O)O3	{35: 1, 28: 1, 14: 10, 6: 1, 15: 1}
Did not match all atoms present	6365-83-9	CCC(C)C1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].[NH4+]	{1: 2, 2: 1, 3: 1, 38: 2, 14: 2}
Did not match all atoms present	63654-52-4	CCCCCCCCCCCCOS(=O)(=O)[O-].C[N+](C)(CCOC(=O)C=CC(=O)O)CC(=O)N	{1: 3, 2: 14, 6: 2, 22: 1, 24: 1, 27: 1, 28: 1, 29: 3, 30: 1}
Did not match all atoms present	63659-19-8	CC(C)NCC(COC1=CC=C(C=C1)CCOCC2CC2)O.Cl	{1: 2, 2: 5, 3: 2, 11: 2, 12: 1, 14: 4, 17: 1, 20: 1, 22: 2, 31: 1}
Did not match all atoms present	6366-06-9	CC1=CC(=CC(=C1)C#C)C	{1: 2, 10: 1, 14: 3, 9: 1}
Did not match all atoms present	6366-23-0	C[C@H](C(=O)O)OC1=CC=CC2=CC=CC=C21	{27: 1, 1: 1, 3: 1, 22: 1, 14: 7}
Did not match all atoms present	6366-24-1	CC1=C2C=CC(=CC2=CC3=C1C=CC4=CC=CC=C43)Cl	{1: 1, 14: 10, 17: 1}
Did not match all atoms present	63661-65-4	CC=CC1=CC(=C(C=C1)[O-])OC.[Na+]	{1: 2, 22: 1, 14: 3, 6: 2}
Did not match all atoms present	63665-72-5	CCN1C(=CC2=[N+](C3=C(C=C2)C=C(C=C3)C)CC)SC4=C1C5=CC=CC=C5C=C4.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 6: 1, 33: 2, 41: 1, 14: 15, 15: 1, 29: 3}
Did not match all atoms present	63665-74-7	CC1=CC(=O)N2C(=N1)N=C(N2)C(=O)OC	{32: 1, 1: 2, 35: 2, 33: 1, 14: 1, 25: 1, 28: 1}
Did not match all atoms present	63665-75-8	CC1=C(C=CC(=C1)C2(C3=CC=CC=C3S(=O)(=O)N2)C4=CC(=C(C=C4)O)C)O	{32: 1, 1: 2, 13: 1, 14: 10, 21: 2, 29: 2}
Did not match all atoms present	63665-80-5	C[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)C=C(C4=CC=CC=C4)Cl.[Cl-]	{1: 1, 6: 1, 33: 1, 41: 1, 7: 1, 14: 11, 17: 2}
Did not match all atoms present	63665-81-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C(=CC(=CC2=[N+](C3=C(S2)C=CC4=CC=CC=C43)C)C5=CC=CC=C5)SC6=C1C7=CC=CC=C7C=C6	{1: 3, 33: 2, 6: 2, 7: 1, 41: 2, 14: 21, 15: 1, 29: 3}
Did not match all atoms present	63665-87-2	CC1=C2CCCC2=C(C=C1)C(=O)C3=CC=CC4=CC=CC=C43	{24: 1, 1: 1, 11: 3, 14: 9}
Did not match all atoms present	63665-89-4	CCN1C(=CC2=[N+](C3=C(C=C2)C=C(C=C3)C)CC)SC4=C1C5=CC=CC=C5C=C4.[Br-]	{1: 3, 2: 2, 6: 1, 33: 2, 41: 1, 14: 11, 15: 1, 18: 1}
Did not match all atoms present	63665-90-7	CCCCCCCCCCCCCCCC(=O)OC1=C(C(=C2C(=C1)CC(C(O2)C)CCCC(C)CCCC(C)CCCC(C)C)C)C	{1: 8, 2: 23, 3: 3, 11: 1, 12: 2, 14: 1, 23: 1, 28: 1}
Did not match all atoms present	63665-91-8	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1(C2=C(N=CC=C2)N(C1=CC=C3C4=CC=CC=C4[N+](=C3C5=CC=CC=C5)CCC#N)C)C	{1: 4, 2: 2, 35: 1, 37: 1, 6: 2, 33: 2, 13: 1, 14: 16, 15: 3, 29: 3}
Did not match all atoms present	63665-92-9	CCOC(=O)C=C(NC1=C(C=C(C=C1)Cl)Cl)NNC2=C(C=C(C=C2Cl)Cl)Cl	{1: 1, 2: 1, 6: 1, 7: 1, 14: 5, 17: 5, 28: 1, 31: 3}
Did not match all atoms present	63665-95-2	CC1=NN(C(=C1[N+](=O)[O-])[O-])C2=CC=C(C=C2)[N+](=O)[O-].[Na+]	{1: 1, 35: 1, 38: 2, 14: 4, 33: 1}
Did not match all atoms present	63666-07-9	CNC1=CC=CC=C1NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 14: 6, 31: 2}
Did not match all atoms present	63666-09-1	CNC1=NC2=CC=CC=C2N=C1NC	{1: 2, 35: 2, 14: 4, 31: 2}
Did not match all atoms present	63666-11-5	CCOC(=O)C1=NC(=NN1)N	{32: 1, 1: 1, 2: 1, 35: 2, 28: 1, 30: 1}
Did not match all atoms present	63671-76-1	CCCCCCCCCCCCCCCCCCOC1=CC(=C(C(=C1)C2=CC=CC=C2)O)C3=CC=CC=C3	{1: 1, 2: 17, 22: 1, 21: 1, 14: 12}
Did not match all atoms present	63676-25-5	C1CCN(C1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O	{33: 1, 2: 2, 41: 1, 11: 4, 14: 11, 21: 2, 22: 1, 24: 1}
Did not match all atoms present	6368-72-5	CCNC1=C(C2=CC=CC=C2C=C1)N=NC3=CC=C(C=C3)N=NC4=CC=CC=C4	{1: 1, 2: 1, 34: 4, 14: 15, 31: 1}
Did not match all atoms present	6368-90-7	COC1=C(C=C(C(=C1)N)Cl)NC(=O)C2=CC=CC=C2	{1: 1, 14: 7, 17: 1, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6368-91-8	COC1=CC(=C(C=C1C#N)OC)N.Cl	{1: 2, 37: 1, 14: 2, 17: 1, 22: 2, 30: 1}
Did not match all atoms present	63680-58-0	C1=CC=C2C(=C1)C=CC(=N2)NCCCl.Cl	{17: 2, 2: 2, 35: 1, 14: 6, 31: 1}
Did not match all atoms present	63680-93-3	C1=CC=C(C=C1)CO/N=C/C2=CC=CC=N2	{34: 1, 35: 1, 6: 1, 2: 1, 14: 9, 22: 1}
Did not match all atoms present	63680-94-4	CCS(=O)(=O)O.C1=C/C(=C/N=O)/NC=C1	{32: 1, 1: 1, 2: 1, 6: 1, 34: 1, 14: 4, 15: 1, 20: 1, 29: 3}
Did not match all atoms present	63687-33-2	CC(C)C(C(C)(C)CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 4, 2: 1, 3: 2, 4: 1, 14: 4, 20: 2, 27: 2}
Did not match all atoms present	6369-32-0	C1=CC=C(C=C1)NC2=CC3=C(C=C2)C=C(/C(=N/NC4=CC=CC=C4C(=O)[O-])/C3=O)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 13, 15: 2, 24: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	6369-33-1	CCN(C1=CC(=C(C=C1)C)N/N=C/2\C(=CC3=C(C2=O)C=C(C=C3)NC4=CC=C(C=C4)OC)S(=O)(=O)[O-])C(=O)C.[Na+]	{1: 4, 2: 1, 33: 1, 34: 1, 14: 11, 15: 2, 22: 1, 24: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	63690-09-5	C1=CC(=CC=C1CC2=CC=C(C=C2)C(=N)N)C(=N)N	{2: 1, 36: 2, 30: 2, 14: 8, 7: 2}
Did not match all atoms present	63690-51-7	CCC1=CC=CC=C1C=C.CC1=NC=C(C=C1)C=C.C=CC1=CC=CC=C1C=C	{1: 2, 2: 1, 35: 1, 5: 4, 6: 4, 14: 11}
Did not match all atoms present	63696-99-1	CCOC(=O)[C@H](C)OS(=O)(=O)C	{1: 3, 2: 1, 3: 1, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	63699-79-6	CN1CC2CC(C1)C3=CC=CC(=O)N3C2	{1: 1, 33: 2, 11: 4, 12: 2, 14: 3, 25: 1}
Did not match all atoms present	637-01-4	CN(C)C1=CC=C(C=C1)N(C)C.Cl.Cl	{1: 4, 33: 2, 14: 4, 17: 2}
Did not match all atoms present	637-03-6	C1=CC=C(C=C1)[As]=O	{29: 1, 14: 5}
Did not match all atoms present	637-07-0	CCOC(=O)C(C)(C)OC1=CC=C(C=C1)Cl	{1: 3, 2: 1, 4: 1, 14: 4, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	637-12-7	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Al+3]	{24: 3, 1: 3, 2: 48}
Did not match all atoms present	637-27-4	CCC(=O)OC1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	637-44-5	C1=CC=C(C=C1)C#CC(=O)O	{10: 2, 27: 1, 14: 5}
Did not match all atoms present	637-47-8	CC1=CC=C(C=C1)NNC2=CC=C(C=C2)C	{1: 2, 14: 8, 31: 2}
Did not match all atoms present	637-50-3	C/C=C/C1=CC=CC=C1	{1: 1, 14: 5, 6: 2}
Did not match all atoms present	637-53-6	CC(=S)NC1=CC=CC=C1	{1: 1, 31: 1, 14: 5, 7: 1}
Did not match all atoms present	637-54-7	CCCCCCCCCCCCCCCCCC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 2: 16, 14: 5, 31: 1}
Did not match all atoms present	637-55-8	CCCCCCCCCCCCCCCCCC(=O)OC1=CC=CC=C1	{1: 1, 2: 16, 28: 1, 14: 5}
Did not match all atoms present	637-56-9	CCOC1=CC=C(C=C1)N.Cl	{1: 1, 2: 1, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	637-57-0	CC(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)[O-]	{1: 1, 6: 1, 38: 1, 7: 1, 14: 4, 24: 1}
Did not match all atoms present	637-58-1	CCCCOC1=CC=C(C=C1)OCCCN2CCOCC2.Cl	{1: 1, 2: 6, 33: 1, 11: 4, 14: 4, 17: 1, 22: 2, 23: 1}
Did not match all atoms present	637-59-2	C1=CC=C(C=C1)CCCBr	{2: 3, 18: 1, 14: 5}
Did not match all atoms present	637-60-5	CC1=CC=C(C=C1)NN.Cl	{1: 1, 31: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	637-69-4	COC1=CC=C(C=C1)C=C	{1: 1, 14: 4, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	637-86-5	CCCC(=O)[O-].CCCC(=O)[O-].[Mn+2]	{24: 2, 1: 2, 2: 4}
Did not match all atoms present	637-87-6	C1=CC(=CC=C1Cl)I	{17: 1, 19: 1, 14: 4}
Did not match all atoms present	637-89-8	C1=CC(=CC=C1O)S	{21: 1, 14: 4, 39: 1}
Did not match all atoms present	6370-12-3	COC1=CC=CC(=C1)C2C(=CNC=C2C(=O)OC)C(=O)OC	{32: 1, 1: 3, 12: 1, 14: 6, 15: 2, 22: 1, 28: 2}
Did not match all atoms present	6370-23-6	CC1=CC(=C(C=C1N)S(=O)(=O)O)C	{1: 2, 30: 1, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	6370-43-0	CC1=C/C(=N/NC2=CC=CC=C2C)/C(=O)C=C1	{1: 2, 34: 1, 14: 7, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	6370-58-7	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NC(=O)C5=CC=CC=C5	{24: 2, 25: 2, 21: 2, 14: 14, 31: 2}
Did not match all atoms present	63701-23-5	CC(C)CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCCC(C)C)S(=O)(=O)[O-].[NH4+]	{1: 4, 2: 18, 3: 2, 29: 3, 14: 5}
Did not match all atoms present	63701-24-6	CC(C)CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCCC(C)C)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 18, 3: 2, 29: 3, 14: 5}
Did not match all atoms present	6371-55-7	C1=CC=C(C(=C1)C(=O)O)N=NC2=CC=C(C=C2)N(CCO)CCO	{33: 1, 2: 4, 34: 2, 14: 8, 20: 2, 27: 1}
Did not match all atoms present	6371-76-2	C1=CC=C(C=C1)N/N=C\2/C(=O)C(=CC3=CC=CC=C23)C(=O)[O-].C1=CC=C(C=C1)N/N=C\2/C(=O)C(=CC3=CC=CC=C23)C(=O)[O-].[Ca+2]	{34: 2, 14: 20, 15: 4, 24: 2, 25: 2, 31: 2}
Did not match all atoms present	6371-84-2	CC1=CC(=C(C=C1)NN=C2C(=O)C=CC(=NNC3=CC=C(C=C3)S(=O)(=O)[O-])C2=O)C.[Na+]	{1: 2, 34: 2, 14: 9, 25: 2, 29: 3, 31: 2}
Did not match all atoms present	6371-96-6	CC1=CC=CC=C1NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)OC)[N+](=O)[O-]	{1: 3, 34: 2, 3: 1, 38: 1, 14: 7, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	63710-09-8	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)O)O[C@H]5C[C@@H]([C@@H](C(O5)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O)O)N(C)C)O	{1: 6, 2: 1, 33: 1, 11: 3, 12: 10, 13: 1, 14: 3, 20: 3, 21: 3, 22: 2, 23: 2, 25: 2, 28: 1}
Did not match all atoms present	63710-10-1	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@@H]([C@@H](O7)C)O)O)O)N(C)C)O	{1: 7, 2: 1, 33: 1, 11: 4, 12: 14, 13: 1, 14: 3, 20: 4, 21: 3, 22: 3, 23: 3, 25: 2, 28: 1}
Did not match all atoms present	63710-43-0	CC(C)NCCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].Cl.Cl	{1: 2, 2: 3, 3: 1, 38: 1, 14: 7, 17: 2, 35: 1, 31: 2}
Did not match all atoms present	63716-63-2	CC1=C(C(=CC(=C1)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4)Br)[O-])C)Br)O.[Na+]	{1: 2, 13: 1, 14: 8, 18: 2, 21: 1, 23: 1, 29: 2}
Did not match all atoms present	63716-96-1	C1CN2CCC1C(C2)OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4.C1CN2CCC1C(C2)OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4.O.O.OS(=O)(=O)O	{33: 2, 3: 2, 11: 10, 12: 4, 14: 20, 20: 2, 28: 2, 29: 2}
Did not match all atoms present	63717-27-1	C(CN)CNCCSP(=O)(O)O.O	{2: 5, 40: 1, 20: 2, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	63717-64-6	[Ag].[Au]	{}
Did not match all atoms present	6372-14-1	C1=CC=C(C=C1)C[C@@H](CO)NC(=O)OCC2=CC=CC=C2	{2: 3, 3: 1, 14: 10, 20: 1, 28: 1, 31: 1}
Did not match all atoms present	6372-40-3	CC(C)P(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 3: 1, 14: 10}
Did not match all atoms present	6372-41-4	CCCCP(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 3, 14: 10}
Did not match all atoms present	6372-42-5	C1CCC(CC1)P(C2=CC=CC=C2)C3=CC=CC=C3	{11: 5, 12: 1, 14: 10}
Did not match all atoms present	6372-44-7	CCCCP(CCCC)C1=CC=CC=C1	{1: 2, 2: 6, 14: 5}
Did not match all atoms present	6372-48-1	CPC1=CC=CC=C1	{1: 1, 14: 5}
Did not match all atoms present	6372-69-6	CN(C)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-].Cl[Zn]Cl	{1: 4, 35: 1, 33: 2, 41: 1, 14: 6, 17: 3}
Did not match all atoms present	63722-33-8	CC(=O)NC=C.C=CS(=O)(=O)[O-].[Na+]	{1: 1, 5: 2, 6: 2, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	63723-54-6	CC1=CC(=C2C3=C1NC(=O)C(=C3C4=CC=CC=C4C2=O)C(=O)C)Br	{32: 1, 1: 2, 14: 5, 18: 1, 24: 1, 25: 2}
Did not match all atoms present	6373-07-5	CCCCCCCCCCCCCCCCCC(=O)[O-].CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)O	{1: 5, 2: 20, 33: 2, 14: 10, 23: 1, 24: 1, 27: 1}
Did not match all atoms present	6373-10-0	C1=CC=C2C(=C1)C=CC=C2NN=C3C=CC4=C(C3=O)C=CC=C4S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC=C2NN=C3C=CC4=C(C3=O)C=CC=C4S(=O)(=O)[O-].[Ca+2]	{34: 2, 14: 24, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	6373-11-1	C1=CC=C2C(=C1)C=C3C=CC=C4C3=C2C(=O)C4=O	{25: 2, 14: 8}
Did not match all atoms present	6373-15-5	CC(=O)NC1=C(C=C(C=C1)N)N	{24: 1, 1: 1, 30: 2, 14: 3, 31: 1}
Did not match all atoms present	6373-16-6	CNC1=C2C(=C(C=C1)O)C(=O)C3=CC=CC=C3C2=O	{1: 1, 31: 1, 21: 1, 14: 6, 25: 2}
Did not match all atoms present	6373-20-2	C1=CC2=C(C=C1Cl)C(=O)C3=C4C2=CC(=C5C4=C(C=C3)C6=C7C5=C(C=C8C7=C(C=C6)C(=O)C9=C8C=CC(=C9)Cl)Cl)Cl	{17: 4, 14: 12, 25: 2}
Did not match all atoms present	6373-46-2	C1=CC=C(C=C1)COC2=CC=C(C=C2)N	{2: 1, 30: 1, 22: 1, 14: 9}
Did not match all atoms present	6373-50-8	C1CCC(CC1)C2=CC=C(C=C2)N	{11: 5, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	6373-73-5	C1=CC(=CC=C1N)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	6373-74-6	C1=CC=C(C=C1)NC2=C(C=C(C=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-].[Na+]	{38: 2, 29: 3, 14: 11, 31: 2}
Did not match all atoms present	6373-79-1	C1=CC=C(C=C1)NC2=C(C=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)C4=CC(=C(C=C4)NC5=CC(=C(C=C5)NC6=CC=CC=C6)S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{38: 2, 29: 8, 14: 22, 31: 4}
Did not match all atoms present	6373-95-1	CCN(CC)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])OC	{1: 3, 2: 2, 38: 1, 33: 1, 34: 2, 14: 7, 22: 1}
Did not match all atoms present	63732-07-0	CCCCCCCCCCCCS(=O)(=O)O.CN(CC[C@@H](CC(=O)N[C@H]1C=C[C@@H](O[C@@H]1C(=O)O)N2C=CC(=NC2=O)N)N)C(=N)N	{1: 2, 2: 14, 3: 1, 36: 1, 33: 2, 7: 1, 12: 3, 14: 4, 35: 1, 20: 1, 23: 1, 24: 1, 25: 1, 27: 1, 29: 2, 30: 3, 31: 1}
Did not match all atoms present	63732-31-0	B(OC1(CCCCC1)C2=CC=CC=C2)(OC3(CCCCC3)C4=CC=CC=C4)OC5(CCCCC5)C6=CC=CC=C6	{22: 3, 11: 15, 13: 3, 14: 15}
Did not match all atoms present	63732-42-3	C1CC[C@@]23CCN([C@@H]([C@@H]2C1)CC4=C3C=C(C=C4)O)CCC5=CC(=CC=C5)N.Cl	{33: 1, 2: 2, 11: 7, 12: 2, 13: 1, 14: 7, 17: 1, 21: 1, 30: 1}
Did not match all atoms present	63732-43-4	C1CC[C@@]23CCN([C@@H]([C@@H]2C1)CC4=C3C=C(C=C4)O)CCC5=CC=C(C=C5)N.Cl	{33: 1, 2: 2, 11: 7, 12: 2, 13: 1, 14: 7, 17: 1, 21: 1, 30: 1}
Did not match all atoms present	63732-56-9	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC6=C(C=C(C=C6)[N+](=O)[O-])[N+](=O)[O-])O[C@H]3[C@H](C=C4)O.Cl	{1: 1, 38: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 7, 17: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	63732-62-7	CN1CC[C@]23[C@@H]4C=C[C@H]([C@H]2[C@H]1CC5=C3C(=C(C=C5)OC)O4)O.Cl	{1: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	63732-63-8	C[N+]1(CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O)C.[Cl-]	{1: 3, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	63732-98-9	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Na+].[K+].[Bi+3].[Bi+3]	{24: 4, 3: 4, 20: 4}
Did not match all atoms present	63734-62-3	C1=CC(=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C(=O)O	{4: 1, 14: 7, 16: 3, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	63738-22-7	C1C(O1)CN(CC2CO2)CC3=CC(=CC=C3)CN(CC4CO4)CC5CO5	{33: 2, 2: 6, 11: 4, 12: 4, 14: 4, 23: 4}
Did not match all atoms present	6374-21-6	CC[Si](C)Cl	{1: 2, 2: 1, 17: 1}
Did not match all atoms present	6374-49-8	C1=CC2=C3C(=C1)C4=C(C3=CC=C2)C=C(C=C4)CCCC(=O)O	{2: 3, 27: 1, 14: 9}
Did not match all atoms present	6374-83-0	CC(=O)N(C)C1=C2C(=C(C=C1)Br)C(=O)C3=CC=CC=C3C2=O	{1: 2, 33: 1, 14: 6, 18: 1, 24: 1, 25: 2}
Did not match all atoms present	63741-10-6	CCN(CCCl)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)C	{1: 2, 2: 3, 38: 1, 33: 1, 34: 2, 14: 5, 17: 3}
Did not match all atoms present	6375-16-2	CC1=C(C=C(C=C1)NC(=O)C)N	{24: 1, 1: 2, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	6375-17-3	CC1=CC(=C(C=C1)O)NC(=O)C	{24: 1, 1: 2, 21: 1, 14: 3, 31: 1}
Did not match all atoms present	6375-27-5	CC(=O)CC(=O)NC1=C(C=CC(=C1)OC)OC	{1: 3, 2: 1, 14: 3, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	6375-47-9	CC(=O)NC1=CC(=C(C=C1)OC)N	{1: 2, 14: 3, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6375-55-9	CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C6=CC=CC=C6.[Na+].[Na+]	{1: 2, 34: 4, 35: 2, 33: 2, 12: 2, 14: 16, 15: 2, 25: 2, 29: 6}
Did not match all atoms present	6375-61-7	C1=CC(=C(C=C1Cl)[N+](=O)[O-])SCC(=O)O	{2: 1, 38: 1, 40: 1, 14: 3, 17: 1, 27: 1}
Did not match all atoms present	6375-75-3	CCN(CC)C1=CC(=CC=C1)Cl	{1: 2, 2: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	63753-10-6	CCCCCCCCCC1=CC(=C(C=C1)O)C=O	{1: 1, 2: 8, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	6376-14-3	CC1=CC(=C(C=C1Cl)OC)N	{1: 2, 30: 1, 22: 1, 14: 2, 17: 1}
Did not match all atoms present	6376-26-7	CCN(CC)CCOC1=CC=CC=C1C(=O)NC2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 14: 9, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	6376-86-9	C1=CC=C(C=C1)OCCOC2=CC=C(C=C2)/C=C\3/C(=O)N=C(S3)N	{2: 2, 35: 1, 6: 1, 41: 1, 14: 9, 15: 2, 22: 2, 25: 1, 30: 1}
Did not match all atoms present	63762-79-8	CC1=CC(=C(C=C1)F)O	{16: 1, 1: 1, 21: 1, 14: 3}
Did not match all atoms present	63765-69-5	C1C2CC3CC1CC(C2)(C3)NC(C(F)(F)F)(C(F)(F)F)O.C1C2CC3CC1CC(C2)(C3)NC(C(F)(F)F)(C(F)(F)F)O.O.O.O	{4: 6, 11: 12, 12: 6, 13: 2, 16: 12, 20: 2, 31: 2}
Did not match all atoms present	63765-88-8	CCC(=O)C(CC[NH+]1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{1: 1, 2: 3, 4: 1, 11: 4, 14: 10, 17: 1, 23: 1, 24: 1}
Did not match all atoms present	63766-15-4	C1=CC=C2C=C(C(=CC2=C1)CC3=CC4=CC=CC=C4C=C3S(=O)(=O)[O-])S(=O)(=O)[O-].[Hg+2]	{2: 1, 29: 6, 14: 12}
Did not match all atoms present	6377-18-0	C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)OC2=CC=CC3=C2C4=C5C6=C(C=CC(=C6C(=O)O4)C)OC(=O)C5=C3O)O[C@@H]7[C@@H]([C@H]([C@H]([C@H](O7)C)O)OC)O)O)O	{1: 4, 12: 10, 14: 5, 20: 4, 21: 1, 22: 3, 23: 2, 28: 2}
Did not match all atoms present	63771-33-5	[NH4+].[NH4+].O.Cl[Rh-2](Cl)(Cl)(Cl)Cl	{17: 5}
Did not match all atoms present	63774-55-0	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Mg+2].[Mg+2].[Al+3].[Al+3].[Ba+2].[Ba+2]	{}
Did not match all atoms present	6378-11-6	CCOS(=O)Cl	{1: 1, 2: 1, 29: 1, 22: 1, 17: 1}
Did not match all atoms present	6378-89-8	CCN(CC)C1=C(C=C(C=C1)NC2=CC3=[N+](C4=C(C=CC(=C4)N(CC)CC5=CC(=CC=C5)S(=O)(=O)[O-])N=C3C6=CC=CC=C62)C7=CC=CC=C7)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 4, 35: 1, 33: 3, 14: 20, 29: 6, 31: 1}
Did not match all atoms present	6378-90-1	CC(=O)NC1=C(C=C(C=C1)C2=CC(=C(C=C2)NC(=O)C)[N+](=O)[O-])[N+](=O)[O-]	{24: 2, 1: 2, 38: 2, 14: 6, 31: 2}
Did not match all atoms present	6379-37-9	CCCCCCCC[NH3+].C[As](=O)(O)[O-]	{1: 2, 2: 7, 20: 1, 29: 2}
Did not match all atoms present	6379-46-0	C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)Cl)Cl)[N+](=O)[O-]	{17: 3, 38: 2, 14: 1}
Did not match all atoms present	6379-47-1	CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Mn+2]	{1: 4, 33: 2, 7: 2}
Did not match all atoms present	6379-72-2	C/C=C/C1=CC(=C(C=C1)OC)OC	{1: 3, 22: 2, 14: 3, 6: 2}
Did not match all atoms present	6379-73-3	CC1=C(C=C(C=C1)C(C)C)OC	{1: 4, 3: 1, 22: 1, 14: 3}
Did not match all atoms present	63799-11-1	CC[C@H](C)CC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 2, 2: 2, 3: 1, 37: 1, 14: 8}
Did not match all atoms present	638-00-6	CC1=CC(=CS1)C	{1: 2, 14: 2, 41: 1}
Did not match all atoms present	638-02-8	CC1=CC=C(S1)C	{1: 2, 14: 2, 41: 1}
Did not match all atoms present	638-03-9	CC1=CC(=CC=C1)N.Cl	{1: 1, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	638-16-4	C1(=S)NC(=S)NC(=S)N1	{32: 3}
Did not match all atoms present	638-21-1	C1=CC=C(C=C1)P	{14: 5}
Did not match all atoms present	638-38-0	CC(=O)[O-].CC(=O)[O-].[Mn+2]	{24: 2, 1: 2}
Did not match all atoms present	638-39-1	CC(=O)[O-].CC(=O)[O-].[Sn+2]	{24: 2, 1: 2}
Did not match all atoms present	638-49-3	CCCCCOC=O	{1: 1, 2: 4, 26: 1}
Did not match all atoms present	6380-21-8	CC=CC1=CC=CC=C1O	{1: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	6380-23-0	COC1=C(C=C(C=C1)C=C)OC	{1: 2, 14: 3, 22: 2, 5: 1, 6: 1}
Did not match all atoms present	6380-28-5	CC1=C(C=C(C=C1)C(C)C)OC(=O)C	{1: 4, 3: 1, 28: 1, 14: 3}
Did not match all atoms present	6380-34-3	C1=CC=C(C=C1)[As](I)I	{19: 2, 14: 5}
Did not match all atoms present	6380-63-8	CC(C#N)OC(=O)C1=CC=CC=C1C(=O)OC(C)C#N	{1: 2, 3: 2, 28: 2, 37: 2, 14: 4}
Did not match all atoms present	6381-59-5	C(C(C(=O)[O-])O)(C(=O)[O-])O.O.O.O.O.[Na+].[K+]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	6381-77-7	C([C@H]([C@@H]1C(=C(C(=O)O1)O)[O-])O)O.[Na+]	{2: 1, 3: 1, 12: 1, 15: 2, 20: 3, 28: 1}
Did not match all atoms present	6381-79-9	C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.[K+].[K+].[K+].[K+]	{24: 2}
Did not match all atoms present	63810-51-5	COCCOC1=C(C=CC(=C1)[N+](=O)[O-])N	{1: 1, 2: 2, 38: 1, 14: 3, 22: 2, 30: 1}
Did not match all atoms present	63811-40-5	C(=CC=C1C(=O)NC(=S)NC1=O)C=CC2=C(NC(=S)NC2=O)O	{32: 4, 25: 3, 21: 1, 6: 5, 15: 2}
Did not match all atoms present	63815-56-5	CC1=CC=CC=C1CNC(=O)/C=C/C2=CC=CC=C2	{1: 1, 2: 1, 6: 2, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	63815-60-1	CC[C@@H](C)COC(=O)/C(=C/C1=CC=C(C=C1)N)/C	{1: 3, 2: 2, 3: 1, 6: 1, 7: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	63815-64-5	CC/C(=C\C1=[N+](C2=C([Se]1)C=CC(=C2)OC)CC)/C=C\3/N(C4=C(S3)C=C(C(=C4)C)OC)CCCCS(=O)(=O)[O-]	{1: 5, 2: 6, 33: 2, 6: 2, 7: 1, 41: 1, 14: 5, 15: 1, 22: 2, 29: 3}
Did not match all atoms present	63815-65-6	CC1=CC2=C(C=C1OC)SC(=[N+]2CCCCS(=O)(=O)[O-])C	{1: 3, 2: 4, 33: 1, 41: 1, 14: 2, 22: 1, 29: 3}
Did not match all atoms present	63815-66-7	CC1=CC2=C(C=C1OC)SC(=[N+]2CCCCS(=O)(=O)[O-])C.[Na+].[Cl-]	{1: 3, 2: 4, 33: 1, 41: 1, 14: 2, 17: 1, 22: 1, 29: 3}
Did not match all atoms present	63815-67-8	CC[N+]1=C(C=CC2=C1C=CC(=C2)OC)C=C3N(C4=C(S3)C=CC(=C4)C(F)(F)F)CCCCS(=O)(=O)[O-]	{1: 2, 2: 5, 4: 1, 6: 1, 33: 2, 41: 1, 14: 8, 15: 1, 16: 3, 22: 1, 29: 3}
Did not match all atoms present	63815-68-9	CC1=[N+](C2=C(S1)C=CC(=C2)C(F)(F)F)CCCCS(=O)(=O)[O-]	{1: 1, 2: 4, 4: 1, 33: 1, 41: 1, 14: 3, 16: 3, 29: 3}
Did not match all atoms present	63815-69-0	CC1=[N+](C2=C(N1CCCCS(=O)(=O)[O-])C=C(C=C2)C(F)(F)F)C	{1: 2, 2: 4, 4: 1, 33: 2, 14: 3, 16: 3, 29: 3}
Did not match all atoms present	63815-72-5	CC1=NC2=C(N1C)C=CC(=C2)C(F)(F)F	{1: 2, 35: 1, 4: 1, 33: 1, 14: 3, 16: 3}
Did not match all atoms present	63815-75-8	COC1=CC2=C(C=C1)[N+](=C(C=C2)C=C3N(C4=CC=CC=C4[Se]3)CCCCS(=O)(=O)[O-])CC5=CC=CC=C5	{1: 1, 2: 5, 6: 1, 33: 2, 14: 14, 15: 1, 22: 1, 29: 3}
Did not match all atoms present	63815-76-9	CC1=[N+](C2=C([Se]1)C=CC(=C2)OC)CCCCS(=O)(=O)[O-]	{1: 2, 2: 4, 33: 1, 14: 3, 22: 1, 29: 3}
Did not match all atoms present	63815-77-0	C[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)C=C(C4=CC=CS4)Cl.[Cl-]	{1: 1, 6: 1, 33: 1, 41: 2, 7: 1, 14: 9, 17: 2}
Did not match all atoms present	63815-78-1	CN1C(=CC(=O)C2=CC=CS2)SC3=C1C4=CC=CC=C4C=C3	{1: 1, 6: 1, 33: 1, 41: 2, 14: 9, 15: 1, 24: 1}
Did not match all atoms present	63815-79-2	CN1C2=C(C=CC3=CC=CC=C32)SC1=C(C(=O)C4=CC=CS4)C(=O)C5=CC=CS5	{1: 1, 33: 1, 41: 3, 7: 1, 14: 12, 15: 1, 24: 2}
Did not match all atoms present	63815-80-5	CC1=[N+](C2=CC=CC=C2[Se]1)CCCCS(=O)(=O)[O-]	{1: 1, 2: 4, 29: 3, 14: 4, 33: 1}
Did not match all atoms present	63815-81-6	CC1=[N+](C2=C(S1)C=C(C=C2)OC)CCO.[Br-]	{1: 2, 2: 2, 33: 1, 41: 1, 14: 3, 18: 1, 20: 1, 22: 1}
Did not match all atoms present	63815-82-7	COC1=CC2=C(C=C1)N(C(=CC=CC=CC3=[N+](C4=C(S3)C=C(C=C4)OC)CCO)S2)CCO.[Br-]	{1: 2, 2: 4, 6: 5, 33: 2, 41: 2, 14: 6, 15: 1, 18: 1, 20: 2, 22: 2}
Did not match all atoms present	63815-83-8	CCN1C2=C(C=C(C(=C2)C)OC)SC1=CC(=CC3=[N+](C4=C(S3)C=CC5=CC=CC=C54)C)C6=CC=CS6.[I-]	{1: 4, 2: 1, 33: 2, 6: 2, 7: 1, 41: 3, 14: 11, 15: 1, 19: 1, 22: 1}
Did not match all atoms present	63815-85-0	CC1=[N+](C2=C(N1CCCS(=O)(=O)[O-])C=C(C=C2)C(F)(F)F)C	{1: 2, 2: 3, 4: 1, 33: 2, 14: 3, 16: 3, 29: 3}
Did not match all atoms present	63815-86-1	CN1C2=C(C=C(C=C2)C(F)(F)F)N(C1=CC=CC3=[N+](C4=C(N3CCCS(=O)(=O)[O-])C=C(C=C4)C(F)(F)F)C)CCCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 6, 4: 2, 6: 3, 33: 4, 14: 6, 15: 1, 16: 6, 29: 6}
Did not match all atoms present	63815-90-7	C1=CC=C(C=C1)CN2C3=CC=CC=C3OC2=CC=C4C(=O)N(C(=S)S4)CC(=O)O	{33: 2, 2: 2, 6: 2, 41: 1, 14: 9, 15: 3, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	63815-92-9	CC1=[N+](C2=CC=CC=C2O1)CC3=CC=CC=C3.[Br-]	{1: 1, 2: 1, 33: 1, 14: 9, 18: 1, 23: 1}
Did not match all atoms present	63815-93-0	CCC(=CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)C)SC.[I-]	{1: 3, 2: 1, 33: 1, 6: 1, 7: 1, 40: 1, 41: 1, 14: 6, 19: 1}
Did not match all atoms present	63815-94-1	CCC(=CC1=[N+](C2=C(S1)C=C(C(=C2)C)OC)CCO)C=C3N(C4=C(S3)C=C(C(=C4)C)OC)CC.[I-]	{1: 6, 2: 4, 33: 2, 6: 2, 7: 1, 41: 2, 14: 4, 15: 1, 19: 1, 20: 1, 22: 2}
Did not match all atoms present	63815-96-3	CC1=C(C=CC(=C1)NC(=S)C)OC	{1: 3, 31: 1, 22: 1, 14: 3, 7: 1}
Did not match all atoms present	63815-97-4	CC1=CC2=C(C=C1OC)SC(=[N+]2CCCS(=O)(=O)[O-])C	{1: 3, 2: 3, 33: 1, 41: 1, 14: 2, 22: 1, 29: 3}
Did not match all atoms present	63815-98-5	CC/C(=C\C1=[N+](C2=C([Se]1)C=CC(=C2)OC)CC)/C=C\3/N(C4=C(S3)C=C(C(=C4)C)OC)CCCS(=O)(=O)[O-]	{1: 5, 2: 5, 33: 2, 6: 2, 7: 1, 41: 1, 14: 5, 15: 1, 22: 2, 29: 3}
Did not match all atoms present	63815-99-6	CC1=CC2=C(C=C1OC)SC(=[N+]2CCO)C.[Br-]	{1: 3, 2: 2, 33: 1, 41: 1, 14: 2, 18: 1, 20: 1, 22: 1}
Did not match all atoms present	63816-04-6	CCN1C(=[N+](C2=C1C=C(C(=C2)C(F)(F)F)Cl)CCCCS(=O)(=O)[O-])C	{1: 2, 2: 5, 4: 1, 33: 2, 14: 2, 16: 3, 17: 1, 29: 3}
Did not match all atoms present	63816-06-8	CCN1C(=C(C(=O)N1C2=CC=CC=C2)/C=C/C3N(C4=NC5=C(C=C(C=C5)Cl)N=C4N3C6=CC=CC=C6)C7=CC=CC=C7)C.OCl(=O)(=O)=O	{1: 2, 2: 1, 35: 2, 6: 2, 33: 4, 12: 1, 14: 18, 17: 2, 20: 1, 25: 1, 29: 3}
Did not match all atoms present	63816-08-0	CCSC1=[N+](C2=C(C=C1)C=C(C=C2)OC)CC3=CC=CC=C3.[I-]	{1: 2, 2: 2, 33: 1, 40: 1, 14: 10, 19: 1, 22: 1}
Did not match all atoms present	63816-09-1	COC1=CC2=C(C=C1)N(C(=O)C=C2)CC3=CC=CC=C3	{1: 1, 2: 1, 33: 1, 14: 10, 22: 1, 25: 1}
Did not match all atoms present	63816-11-5	CC1=[N+](C2=C(S1)C=C(C=C2)Cl)CC(=O)O.[Br-]	{1: 1, 2: 1, 33: 1, 41: 1, 14: 3, 17: 1, 18: 1, 27: 1}
Did not match all atoms present	63816-12-6	CCN1C2=C(C=CC1=O)C=C(C=C2)OC	{1: 2, 2: 1, 33: 1, 14: 5, 22: 1, 25: 1}
Did not match all atoms present	63816-13-7	CC[N+]1=C(C=CC2=C1C=CC(=C2)OC)SCC.[I-]	{1: 3, 2: 2, 33: 1, 40: 1, 14: 5, 19: 1, 22: 1}
Did not match all atoms present	63816-14-8	COC1=CC(=C(C=C1)[Se]C#N)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 3, 37: 1}
Did not match all atoms present	63816-15-9	COC1=CC(=C(C=C1)[Se][Se]C2=C(C=C(C=C2)OC)N)N	{1: 2, 30: 2, 22: 2, 14: 6}
Did not match all atoms present	63816-16-0	CCC(=CC1=[N+](C2=C(S1)C=C(C=C2)C)CC)C=C3N(C4=C([Se]3)C=CC(=C4)OC)CC.[I-]	{1: 5, 2: 3, 33: 2, 6: 2, 7: 1, 41: 1, 14: 6, 15: 1, 19: 1, 22: 1}
Did not match all atoms present	63816-17-1	CCC(=CC1=[N+](C2=C([Se]1)C=CC(=C2)OC)CC)SC.[I-]	{1: 4, 2: 2, 33: 1, 6: 1, 7: 1, 40: 1, 14: 3, 19: 1, 22: 1}
Did not match all atoms present	63816-18-2	CC1=NC2=C(O1)C=C(C=C2)Cl	{1: 1, 23: 1, 35: 1, 14: 3, 17: 1}
Did not match all atoms present	63816-19-3	CC1=[N+](C2=C(O1)C=C(C=C2)Cl)C.[I-]	{1: 2, 33: 1, 14: 3, 17: 1, 19: 1, 23: 1}
Did not match all atoms present	63816-20-6	C[N+]1=C(OC2=C1C=CC(=C2)Cl)C=CNC3=CC=CC=C3.[I-]	{1: 1, 6: 2, 33: 1, 14: 8, 17: 1, 19: 1, 23: 1, 31: 1}
Did not match all atoms present	6382-01-0	C(CC(=O)[O-])[C@@H](C(=O)O)N.O.[K+]	{24: 1, 27: 1, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	6382-07-6	CCC(C)(C)C1=CC=C(C=C1)OCCO	{1: 3, 2: 3, 4: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	6382-12-3	CCCCCO[Si](OCCCCC)(OCCCCC)OCCCCC	{1: 4, 2: 16, 22: 4}
Did not match all atoms present	6382-14-5	CCCCCOCC1=CC=CC=C1	{1: 1, 2: 5, 22: 1, 14: 5}
Did not match all atoms present	6382-93-0	C1=CC=C(C=C1)COC(=O)N[C@H](CCCN=C(N)N)C(=O)O	{2: 4, 3: 1, 7: 1, 34: 1, 14: 5, 27: 1, 28: 1, 30: 2, 31: 1}
Did not match all atoms present	63823-06-3	CO[Si](CCCSC=C)(OC)OC	{1: 3, 2: 3, 5: 1, 6: 1, 40: 1, 22: 3}
Did not match all atoms present	6383-11-5	C1=CC=C2C(=C1)C(=O)C2=O	{25: 2, 14: 4}
Did not match all atoms present	6383-59-1	C1=CC=C(C(=C1)/C=N/O)C(=O)O	{34: 1, 27: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	6383-73-9	C1=CC=C2C(=C1)C(=O)N(C2=O)C(CCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O	{33: 1, 2: 2, 3: 1, 38: 1, 14: 8, 24: 1, 25: 2, 27: 1, 31: 1}
Did not match all atoms present	63831-93-6	CC1=C(C=C(C=C1)Cl)C(C)C	{1: 3, 3: 1, 14: 3, 17: 1}
Did not match all atoms present	63833-90-9	CCNC(=O)C(C1=CC=CO1)O	{1: 1, 2: 1, 3: 1, 14: 3, 20: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	63833-98-7	CC(CN1C2=C(C=C(C=C2)C#N)SC3=CC=CC=C31)CN(C)C.C(=C\C(=O)O)\C(=O)O	{1: 3, 2: 2, 3: 1, 37: 1, 6: 2, 33: 2, 41: 1, 14: 7, 27: 2}
Did not match all atoms present	63834-71-9	CCCC1=C(C(=CC=C1)Cl)OCC(CO)O	{1: 1, 2: 4, 3: 1, 14: 3, 17: 1, 20: 2, 22: 1}
Did not match all atoms present	63835-91-6	C[Si](C)(C)[CH2-].C[Si](C)(C)[CH2-].[Cd+2]	{1: 6, 5: 2}
Did not match all atoms present	63837-33-2	CCC1OCC(O1)COC2=CC=C(C=C2)OC3=CC=CC=C3	{1: 1, 2: 2, 11: 1, 12: 2, 14: 9, 22: 2, 23: 2}
Did not match all atoms present	63843-89-0	CCCCC(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)(C(=O)OC2CC(N(C(C2)(C)C)C)(C)C)C(=O)OC3CC(N(C(C3)(C)C)C)(C)C	{1: 17, 2: 4, 4: 3, 33: 2, 11: 4, 12: 2, 13: 4, 14: 2, 21: 1, 28: 2}
Did not match all atoms present	63845-31-8	COC1=CC2=C(C=C1)NC=C2C(=O)C[NH+]3CCCCC3.[Cl-]	{32: 1, 1: 1, 2: 1, 11: 5, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	6385-02-0	CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)[O-])Cl.[Na+]	{24: 1, 1: 1, 31: 1, 14: 6, 17: 2}
Did not match all atoms present	63856-99-5	C\1CC(=C(/C1=C/NC2=CC=CC=C2)Cl)C=NC3=CC=CC=C3.Cl	{34: 1, 6: 2, 11: 2, 14: 10, 15: 3, 17: 2, 31: 1}
Did not match all atoms present	6386-73-8	CC(C)(C1=CC(=C(C=C1)O)Br)C2=CC(=C(C(=C2)Br)O)Br	{1: 2, 18: 3, 4: 1, 21: 2, 14: 5}
Did not match all atoms present	6386-80-7	C1=CC(=CC2=C1C=CS2)C=O	{41: 1, 26: 1, 14: 5}
Did not match all atoms present	63861-55-2	C1=CC=C(C(=C1)C(=O)O)N.C1=CC=C(C(=C1)C(=O)O)N.C(CO)O.[Ti]	{2: 2, 27: 2, 20: 2, 30: 2, 14: 8}
Did not match all atoms present	63867-52-7	C1=CC=C(C=C1)C2=C(OC(=N2)N(CCO)CCO)C3=CC=CC=C3.O	{33: 1, 2: 4, 35: 1, 14: 10, 20: 2, 23: 1}
Did not match all atoms present	63868-62-2	CC1C(OCCN1C)C2=CC=CC=C2.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 2, 3: 4, 33: 1, 11: 2, 12: 2, 14: 5, 20: 4, 23: 1, 27: 4}
Did not match all atoms present	63868-81-5	CC1=C[N+](=CC=C1)CC(=O)C2=CC=C(C=C2)C(=O)C[N+]3=CC=CC(=C3)C.[Br-].[Br-]	{1: 2, 2: 2, 33: 2, 14: 12, 18: 2, 24: 2}
Did not match all atoms present	63868-82-6	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])N)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])[O-])N)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])[O-])N)[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])[O-])N)[N+](=O)[O-].[Zr+4]	{38: 8, 30: 4, 14: 8}
Did not match all atoms present	63868-93-9	CCCCCCCOP(=O)OCCCCCCC.CC(=O)O[Hg]	{1: 3, 2: 12, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	63868-94-0	CCCCCCOP(=O)OCCCCCC.CC(=O)O[Hg]	{1: 3, 2: 10, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	63868-95-1	CC(=O)O[Hg]C1=CC=CC=C1[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	63868-96-2	COC1=CC=CC(=C1)C(=O)N(CC(C[Hg])O)C(=O)O.O	{1: 1, 2: 2, 3: 1, 33: 1, 14: 4, 20: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	63868-98-4	COC1=CC=C(C=C1)C(=O)N(CC(C[Hg])O)C(=O)O.O	{1: 1, 2: 2, 3: 1, 33: 1, 14: 4, 20: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	63869-00-1	CN1C2=C(C(=O)N(C1=O)C)NC=N2.COC1=CC=CC=C1C(=O)N(CC(C[Hg])OC)C(=O)[O-].O.[Na+]	{32: 1, 1: 4, 2: 2, 3: 1, 33: 3, 14: 5, 35: 1, 22: 2, 24: 2, 25: 2}
Did not match all atoms present	63869-01-2	CCCCOP(=O)OCCCC.Cl[Hg]	{1: 2, 2: 6, 29: 1, 22: 2, 17: 1}
Did not match all atoms present	63869-02-3	CC(C)OP(=O)OC(C)C.Cl[Hg]	{1: 4, 3: 2, 29: 1, 22: 2, 17: 1}
Did not match all atoms present	63869-04-5	C1=CC=C(C(=C1)O)[Hg].O	{21: 1, 14: 4}
Did not match all atoms present	63869-05-6	CC1=CC=C(C=C1)S(=O)(=O)N(S(=O)(=O)C2=CC=C(C=C2)C)[Hg]C	{1: 3, 29: 4, 14: 8, 33: 1}
Did not match all atoms present	63869-06-7	CC1=CC=C(C=C1)S(=O)(=O)O[Hg]C	{1: 2, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	63869-07-8	CC1=CC=C(C=C1)N(S(=O)(=O)C2=C(C=CC(=C2)C(C)C)C)[Hg]C	{1: 5, 3: 1, 29: 2, 14: 7, 33: 1}
Did not match all atoms present	63869-08-9	C1=CC=C(C=C1)[Hg]CCCCCCCCCCCCSCCCCCCCCCCCC[Hg]C2=CC=CC=C2	{40: 1, 2: 24, 14: 10}
Did not match all atoms present	63869-14-7	C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.C1C2CC3CC1CC(C2)(C3)N=C(CSS(=O)(=O)O)N.O	{2: 4, 34: 4, 7: 4, 40: 4, 11: 24, 12: 12, 13: 4, 20: 4, 29: 8, 30: 4}
Did not match all atoms present	63869-15-8	C[As](=O)([O-])[O-].[Hg].[Hg]	{1: 1, 29: 3}
Did not match all atoms present	63869-87-4	C[Sn](C)(C)OS(=O)(=O)O	{1: 3, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	63869-91-0	[H+].C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Tm+3]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	6387-14-0	CC1=CC(=CC(=C1N)Cl)S(=O)(=O)O	{1: 1, 14: 2, 17: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	6387-27-5	CC1=C(C=C(C=C1N)S(=O)(=O)O)Cl	{1: 1, 14: 2, 17: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	63870-02-0	CC1=CC(=O)NC2=CC=CC=C2S1	{32: 1, 1: 1, 41: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	63870-18-8	C1=CC(=C(C(=C1)[N+]2=CC=CC(=C2)C(=O)O)CO)C=O.[Cl-]	{33: 1, 2: 1, 14: 7, 17: 1, 20: 1, 26: 1, 27: 1}
Did not match all atoms present	63870-20-2	CC(=O)OC=C.C=CC1=CC=CC=C1.C=CC(=O)O	{1: 1, 5: 3, 6: 3, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	63870-27-9	C[N+](C)(CCCN)CC=C.C1C(O1)CCl.[Cl-]	{1: 2, 2: 5, 5: 1, 6: 1, 11: 1, 12: 1, 17: 2, 23: 1, 30: 1}
Did not match all atoms present	63870-29-1	CCOC(=O)CN1CC(=O)N(C1=S)C2=CC=CC=C2	{1: 1, 2: 2, 33: 2, 11: 1, 14: 5, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	63870-30-4	CC[N+]1=C(OC2=CC=CC=C21)C=CNC3=CC=CC=C3.[I-]	{1: 1, 2: 1, 6: 2, 33: 1, 14: 9, 19: 1, 23: 1, 31: 1}
Did not match all atoms present	63870-31-5	CCN1CCSC1=CC=CC2=[N+](C3=C(O2)C=C(C(=C3)C)C)CC.[I-]	{1: 4, 2: 2, 6: 3, 33: 2, 41: 1, 11: 2, 14: 2, 15: 1, 19: 1, 23: 1}
Did not match all atoms present	63870-32-6	CC[N+]1=C(C=CC2=C1C=CC(=C2)OC)C=C3N(C4=C(S3)C=CC(=C4)Cl)CC(=O)[O-]	{1: 2, 2: 2, 6: 1, 33: 2, 41: 1, 14: 8, 15: 1, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	63870-33-7	CCN1C2=C(C=C(C=C2)N=C3C(=C(C(=NC4=CC5=C(C=C4)N(C6=CC=CC=C65)CC)C(=C3Cl)Cl)Cl)Cl)C7=CC=CC=C71	{1: 2, 2: 2, 33: 2, 34: 2, 14: 14, 15: 6, 17: 4}
Did not match all atoms present	63870-34-8	CC1=C(C(=O)N(N1)C2=CC=C(C=C2)S(=O)(=O)[O-])/C=C/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C.[Na+].[Na+]	{32: 1, 1: 2, 35: 1, 6: 3, 33: 2, 14: 8, 15: 2, 25: 2, 29: 6}
Did not match all atoms present	63870-36-0	CCCCCCCCCCOC1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC(=O)C)S(=O)(=O)NCC)S(=O)(=O)NCC	{1: 4, 2: 11, 34: 1, 14: 7, 15: 2, 22: 1, 24: 1, 25: 1, 29: 4, 31: 4}
Did not match all atoms present	63870-37-1	C1=CC2=C(C=CC3=NNN=C23)C(=C1)S(=O)(=O)O	{32: 1, 35: 2, 20: 1, 29: 2, 14: 5}
Did not match all atoms present	63870-38-2	CC1=CC(=O)N2C(=N1)N=C(N2)CO	{32: 1, 1: 1, 2: 1, 35: 2, 33: 1, 14: 1, 20: 1, 25: 1}
Did not match all atoms present	63870-40-6	CC[N+]1=C(SCC1)C=CNC2=CC=CC=C2.[I-]	{1: 1, 2: 1, 6: 2, 33: 1, 41: 1, 11: 2, 14: 5, 15: 1, 19: 1, 31: 1}
Did not match all atoms present	63870-43-9	CCC(=CC1=[N+](C2=CC=CC=C2S1)CC)SC.[I-]	{1: 3, 2: 2, 33: 1, 6: 1, 7: 1, 40: 1, 41: 1, 14: 4, 19: 1}
Did not match all atoms present	63870-44-0	C1=CC=C(C(=C1)N)[Se][Se]C2=CC=CC=C2N	{30: 2, 14: 8}
Did not match all atoms present	63870-45-1	CCC(=CC1=[N+](C2=CC=CC=C2S1)CC)C=C3N(C4=C(O3)C=C(C(=C4)C)C)CC.[I-]	{1: 5, 2: 3, 33: 2, 6: 2, 7: 1, 41: 1, 14: 6, 15: 1, 19: 1, 23: 1}
Did not match all atoms present	63870-48-4	CCN1C2=CC=CC=C2[Se]C1=CC3=[N+](C4=C(C=C3)C=C(C=C4)C)CC.[I-]	{1: 3, 2: 2, 6: 1, 33: 2, 14: 9, 15: 1, 19: 1}
Did not match all atoms present	63870-49-5	CC[N+]1=C(OC2=C1C=C(C=C2)C3=CC=CC=C3)C.CCOS(=O)(=O)[O-]	{1: 3, 2: 2, 33: 1, 14: 8, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	63870-51-9	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C=C2OC(=O)C)S(=O)(=O)O	{1: 2, 14: 4, 20: 2, 24: 1, 28: 1, 29: 4, 31: 1}
Did not match all atoms present	63870-52-0	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)Cl)C=C(C=C2OC(=O)C)S(=O)(=O)Cl	{1: 2, 14: 4, 17: 2, 24: 1, 28: 1, 29: 4, 31: 1}
Did not match all atoms present	63870-54-2	CCC(=CC1=[N+](C2=C(S1)C=C(C(=C2)C)OC)CCC(=O)O)C=C3N(C4=C(S3)C=CC(=C4)Cl)CC.[I-]	{1: 4, 2: 4, 33: 2, 6: 2, 7: 1, 41: 2, 14: 5, 15: 1, 17: 1, 19: 1, 22: 1, 27: 1}
Did not match all atoms present	63870-55-3	CCC(=CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)C)C=C4N(C5=C(S4)C=C(C=C5)OC)CCC(=O)O.[I-]	{1: 3, 2: 3, 33: 2, 6: 2, 7: 1, 41: 2, 14: 9, 15: 1, 19: 1, 22: 1, 27: 1}
Did not match all atoms present	63870-56-4	CC1=CC2=C(C=C1OC)SC(=[N+]2CCC(=O)O)C	{1: 3, 2: 2, 33: 1, 41: 1, 14: 2, 22: 1, 27: 1}
Did not match all atoms present	63876-46-0	CCC(=O)C1=C(C(=C(C=C1)O)C)O	{24: 1, 1: 2, 2: 1, 21: 2, 14: 2}
Did not match all atoms present	63878-65-9	C[Si]1=CC=CC=C1	{1: 1, 14: 5}
Did not match all atoms present	6388-72-3	COC1=CC=C(C=C1)C2CO2	{1: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	63884-28-6	C[N+]1(CCCCC1)CCCCCCCCCC[N+]2(CCCCC2)C.[I-].[I-]	{19: 2, 1: 2, 2: 10, 11: 10}
Did not match all atoms present	63884-40-2	CC(C)NNCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 1, 3: 1, 29: 3, 31: 2}
Did not match all atoms present	63884-67-3	CC[NH+](CC)CC1=CC=CC=C1OC(=O)N(C)C.[Cl-]	{1: 4, 2: 3, 33: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	63884-71-9	C[NH+](C)CCC1=CC=C(C=C1)OC(=O)N(C)C.[Cl-]	{1: 4, 2: 2, 33: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	63884-77-5	CCC(C)(C)C(C)C/C=N/NC(=S)N	{1: 4, 2: 2, 3: 1, 4: 1, 6: 1, 7: 1, 34: 1, 30: 1, 31: 1}
Did not match all atoms present	63884-80-0	C[NH+](C)C1=CC(=CC=C1)OC(=O)NCC=C.[Cl-]	{1: 2, 2: 1, 5: 1, 6: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	63884-81-1	C[NH+](C)C1=CC(=CC=C1)OC(=O)NCC2=CC=CC=C2.[Cl-]	{1: 2, 2: 1, 14: 9, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	63884-90-2	CCN(CCCl)C(=O)OC1=CC(=C(C(=C1)C)N=O)C	{1: 3, 2: 3, 33: 1, 34: 1, 14: 2, 17: 1, 28: 1, 29: 1}
Did not match all atoms present	63885-02-9	C1=C(C=C(C(=C1Cl)Cl)[S-])Cl.C1=C(C=C(C(=C1Cl)Cl)[S-])Cl.[Zn+2]	{17: 6, 14: 4}
Did not match all atoms present	63885-67-6	CCCCCCCCCOC1=CC2=C(C=C1)C3=C(N2)C(=NC=C3)C	{32: 1, 1: 2, 2: 8, 35: 1, 14: 5, 22: 1}
Did not match all atoms present	63885-68-7	CCCCCOC1=CC2=C(C=C1)C3=C(N2)C(=NC=C3)C.Cl	{32: 1, 1: 2, 2: 4, 35: 1, 14: 5, 17: 1, 22: 1}
Did not match all atoms present	63886-45-3	CC1N(C(CC1)C)/C=C/C=C/C=[N+]2C(CCC2C)C.CC1N(C(CC1)C)/C=C/C=C/C=[N+]2C(CCC2C)C.O.O.O.[Cl-].[Cl-]	{1: 8, 6: 10, 33: 4, 11: 8, 12: 8, 17: 2}
Did not match all atoms present	63886-51-1	CCCCP(=O)(OCC)OP(=O)(OCC)OCC	{1: 4, 2: 6, 29: 2, 22: 4}
Did not match all atoms present	63886-77-1	C1(=C(C(=C(C(=C1F)F)F)N)F)N.Cl.Cl	{16: 4, 17: 2, 30: 2}
Did not match all atoms present	63886-82-8	CCC1C2CCCCC2OP(=S)(O1)Cl	{1: 1, 2: 1, 11: 4, 12: 3, 17: 1, 23: 2}
Did not match all atoms present	63887-17-2	C=CCOC1=CC=CC=C1C(=O)NCCO	{2: 3, 5: 1, 6: 1, 14: 4, 20: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	63887-34-3	CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)N.OS(=O)(=O)[O-]	{1: 2, 2: 4, 14: 4, 20: 1, 24: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	63887-51-4	CCN(CC)C(=O)C1=CC=CC=C1OCC=C	{1: 2, 2: 3, 5: 1, 6: 1, 33: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	63887-52-5	CN(C)C(=O)C1=CC=CC=C1OCC=C	{1: 2, 2: 1, 5: 1, 6: 1, 33: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	63887-61-6	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.COC(=O)C1=CC=C(C=C1)C(=O)OC.C(CO)CCO	{1: 4, 2: 28, 6: 8, 14: 4, 20: 2, 27: 2, 28: 2}
Did not match all atoms present	639-46-3	C[N+]1(CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O)[O-]	{1: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 21: 1, 23: 1, 29: 1}
Did not match all atoms present	639-58-7	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)Cl	{17: 1, 14: 15}
Did not match all atoms present	6390-69-8	CC(C)(C)C1=CC(=C(C(=C1)C2=CC(=CC(=C2O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C	{1: 12, 4: 4, 21: 2, 14: 4}
Did not match all atoms present	63901-83-7	C1CC(OC1)N2C(=O)C(=CNC2=O)F	{32: 1, 33: 1, 11: 3, 12: 1, 14: 1, 16: 1, 23: 1, 25: 2}
Did not match all atoms present	63903-75-3	C[C@H]1[C@@H]2CC3=C([C@@]1(CCN2CCC4=CC=CC=C4)C)C=C(C=C3)O.Br	{1: 2, 2: 2, 33: 1, 11: 3, 12: 2, 13: 1, 14: 8, 18: 1, 21: 1}
Did not match all atoms present	63904-81-4	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)[O-].[Fe+3]	{1: 3, 33: 3, 11: 3, 14: 21, 24: 3, 29: 3}
Did not match all atoms present	63904-82-5	CC(C(=O)[O-])O.CC(C(=O)[O-])O.CC(C(=O)[O-])O.O=[Zr+2].[Na+]	{24: 3, 1: 3, 3: 3, 20: 3, 29: 1}
Did not match all atoms present	63904-83-6	C=CCNC(=S)[S-].C=CCNC(=S)[S-].[Zn+2]	{2: 2, 31: 2, 5: 2, 6: 2, 7: 2}
Did not match all atoms present	63904-87-0	CC(C)NS(=O)(=O)C1=NC2=CC=CC=C2S1	{1: 2, 3: 1, 41: 1, 14: 4, 35: 1, 29: 2, 31: 1}
Did not match all atoms present	63905-33-9	C1=CC=C(C=C1)CC(C(=O)O)NC(=O)COC2=C(C=C(C=C2)Cl)Cl	{2: 2, 3: 1, 14: 8, 17: 2, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	63905-38-4	C=CC[NH+](CCCl)CCCl.[Cl-]	{17: 3, 2: 5, 5: 1, 6: 1}
Did not match all atoms present	63905-54-4	CCOC(=O)C1(CC[NH+](CC1)CC(COC2=CC=CC=C2)O)C3=CC=CC=C3.[Cl-]	{1: 1, 2: 3, 3: 1, 11: 4, 13: 1, 14: 10, 17: 1, 20: 1, 22: 1, 28: 1}
Did not match all atoms present	63905-60-2	CC(C)(C1=CC=CO1)[NH3+].OS(=O)(=O)[O-]	{1: 2, 4: 1, 14: 3, 20: 1, 23: 1, 29: 3}
Did not match all atoms present	63905-64-6	COC1=C(C=C(C=C1)CC2=NC(=CC3=CC(=C(C=C32)OC)OC)C(=O)[O-])OC.[Na+]	{1: 4, 2: 1, 35: 1, 14: 6, 22: 4, 24: 1}
Did not match all atoms present	63905-85-1	C(C(=O)[O-])F.C(C(=O)[O-])F.C(C(=O)[O-])F.[Al+3]	{16: 3, 24: 3, 2: 3}
Did not match all atoms present	63905-89-5	C(C(=O)[O-])F.C(C(=O)[O-])F.[Hg+2]	{16: 2, 24: 2, 2: 2}
Did not match all atoms present	63905-90-8	C(C(=O)[O-])F.[Tl+]	{16: 1, 24: 1, 2: 1}
Did not match all atoms present	63906-07-0	C1=CC(=C[N+](=C1)C(=O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)[N+]4=CC=CC(=C4)I)I.[Br-].[Br-]	{33: 2, 2: 2, 14: 16, 18: 2, 19: 2, 24: 2}
Did not match all atoms present	63906-35-4	C[NH+](C)CCOC(=O)CC1=CNC2=CC=CC=C21.[Cl-]	{32: 1, 1: 2, 2: 3, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	63906-42-3	C[NH+](C)CCOC(=O)COC1=CC=CC2=CC=CC=C21.[Cl-]	{1: 2, 2: 3, 14: 7, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	63906-43-4	C[NH+](C)CCOC(=O)COC1=CC2=CC=CC=C2C=C1.[Cl-]	{1: 2, 2: 3, 14: 7, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	63906-49-0	CCCCOC(=O)C[Se]C#N	{1: 1, 2: 4, 28: 1, 37: 1}
Did not match all atoms present	63906-50-3	C(C(=O)[O-])[Se]C#N.[K+]	{24: 1, 2: 1, 37: 1}
Did not match all atoms present	63906-57-0	CC=CCN1C(=O)C2=C(N=CN2C)N(C1=O)C	{1: 3, 2: 1, 35: 1, 6: 2, 33: 3, 14: 1, 25: 2}
Did not match all atoms present	63906-63-8	CCCN1C(=O)C2=C(N=CN2C)N(C1=O)C	{1: 3, 2: 2, 35: 1, 33: 3, 14: 1, 25: 2}
Did not match all atoms present	63906-64-9	CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CC=CC=C3)C(CN)N4CCOCC4.Cl	{1: 2, 2: 2, 3: 1, 33: 4, 11: 4, 14: 5, 17: 1, 35: 1, 23: 1, 25: 2, 30: 1}
Did not match all atoms present	63906-75-2	CC(=O)NC1=NC(=C(S1)[Hg]OC(=O)C)[Hg]OC(=O)C	{1: 3, 35: 1, 41: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	63906-88-7	C1CC[NH+](CC1)CCC(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3.[Cl-]	{2: 2, 3: 1, 11: 5, 14: 10, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	63907-33-5	C1=CC(=CC=C1CC(C[Hg])O)OCC(=O)[O-].O.[Na+]	{2: 3, 3: 1, 14: 4, 20: 1, 22: 1, 24: 1}
Did not match all atoms present	63907-44-8	CCNS(=O)(=O)C1=CC(=C2C(=C1)C=C(C=C2O)S(=O)(=O)NCC)NC(=O)C	{1: 3, 2: 2, 14: 4, 21: 1, 24: 1, 29: 4, 31: 3}
Did not match all atoms present	6391-21-5	C1=CC(=CC(=C1)N=NC2C(=NN(C2=O)C3=CC(=CC=C3)N)C(=O)[O-])C(=O)NC4=CC=CC(=C4)N=NC5C(=NN(C5=O)C6=CC(=CC=C6)N)C(=O)[O-].[Na+].[Na+]	{33: 2, 34: 4, 35: 2, 12: 2, 14: 16, 15: 2, 24: 3, 25: 2, 30: 2, 31: 1}
Did not match all atoms present	6391-32-8	CC(=O)C(C(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-])N=NC2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=CC(=C4)S(=O)(=O)[O-])OC)C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 3, 34: 4, 3: 2, 14: 13, 22: 1, 24: 7, 29: 6, 31: 4}
Did not match all atoms present	63915-54-8	C[NH+](CCSCCCl)CCSCCCl.[Cl-]	{40: 2, 1: 1, 2: 8, 17: 3}
Did not match all atoms present	63915-76-4	[Be+2].C(C(C(=O)[O-])[O-])C(=O)[O-].[Na+]	{24: 2, 2: 1, 3: 1, 29: 1}
Did not match all atoms present	63916-54-1	CC1(C2CC[C@]1(C(=O)C2)CS(=O)(=O)O)C.C1CCC(CC1)CN2CCCCC2	{1: 2, 2: 2, 33: 1, 11: 13, 12: 2, 13: 2, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	63916-83-6	CCCCCCOC1=CC=C(C=C1)C(=O)OCCCN2CCCCC2C	{1: 2, 2: 8, 33: 1, 11: 4, 12: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	63916-90-5	CC1CCCCN1CCCOC(=O)C2=CC=C(C=C2)OCC(C)C	{1: 3, 2: 4, 3: 1, 33: 1, 11: 4, 12: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	63916-96-1	O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Pb+2]	{17: 2, 29: 8}
Did not match all atoms present	63916-98-3	CCCCCCCC/C=C\CCCCCCCC(=O)O[Pb](CC)(CC)CC	{1: 4, 2: 17, 28: 1, 6: 2}
Did not match all atoms present	63917-04-4	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Lu+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	63917-76-0	CCN(CC)CCOCCCOC(=O)C1=CC=C(C=C1)N	{1: 2, 2: 7, 33: 1, 14: 4, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	63918-29-6	C1CC[NH+](CC1)C(CN)C2=CC=CS2.C(=C\C(=O)[O-])\C(=O)O	{2: 1, 3: 1, 6: 2, 41: 1, 11: 5, 14: 3, 24: 1, 27: 1, 30: 1}
Did not match all atoms present	63918-36-5	CC[NH+](CC[NH+](CC)CCCl)CCCl.[Cl-].[Cl-]	{1: 2, 2: 8, 17: 4}
Did not match all atoms present	63918-38-7	CC[N+]1(CC1)CCO.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 38: 3, 11: 2, 14: 2, 20: 1, 29: 3}
Did not match all atoms present	63918-39-8	C[N+]1(CC1)CCO.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 38: 3, 11: 2, 14: 2, 20: 1, 29: 3}
Did not match all atoms present	63918-49-0	C(C[NH+](CCCl)CCCl)[NH+](CCCl)CCCl.[Cl-].[Cl-]	{17: 6, 2: 10}
Did not match all atoms present	63918-55-8	CCC1C[NH+]1CCCl.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 38: 3, 11: 1, 12: 1, 14: 2, 17: 1, 29: 3}
Did not match all atoms present	63918-56-9	C/C=C/[N+]1(C2=CC=CC=C2CCC3=CC=CC=C31)C.[I-]	{19: 1, 1: 2, 11: 2, 14: 8, 6: 2}
Did not match all atoms present	63918-66-1	C=CCN1CC2=C(C=CC(=C2)Cl)C3=C(C1)C=C(C=C3)Cl	{33: 1, 2: 1, 5: 1, 6: 1, 11: 2, 14: 6, 17: 2}
Did not match all atoms present	63918-82-1	CN(C)C1=CC=C(C=C1)/C=C/C2=C3C(=NC4=C2C5=CC=CC=C5C=C4)C=CC6=CC=CC=C63	{1: 2, 35: 1, 14: 16, 6: 2, 33: 1}
Did not match all atoms present	63918-83-2	COS(=O)(=O)O.C1=CC=C2C(=C1)C=CC3=NC4=C(C=C32)C5=CC=CC=C5C=C4	{1: 1, 35: 1, 14: 13, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	63918-85-4	CC(CC1=CC=CC=C1)NCCO	{1: 1, 2: 3, 3: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	63919-14-2	CC(C(=O)[O-])O.CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Zr+3]	{24: 3, 1: 3, 3: 3, 20: 3}
Did not match all atoms present	63919-17-5	C1=CC=C(C=C1)CC(C(=O)O)C(=O)O.[NH2-].[NH2-].[Pt+2]	{27: 2, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	63919-18-6	C1=CC=C(C=C1)C(CC(C[Hg])O)(C(=O)[O-])C(=O)[O-].O.[Na+].[Na+]	{2: 2, 3: 1, 4: 1, 14: 5, 20: 1, 24: 2}
Did not match all atoms present	63919-21-1	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.N#[O+].[Fe].[Co+3]	{29: 1}
Did not match all atoms present	63919-22-2	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[N-]=O.[Na+].[Na+].[Na+].[Na+].[Fe+3]	{29: 1}
Did not match all atoms present	6392-46-7	CC1=CC(=CC(=C1N(CC=C)CC=C)C)OC(=O)NC	{1: 3, 2: 2, 5: 2, 6: 2, 33: 1, 14: 2, 28: 1, 31: 1}
Did not match all atoms present	6393-42-6	CC1=CC(=C(C(=C1)[N+](=O)[O-])N)[N+](=O)[O-]	{1: 1, 38: 2, 30: 1, 14: 2}
Did not match all atoms present	63937-14-4	C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Hg+]	{24: 1, 2: 1, 3: 4, 20: 5}
Did not match all atoms present	63937-47-3	CCCCCCCC(=O)N1CCC2=CC=CC=C2C1	{1: 1, 2: 6, 33: 1, 11: 3, 14: 4, 24: 1}
Did not match all atoms present	63938-10-3	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)C5C(O5)C=C4	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	63938-16-9	C1=CC=C(C=C1)/C=C/C(=O)[O-].C1=CC=C(C=C1)/C=C/C(=O)[O-].[Ni+2]	{24: 2, 14: 10, 6: 4}
Did not match all atoms present	63938-20-5	C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O.[Y+3]	{24: 3, 20: 3, 2: 6, 27: 6, 4: 3}
Did not match all atoms present	63938-21-6	CC1=C(OC2=C(C1=O)C=CC(=C2C[NH+]3CCOCC3)OC)C.[Cl-]	{1: 3, 2: 1, 11: 4, 14: 2, 17: 1, 22: 1, 23: 2, 25: 1}
Did not match all atoms present	63938-24-9	CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3=CN(C4=CC=CC(=C34)C2=C1)C(=O)C)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 4, 2: 2, 3: 4, 33: 3, 11: 2, 12: 2, 14: 5, 15: 1, 20: 4, 24: 2, 27: 4}
Did not match all atoms present	63938-26-1	CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)N5CCOCC5.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{32: 1, 1: 1, 3: 2, 33: 2, 11: 6, 12: 2, 14: 5, 15: 1, 20: 2, 23: 1, 24: 1, 27: 2}
Did not match all atoms present	63938-27-2	COC1CC23C(=CCN2CCC4=CC(=C(C=C34)OC)O)C=C1	{1: 2, 33: 1, 11: 4, 12: 1, 13: 1, 14: 5, 15: 1, 21: 1, 22: 2}
Did not match all atoms present	63938-28-3	CO[C@@H]1CC23C(=CCN2CCC4=CC(=C(C=C34)O)O)C=C1.Cl	{1: 1, 33: 1, 11: 4, 12: 1, 13: 1, 14: 5, 15: 1, 17: 1, 21: 2, 22: 1}
Did not match all atoms present	63938-62-5	C1=CC=C2C(=C1)C(=CN2)CC[NH2+]CC3=CC=C(C=C3)Cl.[Cl-]	{32: 1, 17: 2, 2: 3, 14: 9}
Did not match all atoms present	63938-79-4	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC(=CC=C3)S(=O)(=O)O)N	{30: 1, 34: 2, 20: 1, 29: 2, 14: 10}
Did not match all atoms present	63938-92-1	C(CCl)SC(=S)SCCCl	{40: 2, 17: 2, 2: 4, 7: 1}
Did not match all atoms present	63938-93-2	C1=CC=C(C(=C1)O[Sb])SCC(=O)O.O.O	{40: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	63941-74-2	CNC(=O)C1=C(C(=C(C(=C1I)NC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)I)NC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)I	{1: 1, 2: 2, 3: 8, 19: 3, 20: 10, 24: 3, 31: 3}
Did not match all atoms present	63944-01-4	[Cl-].[Tm]	{17: 1}
Did not match all atoms present	63944-03-6	[Cl-].[Pr]	{17: 1}
Did not match all atoms present	63944-04-7	[Cl-].[Dy]	{17: 1}
Did not match all atoms present	63944-05-8	[Cl-].[Ho]	{17: 1}
Did not match all atoms present	63944-10-5	CC(C)(CC1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O	{1: 3, 2: 1, 4: 1, 14: 6, 22: 1, 27: 1}
Did not match all atoms present	63948-88-9	CC(CO)O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{1: 1, 2: 1, 3: 1, 14: 3, 20: 2, 27: 1, 28: 2}
Did not match all atoms present	63949-98-4	CC(C(=O)[O-])NC(=O)C1=CC=C(C=C1)NCC2=NC3=CN=C(N=C3[N+](=C2)N)N.[Na+]	{1: 1, 2: 1, 3: 1, 33: 1, 14: 6, 35: 3, 24: 2, 30: 2, 31: 2}
Did not match all atoms present	63951-03-1	C1=CC(=C(C=C1[As]=O)N)[O-].[Na+]	{30: 1, 29: 1, 14: 3}
Did not match all atoms present	63951-08-6	C1C(O1)COCCON(C2=CC=CC=C2)OCCOCC3CO3	{2: 6, 11: 2, 12: 2, 14: 5, 22: 4, 23: 2}
Did not match all atoms present	63951-09-7	C1=C(C=C(C(=C1[Hg])N)[Hg])[N+](=O)[O-].O.O	{38: 1, 30: 1, 14: 2}
Did not match all atoms present	63951-12-2	CC[NH+](CC)CCN(CC)C1=CC=CC=C1.[Cl-]	{1: 3, 2: 5, 33: 1, 14: 5, 17: 1}
Did not match all atoms present	63951-29-1	C[N+](C)(C)C1=CC=C(C=C1)NC(=O)N.[I-]	{1: 3, 14: 4, 19: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	63957-36-8	[H+].[H+].CCOC1=CC=CC(=C1)N.CCOC1=CC=CC(=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{1: 2, 2: 2, 3: 4, 14: 8, 22: 2, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	63957-37-9	[H+].[H+].C1=CC(=CC(=C1)O)N.C1=CC(=CC(=C1)O)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{3: 4, 14: 8, 21: 2, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	63957-38-0	[H+].[H+].C1=CC=C(C(=C1)N)O.C1=CC=C(C(=C1)N)O.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{3: 4, 14: 8, 21: 2, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	63957-39-1	[H+].[H+].C1=CC(=CC=C1N)O.C1=CC(=CC=C1N)O.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{3: 4, 14: 8, 21: 2, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	63957-41-5	C1=CC=C(C=C1)[NH3+].C1=CC=C(C=C1)[NH3+].C1=CC=C(C=C1)[NH3+].[O-][As](=O)([O-])[O-]	{29: 4, 14: 15}
Did not match all atoms present	63957-48-2	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)/C=C/C=C/C=[N+](CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-]	{17: 1, 2: 4, 14: 20, 6: 5, 33: 2}
Did not match all atoms present	63957-59-5	CC[N+](C)(CC)C1=CC(=CC=C1)OC(=O)NC.COS(=O)(=O)[O-]	{1: 5, 2: 2, 14: 4, 22: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	63957-60-8	C1=CC(=C(C=C1N/N=C\2/C(=O)C3=C(C(=CC(=C3N)S(=O)(=O)O)S(=O)(=O)O)C=C2)S(=O)(=O)O)/C=C/C4=C(C=C(C=C4)N/N=C\5/C(=O)C6=C(C(=CC(=C6N)S(=O)(=O)O)S(=O)(=O)O)C=C5)S(=O)(=O)O	{34: 2, 6: 2, 14: 12, 15: 2, 20: 6, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	63957-61-9	CC1=C/C(=N\NC2=C(C=C(C(=C2)C)C(C3=CC(=C(C=C3C)N/N=C\4/C(=O)C=CC(=C4)C)C)C5=CC=CC=C5Cl)C)/C(=O)C=C1	{1: 6, 34: 2, 3: 1, 14: 14, 15: 4, 17: 1, 25: 2, 31: 2}
Did not match all atoms present	6396-90-3	C1=CC=C2C(=C1)C=C(C(=C3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O)N2)O	{32: 1, 14: 8, 15: 3, 20: 1, 25: 2, 27: 1}
Did not match all atoms present	63963-40-6	CSC1=NC2=CC=CC=C2C(=N1)N	{40: 1, 1: 1, 35: 2, 30: 1, 14: 4}
Did not match all atoms present	6397-02-0	CC1=CC(=C(C(=C1)C)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])C.[Na+]	{1: 3, 14: 7, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	63977-49-1	C[N+](C)(CCCl)CCCl.[Cl-]	{1: 2, 2: 4, 17: 3}
Did not match all atoms present	63978-93-8	C1=CC=C2C(=C1)C=CC=C2N=NC3=CC(=CC4=CC=CC=C43)N	{34: 2, 30: 1, 14: 13}
Did not match all atoms present	63978-98-3	C[NH+](C)C1CCCC2=C(C=CC(=C12)Cl)OCC3=CC=CC=C3.[Cl-]	{1: 2, 2: 1, 11: 3, 12: 1, 14: 7, 17: 2, 22: 1}
Did not match all atoms present	63979-26-0	CCN(CC)C(=O)C1=C(N(N=N1)C2=CC=C(C=C2)N)C.Cl	{1: 3, 2: 2, 35: 2, 33: 2, 14: 4, 17: 1, 24: 1, 30: 1}
Did not match all atoms present	63979-33-9	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC(=C(C=C3)OC)S(=O)(=O)O	{1: 5, 3: 1, 33: 2, 14: 11, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	63979-62-4	CC(C)CC[Sn](=O)CCC(C)C	{1: 4, 2: 4, 3: 2, 29: 1}
Did not match all atoms present	63979-95-3	CC(C)(C)C1=C(C=C(C=C1)CSCC2=CC(=C(C=C2)C(C)(C)C)O)O	{1: 6, 2: 2, 4: 2, 40: 1, 14: 6, 21: 2}
Did not match all atoms present	63980-18-7	CC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)N)C	{1: 2, 34: 2, 30: 1, 14: 7}
Did not match all atoms present	63980-27-8	CC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)N/N=C/3\C(=O)C=CC4=CC=CC=C43)C	{1: 2, 34: 3, 14: 13, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	63980-61-0	C(CF)OP(OCCF)OCCF	{16: 3, 2: 6, 22: 3}
Did not match all atoms present	63980-89-2	CCOP(=O)(O)SC1=CC=C(C=C1)C	{1: 2, 2: 1, 40: 1, 14: 4, 20: 1, 22: 1, 29: 1}
Did not match all atoms present	63981-09-9	C1C(=O)NC(=S)N=C1NN	{32: 1, 35: 1, 11: 1, 15: 2, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	63981-20-4	CC(=O)NC1=CC=C(C=C1)O[Se]OC2=CC=C(C=C2)NC(=O)C	{24: 2, 1: 2, 22: 2, 14: 8, 31: 2}
Did not match all atoms present	63981-21-5	C1=CC=C(C=C1)NC(=O)C[Se]C#N	{24: 1, 2: 1, 37: 1, 14: 5, 31: 1}
Did not match all atoms present	63981-49-7	CCCCC(CC)COP(OCC(CC)CCCC)OCC(CC)CCCC.Cl[Hg]Cl	{1: 6, 2: 15, 3: 3, 22: 3, 17: 2}
Did not match all atoms present	63981-53-3	CC(C)C1=C(C=CC(=C1)OC(=O)N(C)C)[N+](C)(C)C.[I-]	{1: 7, 3: 1, 33: 1, 14: 3, 19: 1, 28: 1}
Did not match all atoms present	63981-92-0	CC(C)C1=C(C=CC(=C1)OC(=O)NC)[N+](C)(C)C.[Cl-]	{1: 6, 3: 1, 14: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	63982-03-6	CCCCCCCCCCCCCCCCC[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 2: 16, 29: 3, 22: 1}
Did not match all atoms present	63982-25-2	C[NH+](C)C1=CC(=CC=C1)OC(=O)NC2=CC=CC=C2.[Cl-]	{1: 2, 31: 1, 28: 1, 14: 9, 17: 1}
Did not match all atoms present	63982-32-1	CC(C1=CC(=CC=C1)OC(=O)NC)[NH+](C)C.[Cl-]	{1: 4, 3: 1, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	63982-40-1	CNC(=O)OC1=CC=CC(=C1)[NH+](C)C.[Cl-]	{1: 3, 31: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	63982-47-8	CC1=C(C=C(C=C1)OC(=O)NC)[NH+](C)C.[Cl-]	{1: 4, 31: 1, 28: 1, 14: 3, 17: 1}
Did not match all atoms present	63982-49-0	CC1=CC(=C(C=C1[NH+](C)C)OC(=O)NC)C.[Cl-]	{1: 5, 31: 1, 28: 1, 14: 2, 17: 1}
Did not match all atoms present	63982-52-5	CC1=CC(=C(C=C1OC(=O)NC)C(C)C)OC(=O)NC	{1: 5, 3: 1, 28: 2, 14: 2, 31: 2}
Did not match all atoms present	63982-57-0	[H+].[H+].[H+].CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 16, 24: 2, 29: 6}
Did not match all atoms present	63984-91-8	C[C-]1[CH-][CH-][CH-][CH-]1.C[C-]1C=CC=C1.Br[Mo]Br	{1: 2, 18: 2, 14: 8}
Did not match all atoms present	63984-92-9	C[C-]1[CH-][CH-][CH-][CH-]1.C[C-]1C=CC=C1.[Mo](I)I	{1: 2, 19: 2, 14: 8}
Did not match all atoms present	63989-69-5	O.O.O.O.O.[O-2].O[As](O)O.[Fe+3]	{20: 3}
Did not match all atoms present	63989-75-3	COC1=CC=C2C(=CC1=O)[C@H](CCC3=CC(=C(C(=C32)OC)OC)OC)NC(=O)C4=CC=CC=C4	{1: 4, 11: 2, 12: 1, 14: 9, 22: 4, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	63989-79-7	C1=CC2=C(C=CC(=O)O2)C=C1N.Cl	{17: 1, 28: 1, 30: 1, 14: 5}
Did not match all atoms present	63989-82-2	CC1=C(C=C(C=C1[N+](=O)[O-])O)[N+](=O)[O-]	{1: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	63989-83-3	CC1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].CC1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].[Ba+2]	{1: 2, 38: 4, 14: 4}
Did not match all atoms present	63989-84-4	CC1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].C[NH3+]	{1: 2, 38: 2, 14: 2}
Did not match all atoms present	63989-85-5	CC1=CC(=CC(=C1[O-])[N+](=O)[O-])[N+](=O)[O-].C1COCC[NH2+]1	{1: 1, 11: 4, 38: 2, 14: 2, 23: 1}
Did not match all atoms present	6399-81-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Br	{18: 1, 14: 15}
Did not match all atoms present	63990-56-7	CC(=O)NC1=CC=CC=C1[Se][Se]C2=CC=CC=C2NC(=O)C	{24: 2, 1: 2, 14: 8, 31: 2}
Did not match all atoms present	63990-57-8	CCCC(C)C1=CC(=C(C=C1)OCC(=O)Cl)C(C)CCC	{1: 4, 2: 5, 3: 2, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	63990-88-5	[Be+2].[O-]F.[O-]F	{16: 2, 29: 2}
Did not match all atoms present	63991-14-0	CC(C(C1=C(C=C(C=C1)OC)OC)O)[NH3+].[Cl-]	{1: 3, 3: 2, 14: 3, 17: 1, 20: 1, 22: 2}
Did not match all atoms present	63991-23-1	CC(C(C1=CC=C(C=C1)OC)O)[NH3+].[Cl-]	{1: 2, 3: 2, 14: 4, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	63991-26-4	CC(C(C1=CC=CC=C1)O)[NH2+]C.[Cl-]	{1: 2, 3: 2, 20: 1, 14: 5, 17: 1}
Did not match all atoms present	63991-31-1	CC1=C(C=C(C=C1)C(C(C)[NH3+])O)O.[Cl-]	{1: 2, 3: 2, 14: 3, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	63991-43-5	CNS(=O)(=O)C1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 31: 1, 29: 2, 14: 2, 17: 3}
Did not match all atoms present	63991-48-0	C1=CC(=CC(=C1)[NH3+])C2=[NH+]C3=C(N2)C=C(C=C3)N.[Cl-].[Cl-]	{32: 2, 17: 2, 30: 1, 14: 7}
Did not match all atoms present	63991-49-1	C1=CC(=CC=C1C2=[NH+]C3=C(N2)C=C(C=C3)[NH3+])N.[Cl-].[Cl-]	{32: 2, 17: 2, 30: 1, 14: 7}
Did not match all atoms present	63991-57-1	C1C(O1)COC2=CC=C(C=C2)CNC3=CC=CC=C3	{2: 2, 11: 1, 12: 1, 14: 9, 22: 1, 23: 1, 31: 1}
Did not match all atoms present	63991-70-8	CC1=C(C=CC(=C1)C2=CC=C(C=C2)NC(=O)C)NC(=O)C	{24: 2, 1: 3, 14: 7, 31: 2}
Did not match all atoms present	63992-02-9	C1=CC=C(C(=C1)C(=O)[O-])O[Hg]OC2=CC=CC=C2C(=O)[O-].[Na+].[Na+]	{24: 2, 22: 2, 14: 8}
Did not match all atoms present	63992-41-6	C1=CC=C(C=C1)C2=C(C=CC=C2Cl)[O-].[Na+]	{17: 1, 14: 8}
Did not match all atoms present	63992-48-3	CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CCC(C)S(=O)(=O)[O-])C	{1: 3, 2: 3, 3: 1, 33: 2, 14: 2, 17: 2, 29: 3}
Did not match all atoms present	63995-70-0	C1=CC(=CC(=C1)S(=O)(=O)[O-])P(C2=CC(=CC=C2)S(=O)(=O)[O-])C3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{29: 9, 14: 12}
Did not match all atoms present	64-00-6	CC(C)C1=CC(=CC=C1)OC(=O)NC	{1: 3, 3: 1, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	64-01-7	CC1=C(C=CC(=C1)N=NC2=CC=CC=C2)NC	{1: 2, 34: 2, 14: 8, 31: 1}
Did not match all atoms present	64-02-8	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	64-04-0	C1=CC=C(C=C1)CCN	{2: 2, 30: 1, 14: 5}
Did not match all atoms present	64-10-8	C1=CC=C(C=C1)NC(=O)N	{24: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	64-13-1	CC(CC1=CC=C(C=C1)OC)N	{1: 2, 2: 1, 3: 1, 14: 4, 22: 1, 30: 1}
Did not match all atoms present	64-20-0	C[N+](C)(C)C.[Br-]	{1: 4, 18: 1}
Did not match all atoms present	64-39-1	CCC(=O)OC1(C[C@@H](N(C[C@H]1C)C)C)C2=CC=CC=C2	{1: 4, 2: 1, 33: 1, 11: 2, 12: 2, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	64-43-7	CCC1(C(=O)NC(=NC1=O)[O-])CCC(C)C.[Na+]	{32: 1, 1: 3, 2: 3, 3: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	64-47-1	C[C@@]12CC[NH+]([C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C.C[C@@]12CC[NH+]([C@@H]1N(C3=C2C=C(C=C3)OC(=O)NC)C)C.[O-]S(=O)(=O)[O-]	{1: 8, 33: 2, 11: 4, 12: 2, 13: 2, 14: 6, 28: 2, 29: 4, 31: 2}
Did not match all atoms present	64-60-8	C1CCC2(CC1)CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F.Cl	{33: 1, 2: 3, 11: 9, 13: 1, 14: 4, 16: 1, 17: 1, 24: 1}
Did not match all atoms present	64-67-5	CCOS(=O)(=O)OCC	{1: 2, 2: 2, 29: 2, 22: 2}
Did not match all atoms present	64-72-2	C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O.Cl	{1: 3, 33: 1, 11: 1, 12: 3, 13: 2, 14: 2, 15: 4, 17: 2, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	64-73-3	CN(C)[C@H]1[C@@H]2C[C@@H]3[C@@H](C4=C(C=CC(=C4C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O)Cl)O.Cl	{1: 2, 33: 1, 11: 1, 12: 4, 13: 1, 14: 2, 15: 4, 17: 2, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	64-75-5	C[C@@]1(C2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.Cl	{1: 3, 33: 1, 11: 1, 12: 3, 13: 2, 14: 3, 15: 4, 17: 1, 20: 4, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	64-77-7	CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 3, 14: 4, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	64-86-8	CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC	{1: 5, 11: 2, 12: 1, 14: 4, 22: 4, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	64-95-9	CCN(CC)CCOC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 4, 3: 1, 33: 1, 14: 10, 28: 1}
Did not match all atoms present	64-96-0	CCN(CC)CCOC1=CC=C(C=C1)C2=C(CC3=C2C=CC(=C3)OC)C4=CC=CC=C4.Cl	{1: 3, 2: 4, 33: 1, 11: 1, 14: 12, 15: 2, 17: 1, 22: 2}
Did not match all atoms present	640-15-3	CCSCCSP(=S)(OC)OC	{40: 2, 1: 3, 2: 3, 22: 2}
Did not match all atoms present	640-57-3	CC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2	{1: 1, 29: 2, 14: 9}
Did not match all atoms present	640-61-9	CC1=CC=C(C=C1)S(=O)(=O)NC	{1: 2, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	640-67-5	C(=O)(C(=O)[O-])[O-].[Mn+2]	{24: 2}
Did not match all atoms present	64000-73-3	CC(CN(C)C1=NN=C(C=C1)NN)O	{1: 2, 2: 1, 3: 1, 33: 1, 14: 2, 35: 2, 20: 1, 30: 1, 31: 1}
Did not match all atoms present	64000-97-1	CC1=CC/2=C(C=C1/C=C\C3=NC(=CC=C3)/C=C2)C	{1: 2, 35: 1, 14: 9}
Did not match all atoms present	64000-98-2	CC1=C(C/2=C(C(=C1/C=C\C3=NC(=CC=C3)/C=C2)C)C)C	{1: 4, 35: 1, 14: 7}
Did not match all atoms present	64002-83-1	CC(CC(=O)[O-])CC(C)(C)C.CC(CC(=O)[O-])CC(C)(C)C.[Mn+2]	{24: 2, 1: 8, 2: 4, 3: 2, 4: 2}
Did not match all atoms present	6401-97-4	CC1=NN(C(=N)C1)C2=CC=CC=C2	{1: 1, 35: 1, 36: 1, 33: 1, 11: 1, 14: 5, 15: 2}
Did not match all atoms present	64011-34-3	[H+].[H+].CC1=CC(=CC=C1)N.CC1=CC(=CC=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{1: 2, 3: 4, 14: 8, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	64011-35-4	[H+].[H+].CC1=CC=CC=C1N.CC1=CC=CC=C1N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{1: 2, 3: 4, 14: 8, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	64011-36-5	[H+].[H+].CC1=CC=C(C=C1)N.CC1=CC=C(C=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{1: 2, 3: 4, 14: 8, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	64013-14-5	Cl[Sb+](Cl)Cl	{17: 3}
Did not match all atoms present	64019-93-8	CC(C)(C)C(=O)OC1=C(C=C(C=C1)C(CNC)O)OC(=O)C(C)(C)C.Cl	{1: 7, 2: 1, 3: 1, 4: 2, 14: 3, 17: 1, 20: 1, 28: 2, 31: 1}
Did not match all atoms present	6402-06-8	CCOC(=O)C1=NN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)O	{1: 1, 2: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 20: 1, 25: 1, 28: 1, 29: 2}
Did not match all atoms present	64022-67-9	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OP3OCC4(COP(OC4)OC5=CC=CC=C5)CO3	{1: 2, 4: 1, 11: 4, 13: 1, 14: 13, 21: 1, 22: 2, 23: 4}
Did not match all atoms present	64024-08-4	[H+].[H+].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(=O)(N)N.[Sb+3].[Sb+3]	{24: 5, 3: 4, 29: 4, 30: 2}
Did not match all atoms present	64030-44-0	C1C[C@H](NC1)CNC2=CC=CC=C2	{32: 1, 2: 1, 11: 3, 12: 1, 14: 5, 31: 1}
Did not match all atoms present	64031-65-8	C1=CC2=NC(=C1)C=CC3=C4C=CC5=CC=CC(=N5)C=CC(=C3)C(=C4)C=C2	{35: 2, 14: 16}
Did not match all atoms present	64033-89-2	CCCCCCCCCC1=CC(=C(C=C1)OP(OC2=C(C=C(C=C2)CCCCCCCCC)CCCCCCCCC)OC3=C(C=C(C=C3)CCCCCCCCC)CCCCCCCCC)CCCCCCCCC	{1: 6, 2: 48, 22: 3, 14: 9}
Did not match all atoms present	64033-96-1	COC(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C=CC2=CC=CC=C2	{1: 1, 6: 2, 14: 9, 24: 2, 28: 1, 31: 2}
Did not match all atoms present	64034-87-3	[2H]C([2H])([2H])C#CC#CC([2H])([2H])[2H]	{1: 2, 10: 4}
Did not match all atoms present	64035-64-9	C[Si](C)(C)COS(=O)(=O)C(F)(F)F	{1: 3, 2: 1, 4: 1, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	64036-46-0	CC[Sn](CC)(C1=CC=CC=C1)OC(=O)C	{1: 3, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	64036-72-2	CC1=C2C(=CC=C1)SC(=N2)[NH3+].[Cl-]	{1: 1, 35: 1, 41: 1, 14: 3, 17: 1}
Did not match all atoms present	64036-79-9	C(CSCCSCCS(CCO)(CC[O-])CC[O-])O.[Cl-].[Cl-]	{40: 2, 17: 2, 2: 12, 20: 2, 29: 2}
Did not match all atoms present	64036-91-5	C(C[S+](CCO)CCSCCCl)O.[Cl-]	{40: 1, 17: 2, 2: 8, 20: 2}
Did not match all atoms present	64037-07-6	C1=CC2=C(C=C1Br)N=C(O2)N	{18: 1, 35: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	64037-08-7	C1=C2C(=CC(=C1Cl)Br)OC(=N2)N	{35: 1, 14: 2, 17: 1, 18: 1, 23: 1, 30: 1}
Did not match all atoms present	64037-09-8	C1=C2C(=CC(=C1Br)Cl)OC(=N2)N	{35: 1, 14: 2, 17: 1, 18: 1, 23: 1, 30: 1}
Did not match all atoms present	64037-10-1	C1=CC2=C(C(=C1)Cl)N=C(O2)N	{17: 1, 35: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	64037-11-2	C1=CC2=C(C(=C1)Cl)OC(=N2)N	{17: 1, 35: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	64037-12-3	C1=C2C(=CC(=C1Cl)Cl)OC(=N2)N	{17: 2, 35: 1, 30: 1, 14: 2, 23: 1}
Did not match all atoms present	64037-13-4	C1=CC2=C(C=C1I)N=C(O2)N	{35: 1, 19: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	64037-14-5	COC1=CC2=C(C=C1)OC(=N2)N	{1: 1, 35: 1, 14: 3, 22: 1, 23: 1, 30: 1}
Did not match all atoms present	64037-15-6	CC1=CC2=C(C=C1)OC(=N2)N	{1: 1, 35: 1, 30: 1, 14: 3, 23: 1}
Did not match all atoms present	64037-20-3	CN(C)C1=NC2=C(O1)C=CC(=C2)Cl	{1: 2, 35: 1, 33: 1, 14: 3, 17: 1, 23: 1}
Did not match all atoms present	64037-50-9	CC[NH+](C)C(C)C=C(C1=CC=CS1)C2=CC=CS2.[Cl-]	{1: 3, 2: 1, 3: 1, 6: 1, 7: 1, 41: 2, 14: 6, 17: 1}
Did not match all atoms present	64038-09-1	CCC1(C(=O)NC(=O)N(C1=O)C)C2=CC=C(C=C2)N	{32: 1, 1: 2, 2: 1, 33: 1, 13: 1, 14: 4, 25: 3, 30: 1}
Did not match all atoms present	64038-10-4	CCCCCCC1(C(=O)NC(=S)[N-]C1=O)CC.[Na+]	{32: 1, 1: 2, 2: 6, 35: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	64038-38-6	CC1=C2C=CC3=CC=CC=C3C2=NC4=C1C=CC(=C4C)Cl	{1: 2, 35: 1, 14: 8, 17: 1}
Did not match all atoms present	64038-39-7	CC1=C(C=C2C(=C3C(=NC2=C1)C=CC4=CC=CC=C43)C)F	{16: 1, 1: 2, 35: 1, 14: 8}
Did not match all atoms present	64038-40-0	CC1=C2C(=C3C=CC4=CC=CC=C4C3=NC2=C(C=C1)C)C	{1: 3, 35: 1, 14: 8}
Did not match all atoms present	64038-41-1	C1=CC=C(C(=C1)C=O)OCC(=O)[O-].[Na+]	{24: 1, 2: 1, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	64038-57-9	CN1C(=CNC1=S)C(=O)O	{32: 1, 1: 1, 27: 1, 14: 1, 33: 1}
Did not match all atoms present	64039-27-6	C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=S)N)CO)O.O	{32: 1, 33: 1, 2: 1, 35: 2, 11: 1, 12: 3, 14: 1, 20: 2, 23: 1, 30: 1}
Did not match all atoms present	6404-46-2	C1=CC2=C(C=C(C3=C2C(=C1)NN=N3)N/N=C\4/C=C(C=C(C4=O)Cl)[N+](=O)[O-])S(=O)(=O)O	{32: 1, 34: 1, 35: 2, 38: 1, 14: 6, 15: 3, 17: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	64043-52-3	CC(C(C1=CC=CC=C1)O)[NH+](C)C/C=C/C2=CC=CC=C2.[Cl-]	{1: 2, 2: 1, 3: 2, 6: 2, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	64043-55-6	CC/C(=C(\C1=CC=C(C=C1)O)/C(C(I)I)(I)I)/C2=CC=C(C=C2)O	{1: 1, 2: 1, 3: 1, 4: 1, 7: 2, 14: 8, 19: 4, 21: 2}
Did not match all atoms present	64044-51-5	C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](OC([C@@H]([C@H]2O)O)O)CO)O)O)O)O.O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
Did not match all atoms present	64046-00-0	[NH4+].[K+].[Se-2]	{}
Did not match all atoms present	64046-07-7	CNC(=O)OC1=CC=CC(=C1)[N+](C)(C)CC=C.[Br-]	{1: 3, 2: 1, 5: 1, 6: 1, 14: 4, 18: 1, 28: 1, 31: 1}
Did not match all atoms present	64046-11-3	CC[N+](C)(CC)C1=CC(=CC=C1)OC(=O)N(C)C.[Cl-]	{1: 5, 2: 2, 33: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	64046-12-4	CC[N+](C)(CC)C1=CC(=CC=C1)OC(=O)NC.[Cl-]	{1: 4, 2: 2, 14: 4, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	64046-20-4	CCC[N+](C)(C)C1=CC(=CC=C1)OC(=O)NC.[Br-]	{1: 4, 2: 2, 14: 4, 18: 1, 28: 1, 31: 1}
Did not match all atoms present	64046-38-4	CC1=C(C=C(C=C1)OC(=O)NC)[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 6, 14: 3, 22: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	64046-48-6	C1=CC=C(C=C1)CCCOC(=O)CCl	{17: 1, 2: 4, 28: 1, 14: 5}
Did not match all atoms present	64046-56-6	C1=CC=C(C=C1)NC(=O)C[Se][Se]CC(=O)NC2=CC=CC=C2	{24: 2, 2: 2, 14: 10, 31: 2}
Did not match all atoms present	64046-59-9	CC1=CC(=CC=C1)N=NCC(=O)NC2=CC=CC=C2	{1: 1, 2: 1, 34: 2, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	64046-62-4	CCCCOC(=O)CO[NH3+].[Cl-]	{1: 1, 2: 4, 28: 1, 22: 1, 17: 1}
Did not match all atoms present	64046-68-0	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Ca+2].[Sr+2]	{24: 4, 1: 4}
Did not match all atoms present	64046-79-3	CC(CCCN(CCCl)CCCl)NC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC	{1: 2, 2: 7, 3: 1, 33: 1, 14: 6, 17: 3, 35: 1, 22: 1, 31: 1}
Did not match all atoms present	64046-93-1	CN(C)P(=O)(N(C)C)OP(=O)(N(C)C)N(C)C.Cl[Sb](Cl)Cl.Cl[Sb](Cl)Cl	{1: 8, 33: 4, 29: 2, 22: 1, 17: 6}
Did not match all atoms present	64046-96-4	CC(=O)NC1=C(C=CC(=C1)[As](=O)([O-])[O-])O.[Ca+2]	{1: 1, 14: 3, 21: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	64046-97-5	C1=CC(=CC=C1NCCC(=O)N)[As](=O)(O)[O-].[Na+]	{2: 2, 14: 4, 20: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	64046-99-7	CCC(C(=O)N)NC1=CC=C(C=C1)[As](=O)(O)O	{1: 1, 2: 1, 3: 1, 14: 4, 20: 2, 24: 1, 29: 1, 30: 1, 31: 1}
Did not match all atoms present	64047-08-1	CC(=O)OC1=C(C2=CC=CC=C2C=C1)OC(=O)C	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	64047-26-3	CCN(CC)CC(C)(C)CCNC(=S)[S-].CCN(CC)CC(C)(C)CCNC(=S)[S-].Cl.Cl.[Hg+2]	{1: 8, 2: 10, 4: 2, 33: 2, 7: 2, 17: 2, 31: 2}
Did not match all atoms present	64047-27-4	CC(=NCCN=C(C)/C(=N\[O-])/C)/C(=N/[O-])/C.[Fe+2]	{1: 4, 2: 2, 34: 4, 29: 2, 7: 4}
Did not match all atoms present	64048-05-1	CCCC[Hg]OC(=O)C[S-].[Na+]	{1: 1, 2: 4, 28: 1}
Did not match all atoms present	64048-06-2	CC[Hg]OC(=O)C[S-].[K+]	{1: 1, 2: 2, 28: 1}
Did not match all atoms present	64048-07-3	C[Hg]OC(=O)C[S-].[Na+]	{1: 1, 2: 1, 28: 1}
Did not match all atoms present	64048-08-4	CC(=O)O[Hg]C1=CC=C(S1)[Hg].O	{1: 1, 28: 1, 14: 2, 41: 1}
Did not match all atoms present	64048-13-1	CCOP(=S)(OCC)OP(=S)(OC)OC	{1: 4, 2: 2, 22: 5}
Did not match all atoms present	64048-70-0	C1=CC=C2C(=C1)C3=C4C(=C2C=NNC(=S)N)C=CC5=CC=CC(=C54)C=C3	{34: 1, 6: 1, 7: 1, 14: 11, 30: 1, 31: 1}
Did not match all atoms present	64048-90-4	C1=CC(=CC(=C1)[As](Cl)Cl)C(F)(F)F	{16: 3, 17: 2, 4: 1, 14: 4}
Did not match all atoms present	64048-94-8	C1=CC(=C(C=C1[As]=O)N)OCCO	{2: 2, 14: 3, 20: 1, 22: 1, 29: 1, 30: 1}
Did not match all atoms present	64048-98-2	CC1CC(CC(C1)(C)C)[As](C2CC(CC(C2)(C)C)C)C3CC(CC(C3)(C)C)C	{1: 9, 11: 9, 12: 6, 13: 3}
Did not match all atoms present	64048-99-3	CC[As+](C)(CC)C1=CC=CC(=C1)O.[I-]	{1: 3, 2: 2, 19: 1, 21: 1, 14: 4}
Did not match all atoms present	64049-00-9	CC[As+](C)(CC)C1=CC=CC(=C1)OC(=O)NC.[I-]	{1: 4, 2: 2, 14: 4, 19: 1, 28: 1, 31: 1}
Did not match all atoms present	64049-02-1	C[As+](C)(C)CI.[I-]	{1: 3, 2: 1, 19: 2}
Did not match all atoms present	64049-03-2	C1=CC(=CC=C1N)[As+](C2=CC=C(C=C2)N)(C3=CC=C(C=C3)N)C4=CC=C(C=C4)N.[Cl-]	{17: 1, 30: 4, 14: 16}
Did not match all atoms present	64049-04-3	C1=CC(=CC=C1C(=O)NC(CC(=O)O)C(=O)[O-])NCC2=CN=C3C(=N2)C(=NC(=N3)N)N.[Na+]	{2: 2, 3: 1, 14: 5, 35: 4, 24: 2, 27: 1, 30: 2, 31: 2}
Did not match all atoms present	64049-07-6	C1=CC=C(C=C1)[As](/C=C/Cl)Cl	{17: 2, 14: 5, 6: 2}
Did not match all atoms present	64049-21-4	CCCCCCC[As](Cl)Cl	{1: 1, 2: 6, 17: 2}
Did not match all atoms present	64049-22-5	CCCCCC[As](Cl)Cl	{1: 1, 2: 5, 17: 2}
Did not match all atoms present	64049-23-6	CC(C)CC[As](Cl)Cl	{1: 2, 2: 2, 3: 1, 17: 2}
Did not match all atoms present	64049-27-0	C1=CC(=C(C=C1[N+](=O)[O-])[Hg])N.O	{38: 1, 30: 1, 14: 3}
Did not match all atoms present	64049-28-1	CC(=O)O[Hg]C1=CC(=CC(=C1N)[Hg]C2=C(C(=CC(=C2)[N+](=O)[O-])[Hg]OC(=O)C)N)[N+](=O)[O-]	{1: 2, 38: 2, 28: 2, 30: 2, 14: 4}
Did not match all atoms present	64049-29-2	C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)Cl)Cl)[NH3+].[Cl-]	{17: 3, 2: 1, 30: 1, 14: 6}
Did not match all atoms present	64049-56-5	CCCCCCCCCCCCCCCCCC[N+](C)(C)C.C1=CC(=CC=C1F)S(=O)(=O)[O-]	{16: 1, 1: 4, 2: 17, 29: 3, 14: 4}
Did not match all atoms present	64050-01-7	CC1=C(C=C(C=C1)[N+](C)(C)C)OC(=O)NC.OS(=O)(=O)[O-]	{1: 5, 14: 3, 20: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	64050-03-9	CC1=C(C=C(C=C1)[N+](C)(C)C)OC(=O)NC.[Cl-]	{1: 5, 31: 1, 28: 1, 14: 3, 17: 1}
Did not match all atoms present	64050-20-0	CC(CC12CC3(CC(C1C4=CC=CC=C4)CC(C3)(C2)C)C)NC.Cl	{1: 4, 2: 1, 3: 1, 11: 5, 12: 2, 13: 3, 14: 5, 17: 1, 31: 1}
Did not match all atoms present	64050-23-3	CC1=C2C(=C(C=C1)C)[As]C3=C(N2Cl)C4=CC=CC=C4C=C3	{1: 2, 33: 1, 14: 8, 17: 1}
Did not match all atoms present	64050-25-5	C1=CC=C2C=C3C(=CC2=C1)NC4=CC=CC=C4[Se]3	{32: 1, 14: 10}
Did not match all atoms present	64050-54-0	COP(=O)(OC)ON1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O	{1: 2, 33: 1, 14: 6, 22: 3, 25: 2, 29: 1}
Did not match all atoms present	64050-77-7	CNC(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 14: 4, 22: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	64050-79-9	CN(C1=CC=CC=C1)C(=O)OC2=CC=CC(=C2)[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 33: 1, 14: 9, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	64050-81-3	C[N+](C)(C)C1=CC(=CC=C1)OC(=O)N2CCCCC2.COS(=O)(=O)[O-]	{1: 4, 33: 1, 11: 5, 14: 4, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	64050-83-5	C[N+](C)(C)C1=CC(=CC=C1)OC(=O)NC2=CC=CC=C2.COS(=O)(=O)[O-]	{1: 4, 14: 9, 22: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	64050-95-9	CC1=C(C=CC(=C1)OC(=O)NC)[N+](C)(C)CC=C.[I-]	{1: 4, 2: 1, 5: 1, 6: 1, 14: 3, 19: 1, 28: 1, 31: 1}
Did not match all atoms present	64051-06-5	CNC(=O)OC1=CC=CC(=C1)[N+](C)(C)C.[Cl-]	{1: 4, 31: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	64051-08-7	C[N+](C)(C)C1=CC(=CC=C1)OC(=O)NCC2=CC=CC=C2.[I-]	{1: 3, 2: 1, 14: 9, 19: 1, 28: 1, 31: 1}
Did not match all atoms present	64051-12-3	CC(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 28: 1, 22: 1, 14: 4, 29: 3}
Did not match all atoms present	64051-16-7	C[N+](C)(C)C1=CC(=CC=C1)OC(=O)NCC2=CC=CC=C2.COS(=O)(=O)[O-]	{1: 4, 2: 1, 14: 9, 22: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	64051-18-9	C[N+](C)(C)C1=CC(=CC=C1)OC(=O)N.COS(=O)(=O)[O-]	{1: 4, 14: 4, 22: 1, 28: 1, 29: 3, 30: 1}
Did not match all atoms present	64051-20-3	CCNC(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 2: 1, 14: 4, 22: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	64051-24-7	CCCCCCOCCOP(=O)(O)OCCOCCCCCC.CCNCC	{1: 4, 2: 16, 20: 1, 22: 4, 29: 1, 31: 1}
Did not match all atoms present	64051-25-8	CCCCCCOCCOP(=O)(O)O.CCNCC.CCNCC	{1: 5, 2: 11, 20: 2, 22: 2, 29: 1, 31: 2}
Did not match all atoms present	64051-29-2	CCCCCCCCC=CCCCCCCCCO[P+](=O)OCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 30, 22: 2, 6: 4, 29: 1}
Did not match all atoms present	64051-31-6	CO[Si]N	{1: 1, 30: 1, 22: 1}
Did not match all atoms present	64051-32-7	C(C(C(=O)O)S(=O)(=O)O)C(=O)O.N	{27: 2, 2: 1, 3: 1, 20: 1, 29: 2}
Did not match all atoms present	64051-39-4	CCCCCC1=C(C(=CC=C1)OP(=O)(O)O)CCCCC	{1: 2, 2: 8, 14: 3, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	64051-40-7	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@@H]([C@H]([C@@H]5[C@H]4O5)O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	64057-52-9	CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3S2	{24: 1, 1: 1, 41: 1, 14: 7, 31: 1}
Did not match all atoms present	64057-58-5	C=CCSC(=S)SC(Cl)(Cl)Cl	{2: 1, 4: 1, 5: 1, 6: 1, 7: 1, 40: 2, 17: 3}
Did not match all atoms present	64057-70-1	CC(CC1=CC2=C(C=C1)OCO2)NC.Cl	{1: 2, 2: 1, 3: 1, 11: 1, 14: 3, 17: 1, 23: 2, 31: 1}
Did not match all atoms present	64057-75-6	COCC1=NC=CN=C1	{1: 1, 2: 1, 35: 2, 22: 1, 14: 3}
Did not match all atoms present	64057-79-0	CC(=C)COC(=O)OCC(=C)C	{1: 2, 2: 2, 5: 2, 7: 2}
Did not match all atoms present	64058-13-5	C=CCC1(C(=O)NC(=NC1=O)[S-])CC2=CC=CC=C2.[Na+]	{32: 1, 2: 2, 35: 1, 5: 1, 6: 1, 13: 1, 14: 5, 15: 1, 25: 2}
Did not match all atoms present	64058-14-6	CCC(C)C1(C(=O)NC(=NC1=O)[S-])CC=C.[Na+]	{32: 1, 1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	64058-26-0	C1C[N+]1(CCO)CCO.[Cl-]	{17: 1, 2: 4, 11: 2, 20: 2}
Did not match all atoms present	64058-30-6	C1CN1C(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3	{33: 1, 34: 2, 11: 2, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	64058-36-2	CCN(CC)C1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)O	{1: 2, 2: 2, 3: 1, 33: 1, 14: 9, 20: 1, 24: 1}
Did not match all atoms present	64058-44-2	CC(=O)C1(CCN(CC1)C)C2=CC(=CC=C2)O	{1: 2, 33: 1, 11: 4, 13: 1, 14: 4, 21: 1, 24: 1}
Did not match all atoms present	64058-54-4	CC(=O)COC1=CC=C(C=C1)[As](=O)(O)O	{1: 1, 2: 1, 14: 4, 20: 2, 22: 1, 24: 1, 29: 1}
Did not match all atoms present	64058-57-7	C1=CC(=CC=C1N)[Sb](=O)(O)O.C1=CC(=CC=C1N)[Sb](=O)(O)O.C1=CC(=CC=C1N)[Sb](=O)(O)O.C(=O)(N)N	{24: 1, 30: 5, 20: 6, 29: 3, 14: 12}
Did not match all atoms present	64058-92-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)N	{24: 1, 2: 1, 30: 1, 14: 13}
Did not match all atoms present	64059-26-3	[Be+2].CC(C(=O)[O-])O.CC(C(=O)[O-])O	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	64059-33-2	C1=CSC(=C1)NN	{41: 1, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	64059-42-3	C1=CC2=C(C(=C1)CCl)C(=CC=C2)SCC(=O)O	{40: 1, 17: 1, 2: 2, 27: 1, 14: 6}
Did not match all atoms present	64059-47-8	C[N+](C)(CCO)CC(=O)C1=CC=C(C=C1)C(=O)C[N+](C)(C)CCO.[Br-].[Br-]	{1: 4, 2: 6, 14: 4, 18: 2, 20: 2, 24: 2}
Did not match all atoms present	6406-74-2	CN(C)CC1=CC=C(C=C1)N	{1: 2, 2: 1, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	6406-91-3	CC1=CS(=O)(=O)C2=CC=CC=C12	{1: 1, 29: 2, 14: 5, 15: 1}
Did not match all atoms present	64061-59-2	CC(=CC1=C(C(=CC=C1)[N+](=O)[O-])O)C	{1: 2, 6: 1, 38: 1, 7: 1, 14: 3, 21: 1}
Did not match all atoms present	64063-37-2	CC1=C(C(=C(C=C1)Cl)N)Cl	{1: 1, 30: 1, 14: 2, 17: 2}
Did not match all atoms present	64065-08-3	CP(C)CP(C)C	{1: 4, 2: 1}
Did not match all atoms present	6407-02-9	CC(C)(C)C1=CC=C(S1(=O)=O)C(C)(C)C	{1: 6, 4: 2, 29: 2, 14: 2, 15: 2}
Did not match all atoms present	6407-29-0	C1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)C4=CC=CC=C4O3	{24: 1, 14: 12, 23: 1}
Did not match all atoms present	6407-55-2	COC1=CC=CC2=C1C(=O)C3=C(C2=O)C=CC=C3OC	{1: 2, 22: 2, 14: 6, 25: 2}
Did not match all atoms present	6407-59-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NN	{25: 2, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	64070-10-6	C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[K+].[K+].[Sb+3].[Sb+3]	{24: 4, 3: 4, 29: 4}
Did not match all atoms present	64070-14-0	COC1=CC=CC=C1N.C12C3C(=O)O[Sb-]4(O3)OC(C5C(=O)O[Sb-](O1)(O5)OC2=O)C(=O)O4	{1: 1, 12: 4, 14: 4, 22: 1, 23: 4, 28: 4, 30: 1}
Did not match all atoms present	64070-15-1	[H+].[H+].COC1=CC=C(C=C1)N.COC1=CC=C(C=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{1: 2, 3: 4, 14: 8, 22: 2, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	64071-85-8	C1=CC=C(C=C1)CCN(CCC#N)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Br	{33: 1, 2: 4, 37: 1, 38: 1, 34: 2, 14: 12, 18: 1}
Did not match all atoms present	64071-86-9	COC1=CC(=C(C=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])OC)N=[NH2+].[Cl-].Cl[Zn]Cl	{1: 2, 34: 3, 38: 1, 14: 6, 17: 3, 22: 2, 30: 1}
Did not match all atoms present	64071-87-0	C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)N=NC4=C(C=C(C=C4)[N+](=O)[O-])Cl	{32: 1, 17: 1, 34: 2, 38: 1, 14: 10}
Did not match all atoms present	64078-75-7	C1=CC=C(C=C1)C=CC(=O)NNC(=O)C2=CC=CC=C2O	{24: 2, 31: 2, 14: 9, 6: 2, 21: 1}
Did not match all atoms present	6408-02-2	[H+].C1=CC2=C(C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-])C=C1S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-])C=C1S(=O)(=O)[O-].[Na+].[Na+].[Cr+3]	{17: 2, 34: 4, 29: 6, 14: 16}
Did not match all atoms present	6408-31-7	CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])S(=O)(=O)[O-])Cl)[O-])C3=CC(=CC=C3)S(=O)(=O)[O-].[OH-].[Na+].[Na+].[Cr]	{1: 1, 34: 2, 35: 1, 33: 1, 14: 6, 17: 1, 29: 6}
Did not match all atoms present	6408-34-0	C1=CC=C2C(=C1)C(=O)/C(=N\NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])Cl)/C(=N2)[O-].[OH-].[Na+].[Cr+3]	{34: 1, 35: 1, 14: 6, 15: 2, 17: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	6408-39-5	CC(=O)NC1=CC=C(C=C1)N/N=C/2\C=CC(=O)C(=C2)C(=O)[O-].[Na+]	{1: 1, 34: 1, 14: 7, 15: 2, 24: 2, 25: 1, 31: 2}
Did not match all atoms present	6408-45-3	C1CCC(CC1)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O	{11: 5, 12: 1, 14: 6, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	6408-51-1	CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)[O-].[Na+]	{1: 2, 31: 2, 29: 3, 14: 9, 25: 2}
Did not match all atoms present	6408-68-0	CC1=CC(=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C=CC=C4NC5=C(C=C(C=C5)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 31: 2, 29: 6, 14: 12, 25: 2}
Did not match all atoms present	6408-80-6	CC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 14: 8, 25: 2, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	6408-99-7	CC(C)(C)C1=CC(=NNC2=CC(=CC(=C2O)S(=O)(=O)[O-])[N+](=O)[O-])C(=O)C=C1.CC(C)(C)C1=CC(=NNC2=CC(=CC(=C2O)S(=O)(=O)[O-])[N+](=O)[O-])C(=O)C=C1.[K+].[K+]	{1: 6, 34: 2, 4: 2, 38: 2, 14: 10, 15: 4, 21: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	64082-34-4	O.O.O.O.O.O.O.[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[V].[V].[V].[V]	{}
Did not match all atoms present	64082-35-5	[Li+].[Si-]#[Fe]	{}
Did not match all atoms present	64082-43-5	CC1=C2C(=CC3=C1C=CC4=CC=CC=C43)C=CC=C2C(=O)N	{24: 1, 1: 1, 30: 1, 14: 10}
Did not match all atoms present	6409-09-2	CC1=C(C=C(C=C1N/N=C/2\C=CC(=O)C3=CC=CC=C23)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 34: 1, 14: 8, 15: 1, 17: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	6409-21-8	CC(=O)NC1=C2C(=CC(=CC2=C(C=C1)S(=O)(=O)O)S(=O)(=O)O)O	{1: 1, 14: 4, 20: 2, 21: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	6409-44-5	C1=CC=C2C(=C1)C3=C4C(=C(C=C3)Cl)C=CC=C4C2=O	{17: 1, 14: 9, 25: 1}
Did not match all atoms present	6409-51-4	CN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 33: 1, 14: 8, 17: 1, 29: 2}
Did not match all atoms present	6409-74-1	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O	{24: 1, 25: 2, 21: 1, 14: 11, 31: 1}
Did not match all atoms present	64090-73-9	[CH-]=S.[CH-]=S.[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[N-]=O.[N-]=O.[Mn].[Mn]	{29: 2, 14: 10}
Did not match all atoms present	64090-82-0	[H+].[H+].COC1=CC=CC(=C1)N.COC1=CC=CC(=C1)N.C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].C(C(C(=O)[O-])[O-])(C(=O)[O-])[O-].[Sb+3].[Sb+3]	{1: 2, 3: 4, 14: 8, 22: 2, 24: 4, 29: 4, 30: 2}
Did not match all atoms present	64091-90-3	CN(C(CCC=O)C1=CN=CC=C1)N=O	{1: 1, 2: 2, 3: 1, 33: 1, 34: 1, 14: 4, 35: 1, 26: 1, 29: 1}
Did not match all atoms present	64091-91-4	CN(CCCC(=O)C1=CN=CC=C1)N=O	{1: 1, 2: 3, 35: 1, 33: 1, 34: 1, 14: 4, 24: 1, 29: 1}
Did not match all atoms present	64092-22-4	CN1CCCC1C2=CN=CC=C2.CN1CCCC1C2=CN=CC=C2.C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)[O-].C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)[O-].O.O.O.[Mn+2]	{1: 2, 35: 2, 33: 2, 11: 6, 12: 2, 14: 26, 24: 4}
Did not match all atoms present	64092-48-4	CC1=C(N(C(=C1)CC(=O)[O-])C)C(=O)C2=CC=C(C=C2)Cl.[Na+]	{1: 2, 2: 1, 33: 1, 14: 5, 17: 1, 24: 2}
Did not match all atoms present	64099-82-7	CCCC[Sn](CCCC)(CCCC)C#CC	{1: 4, 2: 9, 10: 2}
Did not match all atoms present	641-13-4	C1=CC2=C3C(=C1)C(=O)C4=C5C3=C(C=C2)C(=O)C6=CC=CC(=C65)C=C4	{25: 2, 14: 10}
Did not match all atoms present	641-16-7	C1=C(C(=C(C(=C1O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 4, 21: 1, 14: 1}
Did not match all atoms present	641-36-1	CN1CCC2=CC=CC3=C2C1CC4=C3C(=C(C=C4)OC)O	{1: 2, 33: 1, 11: 3, 12: 1, 14: 5, 21: 1, 22: 1}
Did not match all atoms present	641-38-3	CC1=CC(=CC2=C1C3=CC(=CC(=C3C(=O)O2)O)O)O	{1: 1, 28: 1, 21: 3, 14: 4}
Did not match all atoms present	641-70-3	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)OC2=O	{28: 2, 38: 1, 14: 3}
Did not match all atoms present	641-91-8	CC1=C(C2=C(C=C1)C(=CC=C2)C)C	{1: 3, 14: 5}
Did not match all atoms present	641-96-3	C1=CC=C(C=C1)C2=CC=CC=C2C3=CC=CC=C3C4=CC=CC=C4	{14: 18}
Did not match all atoms present	6410-10-2	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=C(C=C3)[N+](=O)[O-]	{34: 1, 38: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	6410-26-0	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=CC=CC=C4Cl)C2=O	{34: 1, 14: 14, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	6410-27-1	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=CC(=CC=C4)Cl)/C2=O	{34: 1, 14: 14, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	6410-29-3	COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)N/N=C\3/C4=CC=CC=C4C=C(C3=O)C(=O)NC5=CC=CC=C5	{1: 1, 34: 1, 14: 18, 15: 2, 22: 1, 24: 2, 25: 1, 31: 3}
Did not match all atoms present	6410-35-1	CC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)Cl)Cl)/C2=O	{1: 1, 34: 1, 14: 12, 15: 2, 17: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	6410-39-5	COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=C(C=C4)Cl)[N+](=O)[O-])/C2=O	{1: 1, 34: 1, 38: 1, 14: 12, 15: 2, 17: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	6410-40-8	COC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)Cl)Cl)/C2=O	{1: 2, 34: 1, 14: 11, 15: 2, 17: 2, 22: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	6410-42-0	C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)NN=C3C(=CC4=C(C3=O)C=CC(=C4)NC(=O)NC5=CC6=C(C=C5)C(=O)/C(=N\NC7=CC=CC8=C7C=CC=C8S(=O)(=O)[O-])/C(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 20, 15: 4, 24: 1, 25: 2, 29: 12, 31: 4}
Did not match all atoms present	6410-47-5	CC1=NN(C(=O)C1C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C4C(=NN(C4=O)NN=C5C6=C(C=C(C=C6)[N+](=O)[O-])C(=CC5=O)S(=O)(=O)[O-])C)NN=C7C8=C(C=C(C=C8)[N+](=O)[O-])C(=CC7=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 35: 2, 38: 2, 33: 2, 12: 2, 14: 16, 15: 6, 24: 1, 25: 4, 29: 6, 31: 4}
Did not match all atoms present	64109-72-4	CC[C@H]1C[C@]2([C@@H](CC[C@@H]2O)[C@H]3[C@H]1C4=C(CC3)C=C(C=C4)O)C	{1: 2, 2: 1, 11: 5, 12: 5, 13: 1, 14: 3, 20: 1, 21: 1}
Did not match all atoms present	6411-21-8	CCP(CC)CCP(CC)CC	{1: 4, 2: 6}
Did not match all atoms present	6411-24-1	CCCCCCCCCCCCP(CCCCCCCCCCCC)CCCCCCCCCCCC	{1: 3, 2: 33}
Did not match all atoms present	64118-84-9	C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=C(C=C2Cl)O)Cl	{2: 1, 14: 6, 17: 2, 21: 1, 27: 1, 31: 1}
Did not match all atoms present	64120-46-3	CC1(C2CCC(C2)(C1=C)[Hg]Cl)C	{1: 2, 5: 1, 11: 3, 12: 1, 13: 2, 15: 1, 17: 1}
Did not match all atoms present	64123-46-2	CCC1=C(C=C(C=C1)[N+](=O)[O-])COC	{1: 2, 2: 2, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	64123-64-4	CC(C)C1=C(C=C(C=C1)[N+](=O)[O-])CCl	{1: 2, 2: 1, 3: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	64123-77-9	COC(=O)CC1=CC(=CC=C1)F	{16: 1, 1: 1, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	64124-14-7	CN(C)C1=NC(=NC(=N1)N(C)O)N(C)C	{1: 5, 35: 3, 20: 1, 33: 3}
Did not match all atoms present	64124-17-0	CN(C)C1=NC(=NC(=N1)N(C)CC(=O)O)N(C)C	{1: 5, 2: 1, 27: 1, 35: 3, 33: 3}
Did not match all atoms present	6413-97-4	CC1C(OC(O1)C=CC2=CC=CC=C2)C	{1: 2, 12: 3, 14: 5, 6: 2, 23: 2}
Did not match all atoms present	64130-93-4	CC1=CC=C(C=C1)N=NC2=CC(=C(C=C2OC)N)OC	{1: 3, 30: 1, 34: 2, 22: 2, 14: 6}
Did not match all atoms present	64130-95-6	CC1(CC2=C(C(=O)C1)SC(=[N+]2C)N=NC3=CC=C(C=C3)N(C)C)C.CC1(CC2=C(C(=O)C1)SC(=[N+]2C)N=NC3=CC=C(C=C3)N(C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 10, 34: 4, 33: 4, 41: 2, 11: 4, 13: 2, 14: 8, 17: 4, 25: 2}
Did not match all atoms present	64130-98-9	CCOC1=CC=C(C=C1)CN/N=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.COS(=O)(=O)[O-]	{1: 5, 2: 2, 34: 1, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1, 22: 2, 29: 3, 31: 1}
Did not match all atoms present	64131-03-9	O.O.O.O.O.O.O.[O-]Cl.[Na+]	{17: 1, 29: 1}
Did not match all atoms present	64131-06-2	CC1([C@@H](N2[C@H](S1)C(C2=O)NC(=O)[C@@H](C3=CC=CC=C3)NC(=O)C4=CNC5=C(C4=O)N=CC=C5)C(=O)O)C	{32: 1, 1: 2, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 9, 35: 1, 24: 2, 25: 2, 27: 1, 31: 2}
Did not match all atoms present	64131-07-3	CCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 75, 29: 1, 22: 3}
Did not match all atoms present	64131-08-4	CCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 69, 29: 1, 22: 3}
Did not match all atoms present	64131-09-5	CCCCCCCCCCCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 63, 29: 1, 22: 3}
Did not match all atoms present	64131-10-8	CCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O	{1: 1, 2: 22, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	64131-11-9	CCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 50, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	64131-12-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 54, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	64131-13-1	CCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 46, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	64131-14-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O	{1: 1, 2: 27, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	64131-15-3	CCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O	{1: 1, 2: 25, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	64131-16-4	CCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(O)O	{1: 1, 2: 23, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	64131-18-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 81, 29: 1, 22: 3}
Did not match all atoms present	64131-25-5	CCCCCCCCCCC(C(=O)OC)S(=O)(=O)O	{1: 2, 2: 9, 3: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	64131-26-6	CCCCCCCCC(C(=O)OC)S(=O)(=O)O	{1: 2, 2: 7, 3: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	64131-28-8	CCCCCCCCCC1=CC(=C(C(=C1)CCCCCCCCC)O)CC2=CC(=CC(=C2O)CC3=C(C(=CC(=C3)CCCCCCCCC)CCCCCCCCC)O)CCCCCCCCC	{1: 5, 2: 42, 21: 3, 14: 6}
Did not match all atoms present	64131-86-8	C[Si](C)(C)CC1=CC(=C(C=C1C[Si](C)(C)C)C[Si](C)(C)C)C[Si](C)(C)C	{1: 12, 2: 4, 14: 2}
Did not match all atoms present	64131-87-9	C[Si](C)(C)CC1=C(C(=C(C(=C1C[Si](C)(C)C)C[Si](C)(C)C)C[Si](C)(C)C)C[Si](C)(C)C)C[Si](C)(C)C	{1: 18, 2: 6}
Did not match all atoms present	6414-38-6	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@@H](CC4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 2, 3: 2, 33: 1, 11: 5, 12: 4, 13: 1, 14: 2, 20: 3, 22: 1, 23: 1, 27: 2}
Did not match all atoms present	64140-39-2	C1C2CC3CC1CC(C2)(C3)CCOC(=O)C4=CN=CC=C4	{2: 2, 35: 1, 11: 6, 12: 3, 13: 1, 14: 4, 28: 1}
Did not match all atoms present	64140-42-7	C1C2CC3CC1CC(C2)(C3)CCOC(=O)C4=CC=NC=C4	{2: 2, 35: 1, 11: 6, 12: 3, 13: 1, 14: 4, 28: 1}
Did not match all atoms present	64140-51-8	CCCN(CCC)CC(=O)N1CCC2=CC=CC=C21	{1: 2, 2: 5, 33: 2, 11: 2, 14: 4, 24: 1}
Did not match all atoms present	64143-07-3	CC1C(=O)N(C(=S)N1C(=O)C)C	{1: 3, 33: 2, 12: 1, 15: 1, 24: 1, 25: 1}
Did not match all atoms present	64147-48-4	[O-]P(=O)([O-])[O-].[F-].[Na+].[Fe+3]	{16: 1, 29: 4}
Did not match all atoms present	64153-17-9	CCN1CCC[C@H]1C(=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC3=CC=C(C=C3)OCC4=CC=CC=C4)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CO)NC(=O)OCC7=CC=CC=C7.Cl	{32: 1, 1: 3, 2: 12, 3: 8, 33: 1, 7: 1, 11: 3, 12: 1, 34: 1, 14: 24, 17: 1, 20: 2, 22: 1, 24: 8, 28: 1, 30: 2, 31: 8}
Did not match all atoms present	64153-23-7	CCN1CCC[C@H]1C(=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC3=CC=C(C=C3)OCC4=CC=CC=C4)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CO)NC(=O)OCNC=O.Cl	{32: 1, 1: 3, 2: 12, 3: 8, 33: 1, 7: 1, 11: 3, 12: 1, 34: 1, 14: 19, 17: 1, 20: 2, 22: 1, 24: 8, 26: 1, 28: 1, 30: 2, 31: 9}
Did not match all atoms present	64157-15-9	[H+].[H+].CCCCCCCCCCCCCOP([O-])OCCCCCCCCCCCCC.CCCCCCCCCCCCCOP([O-])OCCCCCCCCCCCCC.CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]	{1: 12, 2: 48, 3: 4, 29: 6, 22: 4}
Did not match all atoms present	64158-97-0	CN(C(=O)OC1=CC=CC2=CC=CC=C21)N=O	{1: 1, 34: 1, 33: 1, 14: 7, 28: 1, 29: 1}
Did not match all atoms present	6416-33-7	COC1=CC=CC=C1N/N=C\2/C(=CC3=C(C=CC(=C3C2=O)NC(=O)C4=C(C=C(C=C4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 10, 15: 2, 17: 2, 22: 1, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	6416-39-3	CC1CC(C2=CC=CC=C12)C3=CC=CC=C3	{1: 1, 11: 1, 12: 2, 14: 9}
Did not match all atoms present	6416-57-5	C1=CC=C2C(=C1)C=CC=C2N=NC3=C(C=C(C=C3)N)N	{34: 2, 30: 2, 14: 10}
Did not match all atoms present	6416-59-7	CC1=CC=CC=C1N=NC2=C(C=C(C(=C2)C)N)N.Cl	{1: 2, 34: 2, 30: 2, 14: 6, 17: 1}
Did not match all atoms present	6416-68-8	C1=CC=C(C=C1)/C=C/C2=C(C=C(C=C2)N3N=C4C=CC5=CC=CC=C5C4=N3)S(=O)(=O)[O-].[Na+]	{33: 1, 35: 2, 14: 14, 6: 2, 29: 3}
Did not match all atoms present	64160-38-9	C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{24: 1, 17: 1, 38: 1, 14: 8, 31: 1}
Did not match all atoms present	64160-40-3	CCOO[N+](=O)[O-]	{1: 1, 2: 1, 22: 2}
Did not match all atoms present	64164-90-5	C1=C2C(=NC(=N1)NN)N=CN2	{32: 1, 35: 3, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	64164-99-4	CCC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O	{1: 3, 2: 1, 4: 1, 14: 8, 24: 1, 27: 1}
Did not match all atoms present	6417-18-1	CCCCN(CCC#N)C1=CC=CC=C1.CCCCN(CCC#N)C1=CC=CC=C1.OS(=O)(=O)O	{1: 2, 2: 10, 37: 2, 33: 2, 14: 10, 20: 2, 29: 2}
Did not match all atoms present	6417-31-8	CC1=C(C2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)N/N=C/4\C(=CC5=C(C4=O)C=CC(=C5)NC(=O)NC6=CC=C(C=C6)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 1, 35: 1, 41: 1, 14: 13, 15: 2, 24: 2, 25: 1, 29: 9, 31: 4}
Did not match all atoms present	6417-35-2	CC(=O)N(C1CCCCC1)C2=CC=C(C=C2)N/N=C/3\C(=CC4=C(C=CC(=C4C3=O)NC(=O)C5=CC=CC=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 33: 1, 11: 5, 12: 1, 14: 12, 15: 2, 24: 2, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	6417-44-3	CC1=CC(=C(C=C1)N=NC2=CC(=CC(=C2N)C)C)C	{1: 4, 34: 2, 30: 1, 14: 5}
Did not match all atoms present	6417-50-1	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=C(C=C5)C(=O)NC6=CC=CC7=C6C(=O)C8=C(C7=O)C(=CC=C8)NC(=O)C9=CC=CC=C9	{24: 4, 25: 4, 14: 26, 31: 4}
Did not match all atoms present	64173-96-2	C1=CC=C2C(=C1)C(=CC(=C2[O-])[N+]#N)S(=O)(=O)[O-].[Na+]	{34: 1, 29: 3, 14: 5}
Did not match all atoms present	64174-59-0	C[Si](C)(C)CC(=C(C[Si](C)(C)C)C[Si](C)(C)C)C[Si](C)(C)C	{1: 12, 2: 4, 7: 2}
Did not match all atoms present	64175-53-7	CC1=C(C(=CC=C1)C)N2CCCC2	{1: 2, 11: 4, 14: 3, 33: 1}
Did not match all atoms present	6418-38-8	C1=CC(=C(C(=C1)F)F)O	{16: 2, 21: 1, 14: 3}
Did not match all atoms present	64181-63-1	CC(C)NC1=C(C2=CC=CC=C2C=C1)N=NC3=CC=C(C=C3)N=NC4=CC=CC=C4	{1: 2, 34: 4, 3: 1, 14: 15, 31: 1}
Did not match all atoms present	64186-72-7	CN1CCN(C2=C1C(=O)C2=O)C	{1: 2, 11: 2, 33: 2, 25: 2}
Did not match all atoms present	64187-24-2	C=COC(=O)CNC(=O)OCC1=CC=CC=C1	{2: 2, 5: 1, 6: 1, 14: 5, 28: 2, 31: 1}
Did not match all atoms present	64187-25-3	C1=CC=C(C=C1)COC(=O)NCC(=O)OC(CBr)Br	{2: 3, 3: 1, 14: 5, 18: 2, 28: 2, 31: 1}
Did not match all atoms present	64187-27-5	CC(C)C[C@@H](C(=O)OC=C)NC(=O)OCC1=CC=CC=C1	{1: 2, 2: 2, 3: 2, 5: 1, 6: 1, 14: 5, 28: 2, 31: 1}
Did not match all atoms present	64187-28-6	CC(C)C[C@@H](C(=O)OC(CBr)Br)NC(=O)OCC1=CC=CC=C1	{1: 2, 2: 3, 3: 3, 14: 5, 18: 2, 28: 2, 31: 1}
Did not match all atoms present	64187-32-2	C=C[C@@]1(CCCN1C(=O)OCC2=CC=CC=C2)C(=O)O	{33: 1, 2: 1, 5: 1, 6: 1, 11: 3, 13: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	64187-33-3	C1CC(N(C1)C(=O)OCC2=CC=CC=C2)(C(CBr)Br)C(=O)O	{33: 1, 2: 2, 3: 1, 11: 3, 13: 1, 14: 5, 18: 2, 27: 1, 28: 1}
Did not match all atoms present	64187-42-4	C=COC(=O)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2	{2: 2, 3: 1, 5: 1, 6: 1, 14: 10, 28: 2, 31: 1}
Did not match all atoms present	64187-43-5	C1=CC=C(C=C1)C[C@@H](C(=O)OC(CBr)Br)NC(=O)OCC2=CC=CC=C2	{2: 3, 3: 2, 14: 10, 18: 2, 28: 2, 31: 1}
Did not match all atoms present	6419-19-8	C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O	{33: 1, 2: 3, 20: 6, 29: 3}
Did not match all atoms present	64192-22-9	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1CCC2=CC=C(C=C2)O)O	{2: 2, 27: 2, 21: 2, 14: 12}
Did not match all atoms present	642-28-4	C1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)O	{3: 1, 20: 1, 14: 12}
Did not match all atoms present	642-29-5	C1=CC=C(C=C1)C(=O)C2=CC=CC3=CC=CC=C32	{24: 1, 14: 12}
Did not match all atoms present	642-31-9	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=O	{26: 1, 14: 9}
Did not match all atoms present	642-32-0	CCC1=C(C(=C(C=C1)CC)CC)CC	{1: 4, 2: 4, 14: 2}
Did not match all atoms present	642-44-4	CCN1C(=O)C=C(N(C1=O)CC=C)N	{1: 1, 2: 2, 5: 1, 6: 1, 33: 2, 14: 1, 25: 2, 30: 1}
Did not match all atoms present	642-65-9	CC(=O)N(C1=CC2=C(C=C1)C3=CC=CC=C3C2)C(=O)C	{24: 2, 1: 2, 11: 1, 14: 7, 33: 1}
Did not match all atoms present	642-71-7	COC1=CC(=CC(=C1OC)OC)O	{1: 3, 22: 3, 21: 1, 14: 2}
Did not match all atoms present	642-72-8	CN(C)CCCOC1=NN(C2=CC=CC=C21)CC3=CC=CC=C3	{1: 2, 2: 4, 35: 1, 33: 2, 14: 9, 22: 1}
Did not match all atoms present	642-84-2	C1=CC(=C(C=C1NC(=O)C2=C(C=CC(=C2)Cl)O)Cl)Cl	{24: 1, 17: 3, 21: 1, 14: 6, 31: 1}
Did not match all atoms present	6420-04-8	CC1=C/C(=N\NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)[O-])C)C)C)/C=C(C1=O)C(=O)[O-].[Na+].[Na+]	{1: 4, 34: 3, 35: 1, 33: 1, 12: 1, 14: 12, 15: 4, 24: 1, 25: 2, 29: 3, 31: 1}
Did not match all atoms present	6420-06-0	CC1=CC=CC(=C1)C2=CC(=C(C=C2)NNC3=C/C(=N/N=C/4\C=C(C5=CC=CC=C5C4=O)S(=O)(=O)[O-])/C(=O)C6=C3C(=CC=C6)S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 34: 2, 14: 16, 15: 4, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	6420-28-6	CC1=C(C=CC=C1NNC2=CC=C(C=C2)C(=O)N=C3C=C(C=C(C3=O)C(=O)[O-])S(=O)(=O)[O-])NC(=O)NC4=C(C(=CC=C4)NNC5=CC=C(C=C5)C(=O)N=C6C=C(C=C(C6=O)C(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 18, 15: 6, 24: 5, 25: 2, 29: 6, 31: 6}
Did not match all atoms present	6420-29-7	CC1=CC(=C(C=C1NC(=O)NC2=CC(=C(C=C2C)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 4, 14: 14, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	6420-36-6	CC1=CC(=C(C=C1N=NC2=CC(=CC(=C2C)NC(=O)C3=CC(=CC=C3)N)S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC(=CC(=C5C)NC(=O)C6=CC(=CC=C6)N)S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 6, 34: 4, 14: 16, 22: 2, 24: 3, 29: 6, 30: 2, 31: 4}
Did not match all atoms present	6420-38-8	CC1=CC(=C(C=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=C(C=C(C=C6)C)C)/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 4, 34: 2, 14: 14, 15: 4, 25: 2, 29: 6, 31: 3}
Did not match all atoms present	6420-39-9	C1=CC(=CC(=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC4=CC5=C(C=C4)C(=O)C(=NNC6=CC=CC(=C6)N)C(=C5)S(=O)(=O)O)S(=O)(=O)O)N	{34: 2, 14: 16, 15: 4, 20: 2, 25: 2, 29: 4, 30: 2, 31: 3}
Did not match all atoms present	6420-44-6	CC1=C(C=CC(=C1)S(=O)(=O)[O-])N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N/NC6=CC=CC=C6OC)/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 15, 15: 4, 22: 1, 24: 1, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	6420-46-8	C1=CC(=CC(=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=CC(=C6)N)/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{34: 2, 14: 16, 15: 4, 24: 1, 25: 2, 29: 6, 30: 2, 31: 4}
Did not match all atoms present	6421-04-1	CCOC(=O)C1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)C(=O)OCC)[O-]	{1: 2, 2: 2, 33: 1, 34: 1, 14: 8, 28: 2, 29: 1}
Did not match all atoms present	6421-30-3	CCOC(=O)C=CC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OC	{1: 2, 2: 1, 6: 3, 34: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	6421-82-5	C1=CC=C2C(=C1)C(=O)C(S2)C(=O)O	{25: 1, 27: 1, 12: 1, 14: 4, 41: 1}
Did not match all atoms present	6422-83-9	CC1=C(C=C(C=C1)N2C(=O)C=CC2=O)N3C(=O)C=CC3=O	{1: 1, 33: 2, 14: 7, 25: 4}
Did not match all atoms present	6422-86-2	CCCCC(CC)COC(=O)C1=CC=C(C=C1)C(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	64226-51-3	C(C(C(=O)[O-])S(=O)(=O)[O-])C(=O)N.[Na+].[Na+]	{24: 2, 2: 1, 3: 1, 29: 3, 30: 1}
Did not match all atoms present	6423-43-4	CC(CO[N+](=O)[O-])O[N+](=O)[O-]	{1: 1, 2: 1, 3: 1, 22: 2}
Did not match all atoms present	6424-20-0	C(=O)[O-].C(=O)[O-].O.O.[Co+2]	{26: 2}
Did not match all atoms present	6424-34-6	CC1=CC(=C(C=C1N)N)N=C2C=CC(=[N+](C)C)C=C2.O.[Cl-]	{1: 3, 34: 1, 33: 1, 14: 6, 15: 2, 17: 1, 30: 2}
Did not match all atoms present	6424-75-5	CC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)Br)S(=O)(=O)[O-].[Na+]	{1: 1, 14: 8, 18: 1, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	6424-76-6	C1COC2=C3C4=C(C=CC5=C4C(=C2)C6=CC=CC=C6C5=O)C7=C8C3=C(O1)C=C9C8=C(C=C7)C(=O)C1=CC=CC=C19	{25: 2, 11: 2, 14: 14, 23: 2}
Did not match all atoms present	64240-65-9	CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCC(C)CC	{1: 3, 2: 7, 3: 1, 14: 8, 22: 1, 28: 2}
Did not match all atoms present	64241-34-5	CCN(CC(C)O)C1=NN=C(C=C1)NNC(=O)OCC	{1: 3, 2: 3, 3: 1, 33: 1, 14: 2, 35: 2, 20: 1, 28: 1, 31: 2}
Did not match all atoms present	64245-99-4	C1OC2=C(O1)C=C(C=C2)OCC(COC3=CC4=C(C=C3)OCO4)N	{2: 2, 3: 1, 11: 2, 14: 6, 22: 2, 23: 4, 30: 1}
Did not match all atoms present	64246-03-3	CN(C)CCCC(COC1=CC2=C(C=C1)OCO2)(COC3=CC4=C(C=C3)OCO4)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 7, 4: 2, 33: 1, 11: 2, 14: 6, 20: 2, 22: 2, 23: 4, 27: 3}
Did not match all atoms present	64246-07-7	CNC(=O)OC(CCC[NH+](C)C)(COC1=CC2=C(C=C1)OCO2)COC3=CC4=C(C=C3)OCO4.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O	{1: 3, 2: 7, 4: 2, 11: 2, 14: 6, 20: 1, 22: 2, 23: 4, 24: 1, 27: 2, 28: 1, 31: 1}
Did not match all atoms present	64246-13-5	CC(=O)OC(CCCN1CCCCC1)(COC2=CC3=C(C=C2)OCO3)COC4=CC5=C(C=C4)OCO5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 1, 2: 7, 4: 2, 33: 1, 11: 7, 14: 6, 20: 1, 22: 2, 23: 4, 27: 3, 28: 1}
Did not match all atoms present	64246-17-9	C1CCN(CC1)CCCC(COC2=CC3=C(C=C2)OCO3)COC4=CC5=C(C=C4)OCO5.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{33: 1, 2: 7, 3: 1, 4: 1, 11: 7, 14: 6, 20: 1, 22: 2, 23: 4, 27: 3}
Did not match all atoms present	64248-56-2	C1=CC(=C(C(=C1)F)Br)F	{16: 2, 18: 1, 14: 3}
Did not match all atoms present	64248-58-4	C1=CC(=C(C=C1I)F)F	{16: 2, 19: 1, 14: 3}
Did not match all atoms present	64248-62-0	C1=CC(=C(C=C1C#N)F)F	{16: 2, 37: 1, 14: 3}
Did not match all atoms present	64248-63-1	C1=C(C=C(C=C1F)F)C#N	{16: 2, 37: 1, 14: 3}
Did not match all atoms present	64248-64-2	C1=CC(=C(C=C1F)C#N)F	{16: 2, 37: 1, 14: 3}
Did not match all atoms present	64249-01-0	CC(C)N(C1=CC=C(C=C1)Cl)C(=O)CSP(=S)(OC)OC	{1: 4, 2: 1, 3: 1, 33: 1, 40: 1, 14: 4, 17: 1, 22: 2, 24: 1}
Did not match all atoms present	64249-79-2	C1=CC=C(C=C1)C(=CC(=O)C(C(F)F)(F)F)S	{3: 1, 4: 1, 6: 1, 7: 1, 39: 1, 14: 5, 16: 4, 24: 1}
Did not match all atoms present	64253-71-0	CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)N)OC(CC(C)O)OC(C)CO	{1: 5, 2: 2, 3: 3, 11: 3, 12: 5, 13: 1, 14: 3, 20: 3, 21: 2, 22: 4, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	64253-73-2	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@H]7CC[C@@H]([C@@H](O7)C)O)O)N(C)C)O	{1: 7, 2: 1, 33: 1, 11: 5, 12: 13, 13: 1, 14: 3, 20: 3, 21: 3, 22: 3, 23: 3, 25: 2, 28: 1}
Did not match all atoms present	64267-17-0	COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC4=C(C=C(C=C4)OC)OC3=O	{24: 1, 1: 2, 28: 2, 22: 2, 14: 8}
Did not match all atoms present	64267-45-4	C[C@H]1[C@@H]([C@@]([C@H]([C@@H](O1)O[C@H]2C[C@]([C@@H](C3=C2C(=C4C(=C3)C(=O)C5=C6C(=CC(=C5C4=O)O)[C@@]7([C@@H]([C@H]([C@@H]([C@H](O6)O7)O)N(C)C)O)C)O)C(=O)O)(C)O)OC)(C)OC)OC	{1: 9, 33: 1, 11: 1, 12: 10, 13: 3, 14: 2, 20: 3, 21: 2, 22: 4, 23: 3, 25: 2, 27: 1}
Did not match all atoms present	64267-46-5	C[C@H]1[C@@H]([C@@]([C@H]([C@@H](O1)O[C@H]2C[C@](CC3=C2C(=C4C(=C3)C(=O)C5=C6C(=CC(=C5C4=O)O)[C@@]7([C@@H]([C@H]([C@@H]([C@H](O6)O7)O)N(C)C)O)C)O)(C)O)OC)(C)OC)OC	{1: 9, 33: 1, 11: 2, 12: 9, 13: 3, 14: 2, 20: 3, 21: 2, 22: 4, 23: 3, 25: 2}
Did not match all atoms present	64267-66-9	COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C5C(C(OC5OC4=C1)OC(=O)C6=CC(=CC=C6)Cl)O	{1: 1, 11: 2, 12: 4, 14: 5, 17: 1, 20: 1, 22: 1, 23: 2, 25: 1, 28: 2}
Did not match all atoms present	6427-17-4	CN(C)C.NS(=O)(=O)O	{1: 3, 20: 1, 29: 2, 30: 1, 33: 1}
Did not match all atoms present	6427-66-3	C1=CC(=CC=C1C(=O)O)N=[N+]=[N-]	{34: 2, 27: 1, 14: 4}
Did not match all atoms present	6427-86-7	CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 28}
Did not match all atoms present	6427-90-3	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Cr+2]	{24: 2, 1: 2, 2: 12}
Did not match all atoms present	6428-18-8	CCOC1=C(C2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)N=NC3=CC(=C(C(=C3)C)N=NC4=CC5=C(C=CC=C5S(=O)(=O)[O-])C=C4)C)N/N=C/6\C(=CC7=CC(=CC(=C7C6=O)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 4, 2: 1, 34: 5, 14: 15, 15: 2, 22: 1, 24: 1, 25: 1, 29: 12, 31: 2}
Did not match all atoms present	6428-19-9	CCOC1=C(C2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)N=NC3=C4C=C(C=CC4=C(C=C3)N=NC5=CC(=CC=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/6\C(=CC7=C(C6=O)C=CC(=C7)NC(=O)C8=CC(=CC=C8)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 1, 34: 5, 14: 21, 15: 2, 22: 1, 24: 1, 25: 1, 29: 12, 30: 1, 31: 2}
Did not match all atoms present	6428-31-5	C1=CC(=CC=C1NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N=NC5=C(C=C(C=C5)N)N)S(=O)(=O)O)S(=O)(=O)O)N=NC6=C(C=C(C=C6)N)N	{34: 7, 14: 16, 15: 2, 20: 2, 25: 1, 29: 4, 30: 5, 31: 1}
Did not match all atoms present	6428-38-2	C1=CC(=CC=C1NC2=C(C=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N=NC5=C(C=C(C=C5)NCCO)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/6\C(=CC7=C(C6=O)C=C(C=C7)N=NC8=C(C=C(C=C8)NCCO)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 4, 34: 6, 14: 21, 15: 4, 20: 2, 25: 2, 29: 9, 30: 2, 31: 5}
Did not match all atoms present	64282-98-0	CC1=C(C=CC(=C1)N(CCC#N)CCN2C(=O)CCC2=O)/C=C/C3C(C4=CC=CC=C4N3C)(C)C.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Zn]	{1: 4, 2: 4, 37: 1, 6: 2, 33: 3, 11: 2, 12: 1, 13: 1, 14: 7, 25: 2, 29: 8}
Did not match all atoms present	64284-35-1	CC(C)([C@H](C1=CC=C(C=C1)OC)O)C(=O)[O-]	{1: 3, 3: 1, 4: 1, 14: 4, 20: 1, 22: 1, 24: 1}
Did not match all atoms present	64285-73-0	CC1=CC(=CC(=C1N)C)C2=CC(=C(C(=C2)C)N)C.Cl.Cl	{1: 4, 30: 2, 14: 4, 17: 2}
Did not match all atoms present	64285-95-6	C1=CC(=CC=C1N=C=S)OC(F)(F)F	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 22: 1}
Did not match all atoms present	64287-26-9	CCN(CC)C1=CC(=CC=C1)N(CC)CC	{1: 4, 2: 4, 14: 4, 33: 2}
Did not match all atoms present	64296-43-1	C1=CC(=C(C=C1C2(C(C(C3=C(C=C(C=C3O2)O)O)O)O)O)O)O	{12: 2, 13: 1, 14: 5, 20: 3, 21: 4, 23: 1}
Did not match all atoms present	643-28-7	CC(C)C1=CC=CC=C1N	{1: 2, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	643-43-6	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CC(=O)O	{2: 1, 27: 1, 38: 2, 14: 3}
Did not match all atoms present	643-58-3	CC1=CC=CC=C1C2=CC=CC=C2	{1: 1, 14: 9}
Did not match all atoms present	643-60-7	COC1=C(C(=C2CNCCC2=C1)O)OC	{32: 1, 1: 2, 11: 3, 14: 1, 21: 1, 22: 2}
Did not match all atoms present	643-65-2	CC1=CC=CC(=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9}
Did not match all atoms present	643-75-4	C1=CC=C(C=C1)C(=O)C(=O)C(=O)C2=CC=CC=C2	{24: 3, 14: 10}
Did not match all atoms present	643-76-5	C1=CC=C(C=C1)C=CC2(C=CC=CC2F)F	{16: 2, 14: 9, 12: 1, 13: 1, 6: 2}
Did not match all atoms present	643-79-8	C1=CC=C(C(=C1)C=O)C=O	{26: 2, 14: 4}
Did not match all atoms present	643-84-5	COC1=CC(=CC(=C1O)OC)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]	{1: 2, 14: 5, 17: 1, 21: 4, 22: 2, 23: 1}
Did not match all atoms present	643-93-6	CC1=CC=CC(=C1)C2=CC=CC=C2	{1: 1, 14: 9}
Did not match all atoms present	643-94-7	C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2OC(=O)C3=CC=CC=C3	{28: 2, 14: 14}
Did not match all atoms present	64309-76-8	C1=CC2=C(C=C1N)C=NN2.Cl	{32: 1, 17: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	64323-57-5	C1=C2N=CN=C3N2C(=NC=N3)C=N1	{33: 1, 35: 5, 14: 4}
Did not match all atoms present	64325-78-6	COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OC[C@@H]4[C@H](C[C@@H](O4)N5C=NC6=C5N=CN=C6NC(=O)C7=CC=CC=C7)O	{1: 2, 2: 1, 35: 3, 4: 1, 33: 1, 11: 1, 12: 3, 14: 20, 20: 1, 22: 3, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	64326-48-3	C1=CC(=CC=C1S(=O)(=O)/C=C/C#N)Cl	{17: 1, 37: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	64334-96-9	CC1=NC2=C(C=C1)C=CC(=C2)N	{1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	64339-13-5	CO[Si](CCCNCCN)(OC)OC.Cl	{1: 3, 2: 5, 17: 1, 22: 3, 30: 1, 31: 1}
Did not match all atoms present	64339-43-1	C1=C(C=C(C=C1O)I)O	{19: 1, 21: 2, 14: 3}
Did not match all atoms present	6434-57-7	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=C(C=C(C=C3)[N+](=O)[O-])O	{34: 1, 38: 1, 14: 9, 15: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	64343-19-7	CC(C)(C)OOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OOC(C)(C)C)C(=O)O	{1: 6, 4: 2, 14: 2, 22: 2, 27: 2, 28: 2}
Did not match all atoms present	64345-99-9	CCCCCCCCCCCCCCCCOS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 19, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	64346-02-7	CCCCCCCCCCCCCCOS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 17, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	64346-07-2	CC1=C(C=C(C=C1)SSC2=CC(=C(C=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	64346-09-4	C1CCC2=C(C1)C=CC=C2S(=O)(=O)[O-].[Na+]	{11: 4, 29: 3, 14: 3}
Did not match all atoms present	64346-10-7	COC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=CC=CC=C3C(=NNC4=C(C=CC(=C4)Cl)OC)C2=O	{1: 3, 34: 1, 14: 11, 15: 2, 17: 1, 22: 3, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	64346-12-9	CCCCCCCCCCCCCCCCCCOP(=O)(O)O.C(CO)NCCO	{1: 1, 2: 21, 20: 4, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	64346-13-0	CCCCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)NCCO	{1: 1, 2: 21, 20: 3, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	64346-20-9	CCCCCCCCCCCCCCCC(=O)OCC[N+]1(CC[N+](CC1)(C)CCOC(=O)CCCCCCCCCCCCCCC)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-]	{1: 6, 2: 32, 11: 4, 22: 2, 28: 2, 29: 6}
Did not match all atoms present	64346-24-3	CN(C)CCCOC1=C(C(=O)N2C=CN=CC2=N1)C3=CC=CC=C3.Br	{1: 2, 2: 3, 35: 2, 33: 2, 14: 8, 18: 1, 22: 1, 25: 1}
Did not match all atoms present	64346-26-5	CCCCCCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]	{1: 1, 2: 21, 20: 2, 14: 5, 17: 1}
Did not match all atoms present	64346-29-8	C1COCCN1C(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)N4CCOCC4	{33: 2, 2: 1, 11: 8, 14: 8, 23: 2, 24: 2, 31: 2}
Did not match all atoms present	64346-35-6	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\4/C(=CC5=C(C4=O)C=CC(=C5)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 3, 14: 11, 15: 2, 22: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	64346-37-8	CC1=C(C=CC(=C1)N)N=NC2=CC(=C(C=C2)N=NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 30: 1, 34: 4, 29: 6, 14: 11}
Did not match all atoms present	64346-38-9	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)O)C)NN=C3C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 1, 14: 10, 15: 1, 21: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	64346-40-3	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])N=NC3=CC(=C(C=C3)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 34: 4, 38: 1, 14: 15, 24: 1, 29: 6, 31: 1}
Did not match all atoms present	64346-51-6	CCCCCCCCCCOP(=O)(O)O.C(CO)NCCO.C(CO)NCCO	{1: 1, 2: 17, 20: 6, 22: 1, 29: 1, 31: 2}
Did not match all atoms present	64346-52-7	CCCCN(CCCC)C1=CC=C(C=C1)C(C#N)C(C#N)C#N	{1: 2, 2: 6, 3: 2, 37: 3, 33: 1, 14: 4}
Did not match all atoms present	64346-56-1	CC1=CC(=C(C=C1)C)SSC2=CC=CC(=C2C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	64346-57-2	CC1=CC(=C(C=C1)C)SSC2=CC(=C(C=C2)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	64346-58-3	CCCCCCCCCCCCOP(=O)(O)O.C1COCCN1	{32: 1, 1: 1, 2: 11, 11: 4, 20: 2, 22: 1, 23: 1, 29: 1}
Did not match all atoms present	64346-60-7	CCC(CN(CCC#N)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C)O	{1: 2, 2: 4, 3: 1, 37: 1, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	64346-61-8	CCN(CC[N+](C)(CC)CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C.[Cl-]	{1: 5, 2: 5, 38: 1, 33: 1, 34: 2, 14: 6, 17: 2}
Did not match all atoms present	64346-65-2	CCCCCCCCCCCCCCCC(=O)N(CC[N+](C)(CCN(CCN(CCO)CCOC(=O)CCCCCCCCCCCCCCC)CCO)CCO)CCO.COS(=O)(=O)[O-]	{1: 4, 2: 44, 33: 3, 20: 4, 22: 1, 24: 1, 28: 1, 29: 3}
Did not match all atoms present	64346-68-5	CCN(CC[N+](CC)(CC)CC)C1=CC=CC=C1.[Cl-]	{1: 4, 2: 6, 33: 1, 14: 5, 17: 1}
Did not match all atoms present	64346-69-6	CC1=C(C(=C(C=C1)C(C2=CC=CC=C2)(C3=C(C(=C(C=C3)C)C)NOS(=O)(=O)[O-])Cl)NOS(=O)(=O)[O-])C	{1: 4, 4: 1, 14: 9, 17: 1, 22: 2, 29: 6, 31: 2}
Did not match all atoms present	64346-70-9	CCN(CC)C1=CC=CC=C1OC	{1: 3, 2: 2, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	64346-71-0	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=CC(=CC=C4)Cl)NC5=CC(=CC=C5)Cl	{17: 2, 31: 2, 14: 14, 25: 2}
Did not match all atoms present	64346-72-1	CCN(CC)C1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2)OC	{1: 3, 2: 2, 33: 1, 14: 8, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	64346-74-3	C1=CC=C2C(=C1)C(=CC=C2N=NC3=C4C=C(C=CC4=C(C=C3)N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]	{30: 1, 34: 4, 29: 9, 14: 14}
Did not match all atoms present	64346-75-4	CCNC1=C(C=C(C=C1)S(=O)(=O)O)C	{1: 2, 2: 1, 14: 3, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	64346-91-4	C(CNS(=O)(=O)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F)N.C(=C(F)F)(F)F	{2: 2, 4: 5, 7: 4, 16: 17, 22: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	64349-34-4	C1=CC=C(C(=C1)CNCCNCCN)O	{2: 5, 30: 1, 21: 1, 14: 4, 31: 2}
Did not match all atoms present	64353-29-3	CCC1=CC=C(C=C1)CCN	{1: 1, 2: 3, 30: 1, 14: 4}
Did not match all atoms present	64353-61-3	C1C=CC2C1C(C2C3=CC=CC=C3)O	{20: 1, 11: 1, 12: 4, 14: 7}
Did not match all atoms present	64359-80-4	CCCCCCCCN1C(=O)C(=CS1)Cl	{1: 1, 2: 7, 33: 1, 41: 1, 14: 1, 17: 1, 25: 1}
Did not match all atoms present	64359-81-5	CCCCCCCCN1C(=O)C(=C(S1)Cl)Cl	{1: 1, 2: 7, 33: 1, 41: 1, 17: 2, 25: 1}
Did not match all atoms present	6436-90-4	CCOC(=O)CNCC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	64363-63-9	CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=CC=CC=C5C4=O)O)(C(=O)CO)O)N)O	{1: 1, 2: 1, 11: 3, 12: 5, 13: 1, 14: 4, 20: 3, 21: 2, 22: 1, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	64363-88-8	C1CC[C@H]2CC3=CC=CC=C3C[C@H]2C1	{11: 6, 12: 2, 14: 4}
Did not match all atoms present	64363-96-8	CC1([C@H]([C@H]1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Br)Br)C	{1: 2, 3: 1, 37: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 18: 2, 22: 1, 28: 1}
Did not match all atoms present	64365-65-7	CC1=CC(=CC(=C1N)C)C(C2=CC(=C(C(=C2)C)N)C)(C3=C(C=CC=C3Cl)Cl)O	{1: 4, 4: 1, 14: 7, 17: 2, 20: 1, 30: 2}
Did not match all atoms present	6437-46-3	CC(=O)COC1=CC=CC=C1OC	{24: 1, 1: 2, 2: 1, 22: 2, 14: 4}
Did not match all atoms present	64375-47-9	CCN1C(=O)/C(=C\C=C\2/N(CCS2)CCCS(=O)(=O)O)/SC1=S.CCN(CC)CC	{1: 4, 2: 7, 6: 2, 33: 3, 41: 2, 11: 2, 15: 3, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	64379-91-5	C1=CC(=CC(=C1)C(F)(F)F)C=CC(=O)Cl	{4: 1, 6: 2, 14: 4, 16: 3, 17: 1, 24: 1}
Did not match all atoms present	64381-83-5	C=CC1=CC=C(C=C1)CCl.C=CC1=CC=C(C=C1)C=C	{17: 1, 2: 1, 14: 8, 5: 3, 6: 3}
Did not match all atoms present	64381-95-9	[Li+].[Li+].[Li+].[Li+].CC1=CC(=C(C(=C1N)N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=NC4=C(C(=CC(=C4N)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])C)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N)N=NC6=CC=C(C=C6)S(=O)(=O)[O-]	{1: 2, 34: 8, 6: 2, 14: 16, 29: 12, 30: 4}
Did not match all atoms present	64381-97-1	CCC(C)NC1=CC=C(C=C1)N(C(C)CC)C(C)CC	{1: 6, 2: 3, 3: 3, 33: 1, 14: 4, 31: 1}
Did not match all atoms present	64382-04-3	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCC(CO)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{1: 2, 2: 16, 4: 1, 6: 4, 14: 7, 20: 3, 27: 4, 28: 2}
Did not match all atoms present	64382-80-5	C1=CC=C(C(=C1)CN=C=S)F	{8: 1, 16: 1, 2: 1, 34: 1, 14: 4}
Did not match all atoms present	6439-39-0	CCOC(=O)CC[Si](OCC)(OCC)OCC	{1: 4, 2: 6, 28: 1, 22: 3}
Did not match all atoms present	64398-84-1	C1=CC=C(C=C1)C(=O)NC2=NC=C(S2)[N+](=O)[O-]	{35: 1, 38: 1, 41: 1, 14: 6, 24: 1, 31: 1}
Did not match all atoms present	64399-27-5	C1CC1(C#N)C2=CC=C(C=C2)Cl	{17: 1, 11: 2, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	64399-28-6	C1CCC(CC1)(C#N)C2=CC=C(C=C2)Cl	{17: 1, 11: 5, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	644-06-4	CC1(C=CC2=CC(=C(C=C2O1)OC)OC)C	{1: 4, 22: 2, 13: 1, 14: 4, 23: 1}
Did not match all atoms present	644-08-6	CC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 14: 9}
Did not match all atoms present	644-13-3	C1=CC=C(C=C1)C(=O)C2=CC3=CC=CC=C3C=C2	{24: 1, 14: 12}
Did not match all atoms present	644-21-3	CCN(C1=CC=CC=C1)N	{1: 1, 2: 1, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	644-26-8	CCC(C)(CN(C)C)OC(=O)C1=CC=CC=C1	{1: 4, 2: 2, 4: 1, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	644-30-4	CC1=CC=C(C=C1)C(C)CCC=C(C)C	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 14: 4}
Did not match all atoms present	644-31-5	CC(=O)OOC(=O)C1=CC=CC=C1	{1: 1, 28: 2, 14: 5}
Did not match all atoms present	644-32-6	C1=CC=C(C=C1)C(=O)SSC(=O)C2=CC=CC=C2	{24: 2, 40: 2, 14: 10}
Did not match all atoms present	644-33-7	C1=CC=C(C=C1)C(=O)NCCNC(=O)C2=CC=CC=C2	{24: 2, 2: 2, 14: 10, 31: 2}
Did not match all atoms present	644-35-9	CCCC1=CC=CC=C1O	{1: 1, 2: 2, 21: 1, 14: 4}
Did not match all atoms present	644-36-0	CC1=CC=CC=C1CC(=O)O	{1: 1, 2: 1, 27: 1, 14: 4}
Did not match all atoms present	644-62-2	CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)O)Cl	{31: 1, 1: 1, 27: 1, 14: 6, 17: 2}
Did not match all atoms present	644-64-4	CC1=CC(=NN1C(=O)N(C)C)OC(=O)N(C)C	{1: 5, 35: 1, 33: 3, 14: 1, 24: 1, 28: 1}
Did not match all atoms present	644-71-3	C1=CC=C(C=C1)NC2=CC=CC=C2O	{21: 1, 14: 9, 31: 1}
Did not match all atoms present	644-97-3	C1=CC=C(C=C1)P(Cl)Cl	{17: 2, 14: 5}
Did not match all atoms present	644-98-4	CC(C)C1=CC=CC=N1	{1: 2, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	64407-07-4	C1=CC(=CC(=C1)CCl)C#N	{17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	64408-99-7	CCCCCCCC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N	{1: 1, 2: 6, 37: 1, 40: 1, 14: 8, 24: 1}
Did not match all atoms present	6441-77-6	C1=CC(=C(C(=C1Cl)C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)Br)[O-])Br)Br)Br)C(=O)[O-])Cl.[K+].[K+]	{14: 4, 17: 2, 18: 4, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	6441-94-7	CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=CC=C(C=C4)[N+](=O)[O-])/C3=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 38: 1, 14: 11, 15: 2, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	6441-96-9	CC(=O)NC1=CC=CC2=C1/C(=N\NC3=CC(=CC(=C3O)S(=O)(=O)[O-])Cl)/C(=O)C=C2.[Na+]	{1: 1, 34: 1, 14: 7, 15: 1, 17: 1, 21: 1, 24: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	64415-11-8	CSC1=NC(=C(C(=N1)Cl)C2=CC=CC=C2)Cl	{40: 1, 1: 1, 35: 2, 14: 5, 17: 2}
Did not match all atoms present	64415-13-0	C1=CC(=C(C=C1S(=O)(=O)NCCC#N)N)Cl	{2: 2, 37: 1, 14: 3, 17: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	64415-14-1	CCCCCCCCCCCCCCC1=C(N=C(S1)N)C2=CC=CC=C2	{1: 1, 2: 13, 35: 1, 41: 1, 14: 5, 30: 1}
Did not match all atoms present	64415-15-2	C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)O)S(=O)(=O)N	{30: 1, 27: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	64415-28-7	CCCCCCC(=O)OC(=O)C1=CC=CC=C1CCCC.CCC(CO)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(CCCC(=O)O)CCCC(=O)O	{1: 3, 2: 19, 4: 1, 14: 8, 20: 3, 27: 2, 28: 4}
Did not match all atoms present	64415-30-1	CCCCC1=CC=CC=C1C(=O)OCC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 6, 4: 1, 14: 8, 20: 2, 28: 3}
Did not match all atoms present	64416-49-5	CC(=C)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 38: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	6442-00-8	CC=CC1=C(C=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3)O)OC	{1: 2, 2: 2, 3: 1, 6: 2, 33: 2, 11: 4, 14: 8, 20: 1, 22: 2}
Did not match all atoms present	6442-08-6	CC1=C(C=CC(=C1)C2(CCCCC2)C3=CC(=C(C=C3)N)C)N	{1: 2, 30: 2, 11: 5, 13: 1, 14: 6}
Did not match all atoms present	6442-10-0	CCN(CC)C1=CC(=C(C=C1)N=O)C	{1: 3, 2: 2, 33: 1, 34: 1, 14: 3, 29: 1}
Did not match all atoms present	64426-36-4	C[Si](C)(N[Si](C)(C)Cl)N[Si](C1=CC=CC=C1)(C2=CC=CC=C2)Cl	{1: 4, 31: 2, 14: 10, 17: 2}
Did not match all atoms present	64426-38-6	C[Si](C)(N[Si](C)(C)Cl)N[Si](C)(C=C)Cl	{1: 5, 31: 2, 5: 1, 6: 1, 17: 2}
Did not match all atoms present	64426-42-2	C(C[Si](O)(O)O)CCl.C(=S)(N)N	{17: 1, 2: 3, 20: 3, 30: 2, 7: 1}
Did not match all atoms present	64426-47-7	C[Si](C)O[Si](C)(CCC(F)(F)F)O[Si](C)(CCC(F)(F)F)O[Si](C)(CCC(F)(F)F)O[Si](C)C	{16: 9, 1: 7, 2: 6, 4: 3, 22: 4}
Did not match all atoms present	6443-69-2	CC1=CC(=C(C(=C1)OC)OC)OC	{1: 4, 22: 3, 14: 2}
Did not match all atoms present	6443-72-7	COC1=C(C=C(C=C1)/C=C/C#N)OC	{1: 2, 22: 2, 14: 3, 6: 2, 37: 1}
Did not match all atoms present	6443-85-2	C1=CC(=CN=C1)CC#N	{2: 1, 35: 1, 37: 1, 14: 4}
Did not match all atoms present	64431-58-9	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@H]7CCC(=O)[C@@H](O7)C)O)NC)O	{1: 6, 2: 1, 11: 5, 12: 12, 13: 1, 14: 4, 20: 2, 21: 2, 22: 3, 23: 3, 25: 3, 28: 1, 31: 1}
Did not match all atoms present	64431-68-1	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@H]7CC[C@H]([C@@H](O7)C)O)O)N(C)C)O	{1: 7, 2: 1, 33: 1, 11: 5, 12: 13, 13: 1, 14: 4, 20: 3, 21: 2, 22: 3, 23: 3, 25: 2, 28: 1}
Did not match all atoms present	64441-14-1	CC1=C(C=C(C=C1)C(=O)N)N=NC(C(=O)C)C(=O)NC2=C(C=C(C=C2)C3=CC(=C(C=C3)NC(=O)C(C(=O)C)N=NC4=C(C=CC(=C4)C(=O)N)C)C)C	{1: 6, 34: 4, 3: 2, 14: 12, 24: 6, 30: 2, 31: 2}
Did not match all atoms present	64443-05-6	CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+]	{16: 6, 1: 4, 37: 4}
Did not match all atoms present	64448-68-6	C=CC(=O)OCC(COC1=CC=C(C=C1)CC2=CC=C(C=C2)OCC(COC(=O)C=C)O)O	{2: 5, 3: 2, 5: 2, 6: 2, 14: 8, 20: 2, 22: 2, 28: 2}
Did not match all atoms present	64461-82-1	C1CN=C(N1)NC2=C(C=CC3=NSN=C32)Cl.Cl	{32: 1, 35: 3, 41: 1, 11: 2, 14: 2, 15: 1, 17: 2, 31: 1}
Did not match all atoms present	64461-98-9	C1=C2C(=C(C(=C1Cl)Cl)Cl)OC3=C(O2)C(=C(C=C3Cl)Cl)Cl	{17: 6, 14: 2, 23: 2}
Did not match all atoms present	64466-47-3	CC(=O)C1=COC2=C(C=CC(=C12)OC)OC	{24: 1, 1: 3, 22: 2, 14: 3, 23: 1}
Did not match all atoms present	64466-48-4	CC(=O)C1=COC2=C1C=CC(=C2OC)OC	{24: 1, 1: 3, 22: 2, 14: 3, 23: 1}
Did not match all atoms present	64466-49-5	CC(=O)C1=CC2=C(C=CC(=C2OC1)OC)OC	{1: 3, 11: 1, 14: 3, 15: 1, 22: 2, 23: 1, 24: 1}
Did not match all atoms present	64466-50-8	CC(=O)C1=CC2=C(C(=C(C=C2)OC)OC)OC1	{1: 3, 11: 1, 14: 3, 15: 1, 22: 2, 23: 1, 24: 1}
Did not match all atoms present	64475-46-3	[Ag].[Ag].[Ag].[Ag].[Ag]	{}
Did not match all atoms present	6448-90-4	COC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=CC=C3)OC	{1: 2, 22: 2, 14: 6, 25: 2}
Did not match all atoms present	64481-11-4	C1=C2C(=CC(=C1Cl)Cl)OC=C(C2=O)C=O	{17: 2, 26: 1, 25: 1, 14: 3, 23: 1}
Did not match all atoms present	64482-94-6	CC1(N(C2=CC=CC3=C2C(=CC=C3)N1C)C)C	{1: 4, 13: 1, 14: 6, 33: 2}
Did not match all atoms present	64484-88-4	CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)C(=O)NC5=C(C(=CC=C5)Cl)Cl)C(=O)OC)/C2=O	{1: 2, 34: 1, 14: 15, 15: 2, 17: 2, 24: 3, 25: 1, 28: 1, 31: 4}
Did not match all atoms present	64485-10-5	CC\1=NN(C(=N)/C1=N/NC2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl)C3=CC=C(C=C3)Cl.C(CO)NCCO	{1: 1, 2: 4, 35: 1, 36: 1, 33: 1, 34: 1, 14: 6, 15: 3, 17: 3, 20: 3, 29: 2, 31: 2}
Did not match all atoms present	64485-82-1	CCOC(=O)/C(=N/O)/C1=CSC(=N1)N	{1: 1, 2: 1, 35: 1, 7: 1, 41: 1, 34: 1, 14: 1, 20: 1, 28: 1, 30: 1}
Did not match all atoms present	64485-93-4	CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)/C(=N\OC)/C3=CSC(=N3)N)SC1)C(=O)[O-].[Na+]	{1: 2, 2: 1, 35: 1, 33: 1, 7: 1, 41: 2, 11: 1, 12: 2, 34: 1, 14: 1, 15: 2, 22: 1, 24: 2, 25: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	64488-52-4	CS(=O)(=O)NC1=CC=C(C=C1)C(=O)CCl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	6449-09-8	C1=C(C2=C(C(=C1S(=O)(=O)O)O)C(=O)C3=C(C2=O)C(=C(C=C3[N+](=O)[O-])S(=O)(=O)O)O)[N+](=O)[O-]	{38: 2, 14: 2, 20: 2, 21: 2, 25: 2, 29: 4}
Did not match all atoms present	6449-79-2	CC1=CC2=CC3=CC(=C(C=C3N=C2C=C1N)N)C.C(=O)O	{1: 2, 35: 1, 14: 5, 26: 1, 27: 1, 30: 2}
Did not match all atoms present	64490-84-2	C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)N(CCOC(=O)C3=CC=CC=C3)CCOC(=O)C4=CC=CC=C4	{33: 1, 2: 4, 14: 19, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	64490-86-4	CCN(CC[N+](CC)(CC)CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC3=CC=C(C=C3)N=NC4=CC=C(C=C4)N(CC)CC[N+](CC)(CC)CC.CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)[O-].CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)[O-]	{1: 10, 2: 12, 38: 2, 33: 2, 34: 4, 14: 22, 22: 1, 29: 6}
Did not match all atoms present	64490-92-2	CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)O.O.O.[Na+]	{1: 2, 2: 1, 33: 1, 14: 6, 24: 1, 27: 1}
Did not match all atoms present	64491-74-3	CCOC1=NC(=NS1)C(Cl)(Cl)Cl.COC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OC	{1: 3, 2: 1, 35: 2, 4: 1, 7: 2, 41: 1, 14: 4, 17: 3, 22: 1, 28: 2, 31: 4}
Did not match all atoms present	645-00-1	C1=CC(=CC(=C1)I)[N+](=O)[O-]	{19: 1, 38: 1, 14: 4}
Did not match all atoms present	645-05-6	CN(C)C1=NC(=NC(=N1)N(C)C)N(C)C	{1: 6, 35: 3, 33: 3}
Did not match all atoms present	645-08-9	COC1=C(C=C(C=C1)C(=O)O)O	{1: 1, 22: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	645-09-0	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N	{24: 1, 38: 1, 30: 1, 14: 4}
Did not match all atoms present	645-12-5	C1=C(OC(=C1)[N+](=O)[O-])C(=O)O	{27: 1, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	645-13-6	CC(C)C1=CC=C(C=C1)C(=O)C	{24: 1, 1: 3, 3: 1, 14: 4}
Did not match all atoms present	645-15-8	C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)OC2=CC=C(C=C2)[N+](=O)[O-]	{38: 2, 20: 1, 22: 2, 14: 8, 29: 1}
Did not match all atoms present	645-35-2	C1=C(NC=N1)C[C@@H](C(=O)O)N.Cl	{32: 1, 2: 1, 3: 1, 14: 2, 17: 1, 35: 1, 27: 1, 30: 1}
Did not match all atoms present	645-43-2	C1CCCN(CCC1)CCN=C(N)N.OS(=O)(=O)O	{33: 1, 2: 2, 7: 1, 11: 7, 34: 1, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	645-45-4	C1=CC=C(C=C1)CCC(=O)Cl	{24: 1, 17: 1, 2: 2, 14: 5}
Did not match all atoms present	645-48-7	C1=CC=C(C=C1)NNC(=S)N	{31: 2, 30: 1, 14: 5, 7: 1}
Did not match all atoms present	645-49-8	C1=CC=C(C=C1)/C=C\C2=CC=CC=C2	{14: 10, 6: 2}
Did not match all atoms present	645-55-6	C1=CC=C(C=C1)N[N+](=O)[O-]	{38: 1, 14: 5, 31: 1}
Did not match all atoms present	645-56-7	CCCC1=CC=C(C=C1)O	{1: 1, 2: 2, 21: 1, 14: 4}
Did not match all atoms present	645-59-0	C1=CC=C(C=C1)CCC#N	{2: 2, 37: 1, 14: 5}
Did not match all atoms present	645-92-1	C1(=NC(=O)N=C(N1)N)N	{32: 1, 25: 1, 35: 2, 30: 2}
Did not match all atoms present	645-93-2	C1(=NC(=O)NC(=O)N1)N	{32: 2, 25: 2, 35: 1, 30: 1}
Did not match all atoms present	645-96-5	C1=CC=C(C=C1)[Se]	{14: 5}
Did not match all atoms present	645-99-8	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Hg+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	64501-17-3	CCC[Te]CCC	{1: 2, 2: 4}
Did not match all atoms present	64502-82-5	CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6CC[C@@H]([C@@H](O6)C)O[C@H]7CC[C@@H]([C@@H](O7)C)O)N(C)C)O	{1: 7, 2: 1, 33: 1, 11: 6, 12: 12, 13: 1, 14: 3, 20: 2, 21: 3, 22: 3, 23: 3, 25: 2, 28: 1}
Did not match all atoms present	64503-45-3	B(CCC)(CCC)SC1=CC=C(C=C1)OC	{40: 1, 1: 3, 2: 4, 22: 1, 14: 4}
Did not match all atoms present	64503-46-4	B(CCC)(CCC)SC1=CC=C(C=C1)C	{40: 1, 1: 3, 2: 4, 14: 4}
Did not match all atoms present	64503-47-5	B(CCC)(CCC)SC1=CC=CC(=C1)C	{40: 1, 1: 3, 2: 4, 14: 4}
Did not match all atoms present	64503-48-6	B(CCC)(CCC)SC1=CC=C(C=C1)Cl	{40: 1, 1: 2, 2: 4, 14: 4, 17: 1}
Did not match all atoms present	64503-49-7	B(CCC)(CCC)SC1=CC=C(C=C1)Br	{40: 1, 1: 2, 2: 4, 18: 1, 14: 4}
Did not match all atoms present	64504-69-4	CCN1CC2=C(C=CS2)C3=C(C1)SC=C3	{1: 1, 2: 1, 33: 1, 41: 2, 11: 2, 14: 4}
Did not match all atoms present	64504-70-7	C1C2=CSC=C2C3=CSC=C3CN1C4=CC=CC=C4	{33: 1, 11: 2, 14: 9, 41: 2}
Did not match all atoms present	64504-71-8	CC1(C2=C(C=CS2)C3=C(C(O1)(C)C)SC=C3)C	{1: 4, 41: 2, 13: 2, 14: 4, 23: 1}
Did not match all atoms present	64504-72-9	CC1(C2=CSC=C2C3=CSC=C3C(O1)(C)C)C	{1: 4, 41: 2, 13: 2, 14: 4, 23: 1}
Did not match all atoms present	64506-49-6	CC(=CCOC1=CC=C(C=C1)/C=C/C(=O)C2=C(C=C(C=C2)OCC=C(C)C)OCC(=O)O)C	{1: 4, 2: 3, 6: 4, 7: 2, 14: 7, 22: 3, 24: 1, 27: 1}
Did not match all atoms present	64508-90-3	C1=CC(=CC=C1CCCCC(=O)O)N(CCCl)CCCl	{17: 2, 2: 8, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	64509-06-4	CCCCCCCCCCCC/C=C/OP(=O)(O/C=C/CCCCCCCCCCCC)O	{1: 2, 2: 22, 6: 4, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	64509-07-5	CCCCCCCCCCCCCC/C=C/C=C/OP(=O)(O)O	{1: 1, 2: 13, 6: 4, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	64509-08-6	C=CCCCCCCCCCCCC/C=C/OS(=O)(=O)[O-].[Na+]	{2: 12, 22: 1, 5: 1, 6: 3, 29: 3}
Did not match all atoms present	6451-09-8	C1=CC=C2C(=C1)C3=C4C=C(C=CC4=NC5=CC=CC(=C53)C2=O)C6=CC7=C(C=C6)NC8=C(C7=O)C=CC9=C8C(=O)C1=CC=CC=C1C9=O	{32: 1, 25: 4, 35: 1, 14: 19}
Did not match all atoms present	64516-17-2	CCCO.CCCO.CCCO.CO.[Ti]	{1: 4, 2: 6, 20: 4}
Did not match all atoms present	6452-49-9	C1=CC=C(C=C1)OC2=CC(=CC=C2)Cl	{17: 1, 22: 1, 14: 9}
Did not match all atoms present	6452-54-6	C=CCOC1=CC=CC=C1OCC(CO)O	{2: 3, 3: 1, 5: 1, 6: 1, 14: 4, 20: 2, 22: 2}
Did not match all atoms present	6452-62-6	C1=CC=C(C=C1)OC2=CC=C(C=C2)[Sn](C3=CC=C(C=C3)OC4=CC=CC=C4)(C5=CC=C(C=C5)OC6=CC=CC=C6)C7=CC=C(C=C7)OC8=CC=CC=C8	{22: 4, 14: 36}
Did not match all atoms present	6452-71-7	CC(C)NCC(COC1=CC=CC=C1OCC=C)O	{1: 2, 2: 3, 3: 2, 5: 1, 6: 1, 14: 4, 20: 1, 22: 2, 31: 1}
Did not match all atoms present	6452-73-9	CC(C)NCC(COC1=CC=CC=C1OCC=C)O.Cl	{1: 2, 2: 3, 3: 2, 5: 1, 6: 1, 14: 4, 17: 1, 20: 1, 22: 2, 31: 1}
Did not match all atoms present	64521-13-7	CC1=C2C=CC3=C(C2=CC4=CC=CC=C14)[C@H]([C@@H](C=C3)O)O	{1: 1, 12: 2, 14: 9, 20: 2}
Did not match all atoms present	64521-14-8	CC1=C2C=CC3=C(C2=CC4=CC=CC=C14)C=C[C@H]([C@@H]3O)O	{1: 1, 12: 2, 14: 9, 20: 2}
Did not match all atoms present	64521-15-9	CC1=C2C=CC3=CC=CC=C3C2=CC4=C1[C@H]([C@@H](C=C4)O)O	{1: 1, 12: 2, 14: 9, 20: 2}
Did not match all atoms present	64521-16-0	C1CC2=C(C3C1O3)C4=CC5=CC=CC=C5C=C4C=C2	{11: 2, 12: 2, 14: 8, 23: 1}
Did not match all atoms present	64529-56-2	CCSC1=NN=C(C(=O)N1N)C(C)(C)C	{1: 4, 2: 1, 35: 2, 4: 1, 33: 1, 40: 1, 25: 1, 30: 1}
Did not match all atoms present	6453-67-4	CCC1=C2C=C3C(=C4C(=O)CC(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)OC)C4=N3)C	{32: 2, 1: 6, 2: 3, 35: 2, 5: 1, 6: 1, 11: 1, 12: 2, 14: 3, 25: 1, 28: 1}
Did not match all atoms present	6453-99-2	C1=CC=C(C=C1)C(=O)C2=CSC=C2	{24: 1, 41: 1, 14: 8}
Did not match all atoms present	64532-94-1	CC(C)C1=CC=CC=C1OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 2, 3: 1, 22: 3, 14: 14, 29: 1}
Did not match all atoms present	64532-96-3	CCCCCCC1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 1, 2: 5, 22: 3, 14: 14, 29: 1}
Did not match all atoms present	64536-78-3	C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1CC=CCCC=C1.C1=CC=NC=C1.F[P-](F)(F)(F)(F)F.[Ir]	{16: 6, 35: 1, 11: 19, 12: 3, 14: 9}
Did not match all atoms present	64539-55-5	C#[C-].C#[C-].[U+2]	{9: 2}
Did not match all atoms present	64541-68-0	B(CCC)(CCC)SC1=CC(=CC=C1)Cl	{40: 1, 1: 2, 2: 4, 14: 4, 17: 1}
Did not match all atoms present	64544-07-6	CC(OC(=O)C)OC(=O)C1=C(CS[C@H]2N1C(=O)[C@H]2NC(=O)/C(=N\OC)/C3=CC=CO3)COC(=O)N	{1: 3, 2: 1, 3: 1, 33: 1, 7: 1, 41: 1, 11: 1, 12: 2, 34: 1, 14: 3, 15: 2, 22: 1, 23: 1, 24: 1, 25: 1, 28: 3, 30: 1, 31: 1}
Did not match all atoms present	64549-05-9	CCCC[Sn](CCCC)(CC=C)Cl	{1: 2, 2: 7, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	64550-80-7	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@H]([C@@H]([C@@H]5[C@H]4O5)O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	64551-89-9	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C5C(O5)C(C4O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	64552-28-9	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=CC(=C(C=C3)Cl)S(=O)(=O)[O-])C(=O)[O-].[Mn+2]	{34: 1, 14: 8, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	64573-34-8	COC1=CC=C(C=C1)C(=C(C#N)C#N)C=C(SC)SC	{1: 3, 37: 2, 6: 1, 7: 3, 40: 2, 14: 4, 22: 1}
Did not match all atoms present	6459-94-5	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N/N=C/5\C(=O)C=CC6=CC(=CC(=C65)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C.[Na+].[Na+]	{1: 3, 34: 3, 14: 18, 15: 1, 22: 1, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	64598-80-7	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3[C@H]5C(O5)[C@@H]([C@H]4O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	64598-81-8	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3[C@H]5C(O5)[C@@H]([C@@H]4O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	64598-82-9	C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@H]5[C@H](O5)[C@H]([C@@H]4O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	646-00-4	CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Mn+2]	{24: 2, 1: 2, 2: 24, 6: 8}
Did not match all atoms present	646-34-4	C(=N)(N)N.OS(=O)(=O)O	{36: 1, 20: 2, 29: 2, 30: 2, 7: 1}
Did not match all atoms present	6460-01-1	CC1=CC=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N/NC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 14: 18, 15: 4, 24: 1, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	6460-05-5	CN(C)C1=CC=C(C=C1)/C(=C\2/C=CC(=[N+](C)C)C(=C2)S(=O)(=O)O)/C3=CC=C(C=C3)N(C)CC4=CC(=CC=C4)S(=O)(=O)O	{1: 5, 2: 1, 33: 3, 7: 1, 14: 15, 15: 3, 20: 2, 29: 4}
Did not match all atoms present	64601-03-2	C1=CC=C(C=C1)O.C(CO)NCCO	{2: 4, 20: 2, 21: 1, 14: 5, 31: 1}
Did not match all atoms present	64601-04-3	C1=CC=C(C=C1)O.C(CO)N	{2: 2, 30: 1, 20: 1, 21: 1, 14: 5}
Did not match all atoms present	64601-12-3	[Li+].COC(=O)CCCC(=O)[O-]	{24: 1, 1: 1, 2: 3, 28: 1}
Did not match all atoms present	64603-91-4	C1CNCC2=C1C(=O)NO2	{32: 2, 25: 1, 11: 3, 23: 1}
Did not match all atoms present	64604-91-7	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)NCCN	{1: 6, 2: 4, 4: 2, 14: 2, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6461-99-0	C1=CC(=CC=C1C#N)S(=O)(=O)C2=CC=C(C=C2)C#N	{29: 2, 14: 8, 37: 2}
Did not match all atoms present	64611-87-6	CC(=O)NC1=CC(=C(C=C1)OC)N(CCC#N)CC=C	{1: 2, 2: 3, 5: 1, 6: 1, 33: 1, 14: 3, 22: 1, 24: 1, 37: 1, 31: 1}
Did not match all atoms present	64611-94-5	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C3=C2C=NS3)[N+](=O)[O-])Br)NC(=O)COC4=CC=CC=C4	{1: 2, 2: 3, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 10, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	64624-44-8	C(CC(=O)N=[N+]=[N-])CC(=O)N=[N+]=[N-]	{24: 2, 2: 3, 34: 4}
Did not match all atoms present	64640-24-0	C1=CC=C2C(=C1)C(=C/C(=N/NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)Cl)NC5=C(C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)/C2=O)S(=O)(=O)O	{34: 1, 35: 3, 14: 11, 15: 2, 17: 1, 20: 4, 25: 1, 29: 8, 31: 3}
Did not match all atoms present	64640-25-1	C1=CC=C(C=C1)C2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(/C(=N/NC5=CC=CC=C5)/C4=O)S(=O)(=O)O	{34: 1, 35: 3, 14: 13, 15: 2, 17: 1, 20: 2, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	64641-84-5	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3	{1: 2, 4: 1, 14: 14, 28: 1}
Did not match all atoms present	6465-03-8	COC(=O)NC1=CC=C(C=C1)N	{1: 1, 28: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	6465-92-5	COP(=O)([O-])OC=C(Cl)Cl.COP(=O)([O-])OC=C(Cl)Cl.COP(=O)(OC)OC=C(Cl)Cl.[Ca+2]	{1: 4, 6: 3, 7: 3, 17: 6, 22: 7, 29: 5}
Did not match all atoms present	64653-03-8	CCCCN(CCCC)C(=S)[S-].CCCCN(CCCC)C(=S)[S-].[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Sn+4]	{1: 4, 2: 12, 5: 2, 33: 2, 7: 2, 14: 10}
Did not match all atoms present	64653-05-0	CCCCN(CCCC)C(=S)S[Sn](C)(C)SC(=S)N(CCCC)CCCC	{40: 2, 1: 6, 2: 12, 33: 2, 7: 2}
Did not match all atoms present	64653-30-1	C1=CC=C(C=C1)C2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)N/N=C\4/C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)O)C(=O)O)S(=O)(=O)O	{33: 1, 34: 1, 35: 4, 14: 12, 15: 2, 17: 1, 20: 2, 25: 1, 27: 1, 29: 4, 31: 2}
Did not match all atoms present	64653-59-4	CCC1=CC=CC=C1NC2=CC=CC=C2CC	{1: 2, 2: 2, 14: 8, 31: 1}
Did not match all atoms present	64653-78-7	CC1=CC=C(C=C1)S(=O)(=O)[O-].C=O.C1=CC=C(C=C1)O.[Na+]	{1: 1, 29: 3, 5: 1, 14: 9, 21: 1}
Did not match all atoms present	64653-92-5	CCCCCCCCCCCCCC(=O)OCC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 15, 4: 1, 14: 4, 20: 2, 28: 3}
Did not match all atoms present	64653-95-8	CCCCCCCCCCCCCC(=O)OCC(CC)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 16, 4: 1, 14: 4, 20: 2, 28: 3}
Did not match all atoms present	64653-97-0	CCCCCCCCC=CCCCCCCCC(=O)O.C1=CC2=NNN=C2C=C1	{32: 1, 1: 1, 2: 14, 35: 2, 6: 2, 14: 4, 27: 1}
Did not match all atoms present	64654-05-3	CCCCCCCCCCCCC1=CC=CC=C1NC2=CC=CC3=CC=CC=C32	{1: 1, 2: 11, 14: 11, 31: 1}
Did not match all atoms present	64654-06-4	CCCCCCCCCCCCCCC1=C(C=CC(=C1CCCCCCCCCCCCCC)O)O	{1: 2, 2: 26, 21: 2, 14: 2}
Did not match all atoms present	6467-83-0	CCOC1=CC2=C(C=C1)N=C(S2)N/N=C\3/C=C(C4=CC=CC=C4C3=O)OC	{1: 2, 2: 1, 35: 1, 41: 1, 34: 1, 14: 8, 15: 2, 22: 2, 25: 1, 31: 1}
Did not match all atoms present	64675-27-0	C1C2=CC=CC=C2OC3=C1C(=C(C(=C3CC4=CC=CC=C4O)O)C(=O)CCC5=CC=CC=C5)O	{2: 3, 11: 1, 14: 13, 21: 3, 23: 1, 24: 1}
Did not match all atoms present	64683-38-1	C1=CC=C(C(=C1)C(=O)O)N/N=C\2/C(=CC(=CC2=O)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])[O-].[Na+].[Na+]	{34: 3, 14: 10, 15: 3, 25: 1, 27: 1, 29: 3, 31: 1}
Did not match all atoms present	64683-39-2	C1=CC2=C(C=C1N/N=C/3\C(=O)C4=C(C=C3S(=O)(=O)O)C=C(C=C4)NC(=O)NC5=CC6=C(C(=O)/C(=N\NC7=CC8=C(C=C(C=C8)S(=O)(=O)O)C=C7)/C(=C6)S(=O)(=O)O)C=C5)C=CC(=C2)S(=O)(=O)O.C(N(CCOCCO)CCOCCO)COCCO.C(N(CCOCCO)CCOCCO)COCCO.C(N(CCOCCO)CCOCCO)COCCO	{33: 3, 2: 36, 34: 2, 14: 20, 15: 4, 20: 13, 22: 9, 24: 1, 25: 2, 29: 8, 31: 4}
Did not match all atoms present	64683-43-8	CC1(C2=CC=CC=C2[N+](=C1C=CN3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C)C.[Cl-]	{1: 3, 35: 1, 6: 2, 33: 2, 13: 1, 14: 15, 15: 1, 17: 1}
Did not match all atoms present	64686-82-4	C1=CC=C(C=C1)CN2C(=C(SC2=S)C(=O)N)N	{33: 1, 2: 1, 41: 1, 14: 5, 24: 1, 30: 2}
Did not match all atoms present	6469-85-8	C1=CC=C(C(=C1)C(=O)O)SC2=CC=C(C=C2)Cl	{40: 1, 17: 1, 27: 1, 14: 8}
Did not match all atoms present	64693-33-0	C1CN1P(=O)(C23CC4CC(C2)CC(C4)C3)N5CC5	{33: 2, 11: 10, 12: 3, 13: 1, 29: 1}
Did not match all atoms present	64694-79-7	CC(=O)N1C2=C(C3=CC=CC=C3C=C2)C4=C1C=CC5=CC=CC=C54	{24: 1, 1: 1, 14: 12, 33: 1}
Did not match all atoms present	64695-78-9	C1=C(C(=CC(=C1Br)Br)F)F	{16: 2, 18: 2, 14: 2}
Did not match all atoms present	6470-09-3	C(=NC(=O)N=C=S)=S	{8: 2, 24: 1, 34: 2}
Did not match all atoms present	6470-17-3	COC1=C(C=C(C=C1)N)S(=O)(=O)O	{1: 1, 14: 3, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	6470-18-4	CC(=O)NC1=CC=CC2=C1C=C(C=C2)O	{24: 1, 1: 1, 21: 1, 14: 6, 31: 1}
Did not match all atoms present	6470-23-1	COC1=CC=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC=C(C=C4)N)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 1, 14: 12, 15: 2, 22: 1, 24: 1, 25: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	6470-52-6	C1=CC(=CC=C1NC2=CC(=C(C=C2)N)S(=O)(=O)O)[N+](=O)[O-]	{38: 1, 14: 7, 20: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	6470-98-0	C1=CC(=CC=C1N)N/N=C/2\C=CC(=O)C(=C2)C(=O)[O-].[Na+]	{34: 1, 14: 7, 15: 2, 24: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	64704-23-0	C(C(C(=O)[O-])N)SSCC(C(=O)[O-])N.[Na+].[Na+]	{24: 2, 40: 2, 2: 2, 3: 2, 30: 2}
Did not match all atoms present	64705-15-3	CC#C[Hg]C#CC	{1: 2, 10: 4}
Did not match all atoms present	64709-48-4	CCN(CC)CCOC(=O)C1=CC=CC2=C1NC3=C2C4=CC=CC=C4CC3.Cl	{32: 1, 1: 2, 2: 4, 33: 1, 11: 2, 14: 7, 17: 1, 28: 1}
Did not match all atoms present	64709-49-5	CCN(CC)CCOC(=O)C1=CC2=C(C=C1)C3=C(N2)CCC4=CC=CC=C43.Cl	{32: 1, 1: 2, 2: 4, 33: 1, 11: 2, 14: 7, 17: 1, 28: 1}
Did not match all atoms present	64709-50-8	CCN(CC)CCOC(=O)C1=CC2=C(C=C1)NC3=C2C4=CC=CC=C4CC3.Cl	{32: 1, 1: 2, 2: 4, 33: 1, 11: 2, 14: 7, 17: 1, 28: 1}
Did not match all atoms present	6471-07-4	C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/3\C=CC(=O)C(=C3)C(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	6471-17-6	C1=CC(=CC=C1N/N=C/2\C=CC(=O)C(=C2)C(=O)[O-])SC3=CC=C(C=C3)N/N=C\4/C=CC(=O)C(=C4)C(=O)[O-].[Na+].[Na+]	{34: 2, 40: 1, 14: 14, 15: 4, 24: 2, 25: 2, 31: 2}
Did not match all atoms present	6471-46-1	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=CC(=CC=C3)[N+](=O)[O-]	{34: 1, 38: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	6471-49-4	COC1=C(C=C(C=C1)[N+](=O)[O-])N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]	{1: 1, 34: 1, 38: 2, 14: 12, 15: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	64710-74-3	C1=CC=C(C=C1)CC(C#N)(C#N)N=NC2=CC=C(C=C2)Br	{2: 1, 4: 1, 37: 2, 34: 2, 14: 9, 18: 1}
Did not match all atoms present	64716-02-5	CCCCCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[K+]	{1: 1, 2: 14, 29: 3, 14: 4}
Did not match all atoms present	64719-39-7	C[C@@H]1[C@@H]([C@@H](C[C@H](O1)O[C@H]2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N)O.[Fe+3]	{1: 2, 2: 1, 11: 3, 12: 5, 13: 1, 14: 3, 20: 3, 21: 2, 22: 2, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	6472-50-0	CC1=C(C=C(C(=C1)C2=CC(=C(C=C2S(=O)(=O)[O-])NN=C3C(=O)C=CC4=CC=CC=C43)C)S(=O)(=O)[O-])NN=C5C(=O)C=CC6=CC=CC=C65.[Na+].[Na+]	{1: 2, 34: 2, 14: 16, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	6472-58-8	COC1=C(C=CC(=C1)S(=O)(=O)O)N	{1: 1, 14: 3, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	64722-50-5	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCS(=O)(=O)O)C=C4N(C5=C(O4)C=CC(=C5)C)CCCS(=O)(=O)[O-]	{1: 2, 2: 7, 33: 2, 6: 2, 7: 1, 14: 11, 15: 1, 20: 1, 23: 2, 29: 5}
Did not match all atoms present	64725-57-1	COC1C2CCC1C3=CC=CC=C23	{1: 1, 11: 2, 12: 3, 22: 1, 14: 4}
Did not match all atoms present	6473-02-5	C1=CC(=C(C=C1N=NC2=CC(=C(C(=C2O)N=NC3=CC(=C(C=C3)[N+](=O)[O-])N)O)N=NC4=C5C(=CC(=C4)S(=O)(=O)[O-])C=C(C=C5O)S(=O)(=O)[O-])N)[N+](=O)[O-].[Na+].[Na+]	{34: 6, 38: 2, 14: 11, 21: 3, 29: 6, 30: 2}
Did not match all atoms present	64743-14-2	C1=CC=C(C=C1)C2=C(C(=O)N(N2)C3=CC=CC=C3)N/N=C\4/C=C(C=C(C4=O)S(=O)(=O)O)[N+](=O)[O-]	{32: 1, 33: 1, 34: 1, 38: 1, 14: 12, 15: 3, 20: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	64743-15-3	CC1=CC(=C(C(=C1N)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-])C)C)N)N=NC5=CC=C(C=C5)S(=O)(=O)[O-].[Na+].[Na+]	{1: 3, 34: 5, 14: 14, 15: 2, 24: 1, 25: 1, 29: 3, 30: 2, 31: 1}
Did not match all atoms present	64744-01-0	CCCCC(CC)CC=C(C)C1=C(C2=C(C=CC=N2)C=C1)O	{1: 3, 2: 5, 3: 1, 6: 1, 7: 1, 14: 5, 35: 1, 21: 1}
Did not match all atoms present	64755-12-0	C=CC=C.C=CC1=CC=CC=C1.C=CC(=O)OCCC(=O)O.C=CC(=O)OCCO	{2: 4, 5: 5, 6: 5, 14: 5, 20: 1, 27: 1, 28: 2}
Did not match all atoms present	64755-14-2	C[C@H]1C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@@H](C(=O)N([C@@H]2C(C3=CC=C(C=C3)OC4=C(C=CC(=C4)C[C@H](C(=O)N1)N(C2=O)C)O)O)C)C)CC5=CC=C(C=C5)OC)C)C	{32: 3, 1: 7, 2: 1, 33: 3, 11: 1, 12: 7, 14: 11, 20: 1, 21: 1, 22: 1, 23: 1, 25: 6}
Did not match all atoms present	64759-30-4	[Mg].[Ca]	{}
Did not match all atoms present	6476-36-4	CC(C)P(C(C)C)C(C)C	{1: 6, 3: 3}
Did not match all atoms present	6476-37-5	C1CCC(CC1)P(C2CCCCC2)C3=CC=CC=C3	{11: 10, 12: 2, 14: 5}
Did not match all atoms present	64762-45-4	CC1=CC=NN(C=C1)C(=O)C2=CC=CC=C2	{1: 1, 35: 1, 33: 1, 14: 9, 15: 1, 24: 1}
Did not match all atoms present	64771-59-1	C(#C[Hg]C#CCl)Cl	{17: 2, 10: 4}
Did not match all atoms present	64776-55-2	C1C23C=CC=CC2(CS1=O)C=CC=C3	{11: 2, 13: 2, 14: 8, 29: 1}
Did not match all atoms present	64781-03-9	CCCCCCCCCCCCCCCCCCOC(=O)OOC(=O)C	{1: 2, 2: 17, 28: 1}
Did not match all atoms present	64789-67-9	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@@H]4CCCN4C(=O)[C@@H](CC5=CC=CC=C5)NC(=O)[C@@H]6CCC(=O)N6	{32: 1, 1: 2, 2: 9, 3: 7, 33: 2, 7: 1, 11: 8, 12: 3, 34: 1, 14: 14, 20: 1, 21: 1, 24: 10, 25: 1, 30: 3, 31: 7}
Did not match all atoms present	6479-02-3	CC1=CN=C2C(=N1)N=C(C(=N2)C)C	{1: 3, 35: 4, 14: 1}
Did not match all atoms present	6479-03-4	CC1=C(N=C2C(=N1)N=C(C(=N2)C)C)C	{1: 4, 35: 4}
Did not match all atoms present	64791-32-8	C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)N/N=C/4\C(=CC5=C(C4=O)C=C(C=C5)N)S(=O)(=O)[O-])N/N=C\6/C=CC(=O)C(=C6)C(=O)[O-].[Na+].[Na+]	{32: 1, 34: 2, 35: 1, 14: 14, 15: 4, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	6480-68-8	C1=CC=C2C(=C1)C=C(C=N2)C(=O)O	{35: 1, 27: 1, 14: 6}
Did not match all atoms present	64800-83-5	CCC1=CC=C(C=C1)CCC2=CC=CC=C2	{1: 1, 2: 3, 14: 9}
Did not match all atoms present	64808-27-1	CC1=NN(N(C1=S)C)C	{1: 3, 35: 1, 33: 2}
Did not match all atoms present	64808-28-2	CN1C(=S)C=NN1C	{1: 2, 35: 1, 14: 1, 33: 2}
Did not match all atoms present	64817-78-3	CCCCCCCCCCCCCC(=O)C1=C2C(=CC3=C1C(=C(C=C3)O)O)C=CC=C2O	{24: 1, 1: 1, 2: 12, 21: 3, 14: 6}
Did not match all atoms present	6482-34-4	CC(C)OC(=O)OC(C)C	{1: 4, 3: 2}
Did not match all atoms present	6483-64-3	COC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)N/N=C\3/C4=CC=CC=C4C=CC3=O)OC)C5=CC=CC=C5)N/N=C\6/C7=CC=CC=C7C=CC6=O	{1: 2, 34: 2, 3: 1, 14: 23, 15: 2, 22: 2, 25: 2, 31: 2}
Did not match all atoms present	6483-65-4	C1=CC=C2C(=C1)C(=CC=C2N=NC3=C4C=CC(=CC4=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C\5/C6=C(C=C(C=C6)S(=O)(=O)[O-])C=C(C5=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 3, 14: 15, 15: 2, 25: 1, 29: 12, 31: 1}
Did not match all atoms present	6483-86-9	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)O	{25: 2, 38: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	64835-62-7	CCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCC)C	{1: 3, 2: 6, 28: 2, 14: 11}
Did not match all atoms present	64835-63-8	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C	{1: 2, 2: 4, 14: 8}
Did not match all atoms present	64838-75-1	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3[C@H]([C@@H]([C@H]5[C@@H]4O5)O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	6484-25-9	C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)Cl	{17: 1, 35: 2, 14: 9}
Did not match all atoms present	6484-52-2	[NH4+].[N+](=O)([O-])[O-]	{}
Did not match all atoms present	6485-34-3	C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].[Ca+2]	{35: 2, 29: 4, 14: 8, 15: 2}
Did not match all atoms present	6485-39-8	C(C(C(C(C(C(=O)[O-])O)O)O)O)O.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Mn+2]	{24: 2, 2: 2, 3: 8, 20: 10}
Did not match all atoms present	6485-67-2	C1=CC=C(C=C1)[C@H](C(=O)N)N	{24: 1, 3: 1, 30: 2, 14: 5}
Did not match all atoms present	6485-79-6	CC(C)[Si](C(C)C)C(C)C	{1: 6, 3: 3}
Did not match all atoms present	6485-81-0	CC(C)C[Si](CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 3}
Did not match all atoms present	64854-98-4	CCC(C)C(=O)OCC1(C2C1(CC(C3(C2C=C(CC4(C3C=C(C4=O)C)O)CO)O)C)OC(=O)CC5=CC=CC=C5)C	{1: 5, 2: 4, 3: 1, 11: 2, 12: 4, 13: 4, 14: 7, 15: 2, 20: 3, 25: 1, 28: 2}
Did not match all atoms present	64854-99-5	CCC(C)C(=O)OCC1(C2C1(CC(C3(C2C=C(CC4(C3C=C(C4=O)C)O)COC(=O)C)O)C)OC(=O)CC5=CC=CC=C5)C	{1: 6, 2: 4, 3: 1, 11: 2, 12: 4, 13: 4, 14: 7, 15: 2, 20: 2, 25: 1, 28: 3}
Did not match all atoms present	6486-92-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C(=C3O)OC4=CC=C(C=C4)S(=O)(=O)O)S(=O)(=O)O)O	{14: 8, 20: 2, 21: 2, 22: 1, 25: 2, 29: 4}
Did not match all atoms present	64862-95-9	CC1=CC=C(C=C1)NC2=C3C(=C(C(=C2)C(=O)OC)N)C(=O)C4=CC=CC=C4C3=O	{1: 2, 14: 9, 25: 2, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	64862-96-0	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCNCCO)NCCNCCO	{25: 2, 2: 8, 20: 2, 14: 6, 31: 4}
Did not match all atoms present	64864-07-9	COP(=O)(O)O.C(CO)N.C(CO)N	{1: 1, 2: 4, 20: 4, 22: 1, 29: 1, 30: 2}
Did not match all atoms present	64869-35-8	C1=CC2=C3C(=C1)S[Se]C3=CC=C2	{41: 1, 14: 6}
Did not match all atoms present	64869-36-9	C1=CC2=C3C(=C1)S[Te]C3=CC=C2	{41: 1, 14: 6}
Did not match all atoms present	64869-37-0	C1=CC2=C3C(=C1)[Se][Te]C3=CC=C2	{14: 6}
Did not match all atoms present	6487-07-6	C1=CC=C(C=C1)C(=O)NC2=C3C(=C4C(=C2)C5=C(N4)C6=C(C=C5)C(=O)C7=C(C6=O)C=CC8=C7NC9=C1C(=C(C=C89)NC(=O)C2=CC=CC=C2)C(=O)C2=CC=CC=C2C1=O)C(=O)C1=CC=CC=C1C3=O	{24: 2, 25: 6, 32: 2, 14: 24, 31: 2}
Did not match all atoms present	6487-28-1	CCOC1=C2C=CC=CC2=CC3=CC=CC=C31	{1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	6487-39-4	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.O.O.O.O.O.[La+3].[La+3]	{24: 3}
Did not match all atoms present	6487-48-5	C(=O)(C(=O)[O-])[O-].O.[K+].[K+]	{24: 2}
Did not match all atoms present	64885-17-2	CCCCC(CC)COC(=O)C=C.CC(C)(C)C1=CC=CC=C1C=C.C=CC1=CC=CC=C1	{1: 5, 2: 5, 3: 1, 4: 1, 5: 3, 6: 3, 14: 9, 28: 1}
Did not match all atoms present	64887-75-8	C1=CC=C2C(=C1)C(=O)C(C2=O)[N+](=O)[O-]	{25: 2, 12: 1, 38: 1, 14: 4}
Did not match all atoms present	64896-28-2	C[C@@H]([C@H](C)P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4	{1: 2, 3: 2, 14: 20}
Did not match all atoms present	64902-72-3	CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2Cl	{1: 2, 35: 3, 14: 4, 17: 1, 22: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	64909-33-7	[B-](F)(F)(F)F.CN(C)C1=C(C=C(C=C1)[N+]#N)Cl	{1: 2, 34: 1, 33: 1, 14: 3, 16: 4, 17: 1}
Did not match all atoms present	64910-63-0	CCCCS(=O)(=O)NC1CCCCC1	{1: 1, 2: 3, 11: 5, 12: 1, 29: 2, 31: 1}
Did not match all atoms present	64916-48-9	C(=C(\[O-])/C(F)(F)F)\C(=O)C(F)(F)F.C(=C(\[O-])/C(F)(F)F)\C(=O)C(F)(F)F.[Pd+2]	{16: 12, 24: 2, 4: 4, 6: 2, 7: 2}
Did not match all atoms present	6492-48-4	CC1=C(C=C(C=C1)NC(=S)N)N	{1: 1, 31: 1, 30: 2, 14: 3, 7: 1}
Did not match all atoms present	6492-53-1	C1=CC(=CC=C1N/N=C/2\C=C(C(=O)C(=C2)S(=O)(=O)[O-])C(=O)[O-])N/N=C\3/C=C(C(=O)C(=C3)S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 8, 15: 6, 24: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	6492-73-5	C1=CC=C2C(=C1)C(=O)/C(=C/3\C(=O)C4=C(N3)C=CC(=C4)Br)/N2	{32: 2, 25: 2, 18: 1, 14: 7, 15: 2}
Did not match all atoms present	6492-81-5	CC1=CC(=C(C=C1Cl)OC)NC(=O)CC(=O)C2=CC=C(C=C2)C(=O)CC(=O)NC3=C(C=C(C(=C3)C)Cl)OC	{1: 4, 2: 2, 14: 8, 17: 2, 22: 2, 24: 4, 31: 2}
Did not match all atoms present	64920-28-1	CC(=C)C(=O)OCCN(C)C.OS(=O)(=O)O	{1: 3, 2: 2, 5: 1, 7: 1, 20: 2, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	64920-29-2	CCOC(=O)C(=O)CCC1=CC=CC=C1	{24: 1, 1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	64920-31-6	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=C[C@H]([C@@H]4O)O	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	64920-33-8	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3[C@H]5[C@H](O5)[C@H]([C@@H]4O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	64924-62-5	CCCCCCCC1=CC=C(C=C1)NC2=CC=CC=C2	{1: 1, 2: 6, 14: 9, 31: 1}
Did not match all atoms present	64924-63-6	CC1=CC(=C(C=C1C2(CCCCC2)C)C)O	{1: 3, 11: 5, 13: 1, 14: 2, 21: 1}
Did not match all atoms present	64924-64-7	CC1=C(C=CC(=C1C)O)C2(CCCCC2)C	{1: 3, 11: 5, 13: 1, 14: 2, 21: 1}
Did not match all atoms present	64924-66-9	CCC1(CCCC1)C2=CC(=CC(=C2O)C)C	{1: 3, 2: 1, 11: 4, 13: 1, 14: 2, 21: 1}
Did not match all atoms present	64925-80-0	CC/C(=C(\C(=O)N/C(=C/C(=O)O)/C(=O)O)/NC(=O)[C@@H]1C=CCN1C(=O)[C@@H]2[C@@](OC3=C(C(=CC(=C3)[C@@H]([C@@H](C(=O)N[C@H](C(=O)N2)C(=C)C)NC)O)Cl)O)(C)CC)/C	{32: 2, 1: 6, 2: 2, 5: 1, 6: 1, 7: 4, 11: 1, 12: 5, 13: 1, 14: 4, 17: 1, 20: 1, 21: 1, 23: 1, 24: 3, 25: 2, 33: 1, 27: 2, 31: 3}
Did not match all atoms present	6493-05-6	CC(=O)CCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C	{1: 3, 2: 4, 35: 1, 33: 3, 14: 1, 24: 1, 25: 2}
Did not match all atoms present	6493-69-2	C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O.[Sn+2]	{24: 2, 20: 1, 2: 2, 27: 1, 4: 1}
Did not match all atoms present	6493-73-8	C1=CC=C(C=C1)CSSSCC2=CC=CC=C2	{40: 3, 2: 2, 14: 10}
Did not match all atoms present	6493-83-0	CC(C(=O)C1=CC=CC=C1)OC	{24: 1, 1: 2, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	64938-66-5	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3[C@@H]5[C@@H](O5)[C@H]([C@@H]4O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	64953-12-4	CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)(NC(=O)C(C4=CC=C(C=C4)O)C(=O)[O-])OC)OC2)C(=O)[O-].[Na+].[Na+]	{1: 2, 2: 1, 3: 1, 33: 2, 40: 1, 11: 1, 12: 1, 13: 1, 14: 4, 15: 2, 35: 3, 21: 1, 22: 1, 23: 1, 24: 3, 25: 1, 31: 1}
Did not match all atoms present	64957-86-4	CC1(COC(=N1)C2=C(C=CC=C2OC)OC)C	{1: 4, 35: 1, 11: 1, 13: 1, 14: 3, 15: 1, 22: 2, 23: 1}
Did not match all atoms present	64957-95-5	CCCCCCCCC=CCCCCCCCC(=O)NC1=C(C=C(C=C1)OC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 14, 6: 2, 14: 3, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	64965-91-9	CC1=CC(=C2C(=C1)C=CO2)C	{1: 2, 14: 4, 23: 1}
Did not match all atoms present	64969-34-2	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)Cl)Cl)N.OS(=O)(=O)O.OS(=O)(=O)O	{17: 2, 30: 2, 20: 4, 29: 4, 14: 6}
Did not match all atoms present	64972-18-5	CCCCCCCCOCCCN(CCC(=O)O)CCC(=O)[O-].[Na+]	{1: 1, 2: 14, 33: 1, 22: 1, 24: 1, 27: 1}
Did not match all atoms present	64977-44-2	CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)C(=CC=C4)F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	64977-46-4	CC1=C(C2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3)F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	64977-47-5	CC1=C2C(=C3C=CC=C(C3=C1)F)C=CC4=CC=CC=C42	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	64977-48-6	CC1=C2C(=C3C=C(C=CC3=C1)F)C=CC4=CC=CC=C42	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	64977-49-7	CC1=CC2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3F	{16: 1, 1: 1, 14: 10}
Did not match all atoms present	64985-31-5	CC(C)(C)C1=C(C(=CC=C1)Cl)N	{1: 3, 4: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	64987-03-7	CCOC(=O)C(=O)C1=CSC(=N1)NC=O	{1: 1, 2: 1, 35: 1, 41: 1, 14: 1, 24: 1, 26: 1, 28: 1, 31: 1}
Did not match all atoms present	6499-38-3	CC1=NC2=NC=CN=C2N=C1	{1: 1, 35: 4, 14: 3}
Did not match all atoms present	6499-39-4	CC1=NC2=NC=CN=C2N=C1C	{1: 2, 35: 4, 14: 2}
Did not match all atoms present	65-14-5	CCC(C1=CC=C(C=C1)O)C(C#N)C2=CC=C(C=C2)O	{1: 1, 2: 1, 3: 2, 37: 1, 14: 8, 21: 2}
Did not match all atoms present	65-19-0	COC(=O)[C@H]1[C@H](CC[C@@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O.Cl	{32: 1, 1: 1, 33: 1, 11: 6, 12: 5, 14: 4, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	65-22-5	CC1=NC=C(C(=C1O)C=O)CO.Cl	{1: 1, 2: 1, 35: 1, 14: 1, 17: 1, 20: 1, 21: 1, 26: 1}
Did not match all atoms present	65-23-6	CC1=NC=C(C(=C1O)CO)CO	{1: 1, 2: 2, 35: 1, 14: 1, 20: 2, 21: 1}
Did not match all atoms present	65-28-1	CC1=CC=C(C=C1)N(CC2=NCCN2)C3=CC(=CC=C3)O.CS(=O)(=O)O	{32: 1, 1: 2, 2: 1, 35: 1, 33: 1, 11: 2, 14: 8, 15: 1, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	65-29-2	CC[N+](CC)(CC)CCOC1=C(C(=CC=C1)OCC[N+](CC)(CC)CC)OCC[N+](CC)(CC)CC.[I-].[I-].[I-]	{1: 9, 2: 15, 19: 3, 22: 3, 14: 3}
Did not match all atoms present	65-30-5	CN1CCCC1C2=CN=CC=C2.CN1CCCC1C2=CN=CC=C2.OS(=O)(=O)O	{1: 2, 35: 2, 33: 2, 11: 6, 12: 2, 14: 8, 20: 2, 29: 2}
Did not match all atoms present	65-31-6	CN1CCCC1C2=CN=CC=C2.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 1, 3: 4, 33: 1, 11: 3, 12: 1, 14: 4, 35: 1, 20: 4, 27: 4}
Did not match all atoms present	65-45-2	C1=CC=C(C(=C1)C(=O)N)O	{24: 1, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	65-46-3	C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 2, 20: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	65-47-4	C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 2, 20: 6, 22: 3, 23: 1, 25: 1, 29: 3, 30: 1}
Did not match all atoms present	65-49-6	C1=CC(=C(C=C1N)O)C(=O)O	{30: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	65-64-5	CC(C1=CC=CC=C1)NN	{1: 1, 3: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	65-71-4	CC1=CNC(=O)NC1=O	{32: 2, 1: 1, 14: 1, 25: 2}
Did not match all atoms present	65-85-0	C1=CC=C(C=C1)C(=O)O	{27: 1, 14: 5}
Did not match all atoms present	65-86-1	C1=C(NC(=O)NC1=O)C(=O)O	{32: 2, 25: 2, 27: 1, 14: 1}
Did not match all atoms present	650-20-4	CCOP(=O)(CC)F	{16: 1, 1: 2, 2: 2, 29: 1, 22: 1}
Did not match all atoms present	650-51-1	C(=O)(C(Cl)(Cl)Cl)[O-].[Na+]	{24: 1, 17: 3, 4: 1}
Did not match all atoms present	650-52-2	C(F)(F)(F)P(C(F)(F)F)Cl	{16: 6, 17: 1, 4: 2}
Did not match all atoms present	65000-29-5	COC1=C(C=C(C=C1)Cl)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC=C(C=C4)N)S(=O)(=O)O	{1: 1, 34: 1, 14: 11, 15: 2, 17: 1, 20: 1, 22: 1, 24: 1, 25: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	65000-30-8	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N)N=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=CC(=C(C=C5)N=NC6=CC7=C(C=C(C=C7C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])C)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 6, 14: 20, 24: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	65000-34-2	C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C=C1N/N=C/3\C=CC4=C(C3=O)C=CC(=C4)NC(=O)NC5=CC6=C(C=C5)C(=O)/C(=N\NC7=CC8=C(C=C7)C=C(C=C8)S(=O)(=O)O)/C=C6	{34: 2, 14: 22, 15: 2, 20: 2, 24: 1, 25: 2, 29: 4, 31: 4}
Did not match all atoms present	65000-36-4	CCNC1=C2C(=C(C=C1)NC)C(=O)C3=CC=CC=C3C2=O	{1: 2, 2: 1, 31: 2, 14: 6, 25: 2}
Did not match all atoms present	65001-62-9	CC(C=C)O.C1=CC=C(C=C1)C(=O)O	{1: 1, 3: 1, 5: 1, 6: 1, 14: 5, 20: 1, 27: 1}
Did not match all atoms present	65007-00-3	C1=CC=NC(=C1)OS(=O)(=O)C(F)(F)F	{35: 1, 4: 1, 14: 4, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	65012-74-0	C[C@@H]([C@H](C)P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4.C1C2C=CC1C=C2.[O-]Cl(=O)(=O)=O.[Rh]	{1: 2, 3: 2, 11: 1, 12: 2, 14: 24, 17: 1, 29: 4}
Did not match all atoms present	65013-26-5	[BH4-].C1=CC=C(C=C1)P(=N[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{34: 1, 14: 30}
Did not match all atoms present	65016-55-9	CCCCCCCCCCC1=CSC=C1	{1: 1, 2: 9, 14: 3, 41: 1}
Did not match all atoms present	65016-61-7	CCCCCCCC1=CSC=C1	{1: 1, 2: 6, 14: 3, 41: 1}
Did not match all atoms present	65016-62-8	CCCCCCCCC1=CSC=C1	{1: 1, 2: 7, 14: 3, 41: 1}
Did not match all atoms present	6502-20-1	CC(C)C1=CC=CC=C1CC(C)C=O	{1: 3, 2: 1, 3: 2, 26: 1, 14: 4}
Did not match all atoms present	65027-52-3	C(=O)(C(Cl)(Cl)Cl)N=S1N=S=NS1	{34: 1, 35: 2, 4: 1, 41: 2, 17: 3, 24: 1}
Did not match all atoms present	65036-45-5	C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC(=O)C5=CC=C(C=C5)N)S(=O)(=O)O	{34: 1, 14: 17, 15: 2, 20: 1, 24: 2, 25: 1, 29: 2, 30: 1, 31: 3}
Did not match all atoms present	65036-53-5	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)[N+]#N.[Cl-]	{1: 1, 34: 3, 14: 7, 17: 1, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	65036-56-8	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])[N+]#N	{34: 3, 29: 3, 14: 8}
Did not match all atoms present	65036-59-1	COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+].[Na+].[Na+]	{1: 2, 34: 4, 14: 10, 22: 2, 29: 9, 30: 1}
Did not match all atoms present	65036-62-6	COC1=CC=CC(=C1)C(O)S(=O)(=O)[O-].[Na+]	{1: 1, 3: 1, 14: 4, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	65036-64-8	C1=CC(=C(C=C1N)S(=O)(=O)[O-])NC2=CC3=C(C=C2)NC(=O)N3.[Na+]	{32: 2, 14: 6, 25: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	65036-65-9	C1=CC(=CC=C1CCBr)S(=O)(=O)[O-].[Na+]	{2: 2, 18: 1, 14: 4, 29: 3}
Did not match all atoms present	65036-66-0	CC1=NN(C(=O)C1=CC2=CC=C(C=C2)N(C)C)C3=C(C=CC(=C3)S(=O)(=O)O)Cl	{1: 3, 35: 1, 6: 1, 33: 2, 14: 7, 15: 2, 17: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	65036-67-1	C1=CC(=CC(=C1)S(=O)(=O)[O-])N/N=C\2/C=C(C(=CC2=O)O)N=NC3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 10, 15: 3, 20: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	65036-69-3	COC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)OC)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 4, 6: 2, 14: 14, 22: 2, 29: 6}
Did not match all atoms present	65038-36-0	C1CCC(CC1)P(CCCCP(C2CCCCC2)C3CCCCC3)C4CCCCC4	{2: 4, 11: 20, 12: 4}
Did not match all atoms present	65039-18-1	CCCCCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 11, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	6504-64-9	COCN1C=NC2=C1N=CN=C2Cl	{1: 1, 2: 1, 35: 3, 33: 1, 14: 2, 17: 1, 22: 1}
Did not match all atoms present	6504-77-4	COCCNC1=NC2=C(C(=NC(=N2)C3=CC=CC=C3)N)N=C1C(=O)NCCOC	{1: 2, 2: 4, 35: 4, 14: 5, 22: 2, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	65043-22-3	C1COC(CN1)COC2=CC=CC3=C2CC=C3.Cl	{32: 1, 2: 1, 11: 4, 12: 1, 14: 5, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	65045-71-8	C=O.C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)[O-].[Ca+2]	{5: 1, 14: 14, 29: 6}
Did not match all atoms present	65045-84-3	CCCCCCCCCCCCC1=CC=C(C=C1)SP(=O)(O)SC2=CC=C(C=C2)CCCCCCCCCCCC	{1: 2, 2: 22, 40: 2, 14: 8, 20: 1, 29: 1}
Did not match all atoms present	65045-85-4	CCCCCCCCCCCCC1=CC=C(C=C1)SP(=O)([O-])SC2=CC=C(C=C2)CCCCCCCCCCCC.CCCCCCCCCCCCC1=CC=C(C=C1)SP(=O)([O-])SC2=CC=C(C=C2)CCCCCCCCCCCC.[Zn+2]	{40: 4, 1: 4, 2: 44, 29: 4, 14: 16}
Did not match all atoms present	65045-86-5	CCCCCCCCCC1=CC=C(C=C1)OCCSP(=O)(O)SCCOC2=CC=C(C=C2)CCCCCCCCC	{1: 2, 2: 20, 40: 2, 14: 8, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	6505-29-9	CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)OC)OC)C6=CC=CC=C6	{1: 4, 34: 4, 35: 2, 33: 2, 12: 2, 14: 16, 15: 2, 22: 2, 25: 2}
Did not match all atoms present	6505-30-2	CCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC(=C(C=C2)C(=C3C=CC(=[N+](CC)CC)C=C3)C4=C(C=C(C=C4)N(CC)CC5=CC(=CC=C5)S(=O)(=O)[O-])C)C.[Na+]	{1: 6, 2: 6, 33: 3, 7: 1, 14: 18, 15: 2, 20: 1, 29: 5}
Did not match all atoms present	6505-31-3	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC(=CC=C3)N(CC4=CC(=CC=C4)S(=O)(=O)[O-])CC5=CC(=CC=C5)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 2, 33: 3, 7: 1, 14: 20, 15: 2, 29: 6}
Did not match all atoms present	6505-75-5	C1=CC(=CC(=C1)Cl)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O	{38: 1, 14: 7, 17: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	65051-83-4	CC1=CC=CC=C1C2C=C2	{1: 1, 12: 1, 14: 6}
Did not match all atoms present	65057-90-1	C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)OC(C(C2=NC(=CS2)C3=NC(=CS3)C(=O)NCCCC(CC(=O)NCCCNCCCCN)N)O)NC(=O)C(C(C)O)NC(=O)CC(C(C)NC(=O)C(C(C4=CN=CN4)O[C@@H]5[C@H]([C@H]([C@@H]([C@@H](O5)CO)O)O)O[C@@H]6[C@H]([C@H]([C@@H]([C@H](O6)CO)O)OC(=O)N)O)NC(=O)C7=C(C(=NC(=N7)C(CC(=O)N)NCC(C(=O)N)N)N)C)O)O)O)N	{32: 1, 1: 4, 2: 16, 3: 11, 41: 2, 12: 15, 14: 4, 35: 5, 20: 11, 22: 3, 23: 3, 24: 8, 28: 1, 30: 8, 31: 8}
Did not match all atoms present	65057-91-2	CC1C(C(C(C(O1)OC(C(C2=CSC(=N2)C3=CSC(=N3)C(=O)NCCCNCCCCN)O)NC(=O)C(C(C)O)NC(=O)CC(C(C)NC(=O)C(C(C4=CN=CN4)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)OC(=O)N)O)NC(=O)C7=C(C(=NC(=N7)C(CC(=O)N)NCC(C(=O)N)N)N)C)O)O)O)N	{32: 1, 1: 4, 2: 12, 3: 10, 41: 2, 12: 15, 14: 4, 35: 5, 20: 11, 22: 3, 23: 3, 24: 7, 28: 1, 30: 7, 31: 7}
Did not match all atoms present	65059-37-2	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)N)[N+](=O)[O-]	{25: 2, 38: 2, 30: 1, 14: 5}
Did not match all atoms present	65059-42-9	CCCCCCCC[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 2: 7, 29: 3, 22: 1}
Did not match all atoms present	65059-52-1	CC1=NN(C(=O)C1C=CC=CC=C2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C)C4=CC=C(C=C4)S(=O)(=O)O	{1: 2, 35: 2, 6: 5, 33: 2, 12: 1, 14: 8, 15: 3, 20: 2, 25: 2, 29: 4}
Did not match all atoms present	65059-55-4	CCCCCCCCCCCCCCCCCC(=O)OC(C)C[N+](C)(CCN(CCO)CC(C)O)CC(C)OC(=O)CCCCCCCCCCCCCCCCC.COS(=O)(=O)[O-]	{1: 7, 2: 39, 3: 3, 33: 1, 20: 2, 22: 1, 28: 2, 29: 3}
Did not match all atoms present	65059-71-4	CCCCCCCCCCCCCCC=C[N+](C)(C)CC(=O)[O-]	{24: 1, 1: 3, 2: 14, 6: 2}
Did not match all atoms present	65059-82-7	CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)N=NC3=NC(=C(N3C)C#N)C#N)NC(=O)C	{1: 3, 2: 2, 35: 1, 37: 2, 33: 2, 34: 2, 14: 8, 24: 1, 31: 1}
Did not match all atoms present	65059-84-9	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C(=C2)C)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl)OC)NC(=O)C	{1: 5, 2: 2, 38: 1, 33: 1, 34: 4, 14: 7, 17: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	65059-88-3	CC(=O)NC1=CC(=C(C=C1)OC)N(CCC(=O)OC)CCOC(=O)C	{1: 4, 2: 4, 33: 1, 14: 3, 22: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	65059-89-4	C1=CC=C(C=C1)C(=O)OCCN(CCOC(=O)C2=CC=CC=C2)C3=CC=CC(=C3)N	{33: 1, 2: 4, 28: 2, 30: 1, 14: 14}
Did not match all atoms present	65059-92-9	CCCCCCCCCCCCCCCCCC[N+](CC1=CC=CC=C1)(CC(C)O)CC(C)O.[Cl-]	{1: 3, 2: 20, 3: 2, 14: 5, 17: 1, 20: 2}
Did not match all atoms present	65059-93-0	CCCCCCCC[N+](CC1=CC=CC=C1)(CC(C)O)CC(C)O.[Cl-]	{1: 3, 2: 10, 3: 2, 14: 5, 17: 1, 20: 2}
Did not match all atoms present	65059-94-1	CCCCCCCCCCCCCC[N+](CC1=CC=CC=C1)(CC(C)O)CC(C)O.[Cl-]	{1: 3, 2: 16, 3: 2, 14: 5, 17: 1, 20: 2}
Did not match all atoms present	65059-96-3	CCCCCC=CCC=CCCCCCCCC[N+](C)(C)CC(=O)[O-]	{24: 1, 1: 3, 2: 14, 6: 4}
Did not match all atoms present	65059-97-4	CCCCCCCCCCCCCCCCC[N+](C)(C)CC(=O)[O-]	{24: 1, 1: 3, 2: 17}
Did not match all atoms present	65059-99-6	C[N+](C)(C)CCCN1C(=O)C2=C(C3=C(C(=C2C1=O)N)C(=O)C4=CC=CC=C4C3=O)N.COS(=O)(=O)[O-]	{1: 4, 2: 3, 33: 1, 14: 4, 22: 1, 25: 4, 29: 3, 30: 2}
Did not match all atoms present	6506-37-2	C1COCCN1CCN2C=NC=C2[N+](=O)[O-]	{33: 2, 2: 2, 35: 1, 38: 1, 11: 4, 14: 2, 23: 1}
Did not match all atoms present	65060-06-2	CCCCCCCCCCCCCCCC(=O)N(CC[N+](C)(CCO)CCOC(=O)CCCCCCCCCCCCCCC)CCO.COS(=O)(=O)[O-]	{1: 4, 2: 36, 33: 1, 20: 2, 22: 1, 24: 1, 28: 1, 29: 3}
Did not match all atoms present	65060-08-4	CCCCCCCCCCCCCCCC(=O)N(CC[N+](C)(CCN(CCO)CCOC(=O)CCCCCCCCCCCCCCC)CCO)CCO.COS(=O)(=O)[O-]	{1: 4, 2: 40, 33: 2, 20: 3, 22: 1, 24: 1, 28: 1, 29: 3}
Did not match all atoms present	65072-11-9	CC(C)(CCC(=O)O)C(=O)O.COC(=O)C1=CC=C(C=C1)C(=O)OC.C(CO)O	{1: 4, 2: 4, 4: 1, 14: 4, 20: 2, 27: 2, 28: 2}
Did not match all atoms present	65072-12-0	CC(C)C(C(C)(C)CO)O.COC(=O)C1=CC(=CC=C1)C(=O)OC	{1: 6, 2: 1, 3: 2, 4: 1, 14: 4, 20: 2, 28: 2}
Did not match all atoms present	65072-22-2	CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C)C.CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 12, 2: 6, 33: 2, 34: 4, 14: 14, 17: 4, 24: 2}
Did not match all atoms present	65072-25-5	C1=CC=C(C=C1)C(=O)OCCN(CCOC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)C=O	{33: 1, 2: 4, 28: 2, 26: 1, 14: 14}
Did not match all atoms present	65072-26-6	C1=CC(=CC=C1C(=O)O)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=CC(=CC(=C5C=C4)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 14: 13, 15: 2, 24: 1, 25: 1, 27: 1, 29: 6, 31: 3}
Did not match all atoms present	65072-31-3	C1=CC(=CC=C1C(=O)[O-])N/N=C\2/C=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=C(C=C6)C(=O)[O-])/C(=C5)S(=O)(=O)[O-].[O-]S(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 17, 15: 3, 24: 3, 25: 2, 29: 6, 31: 4}
Did not match all atoms present	65072-32-4	CCN(CC)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(CC)CC.OS(=O)(=O)O	{1: 4, 2: 4, 33: 2, 14: 8, 20: 2, 24: 1, 29: 2}
Did not match all atoms present	65072-39-1	CC1=C(C2=C(C=C1)C=C(C=C2)C3=CC=C(C=C3)C4=NC5=C(S4)C(=C(C=C5)C)S(=O)(=O)O)N	{1: 2, 35: 1, 41: 1, 14: 11, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	65072-40-4	CC1=CC2=C(C(=C1)S(=O)(=O)[O-])SC(=N2)C3=CC=C(C=C3)N.[Na+]	{1: 1, 35: 1, 41: 1, 14: 6, 29: 3, 30: 1}
Did not match all atoms present	65072-41-5	CCN(CC1=CC=CC=C1Cl)C2=CC(=C(C=C2)N=NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)O)C	{1: 2, 2: 2, 35: 1, 33: 1, 41: 1, 34: 2, 14: 10, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	65072-43-7	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=NC4C(=NN(C4=O)CO)C)S(=O)(=O)O.C(CO)NCCO	{1: 2, 2: 5, 35: 2, 33: 1, 41: 1, 12: 1, 34: 2, 14: 6, 15: 1, 20: 4, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	65072-44-8	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=N[C@@H]4C(=NN(C4=O)CO)C)S(=O)(=O)O	{1: 2, 2: 1, 35: 2, 33: 1, 41: 1, 12: 1, 34: 2, 14: 6, 15: 1, 20: 2, 25: 1, 29: 2}
Did not match all atoms present	65072-45-9	C1=CC=C2C(=C1)C=CC(=[N+]2CCCS(=O)(=O)[O-])C=C3N(C4=CC=CC=C4S3)CCCS(=O)(=O)O	{33: 2, 2: 6, 6: 1, 41: 1, 14: 10, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	65072-48-2	C1=CC(=C(C=C1C(C(F)(F)F)(C(F)(F)F)O)Cl)Cl	{16: 6, 17: 2, 4: 3, 14: 3, 20: 1}
Did not match all atoms present	65072-49-3	CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)NN=C3N=C(C(=N3)C#N)C#N)NC(=O)C	{1: 2, 2: 2, 35: 2, 37: 2, 33: 1, 34: 1, 14: 8, 15: 3, 24: 1, 31: 2}
Did not match all atoms present	65072-51-7	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=C(C=C4)C)C(=O)C5=C(C=CC(=C5C3=O)NC6=CC=C(C=C6)C)NC(=O)C7=CC=C(C=C7)[N+](=O)[O-]	{1: 3, 38: 1, 14: 20, 24: 1, 25: 2, 31: 4}
Did not match all atoms present	65072-53-9	C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)N(CCO)CCO)N=NC3=CC=C(C=C3)[N+](=O)[O-]	{33: 1, 2: 4, 38: 1, 34: 2, 14: 12, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	65072-54-0	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N=NC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)N(CCOC(=O)C5=CC=CC=C5)CCOC(=O)C6=CC=CC=C6)NC(=O)C7=CC=CC=C7)C	{1: 2, 2: 4, 33: 1, 34: 6, 14: 29, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	65072-61-9	CCCCOC(=O)C1=CC=CC=C1N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4OCC	{1: 2, 2: 4, 34: 1, 14: 13, 15: 2, 22: 1, 24: 1, 25: 1, 28: 1, 31: 2}
Did not match all atoms present	65079-19-8	CC1=NC2=C(C=C1)C=C(C=C2)N	{1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	6508-04-9	C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)C#N	{22: 1, 14: 8, 37: 2}
Did not match all atoms present	65085-01-0	CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N\OC)/C4=CSC(=N4)N)SC2)C(=O)O	{1: 2, 2: 1, 35: 4, 33: 2, 7: 1, 40: 1, 41: 2, 11: 1, 12: 2, 34: 1, 14: 1, 15: 2, 22: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	65086-42-2	CCCCCC=CCC=CCCCCCCCCOCCCCCCCCC=CCC=CCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 26, 22: 1, 6: 8, 29: 4}
Did not match all atoms present	65086-45-5	CCN(CC)CCN=C1C=CN(C2=C1C=CC(=C2)Cl)O	{1: 2, 2: 4, 33: 2, 34: 1, 14: 5, 17: 1, 21: 1}
Did not match all atoms present	65086-47-7	CC1=C(C=CC(=C1)N(CCC#N)CCO)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 2: 4, 37: 1, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 20: 1}
Did not match all atoms present	65086-49-9	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(F)(F)S(=O)(=O)[O-])(F)F)F)(F)F)F.C(=C(F)F)(F)F.[K+]	{16: 17, 4: 5, 29: 3, 22: 2, 7: 4}
Did not match all atoms present	65086-50-2	CCCCCCCCCCCCCCCC(=O)NCO.C=O.C1(=NC(=NC(=N1)N)N)N	{1: 1, 2: 15, 35: 3, 5: 1, 20: 1, 24: 1, 30: 3, 31: 1}
Did not match all atoms present	65086-51-3	CCCCCCCCCCCCCCCCCC(=O)NCO.C=O.C1(=NC(=NC(=N1)N)N)N	{1: 1, 2: 17, 35: 3, 5: 1, 20: 1, 24: 1, 30: 3, 31: 1}
Did not match all atoms present	65086-89-7	C1=CC=C(C=C1)OC(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)CC5=CC=C(C=C5)NC(=O)OC6=CC=CC=C6	{24: 1, 2: 2, 28: 2, 14: 26, 31: 4}
Did not match all atoms present	65086-93-3	CC(=O)NC1=CC(=C(C=C1)OC)NCCC(=O)OC	{1: 3, 2: 2, 14: 3, 22: 1, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	65086-95-5	CCOC(=O)C(=CC1=CC=C(C=C1)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3)C#N	{1: 1, 2: 5, 33: 1, 6: 1, 7: 1, 14: 14, 28: 3, 37: 1}
Did not match all atoms present	65086-97-7	CC1=CC(=O)N(C(=N1)[O-])C(C)(C)C.[Na+]	{1: 4, 35: 1, 4: 1, 33: 1, 14: 1, 25: 1}
Did not match all atoms present	65087-01-6	CCCCCCCCCCCCCOCCOCCOP(=O)(O)OCCOCCOCCCCCCCCCCCCC	{1: 2, 2: 32, 20: 1, 29: 1, 22: 6}
Did not match all atoms present	65087-03-8	CC1=CC(=C(C=C1)SSC2=C(C=CC(=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65087-04-9	CC1=CC(=C(C=C1)SSC2=C(C=CC=C2C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65087-05-0	CC1=CC(=C(C=C1)SSC2=CC(=C(C=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65087-06-1	CC(=O)N1C(=C(N(C1=O)C)C2=CC=CC=C2)C3=CC=CC=C3	{24: 1, 1: 2, 33: 2, 14: 10, 25: 1}
Did not match all atoms present	65087-14-1	CC1=CC(=C(C=C1)SSC2=CC=CC(=C2C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65087-15-2	CC1=C(C(=CC=C1)SSC2=C(C=CC=C2C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65087-16-3	CC1=C(C(=CC=C1)SSC2=CC(=C(C=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65087-17-4	CC1=C(C(=CC=C1)SSC2=CC(=CC(=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65087-24-3	CCN1C2=C(C3=CC=CC=C3C=C2)OC1=CC=CC4=[N+](C5=C(O4)C6=CC=CC=C6C=C5)CC.[Br-]	{1: 2, 2: 2, 6: 3, 33: 2, 14: 12, 15: 1, 18: 1, 23: 2}
Did not match all atoms present	65087-28-7	CN(C)CCOS(=O)Cl.Cl	{1: 2, 2: 2, 33: 1, 17: 2, 22: 1, 29: 1}
Did not match all atoms present	65089-17-0	CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SCC(=O)NCCO)Cl)C	{1: 2, 2: 3, 35: 2, 40: 1, 14: 4, 17: 1, 20: 1, 24: 1, 31: 2}
Did not match all atoms present	6509-33-7	C1=CC=C(C=C1)[Hg].C1=CC=C(C=C1)[Hg]O[N+](=O)[O-].O	{22: 1, 14: 10}
Did not match all atoms present	65090-77-9	CC(C)[C-]1C=CC=C1.[Na+]	{1: 2, 3: 1, 14: 4}
Did not match all atoms present	65094-18-0	C(F)(F)(F)[Ge](C(F)(F)F)(C(F)(F)F)Br	{16: 9, 18: 1, 4: 3}
Did not match all atoms present	65094-22-6	CCOP(=O)(C(F)(F)Br)OCC	{1: 2, 2: 2, 4: 1, 16: 2, 18: 1, 22: 2, 29: 1}
Did not match all atoms present	65094-25-9	CCOP(=O)(C(F)(Br)Br)OCC	{1: 2, 2: 2, 4: 1, 16: 1, 18: 2, 22: 2, 29: 1}
Did not match all atoms present	65094-73-7	CC(CN(C)C)NC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].Cl.Cl	{1: 3, 2: 1, 3: 1, 38: 1, 33: 1, 14: 7, 17: 2, 35: 1, 31: 1}
Did not match all atoms present	651-06-9	COC1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 2, 14: 6, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	651-48-9	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC=C4[C@@]3(CC[C@@H](C4)OS(=O)(=O)O)C	{1: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 22: 1, 25: 1, 29: 2}
Did not match all atoms present	651-70-7	C1=CSC(=C1)C(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 3, 41: 1}
Did not match all atoms present	651-77-4	CC1=C(C(=C(C(=O)N1)C#N)C(F)(F)F)[N+](=O)[O-]	{32: 1, 1: 1, 4: 1, 37: 1, 38: 1, 16: 3, 25: 1}
Did not match all atoms present	651-80-9	C1=C(C(=C(C(=C1F)F)C(F)(F)F)F)F	{16: 7, 4: 1, 14: 1}
Did not match all atoms present	651-83-2	C1(=C(C(=C(C(=C1F)F)N)F)F)C(F)(F)F	{16: 7, 4: 1, 30: 1}
Did not match all atoms present	651-84-3	C1(=C(C(=C(C(=C1F)F)S)F)F)C(F)(F)F	{16: 7, 4: 1, 39: 1}
Did not match all atoms present	651-89-8	C1(=C(C(=C(C(=C1F)F)C(F)(F)F)F)F)C(F)(F)F	{16: 10, 4: 2}
Did not match all atoms present	6510-65-2	CC1=CC=CC2=C1NC3=CC=CC=C23	{32: 1, 1: 1, 14: 7}
Did not match all atoms present	65104-05-4	[H+].[H+].COC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=C2[O-])N=NC4=C(C=CC(=C4)[N+](=O)[O-])C(=O)[O-].COC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=C2[O-])N=NC4=C(C=CC(=C4)[N+](=O)[O-])C(=O)[O-].[Cu+2]	{1: 2, 34: 4, 38: 2, 14: 24, 22: 2, 24: 4, 31: 2}
Did not match all atoms present	65104-20-3	CCC(=CC1=[N+](C2=CC3=C(C=C2S1)OC4(O3)CCCCC4)CC)C=C5N(C6=CC7=C(C=C6S5)OC8(O7)CCCCC8)CC.[I-]	{1: 3, 2: 3, 33: 2, 6: 2, 7: 1, 41: 2, 11: 10, 13: 2, 14: 4, 15: 1, 19: 1, 23: 4}
Did not match all atoms present	65104-21-4	CCN1C2=CC3=C(C=C2SC1=CC(=CC4=[N+](C5=CC6=C(C=C5S4)OC7(O6)CCCCC7)CC)C)OC8(O3)CCCCC8.[I-]	{1: 3, 2: 2, 33: 2, 6: 2, 7: 1, 41: 2, 11: 10, 13: 2, 14: 4, 15: 1, 19: 1, 23: 4}
Did not match all atoms present	65104-25-8	C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)N=NC5C(=NN(C5=O)C6=CC(=CC=C6)[N+](=O)[O-])C(=O)[O-].[Na+].[Na+]	{33: 2, 34: 4, 35: 2, 38: 2, 12: 2, 14: 16, 15: 2, 24: 3, 25: 2, 31: 1}
Did not match all atoms present	65104-29-2	C1=CC(=CC(=C1)S(=O)(=O)O)N=NC2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)N/N=C\4/C=CC(=O)C(=C4)C(=O)O	{34: 3, 14: 15, 15: 2, 20: 1, 24: 1, 25: 1, 27: 1, 29: 2, 31: 3}
Did not match all atoms present	65104-30-5	CC1=CC(=C(C=C1)SSC2=CC(=CC(=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65104-31-6	CC1=CC(=C(C=C1)C)SSC2=C(C=CC=C2C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65104-32-7	CC1=CC(=C(C=C1)C)SSC2=CC(=CC(=C2)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65104-33-8	CC1=C(C(=CC=C1)C)SSC2=CC(=C(C=C2)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65104-34-9	CC1=C(C(=CC=C1)C)SSC2=CC(=CC(=C2)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65104-35-0	CC1=C(C=C(C=C1)SSC2=CC(=CC(=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65104-38-3	CC(C)(C)OC1=NC(=NC=C1C2=CN=CC=C2)OC(C)(C)C	{1: 6, 35: 3, 4: 2, 22: 2, 14: 5}
Did not match all atoms present	65104-39-4	CCCCCCCCCCCCOP(=O)(O)O.C(CO)NCCO.C(CO)NCCO	{1: 1, 2: 19, 20: 6, 22: 1, 29: 1, 31: 2}
Did not match all atoms present	65104-43-0	CCCCNS(=O)(=O)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F.C(=C(F)F)(F)F	{1: 1, 2: 3, 4: 5, 7: 4, 16: 17, 22: 2, 29: 2, 31: 1}
Did not match all atoms present	65104-48-5	C1=CC2=C(C=C1N)C(=O)/C(=N\NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N/N=C/5\C(=CC6=CC(=CC(=C6C5=O)N)S(=O)(=O)O)S(=O)(=O)[O-])S(=O)(=O)O)S(=O)(=O)O)/C(=C2)S(=O)(=O)O.[Na+]	{34: 2, 6: 2, 14: 13, 15: 4, 20: 4, 25: 2, 29: 11, 30: 2, 31: 2}
Did not match all atoms present	65104-56-5	CCCCCCCCCCCCCCOP(=O)(O)O.C(CO)NCCO	{1: 1, 2: 17, 20: 4, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	65104-57-6	CCCCCCCCCCCCCCOP(=O)(O)O.C(CO)NCCO.C(CO)NCCO	{1: 1, 2: 21, 20: 6, 22: 1, 29: 1, 31: 2}
Did not match all atoms present	65104-58-7	CCCCCCCCCCCCCCOP(=O)(O)O.N	{1: 1, 2: 13, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	65104-59-8	CCCCCCCCCCCCCCOP(=O)(O)O.C1COCCN1	{32: 1, 1: 1, 2: 13, 11: 4, 20: 2, 22: 1, 23: 1, 29: 1}
Did not match all atoms present	65104-74-7	CCCCCCCCCCCCCCC=COC=CCCCCCCCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 26, 22: 1, 6: 4, 29: 4}
Did not match all atoms present	65104-94-1	CCCCCCCC/C=C/C=C/CCCCOP(=O)(OCCCC/C=C/C=C/CCCCCCCC)O	{1: 2, 2: 22, 6: 8, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	65104-95-2	CCCCCCCCCCCCCC/C=C/OP(=O)(O)OC/C=C/CCCCCCCCCCCCC	{1: 2, 2: 26, 6: 4, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	65104-96-3	CCCCCCCC/C=C/C=C/CCCCCCOP(=O)(O)OCCCCCCCC/C=C/C=C/CCCCCC	{1: 2, 2: 26, 6: 8, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	65104-99-6	C1=CC(=CC(=C1)N(C(=O)N)C(=O)NC2=CC=CC(=C2C3=C(C=C(C=C3)CC4=CC(=C(C=C4)C5=C(C=CC=C5NC(=O)N(C6=CC=CC(=C6)CN=C=O)C(=O)N)CN=C=O)Cl)Cl)CN=C=O)CN=C=O	{33: 2, 2: 5, 8: 4, 34: 4, 14: 20, 17: 2, 24: 4, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	65105-00-2	CC(CCOC(=O)NC1=CC=CC(=C1)CN=C=O)OC(=O)NC2=CC=CC(=C2)CN=C=O	{1: 1, 2: 4, 3: 1, 8: 2, 34: 2, 14: 8, 28: 2, 29: 2, 31: 2}
Did not match all atoms present	65105-01-3	CCC(=NOC(=O)NC1=CC(=CC=C1)N(C)C(=O)OCCC(C)OC(=O)N(C)C2=CC=CC(=C2)NC(=O)ON=C(C)CC)C	{1: 7, 2: 4, 3: 1, 33: 2, 7: 2, 34: 2, 14: 8, 28: 4, 31: 2}
Did not match all atoms present	6512-83-0	C1=CC=C(C(=C1)C(=O)O)[Se][Se]C2=CC=CC=C2C(=O)O	{27: 2, 14: 8}
Did not match all atoms present	65121-70-2	CCN1C(=O)C2=C(C3=C(C(=C2C1=O)N)C(=O)C4=CC=CC=C4C3=O)N	{1: 1, 2: 1, 33: 1, 14: 4, 25: 4, 30: 2}
Did not match all atoms present	65121-73-5	CC1(C2=CC=CC=C2[N+](=C1C=NN(C)C3=CC=CC=C3)C)C.OS(=O)(=O)[O-]	{1: 4, 34: 1, 6: 1, 33: 2, 13: 1, 14: 9, 15: 1, 20: 1, 29: 3}
Did not match all atoms present	65121-80-4	CCCCCCCCCCOP(=O)(O)O.C1COCCN1.C1COCCN1	{32: 2, 1: 1, 2: 9, 11: 8, 20: 2, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	65121-81-5	CCCCCCCCCCOP(=O)(O)O.C(CO)NCCO	{1: 1, 2: 13, 20: 4, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	65121-82-6	CCCCCCCCCCOS(=O)(=O)O.C(CO)NCCO	{1: 1, 2: 13, 20: 3, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	65121-87-1	CCCCCCCCCCCC/C=C/OS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 15, 6: 2, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	65121-89-3	CCCCCCCCCCCC/C=C/OS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 17, 6: 2, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	65121-93-9	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=C(C=C3)N(CC)CC.CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=C(C=C3)N(CC)CC.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 12, 2: 12, 33: 6, 7: 2, 14: 24, 15: 4, 17: 4}
Did not match all atoms present	65121-97-3	CC1=CC(=C(N1C2=CC(=CC=C2)I)C)C=O	{1: 2, 26: 1, 19: 1, 14: 5, 33: 1}
Did not match all atoms present	65122-01-2	CCN1CCSC1=CC(=C2C(=O)N(C(=S)O2)CC)C	{1: 3, 2: 2, 33: 2, 6: 1, 7: 1, 41: 1, 11: 2, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	65122-11-4	C1=CC2=C(C=C1Cl)C(=O)C3=CC=C4C5=C6C(=CC=C7C6=C(C=C5)C8=C(C7=O)C=C(C=C8)Cl)C9=C4C3=C2C=C9	{17: 2, 14: 14, 25: 2}
Did not match all atoms present	65122-12-5	CN1C(=CC=C2C(=NOC2=O)C3=CC=CC=C3)N(C4=NC5=CC=CC=C5N=C41)C	{1: 2, 35: 3, 6: 2, 33: 2, 14: 9, 15: 3, 28: 1}
Did not match all atoms present	65122-24-9	CCCCCCCCCCCCCCCCOP(=O)(O)O.C(CO)NCCO	{1: 1, 2: 19, 20: 4, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	65122-28-3	C=CCCCCCCCCCCCC/C=C/OP(=O)(O)O	{2: 12, 5: 1, 6: 3, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	65122-30-7	CCCCCCCCCCCC/C=C/C=C/OS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 15, 6: 4, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	65122-31-8	CCCCCCCCCCCC/C=C/C=C/OS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 17, 6: 4, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	65122-39-6	CCC1=CC(=C(C(=C1NC2=C3C(=C(C=C2)NC4=C(C(=C(C=C4CC)CC)S(=O)(=O)O)CC)C(=O)C5=CC=CC=C5C3=O)CC)S(=O)(=O)O)CC	{1: 6, 2: 6, 14: 8, 20: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	65122-43-2	C1=CC=C(C=C1)C2=NOC(=O)C2C=CNC3=CC=CC=C3	{35: 1, 6: 2, 12: 1, 14: 10, 15: 1, 28: 1, 31: 1}
Did not match all atoms present	65122-44-3	CC(=O)O.C1=CC(=CC(=C1)N)N=NC2=C(C=C(C=C2)N)N	{1: 1, 34: 2, 27: 1, 30: 3, 14: 7}
Did not match all atoms present	65122-45-4	C1=CC(=CC(=C1)N)N=NC2=C(C=C(C=C2)N)N.C(=O)O	{34: 2, 26: 1, 27: 1, 30: 3, 14: 7}
Did not match all atoms present	65133-66-6	CC(=C)C(=O)OCCOCCOC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCCOC(=O)C(=C)C	{1: 4, 2: 6, 4: 1, 5: 2, 7: 2, 14: 8, 22: 3, 28: 2}
Did not match all atoms present	65138-66-1	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.C1=CC(=CC=C1N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-]	{1: 15, 2: 9, 35: 1, 33: 1, 12: 1, 34: 2, 14: 32, 15: 1, 23: 3, 24: 1, 25: 1, 28: 3, 29: 6, 31: 6}
Did not match all atoms present	65138-73-0	CCCCCCCCCCOP(=O)(O)O.N	{1: 1, 2: 9, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	65138-74-1	CCCCCCCCCCOP(=O)(O)O.N.N	{1: 1, 2: 9, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	65138-76-3	CCCCCCCCCCCCOP(=O)(O)O.N	{1: 1, 2: 11, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	65138-77-4	CCCCCCCCCCCCCOCCOCCOP(=O)(O)O	{1: 1, 2: 16, 20: 2, 29: 1, 22: 3}
Did not match all atoms present	65138-79-6	C1=CC=C2C(=C1)C(=O)N(C2=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C(=O)C5=C(C4=O)C=CC=C5[N+](=O)[O-]	{25: 4, 38: 2, 14: 9, 33: 1}
Did not match all atoms present	65138-84-3	CCCCCCCCCCCCCCCCOP(=O)([O-])[O-].C(CO)[NH2+]CCO.C(CO)[NH2+]CCO	{1: 1, 2: 23, 20: 4, 29: 3, 22: 1}
Did not match all atoms present	65141-46-0	C1=CC(=CN=C1)C(=O)NCCO[N+](=O)[O-]	{2: 2, 35: 1, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	65146-47-6	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CN=C(N3)N.Cl	{32: 1, 17: 1, 35: 1, 30: 1, 14: 10}
Did not match all atoms present	6515-38-4	C1=C(C(=O)NC(=C1Cl)Cl)Cl	{32: 1, 17: 3, 14: 1, 25: 1}
Did not match all atoms present	65150-82-5	C1=CC(=CC(=C1)N)N=NC2=C(C=C(C=C2)N)N.Cl	{17: 1, 34: 2, 30: 3, 14: 7}
Did not match all atoms present	65150-87-0	[Li+].[Li+].[Li+].C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=CC=C(C=C3)C4=CC=C(C=C4)N/N=C\5/C(=CC6=CC(=CC(=C6C5=O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]	{34: 2, 14: 17, 15: 3, 25: 2, 29: 9, 31: 2}
Did not match all atoms present	65151-08-8	CCC(C)[Pb](C(C)CC)(C(C)CC)C(C)CC	{1: 8, 2: 4, 3: 4}
Did not match all atoms present	65151-12-4	CCCCCCCCCCCCCCCCO.CC(C)O.CC(C)O.CC(C)O.[Ti]	{1: 7, 2: 15, 3: 3, 20: 4}
Did not match all atoms present	65151-13-5	CCCCCCCCCCCCCCCCO.CCCCCCCCCCCCCCCCO.CCCCCCCCCCCCCCCCO.CC(C)O.[Ti]	{1: 5, 2: 45, 3: 1, 20: 4}
Did not match all atoms present	65151-24-8	CCN(CC1=CC=CC=C1Cl)C2=CC=CC(=C2)C	{1: 2, 2: 2, 33: 1, 14: 8, 17: 1}
Did not match all atoms present	65151-27-1	CC1=CC(=C(C=C1N)OC)N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 2, 34: 2, 14: 7, 20: 2, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	65151-29-3	CC1=C(C=CC(=C1)N)N=NC2=CC(=C(C=C2)N=NC3=CC(=C(C=C3)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)O)S(=O)(=O)O)C)C	{1: 3, 34: 6, 14: 14, 20: 2, 29: 4, 30: 1}
Did not match all atoms present	65151-32-8	C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)NN=C3C=C(C(=CC3=O)O)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)O)S(=O)(=O)O	{34: 3, 14: 12, 15: 3, 20: 5, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	65151-45-3	CCCCCCCCCCCCCCCCOP(=O)(O)O.C1COCCN1	{32: 1, 1: 1, 2: 15, 11: 4, 20: 2, 22: 1, 23: 1, 29: 1}
Did not match all atoms present	65151-46-4	CCCCCCCCCCCCCCCCOP(=O)(O)O.C1COCCN1.C1COCCN1	{32: 2, 1: 1, 2: 15, 11: 8, 20: 2, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	65151-48-6	CCCCCCCCCCCCCCCC[N+](CC1=CC=CC=C1)(CC(C)O)CC(C)O.[Cl-]	{1: 3, 2: 18, 3: 2, 14: 5, 17: 1, 20: 2}
Did not match all atoms present	65151-60-2	CC1=CC(=CC(=C1)SSC2=CC(=CC(=C2)C)C)C	{40: 2, 1: 4, 14: 6}
Did not match all atoms present	65151-61-3	CCOC(=O)C(C#N)C(C#N)C1=CC=C(C=C1)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3	{1: 1, 2: 5, 3: 2, 37: 2, 33: 1, 14: 14, 28: 3}
Did not match all atoms present	65151-64-6	C(#N)C1=C(N=C(N1)[N+]#N)C#N.[Cl-]	{32: 1, 17: 1, 34: 1, 35: 1, 37: 2}
Did not match all atoms present	65151-66-8	CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C(=[N+](C2=NC3=CC=CC=C3N=C21)C)C=CC4=C(N(OC4=O)C)C5=CC=CC=C5	{1: 4, 35: 2, 6: 2, 33: 3, 14: 13, 28: 1, 29: 3}
Did not match all atoms present	65151-68-0	CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)C(C3=O)C4=NC5=CC=CC=C5CC4=O	{1: 1, 2: 11, 35: 1, 11: 1, 12: 1, 14: 11, 15: 1, 24: 1, 25: 3, 31: 1}
Did not match all atoms present	65151-69-1	[Li+].[Li+].CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)[O-])S(=O)(=O)[O-]	{1: 1, 35: 2, 41: 1, 12: 1, 14: 10, 24: 1, 25: 2, 29: 3}
Did not match all atoms present	65151-75-9	CCCCCCCCCC(CCCCCCCC(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 15, 3: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	65151-77-1	CC(C)OC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl	{1: 2, 2: 2, 3: 1, 33: 1, 11: 5, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	65151-78-2	COC1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)NCCC3=CC=CC=C3.Cl	{1: 1, 2: 3, 3: 1, 14: 14, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	65151-79-3	CCCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl	{1: 1, 2: 6, 33: 1, 11: 5, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	65151-81-7	CCCCCCCCCCCCCCCCCCOS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 21, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	65151-88-4	CCCCCCCCCCCCCC/C=C/C=C/OS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 17, 6: 4, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	65151-90-8	CCCCCCCCCCCCCC/C=C/C=C/OS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 19, 6: 4, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	65151-93-1	CCCCCCCCCCCCCC/C=C/OS(=O)(=O)O.CCN(CC)CCO	{1: 3, 2: 17, 6: 2, 33: 1, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	65152-04-7	CC(C)(C)C(C(C)(C)O[N+](=O)[O-])N=O	{1: 5, 34: 1, 3: 1, 4: 2, 22: 1, 29: 1}
Did not match all atoms present	65152-07-0	CC(C)CC1=CC(=C(C=C1)O)CC(C)C	{1: 4, 2: 2, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	65152-09-2	CN1CCSC1=CC=C2C(=O)N(C(=S)S2)CC(=O)O	{1: 1, 2: 1, 6: 2, 33: 2, 41: 2, 11: 2, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	65152-14-9	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C4=CC=CC=C4C(=C3)S(=O)(=O)[O-])N)C)N=NC5=CC(=C6C=CC(=CC6=C5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 30: 2, 34: 4, 29: 9, 14: 15}
Did not match all atoms present	65152-15-0	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C4=CC=CC=C4C(=C3)S(=O)(=O)[O-])N)C)N=NC5=CC(=C6C=C(C=CC6=C5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 30: 2, 34: 4, 29: 9, 14: 15}
Did not match all atoms present	65152-17-2	CC1=CC(=C(C=C1Cl)N=NC2=CC(=C(C3=CC=CC=C32)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Sr+2]	{1: 1, 34: 2, 14: 7, 17: 1, 29: 6, 30: 1}
Did not match all atoms present	65152-19-4	C1=CC=C(C(=C1)C(F)(F)F)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)O)C=CC2=N.C(CO)NCCO	{2: 4, 4: 1, 14: 8, 15: 5, 16: 3, 20: 3, 25: 1, 36: 1, 29: 2, 31: 3}
Did not match all atoms present	65152-25-2	C1=CC=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=CC(=CC(=C5C=C4)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 14, 15: 2, 21: 1, 24: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	65168-09-4	CC1=CC2=C(C=C1)SC(=CC3=[N+](C4=CC=CC=C4C=C3)CCCS(=O)(=O)[O-])N2CCCS(=O)(=O)O	{1: 1, 2: 6, 6: 1, 33: 2, 41: 1, 14: 9, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	65168-11-8	CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=NC=C(C2=CC=CC=C21)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 6: 2, 33: 1, 14: 13, 29: 3}
Did not match all atoms present	65168-14-1	CC1=CC(=C(C=C1N)OC)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 2, 34: 2, 14: 7, 20: 2, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	65168-20-9	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-])C)NN=C5C=CC(=O)C=C5.[Na+].[Na+]	{1: 2, 34: 2, 14: 14, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	65171-20-2	C1(=C(C(=C(C(=C1F)F)N=NC2=C(C(=C(C(=C2F)F)C(F)(F)F)F)F)F)F)C(F)(F)F	{16: 14, 34: 2, 4: 2}
Did not match all atoms present	65173-82-2	CCN(CC)P1N(CCN1C)C	{1: 4, 2: 2, 11: 2, 33: 3}
Did not match all atoms present	65173-83-3	CC(C)N(C(C)C)P1N(CCN1C)C	{11: 2, 1: 6, 3: 2, 33: 3}
Did not match all atoms present	65176-75-2	COC1=C(C2=C(C(=C1)O)C(=O)C3=C(C=C4C(=C3O2)C5C=COC5O4)OC)OC	{1: 3, 12: 2, 14: 4, 21: 1, 22: 3, 23: 3, 25: 1}
Did not match all atoms present	65180-62-3	C1=CC2=C(C=CC(=C2S(=O)(=O)O)N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)NC5=NC(=NC(=N5)Cl)N(CCS(=O)(=O)CCCl)CCS(=O)(=O)CCCl)S(=O)(=O)O)S(=O)(=O)O)C(=C1)S(=O)(=O)O	{33: 1, 2: 8, 35: 3, 34: 1, 14: 8, 15: 2, 17: 3, 20: 4, 25: 1, 29: 12, 31: 2}
Did not match all atoms present	65180-72-5	C1=CC(=CC=C1N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)Cl)N(CCS(=O)(=O)CCCl)CCS(=O)(=O)CCCl)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{33: 1, 2: 8, 35: 3, 34: 1, 14: 7, 15: 2, 17: 3, 20: 3, 25: 1, 29: 10, 31: 2}
Did not match all atoms present	65181-78-4	CC1=CC(=CC=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)N(C5=CC=CC=C5)C6=CC=CC(=C6)C	{1: 2, 14: 26, 33: 2}
Did not match all atoms present	65184-10-3	CC1=CC2=C(N1)C=CC=C2OCC(CNC(C)CCN3C=NC4=C3C(=O)N(C(=O)N4C)C)O	{32: 1, 1: 4, 2: 4, 3: 2, 33: 3, 14: 5, 35: 1, 20: 1, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	65185-58-2	C1=CC=C(C(=C1)CCN)Br	{2: 2, 30: 1, 18: 1, 14: 4}
Did not match all atoms present	65185-88-8	CCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCC	{1: 2, 2: 16, 28: 2, 14: 4}
Did not match all atoms present	65185-89-9	CCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCC	{1: 2, 2: 18, 28: 2, 14: 4}
Did not match all atoms present	65186-04-1	C=CCO.C=CC1=CC=CC=C1.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{2: 1, 5: 2, 6: 2, 14: 8, 20: 1, 27: 1, 28: 2}
Did not match all atoms present	65186-09-6	CCCCCCCCCCCCCC/C=C/OS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 19, 6: 2, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	65186-16-5	COC1=CC=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)C(=NNC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)[O-])C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 14: 18, 15: 4, 22: 1, 24: 1, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	65195-04-2	CCCCCCCC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC)C#N	{1: 2, 2: 10, 28: 1, 37: 1, 14: 11}
Did not match all atoms present	652-03-9	C1(=C(C(=C(C(=C1F)F)F)F)C(=O)O)C(=O)O	{16: 4, 27: 2}
Did not match all atoms present	652-04-0	CC1=CC2=C(C3=CC=CC=C3C=C2)C4=CC=CC=C14	{1: 1, 14: 11}
Did not match all atoms present	652-18-6	C1=C(C(=C(C(=C1F)F)C(=O)O)F)F	{16: 4, 27: 1, 14: 1}
Did not match all atoms present	652-22-2	C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)C(F)(F)F	{16: 8, 24: 1, 4: 1}
Did not match all atoms present	652-29-9	CC(=O)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 1, 24: 1}
Did not match all atoms present	652-31-3	C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)N	{16: 5, 24: 1, 30: 1}
Did not match all atoms present	652-32-4	CC1=C(C(=C(C(=C1F)F)C(=O)O)F)F	{16: 4, 1: 1, 27: 1}
Did not match all atoms present	652-36-8	C1(=C(C(=C(C(=C1F)F)C(=O)O)F)F)C(=O)O	{16: 4, 27: 2}
Did not match all atoms present	652-39-1	C1=CC2=C(C(=C1)F)C(=O)OC2=O	{16: 1, 28: 2, 14: 3}
Did not match all atoms present	652-46-0	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)O	{1: 4, 3: 1, 21: 1, 14: 12, 33: 2}
Did not match all atoms present	65201-45-8	COC1=CC=C(C=C1)N2CCN(CC2)C=C3CC4=C(C3=O)C=CC=C4F	{1: 1, 6: 1, 33: 2, 11: 5, 14: 7, 15: 1, 16: 1, 22: 1, 25: 1}
Did not match all atoms present	65201-69-6	CCCCCC(=O)OC1=C(C(=C(C(=C1OC(=O)CCCCC)OC(=O)CCCCC)OC(=O)CCCCC)OC(=O)CCCCC)OC(=O)CCCCC	{1: 6, 2: 24, 28: 6}
Did not match all atoms present	65201-70-9	CCCCCCC(=O)OC1=C(C(=C(C(=C1OC(=O)CCCCCC)OC(=O)CCCCCC)OC(=O)CCCCCC)OC(=O)CCCCCC)OC(=O)CCCCCC	{1: 6, 2: 30, 28: 6}
Did not match all atoms present	65201-71-0	CCCCCCCC(=O)OC1=C(C(=C(C(=C1OC(=O)CCCCCCC)OC(=O)CCCCCCC)OC(=O)CCCCCCC)OC(=O)CCCCCCC)OC(=O)CCCCCCC	{1: 6, 2: 36, 28: 6}
Did not match all atoms present	65201-77-6	CCCC[N+](CCCC)(CCCC)CCCC.[O-]I(=O)(=O)=O	{1: 4, 2: 12, 19: 1, 29: 4}
Did not match all atoms present	65208-16-4	CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)C1=C(C2=CC=CC=C2C(=C1)[N+](=O)[O-])O	{1: 2, 2: 34, 38: 1, 33: 1, 14: 5, 21: 1, 24: 1}
Did not match all atoms present	65208-17-5	CN(C)N=NC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(CCO)CCO	{1: 2, 2: 4, 33: 2, 34: 4, 14: 8, 20: 2}
Did not match all atoms present	65208-22-2	C1CCC(CC1)N(CC2=CC=CC=C2)C3=CC=C(C=C3)N=NC4=[N+](C=CS4)CCC(=O)N.C1CCC(CC1)N(CC2=CC=CC=C2)C3=CC=C(C=C3)N=NC4=[N+](C=CS4)CCC(=O)N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{33: 4, 2: 6, 41: 2, 11: 10, 12: 2, 34: 4, 14: 22, 17: 4, 24: 2, 30: 2}
Did not match all atoms present	65208-23-3	CCN(CCN1C(=O)CCC1=O)C2=CC(=C(C=C2)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C	{1: 2, 2: 3, 38: 1, 33: 2, 11: 2, 34: 2, 14: 6, 17: 1, 25: 2}
Did not match all atoms present	65208-24-4	CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NN=C2C=CC3=C(C2=O)C=CC=C3NS(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)F	{1: 1, 34: 1, 38: 1, 14: 12, 15: 1, 16: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	65208-25-5	CCN(CCN1C(=O)C2=CC=CC=C2C1=O)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 33: 2, 34: 2, 14: 12, 25: 2}
Did not match all atoms present	65208-31-3	CCN(CCOCCOCC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)NC(=O)C	{1: 3, 2: 6, 38: 1, 33: 1, 34: 2, 14: 5, 18: 2, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	65208-32-4	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)CNC(=O)C2=C/C(=N/NC3=CC=C(C=C3)OC)/C4=CC=CC=C4C2=O	{1: 3, 2: 16, 3: 1, 34: 1, 14: 13, 15: 2, 22: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	65208-33-5	CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)C1=C(C2=CC=CC=C2C(=C1)N)O	{1: 2, 2: 34, 33: 1, 14: 5, 21: 1, 24: 1, 30: 1}
Did not match all atoms present	65208-34-6	C1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3C(=C2)[N+](=O)[O-])O	{38: 1, 28: 1, 21: 1, 14: 10}
Did not match all atoms present	65208-42-6	CC1=CC(=O)N(C(=O)N1)CC(C)C	{32: 1, 1: 3, 2: 1, 3: 1, 33: 1, 14: 1, 25: 2}
Did not match all atoms present	65208-47-1	[H+].[H+].[H+].[H+].CCCC(C(CC)C[O-])[O-].CCCC(C(CC)C[O-])[O-].CCCC(C(CC)C[O-])[O-].CCCC(C(CC)C[O-])[O-].[Ti+4]	{1: 8, 2: 16, 3: 8, 29: 8}
Did not match all atoms present	6521-29-5	CCCCCOC(=O)C1=CC=C(C=C1)O	{1: 1, 2: 4, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	6521-30-8	CC(C)CCOC(=O)C1=CC=C(C=C1)O	{1: 2, 2: 2, 3: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	65210-28-8	CC1(OC2=CC=CC=C2O1)CC[NH2+]C3CCCCC3.[Cl-]	{1: 1, 2: 2, 11: 5, 12: 1, 13: 1, 14: 4, 17: 1, 23: 2}
Did not match all atoms present	65210-29-9	CC1(OC2=CC=CC=C2O1)CC[NH2+]CCC3=CC=CC=C3.[Cl-]	{1: 1, 2: 4, 13: 1, 14: 9, 17: 1, 23: 2}
Did not match all atoms present	65210-30-2	CC1(OC2=CC=CC=C2O1)CC[NH+](C)C.[Cl-]	{1: 3, 2: 2, 13: 1, 14: 4, 17: 1, 23: 2}
Did not match all atoms present	65210-31-3	CC[NH+](CC)CCC1(OC2=CC=CC=C2O1)C.[Cl-]	{1: 3, 2: 4, 13: 1, 14: 4, 17: 1, 23: 2}
Did not match all atoms present	65210-32-4	CC1(OC2=CC=CC=C2O1)CC[NH+](C)CCC3=CC=CC=C3.[Cl-]	{1: 2, 2: 4, 13: 1, 14: 9, 17: 1, 23: 2}
Did not match all atoms present	65210-33-5	CC1(OC2=CC=CC=C2O1)CC[NH+]3CCCCC3.[Cl-]	{1: 1, 2: 2, 11: 5, 13: 1, 14: 4, 17: 1, 23: 2}
Did not match all atoms present	65210-37-9	CC1(OC2=CC=CC=C2O1)CCNCCNCCC3(OC4=CC=CC=C4O3)C.Cl.Cl	{1: 2, 2: 6, 13: 2, 14: 8, 17: 2, 23: 4, 31: 2}
Did not match all atoms present	6522-74-3	C1=CC=C(C(=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)O)S(=O)(=O)O	{34: 1, 35: 3, 14: 8, 15: 2, 17: 2, 20: 2, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	6522-86-7	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)O)S(=O)(=O)O	{34: 1, 35: 3, 14: 8, 15: 2, 17: 2, 20: 2, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	65229-21-2	[O-2].[O-2].[O-2].[O-2].[O-2].[Ru+4].[Gd+3].[Bi+3]	{}
Did not match all atoms present	65232-57-7	CCC1=C(C(=CC=C1)CC)Br	{1: 2, 2: 2, 18: 1, 14: 3}
Did not match all atoms present	65235-34-9	C.C1(=NC(=NC(=N1)N)N)N.C1(=NC(=NC(=N1)N)N)N	{35: 6, 30: 6}
Did not match all atoms present	65235-64-5	C1=C(C2=C(C(=C1Br)N)C(=O)C3=C(C2=O)C(=CC(=C3N)Br)O)O	{25: 2, 18: 2, 30: 2, 21: 2, 14: 2}
Did not match all atoms present	65237-05-0	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)O)NN=C3C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)O)S(=O)(=O)O	{34: 1, 14: 9, 15: 2, 20: 3, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	65238-84-8	C1=CC=C(C=C1)CCNC(=O)N2C=C(C(=O)NC2=O)F	{32: 1, 33: 1, 2: 2, 14: 6, 16: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	65243-01-8	C1C(C(C(S1(=O)=O)Cl)Cl)Br	{17: 2, 18: 1, 11: 1, 12: 3, 29: 2}
Did not match all atoms present	65248-67-1	CN1CCN=C1CC2=C(C=CC=C2Cl)Cl	{1: 1, 2: 1, 35: 1, 33: 1, 11: 2, 14: 3, 15: 1, 17: 2}
Did not match all atoms present	65253-04-5	C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)(C)C2=CC=CC=C2	{1: 3, 4: 1, 11: 3, 12: 3, 14: 5, 20: 1}
Did not match all atoms present	65258-53-9	CCN1C(=NN=N1)N	{1: 1, 2: 1, 35: 3, 30: 1, 33: 1}
Did not match all atoms present	6526-72-3	CC(C)C1=CC=CC=C1[N+](=O)[O-]	{1: 2, 3: 1, 38: 1, 14: 4}
Did not match all atoms present	65268-91-9	CC[NH+](CC[NH2+]CCCC1(OC2=CC=CC=C2O1)C)CC.C(=C\C(=O)[O-])\C(=O)O.C(=C\C(=O)[O-])\C(=O)O	{1: 3, 2: 7, 6: 4, 13: 1, 14: 4, 23: 2, 24: 2, 27: 2}
Did not match all atoms present	65269-96-7	CCCCCCS(=O)(=O)F	{16: 1, 1: 1, 2: 5, 29: 2}
Did not match all atoms present	65271-80-9	C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO	{2: 8, 14: 4, 20: 2, 21: 2, 25: 2, 31: 4}
Did not match all atoms present	65272-47-1	CN=C(N)N.N(=O)[O-].[Na+]	{1: 1, 34: 2, 29: 2, 30: 2, 7: 1}
Did not match all atoms present	65277-37-4	CCN(CC)C1=CC2=C(C=C1)C=C3C(=C(C(=N)N4C3=NC5=CC=CC=C5C4)C(=O)N)O2	{1: 2, 2: 2, 35: 1, 36: 1, 33: 2, 11: 1, 14: 8, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	65277-38-5	CN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(/C(=N/NC5=C(C=C(C=C5)OC)S(=O)(=O)O)/C4=O)S(=O)(=O)O)Cl	{1: 2, 34: 1, 35: 3, 33: 1, 14: 11, 15: 2, 17: 1, 20: 3, 22: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	65277-42-1	CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl	{1: 1, 2: 2, 35: 1, 33: 3, 11: 5, 12: 1, 13: 1, 14: 10, 17: 2, 22: 1, 23: 2, 24: 1}
Did not match all atoms present	65277-52-3	C=CCCCCCCCCC(=O)NCCOC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 11, 3: 1, 5: 1, 6: 1, 24: 2, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	65277-54-5	CCCCCCC(CC=CCCCCCCCC(=O)NCCOC(=O)C(CC(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{1: 1, 2: 16, 3: 2, 6: 2, 20: 1, 24: 2, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	6528-53-6	C1=CC2=C3C(=C(C=C2S(=O)(=O)O)S(=O)(=O)O)C=CC4=C(C=C(C1=C43)S(=O)(=O)O)S(=O)(=O)O	{20: 4, 29: 8, 14: 6}
Did not match all atoms present	65283-60-5	C1=CC2=C(C=CC(=C2C3=C(C=CC4=C3C=CC(=C4)Br)O)O)C=C1Br	{18: 2, 21: 2, 14: 10}
Did not match all atoms present	6529-53-9	C1=CC(=CC=C1CCBr)Cl	{17: 1, 2: 2, 18: 1, 14: 4}
Did not match all atoms present	65292-51-5	CC(C)(C1=CC(=C(C=C1)[O-])[S+]2CCCC2)C3=CC(=C(C=C3)[O-])[S+]4CCCC4	{1: 2, 11: 8, 4: 1, 14: 6}
Did not match all atoms present	65293-86-9	CC/C(=C\C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CC)/OCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 3, 33: 1, 6: 1, 7: 1, 14: 12, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	65293-88-1	C1CSC(=CC=C(C#N)S(=O)(=O)CCCCCCCCCCC(=O)[O-])N1CCCS(=O)(=O)[O-].[Na+].[Na+]	{33: 1, 2: 13, 37: 1, 6: 2, 7: 1, 41: 1, 11: 2, 15: 1, 24: 1, 29: 5}
Did not match all atoms present	65294-03-3	CCN\1C2=CC(=C(C=C2N(/C1=C\C=C3C(=O)N(C(=S)N(C3=O)CC)CC)CCCCS(=O)(=O)[O-])Cl)Cl.[Na+]	{1: 3, 2: 7, 6: 2, 33: 4, 14: 2, 15: 3, 17: 2, 25: 2, 29: 3}
Did not match all atoms present	65294-06-6	CN(C)CCCNC1=C2C(=C(C=C1)NCCCN(C)C)C(=O)C3=C(C=CC(=C3C2=O)NCCCN(C)C)NCCCN(C)C	{1: 8, 2: 12, 33: 4, 14: 4, 25: 2, 31: 4}
Did not match all atoms present	65294-07-7	CCN1C2=CC=CC=C2C(C1=CC=CC3=[N+](C4=CC=CC=C4C3(C)C)CC)(C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 7, 2: 2, 6: 3, 33: 2, 13: 2, 14: 12, 15: 2, 29: 3}
Did not match all atoms present	65294-08-8	CCCC[N+]1=CC=C(C2=CC=CC=C21)C=CC=C3N(C4=CC=CC=C4[Se]3)CC.[I-]	{1: 2, 2: 4, 6: 3, 33: 2, 14: 10, 15: 1, 19: 1}
Did not match all atoms present	65294-10-2	CCCCOC(=O)/C=C\C(=O)[O-].CC(=O)OC=C.[Na+]	{1: 2, 2: 3, 5: 1, 6: 3, 24: 1, 28: 2}
Did not match all atoms present	65294-15-7	CCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCC.CN(C)C1CCCCC1	{1: 4, 2: 24, 33: 1, 11: 5, 12: 1, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	65294-17-9	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-]	{1: 6, 34: 2, 33: 3, 7: 1, 14: 25, 15: 2, 29: 3, 31: 1}
Did not match all atoms present	65294-20-4	CC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)C)C)(C(F)(F)F)C(F)(F)F)C	{16: 6, 1: 4, 4: 3, 14: 6}
Did not match all atoms present	65295-69-4	C1=CC(=C(C(=C1)F)N=C=O)F	{8: 1, 16: 2, 34: 1, 29: 1, 14: 3}
Did not match all atoms present	653-03-2	CCCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)C	{1: 2, 2: 5, 33: 3, 41: 1, 11: 4, 14: 7, 24: 1}
Did not match all atoms present	653-11-2	C1=C(C(=C(C(=C1F)F)NN)F)F	{16: 4, 30: 1, 14: 1, 31: 1}
Did not match all atoms present	653-20-3	C(C1=C(C(=C(C(=C1F)F)F)F)F)C(=O)N	{16: 5, 24: 1, 2: 1, 30: 1}
Did not match all atoms present	653-21-4	C(C1=C(C(=C(C(=C1F)F)F)F)F)C(=O)O	{16: 5, 2: 1, 27: 1}
Did not match all atoms present	653-30-5	C(C#N)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 2: 1, 37: 1}
Did not match all atoms present	653-31-6	C(CO)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 2: 2, 20: 1}
Did not match all atoms present	653-34-9	C=CC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 5: 1, 6: 1}
Did not match all atoms present	653-35-0	C(C1=C(C(=C(C(=C1F)F)F)F)F)Cl	{16: 5, 17: 1, 2: 1}
Did not match all atoms present	653-37-2	C(=O)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 26: 1}
Did not match all atoms present	653-49-6	C1=C(C=C(C(=C1[N+](=O)[O-])NN)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 30: 1, 14: 2, 31: 1}
Did not match all atoms present	6530-11-6	C1CN2CCC1C(C2)NCC3=CC=CC=C3	{33: 1, 2: 1, 11: 5, 12: 2, 14: 5, 31: 1}
Did not match all atoms present	65300-30-3	CC(=O)C=CC1=CC(=CC=C1)Br	{24: 1, 1: 1, 18: 1, 14: 4, 6: 2}
Did not match all atoms present	65303-82-4	C1=CC(=C(C=C1N=C=O)[N+](=O)[O-])F	{34: 1, 38: 1, 8: 1, 14: 3, 16: 1, 29: 1}
Did not match all atoms present	65304-59-8	CC1=C(C2=C(C(=C1CCC3=CC=C(CC2)C=C3)C)C)C	{1: 4, 11: 4, 14: 4}
Did not match all atoms present	65307-72-4	CCCCCCCCCCN(C1=CC=CC2=C1N=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C	{1: 2, 2: 9, 35: 1, 33: 1, 14: 10, 29: 2}
Did not match all atoms present	65308-00-1	CCCC[Sn](CCCC)(SCC(=O)OCCCCCC(C)C)SCC(=O)OCCOC(=O)CS[Sn](CCCC)(CCCC)SCC(=O)OCCCCCC(C)C	{40: 4, 1: 8, 2: 28, 3: 2, 28: 4}
Did not match all atoms present	6531-35-7	CC1=C(C=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)C	{1: 2, 14: 6, 25: 2}
Did not match all atoms present	6531-45-9	[Li+].CCC(=O)[O-]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	65313-33-9	C(Cl)[Bi]	{17: 1, 2: 1}
Did not match all atoms present	65313-37-3	C[Ga]C.C[Ga]C	{1: 4}
Did not match all atoms present	65316-39-4	C1=COC(=C1)C(=O)NC2=NC=NC3=C2NC=N3	{32: 1, 35: 3, 14: 5, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	65317-00-2	COC1=CC2=C(C=C1CCC3=CC=C(CC2)C=C3)OC	{1: 2, 11: 4, 22: 2, 14: 6}
Did not match all atoms present	65322-65-8	C1=CC=C2C(=C1)C=CC=C2C[N+]3=CC=CC4=CC=CC=C43.[Cl-]	{17: 1, 2: 1, 14: 14, 33: 1}
Did not match all atoms present	65322-76-1	CN(C)CC(=O)C1=CC2=C(C=C1)OC3=C2C=C(C=C3)C(=O)CN(C)C.Cl.Cl	{1: 4, 2: 2, 33: 2, 14: 6, 17: 2, 23: 1, 24: 2}
Did not match all atoms present	6533-68-2	CN1[C@@H]2CC(C[C@H]1C3C2O3)OC(=O)[C@H](CO)C4=CC=CC=C4.O.O.O.Br	{1: 1, 2: 1, 3: 1, 33: 1, 11: 2, 12: 5, 14: 5, 18: 1, 20: 1, 23: 1, 28: 1}
Did not match all atoms present	6533-73-9	C(=O)([O-])[O-].[Tl+].[Tl+]	{24: 1}
Did not match all atoms present	65330-59-8	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])[O-].[Na+].[Na+].[Cu+2]	{24: 3, 2: 2, 4: 1, 29: 1}
Did not match all atoms present	65338-09-2	C1=CC(=CC=C1C(=O)O)N/N=C/C(=N/NC2=CC=C(C=C2)C(=O)O)/C(C(C(CO)O)O)O	{2: 1, 3: 3, 6: 1, 7: 1, 34: 2, 14: 8, 20: 4, 27: 2, 31: 2}
Did not match all atoms present	65339-11-9	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC=CC(=C2)C(=O)NC3=NN(C(=O)C3)C4=C(C=C(C=C4Cl)Cl)Cl	{1: 2, 2: 15, 3: 1, 33: 1, 11: 1, 14: 10, 15: 1, 17: 3, 35: 1, 22: 1, 24: 2, 25: 1, 31: 2}
Did not match all atoms present	6535-47-3	CC1=CC(=C(C=C1)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4C)[N+](=O)[O-]	{1: 2, 34: 1, 38: 1, 14: 12, 15: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	6535-48-4	CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)Cl)C)/C2=O	{1: 2, 34: 1, 14: 11, 15: 2, 17: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	65350-78-9	CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCNC(=O)CCCCCCCCCCCCCCCCC)CC(=O)[O-]	{1: 2, 2: 35, 35: 1, 11: 2, 15: 1, 24: 2, 31: 1}
Did not match all atoms present	65351-55-5	C[Si]([O-])([O-])[O-].[K+].[K+].[K+]	{1: 1, 29: 3}
Did not match all atoms present	65353-51-7	C(=C(\O)/C(F)(F)F)\C(=O)C(F)(F)F.C(=C(\O)/C(F)(F)F)\C(=O)C(F)(F)F.[Pt]	{4: 4, 6: 2, 7: 2, 16: 12, 20: 2, 24: 2}
Did not match all atoms present	65355-52-4	CCN(CC)C1=CC2=C(C=C1)C=C3C(=C(C(=N)N4C3=NC5=CC=CC=C5C4)C#N)O2	{1: 2, 2: 2, 35: 1, 36: 1, 37: 1, 33: 2, 11: 1, 14: 8, 23: 1}
Did not match all atoms present	65355-56-8	C1=CC(=CC=C1OCCCC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{24: 1, 2: 3, 22: 1, 14: 4, 29: 3}
Did not match all atoms present	65357-62-2	[Cu].[Cu].[Cu].[Cu]	{}
Did not match all atoms present	65365-88-0	C(CCC(O)(P(=O)(O)O)P(=O)(O)O)CC(O)(P(=O)(O)O)P(=O)(O)O	{20: 10, 2: 4, 4: 2, 29: 4}
Did not match all atoms present	65369-95-1	C1=CC(=CC(=C1)S(=O)(=O)CCO)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{2: 2, 38: 1, 14: 8, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	65370-06-1	CCSCC1=CC=CC=C1O	{40: 1, 1: 1, 2: 2, 21: 1, 14: 4}
Did not match all atoms present	65379-23-9	C1=CC=C(C=C1)OCCOP(=O)([O-])[O-].[K+].[K+]	{2: 2, 22: 2, 14: 5, 29: 3}
Did not match all atoms present	65382-88-9	CCCCOC(=O)C1=CC=CC=C1C	{1: 2, 2: 3, 28: 1, 14: 4}
Did not match all atoms present	65383-61-1	CC1(CC(=O)C2=CC(=C(C=C2O1)OC)OC)C	{1: 4, 11: 1, 13: 1, 14: 2, 22: 2, 23: 1, 25: 1}
Did not match all atoms present	65383-73-5	CCOC1=C(C=C2C=CC(OC2=C1)(C)C)OC	{1: 4, 2: 1, 13: 1, 14: 4, 22: 2, 23: 1}
Did not match all atoms present	6539-57-7	CC(C(C1=CC(=C(C=C1)O)O)O)N	{1: 1, 3: 2, 14: 3, 20: 1, 21: 2, 30: 1}
Did not match all atoms present	654-01-3	C1=CC(=C(C(=C1)F)CC#N)F	{16: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	654-18-2	C1=NC2=C(N1)C(=NC=N2)SCC(F)(F)F	{32: 1, 2: 1, 35: 3, 4: 1, 40: 1, 14: 2, 16: 3}
Did not match all atoms present	654-42-2	CC1=CC(=CC(=C1O)C)O	{1: 2, 21: 2, 14: 2}
Did not match all atoms present	654-53-5	C1=C(C(=C(C(=C1F)F)F)F)C(F)(F)F	{16: 7, 4: 1, 14: 1}
Did not match all atoms present	654-70-6	C1=CC(=C(C=C1N)C(F)(F)F)C#N	{16: 3, 4: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	654-76-2	COC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F	{1: 1, 4: 1, 38: 1, 14: 3, 16: 3, 22: 1}
Did not match all atoms present	65400-79-5	CN1CCSC1=NC(=O)C2=CN=CC=C2	{1: 1, 34: 1, 35: 1, 33: 1, 41: 1, 11: 2, 14: 4, 15: 1, 24: 1}
Did not match all atoms present	65405-46-1	C=CC1=C(C(=CC=C1)S(=O)(=O)O)C=C	{14: 3, 20: 1, 5: 2, 6: 2, 29: 2}
Did not match all atoms present	65405-60-9	C[N+](C)(CC1=CC=CC=C1C=C)[O-].C=CC1=CC=CC=C1C=C	{1: 2, 2: 1, 5: 3, 6: 3, 14: 8, 29: 1}
Did not match all atoms present	65405-76-7	CCC=CCCOC(=O)C1=CC=CC=C1N	{1: 1, 2: 3, 6: 2, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	65405-77-8	CCC=CCCOC(=O)C1=CC=CC=C1O	{1: 1, 2: 3, 6: 2, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	65411-94-1	C[Si](C)(C)C(=C([Si](C)(C)C)Cl)Cl	{1: 6, 17: 2, 7: 2}
Did not match all atoms present	65411-95-2	C[Si](C)(C)/C(=C(/[Si](C)(C)C)\Br)/Br	{1: 6, 18: 2, 7: 2}
Did not match all atoms present	65416-15-1	CC=C(C)CCOC(=O)C1=CC=CC=C1O	{1: 2, 2: 2, 6: 1, 7: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	65416-17-3	CCC(=O)N1C2CCC1CN(C2)CCCC3=CC=CC=C3	{1: 1, 2: 4, 33: 2, 11: 4, 12: 2, 14: 5, 24: 1}
Did not match all atoms present	65416-19-5	C1=CC=C(C=C1)CC(OCC2=CC=CC=C2)OCC3=CC=CC=C3	{2: 3, 3: 1, 22: 2, 14: 15}
Did not match all atoms present	65416-22-0	C1=CC=C(C=C1)CC(=O)OC(C2=CC=CC=C2)C(Cl)(Cl)Cl	{2: 1, 3: 1, 4: 1, 14: 10, 17: 3, 28: 1}
Did not match all atoms present	65416-29-7	CC(CCC=C(C)C)CC(O)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 3, 3: 2, 6: 1, 7: 1, 20: 1, 29: 3}
Did not match all atoms present	65416-31-1	B(OCC(C)CC1=CC=C(C=C1)C(C)C)(OCC(C)CC2=CC=C(C=C2)C(C)C)OCC(C)CC3=CC=C(C=C3)C(C)C	{1: 9, 2: 6, 3: 6, 22: 3, 14: 12}
Did not match all atoms present	65416-32-2	B(OCC(=CC1=CC=C(C=C1)C(C)(C)C)C)(OCC(=CC2=CC=C(C=C2)C(C)(C)C)C)OCC(=CC3=CC=C(C=C3)C(C)(C)C)C	{1: 12, 2: 3, 4: 3, 6: 3, 7: 3, 14: 12, 22: 3}
Did not match all atoms present	65416-33-3	B(OCC=C(C)CCC=C(C)C)(OCC=C(C)CCC=C(C)C)OCC=C(C)CCC=C(C)C	{1: 9, 2: 9, 22: 3, 6: 6, 7: 6}
Did not match all atoms present	6544-02-1	C(=N[Si](N=C=S)(N=C=S)N=C=S)=S	{8: 4, 34: 4}
Did not match all atoms present	65442-31-1	CCC(C)C1=CC2=C(C=C1)N=CC=C2	{1: 2, 2: 1, 3: 1, 14: 6, 35: 1}
Did not match all atoms present	65451-61-8	CC(C)CCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])CCCCCCC(C)C.[Na+].[Na+]	{1: 4, 2: 12, 3: 2, 29: 6, 14: 4}
Did not match all atoms present	65454-61-7	C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[99Tc+4]	{24: 5, 33: 3, 2: 9}
Did not match all atoms present	65460-51-7	CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CCCCCCCCCCCCCOP([O-])OCCCCCCCCCCCCC.CCCCCCCCCCCCC[OH+]P([O-])[OH+]CCCCCCCCCCCCC.[Ti+4]	{1: 12, 2: 48, 3: 4, 29: 6, 22: 2}
Did not match all atoms present	65466-10-6	CCC=CCOC(=O)C1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	6547-08-6	C[Se]C1=CC=CC=C1C(=O)O	{1: 1, 27: 1, 14: 4}
Did not match all atoms present	6547-53-1	C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(=O)O	{2: 2, 27: 1, 22: 1, 14: 9}
Did not match all atoms present	6548-09-0	C1=CC2=C(C=C1Br)C(=CN2)CC(C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 4, 18: 1, 27: 1, 30: 1}
Did not match all atoms present	6548-24-9	CC1=CC(=CC(=C1N2C(=O)C(C(=N2)C)N=NC3=CC=C(C=C3)C(C4=CC=CC=C4)C5=CC=C(C=C5)N=NC6C(=NN(C6=O)C7=C(C=C(C=C7C)S(=O)(=O)[O-])Cl)C)Cl)S(=O)(=O)[O-].[Na+].[Na+]	{1: 4, 34: 4, 3: 1, 33: 2, 12: 2, 14: 17, 15: 2, 17: 2, 35: 2, 25: 2, 29: 6}
Did not match all atoms present	6548-29-4	C1=CC(=C(C=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])Cl)Cl)N=NC5=C6C=CC(=CC6=CC(=C5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{17: 2, 30: 2, 34: 4, 29: 12, 14: 14}
Did not match all atoms present	6548-31-8	COC1=CC(=C(C=C1N/N=C/2\C=CC(=O)C(=C2)C(=O)[O-])OC)N/N=C/3\C(=CC4=C(C3=O)C=CC(=C4)NC5=CC6=C(C=C5)C(=O)/C(=N\NC7=C(C=C(C(=C7)OC)N/N=C\8/C=CC(=O)C(=C8)C(=O)[O-])OC)/C(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 4, 14: 18, 15: 8, 22: 4, 24: 2, 25: 4, 29: 6, 31: 5}
Did not match all atoms present	65497-24-7	CN1C2=C(N=C1OCCCN(C)C)N(C(=O)N(C2=O)C)C.Cl	{1: 5, 2: 3, 35: 1, 33: 4, 17: 1, 22: 1, 25: 2}
Did not match all atoms present	655-05-0	CN(C)C1=NC(=O)C(O1)C2=CC=CC=C2	{1: 2, 35: 1, 33: 1, 12: 1, 14: 5, 15: 1, 23: 1, 25: 1}
Did not match all atoms present	655-20-9	CSC1=CC=CC=C1F	{16: 1, 1: 1, 14: 4, 40: 1}
Did not match all atoms present	655-32-3	C1=CC(=CC=C1C(=O)C(F)(F)F)F	{16: 4, 24: 1, 4: 1, 14: 4}
Did not match all atoms present	655-35-6	CC[NH+](CC)CCC1=C(C2=C(C=C(C=C2)OCC(=O)OCC)OC1=O)C.[Cl-]	{1: 4, 2: 6, 14: 3, 17: 1, 22: 1, 28: 2}
Did not match all atoms present	655-48-1	C1=CC=C(C=C1)C(C(C2=CC=CC=C2)O)O	{3: 2, 20: 2, 14: 10}
Did not match all atoms present	655-86-7	C1=CC=C2C(=C1)N=C3C=C(C(=CC3=N2)N)N	{35: 2, 30: 2, 14: 6}
Did not match all atoms present	65504-94-1	CCOCC1=NC=CN=C1	{1: 1, 2: 2, 35: 2, 22: 1, 14: 3}
Did not match all atoms present	65504-99-6	C=CCCCCCCCCCCCCCC=CC(=O)NCCOC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 16, 3: 1, 5: 1, 6: 3, 24: 2, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	65505-13-7	C[N+](C)(C)CNC(=O)C=C.COS(=O)(=O)[O-]	{1: 4, 2: 1, 5: 1, 6: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	65505-17-1	CC1=C(C=CO1)SSC	{40: 2, 1: 2, 14: 2, 23: 1}
Did not match all atoms present	65505-24-0	CC(C)COC(=O)C1=CC=CC=C1NC	{1: 3, 2: 1, 3: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	65516-74-7	CSC1=CC(=C(C(=C1SC)SC)SC)SC	{40: 5, 1: 5, 14: 1}
Did not match all atoms present	65516-85-0	CSC1=CC(=CC(=C1SC)SC)C(F)(F)F	{16: 3, 1: 3, 4: 1, 14: 2, 40: 3}
Did not match all atoms present	6552-57-4	[2H]C1(C(O1)([2H])[2H])[2H]	{11: 2, 23: 1}
Did not match all atoms present	65520-08-3	C1=CC(=CN=C1)Br.Cl	{17: 1, 18: 1, 35: 1, 14: 4}
Did not match all atoms present	65520-53-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)OCCCS(=O)(=O)[O-])O.[Na+]	{2: 3, 14: 6, 21: 1, 22: 1, 25: 2, 29: 3}
Did not match all atoms present	6553-96-4	CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)Cl)C(C)C	{1: 6, 3: 3, 29: 2, 14: 2, 17: 1}
Did not match all atoms present	65530-77-0	C(COS(=O)(=O)O)C(F)(F)F	{2: 2, 4: 1, 16: 3, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	65536-40-5	COC1=CC=C(C=C1)NC(=O)NCCCl	{1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	65537-00-0	C1=CC=C2C(=C1)N(C(=S)S2)CNC3=CC(=CC=C3)[N+](=O)[O-]	{33: 1, 2: 1, 38: 1, 41: 1, 14: 8, 31: 1}
Did not match all atoms present	6554-98-9	C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)O	{14: 9, 6: 2, 21: 1}
Did not match all atoms present	6555-29-9	CC(CC(=O)OC)C1=CC=C(C=C1)OC	{1: 3, 2: 1, 3: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	6556-11-2	C1=CC(=CN=C1)C(=O)OC2C(C(C(C(C2OC(=O)C3=CN=CC=C3)OC(=O)C4=CN=CC=C4)OC(=O)C5=CN=CC=C5)OC(=O)C6=CN=CC=C6)OC(=O)C7=CN=CC=C7	{28: 6, 35: 6, 12: 6, 14: 24}
Did not match all atoms present	65567-32-0	CC[C@]1(C(=O)NC(=O)N1)C2=CC=CC=C2	{32: 2, 1: 1, 2: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	65572-70-5	C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(COCCO)O	{2: 4, 14: 10, 20: 2, 22: 1, 27: 2, 28: 4}
Did not match all atoms present	65573-02-6	CC1=C(N=CN1)CSCCNC(=NCCCC2=CN=CN2)N.Cl.Cl.Cl	{32: 2, 1: 1, 2: 6, 35: 2, 7: 1, 40: 1, 34: 1, 14: 3, 17: 3, 30: 1, 31: 1}
Did not match all atoms present	65573-09-3	CC(C)C1=CC=C(C=C1)OP(=S)(OC2=CC=C(C=C2)C(C)C)S	{1: 4, 3: 2, 22: 2, 14: 8, 39: 1}
Did not match all atoms present	65573-10-6	CC(C)C1=CC=C(C=C1)OP(=S)(OC2=CC=C(C=C2)C(C)C)[S-].[Na+]	{1: 4, 3: 2, 22: 2, 14: 8}
Did not match all atoms present	65573-11-7	CCC(C)OC(=S)NC	{1: 3, 2: 1, 3: 1, 7: 1, 22: 1, 31: 1}
Did not match all atoms present	65589-70-0	C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N.C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.[Cl-]	{1: 1, 35: 1, 33: 1, 14: 14, 17: 1, 30: 4}
Did not match all atoms present	65591-11-9	C12=NNN=C1N=C(N=C2N)N.OS(=O)(=O)O	{32: 1, 35: 4, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	65594-36-7	CC1=C(C(=C(C(=C1C)C)N=O)C)C	{1: 5, 34: 1, 29: 1}
Did not match all atoms present	65598-00-7	CCCCCCCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C	{1: 6, 2: 17, 4: 1, 22: 1}
Did not match all atoms present	656-31-5	C1=CC=C(C(=C1)NC(=O)N)F	{16: 1, 24: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	656-32-6	C1=CC=C(C(=C1)NC(=S)N)F	{16: 1, 31: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	656-35-9	C1=CC(=C(C=C1F)F)CC#N	{16: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	656-53-1	CC1=C(SC=N1)CCOC(=O)C	{1: 2, 2: 2, 35: 1, 41: 1, 14: 1, 28: 1}
Did not match all atoms present	656-65-5	C1=CC(=C(C=C1N)F)Br	{16: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	6560-83-4	C1=CC=C2C(=C1)C=CC(=N2)I	{35: 1, 19: 1, 14: 6}
Did not match all atoms present	65605-75-6	CC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O.C(CO)O.C(C(CO)O)O	{1: 1, 2: 5, 3: 2, 14: 6, 20: 7, 28: 4}
Did not match all atoms present	65605-79-0	CC(CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(C(CO)O)O	{1: 1, 2: 3, 3: 2, 14: 6, 20: 5, 27: 2, 28: 2}
Did not match all atoms present	65605-80-3	CC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(C(CO)(CO)CO)O	{1: 1, 2: 5, 3: 1, 4: 1, 14: 10, 20: 6, 27: 2, 28: 4}
Did not match all atoms present	65605-81-4	CCC(CO)(CO)CO.CC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=O)OC1=O	{1: 2, 2: 5, 3: 1, 4: 1, 14: 10, 20: 5, 27: 2, 28: 4}
Did not match all atoms present	65606-61-3	CC(CC(=C1C=CC=C1)[O-])CC(C)(C)C.[CH-]1C=CC=C1.[Fe+2]	{1: 4, 2: 2, 3: 1, 4: 1, 7: 1, 14: 9, 15: 1}
Did not match all atoms present	6561-60-0	CCCC(=O)NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 38: 2, 14: 3, 24: 1, 31: 2}
Did not match all atoms present	6561-63-3	CCC(=O)N(C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])N	{1: 1, 2: 1, 38: 2, 33: 1, 14: 3, 24: 1, 30: 1}
Did not match all atoms present	65616-74-2	CC(=C)C(=O)O.C=CC1=CC=CC=C1.C=CC(=O)OCCO	{1: 1, 2: 2, 5: 3, 6: 2, 7: 1, 14: 5, 20: 1, 27: 1, 28: 1}
Did not match all atoms present	6562-41-0	B(N(C)C)(N(C)C)Cl	{1: 4, 33: 2, 17: 1}
Did not match all atoms present	6565-55-5	CCC(C)C1=CC(=CC(=C1)C(C)CC)C(C)CC	{1: 6, 2: 3, 3: 3, 14: 3}
Did not match all atoms present	65654-08-2	COC1=CC=C(C=C1)C(=O)NCC(=O)NO	{1: 1, 2: 1, 14: 4, 20: 1, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	65654-13-9	C1=CSC(=C1)C(=O)NCC(=O)NO	{2: 1, 41: 1, 14: 3, 20: 1, 24: 2, 31: 2}
Did not match all atoms present	6566-19-4	CC1CCCC2=C1C=CC3=C2C=CC(=C3)C(C)C	{11: 3, 1: 3, 3: 1, 12: 1, 14: 5}
Did not match all atoms present	65665-49-8	CS(=O)(=O)NCCC1=CC=C(C=C1)NN.CS(=O)(=O)NCCC1=CC=C(C=C1)NN.OS(=O)(=O)O	{1: 2, 2: 4, 14: 8, 20: 2, 29: 6, 30: 2, 31: 4}
Did not match all atoms present	65680-12-8	CN(SCl)S(=O)(=O)C1=CC=CC=C1	{1: 1, 33: 1, 40: 1, 14: 5, 17: 1, 29: 2}
Did not match all atoms present	65682-26-0	C1=CC(=O)OC1=O.C(CO)O.C12=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)OC2=O	{28: 4, 2: 2, 20: 2, 18: 4, 14: 2}
Did not match all atoms present	65686-85-3	C1=CC(=CC=C1C(=NO)C(F)(F)F)Cl	{34: 1, 4: 1, 7: 1, 14: 4, 16: 3, 17: 1, 20: 1}
Did not match all atoms present	6569-51-3	[B]1N[B]N[B]N1	{32: 3}
Did not match all atoms present	6569-69-3	C1C[Hg]CCO1	{11: 4, 23: 1}
Did not match all atoms present	6569-82-0	C1CP1	{11: 2}
Did not match all atoms present	65694-10-2	CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 20, 14: 5, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	657-78-3	C1=CC(=CC(=C1)NC=O)C(F)(F)F	{16: 3, 26: 1, 4: 1, 14: 4, 31: 1}
Did not match all atoms present	657-84-1	CC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{1: 1, 29: 3, 14: 4}
Did not match all atoms present	65702-23-0	C(CS(=O)(=O)Cl)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 11, 17: 1, 2: 2, 4: 5, 29: 2}
Did not match all atoms present	65702-24-1	C(CS(=O)(=O)Cl)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 19, 17: 1, 2: 2, 4: 9, 29: 2}
Did not match all atoms present	65717-13-7	C1(=C(NC(=O)NC1=O)C(=O)[O-])[N+](=O)[O-].[K+]	{24: 1, 25: 2, 38: 1, 32: 2}
Did not match all atoms present	65717-98-8	CC1=CC(=C(C(=C1)C)C(C(=O)N)N(CC(=O)O)CC(=O)O)C	{1: 3, 2: 2, 3: 1, 33: 1, 14: 2, 24: 1, 27: 2, 30: 1}
Did not match all atoms present	65719-10-0	CCCCNC1=NC(=O)N=C(N1)NCCCC	{32: 1, 1: 2, 2: 6, 35: 2, 25: 1, 31: 2}
Did not match all atoms present	65719-14-4	CC[N+]1=C(CCC1)C=CC2=CC=C(C=C2)N(C)C.[I-]	{1: 3, 2: 1, 6: 2, 33: 2, 11: 3, 14: 4, 15: 1, 19: 1}
Did not match all atoms present	65733-72-4	CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC(=CC=C1O)SC2=CC=C(C=C2)O	{1: 3, 4: 1, 5: 1, 40: 1, 14: 12, 21: 3}
Did not match all atoms present	65733-75-7	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC=C(C(=C1)C(=O)O)O	{1: 5, 2: 1, 4: 2, 5: 1, 14: 8, 21: 2, 27: 1}
Did not match all atoms present	65733-76-8	CCC(C)(C)C1=CC=C(C=C1)O.CC(C)(C)C1=CC=C(C=C1)O.C=O	{1: 6, 2: 1, 4: 2, 5: 1, 14: 8, 21: 2}
Did not match all atoms present	65733-78-0	CC1=CCC(CC1)C(=C)C.C1=CC=C(C=C1)O	{1: 2, 5: 1, 7: 1, 11: 3, 12: 1, 14: 6, 15: 1, 21: 1}
Did not match all atoms present	65733-80-4	CCCCCCCCCCCCC1=CC=C(C=C1)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.C1C(O1)CCl	{1: 3, 2: 12, 4: 1, 5: 1, 11: 1, 12: 1, 14: 12, 17: 1, 21: 3, 23: 1}
Did not match all atoms present	65734-38-5	CC(=O)NNC1=CC=C(C=C1)CO	{1: 1, 2: 1, 14: 4, 20: 1, 24: 1, 31: 2}
Did not match all atoms present	65738-45-6	CC1=CC(=C2C1=CC3=CC=C4N3C(=C2)C=C4)C	{1: 2, 14: 7, 33: 1}
Did not match all atoms present	6574-15-8	C1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]	{33: 1, 11: 5, 38: 1, 14: 4}
Did not match all atoms present	6574-95-4	C1=CC=C(C(=C1)C#N)OCC(=O)O	{2: 1, 27: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	6574-97-6	C1=CC(=C(C(=C1)Cl)Cl)C#N	{17: 2, 37: 1, 14: 3}
Did not match all atoms present	6574-98-7	C1=CC(=C(C=C1Cl)Cl)C#N	{17: 2, 37: 1, 14: 3}
Did not match all atoms present	6574-99-8	C1=CC(=C(C=C1C#N)Cl)Cl	{17: 2, 37: 1, 14: 3}
Did not match all atoms present	65749-30-6	[Li+].C(C(=O)[O-])I	{24: 1, 2: 1, 19: 1}
Did not match all atoms present	65749-37-3	CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)NC3=NN(C(=O)C3=NC4=C(C=C(C=C4)N(CC)CCO)C)C5=C(C=C(C=C5Cl)Cl)Cl)C(C)(C)CC	{1: 8, 2: 6, 35: 1, 4: 2, 33: 2, 34: 1, 14: 12, 15: 2, 17: 3, 20: 1, 22: 1, 24: 2, 25: 1, 31: 2}
Did not match all atoms present	65749-39-5	CCOC(=O)CC(=NC(C1=CC=CC=C1)C(=O)[O-])C.[K+]	{1: 2, 2: 2, 3: 1, 7: 1, 34: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	6575-00-4	C1=C(C=C(C=C1Cl)Cl)C#N	{17: 2, 37: 1, 14: 3}
Did not match all atoms present	6575-05-9	C1=C(C=C(C(=C1Cl)C#N)Cl)Cl	{17: 3, 37: 1, 14: 2}
Did not match all atoms present	6575-09-3	CC1=C(C(=CC=C1)Cl)C#N	{1: 1, 37: 1, 14: 3, 17: 1}
Did not match all atoms present	6575-10-6	COC1=C(C(=CC=C1)Cl)C#N	{1: 1, 37: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	6575-11-7	C1=CC(=C(C(=C1)Cl)C#N)N	{17: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	6575-13-9	CC1=C(C(=CC=C1)C)C#N	{1: 2, 37: 1, 14: 3}
Did not match all atoms present	6575-24-2	C1=CC(=C(C(=C1)Cl)CC(=O)O)Cl	{17: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	65756-41-4	CC[N+]1(CCOCC1)C.[Br-]	{1: 2, 2: 1, 11: 4, 18: 1, 23: 1}
Did not match all atoms present	65756-42-5	C(#P)F	{16: 1, 10: 1}
Did not match all atoms present	65761-23-1	CC(=O)S/C=C(/NC1=NC2=CC=CC=C2S1)\O.[Ag]	{1: 1, 35: 1, 6: 1, 7: 1, 40: 1, 41: 1, 14: 4, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	65761-26-4	CCCCCCCCCC1=C(C(=CC=C1)O)CCCCCCCCC.CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O	{1: 7, 2: 17, 4: 2, 5: 1, 14: 7, 21: 2}
Did not match all atoms present	65761-29-7	CC1=CC=CC=C1O.C=O.C1=CC=C(C=C1)N.C1=CC=C(C=C1)O	{1: 1, 30: 1, 5: 1, 14: 14, 21: 2}
Did not match all atoms present	65763-32-8	CC1=C2C=C[C@H]([C@@H](C2=C(C3=C1C4=CC=CC=C4C=C3)C)O)O	{1: 2, 12: 2, 14: 8, 20: 2}
Did not match all atoms present	6577-41-9	C[N+]1(CCCCC1)CC2COC(O2)(C3CCCCC3)C4=CC=CC=C4	{1: 1, 2: 1, 11: 11, 12: 2, 13: 1, 14: 5, 23: 2}
Did not match all atoms present	65776-61-6	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)OC)CCCS(=O)(=O)[O-])OCC	{1: 3, 2: 5, 33: 1, 6: 1, 7: 1, 41: 1, 14: 3, 22: 2, 29: 3}
Did not match all atoms present	65776-62-7	CCCCCCCCCCCCS(=O)(=O)CC(=O)N	{24: 1, 1: 1, 2: 12, 29: 2, 30: 1}
Did not match all atoms present	65776-63-8	CCNC1=NC2=CC=CC=C2N=C1NCC	{1: 2, 2: 2, 35: 2, 14: 4, 31: 2}
Did not match all atoms present	65776-64-9	CC1=[N+](C2=C(S1)C=CC(=C2)OC)CCCO.[I-]	{1: 2, 2: 3, 33: 1, 41: 1, 14: 3, 19: 1, 20: 1, 22: 1}
Did not match all atoms present	65776-65-0	CC(=S)NC1=CC2=CC=CC=C2C=C1Br	{1: 1, 18: 1, 31: 1, 14: 6, 7: 1}
Did not match all atoms present	65776-66-1	CC(=O)NC1=CC2=CC=CC=C2C=C1Br	{24: 1, 1: 1, 18: 1, 14: 6, 31: 1}
Did not match all atoms present	6579-54-0	C1=CC(=C(C(=C1)Cl)S(=O)(=O)Cl)Cl	{17: 3, 29: 2, 14: 3}
Did not match all atoms present	65792-84-9	C#CC1=CC=C(C=C1)C#[C-].[Cu+]	{9: 1, 10: 2, 14: 4}
Did not match all atoms present	65793-50-2	C1=CC=C2C=C3C(=CC2=C1)C(=O)N(C=N3)N	{25: 1, 35: 1, 30: 1, 14: 7, 33: 1}
Did not match all atoms present	65796-87-4	CC(C)(C)CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 11, 2: 1, 4: 4, 21: 1, 14: 2}
Did not match all atoms present	658-21-9	B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.B([O-])(OC=C)F.C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1	{32: 7, 5: 1, 6: 1, 14: 35, 16: 4, 22: 1, 29: 7}
Did not match all atoms present	658-48-0	CC(CC1=CC=C(C=C1)O)(C(=O)O)N	{1: 1, 2: 1, 4: 1, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	658-78-6	C1=CC(=CC=C1[N+](=O)[O-])OC(=O)C(F)(F)F	{16: 3, 28: 1, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	658-79-7	C1=CC(=CC=C1C[C@@H](C(=O)O)NC(=O)CN)O	{2: 2, 3: 1, 14: 4, 21: 1, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	658-90-2	C1=CC(=CC(=C1)OC(F)(F)F)C(=O)F	{16: 4, 24: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	658-91-3	C1=CC(=CC(=C1)OC(F)(F)F)C(=O)N	{4: 1, 14: 4, 16: 3, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	658-93-5	C1=CC(=C(C=C1CC(=O)O)F)F	{16: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	658-99-1	C1=CC(=C(C=C1CC#N)F)F	{16: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	6580-41-2	C1=CC2=C3C(=C1)C=CC4=CC5=CC=CC5=CC(=C43)C=C2	{14: 12}
Did not match all atoms present	6581-06-2	C1CN2CCC1C(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O	{33: 1, 4: 1, 11: 5, 12: 2, 14: 10, 20: 1, 28: 1}
Did not match all atoms present	65813-53-8	CC(C)C(=O)OCC(C)C1=CC=CC=C1	{1: 3, 2: 1, 3: 2, 28: 1, 14: 5}
Did not match all atoms present	65816-20-8	CCN(C=NC1=CC=C(C=C1)C(=O)OCC)C2=CC=CC=C2	{1: 2, 2: 2, 6: 1, 33: 1, 34: 1, 14: 9, 28: 1}
Did not match all atoms present	6582-42-9	CCC(=O)C1=CC(=C(C=C1)Cl)Cl	{24: 1, 1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	6582-52-1	C1=CC=C(C(=C1)CC2=CC=CC=C2N)N	{2: 1, 30: 2, 14: 8}
Did not match all atoms present	65823-94-1	CN1C=CC=C(C1=[Se])C=O	{1: 1, 26: 1, 14: 3, 33: 1}
Did not match all atoms present	65823-95-2	CC(C)N1C=CC=C(C1=[Se])C=O	{1: 2, 26: 1, 3: 1, 14: 3, 33: 1}
Did not match all atoms present	65824-05-7	CC(C)N1C=CC=C(C1=O)C=O	{1: 2, 3: 1, 33: 1, 14: 3, 25: 1, 26: 1}
Did not match all atoms present	65827-99-8	C1=CSC(=C1SC2=C(SC=C2)Br)Br	{40: 1, 41: 2, 18: 2, 14: 4}
Did not match all atoms present	65828-00-4	C1=C(SC=C1Br)SC2=CC(=CS2)Br	{40: 1, 41: 2, 18: 2, 14: 4}
Did not match all atoms present	6583-06-8	C1=CC2=NSN=C2C(=C1)[N+](=O)[O-]	{41: 1, 35: 2, 38: 1, 14: 3}
Did not match all atoms present	65831-43-8	CC1=C2CC(C3=C2C(=CC4=C3C=CC5=C4C=CC(C5O)O)C=C1)O	{1: 1, 11: 1, 12: 3, 14: 7, 20: 3}
Did not match all atoms present	65833-01-4	C1=CC(=CC=C1N2C(=O)C=CC2=O)I	{25: 2, 19: 1, 14: 6, 33: 1}
Did not match all atoms present	65833-67-2	CC1=CC2=NC(=C(NC2=CC1=O)C)C	{32: 1, 1: 3, 35: 1, 14: 2, 25: 1}
Did not match all atoms present	65836-68-2	CCC.[Re]	{1: 2, 2: 1}
Did not match all atoms present	65853-65-8	C1CC(=O)N(C1=O)OC(=O)OCC2=CC=CC=C2Cl	{33: 1, 2: 1, 11: 2, 14: 4, 17: 1, 25: 2}
Did not match all atoms present	65853-67-0	COC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2	{1: 1, 28: 1, 22: 1, 14: 9}
Did not match all atoms present	65859-07-6	CCCCOC(=O)C=C.C=CCCCC1=NC(=NC(=N1)N)N.C=CC(=O)O	{1: 1, 2: 6, 35: 3, 5: 3, 6: 3, 27: 1, 28: 1, 30: 2}
Did not match all atoms present	65859-25-8	CCOC(=O)C=C.CC(=C)C(=O)O.C=CCCCC1=NC(=NC(=N1)N)N	{1: 2, 2: 4, 35: 3, 5: 3, 6: 2, 7: 1, 27: 1, 28: 1, 30: 2}
Did not match all atoms present	65859-28-1	CC(=C)C(=O)OCC[N+](C)(C)CC1CO1.COC(=O)C=C.[Cl-]	{1: 4, 2: 3, 5: 2, 6: 1, 7: 1, 11: 1, 12: 1, 17: 1, 23: 1, 28: 2}
Did not match all atoms present	65859-40-7	CC(C)(C)CCCCCCCCC1=CC=C(C=C1)N.CC(C)(C)CCCCCCCCC1=CC=C(C=C1)N.COP(=O)(O)O	{1: 7, 2: 16, 4: 2, 14: 8, 20: 2, 22: 1, 29: 1, 30: 2}
Did not match all atoms present	65859-44-1	CCN(CC)CC.CN(C)C(=S)S	{1: 5, 2: 3, 39: 1, 33: 2, 7: 1}
Did not match all atoms present	65859-45-2	CC(COC(=O)C(=C)C)OC(=O)C1=CC=CC=C1C(=O)O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 14: 4, 27: 1, 28: 2}
Did not match all atoms present	65859-46-3	CCCCCCCCCCCC(=O)OCCOCC[O-].[K+]	{1: 1, 2: 14, 28: 1, 29: 1, 22: 1}
Did not match all atoms present	65860-38-0	CC(C)[NH2+]C1CCC2=C(C1O)C=CC(=C2CO)O.[Cl-]	{1: 2, 2: 1, 3: 1, 11: 2, 12: 2, 14: 2, 17: 1, 20: 2, 21: 1}
Did not match all atoms present	65860-74-4	CCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 10, 37: 1, 14: 8}
Did not match all atoms present	6587-23-1	C1=CC2=C(C(=C1)Br)N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 14: 3, 16: 3, 18: 1}
Did not match all atoms present	65872-41-5	CON=C(C1=CSC(=N1)N)C(=O)O	{1: 1, 34: 1, 35: 1, 7: 1, 41: 1, 14: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	65879-43-8	CC(C)OC1=CC(=C(C=C1[N+](=O)[O-])OC(C)C)Cl	{1: 4, 3: 2, 38: 1, 14: 2, 17: 1, 22: 2}
Did not match all atoms present	65879-44-9	CC1=CC(=CC(=C1O)N)N.Cl	{1: 1, 30: 2, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	65887-15-2	[Be+2].[Be+2].[OH-].[F-].[F-]	{16: 2}
Did not match all atoms present	6589-48-6	C1CCC(CC1)NCC(C2=CC=CC=C2)O	{2: 1, 3: 1, 11: 5, 12: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	65894-78-2	C1=CC=C(C=C1)C(=O)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{14: 10, 20: 1, 24: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	65899-73-2	C1=CC(=C(C=C1Cl)Cl)C(CN2C=CN=C2)OCC3=C(SC=C3)Cl	{33: 1, 2: 2, 3: 1, 41: 1, 14: 8, 17: 3, 35: 1, 22: 1}
Did not match all atoms present	659-04-1	COC(=O)C=CC1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 38: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	659-22-3	C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)O)O	{14: 8, 6: 2, 21: 2}
Did not match all atoms present	659-28-9	C1=CC(=CC=C1C=O)OC(F)(F)F	{16: 3, 26: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	659-49-4	C1=CC(=CC=C1N)N=O	{30: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	6590-93-8	C1=C(C=C(C=C1Cl)Cl)N=C=S	{8: 1, 17: 2, 34: 1, 14: 3}
Did not match all atoms present	6590-94-9	C1=CC(=C(C=C1N=C=S)Cl)Cl	{8: 1, 17: 2, 34: 1, 14: 3}
Did not match all atoms present	6590-95-0	C1=CC(=C(C(=C1)Cl)N=C=S)Cl	{8: 1, 17: 2, 34: 1, 14: 3}
Did not match all atoms present	6590-96-1	C1=CC(=C(C=C1Cl)Cl)N=C=S	{8: 1, 17: 2, 34: 1, 14: 3}
Did not match all atoms present	6590-97-2	C1=CC(=C(C(=C1)Cl)Cl)N=C=S	{8: 1, 17: 2, 34: 1, 14: 3}
Did not match all atoms present	65907-30-4	CCCCOC(=O)N(C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C	{1: 5, 2: 3, 33: 2, 40: 1, 11: 1, 13: 1, 14: 3, 23: 1, 28: 2}
Did not match all atoms present	6591-05-5	C[P+](=S)C	{1: 2}
Did not match all atoms present	6591-55-5	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Bi+3].[Bi+3]	{24: 6}
Did not match all atoms present	65916-12-3	CCN(CCOCCOCC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])C#N)NC(=O)C	{1: 3, 2: 6, 37: 2, 38: 1, 33: 1, 34: 2, 14: 5, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	65916-13-4	CCCCC(C)NC1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC	{1: 4, 2: 3, 3: 1, 38: 2, 34: 2, 14: 4, 18: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	65916-14-5	CCCCC(C)NC1=C(C=CC(=C1)NC(=O)C)OC	{1: 4, 2: 3, 3: 1, 14: 3, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	6592-85-4	CN1CCC2=CC3=C(C=C2C1O)OCO3	{1: 1, 33: 1, 11: 3, 12: 1, 14: 2, 20: 1, 23: 2}
Did not match all atoms present	65925-28-2	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCCCl	{1: 5, 2: 5, 4: 2, 14: 4, 17: 1, 22: 2}
Did not match all atoms present	65925-29-3	CC1=C(C=CC(=C1)C(C)(C)CC(C)(C)C)OCCOCCCl	{1: 6, 2: 5, 4: 2, 14: 3, 17: 1, 22: 2}
Did not match all atoms present	65927-08-4	CC1(C(=S)C(N=N1)(C)C)C	{1: 4, 35: 2, 13: 2, 15: 1}
Did not match all atoms present	65946-59-0	C[Si](C)(C)C=C(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 22: 2, 6: 1, 7: 1}
Did not match all atoms present	65950-41-6	C1CC(=O)N(C1=O)CC(NCC2=CC=CC=C2)N3C(=O)CCC3=O	{33: 2, 2: 2, 3: 1, 11: 4, 14: 5, 25: 4, 31: 1}
Did not match all atoms present	65954-42-9	CC(C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1)O	{1: 1, 3: 1, 20: 1, 14: 9}
Did not match all atoms present	65954-87-2	CCOC(=O)CCN(CCC(=O)OCC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C	{1: 3, 2: 6, 38: 1, 33: 1, 34: 2, 14: 7, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	6596-37-8	C1=CC=C2C(=C1)C=C3C=CC4=C5C3=C2C6=CC=CC7=C6C5=C(C=C7)C=C4	{14: 14}
Did not match all atoms present	6596-50-5	C=[Se]	{5: 1}
Did not match all atoms present	6596-74-3	CC(=O)NNC1=CC=C(C=C1)N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 2}
Did not match all atoms present	6596-81-2	CN1C=CN(C1=S)C	{1: 2, 14: 2, 33: 2}
Did not match all atoms present	6596-86-7	C=C1C=C2C=CC=CC2=C1	{5: 1, 14: 6, 15: 1}
Did not match all atoms present	6596-95-8	CO[As](OC)OC	{1: 3, 22: 3}
Did not match all atoms present	65967-01-3	CC(=O)NC1CCC2=CC(=C(C(=C2C3=C1C=C(C=C3)OC)OC)OC)OC	{1: 5, 11: 2, 12: 1, 14: 4, 22: 4, 24: 1, 31: 1}
Did not match all atoms present	6597-78-0	COC1=C(C=CC(=C1C(=O)OC)Cl)Cl	{1: 2, 28: 1, 22: 1, 14: 2, 17: 2}
Did not match all atoms present	65970-31-2	CC(C)C(C(C)(C)CO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O	{1: 4, 2: 1, 3: 2, 4: 1, 14: 8, 20: 2, 27: 4}
Did not match all atoms present	65970-35-6	C(CO)O.C(C(CO)O)O.C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)OC2=O	{17: 4, 2: 4, 3: 1, 20: 5, 28: 2}
Did not match all atoms present	65970-43-6	CCC(CO)(CO)COC(=O)C1=CC=CC=C1.C(CCCC(=O)O)CCCC(=O)O	{1: 1, 2: 11, 4: 1, 14: 5, 20: 2, 27: 2, 28: 1}
Did not match all atoms present	65976-60-5	C1COCCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-]	{33: 1, 38: 1, 11: 4, 14: 3, 17: 1, 23: 1}
Did not match all atoms present	65979-81-9	CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.[Zn+2]	{1: 4, 2: 6, 3: 2, 4: 2, 20: 4, 24: 4, 31: 2}
Did not match all atoms present	6598-58-9	C1=CC(=CC=C1NC2=C(C=C3C(=C2)OC4=C(C5=NC6=CC(=C(C=C6OC5=C(C4=N3)Cl)NC7=CC=C(C=C7)Cl)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{35: 2, 14: 12, 17: 4, 23: 2, 29: 6, 31: 2}
Did not match all atoms present	6598-62-5	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=C(C=C(C(=C3)S(=O)(=O)[O-])C4=CC(=C(C=C4S(=O)(=O)[O-])N/N=C\5/C=C(C6=CC=CC=C6C5=O)S(=O)(=O)[O-])C)C.[Na+].[Na+].[Na+]	{1: 3, 34: 3, 14: 17, 15: 2, 22: 1, 25: 1, 29: 11, 31: 1}
Did not match all atoms present	65980-75-8	Cl[Rh-2](Cl)(Cl)(Cl)Cl.[K+].[K+]	{17: 5}
Did not match all atoms present	65980-78-1	[NH4+].[NH4+].[F-].[F-].[F-].[F-].[F-].[Rh+3]	{16: 5}
Did not match all atoms present	65989-13-1	C1=CC2=NSN=C3C2=C4C1=NSN=C4C=C3	{41: 2, 35: 4, 14: 4}
Did not match all atoms present	65997-35-5	C(=O)O[Al]OC=O	{26: 2}
Did not match all atoms present	66-02-4	C1=C(C=C(C(=C1I)O)I)CC(C(=O)O)N	{2: 1, 3: 1, 14: 2, 19: 2, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	66-05-7	CC(CC1=CC=CC=C1)NN.Cl	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	66-23-9	CC(=O)OCC[N+](C)(C)C.[Br-]	{1: 4, 2: 2, 28: 1, 18: 1}
Did not match all atoms present	66-27-3	COS(=O)(=O)C	{1: 2, 29: 2, 22: 1}
Did not match all atoms present	66-32-0	C1CN2CC3=CCOC4CC(=O)N5C6C4C3CC2C61C7=CC=CC=C75.[N+](=O)(O)[O-]	{33: 2, 11: 6, 12: 5, 13: 1, 14: 5, 15: 1, 20: 1, 23: 1, 25: 1}
Did not match all atoms present	66-40-0	CC[N+](CC)(CC)CC	{1: 4, 2: 4}
Did not match all atoms present	66-56-8	C1=CC(=C(C(=C1)O)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 21: 1, 14: 3}
Did not match all atoms present	66-71-7	C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1	{35: 2, 14: 8}
Did not match all atoms present	66-75-1	C1=C(C(=O)NC(=O)N1)N(CCCl)CCCl	{32: 2, 33: 1, 2: 4, 14: 1, 17: 2, 25: 2}
Did not match all atoms present	66-76-2	C1=CC=C2C(=C1)C(=C(C(=O)O2)CC3=C(C4=CC=CC=C4OC3=O)O)O	{2: 1, 28: 2, 21: 2, 14: 8}
Did not match all atoms present	66-77-3	C1=CC=C2C(=C1)C=CC=C2C=O	{26: 1, 14: 7}
Did not match all atoms present	66-79-5	CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O	{1: 3, 35: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 23: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	66-83-1	COC1=CC2=C(C=C1)NC=C2CCN.Cl	{32: 1, 1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	66-97-7	C1=CC(=O)OC2=CC3=C(C=CO3)C=C21	{28: 1, 14: 6, 23: 1}
Did not match all atoms present	66-99-9	C1=CC=C2C=C(C=CC2=C1)C=O	{26: 1, 14: 7}
Did not match all atoms present	660-60-6	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Cu+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	66003-78-9	C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]	{16: 3, 4: 1, 29: 3, 14: 15}
Did not match all atoms present	66008-67-1	CN(CCOC(=O)C=C)S(=O)(=O)CC(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 12, 5: 1, 6: 1, 33: 1, 16: 25, 28: 1, 29: 2}
Did not match all atoms present	66008-68-2	CN(CCOC(=O)C=C)S(=O)(=O)CC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 10, 5: 1, 6: 1, 33: 1, 16: 21, 28: 1, 29: 2}
Did not match all atoms present	66008-69-3	CN(CCOC(=O)C=C)S(=O)(=O)CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 8, 5: 1, 6: 1, 33: 1, 16: 17, 28: 1, 29: 2}
Did not match all atoms present	66008-70-6	CN(CCOC(=O)C=C)S(=O)(=O)CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 6, 5: 1, 6: 1, 33: 1, 16: 13, 28: 1, 29: 2}
Did not match all atoms present	66008-71-7	CN(CCC[N+](C)(C)CC(=O)[O-])S(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 3, 2: 6, 4: 6, 33: 1, 16: 13, 24: 1, 29: 2}
Did not match all atoms present	66008-72-8	CN(CCC[N+](C)(C)CCC(=O)[O-])S(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 3, 2: 7, 4: 6, 33: 1, 16: 13, 24: 1, 29: 2}
Did not match all atoms present	6601-20-3	C=CCNC(=S)NCC=C	{2: 2, 31: 2, 5: 2, 6: 2, 7: 1}
Did not match all atoms present	66019-23-6	CCCCCCCCCCCCCCCCCC1=[N+](C(CO1)(C(=O)OCCCCCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCCC)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 50, 33: 1, 11: 1, 13: 1, 15: 1, 22: 1, 23: 1, 28: 2, 29: 3}
Did not match all atoms present	66019-25-8	CCCCCCCCCCCCCCCCCC1=[N+](C(CO1)C(=O)OCCCCCCCCCCCCCCCCC)CC.CCOS(=O)(=O)[O-]	{1: 4, 2: 34, 33: 1, 11: 1, 12: 1, 15: 1, 22: 1, 23: 1, 28: 1, 29: 3}
Did not match all atoms present	6602-28-4	C1=CC(=C[N+](=C1)[O-])O	{33: 1, 21: 1, 14: 4, 29: 1}
Did not match all atoms present	6602-32-0	C1=CC(=C(N=C1)Br)O	{18: 1, 35: 1, 21: 1, 14: 3}
Did not match all atoms present	6602-54-6	C1=CC(=C(N=C1)Cl)C#N	{17: 1, 35: 1, 37: 1, 14: 3}
Did not match all atoms present	66027-80-3	CC(C)(C)C(=O)C(C(=O)NC1=C(C=CC(=C1)N)Cl)Cl	{1: 3, 3: 1, 4: 1, 14: 3, 17: 2, 24: 2, 30: 1, 31: 1}
Did not match all atoms present	66027-87-0	CCCCCCCCCCCCOS(=O)(=O)N(CC)CC	{1: 3, 2: 13, 29: 2, 22: 1, 33: 1}
Did not match all atoms present	66027-93-8	NS(=O)(=O)[O-].NS(=O)(=O)[O-].NS(=O)(=O)[O-].[In+3]	{29: 9, 30: 3}
Did not match all atoms present	66027-98-3	CC1=C(C(=CC(=C1)CC(C)C)CC(C)C)O	{1: 5, 2: 2, 3: 2, 21: 1, 14: 2}
Did not match all atoms present	66027-99-4	CC(C)CC1=CC(=C(C=C1)OCCOCCN(C)C)CC(C)C	{1: 6, 2: 6, 3: 2, 33: 1, 14: 3, 22: 2}
Did not match all atoms present	66028-00-0	CC(C)CC1=CC(=C(C=C1)OCCOCCCl)CC(C)C	{1: 4, 2: 6, 3: 2, 14: 3, 17: 1, 22: 2}
Did not match all atoms present	66028-01-1	CCCCCCCCC1=CC=C(C=C1)OCCOCCOCCCl	{1: 1, 2: 13, 22: 3, 14: 4, 17: 1}
Did not match all atoms present	66028-11-3	CCCCOC(=O)C=C.CC(=C)C(=O)OCC[N+](C)(C)CC1CO1.[Cl-]	{1: 4, 2: 6, 5: 2, 6: 1, 7: 1, 11: 1, 12: 1, 17: 1, 23: 1, 28: 2}
Did not match all atoms present	66028-34-0	CC1=CC(=CC=C1)CC(C)N.CC1=CC(=CC=C1)CC(C)N.OS(=O)(=O)O	{1: 4, 2: 2, 3: 2, 14: 8, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	66032-51-7	O=C(OCC(O)CO)c1ccc(C(=O)OCC(O)CO)cc1	{28: 2, 2: 4, 3: 2, 20: 4, 14: 4}
Did not match all atoms present	66037-08-9	CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(=NC2=C(C=C(C=C2)N(CC)CCO)C)C(=O)C(C)(C)C	{1: 6, 2: 18, 4: 1, 33: 1, 7: 1, 34: 1, 14: 6, 17: 1, 20: 1, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	66037-55-6	CCOC(=O)C1=C(C=CC(=C1)CC2=CC=C(C=C2)N)N	{1: 1, 2: 2, 28: 1, 30: 2, 14: 7}
Did not match all atoms present	66037-56-7	CCCCOC(=O)C1=C(C=CC(=C1)CC2=CC=C(C=C2)N)N	{1: 1, 2: 4, 28: 1, 30: 2, 14: 7}
Did not match all atoms present	66037-57-8	COC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)C(=O)OC)N	{1: 2, 2: 1, 14: 6, 22: 1, 28: 1, 30: 2}
Did not match all atoms present	66046-78-4	C(CN)N.C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)O)C(=O)O.C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)O)C(=O)O	{2: 2, 27: 4, 18: 8, 30: 2}
Did not match all atoms present	66051-01-2	CO[C@H](CO)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	66055-59-2	CCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OC.C=CC(=O)[O-].[NH4+]	{1: 4, 2: 11, 5: 3, 6: 1, 7: 2, 24: 1, 28: 2}
Did not match all atoms present	6606-34-4	CC12CCC(=O)C=C1CCC3=CC=CC=C23	{1: 1, 11: 4, 13: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	66063-05-6	C1CCC(C1)N(CC2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC=C3	{33: 1, 2: 1, 11: 4, 12: 1, 14: 9, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	66063-61-4	C(C(=O)[O-])NCO.[K+]	{24: 1, 2: 2, 20: 1, 31: 1}
Did not match all atoms present	66064-11-7	C1C(C(=O)N(C1=O)N)C2=CC(=CC=C2)Br	{33: 1, 11: 1, 12: 1, 14: 4, 18: 1, 25: 2, 30: 1}
Did not match all atoms present	6607-45-0	C1=CC=C(C=C1)/C(=C\Cl)/Cl	{17: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	6607-46-1	C1=CC=C(C=C1)C(=CBr)Br	{18: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	66072-11-5	CCCCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCCS(=O)(=O)O.C=CC(=O)O.C=C(Cl)Cl	{1: 4, 2: 5, 5: 5, 6: 2, 7: 3, 17: 2, 20: 1, 27: 1, 28: 3, 29: 2}
Did not match all atoms present	6608-82-8	CC(CN(C)C)OCCS(=O)(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl	{1: 3, 2: 3, 3: 1, 33: 2, 11: 2, 14: 8, 15: 1, 17: 1, 35: 1, 22: 1, 29: 2}
Did not match all atoms present	66085-58-3	CCCCOCC1CO1.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=CC(=O)O.C1C(O1)CCl	{1: 3, 2: 5, 4: 1, 5: 1, 6: 1, 11: 2, 12: 2, 14: 8, 17: 1, 21: 2, 22: 1, 23: 2, 27: 1}
Did not match all atoms present	66085-59-4	CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC	{32: 1, 1: 5, 2: 2, 3: 1, 38: 1, 12: 1, 14: 4, 15: 4, 22: 1, 28: 2}
Did not match all atoms present	66085-61-8	C(CO)NCCO.OS(=O)O	{2: 4, 20: 4, 29: 1, 31: 1}
Did not match all atoms present	66085-69-6	CC1=C(C=CC(=C1)C(C2=CC=CC=C2)C3=CC(=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)C)N=NC6C(=NN(C6=O)C7=CC=CC=C7)C	{1: 4, 34: 4, 3: 1, 33: 2, 12: 2, 14: 21, 15: 2, 35: 2, 25: 2}
Did not match all atoms present	66085-70-9	CC1=CC(=C(C=C1C(C2=CC=CC=C2)C3=CC(=C(C=C3)N/N=C/4\C(=O)C=CC5=CC=CC=C54)C)C)N/N=C\6/C(=O)C=CC7=CC=CC=C76	{1: 3, 34: 2, 3: 1, 14: 22, 15: 2, 25: 2, 31: 2}
Did not match all atoms present	66085-71-0	C1=CC=C(C=C1)NC2=NC(=NC(=N2)N(CCC(=O)N)CCO)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)N(CCC(=O)N)CCO)S(=O)(=O)O)S(=O)(=O)O	{33: 2, 2: 8, 35: 6, 6: 2, 14: 16, 20: 4, 24: 2, 29: 4, 30: 2, 31: 4}
Did not match all atoms present	6609-36-5	C1=C(C=C2C(=C1[N+](=O)[O-])N=C(N2)C(F)(F)F)Br	{32: 1, 35: 1, 4: 1, 38: 1, 14: 2, 16: 3, 18: 1}
Did not match all atoms present	6609-37-6	C1=C(C=C2C(=C1Br)N=C(N2)C(F)(F)F)[N+](=O)[O-]	{32: 1, 35: 1, 4: 1, 38: 1, 14: 2, 16: 3, 18: 1}
Did not match all atoms present	6609-38-7	C1=C(C=C2C(=C1[N+](=O)[O-])N=C(N2)C(F)(F)F)[N+](=O)[O-]	{32: 1, 35: 1, 4: 1, 38: 2, 14: 2, 16: 3}
Did not match all atoms present	6609-40-1	C1=C2C(=CC(=C1Cl)[N+](=O)[O-])N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 38: 1, 14: 2, 16: 3, 17: 1}
Did not match all atoms present	6609-41-2	C1=C2C(=C(C(=C1Cl)Cl)[N+](=O)[O-])N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 38: 1, 14: 1, 16: 3, 17: 2}
Did not match all atoms present	6609-42-3	C1=C2C(=C(C(=C1[N+](=O)[O-])Cl)Cl)N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 38: 1, 14: 1, 16: 3, 17: 2}
Did not match all atoms present	6609-43-4	C1=C2C(=C(C(=C1Cl)[N+](=O)[O-])Cl)N=C(N2)C(F)(F)F	{32: 1, 35: 1, 4: 1, 38: 1, 14: 1, 16: 3, 17: 2}
Did not match all atoms present	6609-53-6	C1=C(C=C2C(=C1Br)N=C(N2)C(F)(F)F)Br	{32: 1, 35: 1, 4: 1, 14: 2, 16: 3, 18: 2}
Did not match all atoms present	6609-54-7	CSC1=CC=CC=C1C#N	{40: 1, 1: 1, 37: 1, 14: 4}
Did not match all atoms present	6609-56-9	COC1=CC=CC=C1C#N	{1: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	6609-57-0	CCOC1=CC=CC=C1C#N	{1: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	6609-64-9	C1COP(=O)(O1)Cl	{17: 1, 11: 2, 29: 1, 23: 2}
Did not match all atoms present	66090-36-6	C1=CC(=CC(=C1)Cl)C(=O)N=C=S	{8: 1, 17: 1, 34: 1, 14: 4, 24: 1}
Did not match all atoms present	66090-76-4	CCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OC.C=CC(=O)[O-].[K+]	{1: 4, 2: 11, 5: 3, 6: 1, 7: 2, 24: 1, 28: 2}
Did not match all atoms present	66096-13-7	C1=CC=C2C(=C1)C(=O)C(=CC3=C(C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S2.[K+].[K+]	{6: 1, 41: 1, 14: 7, 15: 1, 25: 1, 29: 6}
Did not match all atoms present	66096-14-8	C1=CC(=CC=C1N2C(=O)C(=C(N2)C(=O)[O-])/C=C\C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-].[K+].[K+].[K+].[K+]	{32: 1, 33: 2, 35: 1, 6: 3, 14: 8, 15: 2, 24: 2, 25: 2, 29: 6}
Did not match all atoms present	661-36-9	[B-](F)(F)(F)F.C[N+](C)(C)C	{16: 4, 1: 4}
Did not match all atoms present	661-37-0	C[Ge](C)(C)F	{16: 1, 1: 3}
Did not match all atoms present	661-68-7	C[Si](C)(F)[Si](C)(C)F	{16: 2, 1: 4}
Did not match all atoms present	661-69-8	C[Sn](C)C.C[Sn](C)C	{1: 6}
Did not match all atoms present	6610-08-8	C1=CC=C2C=C(C=CC2=C1)N=O	{34: 1, 29: 1, 14: 7}
Did not match all atoms present	6610-29-3	CNC(=S)NN	{1: 1, 31: 2, 30: 1, 7: 1}
Did not match all atoms present	66102-30-5	CC1=C(C(=C(C=C1)C)N(C)C)N(C)C	{1: 6, 14: 2, 33: 2}
Did not match all atoms present	66102-31-6	CC1=C2C(=C(C=C1)C)N(CCN2C)C	{1: 4, 11: 2, 14: 2, 33: 2}
Did not match all atoms present	66102-32-7	CC1=CC2=C(C=C1C)N(CCN2C)C	{1: 4, 11: 2, 14: 2, 33: 2}
Did not match all atoms present	66102-33-8	CN1CCCCCN(C2=CC=CC=C21)C	{1: 2, 11: 5, 14: 4, 33: 2}
Did not match all atoms present	66102-34-9	CN1C2=CC=CC=C2N(C13CCCC3)C	{1: 2, 11: 4, 13: 1, 14: 4, 33: 2}
Did not match all atoms present	66102-37-2	CC1=C2C(=C(C=C1)C)N3CCN2CC3	{1: 2, 11: 4, 14: 2, 33: 2}
Did not match all atoms present	66102-38-3	CC1=CC2=C(C=C1C)N3CCN2CC3	{1: 2, 11: 4, 14: 2, 33: 2}
Did not match all atoms present	66102-39-4	CC1=C2C(=C(C=C1)C)NCCN2	{32: 2, 1: 2, 11: 2, 14: 2}
Did not match all atoms present	66104-23-2	CCCN1C[C@@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)CSC.CS(=O)(=O)O	{32: 1, 1: 3, 2: 3, 33: 1, 40: 1, 11: 3, 12: 3, 14: 4, 20: 1, 29: 2}
Did not match all atoms present	66104-32-3	CC(=O)NC1CCC(=O)C2=C1C=CS2	{1: 1, 41: 1, 11: 2, 12: 1, 14: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	66104-34-5	COC1=CC=C(C=C1)N2N=C3C=CC(=NC3=N2)N	{1: 1, 35: 3, 33: 1, 14: 6, 22: 1, 30: 1}
Did not match all atoms present	66104-36-7	COC1=CC=C(C=C1)N=NC2=C(N=C(C=C2)N)N.Cl	{1: 1, 34: 2, 35: 1, 14: 6, 17: 1, 22: 1, 30: 2}
Did not match all atoms present	66104-40-3	C1=CC(=CC=C1N)SC2=NN=C(S2)N	{40: 1, 41: 1, 35: 2, 30: 2, 14: 4}
Did not match all atoms present	66104-42-5	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{1: 1, 2: 2, 3: 1, 14: 4, 24: 2, 29: 2, 31: 1}
Did not match all atoms present	66104-44-7	CC1=C(C=C(C=C1)N2N=C3C=CC(=NC3=N2)N)C	{1: 2, 35: 3, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	66104-46-9	CC1=C(C=C(C=C1)N=NC2=C(N=C(C=C2)N)N)C.Cl	{1: 2, 34: 2, 35: 1, 14: 5, 17: 1, 30: 2}
Did not match all atoms present	66104-53-8	CC1=CC(=C(C=C1)N=NC2=CC(=C(C=C2)N)C)C.Cl	{1: 3, 34: 2, 30: 1, 14: 6, 17: 1}
Did not match all atoms present	66104-54-9	CCCOC1=CC(=CC(=C1)OCCC)OCCC	{1: 3, 2: 6, 22: 3, 14: 3}
Did not match all atoms present	66104-55-0	CN\1C2=CC=CC=C2S/C1=N\NC=C3N=C4C=CC=CC4=N3	{1: 1, 34: 1, 35: 2, 6: 1, 33: 1, 41: 1, 14: 8, 15: 1, 31: 1}
Did not match all atoms present	66104-56-1	CC1=C(C(=CC=C1)N=NC2=C(C(=C(C=C2)N)C)C)C.Cl	{1: 4, 34: 2, 30: 1, 14: 5, 17: 1}
Did not match all atoms present	66104-58-3	C1=CC2=C(C=CC3=C2C(=C1)C(=O)C4=C3C=CC(=C4)Cl)Cl	{17: 2, 14: 8, 25: 1}
Did not match all atoms present	66104-59-4	CC\1=NN(C(=O)/C1=N\NC2=CC=CC=C2C(=O)O)C3=CC(=C(C=C3Cl)S(=O)(=O)O)Cl	{1: 1, 34: 1, 35: 1, 33: 1, 14: 6, 15: 2, 17: 2, 20: 1, 25: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	66104-63-0	CC(=O)NC1=CC2=C(C=C1)N=C(S2)N=NC3=CC=C(C=C3)N4CCOCC4	{1: 1, 34: 2, 35: 1, 33: 1, 41: 1, 11: 4, 14: 7, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	66104-64-1	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])OC)NN=C3C=CC(=O)C=C3	{1: 2, 34: 3, 38: 1, 14: 10, 15: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	66104-71-0	CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)Cl	{1: 1, 2: 15, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	66104-73-2	CC1=NN(C(=O)C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)Cl)OC(=O)C4=CC=CC=C4)C5=CC=CC=C5	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 15, 15: 1, 17: 1, 25: 1, 28: 1, 29: 2}
Did not match all atoms present	66104-74-3	CCC(CCCCN)CC1=C2C(=C(C=C1)CCCCCN)C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 11, 3: 1, 14: 6, 25: 2, 30: 2}
Did not match all atoms present	66107-29-7	COC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 22: 2, 29: 2}
Did not match all atoms present	66108-37-0	C(C(CCl)OP(=O)(OCC(CCl)(CBr)CBr)OC(CCl)CCl)Cl	{2: 8, 3: 2, 4: 1, 17: 5, 18: 2, 22: 3, 29: 1}
Did not match all atoms present	66119-40-2	C1C2CC(C1C=C2)COP(OCC3CC4CC3C=C4)OCC5CC6CC5C=C6	{2: 3, 11: 6, 12: 9, 22: 3, 14: 6}
Did not match all atoms present	66120-75-0	C(=O)(N)N.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{24: 1, 17: 4, 30: 2}
Did not match all atoms present	66120-76-1	C=O.C1(=NC(=NC(=N1)N)N)N.C(=O)(N)N.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{24: 1, 17: 4, 35: 3, 5: 1, 30: 5}
Did not match all atoms present	66121-41-3	C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)Cl)Cl)[N+](=O)[O-]	{17: 2, 38: 1, 30: 1, 14: 4, 25: 2}
Did not match all atoms present	6613-44-1	CC1=CC(=CC(=C1)C(=O)Cl)C	{24: 1, 1: 2, 14: 3, 17: 1}
Did not match all atoms present	66130-90-3	CCOP(=O)(CC(=O)O[Si](C)(C)C)OCC	{1: 5, 2: 3, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	66137-74-4	C(C(F)(F)S(=O)(=O)F)(OC(C(F)(F)I)(F)F)(F)F	{16: 9, 19: 1, 4: 4, 29: 2, 22: 1}
Did not match all atoms present	66138-22-5	C(CCl)OCCCl.[Na+].[Na+].[S-2]	{17: 2, 2: 4, 22: 1}
Did not match all atoms present	66142-15-2	CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 14: 8, 23: 1, 29: 3}
Did not match all atoms present	66142-16-3	C1=CC=C(C=C1)C(=O)NC2=C(C=C(C(=C2)Cl)N)O.Cl	{14: 7, 17: 2, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	66142-20-9	CC[O+]=C1C=C(OC2=CC=CC=C21)C3=CC=C(C=C3)OC.CS(=O)(=O)[O-]	{1: 3, 2: 1, 14: 9, 22: 2, 23: 1, 29: 3}
Did not match all atoms present	66142-21-0	COC1=CC=C(C=C1)C2=CC(=[O+]C)C3=CC=CC=C3O2.COS(=O)(=O)[O-]	{1: 3, 29: 3, 22: 3, 14: 9, 23: 1}
Did not match all atoms present	66142-71-0	CCC1=C(C(=CC=C1)O)CC	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	66142-94-7	CC1=NN(C(=O)C1N/N=C\2/C3=CC=CC=C3C(=CC2=O)S(=O)(=O)N(CCO)CCO)C4=CC=CC=C4	{1: 1, 2: 4, 35: 1, 33: 2, 12: 1, 34: 1, 14: 10, 15: 3, 20: 2, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	66142-95-8	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].C1CCC(CC1)NC2CCCCC2.C1CCC(CC1)NC2CCCCC2.[Cr+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 11: 20, 12: 4, 14: 14, 15: 4, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	66142-99-2	[H+].[H+].[H+].CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.C1=CC=C2C(=C1)C3=NC2=NC4=NC(=NC5=C6C=CC(=CC6=C([N-]5)N=C7C8=C(C=CC(=C8)S(=O)(=O)[O-])C(=N3)[N-]7)S(=O)(=O)[O-])C9=C4C=CC(=C9)S(=O)(=O)[O-].[Cu+2]	{1: 6, 34: 3, 35: 8, 7: 3, 14: 37, 29: 9, 30: 3, 31: 3}
Did not match all atoms present	66147-68-0	CCCCCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42.Cl	{1: 1, 2: 4, 35: 1, 14: 12, 17: 1, 29: 2, 31: 2}
Did not match all atoms present	66161-48-6	CCOC(=O)CC(CCl)([O-])OCC.[Mg+2].[I-]	{1: 2, 2: 4, 4: 1, 17: 1, 19: 1, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	66161-56-6	CCCCCCCCCCCCCC(=O)NCCC[N+]1(CCOCC1)[O-]	{1: 1, 2: 15, 11: 4, 23: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	66161-57-7	CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 35, 29: 3, 22: 13}
Did not match all atoms present	66161-62-4	CCCCCCCCCCCC(=O)NCCN(CCO)CC(=O)[O-].[Na+]	{1: 1, 2: 15, 33: 1, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	66161-66-8	CCCCCCCCCCCC(=O)NCCC[N+](CCO)(CCO)[O-]	{1: 1, 2: 17, 20: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	66161-67-9	CCCCCCCCCCCCCC(=O)NCCC[N+](CCO)(CCO)[O-]	{1: 1, 2: 19, 20: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	66161-68-0	CCCCCCCCCCCCCCCC(=O)NCCC[N+](CCO)(CCO)[O-]	{1: 1, 2: 21, 20: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	66161-69-1	CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](CCO)(CCO)[O-]	{1: 1, 2: 23, 20: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	66165-38-6	C(CC1=NC(=NC(=N1)N)N)CC(CCC2=NC(=NC(=N2)N)N)C3=NC(=NC(=N3)N)N	{35: 9, 2: 5, 3: 1, 30: 6}
Did not match all atoms present	66169-93-5	CC(=O)[CH-]C(=O)C.[Rb+]	{24: 2, 1: 2, 6: 1}
Did not match all atoms present	66170-39-6	CCCCCCCCCCCCCCCCOC(=O)C1=CN=CC=C1	{1: 1, 2: 15, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	66172-78-9	CCCCCCCCCC1=C(C(=CC=C1)CCCCCCCCC)OCCOCCOCCOCCOCCOCCOCCOP(=O)(O)O	{1: 2, 2: 30, 14: 3, 20: 2, 22: 8, 29: 1}
Did not match all atoms present	66172-79-0	CCCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOCCOCCOP(=O)(O)OCCOCCOCCOCCOCCOCCOC2=CC=CC=C2CCCCCCCCC	{1: 2, 2: 40, 14: 8, 20: 1, 22: 14, 29: 1}
Did not match all atoms present	66172-80-3	CCCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOCCOCCO.OP(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 2: 20, 14: 4, 20: 2, 22: 6, 29: 3}
Did not match all atoms present	66172-81-4	CCCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOCCOCCO.C(CO)NCCO.OP(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 2: 24, 14: 4, 20: 4, 22: 6, 29: 3, 31: 1}
Did not match all atoms present	66172-82-5	CCCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOCCOCCOCCOCCOCCOP(=O)(O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOC2=CC=CC=C2CCCCCCCCC	{1: 2, 2: 52, 14: 8, 20: 1, 22: 20, 29: 1}
Did not match all atoms present	66172-83-6	CCCCCCCCCC1=C(C(=CC=C1)CCCCCCCCC)OCCOCCOCCOCCOCCOCCOCCOP(=O)(O)OCCOCCOCCOCCOCCOCCOCCOC2=C(C=CC=C2CCCCCCCCC)CCCCCCCCC	{1: 4, 2: 60, 14: 6, 20: 1, 22: 16, 29: 1}
Did not match all atoms present	66172-84-7	CCCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOCCOCCOP(=O)(O)O.C(CO)NCCO.C(CO)NCCO	{1: 1, 2: 28, 14: 4, 20: 6, 22: 7, 29: 1, 31: 2}
Did not match all atoms present	66172-85-8	CCCCCCCCCC1=C(C(=CC=C1)CCCCCCCCC)OCCOCCOCCOCCOCCOCCOCCOCCOCCO	{1: 2, 2: 34, 20: 1, 22: 9, 14: 3}
Did not match all atoms present	66176-39-4	C1=CC(=CC=C1CBr)S(=O)(=O)Cl	{17: 1, 2: 1, 18: 1, 14: 4, 29: 2}
Did not match all atoms present	6618-03-7	CCC[Pb](CCC)CCC	{1: 3, 2: 6}
Did not match all atoms present	6618-09-3	C[Si](C)(C)C#CC(F)(F)F	{16: 3, 1: 3, 10: 2, 4: 1}
Did not match all atoms present	66181-84-8	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=CC=C4)C(=O)C5=C(C=CC(=C5C3=O)NC6=CC=CC=C6)NC7=CC=CC=C7	{25: 2, 14: 24, 31: 4}
Did not match all atoms present	66182-97-6	COC1=C(C=C(C=C1)S(=O)(=O)O)C2=NC3=C(S2)N=C(S3)C4=C(C=CC(=C4)S(=O)(=O)O)OC	{1: 2, 35: 2, 41: 2, 14: 6, 20: 2, 22: 2, 29: 4}
Did not match all atoms present	66182-98-7	COC1=C(C=CC=C1S(=O)(=O)[O-])C2=NC3=C(S2)N=C(S3)C4=C(C(=CC=C4)S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 2, 35: 2, 41: 2, 14: 6, 22: 2, 29: 6}
Did not match all atoms present	66186-16-1	CCCCCCCCCCOS(=O)(=O)OCCCCCCCCCC	{1: 2, 2: 18, 29: 2, 22: 2}
Did not match all atoms present	66187-19-7	CC1=CN(N(C1=S)C)C	{1: 3, 14: 1, 33: 2}
Did not match all atoms present	66187-20-0	CC1=C([N+](=NN1C)C)[S-]	{1: 3, 35: 1, 33: 2}
Did not match all atoms present	66195-26-4	CC(C)CCC(C)NC1=CC=C(C=C1)N=O	{1: 3, 2: 2, 3: 2, 34: 1, 14: 4, 29: 1, 31: 1}
Did not match all atoms present	66197-75-9	CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 25, 29: 3, 22: 8}
Did not match all atoms present	66197-79-3	C(COP(=O)(O)[O-])N(CCOP(=O)(O)[O-])CCOP(=O)(O)[O-].[Na+].[Na+].[Na+]	{33: 1, 2: 6, 20: 3, 29: 6, 22: 3}
Did not match all atoms present	6620-60-6	CCCN(CCC)C(=O)C(CCC(=O)O)NC(=O)C1=CC=CC=C1	{1: 2, 2: 6, 3: 1, 33: 1, 14: 5, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	66201-75-0	C1CSC2=CC=CC(=O)N21	{25: 1, 11: 2, 41: 1, 14: 3, 33: 1}
Did not match all atoms present	66212-59-7	COC1=CC2=C(C=C1CCC3=C(C=C(CC2)C(=C3)C(=O)OC)C(=O)OC)OC	{1: 4, 11: 4, 28: 2, 22: 2, 14: 4}
Did not match all atoms present	66214-40-2	C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)O)CC3=C(C=CC(=C3)S(=O)(=O)C4=CC=C(C=C4)O)O	{2: 1, 20: 1, 21: 2, 14: 13, 29: 4}
Did not match all atoms present	66214-41-3	C1=CC=C(C=C1)C(=NC2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=CC(=C4)N=C(C5=CC=CC=C5)Cl)Cl	{17: 2, 34: 2, 25: 2, 14: 16, 7: 2}
Did not match all atoms present	66214-42-4	C1=CC=C(C(=C1)C(=O)[O-])N/N=C\2/C(=CC3=C(C2=O)C=C(C=C3)N)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	66214-43-5	CC1=CC(=CC(=C1C(=O)N)SCC(=O)O)Cl	{1: 1, 2: 1, 40: 1, 14: 2, 17: 1, 24: 1, 27: 1, 30: 1}
Did not match all atoms present	66214-45-7	CC1=NN(C(=O)C1N=NC2=CC=CC=C2OC)C3=C(C=CC(=C3)Cl)Cl	{1: 2, 34: 2, 35: 1, 33: 1, 12: 1, 14: 7, 15: 1, 17: 2, 22: 1, 25: 1}
Did not match all atoms present	66214-46-8	C1=CC=C(C(=C1)NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]	{34: 2, 38: 1, 29: 3, 14: 12, 31: 1}
Did not match all atoms present	66214-47-9	CC1=NN(C(=O)C1N=NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N/NC4=C(C=C(C=C4)C5=CC(=C(C=C5)N/N=C\6/C7=C(C=C(C=C7)S(=O)(=O)[O-])C=C(C6=O)S(=O)(=O)[O-])OC)OC)/C3=O)S(=O)(=O)[O-])C8=CC=CC=C8.[Na+].[Na+].[Na+].[Na+]	{1: 3, 34: 4, 35: 1, 33: 1, 12: 1, 14: 18, 15: 5, 22: 2, 25: 3, 29: 12, 31: 2}
Did not match all atoms present	66214-48-0	CCOC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])OC.[Na+]	{1: 2, 2: 1, 34: 4, 14: 11, 22: 2, 29: 3}
Did not match all atoms present	66214-51-5	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N/N=C/5\C(=CC6=C(C5=O)C=C(C=C6)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 13, 15: 4, 25: 2, 29: 9, 30: 2, 31: 2}
Did not match all atoms present	66214-52-6	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=CC(=C4)N)S(=O)(=O)[O-])C)N/N=C\5/C(=CC6=C(C5=O)C=C(C=C6)N)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 14: 14, 15: 4, 25: 2, 29: 6, 30: 2, 31: 2}
Did not match all atoms present	66214-53-7	CC(=O)NC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=C(C=CC(=C2)[N+](=O)[O-])Cl	{1: 3, 2: 4, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	66214-55-9	C1=CC(=CC=C1/C=C/C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)[N+](=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N=[N+](C5=CC(=C(C=C5)/C=C/C6=C(C=C(C=C6)N=[N+](C7=CC(=C(C=C7)/C=C/C8=C(C=C(C=C8)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)[O-])S(=O)(=O)O)S(=O)(=O)O)[O-])S(=O)(=O)O)S(=O)(=O)O)[O-]	{33: 3, 34: 3, 38: 2, 6: 8, 14: 25, 20: 7, 29: 17}
Did not match all atoms present	66214-56-0	C1=CC=C(C=C1)C(=S)NC2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=CC(=C4)NC(=S)C5=CC=CC=C5	{25: 2, 31: 2, 14: 16, 7: 2}
Did not match all atoms present	66215-27-8	C1CC1NC2=NC(=NC(=N2)N)N	{35: 3, 11: 2, 12: 1, 30: 2, 31: 1}
Did not match all atoms present	6622-55-5	C1=CC=C(C=C1)CNC2=CC=CC=C2C(=O)O	{2: 1, 27: 1, 14: 9, 31: 1}
Did not match all atoms present	6622-92-0	CC1=CC(=O)N=C(N1)C	{32: 1, 1: 2, 35: 1, 14: 1, 25: 1}
Did not match all atoms present	66225-56-7	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC=CC=C4)C=C3)C5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 21, 15: 2, 29: 6}
Did not match all atoms present	66225-65-8	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=CC(=C(C=C3)[O-])C(=O)[O-])C)NN=C4C(=O)C=CC(=NNC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])C4=O.[Na+].[Na+].[Cu+2]	{1: 2, 34: 4, 14: 14, 24: 1, 25: 2, 29: 3, 31: 2}
Did not match all atoms present	6623-41-2	CC1=CC(=C(C=C1C)O)N	{1: 2, 30: 1, 21: 1, 14: 2}
Did not match all atoms present	6623-43-4	CC(C1=CC=CC=C1)NCCO	{1: 1, 2: 2, 3: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	6623-59-2	CCC1=CC(=C(C=C1)Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	66232-25-5	CCCCOC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl	{1: 1, 2: 8, 33: 1, 14: 4, 17: 2, 28: 1}
Did not match all atoms present	66232-28-8	CCCCCCCCCCCCCCOC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl	{1: 1, 2: 18, 33: 1, 14: 4, 17: 2, 28: 1}
Did not match all atoms present	66232-30-2	CCCCCCCCCCCCCCCCCCOC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl	{1: 1, 2: 22, 33: 1, 14: 4, 17: 2, 28: 1}
Did not match all atoms present	6624-02-8	C1=CC=C(C=C1)C(=O)CC(C2=CC=CC=C2)(C3=CC=CC=C3)O	{24: 1, 20: 1, 2: 1, 4: 1, 14: 15}
Did not match all atoms present	6624-60-8	CCCCCC(=O)OCC1=CC=C(C=C1)OC	{1: 2, 2: 5, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	66240-02-6	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=CC(=C3)OC	{1: 3, 22: 1, 14: 9}
Did not match all atoms present	66240-30-0	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=C(C=C3)OC	{1: 3, 22: 1, 14: 9}
Did not match all atoms present	66241-56-3	CC(C)OC(=O)C1=CC=CC=C1C(=O)[O-].[Na+]	{24: 1, 1: 2, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	66246-88-6	CCCC(CN1C=NC=N1)C2=C(C=C(C=C2)Cl)Cl	{1: 1, 2: 3, 3: 1, 33: 1, 14: 5, 17: 2, 35: 2}
Did not match all atoms present	6625-74-7	CC(C)(C)C(=O)NC1=CC=CC=C1	{24: 1, 1: 3, 4: 1, 14: 5, 31: 1}
Did not match all atoms present	66251-45-4	CC(C)CCCCCOC(=O)C=C.CC(=C)C(=O)O.C=CC1=CC=CC=C1	{1: 3, 2: 5, 3: 1, 5: 3, 6: 2, 7: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	66256-71-1	CC[N+]1=C(OC=C1C2=CC=CC=C2)C.[I-]	{1: 2, 2: 1, 33: 1, 14: 6, 19: 1, 23: 1}
Did not match all atoms present	66256-72-2	CC1=CC(=CC=C1)N=NC2C(=NNC2=O)C(=O)O	{32: 1, 1: 1, 34: 2, 35: 1, 12: 1, 14: 4, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	66259-60-7	CCCCCCCCOC1=C(C=C2C(=C1)C(CC3(O2)CC(C4=CC(=C(C=C4O3)C)OCCCCCCCC)(C)C)(C)C)C	{1: 8, 2: 14, 11: 2, 13: 3, 14: 4, 22: 2, 23: 2}
Did not match all atoms present	6626-15-9	C1=CC(=C(C=C1O)O)Br	{18: 1, 21: 2, 14: 3}
Did not match all atoms present	6626-23-9	CC1=C(C2=CC=CC=C2C=C1)CCl	{1: 1, 2: 1, 14: 6, 17: 1}
Did not match all atoms present	6626-32-0	CCCC1=C(C(=CC=C1)CCC)O	{1: 2, 2: 4, 21: 1, 14: 3}
Did not match all atoms present	6626-64-8	CN1C2=CC=CC=C2C=C3C1=CC4=CC=CC=C43	{1: 1, 14: 10, 33: 1}
Did not match all atoms present	66267-19-4	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C(C4=C3)C=C[C@H]([C@@H]5O)O	{20: 2, 12: 2, 14: 12}
Did not match all atoms present	66267-67-2	CCOCCOCCOC(=O)C(C1=CC=CC=C1)O	{1: 1, 2: 5, 3: 1, 14: 5, 20: 1, 22: 2, 28: 1}
Did not match all atoms present	6627-34-5	C1=C(C(=CC(=C1Cl)[N+](=O)[O-])Cl)N	{17: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	6627-51-6	CC1=CC(=C(C=C1)Br)Cl	{1: 1, 18: 1, 14: 3, 17: 1}
Did not match all atoms present	6627-53-8	COC1=C(C=CC(=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	6627-55-0	CC1=CC(=C(C=C1)O)Br	{1: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	6627-78-7	CC1=CC=C(C2=CC=CC=C12)Br	{1: 1, 18: 1, 14: 6}
Did not match all atoms present	6627-88-9	COC1=CC(=CC(=C1O)OC)CC=C	{1: 2, 2: 1, 5: 1, 6: 1, 14: 2, 21: 1, 22: 2}
Did not match all atoms present	6627-89-0	CC(C)(C)OC(=O)OC1=CC=CC=C1	{1: 3, 4: 1, 14: 5}
Did not match all atoms present	66271-32-7	CC1=CC2=CC(=C3C=CC(=CC3=C2C=C1)C)C	{1: 3, 14: 7}
Did not match all atoms present	66271-47-4	CC1=C2C=CC3=C(C2=C(C=C1)C)C(=CC=C3)C	{1: 3, 14: 7}
Did not match all atoms present	66271-76-9	CCCCCCCCCCCCCCCOC=O	{1: 1, 2: 14, 26: 1}
Did not match all atoms present	66271-87-2	CC1=CC=CC2=C1C=CC3=C2C(=CC=C3)C	{1: 2, 14: 8}
Did not match all atoms present	66276-83-3	C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC4=C(C=C3)C5=NC6=NC(=NC7=C8C=CC(=CC8=C([N-]7)N=C9C1=CC(=C(C=C1C(=N9)N=C4[N-]5)CN1C(=O)C2=CC=CC=C2C1=O)CN1C(=O)C2=CC=CC=C2C1=O)CN1C(=O)C2=CC=CC=C2C1=O)C1=C6C=CC=C1CN1C(=O)C2=CC=CC=C2C1=O.[Cu+2]	{25: 10, 2: 5, 35: 8, 14: 31, 33: 5}
Did not match all atoms present	66276-87-7	CCCCCCCCCCOC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl	{1: 1, 2: 14, 33: 1, 14: 4, 17: 2, 28: 1}
Did not match all atoms present	6628-04-2	CC1=NC2=CC=CC=C2C(=C1)N	{1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	6628-06-4	CC1=CC(=C(C=C1)O)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 3, 21: 1}
Did not match all atoms present	6628-28-0	CCOC1=CC2=C(C=C1)N=C(C=C2)C	{1: 2, 2: 1, 35: 1, 22: 1, 14: 5}
Did not match all atoms present	6628-77-9	COC1=NC=C(C=C1)N	{1: 1, 30: 1, 35: 1, 22: 1, 14: 3}
Did not match all atoms present	6628-97-3	C1=CC=C(C=C1)NC2=CC(=O)C3=CC=CC=C3C2=O	{25: 2, 31: 1, 14: 10, 15: 1}
Did not match all atoms present	6628-98-4	C1CC2=CC=CC3=C2C4=C(C=CC=C41)C=C3	{11: 2, 14: 8}
Did not match all atoms present	66286-21-3	CC(=O)C1=CC(=C(C(=C1F)F)F)F	{16: 4, 1: 1, 14: 1, 24: 1}
Did not match all atoms present	6629-10-3	C1=CC=C(C=C1)C=NNC(=O)C(=O)NN=CC2=CC=CC=C2	{24: 2, 34: 2, 14: 10, 6: 2, 31: 2}
Did not match all atoms present	6629-29-4	CC1=C(C=C(C=C1[N+](=O)[O-])N)N	{1: 1, 38: 1, 30: 2, 14: 2}
Did not match all atoms present	6629-80-7	C1=CC=C(C=C1)C2NC(=O)C3=CC=CC=C3O2	{32: 1, 25: 1, 12: 1, 14: 9, 23: 1}
Did not match all atoms present	6629-83-0	CC1=CC=C(C=C1)C=C(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C	{1: 3, 14: 12, 6: 1, 7: 1}
Did not match all atoms present	66291-32-5	CC1=CC2=C(C=C1)C=C(C3=CC=CC=C32)C	{1: 2, 14: 8}
Did not match all atoms present	66291-34-7	CC1=CC=CC2=C1C3=CC=CC=C3C(=C2)C	{1: 2, 14: 8}
Did not match all atoms present	66292-05-5	CCCCCCCCCCC1CC2=CC=CC=C2C1	{1: 1, 2: 9, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	6630-01-9	CCC1=CC(=CC(=C1)C)C(C)(C)C	{1: 5, 2: 1, 4: 1, 14: 3}
Did not match all atoms present	6630-18-8	COC1=CC=C(C=C1)OCC2=CC=CC=C2	{1: 1, 2: 1, 22: 2, 14: 9}
Did not match all atoms present	6630-33-7	C1=CC=C(C(=C1)C=O)Br	{18: 1, 26: 1, 14: 4}
Did not match all atoms present	6630-65-5	C1=CC=C2C(=C1)C(C3=CC=CC=C32)Cl	{17: 1, 12: 1, 14: 8}
Did not match all atoms present	6630-86-0	C1=CC=C(C=C1)C(=NNC2=CC=CC=C2)C(=O)C3=CC=CC=C3	{24: 1, 34: 1, 31: 1, 14: 15, 7: 1}
Did not match all atoms present	6630-99-5	C1(=NN=NS1)N	{41: 1, 35: 3, 30: 1}
Did not match all atoms present	66304-04-9	CCCCCOC(=O)C1=CC=CC=C1N(C)C	{1: 3, 2: 4, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	66304-05-0	C1=CC(=C2C(=C1NO)C(=O)C3=C(C=CC(=C3C2=O)NO)O)O	{25: 2, 20: 2, 21: 2, 14: 4, 31: 2}
Did not match all atoms present	66304-06-1	C1=CC(=C2C(=C1NO)C(=O)C3=C(C=CC(=C3C2=O)O)NO)O	{25: 2, 20: 2, 21: 2, 14: 4, 31: 2}
Did not match all atoms present	66304-07-2	C1=CC(=C2C(=C1N(CO)O)C(=O)C3=C(C=CC(=C3C2=O)N(CO)O)O)O	{33: 2, 2: 2, 14: 4, 20: 4, 21: 2, 25: 2}
Did not match all atoms present	66304-08-3	C1=CC(=C2C(=C1N(CO)O)C(=O)C3=C(C=CC(=C3C2=O)O)N(CO)O)O	{33: 2, 2: 2, 14: 4, 20: 4, 21: 2, 25: 2}
Did not match all atoms present	66309-69-1	CN(C)CCN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)CC4=CSC(=N4)N)SC2)C(=O)O.Cl.Cl	{1: 2, 2: 4, 35: 4, 33: 3, 40: 1, 41: 2, 11: 1, 12: 2, 14: 1, 15: 2, 17: 2, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	6631-89-6	CC(C)(C)C1=NN(C(=O)C1)C2=CC=CC=C2	{1: 3, 35: 1, 4: 1, 33: 1, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	6631-94-3	CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2	{24: 1, 1: 1, 41: 1, 14: 7, 32: 1}
Did not match all atoms present	66319-61-7	C1=CC(=CC=C1CC2=CC=C(C=C2)[NH-])N.C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O.[NH4+]	{2: 1, 36: 1, 14: 14, 24: 1, 28: 4, 30: 1}
Did not match all atoms present	6632-39-9	C1=CC(=CC=C1NNC=O)[N+](=O)[O-]	{26: 1, 38: 1, 14: 4, 31: 2}
Did not match all atoms present	6632-44-6	CC1=CC(=C(C=C1)C)S(=O)(=O)C2=C(C=CC(=C2)C)C	{1: 4, 29: 2, 14: 6}
Did not match all atoms present	6632-68-4	CN1C(=C(C(=O)N(C1=O)C)N=O)N	{1: 2, 34: 1, 33: 2, 25: 2, 29: 1, 30: 1}
Did not match all atoms present	6632-71-9	CC12C3C(C(=O)OC3=O)C(C4=CC=CC=C41)(C5=C2C=CC6=CC=CC=C65)C	{1: 2, 12: 2, 13: 2, 14: 10, 28: 2}
Did not match all atoms present	66325-11-9	CCCCCCC1=CC2=C(CCCC2)C=C1	{1: 1, 2: 5, 11: 4, 14: 3}
Did not match all atoms present	66325-42-6	CCCCC1=CC=CC2=C1CCCC2	{1: 1, 2: 3, 11: 4, 14: 3}
Did not match all atoms present	66326-15-6	CCCCCCCCCCCCCCCCCCCCOC=O	{1: 1, 2: 19, 26: 1}
Did not match all atoms present	66327-55-7	CCC(C)C1=C(C=CC2=C1C=C(C=C2)CC3=C(C=CC(=C3)S(=O)(=O)C4=CC=C(C=C4)O)O)S(=O)(=O)[O-].[NH4+]	{1: 2, 2: 2, 3: 1, 14: 12, 21: 2, 29: 5}
Did not match all atoms present	66327-56-8	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC3=C(C4=C(C(=C3)[O-])C(=O)C5=CC=CC=C5C4=O)N.[Na+]	{1: 2, 4: 1, 14: 14, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	6633-63-2	CCCCCCCCCCCCCCCCNC1=CC=CC=C1	{1: 1, 2: 15, 14: 5, 31: 1}
Did not match all atoms present	66332-96-5	CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F	{1: 2, 3: 1, 4: 1, 14: 8, 16: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	66337-79-9	[B-](F)(F)(F)F.CN(C)C1=C(C=C(C(=C1)OC)[N+]#N)OC	{1: 4, 34: 1, 33: 1, 14: 2, 16: 4, 22: 2}
Did not match all atoms present	6634-01-1	CCOC(=O)C1=CC(=C(C=C1C(=O)OCC)C(=O)OCC)C(=O)OCC	{1: 4, 2: 4, 28: 4, 14: 2}
Did not match all atoms present	6634-82-8	C1=CC(=C(C=C1N)S(=O)(=O)[O-])C=CC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 38: 1, 14: 6, 6: 2, 29: 6}
Did not match all atoms present	66346-01-8	CC(C)(C)C(=O)CCC1=CC=C(C=C1)Cl	{1: 3, 2: 2, 4: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	66348-15-0	C(F)(F)(F)[GeH2]C(F)(F)F	{16: 6, 4: 2}
Did not match all atoms present	66348-17-2	C(F)(F)(F)[Ge](C(F)(F)F)(C(F)(F)F)Cl	{16: 9, 17: 1, 4: 3}
Did not match all atoms present	66348-18-3	C(F)(F)(F)[Ge](C(F)(F)F)(C(F)(F)F)I	{16: 9, 19: 1, 4: 3}
Did not match all atoms present	66348-19-4	C[Ge](C(F)(F)F)(C(F)(F)F)C(F)(F)F	{16: 9, 1: 1, 4: 3}
Did not match all atoms present	66348-20-7	C[Ge](C)(C(F)(F)F)C(F)(F)F	{16: 6, 1: 2, 4: 2}
Did not match all atoms present	66349-80-2	CC(C)C1=[C-]CC=C1.CC(C)C1=[C-]CC=C1.[Cl-].[Cl-].[Hf+4]	{1: 4, 3: 2, 11: 2, 14: 4, 15: 2, 17: 2}
Did not match all atoms present	6635-20-7	COC1=CC(=CC(=C1O)[N+](=O)[O-])C=O	{1: 1, 38: 1, 14: 2, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	6635-41-2	C1=CC=C(C(=C1)C=NO)[N+](=O)[O-]	{34: 1, 38: 1, 20: 1, 14: 4, 6: 1}
Did not match all atoms present	6635-54-7	C1=CC=C(C=C1)C(=O)C2=NO[N+](=C2C(=O)C3=CC=CC=C3)[O-]	{24: 2, 33: 1, 35: 1, 14: 10, 23: 1}
Did not match all atoms present	6635-86-5	CC1=C(C(=NC=C1)N)[N+](=O)[O-]	{38: 1, 1: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	66357-35-5	CN/C(=C\[N+](=O)[O-])/NCCSCC1=CC=C(O1)CN(C)C	{1: 3, 2: 4, 33: 1, 6: 1, 7: 1, 40: 1, 14: 2, 23: 1, 38: 1, 31: 2}
Did not match all atoms present	6636-32-4	CC1(C2=CC=CC=C2N=C1C3=CC=CC=C3)C	{1: 2, 35: 1, 13: 1, 14: 9, 15: 1}
Did not match all atoms present	6636-71-1	C1=CC=NC(=C1)CNCCO	{2: 3, 35: 1, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	6636-78-8	C1=CC(=C(N=C1)Cl)O	{17: 1, 35: 1, 21: 1, 14: 3}
Did not match all atoms present	66363-02-8	CC(C)[Sn](C)(C)C(C)C	{1: 6, 3: 2}
Did not match all atoms present	66365-05-7	CC(C)(C)[Si](C)(C)N(C)C	{1: 7, 4: 1, 33: 1}
Did not match all atoms present	6637-87-2	C1=CC(=CC=C1N=NC2=C(C(=CC(=C2O)N=NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C=C4O)S(=O)(=O)O)N=NC5=CC(=CC(=C5O)[N+](=O)[O-])[N+](=O)[O-])O)[N+](=O)[O-]	{34: 6, 38: 3, 14: 11, 20: 2, 21: 4, 29: 4}
Did not match all atoms present	6637-88-3	CC1=CC(=C(C(=C1N)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-])C)C)N)S(=O)(=O)[O-].[Na+].[Na+]	{1: 3, 34: 3, 14: 10, 15: 2, 24: 1, 25: 1, 29: 3, 30: 2, 31: 1}
Did not match all atoms present	66375-39-1	CCCCC1=CC=CC2=C1C=CC=C2S(=O)(=O)O.C(CO)N	{1: 1, 2: 5, 14: 6, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	66375-40-4	C1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=C(C=C2)[N+]#N)S(=O)(=O)[O-]	{34: 3, 29: 3, 14: 10}
Did not match all atoms present	66376-36-1	C(CC(O)(P(=O)(O)O)P(=O)(O)O)CN	{20: 5, 2: 3, 4: 1, 29: 2, 30: 1}
Did not match all atoms present	6638-05-7	CC1=CC(=C(C(=C1)OC)O)OC	{1: 3, 22: 2, 21: 1, 14: 2}
Did not match all atoms present	6638-14-8	C1=CC=C2C(=C1)C=CC(=C2CNC3=CC=C(C=C3)Br)O	{2: 1, 31: 1, 18: 1, 14: 10, 21: 1}
Did not match all atoms present	6638-64-8	C1=CC=C2C(=C1)C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O	{28: 1, 38: 1, 14: 7}
Did not match all atoms present	6639-06-1	C1=CC=C2C(=C1)C=CN2CCC(=O)O	{33: 1, 2: 2, 27: 1, 14: 6}
Did not match all atoms present	6639-30-1	CC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 14: 2, 17: 3}
Did not match all atoms present	6639-32-3	CN(C)C(=O)OC1=C(C=C(C=C1)Cl)Cl	{1: 2, 28: 1, 33: 1, 14: 3, 17: 2}
Did not match all atoms present	6639-36-7	C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)[N+](=O)[O-]	{41: 1, 38: 1, 14: 7}
Did not match all atoms present	6639-47-0	CC1=CC=C(C=C1)N2CN(CN(C2)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C	{1: 3, 11: 3, 14: 12, 33: 3}
Did not match all atoms present	6639-55-0	C1=CC(=C(C=C1Cl)NC=O)Cl	{17: 2, 26: 1, 14: 3, 31: 1}
Did not match all atoms present	6639-79-8	C1=CC2=C(C=C1Cl)NC(=O)C(=O)N2	{32: 2, 17: 1, 14: 3, 25: 2}
Did not match all atoms present	6639-82-3	COC1=CC2=NC=CN=C2C=C1	{1: 1, 35: 2, 22: 1, 14: 5}
Did not match all atoms present	6639-86-7	CC1=C[N+](=O)C2=CC=CC=C2N1[O-]	{1: 1, 29: 2, 14: 5, 33: 2}
Did not match all atoms present	6639-99-2	CC12CCC3=C(C1CCC2O)C=CC4=C3C=CC(=C4)O	{1: 1, 11: 4, 12: 2, 13: 1, 14: 5, 20: 1, 21: 1}
Did not match all atoms present	66392-83-4	C1=CC(=CC=C1OP(=O)(CCl)OC2=CC=C(C=C2)Cl)Cl	{17: 3, 2: 1, 22: 2, 14: 8, 29: 1}
Did not match all atoms present	66398-63-8	CC1=CC=C(C=C1)S(=O)(=O)OCCN(C)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 14: 4, 22: 1, 29: 3}
Did not match all atoms present	664-95-9	CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2CCCCC2	{1: 1, 11: 5, 12: 1, 14: 4, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	6640-03-5	CCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCC	{1: 2, 2: 26, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	6640-09-1	C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC(=C3)C(=O)O	{32: 1, 2: 1, 27: 1, 22: 1, 14: 9}
Did not match all atoms present	6640-22-8	C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)[O-])[O-])C(=O)O.[Na+].[Na+]	{2: 1, 27: 2, 14: 10}
Did not match all atoms present	6640-24-0	C1CN(CCN1)C2=CC(=CC=C2)Cl	{32: 1, 17: 1, 11: 4, 14: 4, 33: 1}
Did not match all atoms present	6640-25-1	C1CC1C(=O)C2=CC=C(C=C2)Cl	{24: 1, 17: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	6640-27-3	CC1=CC(=C(C=C1)O)Cl	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	6640-77-3	CCCCOC(=O)C1=CC(=CC=C1)C	{1: 2, 2: 3, 28: 1, 14: 4}
Did not match all atoms present	6640-78-4	CC1=CC=CC(=C1)C(=O)OCC(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	66407-59-8	CCC1(COC2(CC(NC(C2)(C)C)(C)C)OC1)C3C4(CCC(CC4)OC5CCC(CC5)C(C)C)C(=O)C6(CCC(CC6)OC7CCC(CC7)C(C)C)C(OC(=O)O3)C8(COC9(CC(NC(C9)(C)C)(C)C)OC8)CC	{32: 2, 1: 14, 2: 2, 3: 2, 11: 24, 12: 8, 13: 10, 22: 2, 23: 4, 25: 1}
Did not match all atoms present	6641-64-1	C1=C(C(=CC(=C1Cl)Cl)[N+](=O)[O-])N	{17: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	66419-71-4	[Na].[Na].[Na].[Na].[K]	{}
Did not match all atoms present	6642-25-7	C/C(=N/NC1=NC=NC2=C1NC=N2)/C(=O)O	{32: 1, 1: 1, 34: 1, 35: 3, 7: 1, 14: 2, 27: 1, 31: 1}
Did not match all atoms present	6642-26-8	C1=C2C(=NC=N1)N=C(N2)CO	{32: 1, 2: 1, 35: 3, 20: 1, 14: 2}
Did not match all atoms present	6642-31-5	CN1C(=CC(=O)N(C1=O)C)N	{1: 2, 33: 2, 30: 1, 14: 1, 25: 2}
Did not match all atoms present	66422-95-5	C1=CC(=C(C=C1N)N)OCCO.Cl.Cl	{2: 2, 14: 3, 17: 2, 20: 1, 22: 1, 30: 2}
Did not match all atoms present	66441-11-0	CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(S2)C=C(C=C3)Cl	{1: 2, 2: 1, 3: 1, 41: 1, 14: 7, 17: 1, 35: 1, 22: 2, 28: 1}
Did not match all atoms present	66441-23-4	CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC3=C(O2)C=C(C=C3)Cl	{1: 2, 2: 1, 3: 1, 14: 7, 17: 1, 35: 1, 22: 2, 23: 1, 28: 1}
Did not match all atoms present	6645-46-1	C[N+](C)(C)C[C@@H](CC(=O)O)O.[Cl-]	{1: 3, 2: 2, 3: 1, 17: 1, 20: 1, 27: 1}
Did not match all atoms present	66455-49-0	CCCCCCCCCCCCCCCCCCCOC=O	{1: 1, 2: 18, 26: 1}
Did not match all atoms present	66468-24-4	[Fe+2].[Fe+2].[Br-].[Br-].[Br-].[Br-]	{18: 4}
Did not match all atoms present	66469-15-6	CC(C)CCCCCCCCCCCCCCC(=O)[O-].[K+]	{24: 1, 1: 2, 2: 14, 3: 1}
Did not match all atoms present	66469-86-1	CCOC(=O)CC1=C(C=CC(=C1)OC)OC	{1: 3, 2: 2, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	6647-34-3	CN(C)CCCN1C(=O)C2=C(C3=C(C(=C2C1=O)N)C(=O)C4=CC=CC=C4C3=O)N	{1: 2, 2: 3, 33: 2, 14: 4, 25: 4, 30: 2}
Did not match all atoms present	66470-81-3	C(C(F)(F)F)(C(F)(F)F)OP(OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F	{16: 18, 3: 3, 4: 6, 22: 3}
Did not match all atoms present	66471-17-8	CC1=CC=CC(=C1)C2=C\3C(=CC=C2)N=C(/C3=C\NNC(=S)N)C4=CC(=CC=C4)N	{1: 1, 35: 1, 6: 1, 7: 1, 14: 11, 15: 2, 30: 2, 31: 2}
Did not match all atoms present	66472-85-3	CC(=O)[Se]C1=CC=CC=C1C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4}
Did not match all atoms present	66472-86-4	B(C1=CC(=CC=C1)N)(O)O.B(C1=CC(=CC=C1)N)(O)O.OS(=O)(=O)O	{30: 2, 20: 6, 29: 2, 14: 8}
Did not match all atoms present	6648-62-0	CN(C)S(=O)(=O)OC1=CC=CC(=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O	{1: 2, 33: 1, 14: 10, 21: 1, 22: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	66486-30-4	C1=CC=C2C(=C1)C(=O)OC2=O.C(CO)O.C(C(CO)O)O	{28: 2, 2: 4, 3: 1, 20: 5, 14: 4}
Did not match all atoms present	66498-59-7	CCOP(=O)(/C=C/CBr)OCC	{1: 2, 2: 3, 6: 2, 18: 1, 22: 2, 29: 1}
Did not match all atoms present	66499-61-4	C1=CC(=C(C=C1[Hg]C2=CC(=C(C=C2)O)[N+](=O)[O-])[N+](=O)[O-])O	{38: 2, 21: 2, 14: 6}
Did not match all atoms present	665-03-2	CCP(=O)(OC)F	{16: 1, 1: 2, 2: 1, 29: 1, 22: 1}
Did not match all atoms present	665-46-3	CC[N+](CC)(CC)CC.[F-]	{16: 1, 1: 4, 2: 4}
Did not match all atoms present	665-98-5	C(C[Si](CCC(F)(F)F)(Cl)Cl)C(F)(F)F	{16: 6, 17: 2, 2: 4, 4: 2}
Did not match all atoms present	66502-42-9	CCCCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Ag+]	{24: 1, 1: 1, 2: 22}
Did not match all atoms present	6651-25-8	CCCCCCCCCCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 63}
Did not match all atoms present	6651-26-9	CCCCCCCCCCCCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 69}
Did not match all atoms present	6651-27-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 81}
Did not match all atoms present	6651-34-9	CC(=CO[Si](C)(C)C)C	{1: 5, 22: 1, 6: 1, 7: 1}
Did not match all atoms present	6651-36-1	C[Si](C)(C)OC1=CCCCC1	{1: 3, 11: 4, 22: 1, 14: 1, 15: 1}
Did not match all atoms present	6651-43-0	C[Si](C)(C)OC=CC=C	{1: 3, 22: 1, 5: 1, 6: 3}
Did not match all atoms present	6652-04-6	C1CN(CCC1C2=CC=CC=C2)N=O	{33: 1, 34: 1, 11: 4, 12: 1, 14: 5, 29: 1}
Did not match all atoms present	6652-28-4	CC(C)OC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 2, 3: 2, 22: 1, 14: 10}
Did not match all atoms present	6652-32-0	COC1=CC(=CC(=C1)CCl)OC	{1: 2, 2: 1, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	66530-85-6	[Ag].[Ag].[Ag].[Au]	{}
Did not match all atoms present	66530-94-7	[Ag].[Au].[Au]	{}
Did not match all atoms present	66535-86-2	C1=CC=C2C(=C1)C=CN3C2=NC(=N3)C4=CC=C(C=C4)Cl	{17: 1, 35: 2, 14: 10, 33: 1}
Did not match all atoms present	6654-64-4	C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{20: 3, 29: 6, 14: 5}
Did not match all atoms present	66547-10-2	CC1C2CC(C(/C=C/C=C(CC3=CC(=C(C(=C3)OC)Cl)N(C(=O)CC(C4(C1O4)C)OC(=O)CC(C)C)C)C)OC)(NC(=O)O2)O	{32: 1, 1: 8, 2: 1, 3: 1, 33: 1, 11: 3, 12: 5, 13: 2, 14: 5, 15: 1, 17: 1, 20: 1, 22: 2, 23: 1, 25: 1, 28: 2}
Did not match all atoms present	6655-25-0	CCCS(=O)(=O)NC1=CC=CC=C1	{1: 1, 2: 2, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	6655-72-7	C1=C(C(=CC(=C1Cl)Cl)Cl)S(=O)(=O)NN	{17: 3, 30: 1, 29: 2, 14: 2, 31: 1}
Did not match all atoms present	66552-77-0	CC1=CC2=C(C3=CC=CC=C3C(=C2C=C1C)C)C	{1: 4, 14: 6}
Did not match all atoms present	66558-73-4	CCN(CC)O[Si]1(O[Si](O[Si](O[Si](O1)(C)ON(CC)CC)(C)ON(CC)CC)(C)C)C	{1: 11, 2: 6, 33: 3, 22: 3, 23: 4}
Did not match all atoms present	6656-49-1	CC1=C(C=CC=C1[N+](=O)[O-])C(F)(F)F	{16: 3, 1: 1, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	6657-40-5	CCN(CCO)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl	{1: 1, 2: 3, 38: 1, 33: 1, 34: 2, 14: 6, 17: 2, 20: 1}
Did not match all atoms present	66574-84-3	CC(=O)NC(CC1=CC=CC=C1F)C(=O)O	{1: 1, 2: 1, 3: 1, 14: 4, 16: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	66577-03-5	CCC1=CSC=C1C	{1: 2, 2: 1, 14: 2, 41: 1}
Did not match all atoms present	66577-17-1	CC1=CC2=C(C=CC=C2C(C)C)C=C1	{1: 3, 3: 1, 14: 6}
Did not match all atoms present	66577-20-6	CC1=CC2=CC(=C(C(=C2C=C1)C)C)C	{1: 4, 14: 4}
Did not match all atoms present	66577-21-7	CC1=CC2=C(C=C1)C(=C(C=C2C)C)C	{1: 4, 14: 4}
Did not match all atoms present	66577-37-5	CCC1=CC2=C(C=CC=C2CC)C=C1	{1: 2, 2: 2, 14: 6}
Did not match all atoms present	66582-10-3	[C-]#CCC1=CC=CC=C1.[C-]#CCC1=CC=CC=C1.[Cu+2]	{2: 2, 10: 2, 14: 10}
Did not match all atoms present	6659-60-5	C(CO[N+](=O)[O-])C(CO[N+](=O)[O-])O[N+](=O)[O-]	{2: 3, 3: 1, 22: 3}
Did not match all atoms present	6659-62-7	C1C(O1)CO[N+](=O)[O-]	{2: 1, 11: 1, 12: 1, 22: 1, 23: 1}
Did not match all atoms present	66591-60-4	C1(=NNN=N1)N=C(N)N	{32: 1, 34: 1, 35: 3, 30: 2, 7: 1}
Did not match all atoms present	666-52-4	[2H]C([2H])([2H])C(=O)C([2H])([2H])[2H]	{24: 1, 1: 2}
Did not match all atoms present	666-62-6	CP(C)P(C(F)(F)F)C(F)(F)F	{16: 6, 1: 2, 4: 2}
Did not match all atoms present	66605-57-0	CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)CO	{1: 3, 2: 2, 3: 1, 4: 1, 14: 5, 20: 1, 28: 1, 31: 1}
Did not match all atoms present	66609-02-7	CCC1=C(C(=CC=C1)C(C)CC)N=C=S	{1: 3, 2: 2, 3: 1, 8: 1, 34: 1, 14: 3}
Did not match all atoms present	66609-04-9	CCC1=CC=CC(=C1N=C=S)C	{8: 1, 1: 2, 2: 1, 34: 1, 14: 3}
Did not match all atoms present	6661-29-6	C1=CC=C(C=C1)NC2=CC3=C(C=C2)C(=O)/C(=N/NC4=C(C=C(C=C4)NC(=O)NC5=CC(=C(C=C5)N/N=C\6/C(=CC7=C(C6=O)C=CC(=C7)NC8=CC=CC=C8)S(=O)(=O)[O-])C(=O)[O-])C(=O)[O-])/C(=C3)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 24, 15: 4, 24: 3, 25: 2, 29: 6, 31: 6}
Did not match all atoms present	6661-46-7	C1=CC=C(C=C1)C2=NC3=CC4=C(C=C3C(=N2)NC5=C6C(=C7C(=C5)C(=O)C8=CC=CC=C8C7=O)NC9=C(C6=O)C=C(C=C9)Cl)C(=O)C1=CC=CC=C1C4=O	{32: 1, 35: 2, 14: 19, 17: 1, 25: 5, 31: 1}
Did not match all atoms present	6661-54-7	CCCCOCCOS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 5, 22: 2, 14: 4, 29: 2}
Did not match all atoms present	66620-31-3	CC1=CC(=C(C(=C1)C=O)O)[N+](=O)[O-]	{1: 1, 26: 1, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	66620-37-9	C1=CC(=C(C=C1N)S(=O)(=O)O)NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=C(C=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 3, 14: 8, 15: 2, 20: 4, 25: 1, 29: 8, 30: 3, 31: 1}
Did not match all atoms present	6665-83-4	C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC(=C3)O	{25: 1, 21: 1, 14: 9, 23: 1}
Did not match all atoms present	6665-86-7	C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)O	{25: 1, 21: 1, 14: 9, 23: 1}
Did not match all atoms present	66669-53-2	C(CC(CC(=O)O)(C(=O)[O-])P(=O)([O-])[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 2, 2: 3, 27: 1, 4: 1, 29: 3}
Did not match all atoms present	6667-73-8	CC[N+](CC)(CC)CC.CC[N+](CC)(CC)CC.Cl[Mn-2](Cl)(Cl)Cl	{1: 8, 2: 8, 17: 4}
Did not match all atoms present	6667-75-0	CC[N+](CC)(CC)CC.CC[N+](CC)(CC)CC.Cl[Co-2](Cl)(Cl)Cl	{1: 8, 2: 8, 17: 4}
Did not match all atoms present	66671-22-5	CC(C)(COC(=O)C=C)COC(=O)C1=CC=CC=C1	{1: 2, 2: 2, 4: 1, 5: 1, 6: 1, 14: 5, 28: 2}
Did not match all atoms present	66671-82-7	COC1=C(C=CC(=C1)N)N.OS(=O)(=O)O	{1: 1, 14: 3, 20: 2, 22: 1, 29: 2, 30: 2}
Did not match all atoms present	66671-91-8	CCCCC(C)NC1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])[N+](=O)[O-])OC	{1: 4, 2: 3, 3: 1, 37: 1, 38: 2, 34: 2, 14: 4, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	6668-20-8	CC1=C(C(=C(C(=C1C)CC(C)(C)C)CC(C)(C)C)C)C	{1: 10, 2: 2, 4: 2}
Did not match all atoms present	6669-01-8	C(CBr)OC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 2: 2, 18: 1, 22: 1}
Did not match all atoms present	6669-13-2	CC(C)(C)OC1=CC=CC=C1	{1: 3, 4: 1, 22: 1, 14: 5}
Did not match all atoms present	667-91-4	C1=CC=C(C=C1)C(=C2C3=CC=CC=C3C(=O)C4=CC=CC=C42)C5=CC=CC=C5	{25: 1, 15: 1, 14: 18, 7: 1}
Did not match all atoms present	6670-13-9	C1=CC=C(C=C1)C2=C(OC(=S)N2)C3=CC=CC=C3	{32: 1, 14: 10, 23: 1}
Did not match all atoms present	6670-14-0	CC1=C(OC(=S)N1)C	{32: 1, 1: 2, 23: 1}
Did not match all atoms present	66700-40-1	COC1=CC=CC=C1C=C(C#N)C2=NC3=CC=CC=C3N2	{32: 1, 1: 1, 35: 1, 37: 1, 6: 1, 7: 1, 14: 8, 22: 1}
Did not match all atoms present	6671-49-4	C1=CC(=C(C=C1S(=O)(=O)[O-])[N+](=O)[O-])Cl.[K+]	{17: 1, 38: 1, 29: 3, 14: 3}
Did not match all atoms present	66723-45-3	C#C[N+]#[C-]	{9: 1, 10: 1, 34: 1}
Did not match all atoms present	6673-35-4	CC(C)NCC(COC1=CC=C(C=C1)NC(=O)C)O	{1: 3, 2: 2, 3: 2, 14: 4, 20: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	66737-21-1	CC[Si]1(C(SC1C)C)CC	{1: 4, 2: 2, 12: 2, 41: 1}
Did not match all atoms present	66747-18-0	COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC.COC(=O)C1=CC=C(C=C1)C(=O)OC.C(CO)O	{1: 4, 2: 2, 20: 2, 14: 12, 28: 4}
Did not match all atoms present	66750-10-5	C1COCCOCCOCCOCCN1C2=CC=CC=C2	{33: 1, 11: 10, 14: 5, 23: 4}
Did not match all atoms present	66755-08-6	CCN(CC[N+](C)(C)CCCN)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)SSC3=CC=C(C=C3)N=NC4=CC=C(C=C4)N(CC)CC[N+](C)(C)CCCN.[Cl-].[Cl-]	{1: 6, 2: 12, 33: 2, 40: 2, 34: 4, 14: 16, 17: 2, 30: 2}
Did not match all atoms present	66771-03-7	[Cu].[Cu].[Cu]	{}
Did not match all atoms present	66787-20-0	C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.C(CCCC(=O)O)CCCC(=O)O.C(CCC(=O)O)CC(=O)O	{2: 12, 27: 4, 30: 2, 14: 8}
Did not match all atoms present	66788-01-0	C1CC2=C(C=C1)C3=CC=CC4=C3C5=C(C=CC=C25)C=C4	{11: 2, 14: 10}
Did not match all atoms present	66788-03-2	C1CC2=C(C(C1O)O)C3=CC=CC4=C3C5=C(C=CC=C25)C=C4	{20: 2, 11: 2, 12: 2, 14: 8}
Did not match all atoms present	66788-06-5	C1=CC2=C3C(=C1)C4=C([C@H]([C@@H](C=C4)O)O)C5=CC=CC(=C53)C=C2	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	66788-11-2	C1CC2=C(C3C1O3)C4=CC=CC5=C4C6=C(C=CC=C26)C=C5	{11: 2, 12: 2, 14: 8, 23: 1}
Did not match all atoms present	66788-41-8	C[C@@H]([C@@H](C1=CC=CC=C1)O)NCC=C(C2=CSC=C2)C3=CSC=C3	{1: 1, 2: 1, 3: 2, 6: 1, 7: 1, 41: 2, 14: 11, 20: 1, 31: 1}
Did not match all atoms present	66789-14-8	CCC1(CC(C2=C(C1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)OC7C=CC(=O)C(O7)C)O)N(C)C)O	{1: 7, 2: 1, 33: 1, 11: 3, 12: 12, 13: 1, 14: 6, 20: 2, 21: 2, 22: 3, 23: 3, 25: 3, 28: 1}
Did not match all atoms present	66793-25-7	C=S(F)(F)(F)F	{16: 4, 5: 1}
Did not match all atoms present	66794-46-5	CC(C)C(C)OC=O	{1: 3, 26: 1, 3: 2}
Did not match all atoms present	66794-54-5	[Br-].[Br-].[Po]	{18: 2}
Did not match all atoms present	66794-75-0	CC(C)(C)CCCCCC(=O)OCC1=CC=CC=C1	{1: 3, 2: 6, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	668-37-1	CC[NH+](CC)CCOC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-]	{1: 2, 2: 4, 33: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	668-45-1	C1=CC(=C(C(=C1)Cl)C#N)F	{16: 1, 17: 1, 37: 1, 14: 3}
Did not match all atoms present	668-94-0	C1=CC=C(C=C1)C2=C(N=CN2)C3=CC=CC=C3	{32: 1, 35: 1, 14: 11}
Did not match all atoms present	66810-88-6	CCCCCCCCCCCCCCCCCCN(CCO)CC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 20, 20: 1, 33: 1}
Did not match all atoms present	66817-59-2	C[Si](C)O[Si](C1=CC=CC=C1)(O[Si](C)C)O[Si](C2=CC=CC=C2)(O[Si](C)C)O[Si](C)C	{1: 8, 22: 5, 14: 10}
Did not match all atoms present	6682-67-3	CC1=CC(=C(C2=C1CCC2(C)C)C)C	{1: 5, 11: 2, 13: 1, 14: 1}
Did not match all atoms present	6682-69-5	CC1=CC(=C2C(=C1)CCC2=O)C	{1: 2, 11: 2, 14: 2, 25: 1}
Did not match all atoms present	6682-71-9	CC1=C2CCCC2=C(C=C1)C	{1: 2, 11: 3, 14: 2}
Did not match all atoms present	66827-21-2	CC(C[N+](C)(C)C)N1C2=CC=CC=C2SC3=C1N=CC=C3.[Br-]	{1: 4, 2: 1, 3: 1, 33: 1, 41: 1, 14: 7, 18: 1, 35: 1}
Did not match all atoms present	66827-38-1	CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC=C(C=C2)OC3=CC=CC=C3	{1: 2, 3: 3, 37: 1, 14: 13, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	66827-45-0	CC(=O)OC(CN(C)C)C1=CC=CC=C1	{1: 3, 2: 1, 3: 1, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	66827-50-7	CC[NH+](CC)CC(C)(C)COC(=O)C(CC=C)C1CCCCC1.[Cl-]	{1: 4, 2: 5, 3: 1, 4: 1, 5: 1, 6: 1, 11: 5, 12: 1, 17: 1, 28: 1}
Did not match all atoms present	66827-74-5	C1=CC(=CC=C1[NH-])[N+](=O)[O-].C1=CC(=CC=C1[NH-])[N+](=O)[O-].[Hg+2]	{36: 2, 38: 2, 14: 8}
Did not match all atoms present	6683-19-8	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCC(COC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)(COC(=O)CCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)COC(=O)CCC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C	{1: 24, 2: 12, 4: 9, 14: 8, 21: 4, 28: 4}
Did not match all atoms present	6683-51-8	CC(=C)CCC1=CC=CC=C1	{1: 1, 2: 2, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	66836-92-8	CC(=C)C1=CC=CC=C1.CC(C)(C)C1=CC=CC=C1C=C.C[Si]1(O[Si](O[Si](O1)(C)C)(C)C)C	{1: 10, 4: 1, 5: 2, 6: 1, 7: 1, 14: 9, 23: 3}
Did not match all atoms present	66837-19-2	CCOC(=O)OCC.C(CCCCCO)CCCCO	{1: 2, 2: 12, 20: 2}
Did not match all atoms present	66839-97-2	C1CCN(C1)CC2=C(C=CC(=C2)C3=CC=CC=C3)O	{33: 1, 2: 1, 11: 4, 21: 1, 14: 8}
Did not match all atoms present	66839-98-3	COC1=C(C=C(C=C1)C2=CC=CC=C2)CN3CCCC3	{1: 1, 2: 1, 33: 1, 11: 4, 14: 8, 22: 1}
Did not match all atoms present	66841-25-6	CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C(C(Br)(Br)Br)Br)C	{1: 2, 3: 2, 4: 1, 37: 1, 12: 2, 13: 1, 14: 9, 18: 4, 22: 1, 28: 1}
Did not match all atoms present	66849-29-4	C[C@@H](C1=CC=CC=C1)NCCO	{1: 1, 2: 2, 3: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	66863-43-2	CC(C)(C)OC(=O)N1CC2=C(C[C@H]1C(=O)O)C3=CC=CC=C3N2	{32: 1, 1: 3, 4: 1, 33: 1, 11: 2, 12: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	66867-37-6	CC(CC1=CC=C(C=C1)C2CCCC2)C=O	{1: 1, 2: 1, 3: 1, 11: 4, 12: 1, 14: 4, 26: 1}
Did not match all atoms present	66874-45-1	B1(P(P1C(C)(C)C)C(C)(C)C)N(C(C)C)C(C)C	{1: 10, 3: 2, 4: 2, 33: 1}
Did not match all atoms present	66877-41-6	CC[C@H](C1=CC(=C(C=C1)O)N)[C@@H](CC)C2=CC(=C(C=C2)O)N	{1: 2, 2: 2, 3: 2, 14: 6, 21: 2, 30: 2}
Did not match all atoms present	6689-37-8	COC1=CC=CC=C1O[Si](C)(C)C	{1: 4, 22: 2, 14: 4}
Did not match all atoms present	6689-38-9	COC1=CC=C(C=C1)O[Si](C)(C)C	{1: 4, 22: 2, 14: 4}
Did not match all atoms present	6689-41-4	C/C=C/C1=CC(=C(C=C1)O[Si](C)(C)C)OC	{1: 5, 22: 2, 14: 3, 6: 2}
Did not match all atoms present	6689-43-6	COC1=C(C=CC(=C1)C=O)O[Si](C)(C)C	{1: 4, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	66892-34-0	C1COC2=C(C1=O)C=C(C=C2)F	{16: 1, 25: 1, 11: 2, 14: 3, 23: 1}
Did not match all atoms present	66898-39-3	CCC1=CC2=CC=CC=C2OC1=O	{1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	669-49-8	CC1=C(C(=CC=C1)C)OCC[N+](C)(C)C.[Br-]	{1: 5, 2: 2, 22: 1, 18: 1, 14: 3}
Did not match all atoms present	66902-62-3	COC1=C(C=CC(=C1)CC(C(=O)O)N)N(CCCl)CCCl	{1: 1, 2: 5, 3: 1, 33: 1, 14: 3, 17: 2, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	66902-65-6	CCCCCC[N+](C)(C)CC(C)C1=C2C=CC=CN2C(=C1C)C(=O)C.[Br-]	{1: 6, 2: 6, 3: 1, 33: 1, 14: 4, 18: 1, 24: 1}
Did not match all atoms present	66902-66-7	CCCCC[N+](C)(C)CC(C)C1=C2C=CC=CN2C(=C1C)C(=O)C.[Br-]	{1: 6, 2: 5, 3: 1, 33: 1, 14: 4, 18: 1, 24: 1}
Did not match all atoms present	66902-73-6	CCCC[N+](C)(C)CC(C)C1=C2C=CC=CN2C(=C1C)C(=O)C.[I-]	{1: 6, 2: 4, 3: 1, 33: 1, 14: 4, 19: 1, 24: 1}
Did not match all atoms present	66903-22-8	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)S(=O)(=O)NC4=CC=C(C=C4)N(CCC#N)CCC#N)O	{33: 1, 2: 4, 37: 2, 14: 10, 21: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	66904-99-2	B(=S)Br	{18: 1}
Did not match all atoms present	66907-70-8	C=CCNC1=NN=NN1CC=C	{33: 1, 2: 2, 35: 3, 5: 2, 6: 2, 31: 1}
Did not match all atoms present	66909-38-4	CC1=CC(=NC=C1N)Cl	{1: 1, 35: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	6692-85-9	CCCCCC1=CC2=C(C3CC(CCC3C(O2)(C)C)C)C(=C1)O	{1: 4, 2: 4, 11: 3, 12: 3, 13: 1, 14: 2, 21: 1, 23: 1}
Did not match all atoms present	66922-67-6	CCN(C1=CC=C(C=C1)OCC)C(=O)C	{1: 3, 2: 2, 33: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	66922-79-0	CC(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Sb+3]	{24: 4, 1: 1, 2: 5, 3: 1, 33: 2}
Did not match all atoms present	66931-57-5	C1C(O1)COCC2=CC=CC3=CC=CC=C32	{2: 2, 11: 1, 12: 1, 14: 7, 22: 1, 23: 1}
Did not match all atoms present	66938-39-4	COC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2F)[N+](=O)[O-]	{1: 1, 38: 1, 14: 7, 16: 1, 22: 1, 24: 1}
Did not match all atoms present	66938-41-8	COC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 7, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	66938-86-1	C1=CC(=CC=C1C(=O)C2=CC(=C(C=C2)N)N)F	{16: 1, 24: 1, 30: 2, 14: 7}
Did not match all atoms present	6694-64-0	C1=CC(=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=C(C=C3)NC(=O)C4=CC(=NN=C4Cl)Cl)S(=O)(=O)O)S(=O)(=O)O	{34: 1, 35: 2, 14: 9, 15: 2, 17: 2, 20: 2, 24: 1, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	66941-43-3	CC[N+](CC)(CC)CC(C)(C)COC(=O)C(CO)C1=CC=CC=C1.[Br-]	{1: 5, 2: 6, 3: 1, 4: 1, 14: 5, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	66941-48-8	CC(C1(C(=O)NC(=NC1=O)[O-])CC=C)SCC=C.[Na+]	{32: 1, 1: 1, 2: 2, 3: 1, 5: 2, 6: 2, 40: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	66941-49-9	C/C=C/CC1(C(=O)NC(=NC1=O)[S-])CC=C.[Na+]	{32: 1, 1: 1, 2: 2, 35: 1, 5: 1, 6: 3, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	66941-53-5	CCCCSC(C)C1(C(=O)NC(=NC1=O)[O-])CC=C.[Na+]	{32: 1, 1: 2, 2: 4, 3: 1, 5: 1, 6: 1, 40: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	66941-60-4	C=CCC1(C(=O)NC(=S)NC1=O)C2CCC=C2	{32: 2, 2: 1, 5: 1, 6: 1, 11: 2, 12: 1, 13: 1, 14: 2, 15: 1, 25: 2}
Did not match all atoms present	66941-77-3	CC(C=C)C1(C(=O)NC(=NC1=O)[S-])CC=C.[Na+]	{32: 1, 1: 1, 2: 1, 3: 1, 5: 2, 6: 2, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	66943-92-8	CC1=CC(=NC(=O)N1C)N	{1: 2, 35: 1, 33: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	66949-28-8	C1CCC(CC1)N=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{34: 1, 11: 5, 12: 1, 14: 15}
Did not match all atoms present	6696-58-8	C[N+]12CC[C@@]34[C@@H]1C[C@@H](/C(=C/CO)/C2)/C/5=C/N6[C@H]7/C(=C\N([C@@H]53)C8=CC=CC=C48)/[C@H]\9C[C@H]1[C@@]7(CC[N+]1(C/C9=C/CO)C)C1=CC=CC=C16.[Cl-]	{1: 2, 2: 2, 6: 2, 33: 2, 11: 8, 12: 6, 13: 2, 14: 10, 15: 4, 17: 1, 20: 2}
Did not match all atoms present	66964-37-2	CC1=C2C(=C(C3=CC=CC=C13)CSCCC(C(=O)O)N)C=CC4=CC=CC=C42	{1: 1, 2: 3, 3: 1, 40: 1, 14: 10, 27: 1, 30: 1}
Did not match all atoms present	66967-61-1	CC1=CC(=C(C=C1)C)[N+](C)(C)CC(C)C2=C3C=CC=CN3C(=C2C)C(=O)C.[Cl-]	{1: 7, 2: 1, 3: 1, 33: 1, 14: 7, 17: 1, 24: 1}
Did not match all atoms present	66967-65-5	CC[N+](C)(C)CCCN1C2=CC=CC=C2SC3=C1N=CC=C3.CCOS(=O)(=O)[O-]	{1: 4, 2: 5, 35: 1, 33: 1, 41: 1, 14: 7, 22: 1, 29: 3}
Did not match all atoms present	66967-84-8	C[N+](C)(C)CCC1=CC(=CC=C1)O.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 3, 2: 2, 38: 3, 21: 1, 14: 6}
Did not match all atoms present	66968-12-5	C1=CC=C(C(=C1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O	{2: 1, 3: 1, 14: 4, 24: 1, 27: 3, 31: 1}
Did not match all atoms present	66969-02-6	CN(C)CC12CC3CC(C1)CC(C3)C2Br.CN(C)CC12CC3CC(C1)CC(C3)C2Br.O.Cl.Cl	{1: 4, 2: 2, 33: 2, 11: 10, 12: 8, 13: 2, 17: 2, 18: 2}
Did not match all atoms present	6697-12-7	CCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 14, 14: 5}
Did not match all atoms present	6698-70-0	CC1=CC=C(C=C1)OCC(=O)C	{24: 1, 1: 2, 2: 1, 22: 1, 14: 4}
Did not match all atoms present	66982-95-4	CC(C)CCCCCCCCCCCCCCC(=O)O[Al]=O	{1: 2, 2: 14, 3: 1, 28: 1, 29: 1}
Did not match all atoms present	66998-67-2	C1=CC=C(C=C1)CS(=O)(=O)CCCl	{17: 1, 2: 3, 29: 2, 14: 5}
Did not match all atoms present	67-03-8	CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO	{1: 2, 2: 3, 35: 2, 33: 1, 41: 1, 14: 2, 20: 1, 30: 1}
Did not match all atoms present	67-04-9	CNCC(C1=CC=C(C=C1)O)O.C(C(C(=O)O)O)(C(=O)O)O	{1: 1, 2: 1, 3: 3, 14: 4, 20: 3, 21: 1, 27: 2, 31: 1}
Did not match all atoms present	67-16-3	CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCO)SSC(=C(C)N(CC2=CN=C(N=C2N)C)C=O)CCO)C	{1: 4, 2: 6, 35: 4, 33: 2, 7: 4, 40: 2, 14: 2, 20: 2, 26: 2, 30: 2}
Did not match all atoms present	67-20-9	C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)[N+](=O)[O-]	{32: 1, 33: 1, 34: 1, 38: 1, 6: 1, 11: 1, 14: 2, 23: 1, 25: 2}
Did not match all atoms present	67-36-7	C1=CC=C(C=C1)OC2=CC=C(C=C2)C=O	{26: 1, 22: 1, 14: 9}
Did not match all atoms present	67-45-8	C1COC(=O)N1/N=C/C2=CC=C(O2)[N+](=O)[O-]	{33: 1, 34: 1, 38: 1, 6: 1, 11: 2, 14: 2, 23: 1, 28: 1}
Did not match all atoms present	67-47-0	C1=C(OC(=C1)C=O)CO	{2: 1, 20: 1, 26: 1, 14: 2, 23: 1}
Did not match all atoms present	67-48-1	C[N+](C)(C)CCO.[Cl-]	{1: 3, 2: 2, 20: 1, 17: 1}
Did not match all atoms present	67-51-6	CC1=CC(=NN1)C	{32: 1, 1: 2, 35: 1, 14: 1}
Did not match all atoms present	67-68-5	CS(=O)C	{1: 2, 29: 1}
Did not match all atoms present	67-71-0	CS(=O)(=O)C	{1: 2, 29: 2}
Did not match all atoms present	67-98-1	CCN(CC)CCOC1=CC=C(C=C1)C(CC2=CC=C(C=C2)OC)(C3=CC=CC=C3)O	{1: 3, 2: 5, 4: 1, 33: 1, 14: 13, 20: 1, 22: 2}
Did not match all atoms present	670-40-6	C[C@H]([C@@H](C1=CC=CC=C1)O)NC.Cl	{1: 2, 3: 2, 14: 5, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	670-65-5	C1=C(N=C2C(=N1)NC(=NC2=O)N)C(C(CO)O)O	{32: 1, 2: 1, 3: 2, 14: 1, 35: 3, 20: 3, 25: 1, 30: 1}
Did not match all atoms present	670-95-1	C1=CC=C(C=C1)C2=CN=CN2	{32: 1, 35: 1, 14: 7}
Did not match all atoms present	670-96-2	C1=CC=C(C=C1)C2=NC=CN2	{32: 1, 35: 1, 14: 7}
Did not match all atoms present	670-98-4	COS(=O)C1=CC=CC=C1	{1: 1, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	6700-56-7	CCOC(=O)C1(CCCN(CC1)C)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 3, 4: 1, 33: 1, 11: 5, 13: 1, 14: 5, 20: 1, 27: 3, 28: 1}
Did not match all atoms present	67016-58-4	C=CCO.C=CC1=CC=CC=C1.C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O	{2: 1, 5: 2, 6: 2, 14: 8, 20: 1, 27: 3}
Did not match all atoms present	67026-18-0	C1CN1C2=NC(=NC(=N2)NC3(COC(OC3)C4=CC=CO4)CO)N5CC5	{33: 2, 2: 1, 35: 3, 11: 6, 12: 1, 13: 1, 14: 3, 20: 1, 23: 3, 31: 1}
Did not match all atoms present	67028-17-5	C1=CC2=C(C=C1Cl)OC3=CC(=CC(=C3O2)Cl)Cl	{17: 3, 14: 5, 23: 2}
Did not match all atoms present	6703-27-1	CC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)OC)CCN3C	{1: 3, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	6703-39-5	C1CN=C(N1)COC(C2=CC=CC=C2)C3=CC=CC=C3	{32: 1, 2: 1, 3: 1, 11: 2, 14: 10, 15: 1, 35: 1, 22: 1}
Did not match all atoms present	6703-78-2	CCCCCCCCCCC(=CCCCCCCCCC)C1=CC=CC=C1	{1: 2, 2: 17, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	67031-48-5	CN(C)CC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)N	{1: 2, 2: 1, 3: 1, 33: 1, 14: 9, 28: 1, 30: 1}
Did not match all atoms present	67032-45-5	CCCCOC1=CC=C(C=C1)C(=O)OCCC[NH+]2CCCCC2C.[Cl-]	{1: 2, 2: 6, 11: 4, 12: 1, 14: 4, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	67036-85-5	CC(=O)COC1=CC=C(C=C1)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N	{1: 1, 2: 1, 14: 9, 21: 1, 22: 2, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	6705-03-9	COC1=CC(=C(C=C1)N)C(=O)O	{1: 1, 30: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	6705-31-3	C1=CN=C(C=N1)CCO	{2: 2, 35: 2, 20: 1, 14: 3}
Did not match all atoms present	67050-00-4	CCC1(C(=O)NC(=NC1=O)[S-])C/C=C/C.[Na+]	{32: 1, 1: 2, 2: 2, 35: 1, 6: 2, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	67050-11-7	CCCC(C)C1(C(=O)NC(=NC1=O)[S-])C/C=C/C.[Na+]	{32: 1, 1: 3, 2: 3, 3: 1, 6: 2, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	67050-64-0	CCCCSC(C)C1(C(=O)NC(=NC1=O)[O-])CC.[Na+]	{32: 1, 1: 3, 2: 4, 3: 1, 40: 1, 13: 1, 15: 1, 35: 1, 25: 2}
Did not match all atoms present	67057-34-5	CCCCN(CCCC)C(=S)S[Sn](CCCC)(CCCC)CCCC	{40: 1, 1: 5, 2: 15, 33: 1, 7: 1}
Did not match all atoms present	67059-49-8	CCO[Si]1(CC=CC1)OCC	{1: 2, 2: 2, 11: 2, 22: 2, 14: 2}
Did not match all atoms present	67060-83-7	CCC(C)O[Si](C)(O[Si](OC(C)CC)(OC(C)CC)OC(C)CC)O[Si](OC(C)CC)(OC(C)CC)OC(C)CC	{1: 15, 2: 7, 3: 7, 22: 9}
Did not match all atoms present	6708-69-6	CC=NC1=NC(=NC(=N1)N)N=CC	{1: 2, 34: 2, 35: 3, 30: 1, 6: 2}
Did not match all atoms present	67081-95-2	COC1=CC=CC(=C1)CCCC2=CC=CC=C2	{1: 1, 2: 3, 22: 1, 14: 9}
Did not match all atoms present	67081-97-4	[2H]C([2H])([2H])OC1=CC=C(C=C1)CCCC2=CC(=CC=C2)OC	{1: 2, 2: 3, 22: 2, 14: 8}
Did not match all atoms present	6709-58-6	COC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)OC)[N+]#N	{1: 2, 34: 3, 38: 1, 14: 4, 17: 2, 22: 2}
Did not match all atoms present	671-16-9	CC(C)NC(=O)C1=CC=C(C=C1)CNNC	{1: 3, 2: 1, 3: 1, 14: 4, 24: 1, 31: 3}
Did not match all atoms present	671-35-2	C1=C(C(=O)NC=N1)F	{16: 1, 25: 1, 35: 1, 14: 2, 32: 1}
Did not match all atoms present	671-89-6	C1=C(C(=CC(=C1Cl)S(=O)(=O)Cl)S(=O)(=O)Cl)N	{17: 3, 30: 1, 29: 4, 14: 2}
Did not match all atoms present	6710-43-6	C1COC2(O1)C=CC3=CC=CC=C23	{11: 2, 13: 1, 14: 6, 23: 2}
Did not match all atoms present	67101-63-7	CCCCCCOC(=O)C1=CC(=CC=C1)C	{1: 2, 2: 5, 28: 1, 14: 4}
Did not match all atoms present	67109-90-4	C1CC2C1C3CC2C4=CC=CC=C34	{11: 3, 12: 4, 14: 4}
Did not match all atoms present	6711-19-9	[CH2-]C1=CC=CC=C1	{5: 1, 14: 5}
Did not match all atoms present	6711-46-2	CN(C)CCNC1=CC=CC=C1	{1: 2, 2: 2, 33: 1, 14: 5, 31: 1}
Did not match all atoms present	6711-89-3	CCOC(C[N+](C)(C)C)OCC.[I-]	{19: 1, 1: 5, 2: 3, 3: 1, 22: 2}
Did not match all atoms present	67110-84-3	CCN1CC[C@H]2[C@@H](C1)C3=C([C@@H]2C4=CC=C(C=C4)C)C=C(C=C3)C.Cl	{1: 3, 2: 1, 33: 1, 11: 3, 12: 3, 14: 7, 17: 1}
Did not match all atoms present	67114-26-5	CC(C)CC1(C(=O)NC(=O)[N-]C1=O)CSC.[Na+]	{32: 1, 1: 3, 2: 2, 3: 1, 40: 1, 13: 1, 35: 1, 25: 3}
Did not match all atoms present	67129-08-2	CC1=C(C(=CC=C1)C)N(CN2C=CC=N2)C(=O)CCl	{1: 2, 2: 2, 35: 1, 33: 2, 14: 6, 17: 1, 24: 1}
Did not match all atoms present	6713-83-3	C[Pb](C)C	{1: 3}
Did not match all atoms present	67135-87-9	C[Si]1(P2[Si](P3P1P3[Si]2(C)C)(C)C)C	{1: 6}
Did not match all atoms present	67139-54-2	CN1C2CCC1CC(C2)OC(=S)NC3=CC=CC=C3	{1: 1, 33: 1, 7: 1, 11: 4, 12: 3, 14: 5, 22: 1, 31: 1}
Did not match all atoms present	67151-57-9	CC1=C(C=C(C=C1)[N+](=O)[O-])N=[N+](C2=C(C=CC(=C2)[N+](=O)[O-])C)[O-]	{1: 2, 34: 1, 38: 2, 33: 1, 14: 6, 29: 1}
Did not match all atoms present	67169-27-1	CC(=O)NC1=CC(=C(C=C1)OC)N(C)C	{1: 4, 33: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	67169-91-9	CCOC1=CC(=C(C=C1)NC(=O)C)N	{1: 2, 2: 1, 14: 3, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	67175-75-1	C1CC2=C(C=CC3=C2C=CC4=CC=CC=C43)[C@H]([C@@H]1O)O	{20: 2, 11: 2, 12: 2, 14: 8}
Did not match all atoms present	67191-93-9	CC1=C(C=C(C=C1)F)N=C=O	{1: 1, 34: 1, 8: 1, 14: 3, 16: 1, 29: 1}
Did not match all atoms present	67192-42-1	CC1=C(C=CC(=C1)C(F)(F)F)[N+](=O)[O-]	{16: 3, 1: 1, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	67195-51-1	CC1=C2C=CC3=C2C(=CC4=C3C5C(O5)C6=CC=CC=C64)C=C1	{1: 1, 12: 2, 14: 9, 23: 1}
Did not match all atoms present	67196-02-5	C1CC[NH2+]C(C1)CCOC(=O)NC2=CC=CC=C2.[Cl-]	{2: 2, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	67199-66-0	C1C2=C(C=CC(=C2)N)N=C3N1C(=O)C4=CC=CC=C43	{33: 1, 35: 1, 11: 1, 14: 7, 15: 1, 25: 1, 30: 1}
Did not match all atoms present	672-06-0	CCC1=CC(=C(C(=C1Cl)C)Cl)OC(=O)NC	{1: 3, 2: 1, 14: 1, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	672-13-9	COC1=CC(=C(C=C1)O)C=O	{1: 1, 22: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	672-45-7	C1=C(NC(=O)NC1=O)C(F)(F)F	{16: 3, 25: 2, 4: 1, 14: 1, 32: 2}
Did not match all atoms present	672-57-1	C1=CC(=C(C=C1C(F)(F)F)I)Cl	{16: 3, 17: 1, 19: 1, 4: 1, 14: 3}
Did not match all atoms present	672-65-1	CC(C1=CC=CC=C1)Cl	{1: 1, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	672-66-2	CP(C)C1=CC=CC=C1	{1: 2, 14: 5}
Did not match all atoms present	672-76-4	CC(C)C1=CC=C(C(=O)C=C1)O	{1: 2, 3: 1, 21: 1, 14: 4, 25: 1}
Did not match all atoms present	672-89-9	CC1=CC(=CC(=O)O1)OC	{1: 2, 28: 1, 22: 1, 14: 2}
Did not match all atoms present	6720-37-2	C1=CC=C(C=C1)C(=CC2=CC(=CC=C2)[N+](=O)[O-])C#N	{37: 1, 38: 1, 14: 9, 6: 1, 7: 1}
Did not match all atoms present	67203-86-5	CCC1=CC=CC(=C1N(C(C)COC)C(=O)CCl)C.CCNC1=NC(=NC(=N1)Cl)NC(C)(C)C#N	{1: 7, 2: 4, 3: 1, 4: 1, 37: 1, 33: 1, 14: 3, 17: 2, 35: 3, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67210-66-6	CC[NH+](CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C.OS(=O)(=O)[O-]	{1: 3, 2: 2, 14: 4, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	67219-55-0	COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OC[C@@H]4[C@H](C[C@@H](O4)N5C=CC(=NC5=O)NC(=O)C6=CC=CC=C6)O	{1: 2, 2: 1, 35: 1, 4: 1, 33: 1, 11: 1, 12: 3, 14: 20, 20: 1, 22: 3, 23: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	67227-20-7	C1=CC=C(C=C1)NCCNN.Cl.Cl	{17: 2, 2: 2, 30: 1, 14: 5, 31: 2}
Did not match all atoms present	67227-30-9	C1=COC(=C1)C[NH+](CCCl)CCCl.[Cl-]	{17: 3, 2: 5, 14: 3, 23: 1}
Did not match all atoms present	67230-61-9	CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)NC(=O)C3=CC(=C(C4=C3N=C5C(=C(C(=O)C(=C5O4)C)N)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)C7CCCN7C(=O)C(NC6=O)C(C)C)C)C)C(C)C)C)C)NCC8=CC(=C(C=C8)Cl)Cl	{32: 2, 1: 16, 2: 1, 3: 4, 33: 6, 11: 8, 12: 10, 14: 4, 17: 2, 35: 1, 23: 1, 24: 2, 25: 9, 28: 2, 30: 1, 31: 3}
Did not match all atoms present	67230-67-5	CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)NC(=O)C3=CC(=C(C4=C3N=C5C(=C(C(=O)C(=C5O4)C)N)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)C7CCCN7C(=O)C(NC6=O)C(C)C)C)C)C(C)C)C)C)NCC8=CC=CN8	{32: 3, 1: 16, 2: 1, 3: 4, 33: 6, 11: 8, 12: 10, 14: 4, 35: 1, 23: 1, 24: 2, 25: 9, 28: 2, 30: 1, 31: 3}
Did not match all atoms present	67238-91-9	CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC(=C4O)CN5CCOCC5)O)O)O)C(=O)N)N(C)C)O	{1: 3, 2: 1, 33: 2, 11: 5, 12: 3, 13: 2, 14: 2, 15: 4, 20: 4, 21: 1, 23: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	67239-27-4	C1CCC(C1)C(=O)C2=CC(=C(C=C2)O)O	{24: 1, 11: 4, 12: 1, 21: 2, 14: 3}
Did not match all atoms present	67239-28-5	CC1=CC(=N)N(C=C1)CC(COC2=CC=C(C=C2)C(=O)C3CC3)O	{1: 1, 2: 2, 3: 1, 36: 1, 33: 1, 11: 2, 12: 1, 14: 7, 20: 1, 22: 1, 24: 1}
Did not match all atoms present	67240-23-7	O.O.O.[Na].[Al].[Si].[K].[Ca]	{}
Did not match all atoms present	67242-54-0	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)CCCC3	{1: 2, 11: 4, 14: 6}
Did not match all atoms present	67242-59-5	CN(C=O)C1=CC=CC=N1	{1: 1, 26: 1, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	67242-61-9	C1CCC2=C(C1)C3=CC=CC=C3N2C(=O)N	{24: 1, 33: 1, 11: 4, 30: 1, 14: 4}
Did not match all atoms present	6725-44-6	COC(=O)CC1=CC(=C(C=C1)Cl)Cl	{1: 1, 2: 1, 28: 1, 14: 3, 17: 2}
Did not match all atoms present	67262-60-6	CC(C(=O)NC1=CC=CC=C1)NCCOC	{1: 2, 2: 2, 3: 1, 14: 5, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67262-61-7	CC1=CC=CC=C1NC(=O)C(C)NCCOC	{1: 3, 2: 2, 3: 1, 14: 4, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67262-62-8	CCOCCNC(C)C(=O)NC1=CC=CC=C1C	{1: 3, 2: 3, 3: 1, 14: 4, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67262-64-0	CCC1=CC=CC=C1NC(=O)C(C)NCCOC	{1: 3, 2: 3, 3: 1, 14: 4, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67262-69-5	CCC1=CC=CC=C1NC(=O)CC(C)[NH2+]CCOC.[Cl-]	{1: 3, 2: 4, 3: 1, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	67262-71-9	CCC1=CC=CC=C1NC(=O)CC(C)(C)[NH2+]CCOC.C1CCC(CC1)NS(=O)(=O)[O-]	{1: 4, 2: 4, 4: 1, 11: 5, 12: 1, 14: 4, 22: 1, 24: 1, 29: 3, 31: 2}
Did not match all atoms present	67262-72-0	CCC1=CC=CC=C1NC(=O)CCC[NH2+]CCOC.[Cl-]	{1: 2, 2: 6, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	67262-74-2	CC(C(=O)NC1=CC=CC=C1C(=C)C)NCCOC.C(=O)(C(=O)O)O	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1, 14: 4, 22: 1, 24: 1, 27: 2, 31: 2}
Did not match all atoms present	67262-75-3	CC(C)C1=CC=CC=C1NC(=O)C(C)NCCOC.Cl	{1: 4, 2: 2, 3: 2, 14: 4, 17: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67262-78-6	CCOCCNCC(=O)NC1=C(C=CC=C1C)C	{1: 3, 2: 4, 14: 3, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67262-79-7	CC1=C(C(=CC=C1)C)NC(=O)CNCC(C)OC.Cl	{1: 4, 2: 2, 3: 1, 14: 3, 17: 1, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67262-80-0	CC1=C(C(=CC=C1)C)NC(=O)C(C)NCCOC	{1: 4, 2: 2, 3: 1, 14: 3, 22: 1, 24: 1, 31: 2}
Did not match all atoms present	67262-82-2	CC1=C(C(=CC=C1)C)NC(=O)C(C)NCC(C)OC.OCl(=O)(=O)=O	{1: 5, 2: 1, 3: 2, 14: 3, 17: 1, 20: 1, 22: 1, 24: 1, 29: 3, 31: 2}
Did not match all atoms present	6727-92-0	CCCCCC[As](=O)(CCCCCC)O	{1: 2, 2: 10, 20: 1, 29: 1}
Did not match all atoms present	6727-93-1	CCCCCCCC[As](=O)(CCCCCCCC)O	{1: 2, 2: 14, 20: 1, 29: 1}
Did not match all atoms present	6727-94-2	CCCCCCCCC[As](=O)(CCCCCCCCC)O	{1: 2, 2: 16, 20: 1, 29: 1}
Did not match all atoms present	6727-95-3	CCCCCCCCCC[As](=O)(CCCCCCCCCC)O	{1: 2, 2: 18, 20: 1, 29: 1}
Did not match all atoms present	6727-96-4	CCCCCCCCCCC[As](=O)(CCCCCCCCCCC)O	{1: 2, 2: 20, 20: 1, 29: 1}
Did not match all atoms present	6727-97-5	CCCCCCCCCCCC[As](=O)(CCCCCCCCCCCC)O	{1: 2, 2: 22, 20: 1, 29: 1}
Did not match all atoms present	6727-98-6	CCCCCCCCCCCCC[As](=O)(CCCCCCCCCCCCC)O	{1: 2, 2: 24, 20: 1, 29: 1}
Did not match all atoms present	6727-99-7	CCCCCCCCCCCCCC[As](=O)(CCCCCCCCCCCCCC)O	{1: 2, 2: 26, 20: 1, 29: 1}
Did not match all atoms present	67273-43-2	CCC1=CN=C(C=C1)C2=NC3=CC=CC=C3N2	{32: 1, 1: 1, 2: 1, 35: 2, 14: 7}
Did not match all atoms present	67276-04-4	[B-](C(C)CC)(C(C)CC)C(C)CC.[Na+]	{1: 6, 2: 3, 3: 3}
Did not match all atoms present	67278-71-1	CCOP(=O)(CN(C)CP(=O)(OCC)OCC)OCC	{1: 5, 2: 6, 29: 2, 22: 4, 33: 1}
Did not match all atoms present	6728-00-3	CCCCCCCCCCCCCCCC[As](=O)(CCCCCCCCCCCCCCCC)O	{1: 2, 2: 30, 20: 1, 29: 1}
Did not match all atoms present	6728-01-4	CCCCCCCCCCCCCCCCC[As](=O)(CCCCCCCCCCCCCCCCC)O	{1: 2, 2: 32, 20: 1, 29: 1}
Did not match all atoms present	6728-02-5	CCCCCCCCCCCCCCCCCC[As](=O)(CCCCCCCCCCCCCCCCCC)O	{1: 2, 2: 34, 20: 1, 29: 1}
Did not match all atoms present	6728-03-6	CCCCCCCCCCCCCCCCCCC[As](=O)(CCCCCCCCCCCCCCCCCCC)O	{1: 2, 2: 36, 20: 1, 29: 1}
Did not match all atoms present	6728-04-7	CCCCCCCCCCCCCCCCCCCC[As](=O)(CCCCCCCCCCCCCCCCCCCC)O	{1: 2, 2: 38, 20: 1, 29: 1}
Did not match all atoms present	6728-21-8	CS(=O)(=O)OCC=C	{1: 1, 2: 1, 5: 1, 6: 1, 22: 1, 29: 2}
Did not match all atoms present	67281-48-5	CC=[Se]	{1: 1, 6: 1}
Did not match all atoms present	67284-56-4	CCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N	{1: 1, 2: 1, 37: 1, 11: 4, 12: 2, 14: 8, 28: 1}
Did not match all atoms present	67290-46-4	C=O.C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N.C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 4, 34: 2, 5: 1, 14: 18, 31: 2}
Did not match all atoms present	67292-62-0	C1COP(NC1O)N(CCCl)CCCl	{32: 1, 33: 1, 2: 4, 11: 2, 12: 1, 17: 2, 20: 1, 23: 1}
Did not match all atoms present	67292-68-6	CC1=C(C2=C(N1)C=CC(=C2)OC)CCN(C)C	{32: 1, 1: 4, 2: 2, 33: 1, 14: 3, 22: 1}
Did not match all atoms present	67293-51-0	CCCCCCCC(CC1=CC(=C(C(=C1)OC)OC)OC)N	{1: 4, 2: 7, 3: 1, 14: 2, 22: 3, 30: 1}
Did not match all atoms present	67293-64-5	CC(CN1CCN(CC1)C)CN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl	{1: 2, 2: 2, 3: 1, 33: 3, 41: 1, 11: 4, 14: 7, 17: 1}
Did not match all atoms present	67293-75-8	C1CCCC(CCC1)CN=C(CSP(=O)(O)[O-])N.C1CCCC(CCC1)CN=C(CSP(=O)(O)[O-])N.C1CCCC(CCC1)CN=C(CSP(=O)(O)[O-])N.C1CCCC(CCC1)CN=C(CSP(=O)(O)[O-])N.O.O.O.O.O.[Na+].[Na+].[Na+].[Na+]	{2: 8, 7: 4, 40: 4, 11: 28, 12: 4, 34: 4, 20: 4, 29: 8, 30: 4}
Did not match all atoms present	67293-86-1	CC(=O)OC/N=[N+](/[O-])\OC	{1: 2, 2: 1, 28: 1, 34: 1, 22: 1}
Did not match all atoms present	67293-88-3	[2H]C([2H])([2H])N1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O	{1: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 21: 1, 23: 1}
Did not match all atoms present	67294-81-9	CS(=O)(=O)C(S(=O)(=O)C)S(=O)(=O)C	{1: 3, 3: 1, 29: 6}
Did not match all atoms present	673-04-1	CCNC1=NC(=NC(=N1)OC)NCC	{1: 3, 2: 2, 35: 3, 22: 1, 31: 2}
Did not match all atoms present	673-06-3	C1=CC=C(C=C1)C[C@H](C(=O)O)N	{27: 1, 2: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	673-19-8	CCC(C)C1=CC(=CC=C1)N(C)C(=O)[O-]	{1: 3, 2: 1, 3: 1, 33: 1, 14: 4, 24: 1}
Did not match all atoms present	673-22-3	COC1=CC(=C(C=C1)C=O)O	{1: 1, 22: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	673-31-4	C1=CC=C(C=C1)CCCOC(=O)N	{2: 3, 28: 1, 30: 1, 14: 5}
Did not match all atoms present	673-32-5	CC#CC1=CC=CC=C1	{1: 1, 10: 2, 14: 5}
Did not match all atoms present	673-46-1	CN(C)CCC1=CN=CN1	{32: 1, 1: 2, 2: 2, 35: 1, 33: 1, 14: 2}
Did not match all atoms present	673-48-3	COC1=CC=C(C=C1)[N+]#N.F[P-](F)(F)(F)(F)F	{16: 6, 1: 1, 34: 1, 22: 1, 14: 4}
Did not match all atoms present	673-49-4	CC(=O)NCCC1=CN=CN1	{32: 1, 1: 1, 2: 2, 35: 1, 14: 2, 24: 1, 31: 1}
Did not match all atoms present	673-97-2	CCOP(=O)(C)F	{16: 1, 1: 2, 2: 1, 29: 1, 22: 1}
Did not match all atoms present	67306-00-7	CC(CC1=CC=C(C=C1)C(C)(C)C)CN2CCCCC2	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 11: 5, 14: 4}
Did not match all atoms present	67306-03-0	CC1CN(CC(O1)C)CC(C)CC2=CC=C(C=C2)C(C)(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 33: 1, 11: 2, 12: 2, 14: 4, 23: 1}
Did not match all atoms present	67318-23-4	P(=S)(=S)Cl	{17: 1}
Did not match all atoms present	6732-77-0	CCN(CC)CCOC1=CC=C(C=C1)C(CC2=CC=C(C=C2)OC)C3=CC=CC=C3	{1: 3, 2: 5, 3: 1, 33: 1, 14: 13, 22: 2}
Did not match all atoms present	67325-77-3	COP(=O)(C)OC.C(CCl)OP(=O)(OCCCl)OCCCl	{1: 3, 2: 6, 29: 2, 22: 5, 17: 3}
Did not match all atoms present	67325-90-0	COC1=C(C=CC(=C1)NC2=CC=CC=C2)[N+]#N.C=O.[Cl-]	{1: 1, 34: 1, 5: 1, 14: 8, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	67326-79-8	CCN(CC(COC)OC)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OC)C.[Cl-]	{1: 5, 2: 3, 3: 1, 33: 2, 41: 1, 34: 2, 14: 7, 17: 1, 22: 3}
Did not match all atoms present	67330-25-0	CCCCOC(=O)C1=CC=CC=C1NC2=CC=CC(=C2)C(F)(F)F	{1: 1, 2: 3, 4: 1, 14: 8, 16: 3, 28: 1, 31: 1}
Did not match all atoms present	67330-54-5	CCC1=C(C(=CC=C1)C(C)C)N=C=S	{1: 3, 2: 1, 3: 1, 8: 1, 34: 1, 14: 3}
Did not match all atoms present	67330-61-4	CCC1=C(C(=C(C=C1)C)CC)N	{1: 3, 2: 2, 30: 1, 14: 2}
Did not match all atoms present	67330-62-5	CCC1=C(C(=C(C=C1)Cl)CC)N	{1: 2, 2: 2, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	67335-43-7	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=C[C@@H]([C@H]4O)O	{20: 2, 12: 2, 14: 10}
Did not match all atoms present	67336-18-9	N1=P(N=P(N=P1(F)Br)(F)Br)(F)Br	{16: 3, 18: 3, 35: 3}
Did not match all atoms present	67338-57-2	CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N/N=C\2/C=C(C(=O)C3=C2C(=CC=C3)NS(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)F)Cl	{1: 1, 34: 1, 38: 1, 14: 11, 15: 2, 16: 1, 17: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	67338-58-3	CCN(CCOCCOCC)C1=CC=CC(=C1)NC(=O)C	{1: 3, 2: 6, 33: 1, 14: 4, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	67338-60-7	C1=CC2=C(C=CC(=C2O)C(=O)O)C(=C1)N	{30: 1, 27: 1, 21: 1, 14: 5}
Did not match all atoms present	67338-61-8	COC(=O)C(C#N)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 3: 1, 37: 1, 38: 1, 14: 4, 24: 1, 28: 1}
Did not match all atoms present	67338-62-9	CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)N=NC3=NN=C(S3)SCC)NC(=O)C	{1: 3, 2: 3, 35: 2, 33: 1, 40: 1, 41: 1, 34: 2, 14: 8, 24: 1, 31: 1}
Did not match all atoms present	67341-98-4	C1CC2CC1C34C2(O3)C(=O)C5=CC=CC=C5C4=O	{11: 3, 12: 2, 13: 2, 14: 4, 23: 1, 25: 2}
Did not match all atoms present	67345-78-2	C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)NN	{38: 1, 14: 3, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6736-03-4	CCOP(=O)(OCC)SCC[N+](C)(C)C	{40: 1, 1: 5, 2: 4, 29: 1, 22: 2}
Did not match all atoms present	6736-77-2	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)([O-])[O-])O)O)O)O.[K+].[K+]	{2: 1, 12: 5, 20: 4, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	67360-94-5	C1CCN(CC1)[As](N2CCCCC2)N3CCCCC3.Cl.Cl.Cl	{17: 3, 11: 15, 33: 3}
Did not match all atoms present	67362-76-9	CCCCOCCOC(=O)C1=CC=C(C=C1)N(C)C	{1: 3, 2: 5, 33: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67363-89-7	CCCCCCCCCOC1=CC=C(C=C1)N=CC2=CC=C(C=C2)C#N	{1: 1, 34: 1, 37: 1, 6: 1, 2: 8, 14: 8, 22: 1}
Did not match all atoms present	67363-95-5	CCC1=COC=C1	{1: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	67364-55-0	C1C2=CC=C(O2)C(=O)NC3=CC=CC=C3NC(=O)C4=CC=C(O4)CS1	{32: 2, 41: 1, 11: 2, 14: 8, 23: 2, 25: 2}
Did not match all atoms present	67364-88-9	CC(=O)OCC1=CC=C(C=C1)C(C)(C)C	{1: 4, 2: 1, 4: 1, 14: 4, 28: 1}
Did not match all atoms present	6737-42-4	C1=CC=C(C=C1)P(CCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 3, 14: 20}
Did not match all atoms present	67371-65-7	CC1=CC(=CC=C1)N=NC2=CC=C(C=C2)N(C)OC(=O)C3=CC=CC=C3	{1: 2, 34: 2, 28: 1, 14: 13, 33: 1}
Did not match all atoms present	67373-56-2	CC(C)C(C)(C)[Si](C)(C)Cl	{1: 6, 3: 1, 4: 1, 17: 1}
Did not match all atoms present	67374-76-9	F[Mo](=S)(F)F	{16: 3}
Did not match all atoms present	6738-04-1	C1=CC=C(C=C1)C2=CC=CC=C2OC3=CC=CC=C3	{22: 1, 14: 14}
Did not match all atoms present	6738-23-4	CC1=CC(=C(C=C1)OC)C	{1: 3, 22: 1, 14: 3}
Did not match all atoms present	67395-53-3	B(N=C(C(F)(F)F)C(F)(F)F)(N(C)C)N(C)C	{1: 4, 34: 1, 4: 2, 33: 2, 7: 1, 16: 6}
Did not match all atoms present	67398-11-2	C1CCC(CC1)(N)P(=O)(O)O	{11: 5, 20: 2, 13: 1, 30: 1, 29: 1}
Did not match all atoms present	67399-94-4	CCCCCCCCOC1=CC=C(C=C1)OCCCCCCCC	{1: 2, 2: 14, 22: 2, 14: 4}
Did not match all atoms present	6740-85-8	C1CCC(C1)C(=O)C2=CC=CC=C2Cl	{24: 1, 17: 1, 11: 4, 12: 1, 14: 4}
Did not match all atoms present	6740-88-1	CNC1(CCCCC1=O)C2=CC=CC=C2Cl	{1: 1, 11: 4, 13: 1, 14: 4, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	67401-56-3	C/C=C\1/C2=NC(=CS2)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=CS4)C5=C(C=CC(=N5)C6=NC(=CS6)C7=NC(=CS7)C(=O)N/C(=C\C)/C(=O)NC[C@H](C)O)C8=NC(=CS8)C(=O)N[C@H](C(=O)N1)[C@@H](C)O)[C@@H](C)O)C(C)C	{32: 4, 1: 7, 2: 1, 3: 4, 6: 2, 7: 1, 41: 6, 12: 3, 14: 8, 15: 1, 35: 7, 20: 3, 24: 2, 25: 4, 31: 2}
Did not match all atoms present	67410-20-2	C#CC(=O)O[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{9: 1, 10: 1, 28: 1, 14: 15}
Did not match all atoms present	67411-81-8	CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)C(C(C=C4)O)O	{1: 1, 12: 2, 14: 9, 20: 2}
Did not match all atoms present	67412-53-7	CC(C)(COP(=O)(OCCC(Cl)Cl)OCCC(Cl)Cl)CCl	{1: 2, 2: 6, 3: 2, 4: 1, 17: 5, 22: 3, 29: 1}
Did not match all atoms present	6742-07-0	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@@H](O1)N2C=CC(=NC2=O)N)OC(=O)C)OC(=O)C	{1: 3, 2: 1, 35: 1, 33: 1, 12: 4, 14: 2, 23: 1, 25: 1, 28: 3, 30: 1}
Did not match all atoms present	6742-54-7	CCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 10, 14: 5}
Did not match all atoms present	6742-68-3	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Dy+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	6742-69-4	CC(C)[O-].CC(C)[O-].CC(C)[O-].[Yb+3]	{1: 6, 3: 3, 29: 3}
Did not match all atoms present	67426-60-2	CC1CO1.C1CO1.OS(=O)(=O)[O-].[Na+]	{1: 1, 11: 3, 12: 1, 20: 1, 23: 2, 29: 3}
Did not match all atoms present	67428-03-9	[2H]C([2H])(CON=O)C1=CC=CC=C1	{2: 2, 34: 1, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	67445-50-5	CCCCS[Sn](CCC)(CCC)CCC	{40: 1, 1: 4, 2: 9}
Did not match all atoms present	67446-03-1	C1=CC=C2C(=C1)C3=C(C=C4C5=CC(=C6C7=CC=CC=C7C(=O)C8=C6C5=C(C=C8)C9=C4C3=C(C2=O)C=C9)[N+](=O)[O-])[N+](=O)[O-]	{25: 2, 38: 2, 14: 14}
Did not match all atoms present	6745-35-3	[2H]C(=C([2H])Cl)[2H]	{17: 1, 5: 1, 6: 1}
Did not match all atoms present	6745-75-1	CC1=CC(=C(C=C1C=O)C)OC	{1: 3, 26: 1, 22: 1, 14: 2}
Did not match all atoms present	6746-27-6	CN1CNC(=S)NC1	{32: 2, 1: 1, 11: 2, 33: 1, 15: 1}
Did not match all atoms present	6746-59-4	CCOC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4C)[C@@H](O2)[C@H](C=C5)O)C=C1.O.O.Cl	{1: 2, 2: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 17: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	6746-91-4	CN1C2CCC1CC(C2)OC(=O)C(=C)C3=CC=C(C=C3)Cl.Cl	{1: 1, 5: 1, 7: 1, 11: 4, 12: 3, 14: 4, 17: 2, 33: 1, 28: 1}
Did not match all atoms present	67465-04-7	C1=CC=C(C=C1)CNC2=CC=CC=N2.Cl	{17: 1, 2: 1, 35: 1, 14: 9, 31: 1}
Did not match all atoms present	67465-28-5	CCC(CCC(=O)N1CCCCC1)S(=O)(=O)CC	{1: 2, 2: 4, 3: 1, 33: 1, 11: 5, 24: 1, 29: 2}
Did not match all atoms present	67465-39-8	CN1C(=O)CN(C1=O)CC(C[Hg]Cl)OC	{1: 2, 2: 2, 3: 1, 33: 2, 11: 1, 17: 1, 22: 1, 25: 2}
Did not match all atoms present	67465-41-2	C1=CC(OC1[Hg]Cl)[Hg]Cl	{17: 2, 12: 2, 14: 2, 23: 1}
Did not match all atoms present	67465-42-3	CCC1(C(=O)NC(=O)N(C1=O)CC(C[Hg])OCC)CC.O	{32: 1, 1: 3, 2: 5, 3: 1, 33: 1, 13: 1, 22: 1, 25: 3}
Did not match all atoms present	67465-43-4	CCC1(C(=O)NC(=O)N(C1=O)CC(C[Hg])OC(C)C)CC.O	{32: 1, 1: 4, 2: 4, 3: 2, 33: 1, 13: 1, 22: 1, 25: 3}
Did not match all atoms present	67465-44-5	CCC1(C(=O)NC(=O)N(C1=O)CC(C[Hg])OC)CC.O	{32: 1, 1: 3, 2: 4, 3: 1, 33: 1, 13: 1, 22: 1, 25: 3}
Did not match all atoms present	67465-66-1	CCN(CC)C(C)CN1C2=CC=CC=C2SC3=C1N=CC=C3	{1: 3, 2: 3, 3: 1, 33: 2, 41: 1, 14: 7, 35: 1}
Did not match all atoms present	67466-28-8	C1=CC=C2C(=C1)C=CC3=C4C5C(C(=C32)C6=C4C7=CC=CC=C7C=C6)C(=O)N(C5=O)CC(=O)O	{33: 1, 2: 1, 12: 2, 14: 12, 25: 2, 27: 1}
Did not match all atoms present	67466-58-4	COC1=CC=CC=C1C(=O)N(CC(C[Hg])OCCO)C(=O)[O-].O.[Na+]	{1: 1, 2: 4, 3: 1, 33: 1, 14: 4, 20: 1, 22: 2, 24: 2}
Did not match all atoms present	67469-78-7	C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl	{33: 2, 2: 5, 3: 1, 11: 4, 14: 13, 16: 2, 17: 2, 22: 1}
Did not match all atoms present	67479-03-2	C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)S	{39: 1, 35: 2, 29: 2, 14: 7, 31: 1}
Did not match all atoms present	67479-04-3	COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=NC=CC=N3	{1: 3, 35: 2, 33: 2, 11: 4, 14: 5, 22: 3, 24: 1}
Did not match all atoms present	67481-15-6	CCOP(=O)(OCC)O/C(=C/Cl)/C1=C(C=C(C=C1)Cl)Cl.COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)C(Cl)(Cl)Cl	{1: 4, 2: 2, 3: 1, 4: 1, 6: 1, 7: 1, 14: 11, 17: 6, 22: 5, 29: 1}
Did not match all atoms present	67483-73-2	C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)Cl	{17: 1, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	67485-29-4	CC1(CN=C(NC1)NN=C(/C=C/C2=CC=C(C=C2)C(F)(F)F)/C=C/C3=CC=C(C=C3)C(F)(F)F)C	{32: 1, 1: 2, 34: 1, 35: 1, 4: 2, 6: 4, 7: 1, 11: 2, 13: 1, 14: 8, 15: 1, 16: 6, 31: 1}
Did not match all atoms present	67487-35-8	C1=CC(=C(C=C1Cl)C(=O)NN)Cl	{24: 1, 17: 2, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	6749-73-1	C(C(CCl)OP(OC(CCl)CCl)OC(CCl)CCl)Cl	{17: 6, 2: 6, 3: 3, 22: 3}
Did not match all atoms present	67491-88-7	CCCCCCNS(=O)(=O)C1=CC=C(C=C1)N	{1: 1, 2: 5, 14: 4, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	67493-64-5	C1=CC(=CC(=C1)N)N=NC2=C(C=C(C=C2)N)N.C(C(=O)O)O	{34: 2, 2: 1, 14: 7, 20: 1, 27: 1, 30: 3}
Did not match all atoms present	67499-52-9	CC1=CC(=C2C3=C1NC(=O)C(=C3C4=CC=CC=C4C2=O)C5=CC=CC=C5)Br	{32: 1, 1: 1, 18: 1, 14: 10, 25: 2}
Did not match all atoms present	675-09-2	CC1=CC(=O)OC(=C1)C	{1: 2, 28: 1, 14: 2}
Did not match all atoms present	675-10-5	CC1=CC(=CC(=O)O1)O	{1: 1, 28: 1, 21: 1, 14: 2}
Did not match all atoms present	675-14-9	C1(=NC(=NC(=N1)F)F)F	{16: 3, 35: 3}
Did not match all atoms present	675-62-7	C[Si](CCC(F)(F)F)(Cl)Cl	{16: 3, 1: 1, 2: 2, 4: 1, 17: 2}
Did not match all atoms present	6750-04-5	C#CCOC(=O)C1=CC=CC=C1	{9: 1, 2: 1, 28: 1, 10: 1, 14: 5}
Did not match all atoms present	67504-24-9	CC(=C)C(=O)N.CC(=C)C(=O)OCC[N+](C)(C)C.[Cl-]	{1: 5, 2: 2, 5: 2, 7: 2, 17: 1, 24: 1, 28: 1, 30: 1}
Did not match all atoms present	67506-88-1	C[C-]1[C-]([C-]([C-]([C-]1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.Cl[Th]Cl	{1: 10, 17: 2}
Did not match all atoms present	67515-55-3	C1=CC(=C(C=C1C(=O)O)C(F)(F)F)F	{16: 4, 27: 1, 4: 1, 14: 3}
Did not match all atoms present	67515-56-4	C1=CC(=C(C=C1C(=O)Cl)C(F)(F)F)F	{16: 4, 17: 1, 4: 1, 14: 3, 24: 1}
Did not match all atoms present	67515-57-5	C1=CC(=C(C=C1C(=O)N)C(F)(F)F)F	{16: 4, 24: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	67515-59-7	C1=CC(=C(C=C1C#N)C(F)(F)F)F	{16: 4, 4: 1, 37: 1, 14: 3}
Did not match all atoms present	67515-60-0	C1=CC(=C(C=C1C=O)C(F)(F)F)F	{16: 4, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	67515-61-1	C1=CC(=C(C=C1CO)C(F)(F)F)F	{16: 4, 20: 1, 2: 1, 4: 1, 14: 3}
Did not match all atoms present	67515-74-6	C1=CC(=C(C=C1CN)C(F)(F)F)F	{16: 4, 2: 1, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	6752-38-1	C1=CC(=CC=C1N=C=O)S(=O)(=O)Cl	{8: 1, 17: 1, 34: 1, 29: 3, 14: 4}
Did not match all atoms present	67523-22-2	CC1=C2C(=C3C=CC(C(C3=C1)O)O)C=CC4=CC=CC=C42	{1: 1, 12: 2, 14: 9, 20: 2}
Did not match all atoms present	67531-68-4	CCOC(=O)C1=CC(=CC=C1)N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	67542-72-7	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Mg+2].[Mg+2].[Al+3].[Al+3].[Ce+3].[Ce+3].[Tb+3].[Tb+3]	{}
Did not match all atoms present	6755-54-0	[2H]C(=C)[2H]	{5: 2}
Did not match all atoms present	67550-64-5	C1CCC(C1)([NH3+])P(=O)([O-])[O-]	{11: 4, 13: 1, 29: 3}
Did not match all atoms present	67554-09-0	CCCCOP1(=O)OCCO1	{1: 1, 2: 3, 11: 2, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	67557-57-7	[2H]C([2H])([2H])N(COC(=O)C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 28: 1, 29: 1}
Did not match all atoms present	6756-41-8	CC1=CC=C(C=C1)N/N=C/2\C(=O)C=CC3=CC=CC=C32	{1: 1, 34: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	67562-39-4	C1=C2C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)OC2=C(C(=C1Cl)Cl)Cl	{17: 7, 14: 1, 23: 1}
Did not match all atoms present	67564-91-4	C[C@@H]1CN(C[C@@H](O1)C)CC(C)CC2=CC=C(C=C2)C(C)(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 33: 1, 11: 2, 12: 2, 14: 4, 23: 1}
Did not match all atoms present	6757-53-5	CCCCCCC[As](=O)(CCCCCCC)O	{1: 2, 2: 12, 20: 1, 29: 1}
Did not match all atoms present	6757-54-6	CCCCCCCCCCCCCCC[As](=O)(CCCCCCCCCCCCCCC)O	{1: 2, 2: 28, 20: 1, 29: 1}
Did not match all atoms present	67576-77-6	C[C@H]1[C@H]([C@H]([C@@H](C(O1)OC)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4	{1: 2, 2: 3, 12: 5, 14: 15, 22: 4, 23: 1}
Did not match all atoms present	6758-66-3	C1=CC(=CC(=C1)S(=O)(=O)CCCl)NC(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(/C(=N\NC4=C(C5=C(C=C4)C(=CC=C5)S(=O)(=O)O)S(=O)(=O)O)/C3=O)S(=O)(=O)O	{2: 2, 34: 1, 14: 12, 15: 2, 17: 1, 20: 4, 24: 1, 25: 1, 29: 10, 31: 3}
Did not match all atoms present	67584-31-0	CC(=CC(=O)OC)NC(C1=CC=CC=C1)C(=O)[O-].[K+]	{1: 2, 3: 1, 6: 1, 7: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	67584-45-6	CN(C)CNC(=O)C=C.C=CC(=O)N.C=CC(=O)NCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 2, 5: 3, 6: 3, 33: 1, 24: 3, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	67584-48-9	C=CCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 6, 5: 1, 6: 1, 16: 13, 29: 2, 31: 1}
Did not match all atoms present	67584-49-0	C=CCNS(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 7, 5: 1, 6: 1, 16: 15, 29: 2, 31: 1}
Did not match all atoms present	67584-50-3	CCN(CCC[Si](Cl)(Cl)Cl)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 7, 33: 1, 16: 15, 17: 3, 29: 2}
Did not match all atoms present	67584-54-7	CN(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 7, 33: 1, 16: 15, 29: 2, 31: 1}
Did not match all atoms present	67584-55-8	CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 4, 5: 1, 6: 1, 33: 1, 16: 9, 28: 1, 29: 2}
Did not match all atoms present	67584-56-9	CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 5, 5: 1, 6: 1, 33: 1, 16: 11, 28: 1, 29: 2}
Did not match all atoms present	67584-57-0	CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 6, 5: 1, 6: 1, 33: 1, 16: 13, 28: 1, 29: 2}
Did not match all atoms present	67584-59-2	CC(=C)C(=O)OCCN(C)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 2, 4: 4, 5: 1, 7: 1, 16: 9, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67584-60-5	CC(=C)C(=O)OCCN(C)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 2, 4: 5, 5: 1, 7: 1, 16: 11, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67584-61-6	CC(=C)C(=O)OCCN(C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 2, 4: 6, 5: 1, 7: 1, 16: 13, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67584-63-8	CCN(CC(=O)OCC)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 4, 33: 1, 16: 9, 28: 1, 29: 2}
Did not match all atoms present	67588-88-9	[Cr+3].[OH-].[OH-]	{}
Did not match all atoms present	67589-38-2	CCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OC	{1: 2, 2: 2, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67589-39-3	CCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCC	{1: 2, 2: 3, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67589-46-2	CCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OC	{1: 2, 2: 3, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67589-47-3	CCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCC	{1: 2, 2: 4, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67589-52-0	CCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OC	{1: 2, 2: 4, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67589-53-1	CCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCC	{1: 2, 2: 5, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67589-54-2	CCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCCC	{1: 2, 2: 6, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67590-46-9	CC(C)(C)C12COP(OC1)OC2	{1: 3, 11: 3, 4: 1, 13: 1, 23: 3}
Did not match all atoms present	67590-56-1	CCC12CO[As](OC1)OC2	{1: 1, 2: 1, 11: 3, 13: 1, 23: 3}
Did not match all atoms present	67590-57-2	CC(C)C12CO[As](OC1)OC2	{11: 3, 1: 2, 3: 1, 13: 1, 23: 3}
Did not match all atoms present	67592-36-3	CO[Si](CCC1CCC=CC1)(OC)OC	{1: 3, 2: 2, 11: 3, 12: 1, 14: 2, 22: 3}
Did not match all atoms present	67599-06-8	CCCCC(=NC1=CC=C(C=C1)CC2=CC=C(C=C2)N=C(C)CCCC)C	{1: 4, 2: 7, 34: 2, 14: 8, 7: 2}
Did not match all atoms present	67599-08-0	C1CC(CCC1CC2CCC(CC2)NC(=O)OC(C3=CC=CC=C3)C(=O)C4=CC=CC=C4)NC(=O)OC(C5=CC=CC=C5)C(=O)C6=CC=CC=C6	{2: 1, 3: 2, 11: 8, 12: 4, 14: 20, 24: 2, 28: 2, 31: 2}
Did not match all atoms present	67599-09-1	CCCCCCNS(=O)(=O)C1=CC=C(C=C1)N/N=C/2\C(=C(C(=O)N(C2=O)C)C#N)C	{1: 3, 2: 5, 37: 1, 33: 1, 34: 1, 14: 4, 15: 3, 25: 2, 29: 2, 31: 2}
Did not match all atoms present	67599-10-4	CC1=C(C=CC(=C1)Cl)N=NN(C)CCS(=O)(=O)[O-].[Na+]	{1: 2, 2: 2, 33: 1, 34: 2, 14: 3, 17: 1, 29: 3}
Did not match all atoms present	67599-11-5	CN(CCS(=O)(=O)[O-])N=NC1=C(C=CC(=C1)Cl)OC.[Na+]	{1: 2, 2: 2, 33: 1, 34: 2, 14: 3, 17: 1, 22: 1, 29: 3}
Did not match all atoms present	67599-12-6	CCN(C1=C(C=C(C=C1)S(=O)(=O)[O-])C(=O)[O-])N=NC2=C(C=CC(=C2)C(F)(F)F)Cl.[Na+].[Na+]	{1: 1, 2: 1, 4: 1, 33: 1, 34: 2, 14: 6, 16: 3, 17: 1, 24: 1, 29: 3}
Did not match all atoms present	67599-13-7	CC1=C(C=C(C=C1)Cl)N=NN(C)CC(=O)[O-].[Na+]	{1: 2, 2: 1, 33: 1, 34: 2, 14: 3, 17: 1, 24: 1}
Did not match all atoms present	67599-14-8	CCN(C1=C(C=C(C=C1)S(=O)(=O)[O-])C(=O)[O-])N=NC2=C(C=CC(=C2)Cl)Cl.[Na+].[Na+]	{1: 1, 2: 1, 33: 1, 34: 2, 14: 6, 17: 2, 24: 1, 29: 3}
Did not match all atoms present	67599-15-9	CC1=CC(=C(C=C1)OC)N=NN(C)CC(=O)[O-].[Na+]	{1: 3, 2: 1, 33: 1, 34: 2, 14: 3, 22: 1, 24: 1}
Did not match all atoms present	67599-16-0	COC1=C(C=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=C(C=C(C=C4)Cl)OC	{1: 2, 34: 1, 14: 11, 15: 2, 17: 1, 22: 2, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	67599-17-1	COC1=C(C=C(C=C1)[N+](=O)[O-])N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=C(C=C(C=C4)Cl)OC	{1: 2, 34: 1, 38: 1, 14: 11, 15: 2, 17: 1, 22: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	67599-18-2	CC1=C(C=CC(=C1)Cl)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4OC	{1: 2, 34: 1, 14: 12, 15: 2, 17: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	67599-19-3	CCC(C)COC1=CC=C(C=C1)Br	{1: 2, 2: 2, 3: 1, 14: 4, 18: 1, 22: 1}
Did not match all atoms present	67599-20-6	CCC(C)COC1=CC=C(C=C1)O	{1: 2, 2: 2, 3: 1, 14: 4, 21: 1, 22: 1}
Did not match all atoms present	67599-22-8	CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCC(C)CC	{1: 3, 2: 7, 3: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	67599-36-4	CCO[Si](C)(C)OCC.CCO[Si](CCCN)(OCC)OCC.CCO[Si](C1=CC=CC=C1)(OCC)OCC	{1: 10, 2: 11, 30: 1, 22: 8, 14: 5}
Did not match all atoms present	676-10-8	B(F)(F)F.CCCCNCCCC	{16: 3, 1: 2, 2: 6, 31: 1}
Did not match all atoms present	676-46-0	C(C(C(=O)[O-])O)C(=O)[O-].[Na+].[Na+]	{24: 2, 2: 1, 3: 1, 20: 1}
Did not match all atoms present	676-47-1	C(CC(=O)[O-])C(=O)[O-].[K+].[K+]	{24: 2, 2: 2}
Did not match all atoms present	676-49-3	[2H]C	{}
Did not match all atoms present	676-55-1	[2H]C[2H]	{}
Did not match all atoms present	676-58-4	[CH3-].[Mg+2].[Cl-]	{17: 1}
Did not match all atoms present	676-59-5	CPC	{1: 2}
Did not match all atoms present	676-71-1	C[As](C)Br	{1: 2, 18: 1}
Did not match all atoms present	676-75-5	C[As](C)I	{1: 2, 19: 1}
Did not match all atoms present	676-80-2	[2H]C([2H])[2H]	{}
Did not match all atoms present	676-83-5	CP(Cl)Cl	{1: 1, 17: 2}
Did not match all atoms present	676-96-0	CP(=O)(C)C	{1: 3, 29: 1}
Did not match all atoms present	676-97-1	CP(=O)(Cl)Cl	{1: 1, 29: 1, 17: 2}
Did not match all atoms present	676-98-2	CP(=S)(Cl)Cl	{1: 1, 17: 2}
Did not match all atoms present	676-99-3	CP(=O)(F)F	{16: 2, 1: 1, 29: 1}
Did not match all atoms present	6760-14-1	C1=C(C(=NC=C1[N+](=O)[O-])N)C(=O)O	{38: 1, 35: 1, 27: 1, 30: 1, 14: 2}
Did not match all atoms present	67602-72-6	C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 20: 1, 29: 8, 14: 4}
Did not match all atoms present	67603-79-6	CC1=C(C=C(C=C1)Cl)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC(=C(C=C4C)NC(=O)C5=CC6=CC=CC=C6/C(=N/NC7=C(C=CC(=C7)Cl)C)/C5=O)Cl	{1: 3, 34: 2, 14: 18, 15: 4, 17: 3, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	67605-02-1	CC1=CC=C(C=C1)S(=O)(=O)C(=C)C	{1: 2, 29: 2, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	67605-92-9	[CH3-].[CH3-].C[C-]1[C-]([C-]([C-]([C-]1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[U]	{1: 10}
Did not match all atoms present	67613-11-0	COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)COC.C=O.C(=O)(N)N	{1: 6, 2: 6, 35: 3, 5: 1, 33: 3, 22: 6, 24: 1, 30: 2}
Did not match all atoms present	67613-13-2	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N	{24: 1, 1: 1, 2: 4, 30: 1, 14: 8}
Did not match all atoms present	67614-42-0	CC(=O)NC1=CC(=C(C=C1)C(=O)O)C(=O)O	{24: 1, 1: 1, 27: 2, 14: 3, 31: 1}
Did not match all atoms present	67617-01-0	C[Si]1(C=C1)C	{1: 2, 14: 2}
Did not match all atoms present	67618-27-3	C1=CC2=C3C(=C1)C=CC(=N)C3=C(C=C2)N	{36: 1, 30: 1, 14: 7, 15: 1}
Did not match all atoms present	67618-28-4	CNC1=C2C(=NC)C=CC3=CC=CC(=C32)C=C1	{1: 2, 34: 1, 31: 1, 14: 7, 15: 1}
Did not match all atoms present	67621-72-1	[O-2].[O-2].[O-2].[O-2].[O-2].[Mg+2].[Al+3].[Ba+2].[Ce+3]	{}
Did not match all atoms present	67621-74-3	[O-2].[O-2].[O-2].[O-2].[O-2].[Mg+2].[Al+3].[Sr+2].[Ce+3]	{}
Did not match all atoms present	67633-55-0	CC[N+](CCC#N)(CCNC(=O)CCCCCCCCCCCCCCC(C)C)CCNC(=O)CCCCCCCCCCCCCCC(C)C.CCOS(=O)(=O)[O-]	{1: 6, 2: 36, 3: 2, 37: 1, 22: 1, 24: 2, 29: 3, 31: 2}
Did not match all atoms present	67633-59-4	CC(C)CCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 4, 2: 18, 3: 1, 14: 5, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	67633-61-8	CC[N+](CCC#N)(CCNC(=O)CCCCCCCCCCCCCCC(C)C)CCO.CCOS(=O)(=O)[O-]	{1: 4, 2: 22, 3: 1, 37: 1, 20: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	67633-71-0	CCCCCCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 28, 37: 1, 20: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	67633-73-2	CCCCCCCCC=CCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 22, 37: 1, 6: 2, 20: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	67633-75-4	CCCCCCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCNC(=O)CCCCCCCCCCCCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 48, 37: 1, 22: 1, 24: 2, 29: 3, 31: 2}
Did not match all atoms present	67633-77-6	CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCNC(=O)CCCCCCCCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 40, 37: 1, 22: 1, 24: 2, 29: 3, 31: 2}
Did not match all atoms present	67633-80-1	CCCCCCCCC=CCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCNC(=O)CCCCCCCC=CCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 36, 37: 1, 6: 4, 22: 1, 24: 2, 29: 3, 31: 2}
Did not match all atoms present	67633-82-3	CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 24, 37: 1, 20: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	67633-86-7	CCCCCCCCOS(=O)(=O)[O-].CCCCCCCCOS(=O)(=O)[O-].[Mg+2]	{1: 2, 2: 14, 29: 6, 22: 2}
Did not match all atoms present	67633-87-8	CCCCCCCCOS(=O)(=O)O.C(CO)NCCO	{1: 1, 2: 11, 20: 3, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	67633-88-9	CCCCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 7, 29: 3, 22: 1}
Did not match all atoms present	67633-89-0	CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 19, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	67633-90-3	CCCCCCC(C(=O)OC)S(=O)(=O)O	{1: 2, 2: 5, 3: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	67633-91-4	CCCCC(C(=O)OC)S(=O)(=O)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	67633-94-7	CC1CC(OC(O1)CC2=CC=CC=C2)(C)C	{1: 3, 2: 1, 11: 1, 12: 2, 13: 1, 14: 5, 23: 2}
Did not match all atoms present	67634-02-0	CC(=CCCC(=CCOC(CC1=CC=CC=C1)OCC=C(C)CCC=C(C)C)C)C	{1: 6, 2: 7, 3: 1, 6: 4, 7: 4, 14: 5, 22: 2}
Did not match all atoms present	67634-04-2	CC(CCC=C(C)C)CCOC(CC1=CC=CC=C1)OCCC(C)CCC=C(C)C	{1: 6, 2: 9, 3: 3, 6: 2, 7: 2, 14: 5, 22: 2}
Did not match all atoms present	67634-15-5	CCC1=CC=C(C=C1)CC(C)(C)C=O	{1: 3, 2: 2, 4: 1, 26: 1, 14: 4}
Did not match all atoms present	67639-45-6	CC1=C2C3=CC=CC=C3C(=CC2=C(C4=CC=CC=C14)CCl)F	{16: 1, 1: 1, 2: 1, 14: 9, 17: 1}
Did not match all atoms present	6764-27-8	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CC#N)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 35: 1, 37: 1, 41: 1, 14: 6, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	6764-43-8	CC1=NC2=C(O1)C=CC(=C2)S(=O)(=O)O	{1: 1, 35: 1, 14: 3, 20: 1, 23: 1, 29: 2}
Did not match all atoms present	6764-45-0	CCOC(=O)C1=CC(=C(C=C1NC2=CC=C(C=C2)C)C(=O)OCC)NC3=CC=C(C=C3)C	{1: 4, 2: 2, 28: 2, 14: 10, 31: 2}
Did not match all atoms present	67642-21-1	CC1CCCC(N1CC(CON=CC2=CC=C(O2)[N+](=O)[O-])O)C.Cl	{1: 2, 2: 2, 3: 1, 38: 1, 6: 1, 33: 1, 11: 3, 12: 2, 34: 1, 14: 2, 17: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	67648-61-7	CC(C(=O)O)OC1=CC=C(C=C1)O	{1: 1, 3: 1, 14: 4, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	67651-34-7	C1=CC(=CC=C1C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)O	{17: 4, 21: 1, 14: 5}
Did not match all atoms present	67658-42-8	CCN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CC(=O)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{32: 1, 1: 1, 2: 2, 3: 2, 33: 1, 11: 3, 12: 3, 14: 4, 20: 2, 24: 1, 27: 2, 30: 1}
Did not match all atoms present	67658-46-2	CCCN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CC(=O)N.CCCN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CC(=O)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{32: 2, 1: 2, 2: 6, 3: 2, 33: 2, 11: 6, 12: 6, 14: 8, 20: 2, 24: 2, 27: 2, 30: 2}
Did not match all atoms present	6766-56-9	CC1=CC(=C(C(=C1)C(C)(C)C)O)CCC2=C(C(=CC(=C2)C)C(C)(C)C)O	{1: 8, 2: 2, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	67663-00-7	CC(CCCC(C)(C)O)CC(C1(C=NC2=CC=CC=C21)C)C3(C=NC4=CC=CC=C43)C	{1: 5, 2: 4, 3: 2, 4: 1, 13: 2, 14: 10, 35: 2, 20: 1}
Did not match all atoms present	67674-20-8	CC(=O)NC1=CC(=C(C=C1OC)OC)S(=O)(=O)CCO	{1: 3, 2: 2, 14: 2, 20: 1, 22: 2, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	67674-23-1	CCN(CCO)C1=CC(=C(C=C1)N=NC2=C(C=CC(=C2)Cl)Cl)C	{1: 2, 2: 3, 33: 1, 34: 2, 14: 6, 17: 2, 20: 1}
Did not match all atoms present	67674-24-2	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)N(C)C)OC)N	{1: 4, 34: 2, 33: 1, 14: 6, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	67674-25-3	CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-])N(CCO)CCO	{1: 1, 2: 4, 38: 1, 33: 1, 34: 2, 14: 7, 20: 2}
Did not match all atoms present	67674-26-4	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCO)NCCCO	{25: 2, 2: 5, 20: 2, 14: 6, 31: 2}
Did not match all atoms present	67674-27-5	C1=CC=C(C=C1)CNC2=C3C(=C(C=C2)O)C(=O)C4=C(C3=O)C(=C(C=C4O)Br)N	{2: 1, 14: 8, 18: 1, 21: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	67674-29-7	COC1=CC(=C(C(=C1)S(=O)(=O)CCOS(=O)(=O)O)N/N=C\2/C=C(C3=CC=CC=C3C2=O)S(=O)(=O)O)OC	{1: 2, 2: 2, 34: 1, 14: 7, 15: 2, 20: 2, 22: 3, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	67674-30-0	CC1=CC(=C(C=C1NC(=O)C)S(=O)(=O)CCO)C	{1: 3, 2: 2, 14: 2, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	67674-31-1	C1=CC=C2C(=C1)C(=O)C(S2)C(=O)[O-].[Na+]	{24: 1, 25: 1, 12: 1, 14: 4, 41: 1}
Did not match all atoms present	67674-33-3	CC1=CC(=C(C=C1)C(=O)C=CN2CCN(CC2)C3=CC=CC=C3)C	{1: 2, 6: 2, 33: 2, 11: 4, 14: 8, 24: 1}
Did not match all atoms present	67674-40-2	CCC=CCCC=CCOC=O	{1: 1, 2: 4, 26: 1, 6: 4}
Did not match all atoms present	67674-48-0	CC1=CC=C(C=C1)S(=O)(=O)OC(C(F)(F)F)C(F)(F)F	{1: 1, 3: 1, 4: 2, 14: 4, 16: 6, 22: 1, 29: 2}
Did not match all atoms present	67674-55-9	CO[Si](CCCN=CC1=CC=CC=C1)(OC)OC	{1: 3, 34: 1, 6: 1, 2: 3, 14: 5, 22: 3}
Did not match all atoms present	67674-56-0	CN(C)CCC[Si](OC)(OC)OC.Cl	{1: 5, 2: 3, 33: 1, 22: 3, 17: 1}
Did not match all atoms present	67674-57-1	CCO[Si](CCCNC(C)C(=O)O)(OCC)OCC	{1: 4, 2: 6, 3: 1, 22: 3, 27: 1, 31: 1}
Did not match all atoms present	67674-58-2	CCCCCCCCCCCC(=O)NCCNCCC[Si](OC)(OC)OC.Cl	{1: 4, 2: 15, 17: 1, 22: 3, 24: 1, 31: 2}
Did not match all atoms present	67674-59-3	CCCCCCCCCCCCCCCCCC(=O)NCCNCCC[Si](OC)(OC)OC.Cl	{1: 4, 2: 21, 17: 1, 22: 3, 24: 1, 31: 2}
Did not match all atoms present	67674-60-6	CCO[Si](CCCN=C(C)C1=CC=CC=C1)(OCC)OCC	{1: 4, 2: 6, 7: 1, 34: 1, 14: 5, 22: 3}
Did not match all atoms present	67674-62-8	CCOC(=O)C=C.CO[Si](CCC1CCC2C(C1)O2)(OC)OC.C(CN)N	{1: 4, 2: 5, 5: 1, 6: 1, 11: 3, 12: 3, 22: 3, 23: 1, 28: 1, 30: 2}
Did not match all atoms present	67674-63-9	CCOC(=O)C=C.CO[Si](CCCCl)(OC)OC.C(CN)N	{1: 4, 2: 6, 5: 1, 6: 1, 17: 1, 22: 3, 28: 1, 30: 2}
Did not match all atoms present	67679-52-1	CCCCCOC1=CC=C(C=C1)OC(=O)C2CCC(CC2)CCC	{1: 2, 2: 6, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	67679-66-7	CCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCCCCC	{1: 2, 2: 8, 11: 4, 12: 2, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	6768-23-6	CCOC(=O)C(=CC1=CC=C(C=C1)OC)C(=O)OCC	{1: 3, 2: 2, 6: 1, 7: 1, 14: 4, 22: 1, 28: 2}
Did not match all atoms present	67682-19-3	CC(C(C)(C)CC1=CC=CC=C1)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	67689-49-0	CN(C)CCCNS(=O)(=O)C1=CC2=C(C=C1)C3=NC4=NC(=NC5=NC(=NC6=C7C=CC(=CC7=C([N-]6)N=C2[N-]3)S(=O)(=O)NCCCN(C)C)C8=C5C=CC=C8S(=O)(=O)NCCCN(C)C)C9=C4C(=CC=C9)S(=O)(=O)NCCCN(C)C.[Cu+2]	{1: 8, 2: 12, 35: 8, 33: 4, 14: 12, 29: 8, 31: 4}
Did not match all atoms present	67694-88-6	C1CC2=C(C3C1O3)C4=C(C=C2)C5=CC=CC=C5C=C4	{11: 2, 12: 2, 14: 8, 23: 1}
Did not match all atoms present	67697-31-8	CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O)C	{1: 2, 2: 1, 33: 1, 14: 7, 24: 1, 27: 2}
Did not match all atoms present	67697-32-9	CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(C=C(C=C3)C(=O)O)C(=O)O)C	{1: 2, 2: 1, 33: 1, 14: 7, 24: 1, 27: 2}
Did not match all atoms present	67697-46-5	CCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)N(C5=CC=CC=C5)C6=CC=CC=C6)C	{1: 2, 2: 1, 33: 2, 13: 1, 14: 18, 28: 1}
Did not match all atoms present	67697-49-8	CCCCN1C(=C(C2=CC=CC=C21)C(=O)C3=CC=CC=C3C(=O)O)C	{1: 2, 2: 3, 33: 1, 14: 8, 24: 1, 27: 1}
Did not match all atoms present	67697-69-2	CN(C)C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)N(C4=CC=CC=C4)C5=CC=CC=C5	{1: 2, 28: 1, 13: 1, 14: 18, 33: 2}
Did not match all atoms present	67698-68-4	CCCCCCCCOC1=CC=C(C=C1)CO	{1: 1, 2: 8, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	677-24-7	COP(=O)(Cl)Cl	{1: 1, 29: 1, 22: 1, 17: 2}
Did not match all atoms present	677-43-0	CN(C)P(=O)(Cl)Cl	{1: 2, 33: 1, 29: 1, 17: 2}
Did not match all atoms present	677-67-8	C(=O)(C(F)(F)S(=O)(=O)F)F	{16: 4, 24: 1, 4: 1, 29: 2}
Did not match all atoms present	67701-35-3	CC1=C(C=C(C=C1)C(=O)N)N.CC1=C(C=C(C=C1)C(=O)N)N.OS(=O)(=O)O	{1: 2, 14: 6, 20: 2, 24: 2, 29: 2, 30: 4}
Did not match all atoms present	67701-36-4	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCCO)NCCCO	{25: 2, 2: 6, 20: 2, 14: 6, 31: 2}
Did not match all atoms present	67704-68-1	CC(C)NC1=NC(=NC(=N1)N(C)C#N)NC(C)C	{1: 5, 3: 2, 37: 1, 33: 1, 35: 3, 31: 2}
Did not match all atoms present	6771-94-4	C1=CC(=CC=C1C(=O)NC2=CC3=C(C=C2)C(=O)/C(=N/NC4=CC=C(C=C4)C(=O)NC5=CC(=C(C=C5)[O-])C(=O)O)/C(=C3)S(=O)(=O)[O-])N.[Na+].[Na+]	{34: 1, 14: 15, 15: 2, 24: 2, 25: 1, 27: 1, 29: 3, 30: 1, 31: 3}
Did not match all atoms present	67711-84-6	CC1CO1.C1CO1.OP(=O)(O)[O-].[K+]	{1: 1, 11: 3, 12: 1, 20: 2, 23: 2, 29: 2}
Did not match all atoms present	67712-19-0	CC1=C(C=CC=C1N=C=O)N=C=O.C1=CC=C(C=C1)N=C=O	{8: 3, 1: 1, 34: 3, 29: 3, 14: 8}
Did not match all atoms present	67712-20-3	CC1=C/C(=N/NC2=CC=C(C=C2)N)/C=C(C1=O)C(=O)[O-].[Na+]	{1: 1, 34: 1, 14: 6, 15: 3, 24: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	6772-85-6	C1=CC=C(C(=C1)C=CC2=CC=CC=N2)I	{35: 1, 19: 1, 14: 8, 6: 2}
Did not match all atoms present	67730-10-3	C1=CC2=NC3=C(N2C=C1)N=C(C=C3)N	{33: 1, 35: 2, 30: 1, 14: 6}
Did not match all atoms present	67730-11-4	CC1=CC=CN2C1=NC3=C2N=C(C=C3)N	{1: 1, 35: 2, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	67733-57-7	C1=C2C3=CC(=C(C=C3OC2=CC(=C1Br)Br)Br)Br	{18: 4, 14: 4, 23: 1}
Did not match all atoms present	67745-25-9	C1=CC=C2C(=C1)C(=C3C(=C4C5=CC=CC=C5C(=O)C6=CC=CC=C64)C3=O)C7=CC=CC=C7C2=O	{25: 3, 14: 16, 15: 2}
Did not match all atoms present	67745-26-0	C1=CC=C2C(=C1)C(=C3C(=C4C5=CC=CC=C5C(=O)C6=CC=CC=C64)C3=C7C8=CC=CC=C8C(=O)C9=CC=CC=C97)C1=CC=CC=C1C2=O	{25: 3, 14: 24, 15: 6}
Did not match all atoms present	67747-09-5	CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N2C=CN=C2	{1: 1, 2: 4, 35: 1, 33: 2, 14: 5, 17: 3, 22: 1, 24: 1}
Did not match all atoms present	67748-63-4	CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)/C=C/N(C4=CC=CC=C4)C(=O)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 1, 6: 2, 33: 2, 41: 1, 14: 15, 24: 1, 29: 3}
Did not match all atoms present	6775-01-5	C1=CC=C(C=C1)P(CCCN)CCCN	{2: 6, 30: 2, 14: 5}
Did not match all atoms present	6775-25-3	CC1=CC=CC=C1OCC(CN2CCC=CC2)O.Cl	{1: 1, 2: 2, 3: 1, 33: 1, 11: 3, 14: 6, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	6775-77-5	CCOC1=CC=C(C=C1)CC#N	{1: 1, 2: 2, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	6775-78-6	C1=CC(=NN2C1=NC=C2)Cl	{17: 1, 35: 2, 14: 4, 33: 1}
Did not match all atoms present	67762-54-3	C1=CC(=O)OC1=O.C(CNCCNCCNCC[NH-])[NH-].[Zn+2]	{36: 2, 2: 8, 28: 2, 14: 2, 31: 3}
Did not match all atoms present	67762-62-3	C=O.C1=CC=C(C=C1)O.C(CNCCN)N	{2: 4, 5: 1, 14: 5, 21: 1, 30: 2, 31: 1}
Did not match all atoms present	67762-66-7	CCCCCCCCCCCCOC=C.CC1=CC=CC2=NNN=C12	{32: 1, 1: 2, 2: 11, 35: 2, 5: 1, 6: 1, 14: 3, 22: 1}
Did not match all atoms present	67762-69-0	CCCCCCCCCC(C)(C)N.C=O.C1=CC2=NNN=C2C=C1	{32: 1, 1: 3, 2: 8, 35: 2, 4: 1, 5: 1, 14: 4, 30: 1}
Did not match all atoms present	67762-76-9	CCCCCCC(=O)OCC(CO)(CO)COP(=O)(O)O	{1: 1, 2: 9, 4: 1, 20: 4, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	67763-26-2	CCN(CC)C1=CC(=C(C=C1)[N+]#N)Cl.CCN(CC)C1=CC(=C(C=C1)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 4, 33: 2, 34: 2, 14: 6, 17: 6}
Did not match all atoms present	67763-27-3	CC(C)[O-].CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)SC2=C(C=CC(=C2)C(C)(C)CC(C)(C)C)[O-].[Ni+2]	{1: 12, 2: 2, 3: 1, 4: 4, 40: 1, 14: 6, 21: 1, 29: 1}
Did not match all atoms present	67771-14-6	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC(=CC(=C1)O)O	{1: 5, 2: 1, 4: 2, 5: 1, 14: 8, 21: 3}
Did not match all atoms present	67779-49-1	CC(=CCC/C(=C/C(O)S(=O)(=O)[O-])/C)C.[Na+]	{1: 3, 2: 2, 3: 1, 6: 2, 7: 2, 20: 1, 29: 3}
Did not match all atoms present	67783-98-6	CC1=CC=CC=C1O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O	{1: 3, 4: 1, 5: 1, 14: 12, 21: 3}
Did not match all atoms present	67784-74-1	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC=C(C=C1)N	{1: 2, 30: 1, 4: 1, 21: 2, 14: 13}
Did not match all atoms present	67784-92-3	CNC.CO.C=CC(=O)N.C=O	{1: 3, 5: 2, 6: 1, 20: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	67785-34-6	CCOC1=C(C=CC(=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+]#N.CCOC1=C(C=CC(=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 2: 6, 33: 2, 34: 2, 14: 26, 17: 4, 22: 2}
Did not match all atoms present	67785-36-8	CCOC(=O)C=C.CC(=C)C(=O)[O-].COC(=O)C=C.C=C(CC(=O)O)C(=O)O.[NH4+]	{1: 3, 2: 2, 5: 4, 6: 2, 7: 2, 24: 1, 27: 2, 28: 2}
Did not match all atoms present	67785-39-1	CC(=C)C(=O)[O-].C=CC(=O)NCO.C=CC(=O)O.[Na+]	{1: 1, 2: 1, 5: 3, 6: 2, 7: 1, 20: 1, 24: 2, 27: 1, 31: 1}
Did not match all atoms present	67785-55-1	CC(=C)C(=O)OCC[N+](C)(C)C.CC(=O)OC=C.COS(=O)(=O)[O-]	{1: 6, 2: 2, 5: 2, 6: 1, 7: 1, 22: 1, 28: 2, 29: 3}
Did not match all atoms present	67785-56-2	C=CC(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].C=CC(=O)[O-].[Al+3].[K+]	{24: 4, 5: 4, 6: 4}
Did not match all atoms present	67785-69-7	CCCCCC(=CC1=CC=CC=C1)C(OCC=C(C)CCC=C(C)C)OCC=C(C)CCC=C(C)C	{1: 7, 2: 10, 3: 1, 6: 5, 7: 5, 14: 5, 22: 2}
Did not match all atoms present	67785-71-1	CCCCCC(=CC1=CC=CC=C1)C(OC(C)(CCC=C(C)C)C=C)OC(C)(CCC=C(C)C)C=C	{1: 7, 2: 8, 3: 1, 4: 2, 5: 2, 6: 5, 7: 3, 14: 5, 22: 2}
Did not match all atoms present	67785-72-2	CC(C)C1=CC=C(C=C1)C(OC)OC	{1: 4, 3: 2, 22: 2, 14: 4}
Did not match all atoms present	67785-76-6	COC(=O)C1=CC=CC=C1N=CCC2=CC=CC=C2	{1: 1, 2: 1, 6: 1, 34: 1, 14: 9, 28: 1}
Did not match all atoms present	67785-77-7	CCC(=O)OC(C)(C)CC1=CC=CC=C1	{1: 3, 2: 2, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	67785-78-8	B(O)(O)OCCN(CCO)CCO	{33: 1, 2: 6, 20: 4, 22: 1}
Did not match all atoms present	67785-88-0	CC(C)CC1=C(C(=C(C=C1OC2=CC=CC=C2)Cl)CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 3, 14: 6, 17: 1, 22: 1}
Did not match all atoms present	67785-89-1	CCCCCCCCCC(C)(C)C1=CC=CC2=C1C(=CC=C2)S(=O)(=O)O	{1: 3, 2: 8, 4: 1, 14: 6, 20: 1, 29: 2}
Did not match all atoms present	67785-93-7	CCCCCCC(CC=CCCCCCCCC(=O)[O-])OS(=O)(=O)[O-].[K+].[K+]	{1: 1, 2: 13, 3: 1, 6: 2, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67785-96-0	CCCCCCCC/C=C\CCCCCCCC(=O)NCCN(CC)CCO.CCOS(=O)(=O)O	{1: 3, 2: 20, 6: 2, 33: 1, 20: 2, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	67785-99-3	C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CCN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])CP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]	{33: 3, 2: 9, 29: 15}
Did not match all atoms present	67786-07-6	C1=CC(=CC(=C1)S(=O)(=O)[O-])N/N=C\2/C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 3, 38: 1, 14: 10, 15: 2, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	67786-08-7	CC1=CC=CC=C1O.C(CO)N	{1: 1, 2: 2, 14: 4, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	67786-10-1	CC(=C)CC(C)(C)C.C=O.C1=CC=C(C=C1)O	{1: 4, 2: 1, 4: 1, 5: 2, 7: 1, 14: 5, 21: 1}
Did not match all atoms present	67786-11-2	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[NH4+].[NH4+].[Ge]	{24: 6}
Did not match all atoms present	67786-12-3	CC1=CC2=C(N1)C=CC(=C2)S(=O)(=O)O	{32: 1, 1: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	67786-13-4	CCOC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])N.[Na+]	{1: 1, 2: 1, 34: 2, 14: 7, 22: 1, 29: 3, 30: 1}
Did not match all atoms present	67786-15-6	COC1=C(C=C(C=C1)S(=O)(=O)[O-])NN=C2C=CC(=O)C(=NNC3=CC(=C(C=C3)[N+](=O)[O-])N)C2=O.[Na+]	{1: 1, 34: 2, 38: 1, 14: 8, 22: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	67786-16-7	C1=CC(=CC=C1N/N=C\2/C=C(C(=CC2=O)O)N=NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C=C4O)S(=O)(=O)O)[N+](=O)[O-]	{34: 3, 38: 1, 14: 10, 15: 3, 20: 3, 21: 1, 25: 1, 29: 4, 31: 1}
Did not match all atoms present	67786-17-8	C1=CC(=CC=C1C(=O)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)[O-])N.[Na+]	{14: 9, 21: 1, 24: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	67786-19-0	CCOC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)N=NC3C(=NN(C3=O)C4=CC(=CC=C4)N)C(=O)[O-].[Na+]	{1: 1, 2: 1, 35: 1, 33: 1, 12: 1, 34: 4, 14: 11, 15: 1, 20: 1, 22: 1, 24: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	67786-20-3	CCNS(=O)(=O)C1=C(C=C(C(=C1)Cl)N/N=C/2\C(=NC3=C2C=CC=C3S(=O)(=O)[O-])C)Cl.[Na+]	{1: 2, 2: 1, 35: 1, 34: 1, 14: 5, 15: 2, 17: 2, 29: 5, 31: 2}
Did not match all atoms present	67786-21-4	CCNS(=O)(=O)C1=C(C=C(C(=C1)Cl)N/N=C/2\C(=NC3=C2C=C(C=C3)S(=O)(=O)[O-])C)Cl.[Na+]	{1: 2, 2: 1, 35: 1, 34: 1, 14: 5, 15: 2, 17: 2, 29: 5, 31: 2}
Did not match all atoms present	67786-22-5	CC1=CC2=C(N1)C(=CC=C2)S(=O)(=O)O	{32: 1, 1: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	67786-23-6	C1=CC(=CC=C1N=NC2=CC(=C(C(=C2O)N=NC3=C(C=CC(=C3)[N+](=O)[O-])O)O)N=NC4=C5C(=CC(=C4)S(=O)(=O)[O-])C=C(C(=C5O)N=NC6=CC=C(C=C6)[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-].[Na+].[Na+]	{34: 8, 38: 3, 21: 4, 14: 15, 29: 6}
Did not match all atoms present	67786-26-9	CC1=NN(C(=O)C1N=NC2=CC=CC=C2C(=O)[O-])C3=CC=CC=C3.[Na+]	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 9, 15: 1, 24: 1, 25: 1}
Did not match all atoms present	67786-29-2	C(=O)[NH3+].C(#N)N=C(N)N	{26: 1, 37: 1, 34: 1, 30: 2, 7: 1}
Did not match all atoms present	67786-32-7	CC1CO1.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N	{1: 1, 2: 1, 11: 1, 12: 1, 14: 8, 23: 1, 30: 2}
Did not match all atoms present	67797-68-6	C1(=NC(=NC(=N1)N)N)N.C(=O)(C(=O)[O-])[O-]	{24: 2, 35: 3, 30: 3}
Did not match all atoms present	6780-13-8	C(CN)N.O	{2: 2, 30: 2}
Did not match all atoms present	6780-49-0	CCOC=NC1=CC=CC=C1	{1: 1, 34: 1, 6: 1, 2: 1, 14: 5, 22: 1}
Did not match all atoms present	67800-79-7	CCCCCCC=C(CCCCC)C=NC1=CC=CC=C1C(=O)OC	{1: 3, 2: 9, 6: 2, 7: 1, 34: 1, 14: 4, 28: 1}
Did not match all atoms present	67800-84-4	CC1C2CC2(C(=CC3=CC=C(C=C3)OC)C1=O)C(C)C	{1: 4, 3: 1, 6: 1, 11: 1, 12: 2, 13: 1, 14: 4, 15: 1, 22: 1, 25: 1}
Did not match all atoms present	67800-88-8	CCN1C2=C(C=CC(=C2)OC)[Se]C1=CC3=[N+](C4=C(C=C3)C=C(C=C4)OC)CC.[Br-]	{1: 4, 2: 2, 6: 1, 33: 2, 14: 8, 15: 1, 18: 1, 22: 2}
Did not match all atoms present	67800-91-3	CCN1C2=CC=CC=C2SC1=CC(=CC3=[N+](C4=CC=CC=C4S3)CC)C.CCOS(=O)(=O)[O-]	{1: 4, 2: 3, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 22: 1, 29: 3}
Did not match all atoms present	67800-93-5	CC[N+]1=C(OC2=C1C3=CC=CC=C3C=C2)C=CNC4=CC=CC=C4.CCOS(=O)(=O)[O-]	{1: 2, 2: 2, 6: 2, 33: 1, 14: 11, 22: 1, 23: 1, 29: 3, 31: 1}
Did not match all atoms present	67800-99-1	CCCCN(CCCC)S(=O)(=O)C1=CC2=C3[N-]C(=C2C=C1)N=C4C5=C(C=CC=C5S(=O)(=O)N(CCCC)CCCC)C(=N4)N=C6C7=C(C(=CC=C7)S(=O)(=O)N(CCCC)CCCC)C(=N6)N=C8C9=CC=CC=C9C(=N3)[N-]8.[Cu+2]	{1: 6, 2: 18, 35: 8, 33: 3, 14: 13, 29: 6}
Did not match all atoms present	67801-02-9	CC1=CC(=C(C=C1Cl)NN=C2C(=O)C=CC3=CC=CC=C32)S(=O)(=O)[O-].CC1=CC(=C(C=C1Cl)NN=C2C(=O)C=CC3=CC=CC=C32)S(=O)(=O)[O-].[Ca+2]	{1: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	67801-03-0	CCC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C/2\C3=CC=CC=C3C=CC2=O.CCC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C/2\C3=CC=CC=C3C=CC2=O.[Ca+2]	{1: 2, 2: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	67801-04-1	CCN(CC1=CC=C(C=C1)S(=O)(=O)O)C2=CC=CC(=C2)C	{1: 2, 2: 2, 33: 1, 14: 8, 20: 1, 29: 2}
Did not match all atoms present	67801-05-2	CCCCOCCN1C(=O)C2=C(C3=C(C(=C2C1=O)N)C(=O)C4=CC=CC=C4C3=O)N	{1: 1, 2: 5, 33: 1, 14: 4, 22: 1, 25: 4, 30: 2}
Did not match all atoms present	67801-06-3	CCOC1=C(C=C(C=C1)N)N.Cl.Cl	{1: 1, 2: 1, 14: 3, 17: 2, 22: 1, 30: 2}
Did not match all atoms present	67801-08-5	COC1=C(C=CC(=C1)N2CCOCC2)[N+]#N.COC1=C(C=CC(=C1)N2CCOCC2)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 2, 33: 2, 11: 8, 14: 6, 17: 4, 22: 2, 23: 2}
Did not match all atoms present	67801-09-6	CC(=C1C(=O)N(C(=S)O1)CCS(=O)(=O)O)C=C2N(C3=CC=CC=C3O2)C	{1: 2, 2: 2, 33: 2, 6: 1, 7: 1, 14: 4, 15: 3, 20: 1, 23: 2, 25: 1, 29: 2}
Did not match all atoms present	67801-18-7	C1CCC2=C(C1)C=CC(=C2)CC=O	{2: 1, 11: 4, 26: 1, 14: 3}
Did not match all atoms present	67801-26-7	CCOC(=O)C1=CC=CC=C1N=CCCCCCC(C)(C)O	{1: 3, 2: 6, 4: 1, 6: 1, 34: 1, 14: 4, 20: 1, 28: 1}
Did not match all atoms present	67801-47-2	CC(=CCCC(=CC=NC1=CC=CC=C1C(=O)OC)C)C	{1: 4, 2: 2, 6: 3, 7: 2, 34: 1, 14: 4, 28: 1}
Did not match all atoms present	67801-53-0	CC1=CC=C(C=C1)C2=C(C=CC(=C2)C(=O)OC)C(=O)OC	{1: 3, 28: 2, 14: 7}
Did not match all atoms present	67801-54-1	COC(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=CC(=C3)C(=O)OC	{1: 2, 28: 2, 14: 6, 25: 1}
Did not match all atoms present	67801-55-2	CC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)C(=O)OC	{1: 2, 2: 1, 28: 2, 14: 8}
Did not match all atoms present	67801-56-3	CC1=CC(=C(C=C1)C(=O)OC)C2=CC=C(C=C2)C(=O)OC	{1: 3, 28: 2, 14: 7}
Did not match all atoms present	67801-57-4	C1=CC(=C(C=C1C(=O)[O-])C(=O)[O-])C(=O)[O-].[Co+3]	{24: 3, 14: 3}
Did not match all atoms present	67801-58-5	CC1=C2C3=CC=CC=C3C(=O)OC2=C(C=C1)C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	67801-59-6	COC(=O)C1=CC2=C(C=C1)C3=C(C(=CC=C3)C(=O)OC)OC2=O	{1: 2, 28: 3, 14: 6}
Did not match all atoms present	67801-60-9	CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN)C.OP(=O)(O)O	{1: 4, 2: 1, 3: 1, 11: 5, 12: 1, 13: 2, 14: 3, 20: 3, 29: 1, 30: 1}
Did not match all atoms present	67801-68-7	C1=CC=C2C=C(C=CC2=C1)C(C3=CC4=CC=CC=C4C=C3)(S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{4: 1, 29: 6, 14: 14}
Did not match all atoms present	67801-77-8	CC(=C)C(=O)O.C=C/C=C/[NH3+]	{1: 1, 27: 1, 5: 2, 6: 3, 7: 1}
Did not match all atoms present	67803-84-3	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)N=NC(C(=O)NC5=C(C=C(C=C5)Cl)Cl)C(=O)NC6=C(C=C(C=C6)Cl)Cl	{34: 2, 3: 1, 14: 17, 17: 4, 24: 3, 25: 2, 31: 3}
Did not match all atoms present	67806-12-6	CCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)[O-]	{24: 1, 1: 3, 2: 17, 29: 1, 31: 1}
Did not match all atoms present	6781-42-6	CC(=O)C1=CC(=CC=C1)C(=O)C	{24: 2, 1: 2, 14: 4}
Did not match all atoms present	6781-98-2	CC1=C(C(=CC=C1)C)Cl	{1: 2, 14: 3, 17: 1}
Did not match all atoms present	67814-76-0	C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N)NC(=O)[C@H](CN)O)O.[O-]S(=O)(=O)[O-]	{1: 2, 2: 2, 3: 1, 11: 2, 12: 13, 13: 1, 20: 7, 22: 2, 23: 2, 24: 1, 29: 4, 30: 3, 31: 2}
Did not match all atoms present	67815-56-9	C1=CC(=C(C(=C1F)N)F)F	{16: 3, 30: 1, 14: 2}
Did not match all atoms present	67815-64-9	C1=CC2=C(C=CC(=C2N=O)[O-])C=C1S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2N=O)[O-])C=C1S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2N=O)[O-])C=C1S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Co+3]	{34: 3, 29: 12, 14: 15}
Did not match all atoms present	67815-65-0	C1=CC(=CC=C1NCS(=O)(=O)[O-])N=NC2=C(C=CC(=C2)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{2: 1, 34: 2, 14: 7, 17: 1, 29: 6, 31: 1}
Did not match all atoms present	67815-66-1	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)N/N=C\2/C(=CC=C3C2=CC(=CC3=O)S(=O)(=O)[O-])N.[Na+]	{34: 1, 38: 1, 14: 7, 15: 5, 25: 1, 27: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	67815-67-2	C1=C(C(=CC(=C1Cl)[N+](=O)[O-])O)N.Cl	{17: 2, 30: 1, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	67815-68-3	C1=C(C=C(C(=C1[N+](=O)[O-])O)N)Cl.Cl	{17: 2, 30: 1, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	67815-69-4	C1=C(C=C2C(=CC(=CC2=C1S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]	{30: 1, 29: 9, 14: 4}
Did not match all atoms present	67815-71-8	CC(C)(CO)CO.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O.C(CCCC(=O)O)CCCC(=O)O	{1: 2, 2: 9, 4: 1, 14: 3, 20: 2, 27: 3, 28: 2}
Did not match all atoms present	67815-76-3	CCC(C)OP(=S)(OC(C)CC)S.C1CCC(CC1)NC2CCCCC2	{1: 4, 2: 2, 3: 2, 39: 1, 11: 10, 12: 2, 22: 2, 31: 1}
Did not match all atoms present	67815-78-5	CCC(CO)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O	{1: 1, 2: 4, 4: 1, 14: 6, 20: 3, 28: 4}
Did not match all atoms present	67815-91-2	CCCCCCCCCC(CCCCCCCC(=O)O)OS(=O)(=O)[O-].[Na+]	{1: 1, 2: 15, 3: 1, 22: 1, 27: 1, 29: 3}
Did not match all atoms present	67815-95-6	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C(CO)NCCO	{1: 1, 2: 15, 14: 4, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	67815-96-7	CCCCCCCCCC(CCCCCCCC(=O)OCCCCCCCC(C)C)OS(=O)(=O)[O-].[Na+]	{1: 3, 2: 22, 3: 2, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	67815-97-8	CCCCCCCCCCCCCCCCCC(=O)N(CCO)CCOC(=O)/C=C/C(=O)O.N	{1: 1, 2: 20, 6: 2, 33: 1, 20: 1, 24: 1, 27: 1, 28: 1}
Did not match all atoms present	67816-06-2	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[In+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	67816-07-3	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ir+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	67816-08-4	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ir+3]	{24: 3, 1: 3, 2: 18}
Did not match all atoms present	67816-09-5	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[La+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	67816-11-9	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Pd+2]	{24: 2, 1: 4, 2: 8, 3: 2}
Did not match all atoms present	67821-33-4	C1=CC(=CC=C1C=C(C#N)C#N)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]	{37: 2, 38: 1, 7: 1, 14: 8, 6: 1, 28: 1}
Did not match all atoms present	67827-53-6	CCOC(=O)C=CC1=C(C=C(C=C1OC)OC)OC	{1: 4, 2: 1, 6: 2, 14: 2, 22: 3, 28: 1}
Did not match all atoms present	67827-54-7	CCOC1=CC(=C(C=C1C=O)OCC)OCC	{1: 3, 2: 3, 26: 1, 22: 3, 14: 2}
Did not match all atoms present	67827-55-8	CCC1=C(C=C(C=C1OC)OC)OC	{1: 4, 2: 1, 22: 3, 14: 2}
Did not match all atoms present	67827-56-9	COC1=CC(=C(C(=C1)OC)Cl)OC	{1: 3, 22: 3, 14: 2, 17: 1}
Did not match all atoms present	67827-57-0	C1=CC=C(C=C1)C(=O)NC2=CC(=CC(=C2)O)O	{24: 1, 21: 2, 14: 8, 31: 1}
Did not match all atoms present	67827-58-1	CCCCCCCCCCCC(=O)O[Sn](C)(C)O[Sn](C)(C)OC(=O)CCCCCCCCCCC	{1: 6, 2: 20, 28: 2, 22: 1}
Did not match all atoms present	67827-59-2	CCCCCCCC/C=C/CCCCCCCC(=O)O[Sn](O[Sn](OC(=O)CCCCCCC/C=C/CCCCCCCC)(CCCC)CCCC)(CCCC)CCCC	{1: 6, 2: 40, 28: 2, 22: 1, 6: 4}
Did not match all atoms present	67827-62-7	C1=CC=C2C(=C1)C(=CC=C2N(CC(CO)O)CC(CO)O)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 2: 4, 3: 2, 38: 2, 34: 2, 14: 8, 17: 1, 20: 4}
Did not match all atoms present	67827-63-8	CC1=NN(C(=O)C1N/N=C/2\C=C(C=CC2=O)C(=O)NC3=CC(=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=C(C=C5)N)C)C(=O)O)C6=CC=C(C=C6)N	{1: 2, 34: 3, 35: 2, 33: 2, 12: 2, 14: 14, 15: 4, 24: 1, 25: 3, 27: 1, 30: 2, 31: 2}
Did not match all atoms present	67827-64-9	CCN1C(=O)C(=C(/C(=N/NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)Cl)OC(C)C)S(=O)(=O)[O-])/C1=O)C)CS(=O)(=O)[O-].[Na+].[Na+]	{1: 4, 2: 2, 3: 1, 33: 1, 34: 1, 14: 3, 15: 3, 17: 1, 35: 3, 22: 1, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	67827-65-0	CC1=CC(=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC(=C(C=C5)S(=O)(=O)[O-])NC6=NC(=NC(=N6)C(C)C)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 3, 34: 1, 3: 1, 14: 9, 15: 2, 17: 2, 35: 6, 25: 1, 29: 12, 31: 4}
Did not match all atoms present	67827-67-2	CN(C1=CC2=C(C=C1)C(=O)C(=NNC3=C(C=CC(=C3)NC(=O)C(CBr)Br)S(=O)(=O)[O-])C(=C2)S(=O)(=O)[O-])C(=O)C(CBr)Br.[Na+].[Na+]	{1: 1, 2: 2, 3: 2, 33: 1, 34: 1, 14: 7, 15: 2, 18: 4, 24: 2, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	67827-69-4	CC1=C(C=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O)Cl	{1: 1, 14: 9, 17: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	67827-70-7	CCCCN(C1=C(C=CC(=C1)S(=O)(=O)Cl)OC)C(=O)C	{1: 3, 2: 3, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	67827-72-9	COC1=C(C=C(C=C1)[N+](=O)[O-])N.Cl	{1: 1, 38: 1, 14: 3, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	67827-84-3	[H+].CNS(=O)(=O)C1=CC(=C(C=C1)[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].CNS(=O)(=O)C1=CC(=C(C=C1)[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].[Cr+3]	{1: 2, 34: 4, 29: 4, 14: 18, 31: 2}
Did not match all atoms present	67827-88-7	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=CC=C(C=C3)N(CN)C(=O)C4=CC(=C(C(=C4CN)CN)N/N=C/5\C(=O)C=CC6=CC=CC=C65)CN	{33: 1, 2: 4, 34: 2, 14: 17, 15: 2, 24: 1, 25: 2, 30: 4, 31: 2}
Did not match all atoms present	67827-89-8	CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=CC=C(C=C3)N(CN)C(=O)C4=CC(=C(C(=C4CN)CN)N/N=C/5\C(=O)C=CC6=CC=CC=C65)CN	{1: 4, 2: 4, 33: 1, 34: 2, 14: 17, 15: 2, 24: 1, 25: 2, 27: 4, 30: 4, 31: 2}
Did not match all atoms present	67827-90-1	CCCCCCCCCCC(C(=O)OCC(CO)O)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 11, 3: 2, 20: 2, 28: 1, 29: 3}
Did not match all atoms present	67828-01-7	CC(C)CCCCCC1=CC=CC=C1S(=O)(=O)[O-].[Na+]	{1: 2, 2: 5, 3: 1, 29: 3, 14: 4}
Did not match all atoms present	67828-02-8	CC(C)CCCCC1=CC=CC=C1S(=O)(=O)[O-].[Na+]	{1: 2, 2: 4, 3: 1, 29: 3, 14: 4}
Did not match all atoms present	67828-17-5	CCCCN(CCCC)P(=O)(OCC)OCC	{1: 4, 2: 8, 29: 1, 22: 2, 33: 1}
Did not match all atoms present	67828-18-6	CC1=CC(=C(C=C1N/N=C/2\C=C(C3=CC=CC=C3C2=O)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O)C	{1: 2, 2: 2, 34: 1, 14: 7, 15: 2, 20: 2, 22: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	67828-20-0	CC1=C(C=C(C=C1)[N+](=O)[O-])NN=C2C3=CC=CC=C3C=C(C2=O)C(=O)NC4=C(C=CC(=C4)Cl)OC	{1: 2, 34: 1, 38: 1, 14: 11, 15: 2, 17: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	67828-22-2	CC(=O)C(C(=O)NC1=C(C=C(C=C1)OC)OC)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=C(C=C4)OC)OC)Cl)Cl	{1: 6, 34: 4, 3: 2, 14: 12, 17: 2, 22: 4, 24: 4, 31: 2}
Did not match all atoms present	67828-23-3	C1=CC=C(C=C1)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)O.[Cu]	{34: 1, 14: 10, 15: 2, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	67828-25-5	C1=CC(=CC=C1NC2=NC(=NC(=N2)NCCO)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])NCCO)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+].[K+]	{2: 4, 35: 6, 6: 2, 14: 14, 20: 2, 29: 12, 31: 6}
Did not match all atoms present	67828-28-8	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=CC=C(C=C3)Cl)C(=O)O.[Cu]	{34: 1, 14: 9, 15: 2, 17: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	67828-29-9	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C(C3=CC=C(C=C3)N(CC)CC4=CC=CC=C4)C5=C(C=C(C=C5)S(=O)(=O)O)S(=O)(=O)O	{1: 2, 2: 4, 3: 1, 33: 2, 14: 21, 20: 2, 29: 4}
Did not match all atoms present	67828-30-2	CCNC1=C(C=C(C=C1)C(C2=CC(=C(C=C2)NCC)C)C3=CC=CC=C3Cl)C	{1: 4, 2: 2, 3: 1, 14: 10, 17: 1, 31: 2}
Did not match all atoms present	67828-32-4	CCN(CC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CC)CC)C3=C4C=CC(=CC4=CC(=C3)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 2: 4, 3: 1, 33: 2, 14: 13, 20: 2, 29: 4}
Did not match all atoms present	67828-33-5	C1=CC2=C(C=C1C(=O)[O-])SC(=N2)N.[Na+]	{24: 1, 41: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	67828-34-6	C1=CC2=C(C=C1C(=O)O)SC(=N2)N.Br	{35: 1, 41: 1, 14: 3, 18: 1, 27: 1, 30: 1}
Did not match all atoms present	67828-35-7	CCCCOC1=C(C=C(C=C1Br)C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4)Br)O)Br)Br	{1: 1, 2: 3, 13: 1, 14: 8, 18: 4, 21: 1, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	67828-36-8	CC(C1=C(C=C(C=C1)O)O)O	{1: 1, 3: 1, 20: 1, 21: 2, 14: 3}
Did not match all atoms present	67828-38-0	CCOC1=C(C=C(C(=C1Cl)[N+](=O)[O-])C)Cl	{1: 2, 2: 1, 38: 1, 14: 1, 17: 2, 22: 1}
Did not match all atoms present	67828-40-4	CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C)Cl	{1: 2, 2: 1, 38: 1, 14: 2, 17: 1, 22: 1}
Did not match all atoms present	67828-41-5	CCOC1=C(C=C(C=C1Cl)C)Cl	{1: 2, 2: 1, 22: 1, 14: 2, 17: 2}
Did not match all atoms present	67828-42-6	COC(=O)CC1=C(C=C(C=C1)O)O	{1: 1, 2: 1, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	67828-43-7	COC(=O)C(C1=C(C=C(C=C1)O)O)O	{1: 1, 3: 1, 14: 3, 20: 1, 21: 2, 28: 1}
Did not match all atoms present	67828-44-8	C1=C(C(=CC(=C1Cl)O)O)C(=O)O	{17: 1, 27: 1, 21: 2, 14: 2}
Did not match all atoms present	67828-45-9	C1=C(C(=CC(=C1Cl)O)O)C(=O)N	{24: 1, 17: 1, 30: 1, 21: 2, 14: 2}
Did not match all atoms present	67828-46-0	CCCCOC1=CC(=C(C=C1N2CCOCC2)OCCCC)N	{1: 2, 2: 6, 33: 1, 11: 4, 14: 2, 22: 2, 23: 1, 30: 1}
Did not match all atoms present	67828-47-1	CCCCOC1=CC(=C(C=C1N2CCCC2)OCCCC)N	{1: 2, 2: 6, 33: 1, 11: 4, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	67828-49-3	CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCCC2.CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCCC2.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 12, 33: 2, 11: 8, 34: 2, 14: 4, 17: 4, 22: 4}
Did not match all atoms present	67828-50-6	CCCCOC1=CC(=C(C=C1N2CCCC2)OCCCC)[N+](=O)[O-]	{1: 2, 2: 6, 38: 1, 33: 1, 11: 4, 14: 2, 22: 2}
Did not match all atoms present	67828-51-7	C1=CC(=C(C=C1O)O)C(CCCCO)C2=C(C=C(C=C2)O)O	{2: 4, 3: 1, 20: 1, 21: 4, 14: 6}
Did not match all atoms present	67828-52-8	CCN(CC)C1=C(C=C(C(=C1)OCC)N)OCC	{1: 4, 2: 4, 33: 1, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	67828-54-0	CCN(CC)C1=C(C=C(C(=C1)OCC)[N+]#N)OCC.CCN(CC)C1=C(C=C(C(=C1)OCC)[N+]#N)OCC.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 8, 2: 8, 33: 2, 34: 2, 14: 4, 17: 4, 22: 4}
Did not match all atoms present	67828-56-2	COC1=C(C=CC(=C1)[N+]#N)N2CCCC2.COC1=C(C=CC(=C1)[N+]#N)N2CCCC2.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 2, 33: 2, 11: 8, 14: 6, 17: 4, 22: 2}
Did not match all atoms present	67828-57-3	COC1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2	{1: 1, 38: 1, 33: 1, 11: 4, 14: 3, 22: 1}
Did not match all atoms present	67828-58-4	CC1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2	{1: 1, 11: 4, 38: 1, 14: 3, 33: 1}
Did not match all atoms present	67828-59-5	COC1=C(C=C(C=C1)C(=N)C(=O)OC)OC.Cl	{1: 3, 36: 1, 7: 1, 14: 3, 17: 1, 22: 2, 28: 1}
Did not match all atoms present	67828-60-8	CCOC(=O)C(C1=CC=C(C=C1)O)N.Cl	{1: 1, 2: 1, 3: 1, 14: 4, 17: 1, 21: 1, 28: 1, 30: 1}
Did not match all atoms present	67828-61-9	CCOC(=O)C(C1=C(C=C(C=C1)O)O)O	{1: 1, 2: 1, 3: 1, 14: 3, 20: 1, 21: 2, 28: 1}
Did not match all atoms present	67828-62-0	CCOC(=O)CC1=C(C=C(C=C1)O)O	{1: 1, 2: 2, 28: 1, 21: 2, 14: 3}
Did not match all atoms present	67828-63-1	CCOC1=CC(=C(C=C1Cl)OCC)Cl	{1: 2, 2: 2, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	67828-64-2	CCOC1=C(C=C(C(=C1OC)[N+](=O)[O-])C)Cl	{1: 3, 2: 1, 38: 1, 14: 1, 17: 1, 22: 2}
Did not match all atoms present	67828-65-3	C1COCCN1C2=C(C=C(C=C2)[N+]#N)Cl.C1COCCN1C2=C(C=C(C=C2)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{33: 2, 34: 2, 11: 8, 14: 6, 17: 6, 23: 2}
Did not match all atoms present	67828-66-4	[B-](F)(F)(F)F.C1COCCN1C2=C(C=C(C=C2)[N+]#N)Cl	{33: 1, 34: 1, 11: 4, 14: 3, 16: 4, 17: 1, 23: 1}
Did not match all atoms present	67828-68-6	CNCC(=O)C1=CC=C(C=C1)O.Cl	{1: 1, 2: 1, 14: 4, 17: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	67828-69-7	COC(=O)C1=CC(=C(C=C1O)O)Cl	{1: 1, 28: 1, 21: 2, 14: 2, 17: 1}
Did not match all atoms present	67828-70-0	CC(=O)NC1=CC=CC2=C1C(=O)C(C2=O)C3=NC4=CC=CC=C4C=C3O	{1: 1, 35: 1, 12: 1, 14: 8, 21: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	67828-71-1	CC(=O)C1(CC(=O)C(O1)(C)SCC2=CC=CO2)C	{1: 3, 2: 1, 40: 1, 11: 1, 13: 2, 14: 3, 23: 2, 24: 1, 25: 1}
Did not match all atoms present	67828-73-3	C1=CC=C2C(=C1)C=CC3=C2C=CC(=N3)C=C4C5=CC=CC=C5C(=O)O4	{35: 1, 28: 1, 14: 12, 6: 1, 15: 1}
Did not match all atoms present	67829-74-7	CCOC(=O)CCOC1=CC=C(C=C1)Cl	{1: 1, 2: 3, 14: 4, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	6783-05-7	B(/C=C/C1=CC=CC=C1)(O)O	{20: 2, 14: 5, 6: 2}
Did not match all atoms present	67832-11-5	CC1=C(C=CC(=C1)Br)C#N	{1: 1, 18: 1, 37: 1, 14: 3}
Did not match all atoms present	6784-25-4	C1=CC(=CC=C1NC=O)S(=O)(=O)C2=CC=C(C=C2)NC=O	{26: 2, 29: 2, 14: 8, 31: 2}
Did not match all atoms present	6784-62-9	CC(=O)CC1=NC=CN=C1	{24: 1, 1: 1, 2: 1, 35: 2, 14: 3}
Did not match all atoms present	67845-33-4	CC1=CC(=C(C(=C1)C(C)(C)C)OC)C	{1: 6, 4: 1, 22: 1, 14: 2}
Did not match all atoms present	67845-34-5	CCOC1=NC=C(N=C1)C	{1: 2, 2: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	67845-38-9	CCC1=CN=CC(=N1)OC	{1: 2, 2: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	67845-40-3	CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOCCOCCOCCOCCOCCOC(=O)C	{1: 2, 2: 26, 28: 1, 22: 9, 14: 4}
Did not match all atoms present	67845-48-1	CC(=CCCC(=CCN1C=CC2=CC=CC=C21)C)C	{1: 3, 2: 3, 6: 2, 33: 1, 7: 2, 14: 6}
Did not match all atoms present	67845-51-6	CC(C)C1=CC=C(C=C1)CC(C)C#N	{1: 3, 2: 1, 3: 2, 37: 1, 14: 4}
Did not match all atoms present	67845-60-7	CCCCOP(O)OCCCC.CC1=CC2=NNN=C2C=C1	{32: 1, 1: 3, 2: 6, 35: 2, 14: 3, 20: 1, 22: 2}
Did not match all atoms present	67845-63-0	CC1=CC=CC=C1.C1=CC=C(C=C1)CO	{1: 1, 2: 1, 20: 1, 14: 10}
Did not match all atoms present	67845-69-6	CCCCCCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 14, 3: 2, 28: 1, 29: 3}
Did not match all atoms present	67845-70-9	CCCCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 12, 3: 2, 28: 1, 29: 3}
Did not match all atoms present	67845-73-2	CCCCCCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)O.N	{1: 3, 2: 14, 3: 2, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	67845-74-3	CCCCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)O.N	{1: 3, 2: 12, 3: 2, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	67845-75-4	CCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)O.N	{1: 3, 2: 10, 3: 2, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	67845-76-5	CCCCC(CC)COC(=O)C(CCCC)S(=O)(=O)O.N	{1: 3, 2: 8, 3: 2, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	67845-80-1	CCCCCCCCCCCCC1=CC(=C(C(=C1)CN(CCO)CCO)O)CN(CCO)CCO	{1: 1, 2: 21, 33: 2, 14: 2, 20: 4, 21: 1}
Did not match all atoms present	67845-81-2	C1=CC=C(C=C1)C(=O)OCCOCCOC2=CC=CC=C2	{2: 4, 28: 1, 22: 2, 14: 10}
Did not match all atoms present	67845-84-5	CC1=CC(=C(C=C1)[N+]#N)[N+](=O)[O-].CC1=CC(=C(C=C1)[N+]#N)[N+](=O)[O-].CC1=CC(=C(C=C1)[N+]#N)[N+](=O)[O-].CC1=CC(=C(C=C1)[N+]#N)[N+](=O)[O-].[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 34: 4, 38: 4, 14: 12, 17: 4}
Did not match all atoms present	67845-91-4	CC(C)CC(C)CCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 3, 2: 3, 3: 2, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	67845-96-9	CC(C)C(C)CCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 3, 2: 3, 3: 2, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	67845-97-0	CCCCC(C)CCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 2, 2: 5, 3: 1, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	67845-98-1	CCC(C)C(C)CCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 3, 2: 3, 3: 2, 14: 8, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	67846-01-9	COCCCNC(=O)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)O	{1: 1, 2: 3, 17: 4, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	67846-02-0	C1C2CC3CC1CC(C2)C3N4C(=O)C5=C(C4=O)C(=C(C(=C5Cl)Cl)Cl)Cl	{17: 4, 11: 5, 12: 5, 33: 1, 25: 2}
Did not match all atoms present	67846-05-3	CCCCCCCCC(CCCCCCCCC(=O)OCC1CCCO1)OS(=O)(=O)[O-].[Na+]	{1: 1, 2: 16, 3: 1, 11: 3, 12: 1, 22: 1, 23: 1, 28: 1, 29: 3}
Did not match all atoms present	67846-06-4	CCCCCCCCCCCCCCCCCCN(C)C.CCOP(=O)(O)O	{1: 4, 2: 18, 33: 1, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	67846-08-6	CCCCCCCCCCCCCCCCCC(=O)NCCNCCCCNC(=O)N.CCOP(=O)(O)OCC	{1: 3, 2: 24, 20: 1, 22: 2, 24: 2, 29: 1, 30: 1, 31: 3}
Did not match all atoms present	67846-10-0	C1=CC=C(C=C1)COC(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)OCC3=CC=CC=C3	{2: 2, 27: 1, 28: 2, 14: 13}
Did not match all atoms present	67846-12-2	CCCCCCCC/C=C\CCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCC/C=C\CCCCCCCC)CC.CCOS(=O)(=O)O	{1: 4, 2: 34, 6: 4, 33: 1, 20: 1, 22: 1, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	67846-14-4	CCCCCCCCC=CCCCCCCCC1=NCC[N+]1(CC)CCNC(=O)CCCCCCCC=CCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 32, 35: 1, 6: 4, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	67846-16-6	CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 21, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	67846-18-8	C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4	{33: 2, 2: 1, 11: 5, 14: 8, 23: 2}
Did not match all atoms present	67846-19-9	CCCCCCCCCCCCCCCCCCN(C)C.CCCCCCCCOP(=O)(O)OCCCCCCCC	{1: 5, 2: 31, 33: 1, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	67846-22-4	CCCCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 23, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	67846-23-5	CC(=C)C1=CC=CC=C1.COC(=O)C=C.C=CC1=CC=CC=C1	{1: 2, 5: 3, 6: 2, 7: 1, 14: 10, 28: 1}
Did not match all atoms present	67846-24-6	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCO)CO.C(CSCCO)O	{2: 9, 8: 2, 34: 2, 14: 8, 40: 1, 20: 4, 29: 2}
Did not match all atoms present	67846-25-7	C1=CC(=CC=C1CP(=O)(O)O)CP(=O)(O)O.C(C(CO)(CO)CO)O	{20: 8, 2: 6, 4: 1, 29: 2, 14: 4}
Did not match all atoms present	67846-28-0	C(CP(=O)(O)O)P(=O)(O)O.C(C(CO)(CO)CO)O	{20: 8, 2: 6, 4: 1, 29: 2}
Did not match all atoms present	67846-29-1	CC(C)C(C(C)(C)CO)O.C1CCC(=O)NCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O	{32: 1, 1: 4, 2: 2, 3: 2, 4: 1, 8: 2, 11: 5, 34: 2, 14: 8, 20: 2, 25: 1, 29: 2}
Did not match all atoms present	67846-30-4	CC1=NC=CN1.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O	{32: 1, 1: 3, 35: 1, 4: 1, 5: 1, 14: 10, 21: 2}
Did not match all atoms present	67846-31-5	CC1=CC=[N+](C=C1)[O-].C=O.C1=CC=C(C=C1)O	{1: 1, 5: 1, 33: 1, 14: 9, 21: 1, 29: 1}
Did not match all atoms present	67846-32-6	C1C(O1)CCl.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{2: 1, 11: 1, 12: 1, 14: 8, 17: 1, 23: 1, 27: 2, 28: 2}
Did not match all atoms present	67846-42-8	CCOC(=O)C1=C(C=C(C=C1)C(C2=CC(=C(C=C2)C(=O)OCC)C(=O)OCC)(C(F)(F)F)C(F)(F)F)C(=O)OCC	{1: 4, 2: 4, 4: 3, 14: 6, 16: 6, 28: 4}
Did not match all atoms present	67846-44-0	CCCCCCCC(=O)NC1=C(C=C(C=C1)C(C2=C(C=C(C=C2)N(CC)CC)C)NC(=O)N)OC	{1: 5, 2: 8, 3: 1, 33: 1, 14: 6, 22: 1, 24: 2, 30: 1, 31: 2}
Did not match all atoms present	67846-55-3	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)C5=NC6=C(N5)C=C(C=C6)NN=C7C=CC(=O)C=C7)S(=O)(=O)O)S(=O)(=O)O	{32: 1, 34: 4, 35: 1, 14: 18, 15: 3, 20: 2, 25: 2, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	67846-57-5	C1=CC(=CC=C1NC2=CC(=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N=NC5=C(C=C(C=C5)NCC(=O)[O-])N)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/6\C(=CC7=C(C6=O)C=C(C=C7)N=NC8=C(C=C(C=C8)NCC(=O)O)N)S(=O)(=O)O.[Na+].[Na+].[Na+]	{2: 2, 34: 6, 14: 21, 15: 4, 20: 1, 24: 1, 25: 2, 27: 1, 29: 8, 30: 2, 31: 5}
Did not match all atoms present	67846-58-6	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)Cl)C3=CC(=C(C=C3Cl)S(=O)(=O)O)Cl	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 6, 15: 1, 17: 3, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	67846-59-7	CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=CC(=C(C=C2OC)[N+]#N)OC.Cl.[Cl-]	{1: 3, 34: 3, 3: 1, 14: 7, 17: 2, 22: 2, 24: 2, 31: 1}
Did not match all atoms present	67846-60-0	CNC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)O)N=NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O	{1: 1, 2: 2, 34: 2, 14: 8, 20: 3, 22: 1, 29: 8, 31: 1}
Did not match all atoms present	67846-61-1	COC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)N)N	{1: 1, 14: 7, 22: 1, 24: 2, 30: 2, 31: 1}
Did not match all atoms present	67846-64-4	COC1=CC(=C(C=C1[N+]#N)NC(=O)C2=CC=CC=C2)OC.Cl.[Cl-]	{1: 2, 34: 1, 14: 7, 17: 2, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	67846-66-6	CCOC(=O)NCC(CCSS(=O)(=O)[O-])C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Na+]	{1: 1, 2: 4, 3: 1, 4: 6, 40: 1, 16: 13, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	67846-68-8	CCCCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)CCOC(=O)CCCCCCCCCCCCCCCCC.[Cl-]	{1: 4, 2: 36, 28: 2, 17: 1}
Did not match all atoms present	67846-69-9	COP(=O)(O)OCCO	{1: 1, 2: 2, 20: 2, 29: 1, 22: 2}
Did not match all atoms present	67848-03-7	C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O.N.N.N.N.N.[Br-].[Br-].[Br-].[Ru+3]	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 18: 3, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	67848-07-1	C12=C(N=C(N1N)N)N=C(N(C2=O)N)N(N)N.[Cl-].[Cl-].[Cl-].[Ru+3]	{17: 3, 35: 2, 33: 3, 30: 5, 25: 1}
Did not match all atoms present	67856-55-7	COC1=CC=CC=C1C2=CC=CC=C2C(=O)N	{24: 1, 1: 1, 30: 1, 22: 1, 14: 8}
Did not match all atoms present	67859-39-6	CCCCCCCCC(CCCCCCCCC(=O)OCC(C)C)OS(=O)(=O)[O-].[Na+]	{1: 3, 2: 16, 3: 2, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	67859-40-9	[C-]#N.[C-]#N.C(CN)N.C(CN)N.[Cu+].[Ag+]	{2: 4, 30: 4}
Did not match all atoms present	67859-41-0	[C-]#N.[C-]#N.C(CN)N.C(CN)N.[Ag+].[Au+]	{2: 4, 30: 4}
Did not match all atoms present	67859-42-1	[C-]#N.[C-]#N.N.N.[Ag+].[Au+]	{}
Did not match all atoms present	67859-43-2	[C-]#N.[C-]#N.[C-]#N.[C-]#N.C(CN)N.C(CN)N.[Cu+2].[Zn+2]	{2: 4, 30: 4}
Did not match all atoms present	67859-44-3	[C-]#N.[C-]#N.C(CN)N.C(CN)N.[Cu+2].[Ag+]	{2: 4, 30: 4}
Did not match all atoms present	67859-48-7	[C-]#N.[C-]#N.[C-]#N.[C-]#N.C(CN)N.N.N.[Pd+2].[Au+].[Au+]	{2: 2, 30: 2}
Did not match all atoms present	67859-49-8	C1CCC(C(C1)N(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Pd+2]	{24: 4, 33: 2, 2: 4, 11: 4, 12: 2}
Did not match all atoms present	67859-51-2	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].N.N.[Zn+2]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	67859-55-6	CCCC[Sn]1(OC(=O)CC(S1)C(=O)O)CCCC	{1: 2, 2: 6, 41: 1, 11: 1, 12: 1, 27: 1, 28: 1}
Did not match all atoms present	67859-59-0	CCCC[Sn](CCCC)(SCCOC(=O)CC(C)CC(C)(C)C)SCCOC(=O)CC(C)CC(C)(C)C	{1: 10, 2: 14, 3: 2, 4: 2, 40: 2, 28: 2}
Did not match all atoms present	67859-66-9	C([S-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 1, 29: 3}
Did not match all atoms present	67859-68-1	[O-]S(=O)[O-].[K+].[Ag+]	{29: 3}
Did not match all atoms present	67859-69-2	[O-]S(=O)[O-].[O-]S(=O)[O-].[Na+].[Au+3]	{29: 6}
Did not match all atoms present	67859-70-5	[O-]S(=O)[O-].[O-]S(=O)[O-].[K+].[Au+3]	{29: 6}
Did not match all atoms present	67859-73-8	CC1=CC(=C(C=C1C(C)CC(C2=CC(=C(C=C2C)OP(OCCCCCCCCCCC(C)C)OCCCCCCCCCCC(C)C)C(C)(C)C)C3=CC(=C(C=C3C)OP(OCCCCCCCCCCC(C)C)OCCCCCCCCCCC(C)C)C(C)(C)C)C(C)(C)C)OP(OCCCCCCCCCCC(C)C)OCCCCCCCCCCC(C)C	{1: 25, 2: 61, 3: 8, 4: 3, 14: 6, 22: 9}
Did not match all atoms present	67859-74-9	CCCCC(CC)COP(OCCCCCCCCCC1=CC=CC=C1)OCC(CC)CCCC	{1: 4, 2: 19, 3: 2, 22: 3, 14: 5}
Did not match all atoms present	67859-75-0	CCCCCCCCCCCCCCCCCC[Si](C)(OCC)OCC	{1: 4, 2: 19, 22: 2}
Did not match all atoms present	67859-76-1	CCCCCC[Si](CCCCCC)(CCCCCC)N=[N+]=[N-]	{1: 3, 2: 15, 34: 2}
Did not match all atoms present	67859-78-3	B(O)(O)O.C1COCCN1	{32: 1, 11: 4, 20: 3, 23: 1}
Did not match all atoms present	67859-80-7	CC(CN)O.CC(C)(C)C1=CC=C(C=C1)C(=O)O	{1: 4, 2: 1, 3: 1, 4: 1, 14: 4, 20: 1, 27: 1, 30: 1}
Did not match all atoms present	67859-82-9	CCCCCCCCCCCCOC(=O)C(=C)C.CC1=CC=CC=C1C=C	{1: 3, 2: 11, 5: 2, 6: 1, 7: 1, 14: 4, 28: 1}
Did not match all atoms present	67859-97-6	CC1CC(CC(C1)(C)C)OC(=O)CC2=CC=CC=C2	{1: 3, 2: 1, 11: 3, 12: 2, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	67859-98-7	CCOC(CC1=CC=C(C=C1)C(C)C)OCC	{1: 4, 2: 3, 3: 2, 22: 2, 14: 4}
Did not match all atoms present	6786-32-9	C1=CC=C(C=C1)C(=O)O[N+](=O)[O-]	{28: 1, 14: 5}
Did not match all atoms present	6786-36-3	CCCCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 16, 14: 5}
Did not match all atoms present	67860-01-9	CCCC(=O)OC1=C(OC=CC1=O)C	{1: 2, 2: 2, 14: 2, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	67860-02-0	CC1=C(C(=O)C=CO1)OC(=O)C(C)O	{1: 2, 3: 1, 14: 2, 20: 1, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	67873-99-8	CCCCCCCCCCCCCCCCCCN(C)CCCCCCCCCCCCCCCCCC.CCOP(=O)(O)OCC	{1: 5, 2: 36, 33: 1, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	67874-01-5	CCCCCCCCCCCCCCCCCCN(CCO)CCO.CCOP(=O)(O)OCC	{1: 3, 2: 23, 33: 1, 20: 3, 22: 2, 29: 1}
Did not match all atoms present	67874-02-6	CCCCCCCCCCCCCCCCCCN(CCO)CCO.CCOP(=O)(O)O	{1: 2, 2: 22, 33: 1, 20: 4, 22: 1, 29: 1}
Did not match all atoms present	67874-03-7	CCCCCCCCCCCCCCCCCCNCC.CCOS(=O)(=O)O	{1: 3, 2: 19, 20: 1, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	67874-08-2	CCCCCCCCCCCCCCCCCCCCCC1=[NH+]CC[N+]1(C)CCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCCCCCC.COS(=O)(=O)[O-]	{32: 1, 1: 4, 2: 44, 37: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67874-10-6	CCCCCCCCCCCCCCCCCCCC1=NCC[N+]1(C)CCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCCCC.COS(=O)(=O)[O-]	{1: 4, 2: 40, 35: 1, 37: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67874-12-8	CCCCCCCCCCCC1=NCC[N+]1(C)CCN(CCC#N)C(=O)CCCCCCCCCCC.COS(=O)(=O)[O-]	{1: 4, 2: 24, 35: 1, 37: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67874-14-0	CCCCCCCCCCCCCCCCCCCCCC1=NCC[N+]1(CC)CCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 46, 35: 1, 37: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67874-16-2	CCCCCCCCCCCC1=NCC[N+]1(CC)CCN(CCC#N)C(=O)CCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 26, 35: 1, 37: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67874-18-4	CCCCCCCCCCCCCCCCCC1=NCC[N+]1(C)CCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCC.COS(=O)(=O)[O-]	{1: 4, 2: 36, 35: 1, 37: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67874-20-8	CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CC)CCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 38, 35: 1, 37: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67874-22-0	CCCCCCCCCCCCCCCCCCCC1=NCC[N+]1(CC)CCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 42, 35: 1, 37: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	67874-23-1	CCN1CCSC1=CC=CC2=[N+](CCS2)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 2, 6: 3, 33: 2, 41: 2, 11: 4, 14: 4, 15: 2, 29: 3}
Did not match all atoms present	67874-24-2	CC1=NC2=CC3=C(C=C2S1)OC4(O3)CCCCC4	{1: 1, 35: 1, 41: 1, 11: 5, 13: 1, 14: 2, 23: 2}
Did not match all atoms present	67874-25-3	C1CCC2(CC1)OC3=C(O2)C=C(C(=C3)[N+](=O)[O-])SSC4=CC5=C(C=C4[N+](=O)[O-])OC6(O5)CCCCC6	{38: 2, 40: 2, 11: 10, 13: 2, 14: 4, 23: 4}
Did not match all atoms present	67874-27-5	CC\1(C2CCC(C2)/C1=C\OC3=CC=CC=C3OC)C	{1: 3, 6: 1, 11: 3, 12: 2, 13: 1, 14: 4, 15: 1, 22: 2}
Did not match all atoms present	67874-34-4	CC1(CC(OC(=N1)C=C)(C)O)C.[O-]S(=O)(=O)[O-]	{1: 3, 35: 1, 5: 1, 6: 1, 11: 1, 13: 2, 15: 1, 20: 1, 23: 1, 29: 4}
Did not match all atoms present	67874-37-7	CC(C)CCCCCCCCCCOP(OCCCCCCCCCCC(C)C)OC1=CC=CC=C1	{1: 4, 2: 20, 3: 2, 22: 3, 14: 5}
Did not match all atoms present	67874-39-9	CC(=C)C(=O)[O-].[OH-].[OH-].[OH-].[OH-].[OH-].[Cr+3].[Cr+3]	{24: 1, 1: 1, 5: 1, 7: 1}
Did not match all atoms present	67874-40-2	CCC(=O)[O-].CCC(=O)[O-].N.N.[Zn+2]	{24: 2, 1: 2, 2: 2}
Did not match all atoms present	67874-42-4	CCCCCCCC(=O)OCCS[Sn](CCCC)(CCCC)SCCOC(=O)CCCCCCC	{40: 2, 1: 4, 2: 22, 28: 2}
Did not match all atoms present	67874-45-7	CC(CC(=O)OCCS[Sn](C)(SCCOC(=O)CC(C)CC(C)(C)C)SCCOC(=O)CC(C)CC(C)(C)C)CC(C)(C)C	{1: 13, 2: 12, 3: 3, 4: 3, 40: 3, 28: 3}
Did not match all atoms present	67874-47-9	CCCC[Sn](CCCC)(SCCOC(=O)C)SCCOC(=O)C	{40: 2, 1: 4, 2: 10, 28: 2}
Did not match all atoms present	67874-48-0	CC(=O)OCCS[Sn](C)(C)SCCOC(=O)C	{40: 2, 1: 4, 2: 4, 28: 2}
Did not match all atoms present	67874-49-1	CCCC[Sn](CCCC)(SCCOC(=O)CC)SCCOC(=O)CC	{40: 2, 1: 4, 2: 12, 28: 2}
Did not match all atoms present	67874-52-6	CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].[Ba+2]	{24: 2, 1: 2, 14: 8}
Did not match all atoms present	67874-55-9	CON(S(=O)(=O)O)S(=O)(=O)[O-].[Na+]	{1: 1, 20: 1, 29: 5, 22: 1, 33: 1}
Did not match all atoms present	67874-56-0	CC1=C(C=CC(=C1)N(CCC#N)CCO)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])Cl	{1: 1, 2: 4, 37: 1, 38: 1, 33: 1, 34: 2, 14: 5, 17: 1, 18: 1, 20: 1}
Did not match all atoms present	67874-58-2	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OC)C)C.C1=CC(=CC=C1N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-]	{1: 15, 2: 6, 35: 1, 33: 1, 12: 1, 34: 2, 14: 32, 15: 1, 23: 3, 24: 1, 25: 1, 28: 3, 29: 6, 31: 6}
Did not match all atoms present	67874-59-3	C1=CC(=CC(=C1)S(=O)(=O)[O-])N=NC2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-].[Na+].[Na+]	{34: 3, 14: 15, 15: 2, 24: 2, 25: 1, 29: 3, 31: 3}
Did not match all atoms present	67874-61-7	C(C#COCC(CS(=O)(=O)[O-])O)O.[Na+]	{2: 3, 3: 1, 10: 2, 20: 2, 22: 1, 29: 3}
Did not match all atoms present	67874-62-8	C(C#CCOCC(CS(=O)(=O)[O-])O)OCC(CS(=O)(=O)[O-])O.[Na+].[Na+]	{2: 6, 3: 2, 10: 2, 20: 2, 22: 2, 29: 6}
Did not match all atoms present	67874-63-9	CCO[Si](CCCNC(=O)C[N+](C)(C)C)(OCC)OCC.[I-]	{1: 6, 2: 7, 19: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	67874-64-0	CC1=C(C(=CC=C1)NC(=O)OCCN(C)C)NC(=O)OCCN(C)C	{1: 5, 2: 4, 33: 2, 14: 3, 28: 2, 31: 2}
Did not match all atoms present	67874-68-4	COC(COC1=CC=CC=C1)OC	{1: 2, 2: 1, 3: 1, 22: 3, 14: 5}
Did not match all atoms present	67874-69-5	CC(=CCCC(=CCOC(=O)C1=CC=CC=C1N)C)C	{1: 3, 2: 3, 6: 2, 7: 2, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	67874-70-8	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC)NCC(COC3=CC=CC=C3)O	{1: 2, 2: 2, 3: 1, 38: 2, 34: 2, 14: 10, 20: 1, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	67874-71-9	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Bi+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	67874-73-1	CCC(C)(C)C1CCC(CC1)OC=O	{1: 3, 2: 1, 4: 1, 11: 4, 12: 2, 26: 1}
Did not match all atoms present	67874-75-3	CC(C)(C)C1=CC(=C(C=C1CC=C)OC)O	{1: 4, 2: 1, 4: 1, 5: 1, 6: 1, 14: 2, 21: 1, 22: 1}
Did not match all atoms present	67874-76-4	CC1=CC=C(C=C1)OC(=O)CCCCCCCCC=C	{1: 1, 2: 8, 5: 1, 6: 1, 14: 4, 28: 1}
Did not match all atoms present	67874-77-5	CC(C)CCCC(C)CCOC(=O)CC1=CC=CC=C1	{1: 3, 2: 6, 3: 2, 28: 1, 14: 5}
Did not match all atoms present	67874-82-2	CC1(CC(C=C2C13CCC(C3)C2(C)C)OC=O)C	{1: 4, 11: 4, 12: 2, 13: 3, 14: 1, 15: 1, 26: 1}
Did not match all atoms present	67874-83-3	CCCCC(CC)C(=O)OCC1=CC=CC=C1	{1: 2, 2: 5, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	67874-84-4	C1N2CN3CN1C[N+](C2)(C3)CC4=CC5=C(C=C4)OCO5.[Cl-]	{33: 3, 2: 1, 11: 7, 14: 3, 17: 1, 23: 2}
Did not match all atoms present	67874-86-6	CCN(CC)CCO.C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O	{1: 2, 2: 4, 33: 1, 13: 1, 14: 12, 20: 1, 21: 2, 28: 1}
Did not match all atoms present	67874-95-7	CC1=C(C=CC=C1N=C=O)N=C=O.C1CCC(=O)NCC1	{32: 1, 1: 1, 34: 2, 8: 2, 11: 5, 14: 3, 25: 1, 29: 2}
Did not match all atoms present	67875-00-7	CC1=CC(=C(C=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N4N=C5C6=CC(=CC(=C6C=CC5=N4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC7=C(C=C(C(=C7)C)N=NC8=CC(=C(C=C8)/C=C/C9=C(C=C(C=C9)N1N=C2C3=CC(=CC(=C3C=CC2=N1)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 4, 35: 4, 6: 4, 33: 2, 14: 24, 22: 2, 24: 1, 29: 24, 31: 2}
Did not match all atoms present	67875-01-8	CCN(CC)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl	{1: 2, 2: 2, 38: 1, 33: 1, 34: 2, 14: 6, 17: 2}
Did not match all atoms present	67875-02-9	CCOC1=CC=C(C=C1)N=NC2=CC(=C(C=C2OC)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])OC.[Na+]	{1: 3, 2: 1, 34: 4, 14: 10, 22: 3, 29: 3}
Did not match all atoms present	67875-03-0	CCN(CCCS(=O)(=O)[O-])C1=CC(=C(C=C1)N=NC2=NC3=CC=CC=C3S2)C.[Na+]	{1: 2, 2: 4, 35: 1, 33: 1, 41: 1, 34: 2, 14: 7, 29: 3}
Did not match all atoms present	67875-05-2	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCC#N)CCC#N	{1: 2, 2: 4, 37: 2, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	67875-06-3	C1=CC(=CC(=C1)Cl)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)[O-])NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N.[K+].[K+]	{36: 1, 14: 11, 15: 5, 17: 1, 24: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	67875-08-5	C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N)S(=O)(=O)[O-].[Na+].[Na+]	{36: 1, 14: 12, 15: 5, 24: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	67875-09-6	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)NC(=O)C4=CC=C(C=C4)N=NC5C(=NN(C5=O)C6=CC=C(C=C6)S(=O)(=O)[O-])C)S(=O)(=O)[O-])C7=CC=C(C=C7)S(=O)(=O)[O-].[K+].[K+].[K+]	{1: 2, 34: 4, 35: 2, 33: 2, 12: 2, 14: 19, 15: 2, 24: 2, 25: 2, 29: 9, 31: 2}
Did not match all atoms present	67875-10-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)NC(=O)CCl)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{2: 1, 14: 8, 17: 1, 24: 1, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	67875-13-2	C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N.[Na+]	{36: 1, 14: 13, 15: 5, 24: 1, 25: 1, 29: 3, 31: 3}
Did not match all atoms present	67875-15-4	C1=CC=C2C(=C1)C=CC=C2N=NC3=CC(=CC(=C3)S(=O)(=O)O)[N+]#N.[Cl-]	{17: 1, 34: 3, 20: 1, 29: 2, 14: 10}
Did not match all atoms present	67875-16-5	CC1=CC(=C(C=C1N=NC2=CC(=CC=C2)S(=O)(=O)[O-])OC)NC(=O)NC3=C(C=C(C(=C3)C)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 4, 34: 4, 14: 12, 22: 2, 24: 1, 29: 6, 31: 2}
Did not match all atoms present	67875-19-8	C1=CC(=C(C=C1N)S(=O)(=O)[O-])C=CC2=C(C=C(C=C2)N3N=C4C=CC5=C(C=C(C=C5C4=N3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 1, 35: 2, 6: 2, 14: 10, 29: 12, 30: 1}
Did not match all atoms present	67875-20-1	CCCCCC1=CC=C(C=C1)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N	{1: 1, 2: 4, 14: 9, 21: 1, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	67875-22-3	CC1=CC(=C(C=C1N=NC2=C(C=CC(=C2)S(=O)(=O)O)OC)OC)[N+]#N.[Cl-]	{1: 3, 34: 3, 14: 5, 17: 1, 20: 1, 22: 2, 29: 2}
Did not match all atoms present	67875-24-5	C1=CC(=CC=C1N)N=NC2=C(C=CC(=C2)S(=O)(=O)[O-])Cl.[Na+]	{17: 1, 30: 1, 34: 2, 29: 3, 14: 7}
Did not match all atoms present	67875-25-6	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)[O-])N/N=C/2\C3=C(C=C(C=C3)S(=O)(=O)[O-])C(=O)C=C2N.[Na+].[Na+]	{34: 1, 38: 1, 14: 7, 15: 2, 24: 1, 25: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	67875-26-7	C1=CC(=CC=C1N)N=NC2=CC3=CC(=CC(=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 34: 2, 29: 6, 14: 9}
Did not match all atoms present	67875-27-8	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)N=NC3=CC=C(C=C3)N=NC4=CC=CC=C4.[Na+]	{1: 1, 2: 2, 33: 1, 34: 4, 14: 17, 29: 3}
Did not match all atoms present	67875-28-9	C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)N)S(=O)(=O)[O-])N.[Na+]	{24: 2, 30: 2, 29: 3, 14: 11, 31: 2}
Did not match all atoms present	67875-29-0	CC1=NN(C(=O)C1NN=C2C=CC(=O)C=C2)C3=CC(=C(C=C3Cl)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 34: 1, 35: 1, 33: 1, 12: 1, 14: 6, 15: 2, 17: 2, 25: 2, 29: 3, 31: 1}
Did not match all atoms present	67875-30-3	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+].[Na+]	{1: 2, 34: 2, 14: 7, 22: 1, 29: 6, 30: 1}
Did not match all atoms present	67875-31-4	C1=CC=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)[N+]#N.[Cl-]	{17: 1, 34: 3, 14: 11}
Did not match all atoms present	67875-32-5	C1=CC(=CC=C1N=NC2=C3C=C(C=CC3=C(C=C2)[N+]#N)S(=O)(=O)O)S(=O)(=O)O.[Cl-]	{17: 1, 34: 3, 20: 2, 29: 4, 14: 9}
Did not match all atoms present	67875-33-6	COC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)OC)[N+]#N.[Cl-]	{1: 2, 34: 3, 14: 6, 17: 1, 20: 1, 22: 2, 29: 2}
Did not match all atoms present	67875-34-7	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCC(=O)O)CCCC(=O)O.C(CCCO)CCO	{2: 13, 27: 4, 20: 2, 14: 4}
Did not match all atoms present	67875-44-9	CCCCC1=CC=CC=C1O.C=O.C(=O)(C(=O)O)O	{1: 1, 2: 3, 5: 1, 14: 4, 21: 1, 27: 2}
Did not match all atoms present	67875-45-0	CC1=C(C=CC=C1N)N.CC1=C(C=CC=C1N=C=O)N=C=O.C(=O)(Cl)Cl	{1: 2, 34: 2, 8: 2, 14: 6, 17: 2, 24: 1, 29: 2, 30: 2}
Did not match all atoms present	67880-21-1	C(#N)C(C#N)(N=[N+]=[N-])N=[N+]=[N-]	{34: 4, 4: 1, 37: 2}
Did not match all atoms present	67881-18-9	CC1=CC=CC=C1C(C2=CC=CC=C2)C3=CC=CC=C3C	{1: 2, 3: 1, 14: 13}
Did not match all atoms present	67881-98-5	CC(=C)C(=O)OCCOP(=O)([O-])OCC[N+](C)(C)C	{1: 4, 2: 4, 5: 1, 7: 1, 22: 2, 28: 1, 29: 2}
Did not match all atoms present	67883-77-6	CCC(C)C(=O)OCC=CC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 6: 2, 14: 5, 28: 1}
Did not match all atoms present	67884-32-6	C[C@H](CP(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4	{1: 1, 2: 1, 3: 1, 14: 20}
Did not match all atoms present	67886-70-8	COC1=CC2=C(C=C1)C=C(C=C2)C#N	{1: 1, 22: 1, 14: 6, 37: 1}
Did not match all atoms present	67889-94-5	CC(C)CCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C(CO)NCCO	{1: 2, 2: 12, 3: 1, 14: 4, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	67889-95-6	CC(C)CCCCCCCC1=CC=CC=C1S(=O)(=O)O.C(CO)NCCO	{1: 2, 2: 11, 3: 1, 14: 4, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	6789-51-1	CN1C(=O)C2=C(C1=O)C=NC=C2	{1: 1, 35: 1, 33: 1, 14: 3, 25: 2}
Did not match all atoms present	6789-88-4	CCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 5, 28: 1, 14: 5}
Did not match all atoms present	6789-99-7	C1CCC2=NNN=C2C1	{32: 1, 35: 2, 11: 4}
Did not match all atoms present	67891-74-1	[O-2].[Fe+3].[Sr+2]	{}
Did not match all atoms present	67892-38-0	CCC1=C(C=C(C=C1NN=C2C(=O)C=CC3=CC=CC=C32)S(=O)(=O)[O-])Cl.CCC1=C(C=C(C=C1NN=C2C(=O)C=CC3=CC=CC=C32)S(=O)(=O)[O-])Cl.[Ba+2]	{1: 2, 2: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	67892-39-1	CC1=C(C=C(C=C1N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-])Cl.[Sr+2]	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	67892-40-4	CC1=C(C=C(C=C1N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-])Cl.[Ca+2]	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	67892-41-5	CC1=C(C=C(C=C1N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-])Cl.[Ba+2]	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	67892-42-6	CN1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C6C4=CC=C7C6=C(C=C5)C(=O)NC7=O)C1=O	{32: 1, 1: 1, 33: 1, 14: 8, 25: 4}
Did not match all atoms present	67892-43-7	C1=CC(=C(C(=C1)S(=O)(=O)O)C(=O)O)C(=O)O	{27: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	67892-44-8	CCC1=CC(=C(C=C1Cl)S(=O)(=O)O)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 2, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	67892-45-9	CCC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)O)Cl	{1: 1, 2: 1, 38: 1, 14: 2, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	67892-46-0	CCC1=C(C=C(C=C1N)S(=O)(=O)O)Cl	{1: 1, 2: 1, 14: 2, 17: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	67892-48-2	CCC1=C(C=C(C=C1)S(=O)(=O)O)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 20: 1, 29: 2}
Did not match all atoms present	67892-49-3	CCC1=C(C=C(C=C1N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-])Cl.[Ca+2]	{1: 1, 2: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	67892-50-6	CC1=C(C=C(C=C1NN=C2C(=O)C=CC3=CC=CC=C32)S(=O)(=O)[O-])Cl.CC1=C(C=C(C=C1NN=C2C(=O)C=CC3=CC=CC=C32)S(=O)(=O)[O-])Cl.[Ba+2]	{1: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	67892-51-7	CCOC(=O)C=C(C)O[Al](OC(C)C)OC(=CC(=O)OCC)C	{1: 6, 2: 2, 3: 1, 6: 2, 7: 2, 22: 3, 28: 2}
Did not match all atoms present	67892-52-8	C(N(COP(=O)(O)O)C(=O)N(COP(=O)(O)O)COP(=O)(O)O)OP(=O)(O)O	{33: 2, 2: 4, 20: 8, 22: 4, 24: 1, 29: 4}
Did not match all atoms present	67892-53-9	CCCCCCCCCCCCCC(C)NC(=O)NC1=C(C(=CC=C1)NC(=O)NC(C)CCCCCCCCCCCCC)C	{1: 5, 2: 24, 3: 2, 14: 3, 24: 2, 31: 4}
Did not match all atoms present	67892-56-2	CCCCCCCCCCCCCCCCCCCCCC[Si](C)(Cl)Cl	{1: 2, 2: 21, 17: 2}
Did not match all atoms present	67892-57-3	CC(CC1=CC=C(C=C1)OC2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C3=CC=C(C=C3)OC4=CC(=C(C=C4)C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 1, 3: 1, 14: 14, 22: 2, 24: 4}
Did not match all atoms present	67892-59-5	C1=CC=C2C(=C1)C(=CC(=C2[O-])N=NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)[O-])S(=O)(=O)O.[Cu+2]	{2: 2, 34: 2, 14: 8, 20: 2, 22: 1, 29: 6}
Did not match all atoms present	67892-60-8	CCO[Si](C=C)(C=C)OCC	{1: 2, 2: 2, 22: 2, 5: 2, 6: 2}
Did not match all atoms present	67892-65-3	CC1=[N+](C2=C(S1)C3=CC=CC=C3C=C2)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 41: 1, 14: 6, 29: 3}
Did not match all atoms present	67892-74-4	CC(=C)C(=O)O.CC(=C)C(=O)[O-].C=C.[K+]	{24: 1, 1: 2, 27: 1, 5: 4, 7: 2}
Did not match all atoms present	67892-90-4	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC(=CC=C1CC2=CC=C(C=C2)N3C(=O)C=CC3=O)N4C(=O)C=CC4=O.C(#N)Cl	{1: 2, 2: 1, 4: 1, 37: 1, 33: 2, 14: 20, 17: 1, 21: 2, 25: 4}
Did not match all atoms present	67892-93-7	CCOC(=O)C=C.CC(C)(CS(=O)(=O)O)NC(=O)C=C	{1: 3, 2: 2, 4: 1, 5: 2, 6: 2, 20: 1, 24: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	67892-95-9	COC(=O)CCN(CCC#N)C1=CC=CC=C1	{1: 1, 2: 4, 37: 1, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	67892-97-1	CS(=O)(=O)NC1=CC=CC2=C1C(=NNC3=C(C=C(C=C3)S(=O)(=O)N)O)C(=O)C=C2	{1: 1, 34: 1, 14: 8, 15: 1, 21: 1, 25: 1, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	67892-98-2	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC4=CC=CC5=C4C(=O)C6=C(C5=O)C(=CC=C6)NC7=C8C(=C(C=C7)NC(=O)C9=CC=CC=C9)C(=O)C1=CC=CC=C1C8=O)C(=O)C1=CC=CC=C1C3=O	{24: 2, 25: 6, 14: 28, 31: 4}
Did not match all atoms present	67893-01-0	CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].[Zr+4]	{24: 4, 1: 4, 5: 4, 7: 4}
Did not match all atoms present	67893-03-2	CC(=C)C1CCC(CC1)(C)OC=O	{1: 2, 5: 1, 7: 1, 11: 4, 12: 1, 13: 1, 26: 1}
Did not match all atoms present	67893-04-3	CC(=C1CCC(CC1)(C)OC=O)C	{1: 3, 7: 1, 11: 4, 13: 1, 15: 1, 26: 1}
Did not match all atoms present	67893-08-7	CCOC(=O)C1=CC=C(C=C1)N=CCC(C)CCCC(C)(C)O	{1: 4, 2: 5, 3: 1, 4: 1, 6: 1, 34: 1, 14: 4, 20: 1, 28: 1}
Did not match all atoms present	67893-09-8	COC1=CC=CC=C1N=NC2=C(C=C3C=C(C=CC3=C2[O-])NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=C(C=CC(=C6)S(=O)(=O)[O-])[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2]	{1: 1, 34: 3, 14: 15, 15: 2, 22: 1, 24: 1, 25: 1, 29: 9, 31: 3}
Did not match all atoms present	67893-41-8	C1=CC=C(C(=C1)C(=O)[O-])NCC(=O)[O-].[K+].[K+]	{24: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	67893-42-9	CCCCCCC(CC=CCCCCCCCC(=O)NCCOC(=O)CC(C(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{1: 1, 2: 16, 3: 2, 6: 2, 20: 1, 24: 2, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	67893-43-0	CC1=C(C=CC(=C1)N=NN(C)CC(=O)[O-])NC(=O)C2=CC=CC=C2.[Na+]	{1: 2, 2: 1, 33: 1, 34: 2, 14: 8, 24: 2, 31: 1}
Did not match all atoms present	67893-45-2	C1=CC(=CC=C1N)N/N=C\2/C(=CC3=C(C2=O)C=C(C=C3)N)S(=O)(=O)O	{34: 1, 14: 8, 15: 2, 20: 1, 25: 1, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	67893-46-3	CC(=O)NC1=CC=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=C(C=C3)N)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	67893-47-4	CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O	{1: 2, 14: 9, 20: 1, 25: 2, 29: 2, 31: 2}
Did not match all atoms present	67893-48-5	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=CC(=C(C=C3N)N)S(=O)(=O)[O-])C)N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-].[Na+].[Na+]	{1: 2, 34: 3, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 30: 2, 31: 1}
Did not match all atoms present	67893-49-6	C1=CC(=CC=C1N)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 34: 2, 29: 6, 14: 9}
Did not match all atoms present	67893-50-9	C1CC(=O)N=C1[O-].C1CC(=O)N=C1[O-].[K+].[Ag+]	{25: 2, 11: 4, 35: 2, 15: 2}
Did not match all atoms present	679-37-8	CCOP(=O)(OCC)P(=O)(OCC)OCC	{1: 4, 2: 4, 29: 2, 22: 4}
Did not match all atoms present	67900-85-0	C1=C2C(=NC=N2)N(C=N1)O	{33: 1, 35: 3, 21: 1, 14: 3}
Did not match all atoms present	67905-10-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)NC5=C6C(=C(C=C5N4)O)C(=O)C7=CC=CC=C7C6=O	{32: 2, 25: 4, 21: 1, 14: 11}
Did not match all atoms present	67905-11-7	C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCO	{2: 2, 14: 4, 20: 1, 21: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	67905-14-0	CC[N+](CC)(CC)CCCNC1=C2C(=C(C=C1)NCCC[N+](CC)(CC)CC)C(=O)C3=CC=CC=C3C2=O.CCOS(=O)(=O)[O-].CCOS(=O)(=O)[O-]	{1: 8, 2: 14, 14: 6, 22: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	67905-15-1	CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O.C(CO)NCCO	{1: 1, 2: 4, 14: 9, 20: 3, 24: 1, 25: 2, 29: 2, 30: 1, 31: 3}
Did not match all atoms present	67905-16-2	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCC(=O)OC)CCOC(=O)C	{1: 4, 2: 4, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	67905-18-4	CCOC(=O)C(=C(C#N)C1=CC=C(C=C1)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3)C#N	{1: 1, 2: 5, 37: 2, 33: 1, 7: 2, 14: 14, 28: 3}
Did not match all atoms present	67905-21-9	CCC(=O)OCCS[Sn](C)(C)SCCOC(=O)CC	{40: 2, 1: 4, 2: 6, 28: 2}
Did not match all atoms present	67905-22-0	CCCC[Sn](SCCOC(=O)CC)(SCCOC(=O)CC)SCCOC(=O)CC	{40: 3, 1: 4, 2: 12, 28: 3}
Did not match all atoms present	67905-25-3	CCCCCCCCCCCCCCC(CN(CC[N+](CC)(CCO)CC(CCCCCCCCCCCCCC)O)CC(CCCCCCCCCCCCCC)O)O.CCOS(=O)(=O)[O-]	{1: 5, 2: 48, 3: 3, 33: 1, 20: 4, 22: 1, 29: 3}
Did not match all atoms present	67905-26-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 87, 29: 3}
Did not match all atoms present	67905-27-5	CCCCCCCCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 81, 29: 3}
Did not match all atoms present	67905-28-6	CCCCCCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 75, 29: 3}
Did not match all atoms present	67905-29-7	CCCCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 69, 29: 3}
Did not match all atoms present	67905-30-0	CCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 63, 29: 3}
Did not match all atoms present	67905-31-1	CCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 57, 29: 3}
Did not match all atoms present	67905-32-2	CCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCC[O-].[Al+3]	{1: 3, 2: 39, 29: 3}
Did not match all atoms present	67905-33-3	B(O)(O)OCCCNCCCO	{2: 6, 20: 3, 22: 1, 31: 1}
Did not match all atoms present	67905-34-4	C1CCCCCC(CCCCC1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 4, 11: 11, 12: 1, 33: 1, 25: 2}
Did not match all atoms present	67905-35-5	CCCCCCCCN1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl	{1: 1, 2: 7, 25: 2, 33: 1, 17: 4}
Did not match all atoms present	67905-36-6	C1CCCC(CC1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 4, 11: 6, 12: 1, 33: 1, 25: 2}
Did not match all atoms present	67905-37-7	CCCCCCCN1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl	{1: 1, 2: 6, 25: 2, 33: 1, 17: 4}
Did not match all atoms present	67905-38-8	CCCCCCN(CCCCCC)C(=O)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)O	{1: 2, 2: 10, 33: 1, 17: 4, 24: 1, 27: 1}
Did not match all atoms present	67905-39-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[Al](CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 87}
Did not match all atoms present	67905-47-9	CC(=C)C(=O)OCCP(C)C	{1: 3, 2: 2, 28: 1, 5: 1, 7: 1}
Did not match all atoms present	67905-52-6	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)OC)C(=O)C4=CC=CC=C4C3=O	{1: 2, 31: 1, 22: 1, 14: 10, 25: 2}
Did not match all atoms present	67905-54-8	CC(=O)NC1=CC2=C(C=C1)C(=O)C(C2=O)C3=NC4=CC=CC=C4C=C3O	{1: 1, 35: 1, 12: 1, 14: 8, 21: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	67905-55-9	CNCC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 14: 9, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	67905-57-1	CNCC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 1, 14: 8, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	67905-59-3	CCN(CC[N+](C)(C)C)C1=CC=CC(=C1)C.OS(=O)(=O)[O-]	{1: 5, 2: 3, 33: 1, 14: 4, 20: 1, 29: 3}
Did not match all atoms present	67905-61-7	C1=CC(=C2C(=C1[N+](=O)[O-])C(=O)C3=C(C2=O)C(=C(C=C3[N+](=O)[O-])[N+](=O)[O-])O)O	{25: 2, 38: 3, 21: 2, 14: 3}
Did not match all atoms present	67905-62-8	CC1=C(C=CC(=C1)N)N=NC2=CC=C(C=C2)NC(=O)OC	{1: 2, 34: 2, 14: 7, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	67905-63-9	CC(=O)NC1=CC(=C(C=C1)O)NCCC#N	{1: 1, 2: 2, 37: 1, 14: 3, 21: 1, 24: 1, 31: 2}
Did not match all atoms present	67905-64-0	CCN(CCC#N)C1=C(C=CC(=C1)NC(=O)C)OCC	{1: 3, 2: 4, 37: 1, 33: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	67905-65-1	CCN(CC)C1=CC=C(C=C1)C=CC2=[N+](C3=CC=CC=C3C2(C)C)C.CCN(CC)C1=CC=C(C=C1)C=CC2=[N+](C3=CC=CC=C3C2(C)C)C.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-]	{1: 10, 2: 4, 6: 4, 33: 4, 13: 2, 14: 22, 15: 2, 29: 6}
Did not match all atoms present	67905-66-2	CCN(CCC#N)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OCC	{1: 3, 2: 4, 37: 1, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	67905-93-5	CCCCCCCCCC1=CC=C(C=C1)O.CCC(C)(C)C1=CC=C(C=C1)O.C=O	{1: 4, 2: 9, 4: 1, 5: 1, 14: 8, 21: 2}
Did not match all atoms present	67905-98-0	CCN(CC)CCOC(=O)C(=C)C.OS(=O)(=O)O	{1: 3, 2: 4, 5: 1, 7: 1, 20: 2, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67906-07-4	CCC(C)(C)C1=CC(=C(C=C1)OCCO)C(C)(C)CC	{1: 6, 2: 4, 4: 2, 14: 3, 20: 1, 22: 1}
Did not match all atoms present	67906-13-2	CC(CN)N.CC(CN)N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Zn+2].[Au+].[Au+]	{1: 2, 2: 2, 3: 2, 30: 4}
Did not match all atoms present	67906-15-4	CC(CN)N.[C-]#N.[C-]#N.[Ag+].[Au+]	{1: 1, 2: 1, 3: 1, 30: 2}
Did not match all atoms present	67906-16-5	CC(CN)N.CC(CN)N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Pd+2].[Au+].[Au+]	{1: 2, 2: 2, 3: 2, 30: 4}
Did not match all atoms present	67906-18-7	CC(CN)N.CC(CN)N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Co+2].[Au+].[Au+]	{1: 2, 2: 2, 3: 2, 30: 4}
Did not match all atoms present	67906-19-8	CC(CN)N.CC(CN)N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Cd+2].[Au+].[Au+]	{1: 2, 2: 2, 3: 2, 30: 4}
Did not match all atoms present	67906-20-1	CC(CN)N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.C(CN)N.[Cu+2].[Au+].[Au+]	{1: 1, 2: 3, 3: 1, 30: 4}
Did not match all atoms present	67906-27-8	C1CCC2=C(C1)C=CC=C2NC3=C4C(=C(C=C3)NC5=CC=CC6=C5CCCC6)C(=O)C7=CC(=C(C=C7C4=O)Cl)Cl	{31: 2, 17: 2, 11: 8, 14: 10, 25: 2}
Did not match all atoms present	67906-28-9	CCOC(=O)C1=C2C3=CC=CC=C3C(=O)C4=C(C=C(C(=C24)NC1=O)C)NC5=CC=C(C=C5)Cl	{32: 1, 1: 2, 2: 1, 14: 9, 17: 1, 25: 2, 28: 1, 31: 1}
Did not match all atoms present	67906-29-0	CCCCCCCCC(C(CCCCCCCC(=O)OCCOCC)S(=O)(=O)[O-])O.[Na+]	{1: 2, 2: 17, 3: 2, 20: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	67906-30-3	C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N=NC4=C(C=CC5=CC=CC=C54)N)OC2=O	{34: 2, 28: 1, 30: 1, 14: 15}
Did not match all atoms present	67906-32-5	CC1=CC=C(C=C1)NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3)C(=O)O	{1: 1, 27: 2, 14: 11, 31: 2}
Did not match all atoms present	67906-34-7	C1=CC(=CC=C1N=NC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-])N(CCC#N)CCO	{33: 1, 2: 4, 35: 1, 37: 1, 38: 1, 41: 1, 34: 2, 14: 7, 20: 1}
Did not match all atoms present	67906-35-8	CCN(CCC#N)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)C	{1: 2, 2: 3, 37: 1, 38: 1, 33: 1, 34: 2, 14: 5, 18: 2}
Did not match all atoms present	67906-36-9	CC1=C(C(=CC=C1)C)NC2=C3C(=C(C=C2)NC4=C(C=CC=C4C)C)C(=O)C5=CC(=C(C=C5C3=O)Cl)Cl	{1: 4, 31: 2, 25: 2, 14: 10, 17: 2}
Did not match all atoms present	67906-37-0	CCC(C)(C)C1=CC=C(C=C1)OC2=C3C4=C(C(=C2)NC5=CC=CC=C5)C(=O)C6=CC=CC=C6C4=C(C(=O)N3)C(=O)OC7=CC=CC=C7	{32: 1, 1: 3, 2: 1, 4: 1, 14: 19, 22: 1, 25: 2, 28: 1, 31: 1}
Did not match all atoms present	67906-38-1	CC(=C)C(=O)OCCCCN(C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 4, 4: 7, 5: 1, 7: 1, 16: 15, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67906-39-2	CC(=C)C(=O)OCCCCN(C)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 4, 4: 4, 5: 1, 7: 1, 16: 9, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67906-40-5	CC(=C)C(=O)OCCCCN(C)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 4, 4: 5, 5: 1, 7: 1, 16: 11, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67906-41-6	CCN(CC=C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 7, 5: 1, 6: 1, 33: 1, 16: 15, 29: 2}
Did not match all atoms present	67906-44-9	CC(=O)NC1=CC(=CC2=CC(=C(C=C21)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N=NC5=C(C=C6C=C(C=C(C6=C5)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)OC)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 2, 29: 12, 31: 2}
Did not match all atoms present	67906-45-0	CC(=O)NC1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N/N=C\6/C7=C(C=CC6=O)C=C(C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 5, 14: 19, 15: 1, 24: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	67906-46-1	C1=CC(=CC=C1CC(=O)N)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C5C=C(C=CC5=C(C=C4)N/N=C/6\C7=C(C=CC6=O)C=C(C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 1, 34: 5, 14: 19, 15: 1, 24: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	67906-47-2	C1=CC(=CC=C1CC(=O)N)N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N/N=C/6\C7=C(C=CC6=O)C=C(C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 1, 34: 5, 14: 19, 15: 1, 24: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	67906-48-3	C1=CC(=CC=C1CC(=O)N)N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C5C=C(C=CC5=C(C=C4)N/N=C/6\C7=C(C=CC6=O)C=C(C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 1, 34: 5, 14: 19, 15: 1, 24: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	67906-49-4	CC(=O)NC1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 4, 14: 14, 24: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	67906-52-9	COC1=CC=CC=C1N=NC2=C3C=C(C=CC3=C(C=C2)NN=C4C=CC(=O)C=C4)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 3, 14: 13, 15: 1, 22: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	67906-54-1	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)OC)N=NCl	{1: 2, 34: 4, 14: 6, 17: 1, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	67906-56-3	CC1=CC(=C(C(=C1Cl)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-])Cl.[Ca+2]	{1: 1, 34: 1, 14: 6, 15: 2, 17: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	67906-57-4	CC1=C(C=C(C(=C1Cl)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-])Cl.[Ca+2]	{1: 1, 34: 1, 14: 6, 15: 2, 17: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	67906-58-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=C5C(=C(C=C4)NC6=CC=CC7=C6C(=O)C8=C(C7=O)C(=CC=C8)NC9=C1C(=C(C=C9)NC2=CC=CC3=C2C(=O)C2=CC=CC=C2C3=O)C(=O)C2=CC=CC=C2C1=O)C(=O)C1=CC=CC=C1C5=O	{25: 10, 14: 32, 31: 4}
Did not match all atoms present	67906-59-6	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)OCCO)OC)N	{1: 2, 2: 2, 34: 2, 14: 6, 20: 1, 22: 2, 30: 1}
Did not match all atoms present	67906-60-9	CCN(CCC#N)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C)C	{1: 3, 2: 3, 37: 1, 38: 1, 33: 1, 34: 2, 14: 6, 29: 2}
Did not match all atoms present	67906-61-0	C1=CC(=CC(=C1)S(=O)(=O)O)NN=C2C(=CC=C3C2=CC(=CC3=O)S(=O)(=O)O)N	{34: 1, 14: 8, 15: 5, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	67906-70-1	CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 6, 5: 1, 7: 1, 16: 13, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67906-73-4	CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 5, 5: 1, 7: 1, 16: 11, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67906-76-7	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC(=CC=C1C(=O)O)N	{1: 2, 2: 1, 4: 1, 11: 1, 12: 1, 14: 12, 17: 1, 21: 2, 23: 1, 27: 1, 30: 1}
Did not match all atoms present	67906-79-0	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CO)N1C(=O)N(C(=O)N(C1=O)CCO)CCO.C(CO)O	{33: 3, 2: 8, 14: 4, 20: 5, 25: 3, 27: 2}
Did not match all atoms present	67906-80-3	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(COCCOCCO)O.C(C(CO)O)O	{2: 8, 3: 1, 14: 4, 20: 5, 22: 2, 27: 2}
Did not match all atoms present	67906-89-2	CCCCCCCCCC(=O)O.CC(CO)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 11, 4: 1, 14: 4, 20: 3, 27: 1, 28: 2}
Did not match all atoms present	67906-94-9	C=CC(=O)O.C(COCC[O-])O.[K+]	{2: 4, 5: 1, 6: 1, 20: 1, 22: 1, 27: 1, 29: 1}
Did not match all atoms present	67907-15-7	CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCS[Sn](C)(C)SCCOC(=O)C2=CC=CC=C2C(=O)OCCCCCC(C)C	{1: 6, 2: 14, 3: 2, 40: 2, 14: 8, 28: 4}
Did not match all atoms present	67907-16-8	CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCS	{1: 2, 2: 7, 3: 1, 39: 1, 14: 4, 28: 2}
Did not match all atoms present	67907-22-6	C=CCCCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]	{2: 19, 5: 1, 6: 1, 14: 5, 17: 1, 20: 2}
Did not match all atoms present	67907-24-8	C=CCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]	{2: 17, 5: 1, 6: 1, 14: 5, 17: 1, 20: 2}
Did not match all atoms present	67907-25-9	CCCCCCCCCCCCCCCC/C=C/[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]	{1: 1, 2: 20, 6: 2, 14: 5, 17: 1, 20: 2}
Did not match all atoms present	67907-33-9	CC=CC1=CC(=C(C=C1C(C)(C)C)O)OC	{1: 5, 4: 1, 6: 2, 14: 2, 21: 1, 22: 1}
Did not match all atoms present	67914-60-7	CC(=O)N1CCN(CC1)C2=CC=C(C=C2)O	{1: 1, 33: 2, 11: 4, 14: 4, 21: 1, 24: 1}
Did not match all atoms present	67919-46-4	CCCCCCC(OS(=O)(=O)[O-])C/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CC(OS(=O)(=O)[O-])CCCCCC)COC(=O)CCCCCCC/C=C/CC(OS(=O)(=O)[O-])CCCCCC.[Na+].[Na+].[Na+]	{1: 3, 2: 41, 3: 4, 6: 6, 22: 3, 28: 3, 29: 9}
Did not match all atoms present	67920-93-8	CC1=C2C=CC=C3C2=C(C=C1)C4=NC5=CC=CC=C5N4C3=O	{1: 1, 35: 1, 33: 1, 14: 9, 25: 1}
Did not match all atoms present	67922-61-6	CCCCCCCC(=O)O.C(C(COC(=O)CS(=O)(=O)[O-])O)O.[Na+]	{1: 1, 2: 9, 3: 1, 20: 2, 27: 1, 28: 1, 29: 3}
Did not match all atoms present	67923-41-5	CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)Cl)C(F)(F)F)C3=CC=C(C=C3)Cl	{1: 1, 34: 2, 35: 1, 4: 1, 33: 1, 12: 1, 14: 7, 15: 1, 16: 3, 17: 2, 25: 1}
Did not match all atoms present	67923-42-6	CC(=C)C(=O)OCCCOC1=CC=CC=C1	{1: 1, 2: 3, 5: 1, 7: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	67923-43-7	C1=CC(=CC=C1N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)N(CCC#N)CCC#N	{33: 1, 2: 4, 37: 2, 38: 1, 34: 2, 14: 6, 17: 2}
Did not match all atoms present	67923-45-9	C1=CC(=CC(=C1)SC#N)N2C(=O)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C(=O)N(C8=O)C9=CC(=CC=C9)SC#N)C2=O	{40: 2, 25: 4, 37: 2, 14: 16, 33: 2}
Did not match all atoms present	67923-46-0	CC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br	{1: 3, 2: 4, 38: 1, 33: 1, 34: 2, 14: 5, 18: 2, 28: 2}
Did not match all atoms present	67923-47-1	CCC(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 2: 5, 37: 1, 38: 1, 33: 1, 34: 2, 14: 8, 28: 1}
Did not match all atoms present	67923-49-3	CCOC(=O)CCN(CCO)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC	{1: 3, 2: 5, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 20: 1, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	67923-50-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)SC4=CC=C(C=C4)O)N	{40: 1, 25: 2, 30: 1, 21: 2, 14: 9}
Did not match all atoms present	67923-59-5	COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-])NCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 38: 1, 34: 2, 14: 7, 22: 1, 29: 3, 31: 1}
Did not match all atoms present	67923-61-9	CCN(CCOP(=O)(O)O)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 7, 33: 1, 16: 15, 20: 2, 22: 1, 29: 3}
Did not match all atoms present	67923-63-1	CC1=CC(=C(C=C1S(=O)(=O)[O-])OC)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=CC=C6OC)/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 3, 34: 2, 14: 14, 15: 4, 22: 2, 24: 1, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	67923-64-2	CC1=CC(=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N/NC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 17, 15: 4, 24: 1, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	67923-66-4	CC(=O)O.C=O.C(#N)N=C(N)N	{1: 1, 34: 1, 5: 1, 7: 1, 27: 1, 30: 2, 37: 1}
Did not match all atoms present	67923-84-6	CC(CCCCC=CC1=CC=CC=C1C(=O)OC)CN	{1: 2, 2: 5, 3: 1, 6: 2, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	67923-88-0	CCC1=CC=CC2=C1C(C3=CC=CC=C3C2O)O	{1: 1, 2: 1, 12: 2, 14: 7, 20: 2}
Did not match all atoms present	67923-90-4	CCCCCCCCCCOCCOCCOCCOS(=O)(=O)O.N	{1: 1, 2: 15, 20: 1, 29: 2, 22: 4}
Did not match all atoms present	67923-96-0	CC(C)COC(=O)C(=C)C.C=CC(=O)[O-].[Na+]	{1: 3, 2: 1, 3: 1, 5: 2, 6: 1, 7: 1, 24: 1, 28: 1}
Did not match all atoms present	67924-05-4	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 17, 33: 1, 14: 4, 20: 4, 29: 2}
Did not match all atoms present	67924-11-2	C[N+]1=CC=C(C=C1)C=C.COS(=O)(=O)[O-].C=CC1=CC=CC=C1	{1: 2, 5: 2, 6: 2, 33: 1, 14: 9, 22: 1, 29: 3}
Did not match all atoms present	67924-14-5	CCCCCCCCCCCC=NC1=CC=CC=C1C(=O)OC	{1: 2, 2: 10, 6: 1, 34: 1, 14: 4, 28: 1}
Did not match all atoms present	67924-16-7	C(CO)N.C(CO)N.C(CO)N.C(COP(=O)(O)[O-])N(CCOP(=O)(O)[O-])CCOP(=O)(O)[O-].C(COP(=O)(O)[O-])N(CCOP(=O)(O)[O-])CCOP(=O)(O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 18, 20: 9, 22: 6, 29: 12, 30: 3}
Did not match all atoms present	67924-17-8	C(COP(=O)(O)O)N(CCOP(=O)(O)[O-])CCOP(=O)(O)[O-].[Na+].[Na+]	{33: 1, 2: 6, 20: 4, 29: 5, 22: 3}
Did not match all atoms present	67924-18-9	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C(CNCCN)N	{1: 3, 2: 37, 14: 12, 20: 3, 29: 6, 30: 2, 31: 1}
Did not match all atoms present	67924-19-0	C(CCCN(COP(=O)(O)[O-])COP(=O)([O-])[O-])CCN(COP(=O)(O)[O-])COP(=O)([O-])[O-].C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]	{33: 4, 2: 22, 20: 8, 29: 10, 22: 4}
Did not match all atoms present	67924-20-3	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C(CNCCO)N	{1: 2, 2: 26, 14: 8, 20: 3, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	67924-22-5	CC1=NN(C(=C1N=NC2=C(C=C(C=C2)Cl)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=C(C=C2)Cl)[O-])[O-])C3=CC=CC=C3.[Na+].[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 16, 17: 2}
Did not match all atoms present	67924-23-6	C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+].[Co+2]	{33: 2, 2: 6, 29: 12}
Did not match all atoms present	6793-92-6	C1=CC=C(C=C1)COC2=CC=C(C=C2)Br	{2: 1, 22: 1, 18: 1, 14: 9}
Did not match all atoms present	67938-78-7	CC[N-]CC.CC[N-]CC.CC[N-]CC.CC[N-]CC.[Cr+4]	{1: 8, 2: 8, 34: 4}
Did not match all atoms present	67939-05-3	CC1=CC=C(C=C1)N/N=C\2/C(=O)C=C/C(=N\NC3=CC=C(C=C3)S(=O)(=O)[O-])/C2=O.[Na+]	{1: 1, 34: 2, 14: 10, 25: 2, 29: 3, 31: 2}
Did not match all atoms present	67939-22-4	CCCCCCN(CP(=O)(O)O)CP(=O)(O)[O-].[Na+]	{1: 1, 2: 7, 20: 3, 29: 3, 33: 1}
Did not match all atoms present	67939-23-5	CCCCC(CC)C(=O)OCCS[Sn](CCCC)(SCCOC(=O)C(CC)CCCC)SCCOC(=O)C(CC)CCCC	{40: 3, 1: 7, 2: 21, 3: 3, 28: 3}
Did not match all atoms present	67939-25-7	CC1=C(C=CC(=C1)S(=O)(=O)O)N2C(=O)CC(=N2)C(=O)O	{1: 1, 35: 1, 33: 1, 11: 1, 14: 3, 15: 1, 20: 1, 25: 1, 27: 1, 29: 2}
Did not match all atoms present	67939-28-0	CCCC[Sn](SCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC(C)C)(SCCOC(=O)C2=CC=CC=C2C(=O)OCCCCCC(C)C)SCCOC(=O)C3=CC=CC=C3C(=O)OCCCCCC(C)C	{1: 7, 2: 24, 3: 3, 40: 3, 14: 12, 28: 6}
Did not match all atoms present	67939-33-7	CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 4, 5: 1, 7: 1, 16: 9, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67939-34-8	CCCCCCCCCCCCCCCCCCOC(=O)C=C.CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F.C=CC(=O)O	{1: 3, 2: 20, 4: 4, 5: 3, 6: 2, 7: 1, 16: 9, 33: 1, 27: 1, 28: 2, 29: 2}
Did not match all atoms present	67939-36-0	CCN(CCOC(=O)C(=C)C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 7, 5: 1, 7: 1, 16: 15, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67939-42-8	CCN(CCC[Si](Cl)(Cl)Cl)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 8, 33: 1, 16: 17, 17: 3, 29: 2}
Did not match all atoms present	67939-43-9	CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C=C3OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)[O-])OC)N/N=C/5\C(=CC6=CC(=CC(=C6C5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 3, 14: 14, 15: 2, 22: 2, 25: 1, 29: 14, 30: 1, 31: 1}
Did not match all atoms present	67939-47-3	C1CCC2=C(C1)C=CC(=C2)NC3=C4C(=C(C=C3)NC5=CC6=C(CCCC6)C=C5)C(=O)C7=CC(=C(C=C7C4=O)Cl)Cl	{31: 2, 17: 2, 11: 8, 14: 10, 25: 2}
Did not match all atoms present	67939-61-1	CC(=C)C(=O)OCCCCN(C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 4, 4: 6, 5: 1, 7: 1, 16: 13, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67939-62-2	CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Cd+2]	{24: 2, 1: 2, 2: 24, 6: 8}
Did not match all atoms present	67939-64-4	CCCCC(CC)C(=O)OCCS[Sn](C)(C)SCCOC(=O)C(CC)CCCC	{40: 2, 1: 6, 2: 12, 3: 2, 28: 2}
Did not match all atoms present	67939-69-9	[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Mg+2]	{34: 2, 29: 6, 14: 11}
Did not match all atoms present	67939-70-2	C1C(O1)CCl.C1=CC=C(C=C1)O.C(=O)C=O	{2: 1, 11: 1, 12: 1, 14: 5, 17: 1, 21: 1, 23: 1, 26: 2}
Did not match all atoms present	67939-71-3	C1=CC(=CC(=C1)O)O.C1=COC(=C1)CO	{2: 1, 20: 1, 21: 2, 14: 7, 23: 1}
Did not match all atoms present	67939-77-9	CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.O=[U]=O	{27: 2, 1: 4, 2: 8, 3: 2, 29: 2}
Did not match all atoms present	67939-78-0	C1=CC=C(C=C1)C[O-].C1=CC=C(C=C1)C[O-].C1=CC=C(C=C1)C[O-].C1=CC=C(C=C1)C[O-].[Ge]	{2: 4, 29: 4, 14: 20}
Did not match all atoms present	67939-79-1	CC1CCC(C(C1)[O-])C(C)C.CC1CCC(C(C1)[O-])C(C)C.CC1CCC(C(C1)[O-])C(C)C.CC1CCC(C(C1)[O-])C(C)C.[Ge]	{11: 12, 1: 12, 3: 4, 12: 12, 29: 4}
Did not match all atoms present	67939-80-4	C1CCCCC(CCC1)O[Si](OC2CCCCCCCC2)(OC3CCCCCCCC3)OC4CCCCCCCC4	{11: 32, 12: 4, 22: 4}
Did not match all atoms present	67939-81-5	CCCCC(CC)C(=O)O[Si](OC(=O)C(CC)CCCC)(OC(=O)C(CC)CCCC)OC(=O)C(CC)CCCC	{1: 8, 2: 16, 3: 4, 28: 4}
Did not match all atoms present	67939-82-6	CCCCCCCC[S-].[Au+]	{1: 1, 2: 7}
Did not match all atoms present	67939-84-8	CC1CC(=CC2=CC=C(C=C2)NC(=O)C)C(=O)C(=CC3=CC=C(C=C3)NC(=O)C)C1	{1: 3, 6: 2, 11: 2, 12: 1, 14: 8, 15: 2, 24: 2, 25: 1, 31: 2}
Did not match all atoms present	67939-85-9	CC1CC(=CC2=CC=C(C=C2)N)C(=O)C(=CC3=CC=C(C=C3)N)C1.Cl.Cl	{1: 1, 6: 2, 11: 2, 12: 1, 14: 8, 15: 2, 17: 2, 25: 1, 30: 2}
Did not match all atoms present	67939-87-1	CCN(CCOP(=O)(O)OCCN(CC)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 6, 4: 10, 33: 2, 16: 22, 20: 1, 22: 2, 29: 5}
Did not match all atoms present	67939-89-3	CCN(CCOP(=O)(O)O)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 4, 33: 1, 16: 9, 20: 2, 22: 1, 29: 3}
Did not match all atoms present	67939-90-6	CCN(CCOP(=O)(O)O)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 5, 33: 1, 16: 11, 20: 2, 22: 1, 29: 3}
Did not match all atoms present	67939-91-7	CCN(CCOP(=O)(O)OCCN(CC)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 6, 4: 8, 33: 2, 16: 18, 20: 1, 22: 2, 29: 5}
Did not match all atoms present	67939-92-8	CCN(CCOP(=O)(O)OCCN(CC)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 6, 4: 12, 33: 2, 16: 26, 20: 1, 22: 2, 29: 5}
Did not match all atoms present	67939-93-9	CCN(CCOP(=O)(O)OCCN(CC)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 6, 4: 14, 33: 2, 16: 30, 20: 1, 22: 2, 29: 5}
Did not match all atoms present	67939-96-2	CC(=C)C(=O)OCCN(C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 2, 4: 7, 5: 1, 7: 1, 16: 15, 33: 1, 28: 1, 29: 2}
Did not match all atoms present	67940-00-5	CC(=O)NC1=CC(=C(C=C1)OC)N(C)CCC#N	{1: 3, 2: 2, 37: 1, 33: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	67940-01-6	CC(=O)NC1=CC(=C(C=C1)OC)NC	{24: 1, 1: 3, 22: 1, 14: 3, 31: 2}
Did not match all atoms present	67944-71-2	CN=C(NC#N)[S-].[Na+]	{1: 1, 34: 1, 31: 1, 37: 1, 7: 1}
Did not match all atoms present	67947-14-2	C[Si](C)(C)OC1=C(C(=CC=C1)Cl)Cl	{1: 3, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	67947-19-7	COP(=O)(O)OC.C(CO)N	{1: 2, 2: 2, 20: 2, 22: 2, 29: 1, 30: 1}
Did not match all atoms present	6795-16-0	COC1=C2C(=C3C4CCOC4OC3=C1)OC5=C(C2=O)C(=CC=C5)O	{1: 1, 11: 2, 12: 2, 14: 4, 21: 1, 22: 1, 23: 3, 25: 1}
Did not match all atoms present	6795-23-9	COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C(=C1)O[C@@H]5[C@]4(C=CO5)O	{1: 1, 11: 2, 12: 1, 13: 1, 14: 3, 20: 1, 22: 1, 23: 2, 25: 1, 28: 1}
Did not match all atoms present	67952-24-3	CCOC(=O)N1C(=O)CSC1=S	{1: 1, 2: 1, 33: 1, 41: 1, 11: 1, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	67952-25-4	COC(=O)N1C(=O)CSC1=S	{1: 1, 33: 1, 41: 1, 11: 1, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	67952-27-6	[B-](F)(F)(F)F.CCN(CCO)C1=CC(=C(C=C1)[N+]#N)C	{1: 2, 2: 3, 33: 1, 34: 1, 14: 3, 16: 4, 20: 1}
Did not match all atoms present	67952-28-7	C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Mg+2]	{35: 2, 14: 12}
Did not match all atoms present	67952-38-9	CC(CCC1=CC=C(C=C1)OC)O	{1: 2, 2: 2, 3: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	67952-39-0	CCC(C)C(=O)OC1=CC=C(C=C1)C	{1: 3, 2: 1, 3: 1, 28: 1, 14: 4}
Did not match all atoms present	67952-41-4	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Ni+2]	{24: 4, 3: 4, 20: 4}
Did not match all atoms present	67952-42-5	C(C(C(=O)[O-])O)(C(=O)[O-])O.[Mn+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	67952-43-6	[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Ni+2]	{17: 2, 29: 6}
Did not match all atoms present	67952-45-8	CC(C)C1=C2C(=CC=C(C2=C(C=C1)S(=O)(=O)[O-])S(=O)(=O)[O-])C(C)C.[Na+].[Na+]	{1: 4, 3: 2, 29: 6, 14: 4}
Did not match all atoms present	67952-50-5	CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)OC(=O)C=C)OC(=O)C=C	{1: 4, 2: 2, 3: 2, 4: 1, 5: 2, 6: 2, 14: 8, 22: 2, 28: 2}
Did not match all atoms present	67952-53-8	CC(=C)C(=O)[O-].CC(=C)C(=O)[O-].[Co+2]	{24: 2, 1: 2, 5: 2, 7: 2}
Did not match all atoms present	67952-56-1	CC(C)OC(=O)C1=CC=C(C=C1)C(C)(C)C	{1: 5, 3: 1, 4: 1, 14: 4, 28: 1}
Did not match all atoms present	67952-59-4	CC(C)C1=NC=CN=C1SC	{40: 1, 1: 3, 3: 1, 14: 2, 35: 2}
Did not match all atoms present	67952-66-3	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].C(CN)[NH3+]	{1: 1, 2: 13, 30: 1, 29: 3, 14: 4}
Did not match all atoms present	67952-67-4	COC1CCC2=CC=CC=C12	{1: 1, 11: 2, 12: 1, 22: 1, 14: 4}
Did not match all atoms present	67952-69-6	C(C(COP(=O)(O)O)[O-])[O-].[Ni+2]	{2: 2, 3: 1, 20: 2, 29: 3, 22: 1}
Did not match all atoms present	67952-72-1	CC(C)COC(=O)C(=C)C.C=CC(=O)[O-].[NH4+]	{1: 3, 2: 1, 3: 1, 5: 2, 6: 1, 7: 1, 24: 1, 28: 1}
Did not match all atoms present	67952-75-4	C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[K+].[K+].[Pd+2]	{24: 4, 33: 2, 2: 6}
Did not match all atoms present	67952-85-6	C=CC=C.C=CC#N.C=CC1=CC=CC=C1.[NH4+]	{14: 5, 5: 4, 6: 4, 37: 1}
Did not match all atoms present	67952-93-6	CC1=C(C=C(C=C1)CN)Cl	{1: 1, 2: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	67952-97-0	CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)[O-].CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)[O-].CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)[O-].[Al+3]	{24: 3, 1: 3, 2: 36, 28: 3, 14: 12}
Did not match all atoms present	67953-06-4	CC1=CC(=C2C(=C1S(=O)(=O)O)SC(=N2)C3=CC=C(C=C3)N)S(=O)(=O)O	{1: 1, 35: 1, 41: 1, 14: 5, 20: 2, 29: 4, 30: 1}
Did not match all atoms present	67953-07-5	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[NH4+].[NH4+].[NH4+].[Bi+3]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	67953-10-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)N=NC(C(=O)NC4=C(C(=CC=C4)Cl)Cl)C(=O)NC5=C(C(=CC=C5)Cl)Cl	{34: 2, 3: 1, 14: 13, 17: 4, 24: 2, 25: 2, 31: 2}
Did not match all atoms present	67953-11-1	CCCCCCCCC(CCCCCCCCC(=O)OCCC)OS(=O)(=O)O.C(CO)NCCO	{1: 2, 2: 21, 3: 1, 20: 3, 22: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	67953-16-6	C[N+](C)(CC=C)CC1=CC=CO1.[Cl-]	{1: 2, 2: 2, 5: 1, 6: 1, 14: 3, 17: 1, 23: 1}
Did not match all atoms present	67953-18-8	CCCCCCCCCCCCCCCCCC(=O)N(CCO)CCOC(=O)CC(C(=O)O)S(=O)(=O)[O-].N.[Na+]	{1: 1, 2: 21, 3: 1, 33: 1, 20: 1, 24: 1, 27: 1, 28: 1, 29: 3}
Did not match all atoms present	67953-22-4	CC(C)COP(=O)([O-])OCC(C)C.[K+]	{1: 4, 2: 2, 3: 2, 29: 2, 22: 2}
Did not match all atoms present	67953-24-6	CCCCCCOC(=O)C(CC(=O)OC1CCCCC1)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 6, 3: 1, 11: 5, 12: 1, 28: 2, 29: 3}
Did not match all atoms present	67953-31-5	CC(C)CCCCCCCOP(=O)(O)OCCCCCCCC(C)C	{1: 4, 2: 14, 3: 2, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	67953-36-0	CCCCCCCCC(CCCCCCCCC(=O)OCC(C)C)OS(=O)(=O)O.C(CO)N	{1: 3, 2: 18, 3: 2, 20: 2, 22: 1, 28: 1, 29: 2, 30: 1}
Did not match all atoms present	67953-38-2	CCCCCCCCC(CCCCCCCCC(=O)OCC(C)C)OS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 3, 2: 22, 3: 2, 33: 1, 20: 4, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	67953-40-6	CC(CO)(CO)C(=O)O.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 1, 2: 2, 4: 1, 14: 4, 20: 2, 27: 1, 28: 2}
Did not match all atoms present	67953-51-9	C1=CC=C2C(=C1)C(=O)OC2=O.C(CO)COCCCO.C(=C/C(=O)O)\C(=O)O	{2: 6, 6: 2, 14: 4, 20: 2, 22: 1, 27: 2, 28: 2}
Did not match all atoms present	67953-73-5	[B-](F)(F)(F)F.[B-](F)(F)(F)F.[B-](F)(F)(F)F.[Fe+3]	{16: 12}
Did not match all atoms present	67953-74-6	CCCCSCCCC.Cl[Ir](Cl)Cl	{40: 1, 1: 2, 2: 6, 17: 3}
Did not match all atoms present	67953-75-7	CCN(CCO)C1=CC(=C(C=C1)[N+]#N)C.[Cl-].[Cl-].[Cl-].[Zn]	{1: 2, 2: 3, 33: 1, 34: 1, 14: 3, 17: 3, 20: 1}
Did not match all atoms present	67953-79-1	C=CCCCC[NH3+].C1=CC(=O)OC1=O	{2: 4, 14: 2, 28: 2, 5: 1, 6: 1}
Did not match all atoms present	67963-68-2	CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)Br	{1: 5, 18: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	67966-25-0	[B-](C(C)C(C)C)(C(C)C(C)C)C(C)C(C)C.[K+]	{1: 9, 3: 6}
Did not match all atoms present	67966-88-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)O)S(=O)(=O)O)N	{14: 9, 20: 1, 21: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	67968-22-3	[H+].C(N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])P(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[Ni+2]	{33: 1, 2: 3, 29: 9}
Did not match all atoms present	67968-24-5	CCCCCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)[O-])OC2=CC=CC=C2S(=O)(=O)[O-].[NH4+].[NH4+]	{1: 1, 2: 11, 22: 1, 14: 7, 29: 6}
Did not match all atoms present	67968-63-2	CCCCCCCCCC(CCCCCCCC(=O)[O-])S(=O)(=O)[O-].[K+].[K+]	{24: 1, 1: 1, 2: 15, 3: 1, 29: 3}
Did not match all atoms present	67969-65-7	CCN(CCOP(=O)(O)O)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 6, 33: 1, 16: 13, 20: 2, 22: 1, 29: 3}
Did not match all atoms present	67969-67-9	C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Co+2]	{33: 2, 2: 6, 29: 12}
Did not match all atoms present	67969-68-0	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ga+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	67969-73-7	C1=CC=C(C(=C1)N=NC2=C3C=C(C=CC3=C(C=C2)N)S(=O)(=O)[O-])Cl.[Na+]	{17: 1, 30: 1, 34: 2, 29: 3, 14: 9}
Did not match all atoms present	67969-76-0	CC1=C(C=CC=C1N=C=O)N=C=O.C1C=CC2C1C3CC2CC3O	{1: 1, 34: 2, 8: 2, 11: 3, 12: 5, 14: 5, 20: 1, 29: 2}
Did not match all atoms present	67969-77-1	CC(C)(C)C1=CC=C(C=C1)O.CC(C)(C)C1=C(C(=CC=C1)O)O.C=O	{1: 6, 4: 2, 5: 1, 14: 7, 21: 3}
Did not match all atoms present	67969-78-2	CCCCCCC(CCCCCCCCCCC(=O)[O-])O.CC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 15, 3: 1, 20: 1}
Did not match all atoms present	67969-79-3	C1=CC(=C(C=C1N)N)N/N=C/2\C=C3C(=CC(=CC3=O)S(=O)(=O)[O-])C=C2S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 7, 15: 5, 25: 1, 29: 6, 30: 2, 31: 1}
Did not match all atoms present	67969-80-6	CCOC(=O)SC(=S)OC(C)C	{1: 3, 2: 1, 3: 1, 7: 1, 40: 1, 22: 1, 28: 1}
Did not match all atoms present	67969-82-8	B(F)(F)F.CCOCC.F	{16: 4, 1: 2, 2: 2, 22: 1}
Did not match all atoms present	67969-83-9	B(F)(F)F.COC.F	{16: 4, 1: 2, 22: 1}
Did not match all atoms present	67969-89-5	CC(=O)NC1=CC(=C(C=C1)S(=O)(=O)O)[N+]#N.[Cl-]	{1: 1, 34: 1, 14: 3, 17: 1, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	67969-91-9	C1=CC(=CC(=C1)Cl)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)[O-])N.[Na+]	{14: 7, 17: 1, 24: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	67969-92-0	C1=CC(=CC=C1NC2=C(C=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C\5/C(=CC6=C(C5=O)C=C(C=C6)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 14: 15, 15: 4, 25: 2, 29: 9, 30: 2, 31: 3}
Did not match all atoms present	67969-93-1	C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)O)[N+]#N.[Cl-]	{34: 1, 14: 8, 17: 1, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	67969-94-2	C1=CC=C2C(=C1)C(=CC=C2[N+]#N)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)O)S(=O)(=O)O.[Cl-]	{17: 1, 34: 3, 20: 2, 29: 4, 14: 11}
Did not match all atoms present	67969-95-3	CC1=C(C(=CC=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])OC.[Na+]	{1: 2, 14: 8, 22: 1, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	67969-96-4	C1=CC(=C(C=C1[N+]#N)S(=O)(=O)O)/C=C/C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O.[Cl-]	{34: 1, 38: 1, 6: 2, 14: 6, 17: 1, 20: 2, 29: 4}
Did not match all atoms present	67969-97-5	CC1=CC=C(C=C1)O.CC(C)(C)C1=CC=C(C=C1)O.C=O	{1: 4, 4: 1, 5: 1, 14: 8, 21: 2}
Did not match all atoms present	67969-98-6	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.C(O)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 1, 4: 1, 5: 1, 14: 8, 20: 1, 21: 2, 29: 3}
Did not match all atoms present	67969-99-7	CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC(=CC=C1O)S(=O)(=O)C2=CC=C(C=C2)O	{1: 3, 4: 1, 5: 1, 14: 12, 21: 3, 29: 2}
Did not match all atoms present	6797-13-3	CCC1=NC2=CC=CC=C2O1	{1: 1, 2: 1, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	6797-44-0	CC(=O)C(=NO)C(=O)C1=CC=CC=C1	{1: 1, 34: 1, 7: 1, 14: 5, 20: 1, 24: 2}
Did not match all atoms present	67970-01-8	C=O.C1=CC=C(C=C1)C2=CC=C(C=C2)O.C1=CC=C(C=C1)C2=CC=CC=C2O	{5: 1, 14: 18, 21: 2}
Did not match all atoms present	67970-06-3	CC(=C)C.C=O.C1=CC=C(C=C1)O	{1: 2, 21: 1, 5: 2, 14: 5, 7: 1}
Did not match all atoms present	67970-07-4	CC1=CC=CC=C1O.CC(=C)C.N	{1: 3, 21: 1, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	67970-08-5	CC(C)(C)C1=CC=C(C=C1)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.C1=CC=C(C=C1)O	{1: 5, 4: 2, 5: 1, 14: 17, 21: 4}
Did not match all atoms present	67970-10-9	CC1OC(OC(O1)C)C.C=O.C1=CC=C(C=C1)O	{1: 3, 5: 1, 12: 3, 14: 5, 21: 1, 23: 3}
Did not match all atoms present	67970-11-0	CC(=C)C.C1=CC=C(C=C1)O	{1: 2, 21: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	67970-21-2	C[N+](C)(C)C(=O)C=C.[Cl-]	{24: 1, 1: 3, 5: 1, 6: 1, 17: 1}
Did not match all atoms present	67970-25-6	CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCNC(=O)CCCCCCCCCCCCCCCCC)C(=O)N.CCOP(=O)([O-])OCC	{1: 5, 2: 39, 22: 2, 24: 3, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	67970-28-9	CCCCC1=CC2=CC=CC=C2C(=C1CCCC)S(=O)(=O)O.CCCCN	{1: 3, 2: 9, 14: 5, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	67970-29-0	CCCCCN.CCCCC1=CC2=CC=CC=C2C(=C1CCCC)S(=O)(=O)O	{1: 3, 2: 10, 14: 5, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	67970-31-4	CCC(C)(C)C1=CC2=CC=CC=C2C(=C1C(C)(C)CC)S(=O)(=O)O.C1CCC(CC1)N	{1: 6, 2: 2, 4: 2, 11: 5, 12: 1, 14: 5, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	6798-02-3	C1=CC(=CC=C1C(=O)NC2=CC3=C(C=C2)C(=O)/C(=N/NC4=CC=C(C=C4)S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])N=NC5=CC(=C(C=C5N)N)[N+](=O)[O-].[Na+].[Na+]	{34: 3, 38: 1, 14: 14, 15: 2, 24: 1, 25: 1, 29: 6, 30: 2, 31: 2}
Did not match all atoms present	67989-05-3	CC(C)CCCCCC(=O)OCC(C)(CO)COC(=O)C1=CC=C(C=C1)C(C)(C)C.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 6, 2: 8, 3: 1, 4: 2, 14: 8, 20: 1, 28: 4}
Did not match all atoms present	67989-14-4	CCCCCCCCCCCCCCCCCC(=O)OCC(CO)(CO)COC(=O)C1=CC=CC=C1.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 1, 2: 20, 4: 1, 14: 9, 20: 2, 28: 4}
Did not match all atoms present	67989-21-3	CCCCCCCCC(=O)OCC(C)(CO)COC(=O)C1=CC=C(C=C1)C(C)(C)C.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 5, 2: 10, 4: 2, 14: 8, 20: 1, 28: 4}
Did not match all atoms present	67989-25-7	B(O)(O)OCCCCCC(C)C	{1: 2, 2: 5, 3: 1, 20: 2, 22: 1}
Did not match all atoms present	67989-83-7	[H+].CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=CC(=C(C=C3[O-])NC(=O)C)[N+](=O)[O-].CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=CC(=C(C=C3[O-])NC(=O)C)[N+](=O)[O-].[Cr+3]	{1: 4, 34: 4, 38: 2, 14: 14, 24: 4, 31: 4}
Did not match all atoms present	67989-84-8	CC(=CCCC(C)(C=C)OC(CC1=CC=CC=C1)OC(C)(CCC=C(C)C)C=C)C	{1: 6, 2: 5, 3: 1, 4: 2, 5: 2, 6: 4, 7: 2, 14: 5, 22: 2}
Did not match all atoms present	67989-87-1	C(CO)N.C(CO)N.[Cl-].[Cl-].[Zn+2]	{17: 2, 2: 4, 20: 2, 30: 2}
Did not match all atoms present	67989-89-3	[H+].C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+].[Cu+2]	{33: 2, 2: 6, 29: 12}
Did not match all atoms present	67990-00-5	C1CCCCCOC(=O)OCCCC1	{11: 10}
Did not match all atoms present	67990-03-8	CCCCCCCCCC1=CC(=C(C(=C1)C)O)C	{1: 3, 2: 8, 21: 1, 14: 2}
Did not match all atoms present	67990-06-1	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=C(C=CC(=C4)C(=O)N)Cl)/C2=O	{34: 1, 14: 13, 15: 2, 17: 1, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	67990-07-2	COC1=C(C=C(C=C1)[N+](=O)[O-])NN=C2C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4OC	{1: 2, 34: 1, 38: 1, 14: 12, 15: 2, 22: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	67990-08-3	CCN1CCCC1=CC=C2C(=O)N(C(=S)N2CC)C	{1: 3, 2: 2, 6: 2, 33: 3, 11: 3, 15: 3, 25: 1}
Did not match all atoms present	67990-09-4	CCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)O)N	{1: 1, 2: 13, 14: 3, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	67990-10-7	CCCCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C	{1: 2, 2: 13, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	67990-11-8	CC[N+]1=C(OC2=C1C=C(C(=C2)C)C)C=CNC3=CC=CC=C3.[I-]	{1: 3, 2: 1, 6: 2, 33: 1, 14: 7, 19: 1, 23: 1, 31: 1}
Did not match all atoms present	67990-12-9	C1=C(C(=CC(=C1Cl)Cl)NCCCO)N	{2: 3, 14: 2, 17: 2, 20: 1, 30: 1, 31: 1}
Did not match all atoms present	67990-13-0	CCN1CC(=O)N(C1=S)C	{1: 2, 2: 1, 33: 2, 11: 1, 15: 1, 25: 1}
Did not match all atoms present	67990-18-5	CCCCCCOCCOCCOCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 10, 22: 3}
Did not match all atoms present	67990-19-6	C1=CC=C(C(=C1)C(=O)[O-])NCC(=O)O.[Na+]	{24: 1, 2: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	67990-22-1	C1=CC=C(C=C1)N=NC2=C(C(=C(C3=C(C(=C(C=C32)S(=O)(=O)[O-])N=NC4=CC=C(C=C4)[N+](=O)[O-])N)O)N=NC5=CC(=C(C=C5)O)C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 6, 38: 1, 14: 13, 21: 2, 24: 1, 29: 6, 30: 1}
Did not match all atoms present	67990-23-2	C1=CC=C(C=C1)NNC2=C(/C(=N/N=C\3/C=CC(=O)C(=C3)C(=O)[O-])/C(=O)C4=C(C(=C(C=C42)S(=O)(=O)[O-])N=NC5=CC=C(C=C5)N)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 4, 14: 13, 15: 5, 24: 1, 25: 2, 29: 6, 30: 2, 31: 2}
Did not match all atoms present	67990-24-3	CC1=C(C=CC(=C1)N/N=C\2/C(=CC3=C(C2=O)C=C(C=C3)NC4=CC=CC=C4)S(=O)(=O)[O-])N=NC5=CC=C(C=C5)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 3, 14: 16, 15: 2, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	67990-25-4	COC1=CC=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC=C(C=C4)N)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 1, 14: 12, 15: 2, 22: 1, 24: 1, 25: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	67990-26-5	CC1=CC(=C(C=C1)OC)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC=C(C=C4)N)S(=O)(=O)[O-].[Na+]	{1: 2, 34: 1, 14: 11, 15: 2, 22: 1, 24: 1, 25: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	67990-28-7	C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 6: 2, 38: 1, 14: 11, 29: 9, 30: 1}
Did not match all atoms present	67990-30-1	CC1=CC(=CC(=C1Br)OC)Br	{1: 2, 18: 2, 22: 1, 14: 2}
Did not match all atoms present	67990-32-3	C1=C(C=C(C(=C1Br)OC(=O)OC2=C(C=C(C=C2Br)Br)Br)Br)Br	{18: 6, 14: 4}
Did not match all atoms present	67990-33-4	CC1=[N+](C2=C(N1CC3=CC=CC=C3)C=C(C=C2)C(F)(F)F)C.[Br-]	{1: 2, 2: 1, 4: 1, 33: 2, 14: 8, 16: 3, 18: 1}
Did not match all atoms present	67990-34-5	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ba+2]	{34: 1, 14: 11, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	67990-35-6	CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=CC2=O.CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=CC2=O.[Ca+2]	{1: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	67990-36-7	C1=CC=C2C(=C1)C=C/C(=N/NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=O.[Ba+2]	{34: 1, 14: 11, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	67990-37-8	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ca+2]	{34: 1, 14: 11, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	67990-39-0	C=CC(=O)N.C=CC(=O)OCCN.[N+](=O)(O)[O-]	{2: 2, 5: 2, 6: 2, 20: 1, 24: 1, 28: 1, 30: 2}
Did not match all atoms present	68-01-9	CC[N+](CC)(CC)C1=CC(=CC=C1)O.[I-]	{1: 3, 2: 3, 19: 1, 21: 1, 14: 4}
Did not match all atoms present	68-04-2	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Na+].[Na+].[Na+]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	68-05-3	CC[N+](CC)(CC)CC.[I-]	{1: 4, 2: 4, 19: 1}
Did not match all atoms present	68-19-9	CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)([O-])OC(C)CNC(=O)CCC4(C(C5C6(C(C(C(=C(C7=NC(=CC8=NC(=C(C4=N5)C)C(C8(C)C)CCC(=O)N)C(C7(C)CC(=O)N)CCC(=O)N)C)[N-]6)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.[C-]#N.[Co+3]	{1: 11, 2: 13, 3: 1, 33: 1, 12: 9, 13: 5, 14: 4, 15: 8, 35: 5, 20: 2, 22: 2, 23: 1, 24: 7, 29: 2, 30: 6, 31: 1}
Did not match all atoms present	68-35-9	C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{30: 1, 35: 2, 29: 2, 14: 7, 31: 1}
Did not match all atoms present	68-36-0	C1=CC(=CC=C1C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{17: 6, 4: 2, 14: 4}
Did not match all atoms present	68-88-2	C1CN(CCN1CCOCCO)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl	{33: 2, 2: 4, 3: 1, 11: 4, 14: 9, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	68-89-3	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)[O-].[Na+]	{1: 3, 2: 1, 33: 3, 14: 5, 25: 1, 29: 3}
Did not match all atoms present	68-90-6	CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)O)I	{1: 1, 2: 1, 14: 6, 19: 2, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	68-91-7	CC1(C2CCC1(C(=O)C2)CS(=O)(=O)[O-])C.C1CC2C3C(C[S+]2C1)N(C(=O)N3CC4=CC=CC=C4)CC5=CC=CC=C5	{1: 2, 2: 3, 33: 2, 11: 7, 12: 4, 13: 2, 14: 10, 25: 2, 29: 3}
Did not match all atoms present	68-94-0	C1=NC2=C(N1)C(=O)N=CN2	{32: 2, 25: 1, 35: 2, 14: 2}
Did not match all atoms present	680-31-9	CN(C)P(=O)(N(C)C)N(C)C	{1: 6, 29: 1, 33: 3}
Did not match all atoms present	68000-78-2	C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N)NC(=O)[C@H](CN)O)O.OS(=O)(=O)O.OS(=O)(=O)O	{1: 2, 2: 2, 3: 1, 11: 2, 12: 13, 13: 1, 20: 11, 22: 2, 23: 2, 24: 1, 29: 4, 30: 3, 31: 2}
Did not match all atoms present	68003-12-3	C1=CC(=CC=C1N=NC2=C(C=CC(=C2)S(=O)(=O)O)Cl)[N+]#N.[Cl-]	{17: 2, 34: 3, 20: 1, 29: 2, 14: 7}
Did not match all atoms present	68003-13-4	CCOC(=O)C1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)OC)N	{1: 2, 2: 2, 14: 6, 22: 1, 28: 1, 30: 2}
Did not match all atoms present	68003-18-9	C(CCCCCCS(=O)(=O)O)CCCCCC=CS(=O)(=O)O	{2: 12, 20: 2, 29: 4, 6: 2}
Did not match all atoms present	68003-33-8	CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C=CC(=CC3=CC(=C2)S(=O)(=O)O)N	{1: 1, 14: 9, 20: 1, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	68003-34-9	C1=CC(=C(C=C1S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O)C(=O)O)O	{14: 7, 20: 2, 21: 2, 27: 1, 29: 6, 31: 1}
Did not match all atoms present	68003-35-0	C1=CC=C(C=C1)S(=O)(=O)OC2=C3C=CC(=CC3=CC(=C2)S(=O)(=O)O)N	{30: 1, 20: 1, 22: 1, 14: 10, 29: 4}
Did not match all atoms present	68003-38-3	C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]	{38: 1, 14: 7, 17: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	68003-39-4	CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C	{1: 2, 2: 1, 38: 1, 33: 1, 14: 8, 29: 2}
Did not match all atoms present	68003-40-7	CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCO	{1: 1, 2: 2, 38: 1, 14: 3, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	68003-41-8	C1CCC(CC1)C2=CC=C(C=C2)OC3=CC=C(C=C3)[N+](=O)[O-]	{38: 1, 11: 5, 12: 1, 22: 1, 14: 8}
Did not match all atoms present	68003-42-9	CC1=NN(C(=O)C1)C2=CC(=CC=C2)S(=O)(=O)NCCO	{1: 1, 2: 2, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	68003-43-0	C1CCC(CC1)NC2=C3C(=C(C=C2)NCCC(=O)O)C(=O)C4=CC=CC=C4C3=O	{2: 2, 11: 5, 12: 1, 14: 6, 25: 2, 27: 1, 31: 2}
Did not match all atoms present	68003-44-1	C1=CC(=CC=C1NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)O)S(=O)(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.[Na+].[Na+]	{33: 4, 2: 20, 35: 6, 6: 2, 14: 14, 20: 12, 29: 10, 31: 4}
Did not match all atoms present	68003-45-2	CCCCCCCCCCCCOC(=O)C1=C(C=CC(=C1)S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+]	{1: 1, 2: 11, 14: 3, 24: 1, 28: 1, 29: 3}
Did not match all atoms present	68003-48-5	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)OC)N	{1: 3, 2: 2, 33: 1, 13: 1, 14: 9, 22: 1, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	68003-59-8	C/C=C/N=C(C1=CC=CC=C1)N(C)C	{1: 3, 34: 1, 6: 2, 33: 1, 7: 1, 14: 5}
Did not match all atoms present	68003-68-9	CC(=CN=CC1=CC=CC=C1)C	{1: 2, 34: 1, 14: 5, 6: 2, 7: 1}
Did not match all atoms present	68006-83-7	CC1=C(N=C2C(=C1)C3=CC=CC=C3N2)N	{32: 1, 1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	68015-57-6	C1=CC=C\2C(=C1)C3=CC=CC=C3C(=O)/C2=N\NC4=NC=CC=N4	{34: 1, 35: 2, 14: 11, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	68015-58-7	C[N+](C)(CCCNS(=O)(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl)CCO.C(=O)[O-]	{1: 2, 2: 5, 35: 1, 33: 1, 11: 2, 14: 8, 15: 1, 17: 1, 20: 1, 26: 1, 29: 2, 31: 1}
Did not match all atoms present	68015-60-1	CC(C)(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2N)C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4N	{1: 2, 4: 1, 14: 16, 22: 2, 29: 4, 30: 2}
Did not match all atoms present	68015-65-6	C[Si](C)O[Si](C)C.C[Si](C)(C=C)O[Si](C)(C)C=C	{1: 8, 22: 2, 5: 2, 6: 2}
Did not match all atoms present	68015-79-2	C1=C/C(=N\N=C/2\C(=CC3=CC(=CC(=C3C2=O)N=NC4=C/C(=N/NC5=CC=C(C=C5)NC6=C(C=C(C=C6)NNC7=CC(=C(C=C7)[O-])C(=O)[O-])S(=O)(=O)[O-])/C(=O)C=C4[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=O)C=C1.[Na+].[Na+].[Na+].[Na+].[Cu+2]	{34: 5, 14: 19, 15: 6, 24: 1, 25: 3, 29: 9, 31: 4}
Did not match all atoms present	68015-88-3	CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCOCC2.F[P-](F)(F)(F)(F)F	{1: 2, 2: 6, 33: 1, 11: 4, 34: 1, 14: 2, 16: 6, 22: 2, 23: 1}
Did not match all atoms present	68015-89-4	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N.F[P-](F)(F)(F)(F)F	{1: 1, 2: 2, 33: 1, 34: 1, 14: 9, 16: 6}
Did not match all atoms present	68015-90-7	CC1=C(C=CC(=C1)[N+]#N)N2CCCC2.F[P-](F)(F)(F)(F)F	{1: 1, 34: 1, 33: 1, 11: 4, 14: 3, 16: 6}
Did not match all atoms present	68015-91-8	CCNC1=C(C=C(C=C1)[N+]#N)C.F[P-](F)(F)(F)(F)F	{1: 2, 2: 1, 34: 1, 14: 3, 16: 6, 31: 1}
Did not match all atoms present	68015-92-9	C1CCN(C1)C2=C(C=C(C=C2)[N+]#N)Cl.F[P-](F)(F)(F)(F)F	{33: 1, 34: 1, 11: 4, 14: 3, 16: 6, 17: 1}
Did not match all atoms present	68015-94-1	CCC(C)C1=C(C=C(C=C1)[N+](=O)[O-])COC	{1: 3, 2: 2, 3: 1, 38: 1, 14: 3, 22: 1}
Did not match all atoms present	68015-95-2	CCC(C)C1=C(C=C(C=C1)[N+](=O)[O-])CCl	{1: 2, 2: 2, 3: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	68015-97-4	CCOC1=CC(=C(C=C1[N+]#N)OCC)N(C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3.CCOC1=CC(=C(C=C1[N+]#N)OCC)N(C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3.[O-]S(=O)(=O)[O-]	{1: 4, 2: 4, 33: 2, 34: 2, 14: 24, 22: 4, 24: 4, 29: 4}
Did not match all atoms present	68015-98-5	CCOC1=C(C=C(C=C1)N)N.OS(=O)(=O)O	{1: 1, 2: 1, 14: 3, 20: 2, 22: 1, 29: 2, 30: 2}
Did not match all atoms present	68016-01-3	CCCCCCCCC=CCCCCCCCC1=[N+](CCN1CC)CCNC(=O)CCCCCCCC=CCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 32, 6: 4, 33: 2, 11: 2, 15: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	68016-03-5	[O-2].[Co+2].[Ni+2].[Mo]	{}
Did not match all atoms present	68016-04-6	CC(=O)NC1=C(C=C(C=C1S(=O)(=O)Cl)OC)OC	{1: 3, 14: 2, 17: 1, 22: 2, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68016-05-7	COC1=C(C=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4	{1: 1, 34: 1, 14: 13, 15: 2, 22: 1, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	68016-06-8	CC1=C(C=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4C	{1: 2, 34: 1, 14: 12, 15: 2, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	68016-08-0	C1=CC(=C[N+](=C1)CC(COC2=CC=C(C=C2)C(O)S(=O)(=O)[O-])O)C(=O)[O-].[Na+]	{33: 1, 2: 2, 3: 2, 14: 8, 20: 2, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	68016-17-1	C1=CC=C(C=C1)N.C(CCl)Cl	{17: 2, 2: 2, 30: 1, 14: 5}
Did not match all atoms present	68016-18-2	CC1=CC=CC=C1N.C(CCl)Cl	{1: 1, 2: 2, 30: 1, 14: 4, 17: 2}
Did not match all atoms present	68016-19-3	CC(CCl)Cl.C1=CC=C(C=C1)N	{1: 1, 2: 1, 3: 1, 14: 5, 17: 2, 30: 1}
Did not match all atoms present	68016-20-6	CC(=C)CC(C)(C)C.C1=CC=C(C=C1)O	{1: 4, 2: 1, 4: 1, 5: 1, 7: 1, 14: 5, 21: 1}
Did not match all atoms present	68025-13-8	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[NH4+].[Ni+2]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	68025-19-4	C1=CC(=CC=C1NNC(=S)N)S(=O)(=O)[O-].[K+]	{30: 1, 31: 2, 29: 3, 14: 4, 7: 1}
Did not match all atoms present	68025-23-0	CCCCS(=O)(=O)NC1=CC(=C(C=C1)OC)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 2: 3, 34: 1, 14: 3, 17: 3, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	68025-24-1	CC1=C(C=C(C=C1)[N+](=O)[O-])[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 38: 1, 14: 3, 17: 3}
Did not match all atoms present	68025-25-2	COC1=C(C=C(C=C1)Cl)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 22: 1, 14: 3, 17: 4}
Did not match all atoms present	68025-26-3	C1=CC(=C(C=C1Cl)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 5, 34: 1, 14: 3}
Did not match all atoms present	68025-27-4	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CCCS(=O)(=O)[O-])OCC	{1: 2, 2: 5, 33: 1, 6: 1, 7: 1, 14: 8, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	68025-29-6	C(CCCCCC(C(=O)[O-])C(=O)[O-])CCCCC(C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 4, 2: 10, 3: 2}
Did not match all atoms present	68025-39-8	[H+].C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[Co+2]	{33: 2, 2: 6, 29: 12}
Did not match all atoms present	68025-40-1	C(C(=O)O)N(COP(O)[O-])COP(O)[O-].N.N.N.[Ni+2]	{33: 1, 2: 3, 20: 2, 22: 2, 27: 1, 29: 2}
Did not match all atoms present	68025-42-3	C1=CC(=C(C=C1Cl)N/N=C/2\C=CC(=O)C=C2O)O.[Cu]	{34: 1, 14: 6, 15: 2, 17: 1, 20: 1, 21: 1, 25: 1, 31: 1}
Did not match all atoms present	68025-44-5	CN(C1CCCCC1)C2=CC(=C(C=C2)[N+]#N)Cl.CN(C1CCCCC1)C2=CC(=C(C=C2)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 2, 33: 2, 11: 10, 12: 2, 14: 6, 17: 6}
Did not match all atoms present	68025-46-7	CCCCN(CCCC)C1=C(C=C(C=C1)[N+]#N)Cl.CCCCN(CCCC)C1=C(C=C(C=C1)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 12, 33: 2, 34: 2, 14: 6, 17: 6}
Did not match all atoms present	68025-48-9	C1CCCN(CC1)C2=CC=C(C=C2)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 3, 34: 1, 11: 6, 14: 4, 33: 1}
Did not match all atoms present	68025-61-6	CC1=C(C=CC(=C1S(=O)(=O)[O-])N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])Cl.[Ca+2]	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68027-80-5	C1=CC=C(C=C1)C(=O)C2=NC=NC=C2	{24: 1, 35: 2, 14: 8}
Did not match all atoms present	68035-71-2	[H+].[H+].C1=CC=C2C(=C1)C3=NC4=C5C=CC(=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=C(C=CC=C9S(=O)(=O)[O-])C(=N8)N=C2[N-]3)S(=O)(=O)[O-].C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.[Cu+2]	{33: 2, 2: 12, 35: 8, 14: 14, 20: 6, 29: 6}
Did not match all atoms present	68037-31-0	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(=C/C(=O)[O-])\C(=O)O.[K+]	{24: 1, 1: 1, 2: 12, 27: 2, 6: 6}
Did not match all atoms present	68037-32-1	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(=C/C(=O)[O-])\C(=O)O.[Na+]	{24: 1, 1: 1, 2: 12, 27: 2, 6: 6}
Did not match all atoms present	68039-00-9	CC(C)CCCCCCCCCC1=C(C(=CC=C1)OC2=CC=CC=C2)CCCCCCCCCC(C)C	{1: 4, 2: 18, 3: 2, 22: 1, 14: 8}
Did not match all atoms present	68039-01-0	CC(C)CCCCCCCCCC1=CC(=CC=C1)OC2=CC=CC=C2	{1: 2, 2: 9, 3: 1, 22: 1, 14: 9}
Did not match all atoms present	68039-04-3	CCCCCCCCCCCCC1=C(C(=C(C=C1)S(=O)(=O)[O-])OC2=CC=CC=C2S(=O)(=O)[O-])CCCCCCCCCCCC.[NH4+].[NH4+]	{1: 2, 2: 22, 22: 1, 14: 6, 29: 6}
Did not match all atoms present	68039-05-4	CCCCCCCCCCCCC1=C(C(=C(C=C1)S(=O)(=O)OS(=O)(=O)O)OC2=CC=CC=C2)CCCCCCCCCCCC	{1: 2, 2: 22, 14: 7, 20: 1, 22: 2, 29: 4}
Did not match all atoms present	68039-07-6	CC\1=CC(=O)C=C/C1=N\NC2=C3C=CC(=CC3=C(C=C2)N=NC4=CC=CC=C4)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 3, 14: 13, 15: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68039-10-1	CCCCCCCC/C=C/C(CCCCCCC(=O)OCCCC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 16, 3: 1, 6: 2, 28: 1, 29: 3}
Did not match all atoms present	68039-14-5	CC1=CC(=C(C=C1S(=O)(=O)Cl)OC)NC(=O)C	{1: 3, 14: 2, 17: 1, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68039-17-8	CN(CCCN)CCCNC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 6, 38: 1, 33: 1, 14: 4, 30: 1, 31: 1}
Did not match all atoms present	68039-18-9	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[NH4+].[Mn+2]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	68039-19-0	C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)[O-])O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O)C)(C)C(=O)O.[K+]	{1: 7, 11: 9, 12: 14, 13: 6, 14: 1, 15: 1, 20: 5, 22: 2, 23: 2, 24: 1, 25: 1, 27: 2}
Did not match all atoms present	68039-20-3	C1=CC(=CN=C1)CCCS(=O)(=O)[O-].[Na+]	{2: 3, 35: 1, 29: 3, 14: 4}
Did not match all atoms present	68039-22-5	CC[N+](CC)(CC)CCCNC1=C2C(=C(C=C1)NCCC[N+](CC)(CC)CC)C(=O)C3=CC=CC=C3C2=O.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 6, 2: 12, 14: 6, 17: 4, 25: 2, 31: 2}
Did not match all atoms present	68039-23-6	CCCCCCCCCCCC1=[N+](CCN1CCO)CC(CS(=O)(=O)[O-])[O-].[Na+]	{1: 1, 2: 14, 3: 1, 33: 2, 11: 2, 15: 1, 20: 1, 29: 4}
Did not match all atoms present	68039-43-0	CC(C)(C)C1=CC(=CC(=C1)OC)C(C)(C)C	{1: 7, 4: 2, 22: 1, 14: 3}
Did not match all atoms present	68039-46-3	CC(C)C1=CN=CC(=N1)OC	{1: 3, 3: 1, 22: 1, 14: 2, 35: 2}
Did not match all atoms present	68039-50-9	CCC1=CN=C(C=N1)OC	{1: 2, 2: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	68039-52-1	C1=CC=C(C=C1)[NH2+]C2=CC=C(C=C2)C(=C3C=CC(=NC4=CC=CC=C4)C=C3)C5=CC=C(C=C5)N.[Cl-]	{34: 1, 7: 1, 14: 22, 15: 2, 17: 1, 30: 1}
Did not match all atoms present	68039-60-1	[H+].[H+].C1=CC2=C(C(=C(C=C2C=C1N)S(=O)(=O)[O-])N=NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)[O-])[O-])[O-].[Cu+2]	{34: 2, 2: 2, 14: 7, 22: 1, 29: 8, 30: 1}
Did not match all atoms present	68039-61-2	[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)[O-])[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)[O-].[Cu+2]	{34: 2, 2: 2, 14: 6, 22: 1, 29: 11, 30: 1}
Did not match all atoms present	68039-64-5	C1=CC=C2C(=C1)C(=CC(=C2[O-])N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N=NC5=C(C=C6C=C(C=CC6=C5[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{34: 4, 29: 9, 14: 15}
Did not match all atoms present	68039-66-7	CC(C)O.CC(C)O.C(CO)N.C(CO)N(CCO)CCO.[Ti]	{1: 4, 2: 8, 3: 2, 33: 1, 20: 6, 30: 1}
Did not match all atoms present	68039-67-8	CCCCN.CCC(C)(C)C1=CC2=CC=CC=C2C(=C1C(C)(C)CC)S(=O)(=O)O	{1: 7, 2: 5, 4: 2, 14: 5, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	6804-07-5	COC(=O)N=NC=C1C=[N+](C2=CC=CC=C2N1O)[O-]	{1: 1, 34: 2, 6: 1, 33: 2, 14: 5, 15: 1, 20: 1, 28: 1, 29: 1}
Did not match all atoms present	68041-18-9	C1=CC=C2C(=C1)C3=C4C(=C2COS(=O)(=O)[O-])C=CC5=CC=CC(=C54)C=C3.[Na+]	{2: 1, 22: 1, 14: 11, 29: 3}
Did not match all atoms present	68047-06-3	CC/C(=C(\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3	{1: 3, 2: 3, 33: 1, 7: 2, 14: 13, 21: 1, 22: 1}
Did not match all atoms present	68052-05-1	[O-]P(=O)([O-])[O-].[Mg+2].[Ca+2].[Zn+2]	{29: 4}
Did not match all atoms present	68052-06-2	[B-](F)(F)(F)F.CCN(CC)C1=C(C=C(C(=C1)OCC)[N+]#N)OCC	{1: 4, 2: 4, 33: 1, 34: 1, 14: 2, 16: 4, 22: 2}
Did not match all atoms present	68052-07-3	CCN(CC)C1=CC(=C(C=C1OCC)[N+](=O)[O-])OCC	{1: 4, 2: 4, 38: 1, 33: 1, 14: 2, 22: 2}
Did not match all atoms present	68052-08-4	CCOC1=CC(=C(C=C1N2CCCC2)OCC)N	{1: 2, 2: 2, 33: 1, 11: 4, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	68052-10-8	CCCCOC1=CC(=C(C=C1)OCCCC)Cl	{1: 2, 2: 6, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	68052-11-9	[B-](F)(F)(F)F.CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCCC2	{1: 2, 2: 2, 33: 1, 11: 4, 34: 1, 14: 2, 16: 4, 22: 2}
Did not match all atoms present	68052-12-0	CCN(C1=CC(=C(C=C1OCC)[N+](=O)[O-])OCC)C(=O)C	{1: 4, 2: 3, 38: 1, 33: 1, 14: 2, 22: 2, 24: 1}
Did not match all atoms present	68052-14-2	CCCCOC1=CC(=C(C=C1Cl)OCCCC)Cl	{1: 2, 2: 6, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	68052-15-3	CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C)N2CCCC2	{1: 2, 2: 1, 38: 1, 33: 1, 11: 4, 14: 2, 22: 1}
Did not match all atoms present	68052-18-6	COC1=CC(=C(C=C1N2CCOCC2)OC)N	{1: 2, 33: 1, 11: 4, 14: 2, 22: 2, 23: 1, 30: 1}
Did not match all atoms present	68052-19-7	CCOC1=C(C=CC(=C1)[N+](=O)[O-])N2CCCC2	{1: 1, 2: 1, 38: 1, 33: 1, 11: 4, 14: 3, 22: 1}
Did not match all atoms present	68052-22-2	CC1=CC(=CC=C1)N(C(C)CO)C(C)CO	{1: 3, 2: 2, 3: 2, 33: 1, 14: 4, 20: 2}
Did not match all atoms present	68052-36-8	CCN(CC)CCO.C1=CC=C(C=C1)C(=O)O	{1: 2, 2: 4, 33: 1, 14: 5, 20: 1, 27: 1}
Did not match all atoms present	68052-37-9	C1CCC(CC1)[NH2+]C2CCCCC2.C1CCC(CC1)[NH2+]C2CCCCC2.C1CCC(CC1)[NH2+]C2CCCCC2.[O-]P(=O)([O-])[O-]	{11: 30, 12: 6, 29: 4}
Did not match all atoms present	68052-43-7	C1=C(C=C(C=C1C(=O)N)O)C(=O)N	{24: 2, 30: 2, 21: 1, 14: 3}
Did not match all atoms present	68052-44-8	C1=CC=C2C(=C1)C(=CC(=C2O)N=O)N=O	{34: 2, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	68052-45-9	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(C)C	{1: 4, 34: 2, 38: 2, 33: 1, 14: 4, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	68052-46-0	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(C)CCC#N	{1: 3, 2: 2, 37: 1, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	68052-49-3	CCCC[N+](CC)(CCCC)CCCCCC[N+](CC)(CCCC)CCCC.CCOS(=O)(=O)[O-].CCOS(=O)(=O)[O-]	{1: 8, 2: 22, 29: 6, 22: 2}
Did not match all atoms present	68052-50-6	CCCC[N+](CC)(CCCC)CCCC.OS(=O)(=O)[O-]	{1: 4, 2: 10, 20: 1, 29: 3}
Did not match all atoms present	68052-51-7	CCCC[N+](CC)(CCCC)CCCC.CCOS(=O)(=O)[O-]	{1: 5, 2: 11, 29: 3, 22: 1}
Did not match all atoms present	68060-50-4	C1=CC=C(C=C1)C(CCl)N(C(=O)N(CNC(=O)N(CCCl)N=O)C2=CC=CC=C2)N=O	{33: 3, 2: 4, 3: 1, 34: 2, 14: 10, 17: 2, 24: 2, 29: 2, 31: 1}
Did not match all atoms present	68065-81-6	CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N	{1: 1, 2: 4, 37: 1, 11: 4, 12: 2, 14: 8}
Did not match all atoms present	6807-96-1	C1=COC2C1C3=C(O2)C=C4C(=C3O)C(=O)C5=C(C=C(C=C5C4=O)O)O	{25: 2, 12: 2, 21: 3, 14: 5, 23: 2}
Did not match all atoms present	68070-93-9	B(O)(O)O.CC(COCC(C)O)O	{1: 2, 2: 2, 3: 2, 20: 5, 22: 1}
Did not match all atoms present	68070-99-5	CCCCCCCCCCOCCO.OP(=O)(O)O.[K+]	{1: 1, 2: 11, 20: 4, 29: 1, 22: 1}
Did not match all atoms present	68071-22-7	CCCCCCCCCCCCCCCCCCOP(=O)([O-])[O-].CCCCCCCCCCCCCCCCCCOP(=O)([O-])[O-].CCCCCCCCCCCCCCCCCCOP(=O)([O-])[O-].[Al+3].[Al+3]	{1: 3, 2: 51, 29: 9, 22: 3}
Did not match all atoms present	68072-33-3	CC(C)CCCCCOCC(CS(=O)(=O)[O-])O.[Na+]	{1: 2, 2: 7, 3: 2, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	68072-51-5	CCN(CC)C1=CC=C(C=C1)C=C(C#N)C(=O)OCC[N+](C)(C)C.C1=CC=C(C=C1)C(=O)[O-]	{1: 5, 2: 4, 33: 1, 6: 1, 7: 1, 14: 9, 24: 1, 28: 1, 37: 1}
Did not match all atoms present	68072-52-6	CCCCCCCCCCCCCCCCCCOCN(COC)C1=NC(=NC(=N1)N(COC)COCCCCCCCCCCCCCCCCCC)N(COC)COCCCCCCCCCCCCCCCCCC	{1: 6, 2: 57, 35: 3, 22: 6, 33: 3}
Did not match all atoms present	68072-53-7	C1=CC(=C(C=C1NC2=NC(=NC(=N2)N(CCO)CCO)NC3=C(C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)N(CCO)CCO)NC6=C(C=C(C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 12, 20: 4, 29: 18, 31: 4}
Did not match all atoms present	68072-54-8	CCN1C2=CC(=C(C=C2N(C1=CC=CC3=[N+](C4=C(O3)C=C(C(=C4)C)C)CC)CC(=NS(=O)(=O)C)[O-])Cl)Cl	{1: 5, 2: 3, 33: 3, 6: 3, 7: 1, 34: 1, 14: 4, 15: 1, 17: 2, 23: 1, 29: 2}
Did not match all atoms present	68072-55-9	CC1=CC(NC(=S)N1C2=CC=C(C=C2)C(=O)O)(C)C	{32: 1, 1: 3, 33: 1, 13: 1, 14: 5, 15: 2, 27: 1}
Did not match all atoms present	68072-56-0	B(O)(O)O.C(=O)(N)N	{24: 1, 20: 3, 30: 2}
Did not match all atoms present	68077-26-9	CCN1C=C(C(=O)C2=CC(=C(C=C21)Cl)F)C(=O)O	{1: 1, 2: 1, 33: 1, 14: 3, 16: 1, 17: 1, 25: 1, 27: 1}
Did not match all atoms present	68081-73-2	[H+].C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Mg+2]	{24: 5, 33: 3, 2: 9}
Did not match all atoms present	68083-28-3	CC[N+]1=C(OC2=C1C=C(C=C2)S(=O)(=O)[O-])C=CN(C3=CC=CC=C3)C(=O)C	{1: 2, 2: 1, 6: 2, 33: 2, 14: 8, 23: 1, 24: 1, 29: 3}
Did not match all atoms present	68083-29-4	CCOC(=O)CCN(CCO)C1=C(C=CC(=C1)NC(=O)C)OC	{1: 3, 2: 5, 33: 1, 14: 3, 20: 1, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	68083-30-7	C1CSCC1S(=O)(=O)CCCS(=O)(=O)[O-].[K+]	{41: 1, 2: 3, 11: 3, 12: 1, 29: 5}
Did not match all atoms present	68083-31-8	COC1=CC=CC=C1C(O)S(=O)(=O)[O-].[Na+]	{1: 1, 3: 1, 14: 4, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	68083-32-9	C1OC2=C(O1)C=C(C=C2)C(O)S(=O)(=O)O.N	{3: 1, 11: 1, 14: 3, 20: 2, 23: 2, 29: 2}
Did not match all atoms present	68083-33-0	COC1=CC=C(C=C1)C(O)S(=O)(=O)O.N	{1: 1, 3: 1, 14: 4, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	68083-34-1	COC1=C(C=CC(=C1)C(O)S(=O)(=O)[O-])O.[NH4+]	{1: 1, 3: 1, 14: 3, 20: 1, 21: 1, 22: 1, 29: 3}
Did not match all atoms present	68083-35-2	C1=CC=C(C=C1)C2=NC=CN2CCC#N.C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O	{33: 1, 2: 2, 35: 1, 37: 1, 14: 10, 27: 3}
Did not match all atoms present	68083-36-3	C\1=CC(=O)/C(=N\[O-])/C(=O)/C1=N\O.[Na+]	{25: 2, 34: 2, 20: 1, 29: 1, 14: 2}
Did not match all atoms present	68083-38-5	CC1=NN(C(=N)C1)C2=CC(=CC=C2)S(=O)(=O)O	{1: 1, 35: 1, 36: 1, 33: 1, 11: 1, 14: 4, 15: 2, 20: 1, 29: 2}
Did not match all atoms present	68083-39-6	CC(C)C1=CC(=C(C(=C1N=C=NC2=C(C(=C(C=C2C(C)C)C(C)C)N=C=O)C(C)C)C(C)C)N=C=O)C(C)C	{1: 12, 34: 4, 3: 6, 8: 3, 14: 2, 29: 2}
Did not match all atoms present	68083-49-8	CCSC1=CC=CC(=C1)NC2=CC=CC=C2	{40: 1, 1: 1, 2: 1, 14: 9, 31: 1}
Did not match all atoms present	68083-52-3	CCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 6, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	68083-66-9	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C(=C/C(=O)O)\C(=O)O	{1: 2, 4: 1, 6: 2, 14: 8, 21: 2, 27: 2}
Did not match all atoms present	68083-86-3	[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[Si+4].[Si+4].[Si+4].[Ce+3].[Ce+3]	{16: 18}
Did not match all atoms present	68083-87-4	CC(C(=O)[O-])[O-].CC(C(=O)[O-])[O-].[Na+].[Sb+3]	{24: 2, 1: 2, 3: 2, 29: 2}
Did not match all atoms present	68083-97-6	CN(CCO)C1=CC=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)OC	{1: 2, 2: 2, 35: 1, 33: 1, 41: 1, 34: 2, 14: 7, 20: 1, 22: 1}
Did not match all atoms present	68083-99-8	C1COC(O1)(CCC(=O)OCCO)CC2=CC=CC=C2	{2: 5, 11: 2, 13: 1, 14: 5, 20: 1, 23: 2, 28: 1}
Did not match all atoms present	68084-01-5	C1=CC=C(C=C1)CC2=CC(=CO2)C(=O)OCCO	{28: 1, 2: 3, 20: 1, 14: 7, 23: 1}
Did not match all atoms present	68084-09-3	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C/5\C6=C(C=C(C=C6)S(=O)(=O)[O-])C=C(C5=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 13, 15: 4, 22: 2, 25: 2, 29: 12, 30: 1, 31: 2}
Did not match all atoms present	68084-13-9	C1=CC(=CC=C1NCS(=O)(=O)[O-])N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 1, 34: 2, 29: 9, 14: 9, 31: 1}
Did not match all atoms present	68084-14-0	C1=CC(=CC=C1NC(=O)C(=O)[O-])N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C5C=C(C=CC5=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 4, 14: 14, 24: 2, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	68084-15-1	COC1=C(C=C(C=C1)S(=O)(=O)[O-])N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)C(=NNC6=CC=CC=C6OC)C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 15, 15: 4, 22: 2, 24: 1, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	68084-16-2	CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O)OC)N	{1: 2, 34: 2, 14: 6, 20: 2, 21: 1, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	68084-17-3	CCOC(=O)CC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 28: 1, 38: 2, 14: 3}
Did not match all atoms present	68084-18-4	CCNC1=CC=C(C2=CC=CC=C21)N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 2, 34: 2, 14: 8, 18: 1, 31: 1}
Did not match all atoms present	68084-22-0	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)N)S(=O)(=O)[O-])OC)N/N=C\5/C6=C(C=C(C=C6)S(=O)(=O)[O-])C=C(C5=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 14, 15: 4, 22: 2, 25: 2, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	68084-23-1	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C(=CC4=CC(=CC(=C4C3=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\5/C=CC6=C(C5=O)C(=C(C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 12, 15: 3, 21: 1, 22: 2, 25: 2, 29: 12, 30: 1, 31: 2}
Did not match all atoms present	68084-24-2	C1=CC(=CC=C1NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)[N+](=O)[O-]	{34: 3, 38: 2, 14: 10, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	68084-25-3	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC5=CC=CC=C5)S(=O)(=O)[O-])OC)N/N=C\6/C7=C(C=C(C=C7)S(=O)(=O)[O-])C=C(C6=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 19, 15: 4, 22: 2, 25: 2, 29: 9, 31: 3}
Did not match all atoms present	68084-26-4	C1=CC=C(C=C1)CC(=O)C(C#N)C2=CC(=CC=C2)C(F)(F)F	{2: 1, 3: 1, 4: 1, 37: 1, 14: 9, 16: 3, 24: 1}
Did not match all atoms present	68084-27-5	C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.[K+]	{24: 1, 2: 1, 3: 5, 20: 6}
Did not match all atoms present	68084-29-7	C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)[O-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)[O-].C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)[O-].[Al+3]	{18: 15}
Did not match all atoms present	68084-30-0	C1=C(C=C(C(=C1Br)[O-])Br)Br.C1=C(C=C(C(=C1Br)[O-])Br)Br.C1=C(C=C(C(=C1Br)[O-])Br)Br.[Al+3]	{18: 9, 14: 6}
Did not match all atoms present	68084-31-1	C1(=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)[O-])C(=O)[O-].[Mg+2]	{24: 2, 18: 4}
Did not match all atoms present	68084-36-6	CC1=CSC(=CC=CC2=[N+](C(=CS2)C)CC3=CC=CC=C3)N1CC4=CC=CC=C4.[Br-]	{1: 2, 2: 2, 6: 3, 33: 2, 41: 2, 14: 12, 15: 2, 18: 1}
Did not match all atoms present	68084-37-7	COC1=CC2=CC(=C(C=C2C=C1)O)C(=O)NC3=C(C=C(C=C3)OC)OC	{1: 3, 14: 8, 21: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	68084-56-0	CCCCCCCCCCCCN(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)N(CCCCCCCCCCCC)C4=CC=CC=C4	{1: 2, 2: 23, 33: 2, 14: 18, 24: 2, 31: 2}
Did not match all atoms present	68084-62-8	CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 7, 5: 1, 6: 1, 33: 1, 16: 15, 28: 1, 29: 2}
Did not match all atoms present	68084-63-9	CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C)N2CCOCC2	{1: 2, 2: 1, 38: 1, 33: 1, 11: 4, 14: 2, 22: 1, 23: 1}
Did not match all atoms present	68085-85-8	CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(C(F)(F)F)Cl)C	{1: 2, 3: 1, 4: 1, 37: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 16: 3, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	6809-91-2	C1C(C2=CC=CC=C21)C#N	{11: 1, 12: 1, 37: 1, 14: 4}
Did not match all atoms present	6809-93-4	CCCCC(=O)C1CC2=CC=CC=C12	{1: 1, 2: 3, 11: 1, 12: 1, 14: 4, 24: 1}
Did not match all atoms present	6809-94-5	C1C(C2=CC=CC=C21)C(=O)C3=CC=CC=C3	{24: 1, 11: 1, 12: 1, 14: 9}
Did not match all atoms present	6809-95-6	C1C(C2=CC=CC=C21)C(=O)CC3=CC=CC=C3	{24: 1, 2: 1, 11: 1, 12: 1, 14: 9}
Did not match all atoms present	68090-88-0	CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)Cl)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 17: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	68092-43-3	C(CCCN)CCN.C(CCCN)CCN.C(=O)(NOP(=O)(O)O)NOP(=O)(O)O	{2: 12, 20: 4, 22: 2, 24: 1, 29: 2, 30: 4, 31: 2}
Did not match all atoms present	68092-50-2	CC1=CC(=[N+](C=C1)CC(=O)[O-])C	{24: 1, 1: 2, 2: 1, 14: 3, 33: 1}
Did not match all atoms present	68092-52-4	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-])C)N/N=C\5/C=CC(=O)C(=C5)C(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 14: 13, 15: 4, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	68092-64-8	COCCOCCOCCO.COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)COC	{1: 7, 2: 12, 35: 3, 33: 3, 20: 1, 22: 9}
Did not match all atoms present	68092-69-3	CCCCCC=CCC=CCCCCCCCCNC(=O)NC1=CC(=C(C=C1)C)NC(=O)NCCCCCCCCC=CCC=CCCCCC	{1: 3, 2: 26, 6: 8, 14: 3, 24: 2, 31: 4}
Did not match all atoms present	68092-70-6	CC1=CC2=C(C=C1)N3C(=N2)C4=C5C(=C(C=C4)SC6=CC=C(C=C6)Cl)C=CC=C5C3=O	{1: 1, 35: 1, 33: 1, 40: 1, 14: 12, 17: 1, 25: 1}
Did not match all atoms present	68092-71-7	C[Si](C)(CC(CCl)C1=CC=CC=C1)Cl	{1: 2, 2: 2, 3: 1, 14: 5, 17: 2}
Did not match all atoms present	68092-73-9	C1=CC(=CC(=C1)NC(=O)OCCOC(=O)NC2=CC=CC(=C2)CN=C=O)CN=C=O	{2: 4, 8: 2, 34: 2, 14: 8, 28: 2, 29: 2, 31: 2}
Did not match all atoms present	68092-74-0	CC(COCC(C)OC(=O)NC1=CC=CC(=C1)CN=C=O)OC(=O)NC2=CC=CC(=C2)CN=C=O	{1: 2, 2: 4, 3: 2, 8: 2, 34: 2, 14: 8, 22: 1, 28: 2, 29: 2, 31: 2}
Did not match all atoms present	681-06-1	COP(=S)(C)OC	{1: 3, 22: 2}
Did not match all atoms present	681-71-0	CSP(=O)(SC)SC	{40: 3, 1: 3, 29: 1}
Did not match all atoms present	681-84-5	CO[Si](OC)(OC)OC	{1: 4, 22: 4}
Did not match all atoms present	681-98-1	CC(C)CO[Si](OCC(C)C)(OCC(C)C)OCC(C)C	{1: 8, 2: 4, 3: 4, 22: 4}
Did not match all atoms present	681-99-2	CCCC[Sn](CCCC)(CCCC)N=C=O	{8: 1, 1: 3, 2: 9, 34: 1, 29: 1}
Did not match all atoms present	6810-26-0	C1=CC=C(C=C1)C2=CC=C(C=C2)NO	{20: 1, 14: 9, 31: 1}
Did not match all atoms present	68109-57-9	CCC(C)OC(C(=O)C1=CC=CC=C1)OC(C)CC	{1: 4, 2: 2, 3: 3, 14: 5, 22: 2, 24: 1}
Did not match all atoms present	68109-58-0	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])C)NN=C5C=CC(=O)C=C5.[Na+].[Na+]	{1: 2, 34: 2, 14: 14, 15: 3, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68109-59-1	CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Fe+3]	{24: 1, 1: 1, 2: 12, 6: 4}
Did not match all atoms present	68109-68-2	CC1=C(C=CC(=C1)N)N=NC2=CC=CC3=CC(=CC(=C32)S(=O)(=O)[O-])S(=O)(=O)O.[Na+]	{1: 1, 34: 2, 14: 8, 20: 1, 29: 5, 30: 1}
Did not match all atoms present	68109-69-3	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	68109-70-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C2=CC=CC=C2OC1=CC=CC=CC3=[N+](C4=CC=CC=C4O3)C	{1: 3, 6: 5, 33: 2, 14: 12, 15: 1, 23: 2, 29: 3}
Did not match all atoms present	68109-72-8	CCNCC.OP(=O)(O)O	{1: 2, 2: 2, 20: 3, 29: 1, 31: 1}
Did not match all atoms present	68109-78-4	C1=CC=C(C(=C1)N/N=C/2\C=CC(=C3C2=CC(=O)C=C3)N)Cl	{34: 1, 14: 9, 15: 4, 17: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	68109-79-5	C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N.C(=O)O.C(=O)O	{34: 2, 26: 2, 27: 2, 30: 2, 14: 8}
Did not match all atoms present	68109-81-9	CC(C)CCCCCCCOCC(C[N+](C)(C)CC1=CC=CC=C1)O.[Cl-]	{1: 4, 2: 10, 3: 2, 14: 5, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	68109-83-1	B(O)(O)O.C(CN)N.C(CN)N	{2: 4, 20: 3, 30: 4}
Did not match all atoms present	68109-84-2	CCCCC(CC)COC(=O)CCSC(C1=CC=CC=C1)SCCC(=O)O	{1: 2, 2: 9, 3: 2, 40: 2, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	68109-86-4	CCCC[Sn](OC(=O)/C=C/C(=O)O[Sn](OC(=O)/C=C/C(=O)OC1CCCCC1)(CCCC)CCCC)(OC(=O)/C=C/C(=O)OC2CCCCC2)CCCC	{1: 4, 2: 12, 6: 6, 11: 10, 12: 2, 28: 6}
Did not match all atoms present	68109-87-5	CCCC[Sn](OC(=O)/C=C/C(=O)O[Sn](OC(=O)/C=C/C(=O)OCC1=CC=CC=C1)(CCCC)CCCC)(OC(=O)/C=C/C(=O)OCC2=CC=CC=C2)CCCC	{1: 4, 2: 14, 28: 6, 14: 10, 6: 6}
Did not match all atoms present	68109-88-6	CCCCCCCC[Sn](CCCCCCCC)(OC(=O)C=CC(=O)OCC)OC(=O)C=CC(=O)OCC	{1: 4, 2: 16, 28: 4, 6: 4}
Did not match all atoms present	68109-91-1	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C(=CC(=C3C2=O)Br)S(=O)(=O)[O-])N.[K+].[K+]	{25: 2, 18: 1, 30: 1, 29: 6, 14: 4}
Did not match all atoms present	68109-92-2	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C=C(C(=C3C2=O)N)S(=O)(=O)[O-])Br.[K+].[K+]	{25: 2, 18: 1, 30: 1, 29: 6, 14: 4}
Did not match all atoms present	68109-93-3	C1=CC2=C3C(=CC=C4C3=C1C(=C(C4=O)Br)O)C(=C(C2=O)Br)O	{25: 2, 18: 2, 21: 2, 14: 4}
Did not match all atoms present	68109-96-6	CCCCCCCC/C=C/CCCCCCCC(=O)NCCN(CC)CCO.CCOS(=O)(=O)O	{1: 3, 2: 20, 6: 2, 33: 1, 20: 2, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68109-98-8	CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCNCCC#N.CCOS(=O)(=O)[O-]	{1: 3, 2: 26, 37: 2, 22: 1, 24: 1, 29: 3, 31: 2}
Did not match all atoms present	68110-11-2	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C#C	{1: 5, 2: 1, 4: 2, 9: 2, 14: 4, 21: 1}
Did not match all atoms present	68110-18-9	C1=CC=C(C(=C1)N=NC2=C(C=C3C=C(C=CC3=C2[O-])NC(=O)NC4=CC5=CC(=C(C(=C5C=C4)[O-])N=NC6=C(C=CC(=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{24: 1, 34: 4, 29: 9, 14: 15, 31: 2}
Did not match all atoms present	68110-25-8	C1=CC(=CC(=C1)P(=O)([O-])[O-])N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=C(C=CC(=C4)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 3, 14: 9, 15: 2, 20: 2, 25: 1, 29: 13, 30: 1, 31: 1}
Did not match all atoms present	68110-26-9	COC1=C(C=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC(=C(C=C4OC)Cl)OC	{1: 3, 34: 1, 14: 10, 15: 2, 17: 1, 22: 3, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	68110-27-0	CCN1C(=O)C(=C(/C(=N/NC2=C(C=C(C(=C2)NC3=NC(=NC(=N3)NC4=CC(=C(C=C4)S(=O)(=O)[O-])NC5=NC(=NC(=N5)N)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])/C1=O)C)C(=O)N.[Na+].[Na+].[Na+]	{1: 2, 2: 1, 35: 6, 33: 1, 34: 1, 14: 5, 15: 3, 17: 2, 24: 1, 25: 2, 29: 9, 30: 2, 31: 4}
Did not match all atoms present	68110-28-1	CCCCCCCC/C=C\CCCCCCCCNC1=C(C=C(C=C1)OC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 15, 6: 2, 14: 3, 22: 1, 29: 3, 31: 1}
Did not match all atoms present	68110-32-7	CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O.C(CO)N	{1: 1, 2: 13, 14: 4, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	68110-36-1	CC1=CC=CC=C1C=C.C1C=CC2=CC=CC=C21	{1: 1, 14: 10, 11: 1, 5: 1, 6: 1}
Did not match all atoms present	68110-41-8	CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.[Na+]	{1: 4, 2: 10, 3: 2, 29: 2, 22: 2}
Did not match all atoms present	68110-42-9	CC(C)CCCCCOP(=O)([O-])[O-].[Na+].[Na+]	{1: 2, 2: 5, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	68120-86-5	CC(=C=CP(=O)(C)C)C	{8: 1, 1: 4, 29: 1, 6: 1, 7: 1}
Did not match all atoms present	68123-00-2	CCCCCCCCCCCCCOP(OCCCCCCCCCCCCC)OC1=CC=CC=C1	{1: 2, 2: 24, 22: 3, 14: 5}
Did not match all atoms present	68123-01-3	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=[N+](N2CC3=CC=CC=C3)CCO.[Cl-]	{1: 2, 2: 5, 33: 3, 34: 2, 14: 11, 17: 1, 20: 1}
Did not match all atoms present	68123-02-4	CCCCCCCCCCCCCCCCCCOP(OCCCCCCCCCCCCCCCCCC)OC1=CC=CC=C1	{1: 2, 2: 34, 22: 3, 14: 5}
Did not match all atoms present	68123-07-9	CCCCCCCCCCCCCOCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 15, 22: 1, 17: 1}
Did not match all atoms present	68123-08-0	CCCCCCCCOCCC[N+](C)(C)C.[Cl-]	{1: 4, 2: 10, 22: 1, 17: 1}
Did not match all atoms present	68123-09-1	CCCCCCC(=NC1=CC=C(C=C1)N=C(C)CCCCCC)C	{1: 4, 2: 10, 34: 2, 14: 4, 7: 2}
Did not match all atoms present	68123-12-6	CCN(CC)C1=CC=C(C=C1)C2=CC=C(C=C2)C=C3C=CC(=[N+](CC)CC)C=C3.C1=CC=C(C=C1)C(=O)[O-]	{1: 4, 2: 4, 6: 1, 33: 2, 14: 17, 15: 2, 24: 1}
Did not match all atoms present	68123-13-7	C[N+](C)(C)C1=CC=CC(=C1)NC2=CC(=C3C(=C(C=C(C3=O)Br)N)C2=O)N.[Cl-]	{1: 3, 14: 6, 15: 6, 17: 1, 18: 1, 25: 2, 30: 2, 31: 1}
Did not match all atoms present	68123-15-9	CCCCCCCCCCCCS.C=CC=C.C=CC1=CC=CC=C1	{1: 1, 2: 11, 5: 3, 6: 3, 39: 1, 14: 5}
Did not match all atoms present	68123-30-8	C1COC2=C1C=C3C=CC(=O)OC3=C2O	{11: 2, 28: 1, 21: 1, 14: 3, 23: 1}
Did not match all atoms present	68123-31-9	CC(=O)OC1=C(C2=C(C=C1)C(=CO2)OC(=O)C)OC(=O)C	{1: 3, 28: 3, 14: 3, 23: 1}
Did not match all atoms present	68123-33-1	C1CC(=O)N(C1=O)OC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]	{33: 1, 2: 1, 38: 1, 11: 2, 14: 4, 25: 2, 28: 1}
Did not match all atoms present	68123-36-4	CCN(CC)CCCN1C(=NC2=C1C=CC(=C2)Cl)C	{1: 3, 2: 5, 35: 1, 33: 2, 14: 3, 17: 1}
Did not match all atoms present	68123-40-0	CCCCCCCCCCCCCCCCCC(=O)N[N+](C)(C)CC=C.[Cl-]	{1: 3, 2: 17, 5: 1, 6: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	68123-41-1	C1=CC=C(C=C1)NC=CC2=[N+](C3=CC=CC=C3O2)CCC(=O)O.[Br-]	{33: 1, 2: 2, 6: 2, 14: 9, 18: 1, 23: 1, 27: 1, 31: 1}
Did not match all atoms present	68123-42-2	CC1=[N+](C2=CC=CC=C2O1)CCC(=O)O.[Br-]	{1: 1, 2: 2, 33: 1, 14: 4, 18: 1, 23: 1, 27: 1}
Did not match all atoms present	68123-43-3	C[C@H]([C@@H](C1=CC=CC=C1)O)N.C(=O)O	{1: 1, 3: 2, 14: 5, 20: 1, 26: 1, 27: 1, 30: 1}
Did not match all atoms present	68123-44-4	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-].[Mg+2].[Mg+2]	{24: 5, 14: 6}
Did not match all atoms present	68123-46-6	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-].[Cs+].[Cs+].[Cs+].[Cs+]	{24: 5, 14: 6}
Did not match all atoms present	68123-47-7	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-].[Rb+].[Rb+].[Rb+].[Rb+]	{24: 5, 14: 6}
Did not match all atoms present	68123-48-8	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 5, 14: 6}
Did not match all atoms present	68128-59-6	CCCCCCCCCCCCCCCCCCNC(=O)CC(C(=O)O)S(=O)(=O)O.N.N	{1: 1, 2: 18, 3: 1, 20: 1, 24: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	6813-38-3	C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O	{35: 2, 27: 2, 14: 6}
Did not match all atoms present	6813-90-7	C1C(C2=CC=CC=C21)/C(=N\O)/CC3=CC=CC=C3	{2: 1, 7: 1, 11: 1, 12: 1, 34: 1, 14: 9, 20: 1}
Did not match all atoms present	6813-91-8	C/C(=N\OC)/C1CC2=CC=CC=C12	{1: 2, 34: 1, 7: 1, 11: 1, 12: 1, 14: 4, 22: 1}
Did not match all atoms present	6813-92-9	CC(CO/N=C(\C)/C1CC2=CC=CC=C12)O	{1: 2, 2: 1, 3: 1, 7: 1, 11: 1, 12: 1, 34: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	6813-93-0	C/C(=N\OC(=O)C)/C1CC2=CC=CC=C12	{1: 2, 34: 1, 7: 1, 11: 1, 12: 1, 14: 4, 28: 1}
Did not match all atoms present	6813-95-2	C/C(=N\OCC=C)/C1CC2=CC=CC=C12	{1: 1, 2: 1, 5: 1, 6: 1, 7: 1, 11: 1, 12: 1, 34: 1, 14: 4, 22: 1}
Did not match all atoms present	68130-18-7	[OH-].[OH-].[OH-].[OH-].[OH-].[O-2].[O-2].[O-2].[O-2].[O-2].[O-]P(=O)([O-])[O-].[V].[V].[V].[V].[V].[V]	{29: 4}
Did not match all atoms present	68130-22-3	B(O)(O)O.COCCO	{1: 1, 2: 2, 20: 4, 22: 1}
Did not match all atoms present	68130-36-9	[OH-].[O-2].[O-]P(=O)([O-])[O-].[Ni+2].[Mo]	{29: 4}
Did not match all atoms present	68130-38-1	[NH4+].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Na+].[Na+].[Na+].[V].[V].[V].[V].[V].[V].[V].[V]	{}
Did not match all atoms present	68130-49-4	CCCC[C@@H](CC)COC(=O)C1=CC=CC=C1C(=O)OC2CCCCC2	{1: 2, 2: 5, 3: 1, 11: 5, 12: 1, 14: 4, 28: 2}
Did not match all atoms present	68130-76-7	CC(C)(C)C1=CC=C(C=C1)O.C=O	{1: 3, 4: 1, 5: 1, 14: 4, 21: 1}
Did not match all atoms present	68130-77-8	CCCCCCCCCC1=CC=CC=C1O.C(CNCCN)N	{1: 1, 2: 12, 14: 4, 21: 1, 30: 2, 31: 1}
Did not match all atoms present	68130-83-6	C=O.C1=CC=C(C=C1)O	{5: 1, 14: 5, 21: 1}
Did not match all atoms present	68130-85-8	C1C(O1)COCCCCOCC2CO2.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N	{2: 7, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2, 30: 2}
Did not match all atoms present	68130-96-1	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C1CN(C=N1)CCN	{1: 2, 2: 24, 35: 1, 33: 1, 11: 2, 14: 9, 20: 2, 29: 4, 30: 1}
Did not match all atoms present	68132-81-0	CC(C)CC1=C(C(=CC=C1)OCCOCCOCCS(=O)(=O)[O-])CC(C)C.[Na+]	{1: 4, 2: 8, 3: 2, 14: 3, 22: 3, 29: 3}
Did not match all atoms present	68132-84-3	CCCC(C)C1=C(C=CC=C1O)CN(C)CCS(=O)(=O)[O-].[Na+]	{1: 3, 2: 5, 3: 1, 33: 1, 14: 3, 21: 1, 29: 3}
Did not match all atoms present	68132-90-1	C.CN(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C=C3C=CC(=[N+](C)C)C=C3.CN(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C=C3C=CC(=[N+](C)C)C=C3.CN(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C=C3C=CC(=[N+](C)C)C=C3	{1: 12, 33: 6, 14: 36, 6: 3, 15: 6}
Did not match all atoms present	68132-92-3	[H+].COC1=NC(=NC(=N1)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=C3[O-])N=NC4=C(C=CC(=C4)[N+](=O)[O-])[O-])S(=O)(=O)[O-])Cl.COC1=NC(=NC(=N1)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=C3[O-])N=NC4=C(C=CC(=C4)[N+](=O)[O-])[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+].[Cr+3]	{1: 2, 34: 4, 35: 6, 38: 2, 14: 12, 17: 2, 22: 2, 29: 12, 31: 2}
Did not match all atoms present	68132-93-4	[H+].COC1=NC(=NC(=N1)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=C3[O-])N=NC4=C(C=CC(=C4)[N+](=O)[O-])[O-])S(=O)(=O)[O-])Cl.COC1=NC(=NC(=N1)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=C3[O-])N=NC4=C(C=CC(=C4)[N+](=O)[O-])[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+].[Co+3]	{1: 2, 34: 4, 35: 6, 38: 2, 14: 12, 17: 2, 22: 2, 29: 12, 31: 2}
Did not match all atoms present	68133-02-8	C1=CC=C2C(=C1)C=C(C(=N2)C3C(=O)C4=CC5=C(C=CC(=C5C=C4C3=O)Br)Br)O	{35: 1, 12: 1, 14: 9, 18: 2, 21: 1, 25: 2}
Did not match all atoms present	68133-04-0	CCCCCCCC[Sn](OC(=O)/C=C\C(=O)O[Sn](OC(=O)/C=C\C(=O)OCC1=CC=CC=C1)(CCCCCCCC)CCCCCCCC)(OC(=O)/C=C\C(=O)OCC2=CC=CC=C2)CCCCCCCC	{1: 4, 2: 30, 28: 6, 14: 10, 6: 6}
Did not match all atoms present	68133-05-1	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)O	{34: 1, 14: 12, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	68133-14-2	CCOP(=O)(CN(CCOC(=O)NC1=CC=CC(=C1)CN=C=O)CCOC(=O)NC2=CC=CC(=C2)CN=C=O)OCC	{1: 2, 2: 9, 33: 1, 8: 2, 34: 2, 14: 8, 22: 2, 28: 2, 29: 3, 31: 2}
Did not match all atoms present	68133-15-3	C=O.C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{5: 1, 14: 6, 29: 6}
Did not match all atoms present	68133-17-5	C=O.C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])S(=O)(=O)[O-].[NH4+].[NH4+]	{5: 1, 14: 6, 29: 6}
Did not match all atoms present	68133-23-3	C1=CC(=CC(=C1)P(=O)(O)O)NC2=NC(=NC(=N2)Cl)NC3=C(C=C(C(=C3)S(=O)(=O)[O-])NC4=C(C5=C(C=C4)N=C6C(=C(C7=NC8=C(C(=C(C=C8)NC9=CC(=C(C=C9S(=O)(=O)[O-])NC1=NC(=NC(=N1)NC1=CC(=CC=C1)P(=O)(O)O)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])OC7=C6Cl)Cl)O5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{35: 8, 14: 16, 17: 4, 20: 4, 23: 2, 29: 20, 31: 6}
Did not match all atoms present	68133-25-5	COCCOC(=O)CCNC1=C(C=CC(=C1)[N+](=O)[O-])OC	{1: 2, 2: 4, 38: 1, 14: 3, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	68133-26-6	COCCOC(=O)CCNC1=C(C=CC(=C1)N)OC	{1: 2, 2: 4, 14: 3, 22: 2, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	68133-27-7	CNC1=CC2=C(C=C1)C=C(/C(=N/NC3=C(C=C(C=C3)OC)S(=O)(=O)O)/C2=O)S(=O)(=O)O	{1: 2, 34: 1, 14: 7, 15: 2, 20: 2, 22: 1, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	68133-28-8	CC(=O)CNC1=CC2=C(C=C1)C=C(/C(=N/NC3=CC(=CC=C3)P(=O)(O)O)/C2=O)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 34: 1, 14: 8, 15: 2, 20: 2, 24: 1, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	68133-30-2	C1=CC(=CC=C1C(=O)[O-])NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N/N=C/4\C(=CC5=CC(=C(C(=C5C4=O)N)N=NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 3, 35: 3, 14: 12, 15: 2, 17: 1, 20: 1, 24: 1, 25: 1, 29: 14, 30: 1, 31: 3}
Did not match all atoms present	68133-31-3	CCN(C1=C(C=C(C=C1)S(=O)(=O)[O-])C(=O)[O-])N=NC2=C(C=C(C=C2)Cl)Cl.[Na+].[Na+]	{1: 1, 2: 1, 33: 1, 34: 2, 14: 6, 17: 2, 24: 1, 29: 3}
Did not match all atoms present	68133-32-4	CN(C1=CC(=C(C=C1)C2=C(C=C(C=C2)N(C)N=NCCS(=O)(=O)[O-])OC)OC)N=NCCS(=O)(=O)[O-].[Na+].[Na+]	{1: 4, 2: 4, 33: 2, 34: 4, 14: 6, 22: 2, 29: 6}
Did not match all atoms present	68133-33-5	CN(C1=C(C=C(C=C1)C2=CC(=C(C=C2)N(C)N=NCCS(=O)(=O)[O-])Cl)Cl)N=NCCS(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 4, 33: 2, 34: 4, 14: 6, 17: 2, 29: 6}
Did not match all atoms present	68133-34-6	CCCCCCCCCCCCCCCCCC(=O)NCC[NH+](CC)CC.OP(=O)(O)[O-]	{1: 3, 2: 20, 20: 2, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68133-35-7	C1=CC=C(C(=C1)C(=O)O)NN=C2C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)O	{34: 1, 14: 8, 15: 2, 20: 1, 25: 1, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	68133-39-1	CCN(CC(CCl)O)C1=CC=CC(=C1)C.Cl	{1: 2, 2: 3, 3: 1, 33: 1, 14: 4, 17: 2, 20: 1}
Did not match all atoms present	68133-42-6	COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)N/N=C\3/C4=CC=CC=C4C=C(C3=O)C(=O)NC5=C(C=CC(=C5)Cl)Cl	{1: 1, 34: 1, 14: 16, 15: 2, 17: 2, 22: 1, 24: 2, 25: 1, 31: 3}
Did not match all atoms present	68133-43-7	CCCCOCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 5, 29: 3, 22: 2}
Did not match all atoms present	68133-59-5	C(CO)[NH-].[Pt]	{36: 1, 2: 2, 20: 1}
Did not match all atoms present	68133-61-9	CCN1C2=C(C=C(C(=C2)C)C)OC1=CC=C3C(=O)N(C(=S)S3)CC(=O)O	{1: 3, 2: 2, 6: 2, 33: 2, 41: 1, 14: 2, 15: 3, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	68133-70-0	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NCCO	{2: 2, 14: 9, 20: 1, 21: 2, 25: 2, 31: 2}
Did not match all atoms present	68133-81-3	CC1=C(C=C(C=C1)S(=O)(=O)[O-])NC2=NC(=NC(=N2)NC3=C(C4=CC(=C(C(=C4C=C3)[O-])N=NC5=C(C=C(C(=C5)C)N=NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{1: 2, 34: 4, 35: 3, 14: 11, 17: 1, 29: 15, 31: 2}
Did not match all atoms present	68133-83-5	[N-]=O.[Ru](I)(I)I	{19: 3, 29: 1}
Did not match all atoms present	68133-85-7	C(C(=O)[O-])O/C=C(\N)/[O-].[Co+2]	{2: 1, 6: 1, 7: 1, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	68133-86-8	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Na+].[Na+].[Na+].[Na+].[Au+]	{}
Did not match all atoms present	68133-87-9	[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[K+].[K+].[K+].[K+].[Au+]	{}
Did not match all atoms present	68133-88-0	[NH4+].[NH4+].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Ru+3]	{17: 5}
Did not match all atoms present	68133-89-1	C(CN)N.C(CN)N.C(CN)N.[N+](=O)([O-])[O-].[Pt+4]	{2: 6, 30: 6}
Did not match all atoms present	68133-90-4	[H+].[H+].C(CO)N.C(CO)N.[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Pt+4]	{2: 4, 20: 2, 30: 2}
Did not match all atoms present	68133-91-5	C[N+](C)(C)C.C[N+](C)(C)C.[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Pt+4]	{1: 8}
Did not match all atoms present	68133-93-7	C1CCN(CC1)CN2CCCCC2.C(=S)=S	{8: 1, 33: 2, 2: 1, 11: 10}
Did not match all atoms present	68133-98-2	CCCNCC1=CC=C(C=C1)[N+](=O)[O-].Cl	{1: 1, 2: 3, 38: 1, 14: 4, 17: 1, 31: 1}
Did not match all atoms present	68134-01-0	C(C(=O)O)C(CC(=O)[O-])(C(=O)[O-])O.N.[Zn+2]	{24: 2, 20: 1, 2: 2, 27: 1, 4: 1}
Did not match all atoms present	68134-04-3	C1=CC=C(C=C1)CN(CCC(=O)N)C2=NC(=NC(=N2)NC3=C(C=CC(=C3)S(=O)(=O)O)S(=O)(=O)[O-])NC4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)NC6=NC(=NC(=N6)N(CCC(=O)N)CC7=CC=CC=C7)NC8=C(C=CC(=C8)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 6, 35: 6, 6: 2, 14: 22, 20: 1, 24: 2, 29: 17, 30: 2, 31: 4}
Did not match all atoms present	68134-08-7	CC(CNC1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)NCC(C)O)S(=O)(=O)O)S(=O)(=O)O)NC6=CC=CC=C6)O	{1: 2, 2: 2, 3: 2, 6: 2, 14: 16, 35: 6, 20: 4, 29: 4, 31: 6}
Did not match all atoms present	68134-09-8	CCCCCCCCCCCCCCCCCC(=O)NCC[N+](C)(C)CCO.COS(=O)(=O)[O-]	{1: 4, 2: 20, 20: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	68134-11-2	CCCCCCCCC=CCCCCCCCC(=O)NCC[N+](C)(C)CCO.COS(=O)(=O)[O-]	{1: 4, 2: 18, 6: 2, 20: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	68134-13-4	CCCCCCCCCCCCCCCCCC(=O)NCCNCCO.OP(=O)(O)O	{1: 1, 2: 20, 20: 4, 24: 1, 29: 1, 31: 2}
Did not match all atoms present	68134-14-5	CCCCCCCCCCCCCCCCCC1=[N+](CCN1)CCO.OP(=O)(O)[O-]	{32: 1, 1: 1, 2: 18, 33: 1, 11: 2, 15: 1, 20: 3, 29: 2}
Did not match all atoms present	68134-16-7	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=CC=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)/C2=O)S(=O)(=O)O	{1: 1, 2: 2, 34: 1, 14: 7, 15: 2, 20: 3, 22: 1, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	68134-17-8	CCCCCCCCCC(CCCCCCCC(=O)N(C)C1=CC=CC=C1)OS(=O)(=O)[O-].[Na+]	{1: 2, 2: 15, 3: 1, 33: 1, 14: 5, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	68134-18-9	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)S(=O)(=O)O)C3=CC(=CC=C3)N/N=C/4\C(=O)C=C/C(=N\NC5=C6C(=CC(=C5)S(=O)(=O)O)C=C(/C(=N\NC7=CC=CC=C7)/C6=O)S(=O)(=O)O)/C4=O	{1: 1, 34: 5, 35: 1, 33: 1, 12: 1, 14: 18, 15: 3, 20: 3, 25: 4, 29: 6, 31: 3}
Did not match all atoms present	68134-19-0	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)NNC3=CC(=NC4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)C=CC3=O	{34: 1, 38: 2, 14: 13, 15: 2, 20: 2, 25: 1, 29: 4, 31: 3}
Did not match all atoms present	68134-20-3	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)N=NC3=C(C=C(C=C3)NC4=CC(=C(C=C4)N=NC5=C(C=C6C=C(C(=C(C6=C5N)O)N=NC7=C(C=C(C=C7)[N+](=O)[O-])Cl)S(=O)(=O)O)S(=O)(=O)O)O)O	{34: 6, 38: 2, 14: 18, 17: 1, 20: 3, 21: 3, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	68134-21-4	COC1=CC=C(C=C1)N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)O)S(=O)(=O)O)N=NC4=C(C=C(C=C4)NC5=CC(=C(C=C5)N=NC6=CC=C(C=C6)NC7=C(C=C(C=C7)[N+](=O)[O-])S(=O)(=O)[O-])O)O)O	{1: 1, 34: 6, 38: 1, 14: 20, 20: 2, 21: 3, 22: 1, 29: 7, 31: 2}
Did not match all atoms present	68134-25-8	CC1=C(C(=C(C=C1)O)N)C	{1: 2, 30: 1, 21: 1, 14: 2}
Did not match all atoms present	68134-31-6	B1(OC(C(O1)C(C(C(C(=O)[O-])[O-])O)O)CO)O.[Na+].[Na+]	{2: 1, 3: 3, 12: 2, 20: 4, 23: 2, 24: 1, 29: 1}
Did not match all atoms present	68134-32-7	CCN(CCOCC)C1=CC=C(C=C1)C2=[N+](C3=CC=CC4=C3C2=CC=C4)CCC#N.[Cl-]	{1: 2, 2: 6, 37: 1, 33: 2, 14: 10, 15: 1, 17: 1, 22: 1}
Did not match all atoms present	68134-33-8	CC[N+]1=C(SC2=C1C=CC(=C2)OCC)N=NC3=CC=C(C=C3)N(CC)CC.[Cl-]	{1: 4, 2: 4, 33: 2, 41: 1, 34: 2, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	68134-34-9	CCN(CC)C1=CC2=[N+](C3=C(C=CC(=C3)N=NC4=CC=C(C=C4)N(CC)CCC#N)N=C2C=C1)C5=CC=CC=C5.[Cl-]	{1: 3, 2: 5, 35: 1, 37: 1, 33: 3, 34: 2, 14: 15, 17: 1}
Did not match all atoms present	68134-35-0	CC(=NN(C)C1=CC=CC=C1)C2=[N+](C3=CC=CC=C3C2(C)C)C.[Cl-]	{1: 5, 34: 1, 33: 2, 7: 1, 13: 1, 14: 9, 15: 1, 17: 1}
Did not match all atoms present	68134-36-1	CC1(C2=C(C=CC(=C2)Cl)[N+](=C1C=CC3=CC=C(C=C3)N(C)CCO)C)C.[Cl-]	{1: 4, 2: 2, 6: 2, 33: 2, 13: 1, 14: 7, 15: 1, 17: 2, 20: 1}
Did not match all atoms present	68134-37-2	CC1(C2=CC=CC=C2[N+](=C1C=NN(C)C3=CC=C(C=C3)OC4=CC=CC=C4)C)C.[Cl-]	{1: 4, 34: 1, 6: 1, 33: 2, 13: 1, 14: 13, 15: 1, 17: 1, 22: 1}
Did not match all atoms present	68134-39-4	CCC(=O)NC1=C(C=CC(=C1)N(C)C)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])I	{1: 3, 2: 1, 37: 1, 38: 1, 33: 1, 34: 2, 14: 5, 19: 1, 24: 1, 31: 1}
Did not match all atoms present	68134-40-7	CCOC(=O)CCN(CCC(=O)OCC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C	{1: 3, 2: 6, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	68134-42-9	C=O.C(C(CO)(CO)N)O	{20: 3, 2: 3, 4: 1, 5: 1, 30: 1}
Did not match all atoms present	68134-45-2	C=O.C1=CC=C(C=C1)O.C(=C/C(=O)O)\C(=O)O	{14: 5, 27: 2, 5: 1, 6: 2, 21: 1}
Did not match all atoms present	68134-48-5	CC1=CC(=CC=C1)O.C=O.C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 29: 6, 5: 1, 14: 10, 21: 1}
Did not match all atoms present	68134-59-8	C(=O)[O-].[Ni+2].[Cu+2]	{26: 1}
Did not match all atoms present	68134-60-1	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC6=C5C=CC=C6NCC7=CC=CC=C7	{1: 2, 2: 3, 33: 1, 13: 1, 14: 17, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	68134-61-2	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)NC6=CC=CC(=C6)C(F)(F)F	{1: 2, 2: 2, 4: 1, 33: 1, 13: 1, 14: 14, 16: 3, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	6814-58-0	CC1=C(C(=NN1)Cl)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 17: 1}
Did not match all atoms present	68140-26-1	C[Si](C)(C)N1C(=O)N(N=N1)C2=CC=CC=C2	{1: 3, 35: 2, 33: 2, 14: 5, 25: 1}
Did not match all atoms present	68140-32-9	C1=CC=C2C(=C1)C(=CC(=C2[O-])N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N=NC5=C6C=CC(=CC6=CC(=C5[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{34: 4, 29: 9, 14: 15}
Did not match all atoms present	68140-33-0	[Li+].[B-](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F	{16: 4, 14: 16}
Did not match all atoms present	68140-34-1	C1=CC(=C(C=C1C2=CC(=C(C=C2)N=NC3=C(C4=C(C=C3)C(=CC(=C4N)S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])[O-])N/N=C/5\C(=CC6=CC(=CC(=C6C5=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{34: 3, 14: 12, 15: 2, 25: 1, 29: 12, 30: 1, 31: 1}
Did not match all atoms present	68140-42-1	CO[Si](CCCN(CCN(CO)CO)CO)(OC)OC	{1: 3, 2: 8, 20: 3, 22: 3, 33: 2}
Did not match all atoms present	68140-43-2	CC(=O)OCCOC1=CC=CC(=C1)O	{1: 1, 2: 2, 14: 4, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	68140-50-1	CCOC(=O)OC1=C(OC=CC1=O)C	{1: 2, 2: 1, 25: 1, 14: 2, 23: 1}
Did not match all atoms present	68140-57-8	CC(C=CC1C=CCCC1(C)C)C=NC2=CC=CC=C2C(=O)OC	{1: 4, 34: 1, 3: 1, 6: 3, 11: 2, 12: 1, 13: 1, 14: 6, 28: 1}
Did not match all atoms present	68140-63-6	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CNCCN	{1: 3, 2: 39, 6: 8, 14: 4, 20: 1, 27: 2, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	68140-67-0	CCCC(OC=C)OC=C.C=O.C1=CC=C(C=C1)O	{1: 1, 2: 2, 3: 1, 5: 3, 6: 2, 14: 5, 21: 1, 22: 2}
Did not match all atoms present	68140-79-4	CC1(C2=CC=CC=C2[N+](=C1C=CC3=CC=C(C=C3)N(C)CCO)C)C.[Cl-]	{1: 4, 2: 2, 6: 2, 33: 2, 13: 1, 14: 8, 15: 1, 17: 1, 20: 1}
Did not match all atoms present	68140-80-7	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCO)C(=O)CCCCCCCCCCCCCCCCC.OP(=O)(O)O	{1: 2, 2: 36, 33: 1, 20: 4, 24: 2, 29: 1, 31: 1}
Did not match all atoms present	68140-93-2	CCCCCCCCC=CCCCCCCCC1=[N+](CCN1CC)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 18, 6: 2, 33: 2, 11: 2, 15: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	68140-95-4	CCCCCCCCCCCC(=O)N(CCN(CCO)CC(=O)[O-])CC(=O)[O-].[Na+].[Na+]	{24: 3, 1: 1, 2: 16, 20: 1, 33: 2}
Did not match all atoms present	68140-97-6	CCCCOCCOCCC(=O)[O-].[K+]	{24: 1, 1: 1, 2: 7, 22: 2}
Did not match all atoms present	68140-99-8	CC1=CC=CC=C1NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3C)C(=O)O	{1: 2, 27: 2, 14: 10, 31: 2}
Did not match all atoms present	68141-02-6	C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-].C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-].C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-].[Cr+3]	{16: 45, 24: 3, 4: 21}
Did not match all atoms present	68141-03-7	CCCCCCCCCCCCCCC(C)C1=CC=C(C=C1)OC2=CC=CC=C2	{1: 2, 2: 13, 3: 1, 22: 1, 14: 9}
Did not match all atoms present	68141-05-9	C1=CC=C(C=C1)CCCCCCCCCCCCCCCCCC(=O)OCCOC2=CC=CC=C2	{2: 19, 28: 1, 22: 1, 14: 10}
Did not match all atoms present	68141-06-0	C1=CC=C(C=C1)CCCCCCCCCCCCCCCCCCO	{2: 18, 20: 1, 14: 5}
Did not match all atoms present	68141-07-1	C1=CC=C(C=C1)CCCCCCCCCCC(=O)OCC2=CC=CC=C2	{2: 11, 28: 1, 14: 10}
Did not match all atoms present	68141-09-3	B(OC1=CC(=C(C(=C1)C)Cl)C)(OC2=CC(=C(C(=C2)C)Cl)C)OC3=CC(=C(C(=C3)C)Cl)C	{1: 6, 22: 3, 14: 6, 17: 3}
Did not match all atoms present	68141-10-6	CC(C(=O)[O-])OC1=CC=CC2=CC=CC=C21.[Na+]	{24: 1, 1: 1, 3: 1, 22: 1, 14: 7}
Did not match all atoms present	68141-25-3	CCCCCCCC(=O)OCCCC1=CC=CC=C1	{1: 1, 2: 9, 28: 1, 14: 5}
Did not match all atoms present	68141-57-1	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C(=CC=C3)F	{16: 1, 1: 2, 14: 9}
Did not match all atoms present	68145-60-8	N.N.N.N.N.N.[OH-].[OH-].[OH-].[OH-].[Pt+4]	{}
Did not match all atoms present	68146-10-1	[CH3-].C[PH+](C)C.I[Pt]	{1: 3, 19: 1}
Did not match all atoms present	68151-08-6	C1CC2=C3C(=C4CCCC(=O)C4=C5C3=C(CCC5)C=C2)C1	{25: 1, 11: 9, 14: 2}
Did not match all atoms present	68151-18-8	C1CC2=C(C=C1)C3=CC=CC=C3C4=CC=CC=C24	{11: 2, 14: 10}
Did not match all atoms present	68155-45-3	CN(C)C1=CC=C(C=C1)C(C(=NC2CC3=CC=C2C=C3)OS(=O)(=O)C4=CC=CC=C4)C(=NC5CC6=CC=C5C=C6)OS(=O)(=O)C7=CC=CC=C7	{1: 2, 34: 2, 3: 1, 33: 1, 7: 2, 11: 2, 12: 2, 14: 22, 22: 2, 29: 4}
Did not match all atoms present	68155-46-4	CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=CC=C(C=C2)N(CNC=O)C(=O)C3=CC(=C(C(=C3CNC=O)CNC=O)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4OC)CNC=O	{1: 4, 2: 4, 3: 2, 33: 1, 34: 4, 14: 13, 22: 2, 24: 5, 26: 4, 31: 6}
Did not match all atoms present	68155-50-0	CC(C)C1=C(C=C(C=C1)O)C(C)C	{1: 4, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	68155-51-1	CC(C)C1=C(C=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)C(C)C	{1: 4, 3: 2, 22: 3, 14: 13, 29: 1}
Did not match all atoms present	68155-53-3	CC1=CC(=C(C=C1N)S(=O)(=O)CCOS(=O)(=O)O)C	{1: 2, 2: 2, 14: 2, 20: 1, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	68155-58-8	C(CO)N(CCOP(=O)(O)O)CCOP(=O)(O)O	{33: 1, 2: 6, 20: 5, 29: 2, 22: 2}
Did not match all atoms present	68155-60-2	C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)[O-])N=NC3=CC=C(C=C3)NC4=NC(=NC(=N4)N(CCO)CCO)NC5=CC=C(C=C5)N=NC6=CC(=C7C=CC=C(C7=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 1, 2: 4, 35: 3, 34: 4, 14: 18, 20: 2, 29: 12, 31: 2}
Did not match all atoms present	68155-61-3	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=CC=C(C=C4)N=NC5=C(C=C6C=C(/C(=N/NC7=CC=CC=C7)/C(=O)C6=C5N)S(=O)(=O)[O-])S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 5, 14: 21, 15: 2, 25: 1, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	68155-68-0	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+].[K+]	{35: 6, 6: 2, 14: 14, 17: 2, 29: 12, 31: 4}
Did not match all atoms present	68155-70-4	C1=CC(=CC=C1NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+].[K+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 14, 20: 4, 29: 12, 31: 4}
Did not match all atoms present	68155-71-5	CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4OC	{1: 4, 34: 4, 3: 2, 14: 16, 22: 2, 24: 5, 31: 3}
Did not match all atoms present	68155-72-6	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)NN=C5C(=O)C=CC6=CC=CC=C65	{34: 2, 14: 20, 15: 2, 24: 1, 25: 2, 31: 3}
Did not match all atoms present	68155-73-7	CCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC=C(C=C2)C(C3=CC=C(C=C3)N(CC)CC4=CC(=CC=C4)S(=O)(=O)O)C5=CC=CC=C5S(=O)(=O)O	{1: 2, 2: 4, 3: 1, 33: 2, 14: 20, 20: 3, 29: 6}
Did not match all atoms present	68155-74-8	C1CCCN(CC1)C2=CC=C(C=C2)[N+]#N.C1CCCN(CC1)C2=CC=C(C=C2)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 4, 34: 2, 11: 12, 14: 8, 33: 2}
Did not match all atoms present	68155-75-9	CC1=C(C=CC(=C1)N)N2CCCC2.Cl	{1: 1, 33: 1, 11: 4, 14: 3, 17: 1, 30: 1}
Did not match all atoms present	68155-76-0	CCN(CC)C1=C(C=C(C=C1)N)Cl	{1: 2, 2: 2, 33: 1, 14: 3, 17: 1, 30: 1}
Did not match all atoms present	68155-77-1	CCN(CC)CC.OP(=O)([O-])[O-].[Na+].[Na+]	{1: 3, 2: 3, 20: 1, 29: 3, 33: 1}
Did not match all atoms present	68155-85-1	C1=CC=C2C(=C1)C(=O)OC2=O.C(CO)CO	{28: 2, 2: 3, 20: 2, 14: 4}
Did not match all atoms present	68155-94-2	CCCCCCCCC=CCCCCCCCCN.CCCCC(CC)COP(=O)(O)OCC(CC)CCCC	{1: 5, 2: 25, 3: 2, 6: 2, 20: 1, 22: 2, 29: 1, 30: 1}
Did not match all atoms present	68155-95-3	CCN(CC)C1=CC(=C(C=C1)N=C2C=CC(=O)C(=C2)Cl)C	{1: 3, 2: 2, 33: 1, 34: 1, 14: 6, 15: 2, 17: 1, 25: 1}
Did not match all atoms present	68156-03-6	C1=CC=C(C=C1)[S+](C2=CC=CC=C2Cl)C3=CC=CC=C3Cl.F[P-](F)(F)(F)(F)F	{16: 6, 17: 2, 14: 13}
Did not match all atoms present	68156-05-8	C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3Cl.F[P-](F)(F)(F)(F)F	{16: 6, 17: 1, 14: 14}
Did not match all atoms present	68156-06-9	C1(C(C(C(C(C1(F)F)(F)F)(F)S(=O)(=O)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)F	{16: 16, 4: 2, 13: 6, 29: 2}
Did not match all atoms present	68156-13-8	C1=CC=C(C=C1)SC2=CC=CC=C2[S+](C3=CC=CC=C3)C4=CC=CC=C4.F[P-](F)(F)(F)(F)F	{16: 6, 40: 1, 14: 19}
Did not match all atoms present	68156-18-3	C1C2CC(C1C=C2C(=O)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(/C(=N\NC5=C(C6=CC=CC=C6C=C5)S(=O)(=O)O)/C4=O)S(=O)(=O)O)S(=O)(=O)CCCl	{2: 2, 11: 2, 12: 3, 34: 1, 14: 10, 15: 3, 17: 1, 20: 3, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	68156-19-4	[NH4+].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Rh+3]	{29: 8}
Did not match all atoms present	6816-12-2	N(OS(=O)(=O)F)(F)F	{16: 3, 33: 1, 29: 2, 22: 1}
Did not match all atoms present	68160-62-3	C1=CN=CC=C1C=C2C(=O)NC(=O)NC2=O	{32: 2, 35: 1, 6: 1, 14: 4, 15: 1, 25: 3}
Did not match all atoms present	68162-09-4	CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCCCC	{1: 2, 2: 14, 28: 1, 22: 2, 14: 8}
Did not match all atoms present	68162-13-0	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=C[C@H]([C@@H]3O)O	{1: 2, 12: 2, 14: 8, 20: 2}
Did not match all atoms present	68162-14-1	CC1=C2C=C[C@@H]([C@H](C2=C(C3=C1C=CC4=CC=CC=C43)C)O)O	{1: 2, 12: 2, 14: 8, 20: 2}
Did not match all atoms present	68170-22-9	CCCCCCCCCCCCC1=CC=C(C=C1)N.COP(=O)(O)OC	{1: 3, 2: 11, 14: 4, 20: 1, 22: 2, 29: 1, 30: 1}
Did not match all atoms present	68170-35-4	CCCCCCC(O)C/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CC(O)CCCCCC)COC(=O)CCCCCCC/C=C/CC(O)CCCCCC.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O	{1: 3, 2: 42, 3: 4, 6: 6, 8: 2, 34: 2, 14: 8, 20: 3, 28: 3, 29: 2}
Did not match all atoms present	68170-62-7	CCCCCCC(O)C/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CC(O)CCCCCC)COC(=O)CCCCCCC/C=C/CC(O)CCCCCC.CC1=C(C=CC=C1N=C=O)N=C=O	{1: 4, 2: 41, 3: 4, 6: 6, 8: 2, 34: 2, 14: 3, 20: 3, 28: 3, 29: 2}
Did not match all atoms present	68171-29-9	C(COP(=O)(O)O)N(CCOP(=O)(O)O)CCOP(=O)(O)O.[Na+]	{33: 1, 2: 6, 20: 6, 29: 3, 22: 3}
Did not match all atoms present	68171-30-2	C1=CC=C(C=C1)CCOC(C(Cl)(Cl)Cl)OCCC2=CC=CC=C2	{2: 4, 3: 1, 4: 1, 14: 10, 17: 3, 22: 2}
Did not match all atoms present	68171-32-4	[N-]=O.Br[Ru](Br)Br	{18: 3, 29: 1}
Did not match all atoms present	68171-54-0	CCCCCCCCCCCCCCCCO[Si](OCC)(OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC	{1: 4, 2: 46, 22: 4}
Did not match all atoms present	68171-55-1	CC1=NC=CN=C1OCC(C)C	{1: 3, 2: 1, 3: 1, 14: 2, 35: 2, 22: 1}
Did not match all atoms present	68171-60-8	CCCCCCCC1=NCC[N+]1(CCO)CC(=O)[O-]	{1: 1, 2: 9, 35: 1, 11: 2, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	68171-61-9	CCCCCCC(CCCCCCCCCCC(=O)[O-])OC(=O)C.CCCCCCC(CCCCCCCCCCC(=O)[O-])OC(=O)C.[Ca+2]	{24: 2, 1: 4, 2: 30, 3: 2, 28: 2}
Did not match all atoms present	6818-99-1	C1=NNC(=N1)Cl	{32: 1, 17: 1, 35: 2, 14: 1}
Did not match all atoms present	68186-38-9	CCCCCCCCCCCCCCCCCCCCO.OP(=O)([O-])[O-].[Na+]	{1: 1, 2: 19, 20: 2, 29: 3}
Did not match all atoms present	68186-39-0	CCCCOP(=O)(O)OCCOCC	{1: 2, 2: 6, 20: 1, 29: 1, 22: 3}
Did not match all atoms present	68186-49-2	CCCCCCCC(=O)O.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O.C(=C/C(=O)O)\C(=O)O	{1: 1, 2: 10, 4: 1, 6: 2, 14: 4, 20: 4, 27: 3, 28: 2}
Did not match all atoms present	68186-53-8	CCCCCCCCC=CCCCCCCCC(=O)N(CCO)CCOP(=O)(O)O	{1: 1, 2: 18, 6: 2, 33: 1, 20: 3, 22: 1, 24: 1, 29: 1}
Did not match all atoms present	68186-55-0	CCCCCCC=CC=CCCCCCCCC(=O)OCC(COC(=O)C1=CC=CC(=C1)C(=O)O)O	{1: 1, 2: 14, 3: 1, 6: 4, 14: 4, 20: 1, 27: 1, 28: 2}
Did not match all atoms present	68186-56-1	CC(C)CCCCCO.OP(=O)([O-])[O-].[Na+]	{1: 2, 2: 5, 3: 1, 20: 2, 29: 3}
Did not match all atoms present	68186-60-7	CCCCCCCCCC(=O)OCC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 1, 2: 10, 3: 1, 14: 4, 20: 2, 28: 3}
Did not match all atoms present	68186-77-6	CCCCCCCCCCCCCCCCCC(=O)OCC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 2, 2: 19, 4: 1, 14: 4, 20: 2, 27: 2, 28: 1}
Did not match all atoms present	68186-81-2	CC(COC(=O)C1=C(C=CC(=C1)C(=O)O)C(=O)O)OP(=O)(O)O	{1: 1, 2: 1, 3: 1, 14: 3, 20: 2, 22: 1, 27: 2, 28: 1, 29: 1}
Did not match all atoms present	68187-28-0	C1=CC=C(C=C1)OCC(CC(CNCCN)NCCN)O	{2: 7, 3: 2, 14: 5, 20: 1, 22: 1, 30: 2, 31: 2}
Did not match all atoms present	68187-32-6	C(CC(=O)[O-])[C@@H](C(=O)O)N.[Na+]	{24: 1, 27: 1, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	68188-17-0	CCOC1=CC(=C(C=C1[N+]#N)OCC)NC(=O)C2=CC=CC=C2.F[P-](F)(F)(F)(F)F	{1: 2, 2: 2, 34: 1, 14: 7, 16: 6, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	68189-02-6	B(O)(O)O.CCNCC	{1: 2, 2: 2, 20: 3, 31: 1}
Did not match all atoms present	68189-03-7	B(O)(O)O.CCN(CC)CC	{1: 3, 2: 3, 20: 3, 33: 1}
Did not match all atoms present	68189-12-8	B12OCCN(CCO1)CCO2.CC1=CC(=CC=C1)[O-].CC1=CC(=CC=C1)[O-].CC1=CC(=CC=C1)[O-].CC1=CC(=CC=C1)[O-].[Ti+4]	{1: 4, 11: 6, 33: 1, 14: 16, 23: 3}
Did not match all atoms present	68189-14-0	CC(=CC1=C(C=CC2=CC=CC=C21)O)C3=[O+]C4=C(C=C3)C5=CC=CC=C5C=C4.[Cl-]	{1: 1, 6: 1, 7: 1, 14: 14, 17: 1, 21: 1, 23: 1}
Did not match all atoms present	68189-18-4	C1=CC=C2C(=C(C=CC2=C1)N/N=C/3\C(=O)C4=CC=CC=C4C=C3)S(=O)(=O)[O-].C1=CC=C2C(=C(C=CC2=C1)N/N=C/3\C(=O)C4=CC=CC=C4C=C3)S(=O)(=O)[O-].[Ba+2]	{34: 2, 14: 24, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68189-20-8	CC1=C(C(=C(C=C1)C)O)C(C)(C)C	{1: 5, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	68189-22-0	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#[N+]CC)CCNC(=O)CCCCCCCCCCCCCCCCC.CCOS(=O)(=O)[O-]	{1: 4, 2: 40, 33: 1, 34: 1, 22: 1, 24: 2, 29: 3, 31: 2}
Did not match all atoms present	68189-23-1	CCN(CC)C1=CC=C(C=C1)C=NN(C2=CC=CC=C2)C3=CC=CC=C3	{1: 2, 2: 2, 6: 1, 33: 2, 34: 1, 14: 14}
Did not match all atoms present	68189-24-2	CC1=C(C=C(C=C1N/N=C\2/C3=CC=CC=C3C=CC2=O)S(=O)(=O)[O-])Cl.CC1=C(C=C(C=C1N/N=C\2/C3=CC=CC=C3C=CC2=O)S(=O)(=O)[O-])Cl.[Ca+2]	{1: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68189-25-3	C1=CC=C2C(=C(C=CC2=C1)S(=O)(=O)[O-])N/N=C\3/C4=CC=CC=C4C=CC3=O.C1=CC=C2C(=C(C=CC2=C1)S(=O)(=O)[O-])N/N=C\3/C4=CC=CC=C4C=CC3=O.[Ba+2]	{34: 2, 14: 24, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68189-28-6	CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)O)Cl	{1: 1, 38: 1, 14: 2, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	68189-29-7	CC(CNS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)N)O	{1: 1, 2: 1, 3: 1, 14: 6, 20: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	68189-30-0	CC(=O)NC1=CC(=C2C=CC=C(C2=C1)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 14: 5, 20: 2, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	68189-31-1	C1=CC(=CC(=C1)N)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O	{14: 8, 20: 2, 21: 1, 24: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	68189-32-2	CC(=O)NC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)O	{1: 1, 14: 6, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68189-33-3	CCCCCCCCCC(=O)NC1=CC2=CC(=CC(=C2C=C1)O)S(=O)(=O)O	{1: 1, 2: 8, 14: 5, 20: 1, 21: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68189-34-4	C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O	{17: 1, 27: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	68189-36-6	CCC(=O)NC1=CC(=CC=C1)N(CCO)CCO	{1: 1, 2: 5, 33: 1, 14: 4, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	68189-37-7	CC(=O)NC1=CC=C(C=C1)C2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)N)S(=O)(=O)O	{1: 1, 14: 11, 20: 1, 24: 2, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	68189-38-8	CC1=CC(=CC(=C1N)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 30: 1, 20: 2, 29: 4, 14: 2}
Did not match all atoms present	68189-39-9	CC(=O)NC1=CC2=C(C=C1)C(=O)/C(=N\NC3=CC=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)/C(=C2)S(=O)(=O)O	{1: 1, 2: 2, 34: 1, 14: 8, 15: 2, 20: 2, 22: 1, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	68189-43-5	C1CN(CCN1CC(CS(=O)(=O)O)O)CC(CS(=O)(=O)O)O	{33: 2, 2: 4, 3: 2, 11: 4, 20: 4, 29: 4}
Did not match all atoms present	6819-41-6	CCC[O-].[Na+]	{1: 1, 2: 2, 29: 1}
Did not match all atoms present	68191-10-6	[NH4+].[NH4+].[O-]S(=O)[O-].[O-]S(=O)[O-].[Pd+2]	{29: 6}
Did not match all atoms present	68191-11-7	[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[O-]S(=O)[O-].[O-]S(=O)[O-].[O-]S(=O)[O-].[O-]S(=O)[O-].[Pt+2]	{29: 12}
Did not match all atoms present	68191-12-8	[NH4+].[O-]S(=O)[O-].[O-]S(=O)[O-].[Rh+3]	{29: 6}
Did not match all atoms present	68193-67-9	[Ba+2].[OH-]	{}
Did not match all atoms present	68194-15-0	C1=CC(=C(C(=C1)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 6, 14: 4}
Did not match all atoms present	68198-79-8	CC(CCN=C=O)CC(C)(C)CN=C=O.CO[Si](CCCS)(OC)OC	{1: 6, 2: 7, 3: 1, 4: 1, 39: 1, 8: 2, 34: 2, 22: 3, 29: 2}
Did not match all atoms present	682-01-9	CCCO[Si](OCCC)(OCCC)OCCC	{1: 4, 2: 8, 22: 4}
Did not match all atoms present	682-03-1	CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[N+](=O)([O-])[O-]	{1: 4, 2: 20}
Did not match all atoms present	682-30-4	CCOP(=O)(C=C)OCC	{1: 2, 2: 2, 5: 1, 6: 1, 22: 2, 29: 1}
Did not match all atoms present	68201-15-0	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Mg+2].[Ba+2]	{29: 6}
Did not match all atoms present	68201-16-1	O.[Al].[Sr].[Ba]	{}
Did not match all atoms present	68201-75-2	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{30: 1, 34: 2, 29: 6, 14: 11}
Did not match all atoms present	68201-76-3	CC(=O)NC1=CC=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	68201-77-4	C1=CC(=CC(=C1)[N+](=O)[O-])N=NC2=CC=C(C=C2)NN=C3C=CC(=O)C=C3	{34: 3, 38: 1, 14: 12, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	68201-78-5	C1=CC2=C(C=C1N)NC(=N2)SCCCS(=O)(=O)[O-].[Na+]	{32: 1, 2: 3, 35: 1, 40: 1, 14: 3, 29: 3, 30: 1}
Did not match all atoms present	68201-82-1	C.C.CC(CC(=O)O)CC(C)(C)C	{27: 1, 1: 4, 2: 2, 3: 1, 4: 1}
Did not match all atoms present	68201-84-3	CCCCCC=C(CC=CCCCCCCCC(=O)O)S(=O)(=O)O	{1: 1, 2: 12, 6: 3, 7: 1, 20: 1, 27: 1, 29: 2}
Did not match all atoms present	68201-85-4	CCCCCCCCC=C(CCCCCCCC(=O)O)S(=O)(=O)O	{1: 1, 2: 14, 6: 1, 7: 1, 20: 1, 27: 1, 29: 2}
Did not match all atoms present	68201-92-3	CCCC[Sn](=O)CCCC.C(COC(=O)CS)OC(=O)CS	{1: 2, 2: 10, 28: 2, 29: 1, 39: 2}
Did not match all atoms present	68201-93-4	CCOC1=CC(=C(C=C1[N+]#N)OCC)SC2=CC=C(C=C2)C.C=O.OS(=O)(=O)[O-]	{1: 3, 2: 2, 5: 1, 40: 1, 34: 1, 14: 6, 20: 1, 22: 2, 29: 3}
Did not match all atoms present	68201-95-6	C1=CC(=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC4=NC(=NC(=N4)NCCO)NCCO)S(=O)(=O)[O-])N=NC5=CC=C(C=C5)S(=O)(=O)[O-].[Na+].[Na+]	{2: 4, 35: 3, 34: 3, 14: 12, 15: 2, 20: 2, 25: 1, 29: 6, 31: 4}
Did not match all atoms present	68208-16-2	CC1=CC=CC=C1C(CC(=O)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 27: 1, 30: 1}
Did not match all atoms present	68208-18-4	CC1=CC=C(C=C1)C(CC(=O)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 27: 1, 30: 1}
Did not match all atoms present	68208-24-2	COC1=CC=C(C=C1)C(CCO)N	{1: 1, 2: 2, 3: 1, 14: 4, 20: 1, 22: 1, 30: 1}
Did not match all atoms present	68213-74-1	C1C(C(=O)OC1=O)S(=O)(=O)O	{20: 1, 11: 1, 12: 1, 29: 2, 28: 2}
Did not match all atoms present	68213-75-2	CCCCCOP(=O)(O)OCCCCC.C1COCCN1	{32: 1, 1: 2, 2: 8, 11: 4, 20: 1, 22: 2, 23: 1, 29: 1}
Did not match all atoms present	68213-76-3	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[NH4+].[Mg+2]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	68213-77-4	CC(=O)[O-].CC(=O)[O-].[NH4+].[Zn+2]	{24: 2, 1: 2}
Did not match all atoms present	68213-78-5	CC(CC(=O)[O-])CC(C)(C)C.CC(CC(=O)[O-])CC(C)(C)C.[Fe+2]	{24: 2, 1: 8, 2: 4, 3: 2, 4: 2}
Did not match all atoms present	68213-80-9	CC(CN)O.C1=CC=C(C=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	68213-81-0	CC(CNCC(C)O)O.CC(C)(C)C1=CC=C(C=C1)C(=O)O	{1: 5, 2: 2, 3: 2, 4: 1, 14: 4, 20: 2, 27: 1, 31: 1}
Did not match all atoms present	68213-82-1	CC(CNCC(C)O)O.C1=CC=C(C=C1)O	{1: 2, 2: 2, 3: 2, 14: 5, 20: 2, 21: 1, 31: 1}
Did not match all atoms present	68213-84-3	CC(CNCC(C)O)O.C1=CC=C(C=C1)C2=CC=CC=C2O	{1: 2, 2: 2, 3: 2, 14: 9, 20: 2, 21: 1, 31: 1}
Did not match all atoms present	68213-89-8	C1=CC=C(C=C1)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)[O-].[Na+]	{31: 1, 21: 1, 14: 10, 29: 3}
Did not match all atoms present	68213-91-2	CCOC(=O)C\1=NN(C(=O)/C1=N\NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 34: 1, 14: 9, 15: 2, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	68213-92-3	CC1=CC(=C(C=C1)N=NC2=C/C(=N/NC3=CC(=C(C=C3)C)C)/C(=O)C=C2O)C	{1: 4, 34: 3, 14: 8, 15: 3, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	68213-93-4	CC(=O)NC1=C2C(=C(C=C1)[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)NC(=O)C)[N+](=O)[O-]	{1: 2, 38: 2, 14: 4, 24: 2, 25: 2, 31: 2}
Did not match all atoms present	68213-94-5	C1=CC(=C(C=C1Br)Br)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)N)O	{14: 7, 18: 2, 21: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	68213-95-6	CC1=CC(=C(C=C1)N=NC2=C/C(=N/NC3=CC=CC=C3C)/C(=O)C=C2O)C	{1: 3, 34: 3, 14: 9, 15: 3, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	68213-96-7	CC1=CC(=C(C=C1)C)NN=C2C=CC(=O)C(=NNC3=CC=CC=C3C)C2=O	{1: 3, 34: 2, 31: 2, 14: 9, 25: 2}
Did not match all atoms present	68213-97-8	CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCC)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 52, 14: 5, 17: 1}
Did not match all atoms present	68213-99-0	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-].[Na+].[Na+]	{25: 2, 29: 6, 14: 6}
Did not match all atoms present	68214-02-8	COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+].[Na+]	{1: 2, 34: 4, 14: 11, 22: 2, 29: 6, 30: 1}
Did not match all atoms present	68214-03-9	COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\5/C6=C(C=C(C=C6)NC(=O)C7=CC=C(C=C7)N)C(=CC5=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 5, 14: 19, 15: 2, 22: 2, 24: 1, 25: 1, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	68214-05-1	CC1=CC(=C(C(=C1NC2=C3C(=C(C=C2)NC4=C(C(=C(C=C4C)C)S(=O)(=O)[O-])C)C(=O)C5=CC=CC=C5C3=O)C)S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 6, 31: 2, 29: 6, 14: 8, 25: 2}
Did not match all atoms present	68214-06-2	CC(C)CCCC(C)CCOC=O	{1: 3, 2: 5, 3: 2, 26: 1}
Did not match all atoms present	68214-07-3	CCCCCCCCCCCCCCCC[N+](C)(C)C.OS(=O)(=O)[O-]	{1: 4, 2: 15, 20: 1, 29: 3}
Did not match all atoms present	68214-26-6	C1=CC=C(C(=C1)C(=O)[O-])[O-].C1=CC=C(C(=C1)C(=O)[O-])[O-].[NH4+].O.O.[Cr+3]	{24: 2, 14: 8}
Did not match all atoms present	68214-42-6	C1=CC(=C2C(=C1N)C(=O)C3=C(C2=O)C(=C(C(=C3N)Br)Br)N)N	{25: 2, 18: 2, 30: 4, 14: 2}
Did not match all atoms present	68214-56-2	CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 2: 1, 33: 1, 34: 1, 14: 12, 15: 1, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	68214-59-5	CC\1=C(C(=O)NC(=O)/C1=N/NC2=CC=CC=C2)[N+]3=CC=CC=C3.C(C(C(=O)[O-])O)C(=O)O	{32: 1, 1: 1, 2: 1, 3: 1, 33: 1, 34: 1, 14: 10, 15: 3, 20: 1, 24: 1, 25: 2, 27: 1, 31: 1}
Did not match all atoms present	68214-61-9	CC\1=C(C(=O)NC(=O)/C1=N/NC2=C(C=CC(=C2)Cl)Cl)[N+]3=CC=CC=C3.C(C(C(=O)[O-])O)C(=O)O	{32: 1, 1: 1, 2: 1, 3: 1, 33: 1, 34: 1, 14: 8, 15: 3, 17: 2, 20: 1, 24: 1, 25: 2, 27: 1, 31: 1}
Did not match all atoms present	68214-67-5	CC1=CC(=C(C=C1S(=O)(=O)[O-])C)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC4=C(C(=NC(=N4)Cl)Cl)Cl)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 1, 35: 2, 14: 6, 15: 2, 17: 3, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	68214-68-6	CCCCCC1=CC(=C(C=C1)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)CCCCC	{1: 2, 2: 28, 20: 1, 22: 10, 14: 3}
Did not match all atoms present	68214-71-1	C1CN2CCN(C2=N1)/C(=N/C(=N)N3CCN4C3=NCC4)/N.OS(=O)(=O)O	{33: 4, 34: 1, 35: 2, 36: 1, 7: 2, 11: 8, 15: 2, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	68214-72-2	CCOC(=O)NC1=CC=CC2=C1C=C(C=C2)O	{1: 1, 2: 1, 14: 6, 21: 1, 28: 1, 31: 1}
Did not match all atoms present	68214-73-3	CNS(=O)(=O)C1=CC2=C(C=C1)OC(=O)N2	{32: 1, 1: 1, 14: 3, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	68214-74-4	CCC1=CC(=C(C(=C1)CC)Br)C	{1: 3, 2: 2, 18: 1, 14: 2}
Did not match all atoms present	68214-76-6	CCCS(=O)(=O)O.C1=CC=NC=C1	{1: 1, 2: 2, 35: 1, 14: 5, 20: 1, 29: 2}
Did not match all atoms present	68214-78-8	CCN(CC)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])I)OC	{1: 4, 2: 2, 37: 1, 38: 1, 33: 1, 34: 2, 14: 4, 19: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	68214-80-2	CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)N=O)C.Cl	{1: 3, 2: 3, 33: 1, 34: 1, 14: 3, 17: 1, 29: 3, 31: 1}
Did not match all atoms present	68214-81-3	CCN(CCO)C1=CC(=C(C=C1)N=NC2=CC=CC=C2)C	{1: 2, 2: 3, 33: 1, 34: 2, 14: 8, 20: 1}
Did not match all atoms present	68214-82-4	C1=CC(=CC=C1C2=CC=C(C=C2)N/N=C\3/C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)O)N/N=C\5/C(=CC6=C(C5=O)C=C(C=C6)N)S(=O)(=O)[O-].[Na+].[Na+]	{34: 2, 14: 15, 15: 4, 20: 1, 25: 2, 29: 8, 30: 2, 31: 2}
Did not match all atoms present	68220-77-9	[10B-](F)(F)(F)F.[K+]	{16: 4}
Did not match all atoms present	68224-81-7	B(OCCN(C)C)(OCCN(C)C)OCCN(C)C.B(OC1=CC=C(C=C1)C)(OC2=CC=C(C=C2)C)OC3=CC=CC(=C3)C	{1: 9, 2: 6, 22: 6, 14: 12, 33: 3}
Did not match all atoms present	68226-87-9	[Li+].[Li+].[Li+].[Li+].C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-]	{24: 5, 14: 6}
Did not match all atoms present	68226-88-0	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)O.[Cs+].[Cs+].[Cs+]	{24: 4, 27: 1, 14: 6}
Did not match all atoms present	68226-89-1	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)O.[Rb+].[Rb+].[Rb+]	{24: 4, 27: 1, 14: 6}
Did not match all atoms present	68226-90-4	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)O.[K+].[K+].[K+]	{24: 4, 27: 1, 14: 6}
Did not match all atoms present	68226-91-5	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)O.[Na+].[Na+].[Na+]	{24: 4, 27: 1, 14: 6}
Did not match all atoms present	68226-92-6	[Li+].[Li+].[Li+].C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)O	{24: 4, 27: 1, 14: 6}
Did not match all atoms present	68226-93-7	C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)[O-])[O-])C(=O)O.[Cs+].[Cs+]	{2: 1, 27: 2, 14: 10}
Did not match all atoms present	68226-94-8	C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)[O-])[O-])C(=O)O.[Rb+].[Rb+]	{2: 1, 27: 2, 14: 10}
Did not match all atoms present	68227-17-8	CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=CC=C3.CC(C)(C)C1=CC(=C(C=C1)[O-])C(=O)[O-].[Na+].[Cr+3]	{1: 4, 34: 2, 35: 1, 4: 1, 33: 1, 14: 12, 24: 2}
Did not match all atoms present	68227-23-6	CC[N-]S(=O)(=O)C1=CC=C(C=C1)C.[K+]	{1: 2, 2: 1, 34: 1, 29: 2, 14: 4}
Did not match all atoms present	68227-24-7	CCCCCCCCOP(=O)(O)O.CC(CN)O	{1: 2, 2: 8, 3: 1, 20: 3, 22: 1, 29: 1, 30: 1}
Did not match all atoms present	68227-26-9	CC1=C(C=CC=C1Cl)NCS(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 14: 3, 17: 1, 29: 3, 31: 1}
Did not match all atoms present	68227-27-0	CNC1=C2C(=C(C=C1)N)C(=O)C3=C(C=CC(=C3C2=O)N)N	{1: 1, 31: 1, 30: 3, 14: 4, 25: 2}
Did not match all atoms present	68227-28-1	CCCCNC1=C2C(=C(C=C1)NC)C(=O)C3=CC=CC=C3C2=O	{1: 2, 2: 3, 31: 2, 14: 6, 25: 2}
Did not match all atoms present	68227-34-9	CC1=CC(=C(C=C1)C)N=NC2=C(C(=C(C=C2)NN=C3C(=O)C=CC(=NNC4=CC(=C(C=C4C)N=NC5=CC=CC=C5OC)C)C3=O)C)C	{1: 7, 34: 6, 14: 13, 22: 1, 25: 2, 31: 2}
Did not match all atoms present	68227-35-0	COC1=CC=CC=C1N=NC2=CC(=C(C=C2)N/N=C\3/C=C(C(=CC3=O)O)N=NC4=C(C=C(C=C4)N=NC5=CC=CC=C5OC)OC)OC	{1: 4, 34: 7, 14: 16, 15: 3, 20: 1, 22: 4, 25: 1, 31: 1}
Did not match all atoms present	68227-36-1	CC1=CC(=C(C=C1)N=NC2=CC(=C(C=C2)N=NC3=C/C(=N\NC4=CC(=C(C=C4C)N=NC5=CC=CC=C5OC)C)/C(=O)C=C3O)OC)C	{1: 6, 34: 7, 14: 14, 15: 3, 20: 1, 22: 2, 25: 1, 31: 1}
Did not match all atoms present	68227-37-2	CC1=CC=CC=C1NN=C2C=CC(=O)C(=NNC3=CC=CC=C3C)C2=O	{1: 2, 34: 2, 31: 2, 14: 10, 25: 2}
Did not match all atoms present	68227-38-3	C1=CC(=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)O)N=NC4=CC=C(C=C4)S(=O)(=O)O.N.N	{34: 3, 14: 12, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	68227-39-4	CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C(=CC3=C(C2=O)C=C(C=C3)N)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 6, 15: 2, 17: 1, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	68227-41-8	COC1=C(C=CC(=C1)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)NC4=C(C=C(C=C4)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 14: 16, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	68227-43-0	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)O)NNC3=C(C=CC(=C3)Cl)Cl	{36: 1, 14: 7, 15: 5, 17: 2, 20: 1, 25: 1, 29: 2, 31: 2}
Did not match all atoms present	68227-44-1	C1=CC(=CC\2=C1C=CC(=O)/C2=N/NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C6C=CC(=CC6=C(C=C5)N=NC7=CC=C(C=C7)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 5, 14: 19, 15: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	68227-50-9	CCCCCCC1C=CC(CC1C(=O)[O-])CCCCCCCC(=O)O.[K+]	{1: 1, 2: 12, 11: 1, 12: 3, 14: 2, 24: 1, 27: 1}
Did not match all atoms present	68227-53-2	CCCCCCC(CCOC=O)O	{1: 1, 2: 7, 3: 1, 20: 1, 26: 1}
Did not match all atoms present	68227-54-3	CC(C)(C1=CC=C(C=C1)OCC(CN(CCN)CCN)O)C2=CC=C(C=C2)OCC(CN(CCN)CCN)O	{1: 2, 2: 12, 3: 2, 4: 1, 33: 2, 14: 8, 20: 2, 22: 2, 30: 4}
Did not match all atoms present	68227-55-4	COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=CC(=CC=C4)S(=O)(=O)[O-])/C2=O.[Na+]	{1: 1, 34: 1, 14: 13, 15: 2, 22: 1, 24: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	68227-56-5	CC1=NN(C(=O)C1N/N=C\2/C=C(C=CC2=O)S(=O)(=O)NC)C3=CC=C(C=C3)Cl	{1: 2, 34: 1, 35: 1, 33: 1, 12: 1, 14: 7, 15: 3, 17: 1, 25: 2, 29: 2, 31: 2}
Did not match all atoms present	68227-57-6	CCC1=CC=CC=C1N2C(=O)C(C(=N2)C)N=NC3=CC=CC=C3C(=O)O	{1: 2, 2: 1, 35: 1, 33: 1, 12: 1, 34: 2, 14: 8, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	68227-58-7	CCN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)O)OC	{1: 2, 2: 3, 37: 1, 33: 1, 34: 4, 14: 11, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	68227-59-8	CCN(CC1=CC=C(C=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)N=NC3=C(C=C(C(=C3)C)N=NC4=CC=CC=C4OC)OC.[Na+]	{1: 4, 2: 2, 33: 1, 34: 4, 14: 14, 22: 2, 29: 3}
Did not match all atoms present	68227-60-1	C1=CC(=C2C(=C1N)C(=O)C3=C(C2=O)C(=C(C=C3N)S(=O)(=O)[O-])O)O.[Na+]	{25: 2, 30: 2, 21: 2, 14: 3, 29: 3}
Did not match all atoms present	68227-63-4	CC1=NN(C(=O)C1NN=C2C=C(C(=CC2=O)S(=O)(=O)N)Cl)C3=CC=CC=C3	{1: 1, 34: 1, 35: 1, 33: 1, 12: 1, 14: 7, 15: 4, 17: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	68227-64-5	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)S(=O)(=O)[O-])C=C/C(=N/NC4=CC(=CC(=C4O)[N+](=O)[O-])Cl)/C3=O.[Na+]	{34: 1, 38: 1, 14: 11, 15: 1, 17: 1, 21: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	68227-65-6	CC1=NN(C(=O)C1N=NC2=CC=CC=C2C(=O)[O-])C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 2, 35: 1, 6: 2, 33: 1, 12: 1, 14: 10, 15: 1, 20: 1, 24: 1, 25: 1, 29: 5, 30: 1}
Did not match all atoms present	68227-66-7	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])N=NC3=CN(N=C3C(=O)[O-])C4=CC(=CC=C4)N.[Na+].[Na+]	{1: 1, 34: 4, 35: 1, 33: 1, 14: 12, 22: 1, 24: 1, 29: 3, 30: 1}
Did not match all atoms present	68227-68-9	CC1=NN(C(=C1)N)C2=C(C=CC(=C2)S(=O)(=O)O)Cl	{1: 1, 35: 1, 33: 1, 14: 4, 17: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	68227-69-0	C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2N	{30: 1, 22: 1, 14: 9, 29: 2}
Did not match all atoms present	68227-70-3	C1=CC=C(C(=C1)N)S(=O)(=O)OC2=CC=CC=C2Cl	{17: 1, 30: 1, 22: 1, 14: 8, 29: 2}
Did not match all atoms present	68227-71-4	C1=CC(=CC=C1C(=O)NC2=CC3=C(C=C(C=C3C=C2)O)S(=O)(=O)O)N	{14: 9, 20: 1, 21: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	68227-72-5	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N=NC6=CC=CC=C6)S(=O)(=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+].[Na+]	{34: 4, 29: 6, 14: 20, 31: 1}
Did not match all atoms present	68227-73-6	C1=CC2=C(C=C(/C(=N/NC3=CC=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-])C(=C1)N.[Na+].[Na+]	{34: 3, 14: 12, 15: 2, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	68227-75-8	CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)O)N	{1: 1, 30: 1, 20: 1, 29: 4, 14: 7}
Did not match all atoms present	68227-76-9	CCC(=O)NC1=CC(=C(C=C1)OC)N(CCOCCC#N)CCOCCC#N	{1: 2, 2: 9, 37: 2, 33: 1, 14: 3, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	68227-80-5	CCCCCCCCC=CCCCCCCCC(=O)NCCOCCOC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 19, 3: 1, 6: 2, 22: 1, 24: 2, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	68227-97-4	CN(CCCCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 7, 5: 1, 6: 1, 33: 1, 16: 15, 28: 1, 29: 2}
Did not match all atoms present	68227-98-5	CN(CCCCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 6, 5: 1, 6: 1, 33: 1, 16: 13, 28: 1, 29: 2}
Did not match all atoms present	68227-99-6	CN(CCCCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 5, 5: 1, 6: 1, 33: 1, 16: 11, 28: 1, 29: 2}
Did not match all atoms present	68228-01-3	CC(C)(C)CCCCCCCCCC(C)(C)[S-].CC(C)(C)CCCCCCCCCC(C)(C)[S-].CC(C)(C)CCCCCCCCCC(C)(C)[S-].[Au+3]	{1: 15, 2: 27, 4: 6}
Did not match all atoms present	68228-07-9	CCCCCCCCCCCCCCCCCC1=C2C(=CC=C1)N(C(=N2)S(=O)(=O)[O-])CC3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 17, 35: 1, 33: 1, 14: 7, 29: 6}
Did not match all atoms present	68228-08-0	CCCCCCCCCCCCCCCCCC1=NC2=C(N1)C=CC=C2S(=O)(=O)O	{32: 1, 1: 1, 2: 16, 35: 1, 14: 3, 20: 1, 29: 2}
Did not match all atoms present	68228-12-6	CC1=CC(=C2C(=C1N)C(=O)C3=CC=CC=C3C2=O)NC4=C(C(=CC=C4)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 14: 8, 17: 1, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	68238-95-9	CCCCCCCCCCOCCOCCOCCOCCOCCOP(=O)(O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 1, 2: 31, 33: 2, 20: 8, 22: 6, 29: 1}
Did not match all atoms present	68238-97-1	CC[N+]1(CCN=C1CCCCCCCCCCCCCCCC=C)CCO.CCOS(=O)(=O)[O-]	{1: 2, 2: 19, 35: 1, 5: 1, 6: 1, 11: 2, 15: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	68239-03-2	CC1=CC(=CC(=C1O)CNC(=O)NCC2=C(C=CC(=C2)S(=O)(=O)O)O)S(=O)(=O)O.N.N	{1: 1, 2: 2, 14: 5, 20: 2, 21: 2, 24: 1, 29: 4, 31: 2}
Did not match all atoms present	68239-04-3	B(F)(F)F.B(F)(F)F.CCCCCCCCC=CCCCCCCCC1=NCCN1CCO	{1: 1, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 16: 6, 20: 1}
Did not match all atoms present	68239-07-6	CC(C1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O)C(=O)C(=O)N	{1: 1, 3: 1, 33: 1, 11: 1, 14: 8, 24: 2, 25: 1, 30: 1}
Did not match all atoms present	68239-08-7	C1CCC2(CC1)OC3=C(O2)C=C(C(=C3)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 11: 5, 13: 1, 14: 2, 23: 2}
Did not match all atoms present	68239-09-8	CSC1=[N+](C2=CC=CC=C2C=C1)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 40: 1, 14: 6, 29: 3}
Did not match all atoms present	68239-10-1	CCN(CC)CC.C/C(=C\C1=[N+](C2=CC=CC=C2S1)CCCS(=O)(=O)O)/C=C\3/N(C4=CC=CC=C4S3)CCCS(=O)(=O)[O-]	{1: 4, 2: 9, 33: 3, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 20: 1, 29: 5}
Did not match all atoms present	68239-11-2	CC1=[N+](C2=CC3=C(C=C2S1)OC4(O3)CCCCC4)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 41: 1, 11: 5, 13: 1, 14: 2, 23: 2, 29: 3}
Did not match all atoms present	68239-17-8	CCN1C2=C(C=CC(=C2)C)SC1=CC(=CC3=[N+](C4=C(S3)C=CC5=CC=CC=C54)CCCS(=O)(=O)[O-])C6=CC=CO6	{1: 2, 2: 4, 33: 2, 6: 2, 7: 1, 41: 2, 14: 12, 15: 1, 23: 1, 29: 3}
Did not match all atoms present	68239-18-9	CCN1C2=C(C=CC(=C2)C)SC1=CC(=O)C3=CC=CO3	{1: 2, 2: 1, 6: 1, 33: 1, 41: 1, 14: 6, 15: 1, 23: 1, 24: 1}
Did not match all atoms present	68239-21-4	C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)Cl	{17: 1, 34: 2, 30: 1, 14: 8}
Did not match all atoms present	68239-22-5	C1CC(=O)N(C1=O)CC(C2=CC=CC=C2)O	{33: 1, 2: 1, 3: 1, 11: 2, 14: 5, 20: 1, 25: 2}
Did not match all atoms present	68239-24-7	[2H]C1=C(C(=C(C(=C1N([2H])[2H])[2H])[2H])[N+](=O)[O-])[2H]	{38: 1, 30: 1, 14: 4}
Did not match all atoms present	68239-26-9	CCCCCC[C@@H](C)C1=CC=CC(=C1C(=O)O)C(=O)O.COC1=C(C=C2C(=C1)[C@]34CCN5[C@H]3C[C@@H]6[C@@H]7[C@@H]4N2C(=O)C[C@@H]7OCC=C6C5)OC	{1: 4, 2: 5, 3: 1, 33: 2, 11: 6, 12: 5, 13: 1, 14: 6, 15: 1, 22: 2, 23: 1, 25: 1, 27: 2}
Did not match all atoms present	68239-27-0	C1COCCN1C2=C(C(=O)C2=O)Cl	{17: 1, 11: 4, 25: 2, 33: 1, 23: 1}
Did not match all atoms present	68239-32-7	CCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCC(C[N+](C)(C)C)O.[Cl-]	{1: 7, 2: 3, 3: 1, 5: 3, 6: 1, 7: 2, 17: 1, 20: 1, 28: 3}
Did not match all atoms present	68239-52-1	[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC(=C4C=C(C=CC4=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[OH-].[Cr+3]	{34: 2, 38: 1, 29: 3, 14: 10}
Did not match all atoms present	68239-60-1	CC1=NC2=C(C=CC3=C2C(=C1)C4=CC=CC=C4C3=O)S(=O)(=O)O	{1: 1, 35: 1, 14: 7, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	68239-63-4	CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=C(C=C4)Cl)C)/C2=O	{1: 2, 2: 11, 34: 1, 14: 12, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	68239-64-5	CCCCCCCCCCCCC1=CC=C(C=C1)[N+]#N.[Cl-]	{1: 1, 2: 11, 34: 1, 14: 4, 17: 1}
Did not match all atoms present	68239-66-7	CCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)CC(CS(=O)(=O)[O-])OC(=O)C)C	{1: 3, 2: 3, 3: 1, 33: 2, 14: 2, 17: 2, 28: 1, 29: 3}
Did not match all atoms present	68239-68-9	CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)NC(=O)C)CC)C=C3N(C4=C(O3)C=CC(=C4)NC(=O)C)CC.[O-]Cl(=O)(=O)=O	{1: 5, 2: 3, 33: 2, 6: 2, 7: 1, 14: 6, 15: 1, 17: 1, 23: 2, 24: 2, 29: 4, 31: 2}
Did not match all atoms present	68239-69-0	CCN\1C2=CC=CC=C2O/C1=C/C=C\3/C(=O)N(C(=S)N3CC(=O)[O-])C4=CC=CC=C4.[Na+]	{1: 1, 2: 2, 6: 2, 33: 3, 14: 9, 15: 3, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	68239-70-3	CCN1C2=CC=CC=C2SC1=C3C(=O)N(C(=S)S3)CC(=O)O.CCN(CC)CC	{1: 4, 2: 5, 33: 3, 41: 2, 14: 4, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	68239-71-4	CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)NC2=CC(=C(C=C2)Cl)NC3=NN(C(=O)C3)C4=C(C=C(C=C4Cl)Cl)Cl	{1: 2, 2: 15, 3: 1, 33: 1, 11: 1, 14: 9, 15: 1, 17: 4, 35: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	68239-72-5	CN(CCCCO)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 5, 33: 1, 16: 11, 20: 1, 29: 2}
Did not match all atoms present	68239-73-6	CN(CCCCO)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 8, 33: 1, 16: 17, 20: 1, 29: 2}
Did not match all atoms present	68239-74-7	CN(CCCCO)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 6, 33: 1, 16: 13, 20: 1, 29: 2}
Did not match all atoms present	68239-75-8	CCN(CCC[Si](OC)(OC)OC)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 4, 2: 4, 4: 7, 33: 1, 16: 15, 22: 3, 29: 2}
Did not match all atoms present	68239-76-9	CC1=CC(=C(C(=C1)Br)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4Br)C)Br)C(=O)C5=CC=CC=C5C3=O)Br	{1: 2, 18: 4, 31: 2, 14: 10, 25: 2}
Did not match all atoms present	68239-77-0	CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)C)C)C(=O)C5=CC=CC=C5C3=O)C	{1: 4, 31: 2, 14: 12, 25: 2}
Did not match all atoms present	68239-78-1	CCCCC1=C/C(=N\NC2=C(C=C(C=C2)C3(CCCCC3)C4=CC(=C(C=C4)N/N=C\5/C(=O)C=CC(=C5)CCCC)C)C)/C(=O)C=C1	{1: 4, 2: 6, 34: 2, 11: 5, 13: 1, 14: 12, 15: 4, 25: 2, 31: 2}
Did not match all atoms present	68239-82-7	C1=CC(=C(C=C1[N+](=O)[O-])N)N.OS(=O)(=O)O	{30: 2, 38: 1, 20: 2, 29: 2, 14: 3}
Did not match all atoms present	68239-83-8	C1=CC(=C(C=C1N)[N+](=O)[O-])N.OS(=O)(=O)O	{30: 2, 38: 1, 20: 2, 29: 2, 14: 3}
Did not match all atoms present	68239-84-9	CCN(CC)C1=CC(=CC=C1)O.CCN(CC)C1=CC(=CC=C1)O.OS(=O)(=O)O	{1: 4, 2: 4, 33: 2, 14: 8, 20: 2, 21: 2, 29: 2}
Did not match all atoms present	68239-90-7	CC(CO)O.C=O.C1(=NC(=NC(=N1)N)N)N	{1: 1, 2: 1, 3: 1, 5: 1, 35: 3, 20: 2, 30: 3}
Did not match all atoms present	68239-97-4	CC(COC(=O)C(=C)C)O.CC(=C)C(=O)O.C=CC1=CC=CC=C1	{1: 3, 2: 1, 3: 1, 5: 3, 6: 1, 7: 2, 14: 5, 20: 1, 27: 1, 28: 1}
Did not match all atoms present	68239-98-5	CCO[Si](C=C)(OCC)OCC.C1=CC(=CC(=C1)O)O	{1: 3, 2: 3, 5: 1, 6: 1, 14: 4, 21: 2, 22: 3}
Did not match all atoms present	68240-17-5	CC(C)CCCCCCCCCC=CCCCCC1CC(=O)N(C1=O)C2=CC(=C(C=C2)Cl)NC3=NN(C(=O)C3)C4=C(C=C(C=C4Cl)Cl)Cl	{1: 2, 2: 13, 3: 1, 6: 2, 33: 2, 11: 2, 12: 1, 14: 5, 15: 1, 17: 4, 35: 1, 25: 3, 31: 1}
Did not match all atoms present	68247-85-8	CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)O[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)CO)O)O)O[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCN[C@@H](C)C7=CC=CC=C7)O	{32: 1, 1: 5, 2: 9, 3: 10, 41: 2, 12: 10, 14: 9, 35: 5, 20: 8, 22: 2, 23: 2, 24: 7, 28: 1, 30: 5, 31: 7}
Did not match all atoms present	68258-61-7	COC1=C(C=C(C=C1)[N+](=O)[O-])N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC(=C(C=C4OC)OC)Cl	{1: 3, 34: 1, 38: 1, 14: 10, 15: 2, 17: 1, 22: 3, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	68258-62-8	CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=NNC4=C(C=CC(=C4)Cl)OC)C2=O	{1: 2, 34: 1, 14: 12, 15: 2, 17: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	68258-63-9	COC1=C(C=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC(=C(C=C4OC)OC)Cl	{1: 3, 34: 1, 14: 10, 15: 2, 17: 1, 22: 3, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	68258-65-1	CC(CN(CC(C)O)CC(C)O)O.CC(C)(C)C1=CC=C(C=C1)C(=O)O	{1: 6, 2: 3, 3: 3, 4: 1, 33: 1, 14: 4, 20: 3, 27: 1}
Did not match all atoms present	68258-67-3	CCCC=C(CC)CNC1=CC=CC=C1	{1: 2, 2: 4, 6: 1, 7: 1, 14: 5, 31: 1}
Did not match all atoms present	68258-74-2	CO[Si](CCCNCCN)(OC)OC.C=O	{1: 3, 2: 5, 5: 1, 22: 3, 30: 1, 31: 1}
Did not match all atoms present	68258-98-0	CCCCCCCCOP(=O)(O)O.C(CO)NCCO.OP(=O)(O)O	{1: 1, 2: 11, 20: 7, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	68258-99-1	CC1=NN(C(=O)C1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)N4C(=O)C(C(=N4)C)N/N=C\5/C6=C(C=C(C=C6)[N+](=O)[O-])C(=CC5=O)S(=O)(=O)[O-].[Na+]	{1: 2, 34: 1, 35: 2, 38: 1, 33: 2, 11: 1, 12: 1, 14: 12, 15: 4, 24: 1, 25: 3, 29: 3, 31: 3}
Did not match all atoms present	68259-03-0	COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6)NC(=O)C7=CC(=CC=C7)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 5, 14: 19, 15: 2, 22: 2, 24: 1, 25: 1, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	68259-06-3	C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F)(F)F	{16: 20, 4: 9, 29: 2}
Did not match all atoms present	68259-12-1	C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F	{16: 19, 20: 1, 4: 9, 29: 2}
Did not match all atoms present	68259-13-2	CCCCCCCCCCS(=O)(=O)F	{16: 1, 1: 1, 2: 9, 29: 2}
Did not match all atoms present	68259-16-5	CCC(C(=O)[O-])C1(CCCCC1)O.CCC(C(=O)[O-])C1(CCCCC1)O.[Ca+2]	{1: 2, 2: 2, 3: 2, 11: 10, 13: 2, 20: 2, 24: 2}
Did not match all atoms present	68259-17-6	C1=C(C=C(C(=C1C(=O)Cl)C(=O)Cl)C(=O)Cl)C(=O)Cl	{24: 4, 17: 4, 14: 2}
Did not match all atoms present	68259-18-7	CCN(CC)C1=CC2=C(CC3=C(C=C(C=C32)C)C)C=C1	{1: 4, 2: 2, 11: 1, 14: 5, 33: 1}
Did not match all atoms present	68259-19-8	C1=CC(=CC=C1S(=O)(=O)[O-])Cl.C1=CC(=CC=C1S(=O)(=O)[O-])Cl.C1=CC(=CC=C1S(=O)(=O)[O-])Cl.[Fe+3]	{17: 3, 29: 9, 14: 12}
Did not match all atoms present	68259-22-3	CCCCO[P+](=O)OCCCC.CC1=CC=CC2=NNN=C12	{32: 1, 1: 3, 2: 6, 35: 2, 14: 3, 22: 2, 29: 1}
Did not match all atoms present	68259-25-6	CN(C)CC1=CC=CC=C1O.C=O.C1=CC(=CC(=C1)N)N	{1: 2, 2: 1, 5: 1, 33: 1, 14: 8, 21: 1, 30: 2}
Did not match all atoms present	68259-34-7	CCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C(CO)NCCO	{1: 1, 2: 14, 14: 4, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	68259-35-8	CCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CC(C)N	{1: 3, 2: 10, 3: 1, 14: 4, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	6827-31-2	C1CC2=CC3=CC=CC=C3C=C21	{11: 2, 14: 6}
Did not match all atoms present	68279-54-9	CCC1=CC2=C(C=C1)C(=C3CCCCC3=C2O)O	{1: 1, 2: 1, 11: 4, 21: 2, 14: 3}
Did not match all atoms present	6829-52-3	C#P	{9: 1}
Did not match all atoms present	68291-97-4	C1=CC=C2C(=C1)C(=NO2)CS(=O)(=O)N	{2: 1, 35: 1, 14: 4, 23: 1, 29: 2, 30: 1}
Did not match all atoms present	68295-51-2	CCCCCCCCCC/C=C/C(CC(=O)O)C(=O)OC(C)C(=O)O.CC1=CC=CC2=NNN=C12.CC1=CC=CC2=NNN=C12	{32: 2, 1: 4, 2: 10, 3: 2, 6: 2, 14: 6, 35: 4, 27: 2, 28: 1}
Did not match all atoms present	68298-06-6	CCN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 5, 5: 1, 6: 1, 33: 1, 16: 11, 28: 1, 29: 2}
Did not match all atoms present	68298-07-7	C1=CC=C(C=C1)CNS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 4, 14: 5, 16: 9, 29: 2, 31: 1}
Did not match all atoms present	68298-08-8	C1=CC=C(C=C1)CNS(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 5, 14: 5, 16: 11, 29: 2, 31: 1}
Did not match all atoms present	68298-09-9	C1=CC=C(C=C1)CNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 6, 14: 5, 16: 13, 29: 2, 31: 1}
Did not match all atoms present	68298-10-2	C1=CC=C(C=C1)CNS(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 7, 14: 5, 16: 15, 29: 2, 31: 1}
Did not match all atoms present	68298-15-7	CCCCCCCCCCCC(=O)N(CCN(CC(CS(=O)(=O)[O-])O)CC(=O)[O-])CCO.[Na+].[Na+]	{1: 1, 2: 17, 3: 1, 33: 2, 20: 2, 24: 2, 29: 3}
Did not match all atoms present	68298-16-8	CCCCCCCCCCCC(=O)N(CCN(CCO)CC(=O)[O-])CC(CS(=O)(=O)[O-])O.[Na+].[Na+]	{1: 1, 2: 17, 3: 1, 33: 2, 20: 2, 24: 2, 29: 3}
Did not match all atoms present	68298-17-9	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCO)CC(=O)[O-].[Na+]	{1: 1, 2: 21, 33: 1, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	68298-19-1	CCCCCCCCCC(=O)NCC[N+](CCO)(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+]	{24: 3, 1: 1, 2: 14, 20: 1, 31: 1}
Did not match all atoms present	68298-24-8	C=[N+]1CCCCC1.C1CCN(CC1)C(=S)[S-]	{33: 2, 11: 10, 5: 1, 7: 1}
Did not match all atoms present	68298-27-1	C1=CC=C(C=C1)N2C=CN=C2.C1=CC=C(C=C1)N2C=CN=C2.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{33: 2, 27: 2, 14: 20, 35: 2}
Did not match all atoms present	68298-30-6	CCCCCCCCC(C(CCCCCCCCOP(=O)([O-])OCCCCCCCCC(C(CCCCCCCC)Br)Br)Br)Br.CCCCCCCCC(C(CCCCCCCCOP(=O)([O-])OCCCCCCCCC(C(CCCCCCCC)Br)Br)Br)Br.[Ca+2]	{1: 4, 2: 60, 3: 8, 18: 8, 22: 4, 29: 4}
Did not match all atoms present	68298-32-8	CCCCCCCC/C=C\CCCCCCCC(=O)NCCOC(=O)C(CC(=O)O)S(=O)(=O)[O-].C(CO)N(CCO)CCO.[Na+]	{1: 1, 2: 23, 3: 1, 6: 2, 33: 1, 20: 3, 24: 1, 27: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	68298-34-0	CC=CC(=O)C1=CC2=C(C=C1C)C(CC2(C)C)(C)C	{1: 6, 6: 2, 11: 1, 13: 2, 14: 2, 24: 1}
Did not match all atoms present	68298-37-3	CCCCC(CC)C(=O)OCCS[Sn](CCCC)(CCCC)SCCOC(=O)C(CC)CCCC	{40: 2, 1: 6, 2: 18, 3: 2, 28: 2}
Did not match all atoms present	68298-40-8	CCCCCCCCC(=O)OCCS[Sn](C)(C)SCCOC(=O)CCCCCCCC	{40: 2, 1: 4, 2: 18, 28: 2}
Did not match all atoms present	68298-43-1	CCCC[Sn](SCCOC(=O)CC(C)CC(C)(C)C)(SCCOC(=O)CC(C)CC(C)(C)C)SCCOC(=O)CC(C)CC(C)(C)C	{1: 13, 2: 15, 3: 3, 4: 3, 40: 3, 28: 3}
Did not match all atoms present	68298-45-3	C(C(=O)O)N(CO[P+](=O)O)CO[P+](=O)O	{33: 1, 2: 3, 20: 2, 22: 2, 27: 1, 29: 2}
Did not match all atoms present	68298-46-4	CC1(CC2=C(O1)C(=CC=C2)N)C	{1: 2, 11: 1, 13: 1, 14: 3, 23: 1, 30: 1}
Did not match all atoms present	68298-59-9	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)O)O.C(=O)(O)O	{1: 2, 4: 1, 7: 2, 14: 16, 17: 2, 21: 4, 27: 2}
Did not match all atoms present	68298-60-2	CCCCN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 5, 4: 7, 5: 1, 6: 1, 33: 1, 16: 15, 28: 1, 29: 2}
Did not match all atoms present	68298-71-5	C(CNCCN(CCN)CCN)N.OP(=O)(O)O	{33: 1, 2: 8, 20: 3, 29: 1, 30: 3, 31: 1}
Did not match all atoms present	68298-84-0	CC[N+]1(C2=C(C=CC(=C2)C)SC1=CC(=O)C3=CC=CO3)C.COS(=O)(=O)[O-]	{1: 4, 2: 1, 6: 1, 41: 1, 14: 6, 15: 1, 22: 1, 23: 1, 24: 1, 29: 3}
Did not match all atoms present	68298-85-1	CC[N+]1=C(SC2=CC3=C(C=C21)OC4(O3)CCCCC4)C.[I-]	{1: 2, 2: 1, 33: 1, 41: 1, 11: 5, 13: 1, 14: 2, 19: 1, 23: 2}
Did not match all atoms present	68298-88-4	CC1=CC=CC=C1C.C=CC1=CC=CC=C1	{1: 2, 14: 9, 5: 1, 6: 1}
Did not match all atoms present	68298-89-5	CN(CCCCO)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 7, 33: 1, 16: 15, 20: 1, 29: 2}
Did not match all atoms present	68298-90-8	C(CCCN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])CCN(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[Na+].[Na+]	{33: 2, 2: 10, 29: 12}
Did not match all atoms present	68299-01-4	[Li-].CC[N-]S(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 1, 34: 1, 29: 2, 14: 4}
Did not match all atoms present	68299-04-7	C=O.C1=CC=C(C=C1)O.OP(=O)(O)O	{29: 1, 20: 3, 5: 1, 14: 5, 21: 1}
Did not match all atoms present	68299-07-0	C=CC1CCC=CC1.C=O.C1=CC=C(C=C1)O	{5: 2, 6: 1, 11: 3, 12: 1, 14: 7, 21: 1}
Did not match all atoms present	68299-20-7	C1=CC=C(C(=C1)CNS(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)[O-].[Na+]	{2: 1, 4: 5, 14: 4, 16: 11, 29: 5, 31: 1}
Did not match all atoms present	68299-21-8	C1=CC=C(C(=C1)CNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)[O-].[Na+]	{2: 1, 4: 6, 14: 4, 16: 13, 29: 5, 31: 1}
Did not match all atoms present	68299-22-9	CCCCC1=CC=CC(=C1S(=O)(=O)O[O-])C2=CC=CC=C2.[Na+]	{1: 1, 2: 3, 22: 1, 14: 8, 29: 3}
Did not match all atoms present	68299-25-2	CCC[N+]1=CC=CC=C1.CCOS(=O)(=O)[O-]	{1: 2, 2: 3, 33: 1, 14: 5, 22: 1, 29: 3}
Did not match all atoms present	68299-26-3	C1=C(C(=C(C(=C1Br)Br)Br)Br)OCCOC2=C(C(=C(C(=C2Br)Br)Br)Br)Br	{2: 2, 22: 2, 18: 9, 14: 1}
Did not match all atoms present	68299-27-4	C(COC1=C(C(=C(C(=C1Br)Br)Br)Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Cl	{17: 1, 2: 2, 18: 9, 22: 2}
Did not match all atoms present	68299-28-5	CC1=CC(=CC(=C1S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-].[Na+]	{1: 1, 38: 2, 29: 3, 14: 2}
Did not match all atoms present	68299-29-6	C1=CC=C(C(=C1)CNS(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)[O-].[Na+]	{2: 1, 4: 7, 14: 4, 16: 15, 29: 5, 31: 1}
Did not match all atoms present	683-08-9	CCOP(=O)(C)OCC	{1: 3, 2: 2, 29: 1, 22: 2}
Did not match all atoms present	683-18-1	CCCC[Sn](CCCC)(Cl)Cl	{1: 2, 2: 6, 17: 2}
Did not match all atoms present	683-45-4	C[As](C)C#N	{1: 2, 37: 1}
Did not match all atoms present	683-60-3	CC(C)[O-].[Na+]	{1: 2, 3: 1, 29: 1}
Did not match all atoms present	683-73-8	[2H]C(=C([2H])[2H])[2H]	{5: 2}
Did not match all atoms present	683-85-2	CN(C)P(Cl)Cl	{1: 2, 33: 1, 17: 2}
Did not match all atoms present	6830-78-0	C1=CC=C(C=C1)C2=NN=C(N=N2)C3=CC=CC=C3	{35: 4, 14: 10}
Did not match all atoms present	6830-82-6	CNC(=O)CC1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5, 31: 1}
Did not match all atoms present	68307-81-3	COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3CC2)C(=O)C4=CC=C(C=C4)OCCN5CCCC5.CS(=O)(=O)O	{1: 2, 2: 2, 33: 1, 11: 6, 14: 12, 15: 2, 20: 1, 22: 2, 24: 1, 29: 2}
Did not match all atoms present	68307-88-0	CC(=O)O.C(=O)([O-])[O-].[Ca+2]	{24: 1, 1: 1, 27: 1}
Did not match all atoms present	6831-89-6	C1=CC=C(C=C1)C2=CC=NN2C3=CC=CC=C3	{33: 1, 35: 1, 14: 12}
Did not match all atoms present	6831-91-0	CC1=CC=NN1C2=CC=CC=C2	{1: 1, 35: 1, 14: 7, 33: 1}
Did not match all atoms present	68310-00-9	C1=CC=C2C(=C1)C(=O)C=C(C2=O)[O-].[Na+]	{25: 2, 14: 5, 15: 1}
Did not match all atoms present	68310-01-0	C1=CC(=C(C=C1[N+](=O)[O-])SC#N)N	{40: 1, 38: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	68310-02-1	CCCCN(CCO)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 5, 4: 7, 33: 1, 16: 15, 20: 1, 29: 2}
Did not match all atoms present	68310-05-4	CCNC.CCNC.CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)O)S(=O)(=O)O	{1: 5, 2: 2, 35: 2, 41: 1, 12: 1, 14: 10, 20: 1, 25: 2, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	68310-06-5	C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)N(CCO)CCO)N=NC3=C(C=C(C=C3)[N+](=O)[O-])Cl	{33: 1, 2: 4, 38: 1, 34: 2, 14: 11, 17: 1, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	68310-13-4	[O-]S(=O)[O-].[O-]S(=O)[O-].[K+].[K+].[Pd+2]	{29: 6}
Did not match all atoms present	68310-27-0	CCCCN(C1CC(NC(C1)(C)C)(C)C)C2=NC(=NC(=N2)NCCCN(CCCNC3=NC(=NC(=N3)N(CCCC)C4CC(NC(C4)(C)C)(C)C)N(CCCC)C5CC(NC(C5)(C)C)(C)C)C6=NC(=NC(=N6)N(CCCC)C7CC(NC(C7)(C)C)(C)C)N(CCCC)C8CC(NC(C8)(C)C)(C)C)N(CCCC)C9CC(NC(C9)(C)C)(C)C	{32: 6, 1: 30, 2: 24, 35: 9, 33: 7, 11: 12, 12: 6, 13: 12, 31: 2}
Did not match all atoms present	68310-28-1	COC(=O)C=C.C=[C-]C1=CC=CC=C1.[NH4+]	{1: 1, 14: 5, 28: 1, 5: 2, 6: 1}
Did not match all atoms present	68310-32-7	CC(C)CCCCCC1=C(C=CC(=C1S(=O)(=O)O)S(=O)(=O)O)O	{1: 2, 2: 5, 3: 1, 14: 2, 20: 2, 21: 1, 29: 4}
Did not match all atoms present	68310-48-5	C1=CC(=CC=C1CO)C2=CC(=C3C(=C2N)C(=O)C4=C(C=CC(=C4C3=O)N)O)O	{2: 1, 14: 7, 20: 1, 21: 2, 25: 2, 30: 2}
Did not match all atoms present	68310-49-6	CC1=C(C=CC=C1NC(=O)N2CCCCCC2=O)N3C(=O)N(C(=O)N(C3=O)C4=C(C(=CC=C4)NC(=O)N5CCCCCC5=O)C)C6=C(C(=CC=C6)NC(=O)N7CCCCCC7=O)C	{1: 3, 33: 6, 11: 15, 14: 9, 24: 3, 25: 6, 31: 3}
Did not match all atoms present	68310-60-1	CC1(C2CC=C(C1C2)CCOC=O)C	{1: 2, 2: 2, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 26: 1}
Did not match all atoms present	68310-69-0	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N=NC3=C4C=C(C=CC4=C(C=C3)N)S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 34: 2, 29: 6, 14: 11}
Did not match all atoms present	68310-70-3	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N=NC3=C4C=C(C=CC4=C(C=C3)N=NC5=C6C=C(C=CC6=C(C=C5)N/N=C/7\C(=CC8=C(C7=O)C=CC(=C8)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 5, 14: 20, 15: 2, 25: 1, 29: 12, 30: 1, 31: 1}
Did not match all atoms present	68310-73-6	CCCCCCCCC=CCCCCCCCC[N+](C)(C)CCC[N+](C)(C)C.[Cl-].[Cl-]	{1: 6, 2: 18, 6: 2, 17: 2}
Did not match all atoms present	68310-78-1	CC(C)(CO)N.C=CC1=CC=CC=C1.C=CC(=O)O	{1: 2, 2: 1, 4: 1, 5: 2, 6: 2, 14: 5, 20: 1, 27: 1, 30: 1}
Did not match all atoms present	68310-79-2	C=CC1=CC=CC=C1.C=CC(=O)O.C1COCCN1	{32: 1, 5: 2, 6: 2, 11: 4, 14: 5, 23: 1, 27: 1}
Did not match all atoms present	68310-81-6	CC(C)N[Si](C)(C)OC(C)(C)C	{1: 7, 3: 1, 4: 1, 22: 1, 31: 1}
Did not match all atoms present	68310-82-7	C1=CC=C2C=C(C(=CC2=C1)CC3=C(C=CC(=C3)O)S(=O)(=O)C4=CC=C(C=C4)O)S(=O)(=O)O	{2: 1, 20: 1, 21: 2, 14: 13, 29: 4}
Did not match all atoms present	68310-83-8	C(=O)[O-].C(=O)[O-].C(=O)[O-].[NH4+].[Cu+2]	{26: 3}
Did not match all atoms present	68310-86-1	CC(C)(C)NSC(=S)N1CCOCC1	{1: 3, 4: 1, 33: 1, 7: 1, 40: 1, 11: 4, 23: 1, 31: 1}
Did not match all atoms present	68310-87-2	CC(C)CC(C)NC1=CC=C(C=C1)OCCOC2=CC=C(C=C2)NC(C)CC(C)C	{1: 6, 2: 4, 3: 4, 14: 8, 22: 2, 31: 2}
Did not match all atoms present	68310-88-3	CC1=C2C3=CC=CC=C3C(=CC2=C(C4=CC=CC=C14)COC(=O)C)F	{16: 1, 1: 2, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	68310-89-4	CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C.C1=CC=C(C=C1)C(=O)[O-]	{24: 1, 1: 4, 41: 1, 14: 12, 33: 2}
Did not match all atoms present	68315-30-0	CC(C)(C)[N+](=CC1=CC=CC=C1)[O-]	{1: 3, 4: 1, 6: 1, 33: 1, 14: 5, 29: 1}
Did not match all atoms present	68318-34-3	C1(C(C(C(C(C1(F)S(=O)(=O)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	{16: 14, 4: 1, 13: 6, 29: 2}
Did not match all atoms present	68318-37-6	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)NC5=CC=CC(=O)C5=C4)O	{32: 1, 1: 1, 2: 1, 33: 1, 11: 2, 13: 1, 14: 5, 20: 1, 25: 2, 28: 1}
Did not match all atoms present	6832-13-9	C(=C[O-])[N+]#N	{34: 1, 6: 2}
Did not match all atoms present	6832-16-2	COC(=C[N+]#N)[O-]	{1: 1, 34: 1, 22: 1, 6: 1, 7: 1}
Did not match all atoms present	6832-21-9	CC(C)C1=NC(=CC=C1)C(C)C	{1: 4, 3: 2, 14: 3, 35: 1}
Did not match all atoms present	6832-93-5	CCCC(=O)NC1=CC(=CC=C1)Cl	{1: 1, 2: 2, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	6832-98-0	CCCCCCCCCCCCCCCC(=O)NC1=CC=CC=C1	{24: 1, 1: 1, 2: 14, 14: 5, 31: 1}
Did not match all atoms present	68322-84-9	C1=CC(=C(C=C1C(F)(F)F)Br)F	{16: 4, 18: 1, 4: 1, 14: 3}
Did not match all atoms present	68332-64-9	CC(C)(C)C1=CC=C(C=C1)OCCO.OP(=O)(O)O	{1: 3, 2: 2, 4: 1, 14: 4, 20: 4, 22: 1, 29: 1}
Did not match all atoms present	68334-44-1	CCCCC(CC)COC(=O)C=C.CC1=CC=CC=C1C=C.CC(=C)C(=O)O	{1: 4, 2: 5, 3: 1, 5: 3, 6: 2, 7: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	68334-54-3	C[N+](C)(C)CC(COCCCCCCOCC(C[N+](C)(C)C)O)O.Cl.Cl	{1: 6, 2: 10, 3: 2, 17: 2, 20: 2, 22: 2}
Did not match all atoms present	68334-55-4	CCCCCCCCCCCCCOCC(C[N+](C)(C)C)O.[Cl-]	{1: 4, 2: 14, 3: 1, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	68334-62-3	CP(=O)(CCC(=O)OCCO)O	{1: 1, 2: 4, 20: 2, 29: 1, 28: 1}
Did not match all atoms present	68334-63-4	C.C.C[N+]1=C(SC2=CC=CC=C21)C3=CC=C(C=C3)N(C)C.C[N+]1=C(SC2=CC=CC=C21)C3=CC=C(C=C3)N(C)C.C[N+]1=C(SC2=CC=CC=C21)C3=CC=C(C=C3)N(C)C	{1: 9, 41: 3, 14: 24, 33: 6}
Did not match all atoms present	68334-64-5	C.C.CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=CC=C3.CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=CC=C3.CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=CC=C3	{1: 12, 2: 12, 33: 6, 7: 3, 14: 39, 15: 6}
Did not match all atoms present	68334-66-7	C1=CC2=C(C(=C1)S(=O)(=O)O)C(=O)NS2(=O)=O	{32: 1, 25: 1, 20: 1, 29: 4, 14: 3}
Did not match all atoms present	68334-68-9	C1=CC=C(C(=C1)C=CC(=O)N=CC2=CC=CC=C2Cl)Cl	{24: 1, 17: 2, 34: 1, 14: 8, 6: 3}
Did not match all atoms present	68334-70-3	CCCCCCCCCCCCCCCCCCCCCC(=O)NCN(CNC(=O)CCCCCCCCCCCCCCCCCCCCC)C1=NC(=NC(=N1)N(COC)COC)N(COC)COC	{1: 6, 2: 46, 35: 3, 33: 3, 22: 4, 24: 2, 31: 2}
Did not match all atoms present	68334-75-8	CC(C)(C)C1=CC(=C(C=C1)O)O.C=O	{1: 3, 4: 1, 5: 1, 14: 3, 21: 2}
Did not match all atoms present	68334-81-6	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC(=CC=C1O)SC2=CC=C(C=C2)O	{1: 5, 2: 1, 4: 2, 5: 1, 40: 1, 14: 12, 21: 3}
Did not match all atoms present	68334-85-0	CC1CO1.CC(C[O-])O.C(C(CO)O)O.[K+]	{1: 2, 2: 3, 3: 2, 11: 1, 12: 1, 20: 4, 23: 1, 29: 1}
Did not match all atoms present	68334-89-4	CC1=CCC(CC1)C(C)(C)O.CC1=C(C=CC=C1N=C=O)N=C=O.C1C=CC2C1C3CC2CC3O	{1: 4, 34: 2, 4: 1, 8: 2, 11: 6, 12: 6, 14: 6, 15: 1, 20: 2, 29: 2}
Did not match all atoms present	68334-91-8	CCCCOC(=O)C=C.CC1=CC=CC=C1C=C.C=CC(=O)OC1C=CC2C1C3CC2C=C3	{1: 2, 2: 3, 5: 3, 6: 3, 11: 1, 12: 5, 14: 8, 28: 2}
Did not match all atoms present	68337-15-5	C1=CC(=CC=C1N2C=NC=N2)O	{33: 1, 35: 2, 21: 1, 14: 6}
Did not match all atoms present	6834-42-0	COC1=CC=CC(=C1)CC(=O)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	6834-92-0	[O-][Si](=O)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	68343-44-2	[Te]1[Te][Te][Te][Te][Te]1	{}
Did not match all atoms present	68343-65-7	CCCCCCCC(C)CCC1=CC(=CC=C1)S(=O)(=O)Cl	{1: 2, 2: 8, 3: 1, 14: 4, 17: 1, 29: 2}
Did not match all atoms present	68345-19-7	CCOC1=CC2=C(C=C1)N=C(S2)[N-]C(=O)CC(=O)C.[Na+]	{1: 2, 2: 2, 35: 1, 41: 1, 34: 1, 14: 3, 22: 1, 24: 2}
Did not match all atoms present	68345-20-0	CCN(CC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CC)CC)C3=C(C=CC4=C3C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 2: 4, 3: 1, 33: 2, 14: 13, 20: 2, 29: 4}
Did not match all atoms present	68345-21-1	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N/N=C\5/C(=CC6=CC(=CC(=C6C5=O)OS(=O)(=O)C7=CC=C(C=C7)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C.[Na+].[Na+]	{1: 4, 34: 3, 14: 21, 15: 2, 22: 2, 25: 1, 29: 10, 31: 1}
Did not match all atoms present	68345-24-4	CC1(CC(C2=C1C=CC(=C2)C(=O)O)(C)C3=CC=C(C=C3)C(=O)O)C.C1CC(CCC1CO)CO.C(CCO)CO	{1: 3, 2: 6, 11: 5, 12: 2, 13: 2, 14: 7, 20: 4, 27: 2}
Did not match all atoms present	68345-30-2	B(O)(O)O.C(CO)NCCO.C(CO)N(CCO)CCO	{33: 1, 2: 10, 20: 8, 31: 1}
Did not match all atoms present	68348-77-6	C1=CC(=CC=C1NC2=CC=C(C=C2)[N+]#N)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 4, 34: 2, 14: 8, 31: 1}
Did not match all atoms present	68358-79-2	CC1=CC=C(C=C1)CCOC2=CC=C(C=C2)NC(=O)N(C)OC	{1: 3, 2: 2, 33: 1, 14: 8, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	68359-37-5	CC1(C(C1C(=O)OC(C#N)C2=CC(=C(C=C2)F)OC3=CC=CC=C3)C=C(Cl)Cl)C	{1: 2, 3: 1, 37: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 8, 16: 1, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	6836-19-7	COC1=CC2=C(CCCC2=O)C=C1	{1: 1, 11: 3, 22: 1, 14: 3, 25: 1}
Did not match all atoms present	68364-22-7	C[Si](C)(C)OC1=CC2CC1C=C2	{1: 3, 11: 1, 12: 2, 14: 3, 15: 1, 22: 1}
Did not match all atoms present	68364-29-4	CC(=C1C2CCC1C3=C(C=CC(=C23)OC)OC)C	{1: 4, 7: 1, 11: 2, 12: 2, 14: 2, 15: 1, 22: 2}
Did not match all atoms present	68368-33-2	CC(C)(C)C1=CC=C(C=C1)C(=O)N(CCO)CCO	{1: 3, 2: 4, 4: 1, 33: 1, 14: 4, 20: 2, 24: 1}
Did not match all atoms present	68368-34-3	CC1=C(C=CC(=C1S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=CC2=O)Cl.CC1=C(C=CC(=C1S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=CC2=O)Cl.[Ba+2]	{1: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68368-35-4	CC1=CC(=C(C(=C1Cl)N/N=C\2/C3=CC=CC=C3C=CC2=O)S(=O)(=O)[O-])Cl.CC1=CC(=C(C(=C1Cl)N/N=C\2/C3=CC=CC=C3C=CC2=O)S(=O)(=O)[O-])Cl.[Ba+2]	{1: 2, 34: 2, 14: 14, 15: 2, 17: 4, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68368-36-5	CC1=C(C=C(C(=C1Cl)N/N=C\2/C3=CC=CC=C3C=CC2=O)S(=O)(=O)[O-])Cl.CC1=C(C=C(C(=C1Cl)N/N=C\2/C3=CC=CC=C3C=CC2=O)S(=O)(=O)[O-])Cl.[Ba+2]	{1: 2, 34: 2, 14: 14, 15: 2, 17: 4, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68368-37-6	CC1=CC(=C(C(=C1Cl)N)S(=O)(=O)O)Cl	{1: 1, 14: 1, 17: 2, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	68368-38-7	CC1=C(C=CC(=C1S(=O)(=O)O)N)Cl	{1: 1, 14: 2, 17: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	68368-39-8	CC1=C(C=CC(=C1S(=O)(=O)O)[N+](=O)[O-])Cl	{1: 1, 38: 1, 14: 2, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	68368-40-1	CC1=C(C=C(C(=C1Cl)[N+](=O)[O-])S(=O)(=O)O)Cl	{1: 1, 38: 1, 14: 1, 17: 2, 20: 1, 29: 2}
Did not match all atoms present	68368-41-2	CC1=CC(=C(C(=C1Cl)[N+](=O)[O-])S(=O)(=O)O)Cl	{1: 1, 38: 1, 14: 1, 17: 2, 20: 1, 29: 2}
Did not match all atoms present	68368-42-3	CC(C)C1=C(C=C(C=C1)[N+](=O)[O-])COC	{1: 3, 2: 1, 3: 1, 38: 1, 14: 3, 22: 1}
Did not match all atoms present	68368-43-4	C[N+]1(CCOCC1)CCl.[Br-]	{1: 1, 2: 1, 11: 4, 17: 1, 18: 1, 23: 1}
Did not match all atoms present	68368-45-6	CC(=O)[CH2-].C=O.[Na+]	{24: 1, 1: 1, 5: 2}
Did not match all atoms present	68368-49-0	CCCCCCCCCOP(=O)(O)O.C(CO)N(CCO)CCO	{1: 1, 2: 14, 33: 1, 20: 5, 22: 1, 29: 1}
Did not match all atoms present	6837-93-0	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC3=CC(=CC(=C32)N)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 14: 8, 20: 2, 22: 1, 29: 6, 30: 1}
Did not match all atoms present	6837-97-4	C1=CC(=C2C(=C1O)C(=O)C3=C(C=CC(=C3C2=O)O)Cl)Cl	{17: 2, 21: 2, 14: 4, 25: 2}
Did not match all atoms present	683737-82-8	[O].[O].[Sb-]	{}
Did not match all atoms present	68377-91-3	CC(C)(C)NCC(CSC1=NC(=CS1)C2=CC=C(S2)C(=O)N)O.Cl	{1: 3, 2: 2, 3: 1, 4: 1, 40: 1, 41: 2, 14: 3, 17: 1, 35: 1, 20: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	68378-99-4	CC12CN(P(=[Se])(N(C1)C)N(C2)C)C	{1: 4, 11: 3, 13: 1, 33: 3}
Did not match all atoms present	6838-01-3	CC1=NN(C(=O)C1)C2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 35: 1, 33: 1, 11: 1, 14: 5, 15: 1, 20: 2, 25: 1, 29: 4}
Did not match all atoms present	68385-79-5	CC(=O)NC1=CC(=C(C=C1)OCCOC)N	{1: 2, 2: 2, 14: 3, 22: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	68385-95-5	C1=C(C=C(C(=C1Br)N)C#N)Br	{18: 2, 30: 1, 14: 2, 37: 1}
Did not match all atoms present	68389-40-2	CC(C)CCCCCCCOP(=O)([O-])[O-].[K+].[K+]	{1: 2, 2: 7, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	68389-44-6	C=CC(=O)[O-].C(CO)N(CCO)CC(CCl)O.[Na+]	{33: 1, 2: 6, 3: 1, 5: 1, 6: 1, 17: 1, 20: 3, 24: 1}
Did not match all atoms present	68389-46-8	C1=CC=C(C=C1)N.C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C3=CC=C(C=C3)N)O)N	{20: 1, 4: 1, 30: 4, 14: 17}
Did not match all atoms present	68389-47-9	CCCCC(CC)COP(=S)(OCC(C)C)S	{1: 4, 2: 6, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	68389-50-4	C=O.C(=O)O.C(#N)N=C(N)N	{34: 1, 5: 1, 7: 1, 26: 1, 27: 1, 30: 2, 37: 1}
Did not match all atoms present	68389-55-9	C1=CC=C(C=C1)C(=O)OCCOCCOCCO.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{2: 6, 14: 9, 20: 1, 22: 2, 27: 2, 28: 1}
Did not match all atoms present	68389-56-0	CCCCCCCCC(=O)OCC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 1, 2: 9, 3: 1, 14: 4, 20: 2, 28: 3}
Did not match all atoms present	68389-58-2	CCCCCCCCC(=O)OCC(C)(C)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O	{1: 3, 2: 13, 4: 2, 14: 4, 20: 5, 28: 3}
Did not match all atoms present	68389-61-7	CCCCC(CC)C(=O)OCC(CC)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 3, 2: 8, 3: 1, 4: 1, 14: 4, 20: 2, 28: 3}
Did not match all atoms present	68389-65-1	CCCCCCC(=O)O.CC(C)(CO)COC(=O)C(C)(C)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O	{1: 5, 2: 12, 4: 3, 14: 4, 20: 6, 27: 1, 28: 3}
Did not match all atoms present	68389-76-4	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C1CN(C=N1)CCN	{1: 1, 2: 13, 35: 1, 33: 1, 11: 2, 14: 5, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	68389-77-5	C1CN(C=N1)CCN.C(COP(=O)(O)O)N(CCOP(=O)(O)O)CCOP(=O)(O)O	{33: 2, 2: 8, 35: 1, 11: 2, 14: 1, 20: 6, 22: 3, 29: 3, 30: 1}
Did not match all atoms present	6839-93-6	CP(=S)(C)Br	{1: 2, 18: 1}
Did not match all atoms present	68390-52-3	CCCCCCCC(CCCCCCCC1=CC=CC=C1O)C2=CC=CC=C2O	{1: 1, 2: 13, 3: 1, 21: 2, 14: 8}
Did not match all atoms present	68391-16-2	CCCCC(CC)C=O.C=O.C1=CC=C(C=C1)[NH-].[Na+]	{1: 2, 2: 4, 3: 1, 36: 1, 5: 1, 14: 5, 26: 1}
Did not match all atoms present	68391-21-9	C1=CC=C(C=C1)C2=NC=CN2C(=O)C3=CC=C(C=C3)C(=O)O	{24: 1, 33: 1, 27: 1, 14: 11, 35: 1}
Did not match all atoms present	68391-30-0	C[N+](C)(C)C1=CC\2=C(C=C1)C=CC(=O)/C2=N\NC3=CC=CC=C3OC.[Cl-]	{1: 4, 34: 1, 14: 9, 15: 1, 17: 1, 22: 1, 25: 1, 31: 1}
Did not match all atoms present	68391-38-8	C1=CC(=CC=C1N)N/N=C\2/C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)[O-].[Na+]	{34: 3, 14: 10, 15: 2, 20: 1, 25: 1, 29: 5, 30: 3, 31: 1}
Did not match all atoms present	68391-43-5	C1=CC(=C(C=C1[N+](=O)[O-])Cl)[N+]#N.C1=CC(=C(C=C1[N+](=O)[O-])Cl)[N+]#N.[O-]S(=O)(=O)[O-]	{17: 2, 34: 2, 38: 2, 29: 4, 14: 6}
Did not match all atoms present	68391-44-6	C1=CC=C2C(=C1)C(=CC=C2N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])[N+](=O)[O-])NCCO	{2: 2, 38: 2, 34: 2, 14: 8, 18: 1, 20: 1, 31: 1}
Did not match all atoms present	68391-45-7	C1=C(C=C(C(=C1Cl)[N+]#N)Cl)[N+](=O)[O-].C1=C(C=C(C(=C1Cl)[N+]#N)Cl)[N+](=O)[O-].[O-]S(=O)(=O)[O-]	{17: 4, 34: 2, 38: 2, 29: 4, 14: 4}
Did not match all atoms present	68391-46-8	C1=CC(=C(C=C1N(CCC#N)CCC#N)Cl)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{33: 1, 2: 4, 37: 2, 38: 1, 34: 2, 14: 6, 17: 2}
Did not match all atoms present	68391-48-0	C1=CC=C(C=C1)N(CCOCCC#N)CCOCCC#N	{33: 1, 2: 8, 22: 2, 14: 5, 37: 2}
Did not match all atoms present	68391-49-1	C1=CC(=CC=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)N(CCOCCC#N)CCOCCC#N	{33: 1, 2: 8, 37: 2, 38: 1, 34: 2, 14: 7, 17: 1, 22: 2}
Did not match all atoms present	68391-51-5	CC1=C(C=CC(=C1)NCCC#N)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 1, 2: 2, 37: 1, 38: 1, 34: 2, 14: 6, 17: 1, 31: 1}
Did not match all atoms present	68391-57-1	CC[N+]1=C(C(C2=C1C=CC(=C2)C)(C)C)C.[I-]	{1: 5, 2: 1, 33: 1, 13: 1, 14: 3, 15: 1, 19: 1}
Did not match all atoms present	68391-65-1	CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F	{1: 1, 2: 12, 4: 1, 14: 4, 16: 3, 24: 2}
Did not match all atoms present	68398-22-1	CCCCC(C)(C)C(=O)[O-].CCCCC(C)(C)C(=O)[O-].[Ca+2]	{24: 2, 1: 6, 2: 6, 4: 2}
Did not match all atoms present	68399-63-3	C(CN(CCN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])CP(=O)([O-])[O-])N.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 7, 29: 9, 30: 1}
Did not match all atoms present	68399-66-6	CCCCCCCCCC/C=C/C1CC(=O)OC1=O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl	{1: 3, 2: 10, 4: 1, 6: 2, 11: 2, 12: 2, 14: 8, 17: 1, 21: 2, 23: 1, 28: 2}
Did not match all atoms present	68399-69-9	CCCC1=CC(=C(C=C1)OCC)O	{1: 2, 2: 3, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	68399-70-2	CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC=CC=C4[N+](=O)[O-])/C2=O	{1: 1, 34: 1, 38: 1, 14: 13, 15: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	68399-72-4	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)C5=NC6=C(S5)C=C(C=C6)C7=NC8=C(S7)C(=C(C=C8)C)S(=O)(=O)O)S(=O)(=O)O	{1: 2, 34: 2, 35: 3, 41: 3, 14: 15, 20: 2, 29: 4}
Did not match all atoms present	68399-73-5	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5.CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5.[Ba+2]	{1: 4, 2: 8, 33: 4, 7: 2, 14: 42, 15: 4, 29: 12}
Did not match all atoms present	68399-74-6	C1=CC=C2C(=C1)C=CC=C2N/N=C\3/C4=C(C=C(C=C4)S(=O)(=O)[O-])C=C(C3=O)S(=O)(=O)[O-].[Ba+2]	{34: 1, 14: 11, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	68399-76-8	C1=C(NC(=O)NC1=O)C(=O)[O-].C1=C(NC(=O)NC1=O)C(=O)[O-].[Zn+2]	{24: 2, 25: 4, 14: 2, 32: 4}
Did not match all atoms present	68399-77-9	C1COCCN1CC(CS(=O)(=O)O)O	{33: 1, 2: 2, 3: 1, 11: 4, 20: 2, 23: 1, 29: 2}
Did not match all atoms present	68399-78-0	C1CN(CCN1CCO)CC(CS(=O)(=O)O)O	{33: 2, 2: 4, 3: 1, 11: 4, 20: 3, 29: 2}
Did not match all atoms present	68399-79-1	CC(C)(CO)NCC(CS(=O)(=O)O)O	{1: 2, 2: 3, 3: 1, 4: 1, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	68399-80-4	C(CO)N(CCO)CC(CS(=O)(=O)O)O	{33: 1, 2: 6, 3: 1, 20: 4, 29: 2}
Did not match all atoms present	68399-81-5	C(C(CS(=O)(=O)O)O)NC(CO)(CO)CO	{2: 5, 3: 1, 4: 1, 20: 5, 29: 2, 31: 1}
Did not match all atoms present	68399-82-6	CN(C)C1=C(C=C(C(=C1)Cl)[N+]#N)OC.[Cl-]	{1: 3, 34: 1, 33: 1, 14: 2, 17: 2, 22: 1}
Did not match all atoms present	68399-83-7	C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.OS(=O)(=O)O	{35: 2, 20: 2, 29: 2, 14: 16}
Did not match all atoms present	68399-86-0	CCOC1=CC(=C(C=C1C2=CC=C(C=C2)[N+]#N)OCC)OCC.C(=O)(C(=O)[O-])O	{1: 3, 2: 3, 34: 1, 14: 6, 22: 3, 24: 1, 27: 1}
Did not match all atoms present	68399-87-1	CC1=C(C=C(C=C1N2C(=O)C(C(=N2)C(=O)O)N=NC3=CC=CC=C3S(=O)(=O)O)NC(=O)C4=CC(=NN=C4Cl)Cl)S(=O)(=O)O	{1: 1, 34: 2, 35: 3, 33: 1, 12: 1, 14: 7, 15: 1, 17: 2, 20: 2, 24: 1, 25: 1, 27: 1, 29: 4, 31: 1}
Did not match all atoms present	68399-88-2	C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)O)N=NC3=C(C=C(C=C3)NC(=O)C4=CC(=NN=C4Cl)Cl)S(=O)(=O)O)S(=O)(=O)O	{33: 1, 34: 2, 35: 3, 12: 1, 14: 8, 15: 1, 17: 2, 20: 2, 24: 1, 25: 1, 27: 1, 29: 4, 31: 1}
Did not match all atoms present	68399-89-3	CC(=O)NC1=CC2=C(C=C1)C(=O)/C(=N\NC3=C(C4=C(C=C3)C=C(C=C4)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)/C(=C2)S(=O)(=O)O	{1: 1, 2: 2, 34: 1, 14: 9, 15: 2, 20: 3, 22: 1, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	68399-90-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)O)S(=O)(=O)O)N	{34: 2, 14: 13, 20: 2, 25: 2, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	68399-91-7	CCN(CCOS(=O)(=O)O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)CCOS(=O)(=O)O	{1: 1, 2: 5, 33: 1, 34: 2, 14: 8, 20: 2, 22: 2, 29: 6}
Did not match all atoms present	68399-92-8	C1=CC(=CC=C1N=NC2=C(C=C(C=C2)N(CCOS(=O)(=O)O)CCOS(=O)(=O)O)Cl)S(=O)(=O)CCOS(=O)(=O)O	{33: 1, 2: 6, 34: 2, 14: 7, 17: 1, 20: 3, 22: 3, 29: 8}
Did not match all atoms present	68399-94-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)S(=O)(=O)CCO)S(=O)(=O)O)N	{2: 2, 14: 9, 20: 2, 25: 2, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	68399-95-1	CC1=C(C=C(C(=C1Cl)NC(=O)C)Cl)Br	{1: 2, 14: 1, 17: 2, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	68399-96-2	COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=CC=C(C=C4)S(=O)(=O)[O-])/C2=O.[Na+]	{1: 1, 34: 1, 14: 13, 15: 2, 22: 1, 24: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	68399-97-3	C1=CC=C2C(=C1)C(=CC(=C2N)S(=O)(=O)O)Br	{18: 1, 30: 1, 20: 1, 29: 2, 14: 5}
Did not match all atoms present	68399-98-4	CCOC(=O)C1=C2C3=C4C(=C(C=C3)N5CCOCC5)C=CC=C4C(=O)N2NC1=O	{32: 1, 1: 1, 2: 1, 33: 2, 11: 4, 14: 5, 23: 1, 25: 2, 28: 1}
Did not match all atoms present	684-00-4	C(C([Si](Cl)(Cl)Cl)Cl)Cl	{17: 5, 2: 1, 3: 1}
Did not match all atoms present	684-20-8	C[Sb](C(F)(F)F)C(F)(F)F	{16: 6, 1: 1, 4: 2}
Did not match all atoms present	684-82-2	CCC(C)[As](Cl)Cl	{1: 2, 2: 1, 3: 1, 17: 2}
Did not match all atoms present	68400-00-0	C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(/C(=N\NC4=C(C5=C(C=C4)C=C(C=C5)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)/C3=O)S(=O)(=O)O	{2: 2, 34: 1, 14: 13, 15: 2, 20: 4, 22: 1, 24: 1, 25: 1, 29: 10, 31: 2}
Did not match all atoms present	68400-02-2	COC1=C(C=C(C=C1)N)S(=O)(=O)CCO.Cl	{1: 1, 2: 2, 14: 3, 17: 1, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	68400-09-9	C(CNCCN)C[Si](O)(O)O	{2: 5, 20: 3, 30: 1, 31: 1}
Did not match all atoms present	68400-12-4	CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)O)O.CC(C)(C1CCC(CC1)O)C2CCC(CC2)O.C1=CC(=O)OC1=O	{1: 6, 2: 2, 3: 2, 4: 2, 11: 8, 12: 4, 14: 10, 20: 4, 22: 2, 28: 2}
Did not match all atoms present	68400-15-7	C=O.C(COCCO)O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.C1(=NC(=NC(=N1)N)N)N	{2: 7, 35: 3, 5: 1, 12: 8, 13: 1, 20: 10, 22: 2, 23: 2, 30: 3}
Did not match all atoms present	68400-17-9	CC(C(=O)O)O.C=O.C1=CC=C(C=C1)O.C1=COC(=C1)C=O	{1: 1, 3: 1, 5: 1, 14: 8, 20: 1, 21: 1, 23: 1, 26: 1, 27: 1}
Did not match all atoms present	68400-20-4	CCOC1=C(C=CC(=C1)N(C)CC2=CC=CC=C2)[N+]#N.CCOC1=C(C=CC(=C1)N(C)CC2=CC=CC=C2)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 4, 33: 2, 34: 2, 14: 16, 17: 4, 22: 2}
Did not match all atoms present	68400-21-5	[H+].[H+].CN(C1=CC2=C(C(=C(C=C2C=C1)S(=O)(=O)[O-])N=NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)C=C.[Cu+2]	{1: 1, 34: 2, 5: 1, 6: 1, 33: 1, 14: 9, 29: 8}
Did not match all atoms present	68400-22-6	[H+].[H+].CC(=O)/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)[O-])[O-])/C(=NC2=CC=C(C=C2)S(=O)(=O)CCOS(=O)(=O)[O-])[O-].[Cu+2]	{1: 1, 2: 2, 7: 2, 34: 2, 14: 7, 22: 1, 24: 1, 29: 8, 31: 1}
Did not match all atoms present	68400-23-7	[H+].[H+].[H+].[H+].C1=CC2=C(C(=C(C=C2C=C1N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC5=C(C=C(C=C5)S(=O)(=O)CCOS(=O)(=O)[O-])[O-])[O-].[Cu+2]	{2: 2, 34: 3, 14: 10, 15: 2, 22: 1, 25: 1, 29: 14, 30: 1, 31: 1}
Did not match all atoms present	68400-25-9	C.C.CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C.CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C.CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C.CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C	{1: 16, 41: 4, 14: 28, 33: 8}
Did not match all atoms present	68400-29-3	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])NN=C3C=CC(=O)C=C3.[Na+]	{1: 1, 34: 3, 14: 11, 15: 1, 22: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68400-30-6	CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=CC4=C(/C(=N/NC5=C(C=C(C6=C5C=CC(=C6)S(=O)(=O)O)N/N=C\7/C=CC(=O)C(=C7)C(=O)O)OC)/C(=O)C=C4C=C3)S(=O)(=O)O	{1: 2, 34: 4, 35: 1, 33: 1, 12: 1, 14: 16, 15: 5, 20: 2, 22: 1, 25: 3, 27: 1, 29: 4, 31: 2}
Did not match all atoms present	68400-32-8	COC1=C(C2=CC=CC=C2C(=C1)N/N=C\3/C=C(C(=O)C=C3)C(=O)O)[N+]#N.COC1=C(C2=CC=CC=C2C(=C1)N/N=C\3/C=C(C(=O)C=C3)C(=O)O)[N+]#N.[O-]S(=O)(=O)[O-]	{1: 2, 34: 4, 14: 16, 15: 4, 22: 2, 25: 2, 27: 2, 29: 4, 31: 2}
Did not match all atoms present	68400-33-9	C1=CC(=CC(=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=CC(=C6)NC(=O)C(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 16, 15: 4, 24: 5, 25: 2, 29: 6, 31: 6}
Did not match all atoms present	68400-34-0	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])OC)NN=C3C=CC(=O)C=C3.[Na+]	{1: 2, 34: 3, 14: 10, 15: 1, 22: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68400-35-1	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)OC)N.Cl	{1: 2, 34: 2, 14: 6, 17: 1, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	68400-37-3	C1=CC(=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)O)OCCOS(=O)(=O)O	{2: 2, 34: 1, 14: 8, 15: 2, 20: 2, 22: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	68400-38-4	CCCCCCCCCCCCCCCCCCCC(N1CCNC1)OC(=O)N.CCOP(=O)(O)O	{32: 1, 1: 2, 2: 19, 3: 1, 33: 1, 11: 3, 20: 2, 22: 1, 28: 1, 29: 1, 30: 1}
Did not match all atoms present	68400-40-8	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)O)S(=O)(=O)C4=CC=C(C=C4)C	{1: 2, 2: 2, 33: 1, 34: 2, 14: 16, 20: 1, 29: 4}
Did not match all atoms present	68400-41-9	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)NN=C3C=CC(=O)C=C3	{1: 1, 34: 3, 14: 11, 15: 1, 20: 1, 22: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	68400-42-0	CC(=O)C(C(=O)NC1=CC=CC=C1)N/N=C\2/C=C(C=C(C2=O)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]	{1: 1, 34: 1, 3: 1, 38: 1, 14: 7, 15: 3, 24: 2, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	68400-43-1	CN(C)C1=C(C=C(C=C1)[N+]#N)Cl.F[P-](F)(F)(F)(F)F	{1: 2, 34: 1, 33: 1, 14: 3, 16: 6, 17: 1}
Did not match all atoms present	68400-45-3	CC(C)OC1=CC(=C(C=C1[N+]#N)OC(C)C)N2CCOCC2.F[P-](F)(F)(F)(F)F	{1: 4, 34: 1, 3: 2, 33: 1, 11: 4, 14: 2, 16: 6, 22: 2, 23: 1}
Did not match all atoms present	68400-46-4	[B-](F)(F)(F)F.CC(C)OC1=CC(=C(C=C1[N+]#N)OC(C)C)N2CCOCC2	{1: 4, 34: 1, 3: 2, 33: 1, 11: 4, 14: 2, 16: 4, 22: 2, 23: 1}
Did not match all atoms present	68400-47-5	CCOC1=CC(=C(C=C1[N+](=O)[O-])OCC)SC2=CC=C(C=C2)C	{1: 3, 2: 2, 38: 1, 40: 1, 14: 6, 22: 2}
Did not match all atoms present	68400-48-6	CCOC1=CC(=C(C=C1N)OCC)SC2=CC=C(C=C2)C	{1: 3, 2: 2, 40: 1, 14: 6, 22: 2, 30: 1}
Did not match all atoms present	68400-49-7	CC(C)OC1=CC(=C(C=C1N2CCOCC2)OC(C)C)[N+](=O)[O-]	{1: 4, 3: 2, 38: 1, 33: 1, 11: 4, 14: 2, 22: 2, 23: 1}
Did not match all atoms present	68400-50-0	CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)CCCCC	{1: 2, 2: 9, 22: 1, 14: 8}
Did not match all atoms present	68400-51-1	CCC1=CC=C(C=C1)C(=O)C(C)(C)O	{1: 3, 2: 1, 4: 1, 14: 4, 20: 1, 24: 1}
Did not match all atoms present	68400-52-2	CCCC1=CC=C(C=C1)C(=O)C(C)(C)O	{1: 3, 2: 2, 4: 1, 14: 4, 20: 1, 24: 1}
Did not match all atoms present	68400-53-3	CCCCCCCCC(CCCC(=O)C(C)(C)O)C1=CC=CC=C1	{1: 3, 2: 10, 3: 1, 4: 1, 14: 5, 20: 1, 24: 1}
Did not match all atoms present	68400-54-4	CC(C)(C)C1=CC=C(C=C1)C(=O)C(C)(C)O	{24: 1, 1: 5, 4: 2, 14: 4, 20: 1}
Did not match all atoms present	68400-55-5	C1=CC(=CC=C1NC(=O)C(=O)O)N=NC2=C3C=C(C=CC3=C(C=C2)N)S(=O)(=O)[O-].[Na+]	{34: 2, 14: 9, 24: 1, 27: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	68400-56-6	C1=CC=C2C(=C1)C(=C/C(=N/NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C6C=CC(=CC6=C(C=C5)N=NC7=CC=C(C=C7)NC(=O)C(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 5, 14: 19, 15: 2, 24: 1, 25: 1, 27: 1, 29: 9, 31: 2}
Did not match all atoms present	68400-58-8	CCCCCCCCC=CCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 18, 6: 2, 14: 5, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	68400-59-9	COCCOCCOCCC[Si](C)(C)Cl	{1: 3, 2: 7, 22: 3, 17: 1}
Did not match all atoms present	68400-61-3	C=O.C1=CC=C(C=C1)O.C(#N)N=C(N)N.C(=O)(C(=O)O)O	{34: 1, 5: 1, 7: 1, 14: 5, 21: 1, 27: 2, 30: 2, 37: 1}
Did not match all atoms present	68400-63-5	C=O.C1=CC=C(C=C1)O.C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O.C(#N)N=C(N)N	{2: 1, 3: 4, 5: 1, 7: 1, 34: 1, 14: 5, 20: 5, 21: 1, 26: 1, 30: 2, 37: 1}
Did not match all atoms present	68400-66-8	CC1CO1.C=O.C(CNCCN)N	{1: 1, 2: 4, 5: 1, 11: 1, 12: 1, 23: 1, 30: 2, 31: 1}
Did not match all atoms present	68400-68-0	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CC(O)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 3, 2: 25, 3: 1, 6: 8, 14: 4, 20: 2, 27: 4}
Did not match all atoms present	68400-70-4	CC1=CC=CC=C1.C=O.C1CCC(=O)CC1	{1: 1, 11: 5, 5: 1, 14: 5, 25: 1}
Did not match all atoms present	68400-74-8	CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl	{1: 4, 2: 13, 4: 1, 6: 4, 11: 1, 12: 1, 14: 8, 17: 1, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	68400-77-1	CC1=C(C=CC(=C1)S(=O)(=O)C2=C(C=CC(=C2C)CC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)O)O)O	{1: 2, 2: 1, 14: 11, 20: 1, 21: 2, 29: 4}
Did not match all atoms present	68400-79-3	CC1=C(CC2CC1C2(C)C)P(=S)(SC3=C(C4CC(C3)C4(C)C)C)SP(=S)(C5=C(C6CC(C5)C6(C)C)C)SC7=C(C8CC(C7)C8(C)C)C	{1: 12, 40: 3, 11: 8, 12: 8, 13: 4, 15: 8}
Did not match all atoms present	68400-80-6	CC1=C(C=CC(=C1)N)N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 30: 1, 34: 2, 29: 6, 14: 8}
Did not match all atoms present	68400-81-7	CCC1=CC=CC=C1C=C.C=CC1=CC=CC=C1C=C.C=CN1CCCC1=O	{1: 1, 2: 1, 5: 4, 6: 4, 33: 1, 11: 3, 14: 8, 25: 1}
Did not match all atoms present	68401-82-1	CO/N=C(/C1=CSC(=N1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=CCS3)C(=O)[O-].[Na+]	{1: 1, 34: 1, 35: 1, 33: 1, 7: 1, 41: 2, 11: 1, 12: 2, 14: 2, 15: 1, 22: 1, 24: 2, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	68409-64-3	CCCCCCCCCCCC(=O)OCC(C)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{1: 2, 2: 11, 3: 1, 14: 4, 20: 1, 27: 2, 28: 1}
Did not match all atoms present	68411-01-8	B(O)(O)O.CC(CO)O	{1: 1, 2: 1, 3: 1, 20: 5}
Did not match all atoms present	68411-02-9	C(CO)N.S.[S-2].[Cu+2]	{2: 2, 20: 1, 30: 1}
Did not match all atoms present	68411-23-4	[B].[B].CC(CO)O.[O-2].[Na+].[Na+]	{1: 1, 2: 1, 3: 1, 20: 2}
Did not match all atoms present	68411-28-9	CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)O.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 20: 1, 21: 1, 14: 9, 29: 6}
Did not match all atoms present	68411-29-0	CC1=CC(=O)C=CC1=O.C1=CC(=CC=C1N)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O	{1: 1, 38: 1, 14: 10, 15: 1, 20: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	68411-33-6	C1=CC(=C(C(=C1)[O-])[N+](=O)[O-])[O-].[Pb+2]	{38: 1, 14: 3}
Did not match all atoms present	68411-34-7	C1=CC(=CC(=C1)O)O.C(CNCCN)N	{2: 4, 30: 2, 21: 2, 14: 4, 31: 1}
Did not match all atoms present	68411-35-8	CC1=CC(=CC(=C1O)C)Cl.C1=CC(=CC(=C1)O)O	{1: 2, 21: 3, 14: 6, 17: 1}
Did not match all atoms present	68411-38-1	CCC(C)COC1=C(C=C(C=C1)/C=C/C)OC	{1: 4, 2: 2, 3: 1, 6: 2, 14: 3, 22: 2}
Did not match all atoms present	68411-42-7	CCC1=CC=CC=C1CC.[O-2].[O-2].[O-2].[Fe+3].[Fe+3]	{1: 2, 2: 2, 14: 4}
Did not match all atoms present	68411-43-8	CCC1=CC=CC=C1CC.CCC1=CC=CC=C1C=C.[O-2].[O-2].[O-2].[Fe+3].[Fe+3]	{1: 3, 2: 3, 14: 8, 5: 1, 6: 1}
Did not match all atoms present	68411-47-2	CCCCOCC(CC(C1=CC=C(C=C1)N)C2=CC=C(C=C2)N)O	{1: 1, 2: 5, 3: 2, 14: 8, 20: 1, 22: 1, 30: 2}
Did not match all atoms present	68411-51-8	CC[O-].CC[O-].CC(C)C[Al](CC(C)C)CC(C)C.[Mg+2].[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{1: 8, 2: 5, 3: 3, 29: 2, 17: 4}
Did not match all atoms present	68411-52-9	CC(=C)[Al](C(=C)C)C(=C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{1: 3, 17: 4, 5: 3, 7: 3}
Did not match all atoms present	68411-53-0	CC[O-].CC[O-].CC(=C)[Al](C(=C)C)C(=C)C.[Mg+2].[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{1: 5, 2: 2, 5: 3, 7: 3, 17: 4, 29: 2}
Did not match all atoms present	68411-55-2	CC[O-].CC[O-].CC[Al](CC)CC.[Mg+2].[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{1: 5, 2: 5, 29: 2, 17: 4}
Did not match all atoms present	68411-56-3	C(CNCCNCCOCCC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 2: 8, 22: 1, 31: 2}
Did not match all atoms present	68411-57-4	C(CN(CCN)CCOCCC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 33: 1, 2: 8, 30: 1, 22: 1}
Did not match all atoms present	68411-64-3	CCCCCCCC/C=C\CCCCCCCCN.CC1=CC=CC2=NNN=C12.C=O	{32: 1, 1: 2, 2: 15, 35: 2, 5: 1, 6: 2, 14: 3, 30: 1}
Did not match all atoms present	68411-65-4	CC(=O)C.C=O.N	{24: 1, 1: 2, 5: 1}
Did not match all atoms present	68411-67-6	CCCCOCCOCCOCCO.CC(C)[O-].CC(C)[O-].CC(C)[O-].[Al+3]	{1: 7, 2: 9, 3: 3, 20: 1, 22: 3, 29: 3}
Did not match all atoms present	68411-68-7	CC[O-].CC[O-].[Mg+2].[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{1: 2, 2: 2, 29: 2, 17: 4}
Did not match all atoms present	68411-70-1	CC1=CC=C(C=C1)OCC2CO2.C(CNCCN)N	{1: 1, 2: 5, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1, 30: 2, 31: 1}
Did not match all atoms present	68411-83-6	C1C(O1)CCl.C1=CN=CN1.[NH4+].[OH-]	{32: 1, 2: 1, 35: 1, 11: 1, 12: 1, 14: 3, 17: 1, 23: 1}
Did not match all atoms present	68411-87-0	C1=CC=C(C(=C1)C(=O)O)O.C(CCCN)CCN.C(CCC(=O)O)CC(=O)O	{30: 2, 2: 10, 27: 3, 21: 1, 14: 4}
Did not match all atoms present	68412-00-0	C(CN(CC(=O)[O-])CC(=O)[O-])NCCO.[Na+].[Na+]	{24: 2, 33: 1, 2: 6, 20: 1, 31: 1}
Did not match all atoms present	68412-36-2	CCCCCCCCCCCC(=O)O[Sn](CCCC)(CCCC)OC(=O)CCCCCCCCCCC.CCCO[Si](OCCC)(OCCC)OCCC	{1: 8, 2: 34, 28: 2, 22: 4}
Did not match all atoms present	68412-51-1	C(COCCN(CCN)CC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{24: 2, 33: 1, 2: 7, 30: 1, 22: 1}
Did not match all atoms present	68412-57-7	CCCCCCCC(=O)OCC(C[O-])(COCC(CO)(CO)CO)COC(=O)C(CC)CCCC.OP(O)O.[K+]	{1: 3, 2: 18, 3: 1, 4: 2, 20: 6, 22: 1, 28: 2, 29: 1}
Did not match all atoms present	68412-64-6	CC(C)(COP(=O)([O-])[O-])N.[K+].[K+]	{1: 2, 2: 1, 4: 1, 22: 1, 29: 3, 30: 1}
Did not match all atoms present	68412-65-7	[O-]P(=O)(OCl)F.[O-]P(=O)(OCl)F.[Sr+2]	{16: 2, 17: 2, 29: 4, 22: 2}
Did not match all atoms present	68412-66-8	C(NCP(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{2: 2, 29: 6, 31: 1}
Did not match all atoms present	68412-67-9	C(NCP(=O)(O)O)P(=O)(O)O	{2: 2, 20: 4, 29: 2, 31: 1}
Did not match all atoms present	68412-70-4	C1=CC=C(C=C1)NC2=CC=C(C=C2)O.[Na+].[Na+].[S-2]	{21: 1, 14: 9, 31: 1}
Did not match all atoms present	68412-71-5	CC1=CC(=CC=C1)O.CC(C)[O-].CC(C)[O-].CC(C)[O-].[Al+3]	{1: 7, 3: 3, 21: 1, 14: 4, 29: 3}
Did not match all atoms present	68412-72-6	CC(C)(C)C1=CC=C(C=C1)O.C1C=CC2C1C3CC2C=C3	{1: 3, 4: 1, 11: 2, 12: 4, 14: 8, 21: 1}
Did not match all atoms present	68412-81-7	CC1=NC=CN1.C1(=O)NC(=O)NC(=O)N1	{32: 4, 1: 1, 35: 1, 14: 2, 25: 3}
Did not match all atoms present	68413-42-3	CC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 3, 2: 4, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 28: 2}
Did not match all atoms present	68413-47-8	CCCCOC(=O)CC(C(=O)OCCCC)SP(=S)(OCCC)OCCC	{1: 4, 2: 11, 3: 1, 40: 1, 22: 2, 28: 2}
Did not match all atoms present	68413-49-0	CCCCCCOP(=S)(OCCCC)[S-].CCCCCCOP(=S)(OCCCC)[S-].[Zn+2]	{1: 4, 2: 16, 22: 4}
Did not match all atoms present	68413-50-3	CCCCCCCCCCCCC1=CC=C(C=C1)OCC(C[N+](C)(C)C)O.[Cl-]	{1: 4, 2: 13, 3: 1, 14: 4, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	68413-51-4	CN(CCO)C1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC(=CC=C5)S(=O)(=O)[O-])N(C)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=CC(=CC=C6)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 2: 4, 35: 6, 6: 2, 33: 2, 14: 14, 20: 2, 29: 12, 31: 4}
Did not match all atoms present	68413-52-5	C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(/C(=N\NC4=C(C5=C(C=C4)C(=CC=C5)CNC6=C(C(=NC(=N6)F)F)Cl)S(=O)(=O)O)/C3=O)S(=O)(=O)O	{2: 1, 35: 2, 34: 1, 14: 13, 15: 2, 16: 2, 17: 1, 20: 3, 24: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	68413-53-6	CC1=CC(=C(C(=C1)S(=O)(=O)O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O)CNC5=C(C(=NC(=N5)F)F)Cl	{1: 1, 2: 1, 35: 2, 14: 7, 16: 2, 17: 1, 20: 2, 25: 2, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	68413-54-7	COC1=CC=C(C=C1)NC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC(=CC(=C4O)Cl)Cl)/C(=C3)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 1, 14: 10, 15: 2, 17: 2, 21: 1, 22: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	68413-56-9	CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCC	{1: 2, 2: 5, 22: 1, 14: 8}
Did not match all atoms present	68413-58-1	COC1=CC(=C(C=C1)[N+]#N)OC.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 1, 22: 2, 14: 3, 17: 3}
Did not match all atoms present	68413-59-2	COC1=CC(=C(C=C1)OC)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 1, 22: 2, 14: 3, 17: 3}
Did not match all atoms present	68413-62-7	C1CCN(C1)C2=C(C=C(C=C2)[N+]#N)Cl.C1CCN(C1)C2=C(C=C(C=C2)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 6, 34: 2, 11: 8, 14: 6, 33: 2}
Did not match all atoms present	68413-63-8	CN(C)C1=C(C=C(C=C1)[N+]#N)Cl.CN(C)C1=C(C=C(C=C1)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 34: 2, 33: 2, 14: 6, 17: 6}
Did not match all atoms present	68413-66-1	[NH4+].[NH4+].[NH4+].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Os]	{17: 6}
Did not match all atoms present	68413-68-3	N.N.N.N.[OH-].[OH-].[Pd+2]	{}
Did not match all atoms present	68413-69-4	CC(=O)[O-].C1=CC=C(C=C1)/C(=C/C(=O)C2=CC=CC=C2)/[O-].C1=CC=C(C=C1)/C(=C/C(=O)C2=CC=CC=C2)/[O-].[Ru+3]	{24: 3, 1: 1, 14: 20, 6: 2, 7: 2}
Did not match all atoms present	68413-71-8	C1=C(C=C(C(=C1Br)OCCBr)Br)Br	{2: 2, 22: 1, 18: 4, 14: 2}
Did not match all atoms present	68413-73-0	C(CO)NCCO.C(CO)N(CCO)CCO.C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O	{33: 2, 2: 13, 20: 11, 29: 3, 31: 1}
Did not match all atoms present	68413-74-1	C(N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])P(=O)([O-])[O-].[Zn+2].[Zn+2].[Zn+2]	{33: 1, 2: 3, 29: 9}
Did not match all atoms present	68413-75-2	C(CO)N.C(CO)N(CCO)CCO.C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O	{33: 2, 2: 11, 20: 10, 29: 3, 30: 1}
Did not match all atoms present	68413-76-3	C(CO)N.OP(=O)(O)OP(=O)([O-])[O-].[Na+].[Na+]	{2: 2, 30: 1, 20: 3, 29: 4, 22: 1}
Did not match all atoms present	68413-79-6	C1=CC=C(C(=C1)C(=O)N2C=CN=C2)C(=O)N3C=CN=C3	{24: 2, 33: 2, 35: 2, 14: 10}
Did not match all atoms present	68413-84-3	CCCCCCCCCCCCCCCCCC(=O)OCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)COC	{1: 6, 2: 22, 35: 3, 33: 3, 22: 5, 28: 1}
Did not match all atoms present	68413-85-4	C1=CC=C(C=C1)NC2=NC3=C(C=C(C=C3)Cl)N=C2NC4=CC=CC=C4	{17: 1, 35: 2, 14: 13, 31: 2}
Did not match all atoms present	68413-86-5	CCN(CC)C1=CC(=C(C=C1)[N+]#N)OCC.F[P-](F)(F)(F)(F)F	{1: 3, 2: 3, 33: 1, 34: 1, 14: 3, 16: 6, 22: 1}
Did not match all atoms present	68413-87-6	CC[N+]1=C([Se]C2=C1C=C(C=C2)OC)C=C(C3=CC=CS3)Cl.[Cl-]	{1: 2, 2: 1, 33: 1, 6: 1, 7: 1, 41: 1, 14: 6, 17: 2, 22: 1}
Did not match all atoms present	68413-88-7	CCN(CC)C1=C(C=C(C=C1)[N+]#N)Cl.F[P-](F)(F)(F)(F)F	{1: 2, 2: 2, 33: 1, 34: 1, 14: 3, 16: 6, 17: 1}
Did not match all atoms present	68413-89-8	CCNC1=CC(=C(C=C1)[N+]#N)C.F[P-](F)(F)(F)(F)F	{1: 2, 2: 1, 34: 1, 14: 3, 16: 6, 31: 1}
Did not match all atoms present	68413-90-1	CC1=[N+](C2=C(N1CCCS(=O)(=O)[O-])C=C(C=C2)C(F)(F)F)C.[Na+].[Cl-]	{1: 2, 2: 3, 4: 1, 33: 2, 14: 3, 16: 3, 17: 1, 29: 3}
Did not match all atoms present	68413-92-3	COC1=C(C=C(C=C1)C(O)S(=O)(=O)[O-])OC.[Na+]	{1: 2, 3: 1, 14: 3, 20: 1, 22: 2, 29: 3}
Did not match all atoms present	68413-95-6	CC(C)(CO)CO.CC(CO)(CO)CO.C1=CC(=CC=C1C(=O)O)C(=O)O	{1: 3, 2: 5, 4: 2, 14: 4, 20: 5, 27: 2}
Did not match all atoms present	68420-92-8	CC1=CC(=C2C(=C1)C=CC=N2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	68420-93-9	CC1=CC(=C2C(=C1)C=CC=N2)N	{1: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	68422-67-3	CC1=C(C(=CC=C1)N/N=C/2\C(=O)C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])C.CC1=C(C(=CC=C1)N/N=C/2\C(=O)C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])C.[Ba+2]	{1: 4, 34: 2, 14: 16, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68423-02-9	CCCCOCCOCCO.CCOC(=O)CC(=O)C.CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)[O-].CC(C)[O-].CC(C)[O-].[Al+3]	{1: 10, 2: 9, 3: 3, 14: 4, 20: 2, 22: 2, 24: 1, 28: 1, 29: 5}
Did not match all atoms present	68425-62-7	CCCCCCCCCC(CCCCCCCC(=O)OCCC)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 17, 3: 1, 28: 1, 29: 3}
Did not match all atoms present	68425-74-1	C.C.C[N+](C)(C)CC1=CC=CC=C1.C[N+](C)(C)CC1=CC=CC=C1	{1: 6, 2: 2, 14: 10}
Did not match all atoms present	68425-77-4	C1=CC2=C(C=C1NC3=NC(=NC(=N3)Cl)Cl)C(=O)OC24C5=C(C=C(C=C5)O)OC6=C4C=CC(=C6)O.Cl.Cl	{35: 3, 13: 1, 14: 9, 17: 4, 21: 2, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	68425-99-0	CC1(CC(CC(C1)(C)CNC(=O)N2CC=NC2C3=CC=CC=C3)NC(=O)N4CC=NC4C5=CC=CC=C5)C	{1: 3, 2: 1, 35: 2, 33: 2, 11: 5, 12: 3, 13: 2, 14: 12, 24: 2, 31: 2}
Did not match all atoms present	68426-04-0	CC1=NC(N(C1)C(=O)NCC2(CC(CC(C2)(C)C)NC(=O)N3CC(=NC3C4=CC=CC=C4)C)C)C5=CC=CC=C5	{1: 5, 2: 1, 35: 2, 33: 2, 11: 5, 12: 3, 13: 2, 14: 10, 15: 2, 24: 2, 31: 2}
Did not match all atoms present	68426-05-1	COC(CC1=CC=CC=C1)OCC=CC2=CC=CC=C2	{1: 1, 2: 2, 3: 1, 6: 2, 14: 10, 22: 2}
Did not match all atoms present	68426-07-3	CC(C)C(CCC1=CC=CC=C1)O	{1: 2, 2: 2, 3: 2, 20: 1, 14: 5}
Did not match all atoms present	68426-08-4	COC1=CC=C(C=C1)OCC(OC)OC	{1: 3, 2: 1, 3: 1, 22: 4, 14: 4}
Did not match all atoms present	68426-09-5	COC1=CC=C(C=C1)OCC=O	{1: 1, 2: 1, 26: 1, 22: 2, 14: 4}
Did not match all atoms present	68426-46-0	CN(C(=O)OC1=CC=CC=C1)N=O	{1: 1, 34: 1, 33: 1, 14: 5, 28: 1, 29: 1}
Did not match all atoms present	68427-31-6	C1=C(C(=C(C(=C1Cl)Cl)O)C(=O)O)Cl	{17: 3, 27: 1, 21: 1, 14: 1}
Did not match all atoms present	68427-32-7	CCCCCCCCCCOP(=O)(O)[O-].[K+]	{1: 1, 2: 9, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	68427-34-9	[H+].C1=CC2=C(C=CC(=C2C(=C1)C(=O)[O-])C(=O)[O-])S(=O)(=O)[O-].C1=CC2=C(C=CC(=C2C(=C1)C(=O)[O-])C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[K+]	{24: 4, 29: 6, 14: 10}
Did not match all atoms present	68427-37-2	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=C(O3)C=CC(=C4)S(=O)(=O)O.N	{1: 2, 2: 2, 35: 1, 33: 1, 14: 7, 20: 1, 23: 1, 28: 1, 29: 2}
Did not match all atoms present	68429-53-8	CC1=CC(=C(C=C1)CC#N)C	{1: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	6843-30-7	CN(C)C1=CC2=C(C=C1)NC=C2C(=O)C3=CC=CC=C3	{24: 1, 1: 2, 33: 1, 14: 9, 32: 1}
Did not match all atoms present	6843-49-8	CC1(C(=O)NC(=O)N1)C2=CC=CC=C2	{32: 2, 1: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	6843-66-9	CO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC	{1: 2, 22: 2, 14: 10}
Did not match all atoms present	68439-21-4	CC(C)CC(C)OP(=O)([O-])[O-].[Mn+2]	{1: 3, 2: 1, 3: 2, 29: 3, 22: 1}
Did not match all atoms present	68439-39-4	CCCCC(CC)COCCOP(=O)(O)O	{1: 2, 2: 7, 3: 1, 20: 2, 22: 2, 29: 1}
Did not match all atoms present	6844-74-2	CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=CC=CC=C4)/C3=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 12, 15: 2, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	68440-59-5	CCO[Si](OCC)(OCC)OCC.C[Si](C)(C)Cl	{1: 7, 2: 4, 22: 4, 17: 1}
Did not match all atoms present	68441-20-3	CC(C)CCCCCOC(=O)CS.C[Sn](C)(Cl)Cl.C[Sn](Cl)(Cl)Cl.[Na+].[Na+].[S-2]	{1: 5, 2: 6, 3: 1, 39: 1, 17: 5, 28: 1}
Did not match all atoms present	68442-57-9	CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)CN)C.CC(=O)C1=CC=CC=C1.C=O.C(#N)[S-].[NH4+].OS(=O)(=O)O	{1: 5, 2: 1, 3: 1, 5: 1, 11: 5, 12: 1, 13: 2, 14: 8, 20: 2, 24: 1, 29: 2, 30: 1, 37: 1}
Did not match all atoms present	68442-60-4	CC=O.C=O	{1: 1, 26: 1, 5: 1}
Did not match all atoms present	68442-61-5	CCCCC/C=C/C.CC(=O)O.C=O	{1: 3, 2: 4, 27: 1, 5: 1, 6: 2}
Did not match all atoms present	68443-33-4	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC(=O)CCCC(=O)OC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4	{1: 4, 2: 3, 4: 2, 14: 18, 28: 2}
Did not match all atoms present	68443-34-5	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3	{1: 2, 2: 1, 4: 1, 22: 1, 14: 14}
Did not match all atoms present	68443-35-6	CC(=C)C(=O)OC1=CC=C(C=C1)C(C)(C)C2=CC=CC=C2	{1: 3, 4: 1, 5: 1, 7: 1, 14: 9, 28: 1}
Did not match all atoms present	68443-36-7	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC=C	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 14: 9, 22: 1}
Did not match all atoms present	68443-37-8	B(OC1=CC=C(C=C1)C(C)(C)C2=CC=CC=C2)(OC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4)OC5=CC=C(C=C5)C(C)(C)C6=CC=CC=C6	{1: 6, 4: 3, 22: 3, 14: 27}
Did not match all atoms present	68443-39-0	CCCCCCC1OC1/C=C/CCCCCCCC(=O)O.CCCCCCC1OC1/C=C/CCCCCCCC(=O)O.CCCCCCC1OC1/C=C/CCCCCCCC(=O)O.CC(O)C.[Ti]	{1: 5, 2: 36, 3: 1, 6: 6, 12: 6, 20: 1, 23: 3, 27: 3}
Did not match all atoms present	68443-40-3	CCCCCCCCC1C(O1)CCCCCCCC(=O)O.CCCCCCCCC1C(O1)CCCCCCCC(=O)O.CCCCCCCCC1C(O1)CCCCCCCC(=O)O.CC(C)O.[Ti]	{1: 5, 2: 42, 3: 1, 12: 6, 20: 1, 23: 3, 27: 3}
Did not match all atoms present	68443-41-4	CCCCCCC(CCCCCCCCCCC(=O)O)O.CCCCCCC(CCCCCCCCCCC(=O)O)O.C(C(=O)O)O.[Ti]	{27: 3, 1: 2, 2: 31, 3: 2, 20: 3}
Did not match all atoms present	68443-42-5	CCCCCCC(O)C/C=C/CCCCCCCC(=O)OC.CCCCCCC(O)C/C=C/CCCCCCCC(=O)OC.CCCCCCC(O)C/C=C/CCCCCCCC(=O)OC.CC(O)C.[Ti]	{1: 8, 2: 39, 3: 4, 6: 6, 20: 4, 28: 3}
Did not match all atoms present	68443-43-6	CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCC(CC)(COC(=O)C2=CC=CC=C2C(=O)OCCCCCCCCCC)COC(=O)C(=C)C	{1: 4, 2: 22, 4: 1, 5: 1, 7: 1, 14: 8, 28: 5}
Did not match all atoms present	68443-44-7	CC(C1OCCCCO1)C2=CC=CC=C2	{1: 1, 3: 1, 11: 4, 12: 1, 14: 5, 23: 2}
Did not match all atoms present	68443-46-9	CCC(C[O-])(COCC=C)COCC=C.CCC(C[O-])(COCC=C)COCC=C.CCC(C[O-])(COCC=C)COCC=C.CCC(C[O-])(COCC=C)COCC=C.[Ti+4]	{1: 4, 2: 24, 4: 4, 5: 8, 6: 8, 22: 8, 29: 4}
Did not match all atoms present	68443-47-0	CCCCCCC(O)C/C=C\CCCCCCCC(=O)O.CCCCCCC(O)C/C=C\CCCCCCCC(=O)O.C(O)C(=O)O.[Ti]	{1: 2, 2: 27, 3: 2, 6: 4, 20: 3, 27: 3}
Did not match all atoms present	68443-49-2	CCCCCCCCCCCCO.CCCCCCCCCCCCO.CCCCCCCCCCCCO.CC(C)O.[Ti]	{1: 5, 2: 33, 3: 1, 20: 4}
Did not match all atoms present	68443-53-8	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O.CC(C)O.[Ti]	{27: 3, 1: 5, 2: 48, 3: 1, 20: 1}
Did not match all atoms present	68443-58-3	CCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 10, 3: 2, 28: 1, 29: 3}
Did not match all atoms present	68443-60-7	CC(CC(C)(CC(C)(CC(=C)C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{1: 3, 2: 3, 3: 1, 4: 2, 5: 1, 7: 1, 14: 20}
Did not match all atoms present	68443-61-8	CCCCC(CC)COC(=O)C(CCCC)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 8, 3: 2, 28: 1, 29: 3}
Did not match all atoms present	68443-64-1	CCCCC(CC)CNC1=C2C(=C(C=C1)NC(C)C)C(=O)C3=CC=CC=C3C2=O	{1: 4, 2: 5, 3: 2, 14: 6, 25: 2, 31: 2}
Did not match all atoms present	68443-74-3	CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)O.CC(C)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O.[Ti].[Ti]	{1: 12, 2: 56, 3: 6, 14: 4, 20: 2, 27: 6}
Did not match all atoms present	68443-77-6	CC1=C(C=C(C=C1)[N+](=O)[O-])[N+]#N.CC1=C(C=C(C=C1)[N+](=O)[O-])[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 2, 38: 2, 14: 6, 17: 4}
Did not match all atoms present	68443-80-1	CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O[Al]=O	{1: 1, 2: 11, 22: 1, 14: 4, 29: 3}
Did not match all atoms present	68443-81-2	CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O.CC(C)O.CNCCS(=O)(=O)O.[Ti]	{1: 5, 2: 24, 3: 1, 14: 8, 20: 4, 29: 6, 31: 1}
Did not match all atoms present	68443-82-3	CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O.CC(C)O.CC(=C)C(=O)OCCS(=O)(=O)O.[Ti]	{1: 5, 2: 24, 3: 1, 5: 1, 7: 1, 14: 8, 20: 4, 28: 1, 29: 6}
Did not match all atoms present	68443-89-0	CC[N+]1=C([Se]C2=C1C=C(C=C2)OC)C=C(C=C3N(C4=C(S3)C=C(C(=C4)C)OC)CCO)C5=CC=CS5.[Br-]	{1: 4, 2: 3, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 18: 1, 20: 1, 22: 2}
Did not match all atoms present	68443-90-3	CCCCO.C1COCCN1.OP(=O)(O)O	{32: 1, 1: 1, 2: 3, 11: 4, 20: 4, 23: 1, 29: 1}
Did not match all atoms present	68443-94-7	[H+].[H+].CCCCCCCCCCCCCOP([O-])OCCCCCCCCCCCCC.CCCCCCCCCCCCCOP([O-])OCCCCCCCCCCCCC.CC(C)[O-].C=CC[O-].C=CC[O-].C=CC[O-].[Ti+4]	{1: 6, 2: 51, 3: 1, 5: 3, 6: 3, 22: 4, 29: 6}
Did not match all atoms present	68443-97-0	[H+].[H+].[H+].CC(C)[O-].COP(=O)(OC)OP(=O)([O-])[O-].COP(=O)(OC)OP(=O)([O-])[O-].COP(=O)(OC)OP(=O)([O-])[O-].[Ti+4]	{1: 8, 3: 1, 29: 13, 22: 9}
Did not match all atoms present	68443-98-1	COC1=CC=CC(=C1)[C@H](CC(=O)O)N	{1: 1, 2: 1, 3: 1, 14: 4, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	68444-02-0	CCCSC1=CC2=CC(=C(C=C2C=C1)S(=O)(=O)[O-])SCCC.[Na+]	{40: 2, 1: 2, 2: 4, 29: 3, 14: 5}
Did not match all atoms present	68444-04-2	CCCCCCCCCCCCCCCCCC1=NC2=C(N1)C=CC=C2S(=O)(=O)[O-].[Na+]	{32: 1, 1: 1, 2: 16, 35: 1, 14: 3, 29: 3}
Did not match all atoms present	68444-06-4	CC1=C/C(=N\NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])/C(=O)C=C1.[K+]	{1: 1, 34: 3, 14: 11, 15: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68444-07-5	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)S(=O)(=O)[O-])C4=CC=CC=C4Cl.[K+]	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 12, 15: 1, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68444-08-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)NN=C5C=CC(=O)C=C5)S(=O)(=O)[O-])N.[Na+]	{34: 1, 14: 13, 15: 1, 25: 3, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	68444-10-0	CCC(=O)OCCN(CCC#N)C1=CC=CC=C1	{1: 1, 2: 5, 37: 1, 33: 1, 14: 5, 28: 1}
Did not match all atoms present	68444-12-2	C1=CC(=CC(=C1)[N+](=O)[O-])C(O)S(=O)(=O)[O-].[Na+]	{38: 1, 3: 1, 20: 1, 29: 3, 14: 4}
Did not match all atoms present	68444-15-5	C1=CC=C(C=C1)OCC(CNCCNCCNCCN)O	{2: 8, 3: 1, 14: 5, 20: 1, 22: 1, 30: 1, 31: 3}
Did not match all atoms present	68444-16-6	CCCCCCCCCCCCCOCCC[N+](C)(CCO)CCO.[Cl-]	{1: 2, 2: 19, 20: 2, 22: 1, 17: 1}
Did not match all atoms present	68444-17-7	CC(C)OP(=O)(O)O.N.N	{1: 2, 3: 1, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	68444-84-8	CNC1=CC=C(C=C1)N=NC2=[N+](C=CN2C)C.CNC1=CC=C(C=C1)N=NC2=[N+](C=CN2C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 6, 34: 4, 33: 4, 14: 12, 17: 4, 31: 2}
Did not match all atoms present	68457-76-1	CC(=C)C.CC(=CC(C)(C)C)C.C1=CC=C(C=C1)O	{1: 7, 4: 1, 5: 1, 6: 1, 7: 2, 14: 5, 21: 1}
Did not match all atoms present	68457-86-3	CCCCCCCCC(CCCCCCCCC(=O)OC)OS(=O)(=O)[O-].[Na+]	{1: 2, 2: 15, 3: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	68459-81-4	CCC(C)C1=CC(=CC=C1)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1, 14: 4}
Did not match all atoms present	68459-83-6	CCCCCCCCCCCCCCCCCC(=O)[N+](CC)(CCC(=O)O)CCNCCN.CCOS(=O)(=O)[O-]	{1: 3, 2: 24, 22: 1, 24: 1, 27: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	68459-89-2	CCCCCCCCCCCCCCCCC1=CC=C(C=C1)OC2=CC=CC=C2	{1: 1, 2: 15, 22: 1, 14: 9}
Did not match all atoms present	6846-11-3	CN1C(=O)C(NC1=O)C2=CC=CC=C2	{32: 1, 1: 1, 33: 1, 12: 1, 14: 5, 25: 2}
Did not match all atoms present	6846-35-1	C1(=NC(=S)SS1)N	{41: 2, 35: 1, 30: 1}
Did not match all atoms present	68460-01-5	C12=C(C(=C(C(=C1Br)Br)Br)Br)S(=O)(=O)OC2=O	{18: 4, 28: 1, 29: 2}
Did not match all atoms present	68460-03-7	C(C(CCl)Cl)OP(=O)(OC(CCl)CCl)OC(CCl)CCl	{17: 6, 2: 6, 3: 3, 29: 1, 22: 3}
Did not match all atoms present	68460-04-8	C1=CC=C(C=C1)S(=O)(=O)NCCOS(=O)(=O)[O-].[Na+]	{2: 2, 31: 1, 22: 1, 14: 5, 29: 5}
Did not match all atoms present	68460-08-2	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=NC3=C4C=C(C=CC4=C(C=C3)NC(=O)NC5=C6C=CC(=CC6=C(C=C5)N=NC7=CC=C(C=C7)N=NC8=CC=C(C=C8)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 1, 34: 8, 29: 12, 14: 26, 31: 2}
Did not match all atoms present	68460-09-3	CC1=CC(=CC=C1)NC=CC=NC2=CC=CC(=C2)C.Cl	{1: 2, 34: 1, 6: 3, 14: 8, 17: 1, 31: 1}
Did not match all atoms present	68460-17-3	CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC(=CC=C1)S(=O)(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.CC(C)O.[Ti]	{1: 6, 2: 36, 3: 2, 14: 8, 20: 3, 27: 1, 29: 4}
Did not match all atoms present	68469-60-3	COC1=CC=C(C=C1)[Si](C)(C)CC=C	{1: 3, 2: 1, 5: 1, 6: 1, 14: 4, 22: 1}
Did not match all atoms present	68473-31-4	CCCCCCCCCCCCN(C)C.C1=CC=C(C=C1)C(=O)O	{1: 3, 2: 11, 27: 1, 14: 5, 33: 1}
Did not match all atoms present	68475-45-6	C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.[Co+2]	{24: 2, 2: 2, 3: 10, 20: 12}
Did not match all atoms present	68475-46-7	C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.[Cu+2]	{24: 2, 2: 2, 3: 10, 20: 12}
Did not match all atoms present	68475-47-8	C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.[Mn+2]	{24: 2, 2: 2, 3: 10, 20: 12}
Did not match all atoms present	68475-48-9	C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.C(C(C(C(C(C(C(=O)[O-])O)O)O)O)O)O.[Zn+2]	{24: 2, 2: 2, 3: 10, 20: 12}
Did not match all atoms present	68475-50-3	C1=CC=C(C=C1)N/N=C/2\C(=O)C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N.C1=CC=C(C=C1)N/N=C/2\C(=O)C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N.C1=CC=C(C=C1)N/N=C/2\C(=O)C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Al+3].[Al+3]	{34: 3, 14: 24, 15: 6, 25: 3, 29: 18, 30: 3, 31: 3}
Did not match all atoms present	68478-43-3	C1C(O1)COC2=CC=CC=C2.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.C1=CC(=CC=C1N)N	{2: 2, 11: 1, 12: 1, 14: 17, 22: 1, 23: 1, 30: 4}
Did not match all atoms present	68478-66-0	CCCCCCCCCCCCCOCCC[N+](CCO)(CCO)[O-]	{1: 1, 2: 19, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	68478-72-8	CCCCCCCCCCCCCCCCCC(=O)O.CCOP(=O)(OCC)OCC.C(CNCCN)N	{1: 4, 2: 23, 22: 3, 27: 1, 29: 1, 30: 2, 31: 1}
Did not match all atoms present	68478-85-3	CCCCCCCC/C=C(/CCCCCCCC(=O)OCC(C)CC)\S(=O)(=O)O	{1: 3, 2: 16, 3: 1, 6: 1, 7: 1, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	68478-86-4	CCCCCCCC/C=C\CCCCCCC(C(=O)OCCCCC)S(=O)(=O)O.[Na]	{1: 2, 2: 17, 3: 1, 6: 2, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	68478-97-7	B(F)(F)F.CCCCOCC1CO1.CC(C)N	{1: 3, 2: 4, 3: 1, 11: 1, 12: 1, 16: 3, 22: 1, 23: 1, 30: 1}
Did not match all atoms present	68479-16-3	CCC(C(C)Cl)(C(O[Si](O)(O)O)Cl)Cl	{1: 2, 2: 1, 3: 2, 4: 1, 17: 3, 20: 3, 22: 1}
Did not match all atoms present	68479-59-4	CC1=CC=C(C=C1)S(=O)(=O)NCCC(C)CC(C)(C)CN	{1: 4, 2: 4, 3: 1, 4: 1, 14: 4, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	68479-76-5	C[N+](C)(CC[N+](C)(C)CC(CCl)O)CC(CCl)O.[Cl-].[Cl-]	{1: 4, 2: 6, 3: 2, 20: 2, 17: 4}
Did not match all atoms present	68479-93-6	CC(=O)NC1=CC=CC2=C1C=CC(=C2N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-])[O-].[Cr+2]	{1: 1, 34: 2, 14: 8, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	6848-13-1	CN(C)C1=CC(=CC=C1)Cl	{1: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	68480-00-2	CCCCCCCCCCOCCOCCOCCOCCOCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 19, 29: 3, 22: 6}
Did not match all atoms present	68480-01-3	CCCCCCCCCCOCCOCCOCCOCCOCCOP(=O)([O-])[O-].[Na+]	{1: 1, 2: 19, 29: 3, 22: 6}
Did not match all atoms present	68480-22-8	CC(C)C1=CC=CC(=C1)CCO	{1: 2, 2: 2, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	68480-28-4	CC(=CCOC=O)C	{1: 2, 2: 1, 26: 1, 6: 1, 7: 1}
Did not match all atoms present	68480-32-0	CC1=CC2=NNN=C2C=C1.CC1=CC=CC=C1N=C(N)N=C(N)N	{32: 1, 1: 2, 34: 2, 35: 2, 7: 2, 14: 7, 30: 3}
Did not match all atoms present	68488-07-3	C/C(=C\C(=O)C)/[O-].C/C(=C\C(=O)C)/[O-].O.O.[Mg+2]	{24: 2, 1: 4, 6: 2, 7: 2}
Did not match all atoms present	68490-63-1	C1=CC=C(C=C1)C2=NC=CN2.C1(=O)NC(=O)NC(=O)N1	{32: 4, 25: 3, 35: 1, 14: 7}
Did not match all atoms present	68490-66-4	CC1=NC=CN1CCC2=NC(=NC(=N2)N)N.C1(=O)NC(=O)NC(=O)N1.O.O	{32: 3, 1: 1, 2: 2, 35: 4, 33: 1, 14: 2, 25: 3, 30: 2}
Did not match all atoms present	68492-77-3	CCN(CCCS(=O)(=O)[O-])C1=CC=C(C=C1)N=NC2=C(C=CC(=C2)Cl)Cl.[Na+]	{1: 1, 2: 4, 33: 1, 34: 2, 14: 7, 17: 2, 29: 3}
Did not match all atoms present	685-31-4	CCP(N(C)C)N(C)C	{1: 5, 2: 1, 33: 2}
Did not match all atoms present	685-83-6	CCN(CC)P(N(CC)CC)Cl	{1: 4, 2: 4, 33: 2, 17: 1}
Did not match all atoms present	6850-57-3	COC1=CC=CC=C1CN	{1: 1, 2: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	6851-44-1	CCOC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 1, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	6851-80-5	CNCC1=CC=CC=C1OC	{1: 2, 2: 1, 22: 1, 14: 4, 31: 1}
Did not match all atoms present	6851-93-0	CC=S	{1: 1, 6: 1}
Did not match all atoms present	68510-43-0	C1=CC=NC(=C1)C2=NC(=NC(=N2)C3=CC=CC=N3)C4=CC=CC=N4.C1=CC=NC(=C1)C2=NC(=NC(=N2)C3=CC=CC=N3)C4=CC=CC=N4.[O-]S(=O)(=O)[O-].[Fe+2]	{35: 12, 29: 4, 14: 24}
Did not match all atoms present	68511-19-3	C1=CC=C(C=C1)OCCOP(=O)(O)O	{2: 2, 20: 2, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	68511-88-6	CCCCCCCCCCCCCCCCCCO.COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)COC.C(CO)N(CCO)CCO	{1: 7, 2: 29, 35: 3, 33: 4, 20: 4, 22: 6}
Did not match all atoms present	68512-06-1	CC(C)C=O.C1=CC=C(C=C1)CC=O	{1: 2, 2: 1, 3: 1, 26: 2, 14: 5}
Did not match all atoms present	68512-08-3	CCOCCOCCO.C1=CC=C(C(=C1)C(=O)O)O.C(CO)NCCO.C(CO)N(CCO)CCO	{1: 1, 2: 15, 33: 1, 14: 4, 20: 6, 21: 1, 22: 2, 27: 1, 31: 1}
Did not match all atoms present	68515-41-3	CCC(CC)C(C)COC(=O)C1=CC=CC=C1C(=O)OCC(C)C(CC)CC	{1: 6, 2: 6, 3: 4, 28: 2, 14: 4}
Did not match all atoms present	68515-54-8	CCCCC(CCC)CCOC(=O)C1=CC=CC=C1C(=O)OCC(CCC)CC(C)CC	{1: 5, 2: 12, 3: 3, 28: 2, 14: 4}
Did not match all atoms present	68515-55-9	CC(C)CCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)O	{1: 2, 2: 9, 3: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	68515-61-7	CCCC(C(CC(COC(=O)C1=CC=C(C=C1)C(=O)OCCCC(C(C(CC(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl	{1: 1, 2: 8, 3: 7, 14: 4, 17: 8, 28: 2}
Did not match all atoms present	68516-15-4	CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C=NC2=[N+](C3=CC=CC=C3N=C21)C	{1: 3, 35: 2, 29: 3, 14: 9, 33: 2}
Did not match all atoms present	68516-23-4	CC(=O)C(C)(O)SCC1=CC=CO1	{1: 2, 2: 1, 4: 1, 40: 1, 14: 3, 20: 1, 23: 1, 24: 1}
Did not match all atoms present	68516-25-6	C1=CC=C2C(=C1)C(=O)/C(=N\NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])Cl)/C(=N2)[O-].[Cr+3]	{34: 1, 35: 1, 14: 6, 15: 2, 17: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68516-30-3	CCC=CC=CCCCCCCCCO[Si](C)(C)C	{1: 4, 2: 9, 22: 1, 6: 4}
Did not match all atoms present	68516-33-6	CC(C)CCCC(C)CC=C(C(=CC(=O)[O-])C)C(=O)[O-].[Na+].[Na+]	{1: 4, 2: 4, 3: 2, 6: 2, 7: 2, 24: 2}
Did not match all atoms present	68516-34-7	C[Si](C)(C)OCCCCCCCCC[CH2-].[Mg+2].[Br-]	{1: 3, 2: 9, 18: 1, 5: 1, 22: 1}
Did not match all atoms present	68516-46-1	C1=CC(=CC=C1C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].C1=CC(=CC=C1C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].C1=CC(=CC=C1C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Fe+2]	{35: 6, 29: 22, 14: 42}
Did not match all atoms present	68516-47-2	C(=NC(=N)[Se])(N)N	{34: 1, 36: 1, 30: 2, 7: 2}
Did not match all atoms present	68516-48-3	CC(=O)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCOS(=O)(=O)O	{1: 1, 2: 3, 14: 4, 20: 1, 22: 1, 24: 2, 29: 4, 31: 1}
Did not match all atoms present	68516-49-4	C1=CC2=C3C(=CC=C4C3=C1C(=O)C(C4=O)Br)C(=O)C(C2=O)Br	{25: 4, 18: 2, 12: 2, 14: 4}
Did not match all atoms present	68516-50-7	C1=CC=C(C(=C1)C(=CC=O)Cl)[N+](=O)[O-]	{6: 1, 38: 1, 7: 1, 14: 4, 17: 1, 26: 1}
Did not match all atoms present	68516-52-9	COC1=CC=CC=[C-]1.[Mg+2].[Cl-]	{1: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	68516-54-1	C1=CC(=CC=C1OC(C(F)F)(F)F)S(=O)(=O)Cl	{3: 1, 4: 1, 14: 4, 16: 4, 17: 1, 22: 1, 29: 2}
Did not match all atoms present	68516-55-2	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C2=O)C(=C(C=C3N)Br)N	{25: 2, 18: 1, 38: 1, 30: 2, 14: 4}
Did not match all atoms present	68516-57-4	C1=CC(=CC2=C(C=C(C=C21)O)S(=O)(=O)O)[N+](=O)[O-]	{38: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	68516-58-5	C1=CC(=CC=C1C(=O)NC2=CC3=C(C=C(C=C3C=C2)O)S(=O)(=O)O)[N+](=O)[O-]	{38: 1, 14: 9, 20: 1, 21: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68516-60-9	COC1=CC(=C(C=C1N=NC2=CC(=CC=C2)S(=O)(=O)[O-])OC)NN=C3C=CC(=O)C=C3.[Na+]	{1: 2, 34: 3, 14: 10, 15: 1, 22: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68516-61-0	CC[N+]1=C(C(C2=C1C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)(C)C)/C=C/C4=C(N(OC4=O)C)C5=CC=CC=C5.[I-]	{1: 4, 2: 1, 6: 2, 33: 2, 13: 1, 14: 13, 15: 1, 19: 1, 28: 1, 29: 2}
Did not match all atoms present	68516-62-1	C1=CC(=CC=C1C=C2C(=O)C3=C(S2)C=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+]	{6: 1, 41: 1, 14: 7, 15: 1, 25: 1, 29: 6}
Did not match all atoms present	68516-66-5	CCN1C(=CC=C2C(=O)[N+](C(=S)S2)(C)CC)C=CC3=C1C=CC(=C3)OCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 3, 6: 2, 33: 1, 41: 1, 14: 9, 15: 3, 22: 1, 25: 1, 29: 3}
Did not match all atoms present	68516-67-6	CCN1C(=CC=C2C(=O)N(C(=S)S2)CC)C=CC3=C1C=CC(=C3)OCC	{1: 3, 2: 3, 6: 2, 33: 2, 41: 1, 14: 5, 15: 3, 22: 1, 25: 1}
Did not match all atoms present	68516-69-8	CCOC1=CC2=C(C=C1)[N+](=C(C=C2)C)C.COS(=O)(=O)[O-]	{1: 4, 2: 1, 33: 1, 14: 5, 22: 2, 29: 3}
Did not match all atoms present	68516-70-1	CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3)Cl	{1: 1, 2: 18, 14: 12, 17: 1, 22: 1, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	68516-71-2	CC1=CC(C(CC1)C(C)C)OC=O	{1: 3, 3: 1, 11: 2, 12: 2, 14: 1, 15: 1, 26: 1}
Did not match all atoms present	68516-72-3	CCCCCCCCC(C(CCCCCCCC(=O)OCCCC)S(=O)(=O)[O-])O.[Na+]	{1: 2, 2: 17, 3: 2, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	68516-74-5	COC1=C(C=CC(=C1)[N+](=O)[O-])N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC5=C4C=CC=C5NC(=O)C6=CC7=CC=CC=C7/C(=N/NC8=C(C=C(C=C8)[N+](=O)[O-])OC)/C6=O	{1: 2, 34: 2, 38: 2, 14: 22, 15: 4, 22: 2, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	68516-75-6	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=C(C(=CC=C3)Cl)Cl)C(=O)NC4=CC=CC5=C4C=CC=C5NC(=O)C6=CC7=CC=CC=C7/C(=N/NC8=C(C(=CC=C8)Cl)Cl)/C6=O	{34: 2, 14: 22, 15: 4, 17: 4, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	68516-77-8	COC1=C(C2=C(C(=C1)NC(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4C2=O)N	{1: 1, 14: 10, 22: 1, 24: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	68516-78-9	B(O)(O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{33: 3, 2: 18, 20: 12}
Did not match all atoms present	68516-79-0	C1=CC2=C(C(=C(C=C2C=C1[N+](=O)[O-])S(=O)(=O)[O-])O)[N+]#N	{34: 1, 38: 1, 21: 1, 14: 4, 29: 3}
Did not match all atoms present	68516-80-3	CC1=C2C(=C(C=C1)C)SC(=C3C(=O)C4=CC=CC=C4S3)C2=O	{1: 2, 25: 2, 41: 2, 14: 6, 15: 2}
Did not match all atoms present	68516-81-4	CCN(CCO)C1=CC(=C(C=C1)N=NC2=NC=C(S2)[N+](=O)[O-])C	{1: 2, 2: 3, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 4, 20: 1}
Did not match all atoms present	68516-83-6	CCCCCCCCCCCC(=O)N(C(=O)CCCCCCCCCCC)NC(=S)N	{1: 2, 2: 20, 33: 1, 7: 1, 24: 2, 30: 1, 31: 1}
Did not match all atoms present	68516-98-3	[H+].[H+].[H+].[H+].CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(/C(=N\NC3=CC4=CC(=C(C(=C4C=C3)[O-])N=NC5=C(C=C(C=C5)S(=O)(=O)CCOS(=O)(=O)[O-])[O-])S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Cu+2]	{1: 1, 2: 2, 34: 3, 14: 10, 15: 2, 22: 1, 24: 1, 25: 1, 29: 14, 31: 2}
Did not match all atoms present	68516-99-4	C1=CC2=C(C(=C(C=C2C=C1NN=C3C=CC4=C(C3=O)C(=C(C=C4S(=O)(=O)O)S(=O)(=O)O)N)S(=O)(=O)O)N=NC5=C(C=C(C=C5)S(=O)(=O)CCOS(=O)(=O)O)[O-])[O-].[Cu+2]	{2: 2, 34: 3, 14: 10, 15: 1, 20: 4, 22: 1, 25: 1, 29: 10, 30: 1, 31: 1}
Did not match all atoms present	68517-00-0	C1=CC\2=C(C=CC(=O)/C2=N\NC3=C(C=CC(=C3)S(=O)(=O)N)O)C=C1S(=O)(=O)[O-].[Na+].[Cr]	{34: 1, 14: 8, 15: 1, 21: 1, 25: 1, 29: 5, 30: 1, 31: 1}
Did not match all atoms present	68517-02-2	CCC(C1=CC=C(C=C1)OCC2CO2)(C3=CC=C(C=C3)OCC4CO4)C5=CC=C(C=C5)OCC6CO6	{1: 1, 2: 4, 4: 1, 11: 3, 12: 3, 14: 12, 22: 3, 23: 3}
Did not match all atoms present	68517-11-3	CC1=CC=CC=C1N=NC2=CC(=C(C(=C2)C)N)C	{1: 3, 34: 2, 30: 1, 14: 6}
Did not match all atoms present	6852-54-6	CCN=CC1=CC=CC=C1	{1: 1, 2: 1, 34: 1, 14: 5, 6: 1}
Did not match all atoms present	6852-55-7	CCCN=CC1=CC=CC=C1	{1: 1, 2: 2, 34: 1, 14: 5, 6: 1}
Did not match all atoms present	6852-56-8	CC(C)N=CC1=CC=CC=C1	{1: 2, 34: 1, 3: 1, 14: 5, 6: 1}
Did not match all atoms present	6852-58-0	CC(C)(C)N=CC1=CC=CC=C1	{1: 3, 34: 1, 4: 1, 14: 5, 6: 1}
Did not match all atoms present	68521-58-4	COC(=O)C(CC1=CC=CC=C1)N=C=S	{1: 1, 2: 1, 3: 1, 8: 1, 34: 1, 14: 5, 28: 1}
Did not match all atoms present	68525-41-7	CC(C)(C)[C@H](C1=CC=C(C=C1)Cl)[C@H](C2=CC=C(C=C2)Cl)C(C)(C)C	{1: 6, 3: 2, 4: 2, 14: 8, 17: 2}
Did not match all atoms present	68527-46-8	CC(=O)OCCC1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 2: 2, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	68527-47-9	CC(C)C1=CC(=CC(=C1)C(C)(C)OOC(C)(C)C)C(C)C	{1: 9, 3: 2, 4: 2, 22: 2, 14: 3}
Did not match all atoms present	68527-48-0	CC(C)C1=CC(=CC(=C1)C(C)(C)OOC(C)(C)C)C(C)(C)OOC(C)(C)C	{1: 12, 3: 1, 4: 4, 22: 4, 14: 3}
Did not match all atoms present	68527-59-3	C1CC(=O)N=C1[O-].C1CC(=O)N=C1[O-].C1CC(=O)N=C1[O-].C1CC(=O)N=C1[O-].[K+].[Au+3]	{25: 4, 11: 8, 35: 4, 15: 4}
Did not match all atoms present	68527-61-7	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.C1=CC=C(C=C1)C(=O)[O-]	{1: 4, 33: 2, 7: 1, 14: 18, 15: 2, 24: 1}
Did not match all atoms present	68527-62-8	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)[O-])CC2=C(C=CC(=C2)C(C)(C)CC(C)(C)C)[O-].[Ca+2]	{1: 10, 2: 3, 4: 4, 14: 6}
Did not match all atoms present	68527-63-9	CCCCCCCCC=CCCCCCCCC1=NCCN1CCO.CCOS(=O)(=O)OCC	{1: 3, 2: 18, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 20: 1, 22: 2, 29: 2}
Did not match all atoms present	68527-66-2	C1=CC2=CC(=CC(=C2N=C1)[N+](=O)[O-])Cl	{17: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	68527-67-3	C1=CC2=CC(=CC(=C2N=C1)[N+](=O)[O-])Br	{18: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	68527-68-4	CC1=CC(=C2C(=C1C)C=CC=N2)[N+](=O)[O-]	{1: 2, 35: 1, 38: 1, 14: 4}
Did not match all atoms present	68527-70-8	C1=CC=C(C=C1)C2=CC(=C3C(=C2)C=CC=N3)[N+](=O)[O-]	{35: 1, 38: 1, 14: 10}
Did not match all atoms present	68527-71-9	C1=CC=C(C=C1)C2=CC(=C3C(=C2)C=CC=N3)N	{35: 1, 30: 1, 14: 10}
Did not match all atoms present	68527-72-0	CC(C)(C)C1=CC=CC=C1C#N	{1: 3, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	68527-78-6	CCCCCC(=CC1=CC=CC=C1)C=NC2=CC=CC=C2C(=O)OC	{1: 2, 2: 4, 6: 2, 7: 1, 34: 1, 14: 9, 28: 1}
Did not match all atoms present	68527-79-7	CC(CCCC(C)(C)O)C=CN1C=CC2=CC=CC=C21	{1: 3, 2: 3, 3: 1, 4: 1, 6: 2, 33: 1, 14: 6, 20: 1}
Did not match all atoms present	68527-81-1	CC1(C2=CC(=C(C=C2C(C3=CC(=C(C=C31)O)O)(C)C)O)O)C	{1: 4, 13: 2, 14: 4, 21: 4}
Did not match all atoms present	68527-84-4	CCCCCCCCCCCCCC[N+](C)(C)CC.[Br-]	{1: 4, 2: 14, 18: 1}
Did not match all atoms present	68527-98-0	CC1=C(C=CC(=C1)OP(=O)(OC2=CC(=C(C=C2)[N+](=O)[O-])C)OC3=CC(=C(C=C3)[N+](=O)[O-])C)[N+](=O)[O-]	{1: 3, 38: 3, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	68527-99-1	CCCCCCCCCCCC1=[N+](CC[N+]1(CCO)CC(=O)[O-])CC(=O)[O-].[OH-].[OH-].[Na+].[Na+]	{1: 1, 2: 14, 33: 1, 11: 2, 15: 1, 20: 1, 24: 2}
Did not match all atoms present	68528-00-7	CCN(CC)C1=CC2=C(CC3=CC(=C(C=C32)C)Cl)C=C1	{1: 3, 2: 2, 33: 1, 11: 1, 14: 5, 17: 1}
Did not match all atoms present	6853-29-8	CCC1=C(C=CC(=C1)[N+](=O)[O-])N	{1: 1, 2: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	6853-31-2	[2H]C([2H])O[2H]	{1: 1, 20: 1}
Did not match all atoms present	6853-57-2	CCCCCC1=CC=C(C=C1)C=O	{1: 1, 2: 4, 26: 1, 14: 4}
Did not match all atoms present	68532-86-5	CC1=CC(=O)NC(=C1[N+]2=CC=CC=C2)[O-]	{32: 1, 1: 1, 33: 1, 14: 6, 25: 1}
Did not match all atoms present	68538-86-3	CCCCCCCC/C=C/CCCCCCCCOC(=O)/C=C/C(=O)O[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)/C=C\C(=O)OCCCCCCCC/C=C\CCCCCCCC	{1: 4, 2: 44, 28: 4, 6: 8}
Did not match all atoms present	68540-40-9	CCCCCCCCCCCCCCCCC1=CC(=C(C=C1)[O-])C(=O)O.CCCCCCCCCCCCCCCCC1=CC(=C(C=C1)[O-])C(=O)O.[Ca+2]	{1: 2, 2: 30, 27: 2, 14: 6}
Did not match all atoms present	68540-42-1	COC1=C(C=CC(=C1)[N+](=O)[O-])N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC5=C4C=CC=C5NC(=O)C6=CC7=CC=CC=C7/C(=N\NC8=C(C(=CC=C8)Cl)Cl)/C6=O	{1: 1, 34: 2, 38: 1, 14: 22, 15: 4, 17: 2, 22: 1, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	68540-43-2	CC1=CCC(CC1)C(C)(C)[O-].[Na+]	{1: 3, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 29: 1}
Did not match all atoms present	68540-44-3	CCCCCCCC(C)(C)CCC1=CC=C(C=C1)C(=C(CCCCCC)NO)N=O	{1: 4, 2: 13, 4: 1, 7: 2, 34: 1, 14: 4, 20: 1, 29: 1, 31: 1}
Did not match all atoms present	68540-62-5	CC(C)C1=CC=CC=C1C(C)(C)OOC(C)(C)C	{1: 7, 3: 1, 4: 2, 22: 2, 14: 4}
Did not match all atoms present	68540-63-6	CC(C)C1=CC=CC=C1C(C)(C)OOC(C)(C)C2=CC=CC=C2C(C)C	{1: 8, 3: 2, 4: 2, 22: 2, 14: 8}
Did not match all atoms present	68540-75-0	COC1=C(C=C(C=C1)[N+](=O)[O-])[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 38: 1, 14: 3, 17: 3, 22: 1}
Did not match all atoms present	68540-76-1	CC1=C(C=CC(=C1)Cl)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 14: 3, 17: 4}
Did not match all atoms present	68540-78-3	CC1=C(C=C(C=C1)Cl)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 14: 3, 17: 4}
Did not match all atoms present	68540-79-4	CCCCNS(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C	{1: 3, 2: 3, 14: 3, 22: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	68540-81-8	COC1=CC(=C(C=C1)[N+]#N)[N+](=O)[O-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 38: 1, 14: 3, 17: 3, 22: 1}
Did not match all atoms present	68540-82-9	COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 38: 1, 14: 3, 17: 3, 22: 1}
Did not match all atoms present	68540-83-0	C1=CC(=C(C=C1[N+](=O)[O-])Cl)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 4, 34: 1, 38: 1, 14: 3}
Did not match all atoms present	68540-84-1	C1=CC(=C(C=C1C(F)(F)F)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Zn+2]	{16: 3, 17: 4, 34: 1, 4: 1, 14: 3}
Did not match all atoms present	68540-85-2	CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{24: 1, 1: 1, 14: 10, 31: 1}
Did not match all atoms present	68540-86-3	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC=C(C=C3)Cl)[O-].[Na+]	{24: 1, 17: 1, 14: 10, 31: 1}
Did not match all atoms present	68540-87-4	CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{24: 1, 1: 1, 31: 1, 14: 9, 17: 1}
Did not match all atoms present	68540-88-5	CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C	{1: 4, 2: 2, 33: 1, 14: 3, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68540-89-6	CCOC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)OCC)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 14: 7, 22: 2, 24: 1}
Did not match all atoms present	68540-90-9	CN(CCS(=O)(=O)[O-])N=NC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2)OC.[Na+]	{1: 2, 2: 2, 33: 1, 34: 2, 14: 8, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	68540-93-2	COC1=CC(=C(C=C1)OC)NC(=O)C2=C(C=C3C4=CC=CC=C4OC3=C2)[O-].[Na+]	{1: 2, 14: 9, 22: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	68540-94-3	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=CC(=O)C)[O-])C)NC(=CC(=O)C)[O-].[Na+].[Na+]	{1: 4, 6: 2, 7: 2, 14: 6, 24: 2, 31: 2}
Did not match all atoms present	68540-96-5	COC1=C(C=C(C=C1)C(=O)N)[N+]#N.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 14: 3, 17: 3, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	68540-99-8	CC(=O)NC1=CC=CC2=C1/C(=N/NC3=C(C(=CC(=C3)[N+](=O)[O-])NC(=O)C)O)/C(=O)C=C2	{1: 2, 34: 1, 38: 1, 14: 7, 15: 1, 21: 1, 24: 2, 25: 1, 31: 3}
Did not match all atoms present	68541-00-4	CCCCCCCCCC1=CC(=C(C(=C1)C(=O)C2=CC=CC=C2)O)Cl	{1: 1, 2: 8, 14: 7, 17: 1, 21: 1, 24: 1}
Did not match all atoms present	68541-03-7	CC(=O)N(C=CC=C1C(=O)N(C(=O)N(C1=O)C)C)C2=CC=CC=C2	{1: 3, 6: 3, 33: 3, 14: 5, 15: 1, 24: 1, 25: 3}
Did not match all atoms present	68541-04-8	CCC(COS(=O)(=O)O)N	{1: 1, 2: 2, 3: 1, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	68541-05-9	CC1=NN(C(=O)C1=CC2=CC=C(C=C2)N(CCC#N)CCC#N)C3=CC=C(C=C3)S(=O)(=O)O	{1: 1, 2: 4, 35: 1, 37: 2, 6: 1, 33: 2, 14: 8, 15: 2, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	68541-06-0	CCOC(=O)C1=NN(C(=O)C1C=CC=C2C(=O)N(C(=O)N(C2=O)C)C)C3=CC=C(C=C3)S(=O)(=O)O	{1: 3, 2: 1, 35: 1, 6: 3, 33: 3, 12: 1, 14: 4, 15: 2, 20: 1, 25: 4, 28: 1, 29: 2}
Did not match all atoms present	68541-11-7	CCCCCCCCCCCCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 12, 29: 3, 22: 1}
Did not match all atoms present	68541-69-5	[H+].CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])C3=CC=CC=C3.[Na+].[Na+].[Na+].[Na+].[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 14, 29: 12}
Did not match all atoms present	68541-71-9	CN(C)CC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 1, 33: 1, 14: 9, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	68541-73-1	C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N.F[P-](F)(F)(F)(F)F	{16: 6, 34: 1, 14: 9, 31: 1}
Did not match all atoms present	68541-88-8	C1CCN(CC1)P(=[Se])(N2CCCCC2)N3CCCCC3	{33: 3, 11: 15}
Did not match all atoms present	68550-85-6	[Li+].[Li+].CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)S(=O)(=O)[NH-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)S(=O)(=O)[NH-])[O-])C3=CC=CC=C3.[Co+2]	{1: 2, 34: 4, 35: 2, 36: 2, 33: 2, 12: 2, 14: 16, 15: 2, 25: 2, 29: 4}
Did not match all atoms present	68550-96-9	B(O)(O)O.CCOCCOCCOCCO	{1: 1, 2: 7, 20: 4, 22: 3}
Did not match all atoms present	68550-97-0	B(O)(O)O.CCOCCOCCOCCOCCO	{1: 1, 2: 9, 20: 4, 22: 4}
Did not match all atoms present	68555-29-3	CC(=CCC#N)CCC1=CC=CC=C1	{1: 1, 2: 3, 37: 1, 6: 1, 7: 1, 14: 5}
Did not match all atoms present	68555-31-7	CC(CCC#N)CCC1=CC=CC=C1	{1: 1, 2: 4, 3: 1, 37: 1, 14: 5}
Did not match all atoms present	68555-33-9	CC1CC(OC(O1)C2=CC=C(C=C2)C(C)C)(C)C	{1: 5, 3: 1, 11: 1, 12: 2, 13: 1, 14: 4, 23: 2}
Did not match all atoms present	68555-40-8	CCC(=CC1=[N+](C2=C([Se]1)C=CC(=C2)OC)CC)C=C3N(C4=C([Se]3)C=CC(=C4)OC)CC.[I-]	{1: 5, 2: 3, 33: 2, 6: 2, 7: 1, 14: 6, 15: 1, 19: 1, 22: 2}
Did not match all atoms present	68555-54-4	C1=CC=C(C(=C1)N2C(=O)C=CC2=O)SCCSC3=CC=CC=C3N4C(=O)C=CC4=O	{40: 2, 25: 4, 2: 2, 14: 12, 33: 2}
Did not match all atoms present	68555-55-5	C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)N3C(=O)C=CC3=O)N4C(=O)C=CC4=O	{25: 4, 29: 2, 14: 12, 33: 2}
Did not match all atoms present	68555-56-6	CC1=C(C=CC(=C1)N2C(=O)N(C2=O)C3=CC(=C(C=C3)N=C=O)C)N=C=O	{1: 2, 34: 2, 33: 2, 8: 2, 14: 6, 25: 2, 29: 2}
Did not match all atoms present	68555-58-8	CC(=CCOC(=O)C1=CC=CC=C1O)C	{1: 2, 2: 1, 6: 1, 7: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	68555-66-8	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)S(=O)[O-])(F)F)(F)F)(F)F.[Na+]	{16: 15, 4: 7, 29: 2}
Did not match all atoms present	68555-68-0	CCN(CC(=O)[O-])S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F.[Na+]	{1: 1, 2: 2, 4: 4, 33: 1, 16: 9, 24: 1, 29: 2}
Did not match all atoms present	68555-70-4	CCN(CC(=O)[O-])S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Na+]	{1: 1, 2: 2, 4: 6, 33: 1, 16: 13, 24: 1, 29: 2}
Did not match all atoms present	68555-71-5	CCN(CC(=O)[O-])S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Na+]	{1: 1, 2: 2, 4: 7, 33: 1, 16: 15, 24: 1, 29: 2}
Did not match all atoms present	68555-77-1	CN(C)CCCNS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 4, 33: 1, 16: 9, 29: 2, 31: 1}
Did not match all atoms present	68555-78-2	CN(C)CCCNS(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 5, 33: 1, 16: 11, 29: 2, 31: 1}
Did not match all atoms present	68555-79-3	CCN(CC(=O)OCC)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 5, 33: 1, 16: 11, 28: 1, 29: 2}
Did not match all atoms present	68555-80-6	CC(=C)C(=O)NC1=CC=CC=C1C(=O)NO	{1: 1, 5: 1, 7: 1, 14: 4, 20: 1, 24: 2, 31: 2}
Did not match all atoms present	68555-83-9	B(OCC(CC)(CO)COCC(CBr)Br)(OCC(CC)(CO)COCC(CBr)Br)OCC(CC)(CO)COCC(CBr)Br	{1: 3, 2: 18, 3: 3, 4: 3, 18: 6, 20: 3, 22: 6}
Did not match all atoms present	68555-84-0	CCC(CO)(COCC(CBr)Br)COP(OCC(CC)(CO)COCC(CBr)Br)OCC(CC)(CO)COCC(CBr)Br	{1: 3, 2: 18, 3: 3, 4: 3, 18: 6, 20: 3, 22: 6}
Did not match all atoms present	68555-85-1	CCC(COC[C@H](CBr)Br)(COC[C@H](CBr)Br)COP(OCC(CC)(COC[C@H](CBr)Br)COC[C@H](CBr)Br)OCC(CC)(COC[C@H](CBr)Br)COC[C@@H](CBr)Br	{1: 3, 2: 24, 3: 6, 4: 3, 18: 12, 22: 9}
Did not match all atoms present	68555-87-3	B(OCC(CC)(COCC(CBr)Br)COCC(CBr)Br)(OCC(CC)(COCC(CBr)Br)COCC(CBr)Br)OCC(CC)(COCC(CBr)Br)COCC(CBr)Br	{1: 3, 2: 24, 3: 6, 4: 3, 18: 12, 22: 9}
Did not match all atoms present	68555-96-4	C1=CC2=C(C(=C(C=C2C=C1N)S(=O)(=O)O)N=NC3=C(C=CC(=C3)S(=O)(=O)O)[O-])[O-].[Cu+2]	{30: 1, 34: 2, 20: 2, 29: 4, 14: 7}
Did not match all atoms present	68556-00-3	CC1=C(C=CC(=C1)OC)NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{24: 1, 1: 2, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	68556-01-4	COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{24: 1, 1: 1, 22: 1, 14: 10, 31: 1}
Did not match all atoms present	68556-02-5	C1CN(CCN1)C2=CC=C(C=C2)OC[C@@H]3CO[C@@](O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl	{32: 1, 33: 2, 2: 2, 35: 1, 11: 5, 12: 1, 13: 1, 14: 10, 17: 2, 22: 1, 23: 2}
Did not match all atoms present	68556-03-6	COC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{24: 1, 1: 1, 22: 1, 14: 10, 31: 1}
Did not match all atoms present	68556-04-7	CC1=C(C=CC(=C1)Cl)NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{24: 1, 1: 1, 31: 1, 14: 9, 17: 1}
Did not match all atoms present	68556-05-8	C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC4=CC=CC=C4C=C3[O-].[Na+]	{24: 1, 14: 13, 31: 1}
Did not match all atoms present	68556-07-0	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])[O-].[Na+]	{24: 1, 38: 1, 14: 10, 31: 1}
Did not match all atoms present	68556-09-2	C1=CC=C2C=C(C(=CC2=C1)C(=O)NC3=CC(=CC=C3)Cl)[O-].[Na+]	{24: 1, 17: 1, 14: 10, 31: 1}
Did not match all atoms present	68556-11-6	COC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{24: 1, 1: 2, 22: 2, 14: 9, 31: 1}
Did not match all atoms present	68556-12-7	COC1=CC(=C(C=C1NC(=O)C2=CC3=CC=CC=C3C=C2[O-])Cl)OC.[Na+]	{1: 2, 14: 8, 17: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	68556-13-8	C1=CC=C2C(=C1)C3=CC(=C(C=C3N2)C(=O)NC4=CC=C(C=C4)Cl)[O-].[Na+]	{24: 1, 17: 1, 32: 1, 14: 10, 31: 1}
Did not match all atoms present	68556-14-9	COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C4=CC5=CC=CC=C5C=C4[O-].[Na+]	{1: 1, 14: 12, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	68556-15-0	COC1=CC(=C(C=C1NC(=CC(=O)C2=CC=C(C=C2)C(=O)C=C(NC3=CC(=C(C=C3OC)OC)Cl)[O-])[O-])Cl)OC.[Na+].[Na+]	{1: 4, 6: 2, 7: 2, 14: 8, 17: 2, 22: 4, 24: 2, 31: 2}
Did not match all atoms present	68556-16-1	C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=C(C=C4C5=CC=CC=C5OC4=C3)[O-].[Na+]	{24: 1, 31: 1, 14: 13, 23: 1}
Did not match all atoms present	68556-17-2	CCOC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{1: 1, 2: 1, 14: 10, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	68556-18-3	CC1=C(C=C(C=C1)C(=O)NC2=CC3=CC=CC=C3C=C2[O-])Cl.[Na+]	{24: 1, 1: 1, 31: 1, 14: 9, 17: 1}
Did not match all atoms present	68556-19-4	COC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)OC)[N+](=O)[O-]	{24: 1, 1: 2, 38: 1, 22: 2, 14: 7}
Did not match all atoms present	68556-20-7	CC1=CC=C(C=C1)C(=O)NC2=CC3=CC=CC=C3C=C2[O-].[Na+]	{24: 1, 1: 1, 14: 10, 31: 1}
Did not match all atoms present	68556-22-9	CC(=O)CSC1=CC=CO1	{1: 1, 2: 1, 40: 1, 14: 3, 23: 1, 24: 1}
Did not match all atoms present	6856-08-2	COC1=CC=CC(=C1)NC2=C(C=C3C(=C2)[N+](=C4C=C(C5=C(C4=N3)C=CC=C5S(=O)(=O)[O-])NC6=CC=CC=C6)C7=CC=CC=C7)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 35: 1, 33: 1, 14: 20, 22: 1, 29: 6, 31: 2}
Did not match all atoms present	6856-43-5	C[N+]1(CCCCC1)CCC(C2CCCCC2)(C3=CC=CC=C3)O.[I-]	{1: 1, 2: 2, 4: 1, 11: 10, 12: 1, 14: 5, 19: 1, 20: 1}
Did not match all atoms present	68566-23-4	[Cr+2].[OH-]	{}
Did not match all atoms present	68567-68-0	CCCCCCCCCCC(C)C1=CC=C(C=C1)S(=O)(=O)O.C(CO)NCCO	{1: 2, 2: 13, 3: 1, 14: 4, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	68567-69-1	CCCCCCCCCCC(C)C1=CC=C(C=C1)S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 2, 2: 15, 3: 1, 33: 1, 14: 4, 20: 4, 29: 2}
Did not match all atoms present	68568-52-5	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=CC=C3.[Co+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 16, 29: 4, 30: 2}
Did not match all atoms present	68568-53-6	CCCCCCCCCCCCCOP(=O)([O-])OCCCCCCCCCCCCC.[K+]	{1: 2, 2: 24, 29: 2, 22: 2}
Did not match all atoms present	68568-55-8	CCOC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)OCC)N	{1: 2, 2: 2, 14: 7, 22: 2, 24: 1, 30: 1}
Did not match all atoms present	68568-56-9	CC1=CC(=C(C=C1)[N+]#N)[N+](=O)[O-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 1, 34: 1, 38: 1, 14: 3, 17: 3}
Did not match all atoms present	68568-63-8	C(C(C(=O)[O-])O)(C(C(=O)[O-])O)O.[Ca+2]	{24: 2, 3: 3, 20: 3}
Did not match all atoms present	68568-78-5	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=NC4C(=NNC4=O)C)S(=O)(=O)O	{32: 1, 1: 2, 34: 2, 35: 2, 41: 1, 12: 1, 14: 6, 15: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	68568-82-1	CCCCCCCCC1=CC(=C(C=C1)[O-])CNCCN(CCNCC2=C(C=CC(=C2)CCCCCCCC)[O-])CC3=C(C=CC(=C3)CCCCCCCC)O.[Ca+2]	{1: 3, 2: 28, 33: 1, 14: 9, 21: 1, 31: 2}
Did not match all atoms present	68575-35-9	CC(C)(C1=CC(=CC(=C1)Cl)Cl)O	{1: 2, 4: 1, 20: 1, 14: 3, 17: 2}
Did not match all atoms present	68575-36-0	CC(=C)C1=CC(=CC(=C1)Cl)Cl	{1: 1, 17: 2, 5: 1, 14: 3, 7: 1}
Did not match all atoms present	68579-60-2	CNCC(C1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	6858-44-2	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{24: 33, 20: 11, 2: 22, 4: 11}
Did not match all atoms present	68582-45-6	CCN(CC)C1=CC=C(C=C1)C(C2=C(C=C(C=C2)N(CC)CC)C)C3=C(C=C(C=C3)N(CC)CC)C	{1: 8, 2: 6, 3: 1, 14: 10, 33: 3}
Did not match all atoms present	68583-50-6	C[Si]1(O[Si](O[Si](O1)(C)C)(C)C)C.O=[Si]=O	{1: 6, 29: 2, 23: 3}
Did not match all atoms present	68584-26-9	CCCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)[O-].CCCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)[O-].[Mg+2]	{1: 4, 2: 18, 3: 2, 29: 6, 14: 8}
Did not match all atoms present	68584-37-2	CCOP(=O)(C(C(F)F)(C(F)F)O)OCC	{1: 2, 2: 2, 3: 2, 4: 1, 16: 4, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	68584-38-3	C[Si](C)(CCCC#N)Cl.O=[Si]=O	{1: 2, 2: 3, 37: 1, 29: 2, 17: 1}
Did not match all atoms present	68584-80-5	CCCCCCCC[Si](C)(C)Cl.O=[Si]=O	{1: 3, 2: 7, 29: 2, 17: 1}
Did not match all atoms present	68585-12-6	C1CCCC(CCC1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 4, 11: 7, 12: 1, 33: 1, 25: 2}
Did not match all atoms present	68585-51-3	B(O)(O)O.[O-2].[O-]P(=O)([O-])[O-].[O-]S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2].[Zn+2]	{20: 3, 29: 8}
Did not match all atoms present	68585-54-6	CN(C)C(=O)SC(=O)N(C)C.C1COS(=O)(=O)C1	{1: 4, 33: 2, 40: 1, 11: 3, 23: 1, 24: 2, 29: 2}
Did not match all atoms present	68585-66-0	CCCCCCCCO.CCCCCCCCO.CCCCCCCCO.CCCCCCCCO.[Ti]	{1: 4, 2: 28, 20: 4}
Did not match all atoms present	68585-98-8	CCCCCCCCCCCCC1=CC=CC=C1CS(=O)(=O)O.C(CO)NCCO	{1: 1, 2: 16, 14: 4, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	68586-04-9	C1=CC(=O)/C(=N/NC2=C(C=CC(=C2)Cl)[O-])/C(=C1)[O-].[Cu+2]	{34: 1, 14: 6, 15: 2, 17: 1, 25: 1, 31: 1}
Did not match all atoms present	68586-07-2	B(O)(O)O.C(CO)N	{2: 2, 20: 4, 30: 1}
Did not match all atoms present	68586-21-0	CCCCCCCCCCCCC1=CC=CC=C1[O-].CCCCCCCCCCCCC1=CC=CC=C1[O-].[Pb+2]	{1: 2, 2: 22, 14: 8}
Did not match all atoms present	6859-25-2	CC1=C(C=C(C=C1)CC(=O)C2=CN(C3=CC=CC=C32)C(=O)CC4=CC(=C(C=C4)C)C)C	{24: 2, 1: 4, 2: 2, 14: 11, 33: 1}
Did not match all atoms present	68591-34-4	C1=CC=C(C(=C1)OP(=S)(Cl)Cl)Cl	{17: 3, 22: 1, 14: 4}
Did not match all atoms present	68596-94-1	CC1=CC=C(C=C1)[N+]#N.[I-].[I-].[I-]	{1: 1, 34: 1, 19: 3, 14: 4}
Did not match all atoms present	686-07-7	CCN(CC)C(=S)SC	{40: 1, 1: 3, 2: 2, 33: 1, 7: 1}
Did not match all atoms present	686-69-1	CCP(CC)Cl	{1: 2, 2: 2, 17: 1}
Did not match all atoms present	6860-97-5	CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O	{1: 1, 14: 8, 20: 2, 21: 1, 29: 6, 31: 1}
Did not match all atoms present	68602-57-3	C(=O)(C(F)(F)F)OS(=O)(=O)C(F)(F)F	{16: 6, 28: 1, 4: 2, 29: 2}
Did not match all atoms present	68603-25-8	C.C.CCOCCCCCCCCO	{1: 1, 2: 9, 20: 1, 22: 1}
Did not match all atoms present	68604-70-6	C1C[N+](C=N1)(CCC(=O)O)CCOCCC(=O)O.C(CO)NCCO.C(CO)NCCO	{2: 14, 35: 1, 11: 2, 14: 1, 20: 4, 22: 1, 27: 2, 31: 2}
Did not match all atoms present	68606-28-0	CC1=CC(=C(C=C1Cl)Cl)OCC(=C)C	{1: 2, 2: 1, 5: 1, 7: 1, 14: 2, 17: 2, 22: 1}
Did not match all atoms present	68608-61-7	CCCCCCCCCC1=NCCN1CCO.C(C(=O)O)Cl.[OH-].[Na+]	{1: 1, 2: 11, 35: 1, 33: 1, 11: 2, 15: 1, 17: 1, 20: 1, 27: 1}
Did not match all atoms present	68608-72-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)N.C1=CC2=C(C=CC3=C2C(=C1)C(=O)C4=C3C=CC(=C4)Br)Br.[O-2].[Cu+2]	{25: 3, 18: 2, 30: 1, 14: 15}
Did not match all atoms present	68608-75-3	CCCCCCC=O.C1=CC=C(C=C1)C=O	{1: 1, 2: 5, 26: 2, 14: 5}
Did not match all atoms present	68608-89-9	CCC(C1=CC=C(C=C1)S(=O)(=O)[O-])C(C)CC(C)CC(C)C.[Na+]	{1: 5, 2: 3, 3: 4, 29: 3, 14: 4}
Did not match all atoms present	68609-69-8	CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC[O-]	{1: 1, 2: 20, 35: 1, 11: 2, 15: 1, 20: 1, 29: 1}
Did not match all atoms present	6861-64-9	C1CC2=CC=CC3=C(C=CC1=C23)I	{19: 1, 11: 2, 14: 5}
Did not match all atoms present	68610-38-8	CCCCCCCCCC(CCCC/C=C/C)C1=NCCN1CCO.C(C(CCl)O)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 16, 3: 2, 6: 2, 33: 1, 11: 2, 15: 1, 17: 1, 35: 1, 20: 2, 29: 3}
Did not match all atoms present	68610-72-0	CC(=O)C.[OH-].[OH-].[Ca+2]	{24: 1, 1: 2}
Did not match all atoms present	68611-02-9	C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.C(CO)N(CCO)CC[O-].C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Na+]	{33: 3, 2: 15, 3: 4, 4: 1, 20: 8, 27: 8, 29: 1}
Did not match all atoms present	68611-08-5	CC(C)(C1=CC=CC=C1)OO.O=S=O	{1: 2, 4: 1, 40: 1, 14: 5, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	68611-47-2	[O-][Si]([O-])([O-])[O-].[Zn+2].[Zn+2]	{29: 4}
Did not match all atoms present	68611-55-2	CCCCCCCCCCCCCOS(=O)(=O)O	{1: 1, 2: 12, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	68611-74-5	C.C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C	{1: 20, 2: 12, 14: 32, 23: 4, 28: 4, 31: 8}
Did not match all atoms present	68612-93-1	CC1=CC(=O)N(C(=C1C#N)O)CCC2=CC=CC=C2	{1: 1, 2: 2, 37: 1, 33: 1, 14: 6, 21: 1, 25: 1}
Did not match all atoms present	6862-68-6	CCOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)OCC	{1: 2, 2: 2, 27: 2, 28: 2, 14: 2}
Did not match all atoms present	68622-14-0	C1=CC(=C(C=C1[N+](=O)[O-])N=C=O)F	{34: 1, 38: 1, 8: 1, 14: 3, 16: 1, 29: 1}
Did not match all atoms present	68630-78-4	CC(C)CCCCCSCC(=O)[O-].CSC.[Cl-].[Pt+2]	{1: 4, 2: 6, 3: 1, 40: 2, 17: 1, 24: 1}
Did not match all atoms present	68630-80-8	CCCCSCCCC.CCCCSCCCC.[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2].[Pd+2]	{40: 2, 1: 4, 2: 12, 17: 4}
Did not match all atoms present	68630-81-9	CCSCC.[Cl-].[Cl-].[Cl-].[Ru+3]	{40: 1, 1: 2, 2: 2, 17: 3}
Did not match all atoms present	68630-88-6	CCCCCCCCCCCCCCCCCCOC(=O)C(CC(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 23, 3: 2, 28: 2, 29: 3}
Did not match all atoms present	68630-89-7	CCCCCCC1CC(C(C=C1)CCCCCCCC(=O)[O-])C(=O)O.[K+]	{1: 1, 2: 12, 11: 1, 12: 3, 14: 2, 24: 1, 27: 1}
Did not match all atoms present	68630-90-0	CCN(CC)C1=CC=C(C=C1)C(=N)C2=CC=C(C=C2)N(CC)CC.[OH-].[OH-].[O-2].[O-2].P.[Mo]	{1: 4, 2: 4, 36: 1, 33: 2, 7: 1, 14: 8}
Did not match all atoms present	68630-92-2	CCCCCCCC1N(C=CN1CCOCCC(=O)[O-])CCC(=O)[O-].[Na+].[Na+]	{1: 1, 2: 12, 33: 2, 12: 1, 14: 2, 22: 1, 24: 2}
Did not match all atoms present	68630-95-5	CCCCCCCC1N(C=CN1CCO)CCC(=O)[O-].[Na+]	{1: 1, 2: 10, 33: 2, 12: 1, 14: 2, 20: 1, 24: 1}
Did not match all atoms present	68631-02-7	C1=CC(=CC(=C1)Cl)C(C2=CC(=CC=C2)Cl)(C(Cl)(Cl)Cl)Cl	{17: 6, 4: 2, 14: 8}
Did not match all atoms present	68631-04-9	CC1=CC(=CC(=C1C)S(=O)(=O)Cl)[N+](=O)[O-]	{1: 2, 38: 1, 29: 2, 14: 2, 17: 1}
Did not match all atoms present	68631-07-2	CCOC1=CC=C(C=C1)N(C)N=CC2=[N+](C3=CC=CC=C3C2(C)C)C.COS(=O)(=O)[O-]	{1: 6, 2: 1, 34: 1, 6: 1, 33: 2, 13: 1, 14: 8, 15: 1, 22: 2, 29: 3}
Did not match all atoms present	68631-09-4	CC1=C(C=CC(=C1)N2N=C3C=CC4=C(C3=N2)C=CC(=C4)S(=O)(=O)[O-])N=NC5=CC(=C(C=C5)/C=C/C6=C(C=C(C=C6)N7N=C8C=C(C9=C(C8=N7)C=C(C=C9)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 4, 6: 2, 33: 2, 14: 18, 29: 15}
Did not match all atoms present	68631-10-7	C1=CC(=CC(=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=CC(=C6)NC(=O)C(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 16, 15: 4, 24: 4, 25: 2, 29: 6, 31: 5}
Did not match all atoms present	68631-11-8	CC1=CC(=C(C=C1Cl)N/N=C/2\C(=CC=C3C2=CC(=CC3=O)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 6, 15: 5, 17: 1, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	68631-12-9	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=C(C=C3N)N=NC4=C(C=C5C=C(/C(=N/NC6=CC=C(C7=CC=CC=C76)S(=O)(=O)[O-])/C(=O)C5=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])N)C)N/N=C\8/C=CC(=O)C(=C8)C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 6, 14: 20, 15: 4, 24: 1, 25: 2, 29: 9, 30: 2, 31: 2}
Did not match all atoms present	68631-13-0	C1NC(=S)N(CN1CCO)CO	{32: 1, 33: 2, 2: 3, 11: 2, 15: 1, 20: 2}
Did not match all atoms present	68631-14-1	CN(C)C1=CC=C(C=C1)CC2=C(C=C(C=C2)N(C)C)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 1, 29: 3, 14: 7, 33: 2}
Did not match all atoms present	68641-49-6	C1COC(=O)N1P(=O)(N2CCOC2=O)Cl	{17: 1, 11: 4, 28: 2, 29: 1, 33: 2}
Did not match all atoms present	68647-19-8	CC(C)CCCCCOP(=O)([O-])[O-].[K+].[K+]	{1: 2, 2: 5, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	68647-24-5	CCCCCCCCCCCCCOP(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 2: 12, 29: 3, 22: 1}
Did not match all atoms present	68647-25-6	CCCCOCCOCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 7, 29: 3, 22: 3}
Did not match all atoms present	68647-44-9	CC1([C@H](N2[C@@H](S1(=O)=O)CC2=O)C(=O)O)C	{1: 2, 33: 1, 11: 1, 12: 2, 13: 1, 25: 1, 27: 1, 29: 2}
Did not match all atoms present	68647-45-0	CCCCCCCCCCCCCC1=[N+](CCN1CCO)CC(=O)[O-].[OH-].[Na+]	{1: 1, 2: 15, 33: 2, 11: 2, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	68647-46-1	CCCCCCCCC1=[N+](CCN1CCO)CC(=O)[O-].[OH-].[Na+]	{1: 1, 2: 10, 33: 2, 11: 2, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	68647-47-2	[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[Co+3]	{29: 8}
Did not match all atoms present	68648-81-7	CC(C)N.C1=CC=C(C=C1)S(=O)(=O)O	{1: 2, 3: 1, 14: 5, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	68648-96-4	C1=CC=C(C=C1)S(=O)(=O)O.C(CO)N(CCO)CCO	{33: 1, 2: 6, 20: 4, 29: 2, 14: 5}
Did not match all atoms present	68649-25-2	C=O.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)O.C1=CC(=CC=C1O)S(=O)(=O)C2=CC=C(C=C2)O	{29: 4, 20: 1, 5: 1, 14: 15, 21: 2}
Did not match all atoms present	6865-35-6	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Ba+2]	{24: 2, 1: 2, 2: 32}
Did not match all atoms present	6867-30-7	[Li+].C#[C-].C(CN)N	{9: 1, 2: 2, 30: 2}
Did not match all atoms present	68683-20-5	CC(C)C1=CCC(=CC1)CCOC=O	{1: 2, 2: 2, 3: 1, 11: 2, 14: 2, 15: 2, 26: 1}
Did not match all atoms present	68683-30-7	CC(C1=CC=CC=C1)OC(=O)C(C(=O)C)Cl	{1: 2, 3: 2, 14: 5, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	68683-32-9	C1=C(C=C(C(=C1[N+](=O)[O-])NNC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 6, 14: 4, 31: 2}
Did not match all atoms present	68683-34-1	CC1=C(NC(=C1CCC(=O)NCCS(=O)(=O)[O-])CC2=C(C(=C(N2)/C=C/3\C(=C(C(=O)N3)C)C=C)C)CCC(=O)NCCS(=O)(=O)[O-])/C=C\4/C(=C(C(=O)N4)C=C)C.[Na+].[Na+]	{32: 4, 1: 4, 2: 9, 5: 2, 6: 4, 15: 6, 24: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	68683-36-3	CC(C(CO)C[O-])O.[Na+]	{1: 1, 2: 2, 3: 2, 20: 2, 29: 1}
Did not match all atoms present	68683-43-2	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)[O-])Cl.[Na+]	{17: 1, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	68683-46-5	CCC(COC(=O)NC1=CC(=C(C=C1)C)NC(=O)OCC=C)(OCC=C)OCC=C	{1: 2, 2: 5, 4: 1, 5: 3, 6: 3, 14: 3, 22: 2, 28: 2, 31: 2}
Did not match all atoms present	68688-84-6	C[C@]1(C=CC2=C3[C@]1(CCC3=C4C=CC5=CC=CC=C5C4=C2)O)O	{1: 1, 11: 2, 20: 2, 13: 2, 14: 9}
Did not match all atoms present	68688-86-8	CC1=C2CCC3=C2C(=CC4=C3C=CC5=C4[C@@H]([C@H](C=C5)O)O)C=C1	{1: 1, 11: 2, 12: 2, 14: 7, 20: 2}
Did not match all atoms present	68690-89-1	CC(C1=CC=CC=C1)N(C)N=O	{1: 2, 34: 1, 3: 1, 33: 1, 14: 5, 29: 1}
Did not match all atoms present	68694-11-1	CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2	{1: 1, 2: 3, 35: 1, 4: 1, 33: 1, 7: 1, 34: 1, 14: 6, 16: 3, 17: 1, 22: 1}
Did not match all atoms present	68698-60-2	CCCCCCC(C)(C)C(=O)[O-].CCCCCCC(C)(C)C(=O)[O-].[Ba+2]	{24: 2, 1: 6, 2: 10, 4: 2}
Did not match all atoms present	68698-64-6	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)[O-].[K+]	{24: 1, 1: 6, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	68698-78-2	C(CCCCS(=O)(=O)O)CCC/C=C\CCCCCCCC(=O)O.C(CO)N(CCO)CCO	{33: 1, 2: 21, 6: 2, 20: 4, 27: 1, 29: 2}
Did not match all atoms present	68698-86-2	C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].[Al+3].[Al+3]	{38: 6, 29: 9, 14: 12}
Did not match all atoms present	687-78-5	C#C[As](C#C)C#C	{9: 3, 10: 3}
Did not match all atoms present	687-80-9	C#CP(C#C)C#C	{9: 3, 10: 3}
Did not match all atoms present	68703-71-9	CCN(CC)C1=C(C=CC(=C1)NC(=O)C)OCCOC	{1: 4, 2: 4, 33: 1, 14: 3, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	68703-72-0	CCC(=O)NC1=CC(=C(C=C1)OCCOC)N(CC)CC	{1: 4, 2: 5, 33: 1, 14: 3, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	68703-73-1	CCC(=O)NC1=CC(=C(C=C1)OCCOC)NCC	{1: 3, 2: 4, 14: 3, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	68703-78-6	CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=CC=C4Cl)OC)OC	{1: 4, 34: 4, 3: 2, 14: 14, 17: 2, 22: 2, 24: 4, 31: 2}
Did not match all atoms present	68704-50-7	C1=CC(=C(C=C1Cl)Cl)OCC(=O)OCC2=C(C(=C(C(=C2F)F)F)F)F	{2: 2, 14: 3, 16: 5, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	6871-44-9	C/C=C\1/C[N+]2(CCC34C2(C(CC1C3(CO)C(=O)OC)O)NC5=CC=CC=C45)C	{32: 1, 1: 3, 2: 1, 6: 1, 11: 4, 12: 2, 13: 3, 14: 4, 15: 1, 20: 2, 28: 1}
Did not match all atoms present	68715-88-8	C1=CC(=C(C=C1[N+](=O)[O-])N)NC(CO)CO	{2: 2, 3: 1, 38: 1, 14: 3, 20: 2, 30: 1, 31: 1}
Did not match all atoms present	68715-89-9	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC(CO)(CO)CO	{2: 3, 4: 1, 38: 2, 14: 3, 20: 3, 31: 1}
Did not match all atoms present	68715-90-2	CCC(C)OP(=S)(OCC)S	{1: 3, 2: 2, 3: 1, 22: 2, 39: 1}
Did not match all atoms present	68715-91-3	CCCCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)NC2=CC=C(C=C2)OC(=O)OCC)[N+](=O)[O-]	{1: 2, 2: 17, 38: 1, 14: 7, 24: 1, 31: 2}
Did not match all atoms present	68716-15-4	COC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)CC3=C(C=C(C(=C3)C(=O)C4=CC=CC=C4)O)OC	{1: 2, 2: 1, 14: 14, 21: 2, 22: 2, 24: 2}
Did not match all atoms present	6872-06-6	CC1CC2=CC=CC=C2N1	{32: 1, 1: 1, 11: 1, 12: 1, 14: 4}
Did not match all atoms present	68725-14-4	CCCC[Sn+](CCCC)CCCC.C(F)(F)(F)S(=O)(=O)[O-]	{16: 3, 1: 3, 2: 9, 4: 1, 29: 3}
Did not match all atoms present	68729-18-0	C1CC2=C3C(=CC=C2)SC(=O)N3C1	{25: 1, 11: 3, 41: 1, 14: 3, 33: 1}
Did not match all atoms present	6873-15-0	CN1C2=CC=CC=C2C(=O)N=C1CC3=CC=CC=C3	{1: 1, 2: 1, 35: 1, 33: 1, 14: 9, 25: 1}
Did not match all atoms present	68735-92-2	CCCCC(CC)COC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O	{1: 2, 2: 5, 3: 1, 14: 3, 27: 2, 28: 1}
Did not match all atoms present	68739-04-8	CC/C=C/CC1C(O1)C/C=C/CCCCCCCC(=O)O.CC(C)CCCCCCCCCCCCCCC(=O)O.C(C(=O)O)O.[Ti]	{1: 3, 2: 25, 3: 1, 6: 4, 12: 2, 20: 1, 23: 1, 27: 3}
Did not match all atoms present	68739-06-0	CC1=C(C(=CC=C1)C)N/N=C\2/C(=O)C=CC3=CC=CC=C32	{1: 2, 34: 1, 14: 9, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	6874-60-8	CCCCCCCCCCP(=O)(O)O	{1: 1, 2: 9, 20: 2, 29: 1}
Did not match all atoms present	6875-10-1	CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC=O)O)C)C)O)OC)O	{1: 4, 11: 9, 12: 11, 13: 3, 14: 1, 15: 1, 20: 3, 22: 2, 23: 1, 26: 1, 28: 1}
Did not match all atoms present	68751-90-6	CC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)Cl	{24: 1, 1: 1, 21: 1, 14: 7, 17: 1}
Did not match all atoms present	68757-56-2	CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[Zr+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	68757-57-3	CC[N+](CC)(CCOCCC#N)CC1=CC=CC=C1.[Cl-]	{1: 2, 2: 7, 37: 1, 14: 5, 17: 1, 22: 1}
Did not match all atoms present	68758-55-4	CN(CCOC(=O)C=C)S(=O)(=O)CC(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 14, 5: 1, 6: 1, 33: 1, 16: 29, 28: 1, 29: 2}
Did not match all atoms present	68758-56-5	CN(CCOC(=O)C=C)S(=O)(=O)CC(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 3, 4: 16, 5: 1, 6: 1, 33: 1, 16: 33, 28: 1, 29: 2}
Did not match all atoms present	68758-57-6	C(CS(=O)(=O)Cl)C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 25, 17: 1, 2: 2, 4: 12, 29: 2}
Did not match all atoms present	68758-60-1	C(=O)[O-].C(=O)[O-].N.N.N.N.N.N.[Ni+2]	{26: 2}
Did not match all atoms present	68758-65-6	CCN1C(=CC=CC2=CC=[N+](C3=CC=CC=C23)CC)SC4=C1C5=CC=CC=C5C=C4.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 2, 6: 3, 33: 2, 41: 1, 14: 16, 15: 1, 29: 3}
Did not match all atoms present	68758-67-8	CCOC1=C(C=C(C=C1)C)Cl	{1: 2, 2: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	68758-68-9	CCOC(=O)C(C1=CC=C(C=C1)O)O	{1: 1, 2: 1, 3: 1, 14: 4, 20: 1, 21: 1, 28: 1}
Did not match all atoms present	68758-69-0	COC(=O)C(C1=CC=C(C=C1)O)O	{1: 1, 3: 1, 14: 4, 20: 1, 21: 1, 28: 1}
Did not match all atoms present	68758-71-4	C1=C(C(=CC(=C1Cl)O)O)C(=O)NCCO	{2: 2, 14: 2, 17: 1, 20: 1, 21: 2, 24: 1, 31: 1}
Did not match all atoms present	68758-72-5	C1=CC=C(C(=C1)N)SCSC2=CC=CC=C2NCNC3=CC=CC=C3SCSC4=CC=CC=C4N	{40: 4, 2: 3, 30: 2, 14: 16, 31: 2}
Did not match all atoms present	68758-80-5	C1=CC2C(C(C1O2)C(=O)[O-])C(=O)[O-].[K+].[K+]	{24: 2, 12: 4, 14: 2, 23: 1}
Did not match all atoms present	68758-82-7	CCN1/C(=C\C=C/2\C(=O)[N+](=C(S2)/C=C/3\C=C(N4C5=CC=CC=C5N=C4N3CCCCS(=O)(=O)[O-])C)CC)/SC(=C1C6=CC=CC=C6)C7=CC=CC=C7	{1: 3, 2: 6, 35: 1, 6: 3, 33: 4, 41: 2, 14: 15, 15: 7, 25: 1, 29: 3}
Did not match all atoms present	68758-84-9	CCN\1C2=CC=CC=C2S/C1=C/3\CN(C(=S)S3)CC(=O)O.CCN(CC)CC	{1: 4, 2: 5, 33: 3, 41: 2, 11: 1, 14: 4, 15: 3, 27: 1}
Did not match all atoms present	68758-85-0	CC(C)(C)C1=CC=C(C=C1)C(=O)NN/C=C/2\C(=O)C=CC3=CC=CC=C32	{1: 3, 4: 1, 6: 1, 14: 10, 15: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	68758-87-2	CCN1/C(=C/C=C\2/C(=O)N(/C(=C/3\C(=O)N(C(=S)N3CC(=O)O)C4=CC=CC=C4)/S2)CC)/C=CC5=C1C=CC(=C5)OCC	{1: 3, 2: 4, 6: 2, 33: 4, 41: 1, 14: 10, 15: 3, 22: 1, 25: 2, 27: 1}
Did not match all atoms present	68758-88-3	C(CNC(=S)[S-])NCCNC(=S)[S-].[Ca+2]	{2: 4, 31: 3, 7: 2}
Did not match all atoms present	6876-49-9	CC1=CC=C(C=C1)NC(=O)C(C)C	{24: 1, 1: 3, 3: 1, 14: 4, 31: 1}
Did not match all atoms present	6876-66-0	CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C	{24: 1, 1: 2, 14: 8, 31: 1}
Did not match all atoms present	687620-85-5	[In+3].[OH-].[OH-].[OH-].[OH-]	{}
Did not match all atoms present	68767-14-6	CC(C1=CC=C(C=C1)CC2CCCC2=O)C(=O)O	{1: 1, 2: 1, 3: 1, 11: 3, 12: 1, 14: 4, 25: 1, 27: 1}
Did not match all atoms present	68771-70-0	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C4=CC=CC=C43)C(=O)NC5=CC=C(C=C5)C(=O)NC6=C[N+](=CC=C6)C	{1: 4, 33: 2, 14: 30, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	68771-76-6	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C5=CC=CC=C54)C(=O)NC6=C[N+](=CC=C6)C	{1: 4, 33: 2, 14: 30, 24: 4, 29: 6, 31: 4}
Did not match all atoms present	68772-09-8	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)C.[Br-].[Br-]	{1: 2, 33: 2, 14: 18, 18: 2, 24: 1, 31: 3}
Did not match all atoms present	68772-10-1	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)CC.[Br-].[Br-]	{1: 2, 2: 2, 33: 2, 14: 18, 18: 2, 24: 1, 31: 3}
Did not match all atoms present	68772-13-4	CCC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=[N+](C=C4)CCC)N.[Br-].[Br-]	{1: 2, 2: 4, 33: 2, 14: 17, 18: 2, 24: 1, 30: 1, 31: 3}
Did not match all atoms present	68772-18-9	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)/C=C/C3=CC=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)C.[Br-].[Br-]	{1: 2, 6: 2, 33: 2, 14: 18, 18: 2, 31: 2}
Did not match all atoms present	68772-19-0	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)C.[Br-].[Br-]	{1: 2, 6: 2, 33: 2, 14: 18, 18: 2, 24: 1, 31: 3}
Did not match all atoms present	68772-21-4	CC[N+]1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 14: 26, 24: 1, 29: 6, 31: 2}
Did not match all atoms present	68772-29-2	CC[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC4=CC=[N+](C5=CC=CC=C45)CC.[Br-].[Br-]	{1: 2, 2: 2, 33: 2, 14: 18, 18: 2, 24: 1, 31: 3}
Did not match all atoms present	68772-43-0	C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)NC4=C5C=CC(=CC5=[N+](C=C4)C)N)OC.[Br-].[Br-]	{1: 3, 33: 2, 14: 16, 18: 2, 22: 1, 24: 1, 30: 1, 31: 3}
Did not match all atoms present	68778-98-3	CCCCCCCC/C=C\CCCCCCCC(=O)NC(CCO)COC(=O)/C=C\C(=O)[O-].[Na+]	{1: 1, 2: 17, 3: 1, 6: 4, 20: 1, 24: 2, 28: 1, 31: 1}
Did not match all atoms present	68780-28-9	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])CC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])CC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-].C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])CC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-].[Al+3].[Al+3]	{2: 3, 29: 18, 14: 36}
Did not match all atoms present	68782-95-6	CC(C)C1=CC=CC=C1OP(=O)(O)OC2=CC=CC=C2	{1: 2, 3: 1, 14: 9, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	68784-06-5	CCCCC=O.C1=CC=C(C=C1)CC=O	{1: 1, 2: 4, 26: 2, 14: 5}
Did not match all atoms present	68784-07-6	CCN(CC)C1=NC(=NC(=N1)SN)SN	{1: 2, 2: 2, 35: 3, 33: 1, 40: 2, 30: 2}
Did not match all atoms present	68784-15-6	C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O.N	{2: 1, 3: 4, 20: 5, 26: 1}
Did not match all atoms present	68784-33-8	CCCCCCOP(=S)(OCC(C)C)S	{1: 3, 2: 6, 3: 1, 22: 2, 39: 1}
Did not match all atoms present	68784-34-9	CCCCCCOP(=S)(OCC(C)C)[S-].CCCCCCOP(=S)(OCC(C)C)[S-].[Zn+2]	{1: 6, 2: 12, 3: 2, 22: 4}
Did not match all atoms present	68784-67-8	[H+].[H+].CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)OC)C.[Cl-].[Cl-].[Cl-].[Cl-].[Pd+2]	{1: 5, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 17: 4, 28: 1}
Did not match all atoms present	68784-86-1	CC/C=C/C/C=C/CC1OC1CCCCCCCC(=O)O.CC/C=C/C/C=C/CC1OC1CCCCCCCC(=O)O.CC/C=C/C/C=C/CC1OC1CCCCCCCC(=O)O.CC(O)C.[Ti]	{1: 5, 2: 30, 3: 1, 6: 12, 12: 6, 20: 1, 23: 3, 27: 3}
Did not match all atoms present	68784-88-3	CCN(CCNC(=O)CCCCCCCCCCCCCCCC=C)CCO.CCOS(=O)(=O)O	{1: 2, 2: 21, 5: 1, 6: 1, 33: 1, 20: 2, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68784-92-9	C1C2=C(CC3=CC=CC=C31)C=C(C=C2)CC4=CC=C(C=C4)CC5=CC=CC=C5	{2: 2, 11: 2, 14: 16}
Did not match all atoms present	68785-01-3	C(CN(CCN(CP(=O)(O)O)CP(=O)(O)O)CP(=O)(O)O)NCP(=O)(O)O	{33: 2, 2: 8, 20: 8, 29: 4, 31: 1}
Did not match all atoms present	68785-06-8	CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCCC2.CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCCC2.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 4, 33: 2, 11: 8, 34: 2, 14: 4, 17: 4, 22: 4}
Did not match all atoms present	68786-66-3	CSC1=NC2=CC(=C(C=C2N1)Cl)OC3=C(C(=CC=C3)Cl)Cl	{32: 1, 1: 1, 35: 1, 40: 1, 14: 5, 17: 3, 22: 1}
Did not match all atoms present	68797-35-3	C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)[O-])O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)[O-])O)O)O)C)(C)C(=O)O.[K+].[K+]	{1: 7, 11: 9, 12: 14, 13: 6, 14: 1, 15: 1, 20: 5, 22: 2, 23: 2, 24: 2, 25: 1, 27: 1}
Did not match all atoms present	68797-42-2	C1=CC=C(C=C1)CCCCCCCCCCCCCCCCCC(=O)O.C(CO)N(CCO)CCO	{33: 1, 2: 23, 27: 1, 20: 3, 14: 5}
Did not match all atoms present	68797-43-3	C1=CC=C(C=C1)C(=O)OCCNCCO	{28: 1, 2: 4, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	68797-47-7	CC(=C)C(=O)OCC[NH3+].OS(=O)(=O)[O-]	{1: 1, 2: 2, 5: 1, 7: 1, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	68797-49-9	CC(C)CC(C)OC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 3, 2: 2, 3: 3, 24: 1, 28: 1, 29: 3}
Did not match all atoms present	68797-51-3	CCN(CC)C(=S)SCC(=O)[O-].[Na+]	{1: 2, 2: 3, 33: 1, 40: 1, 7: 1, 24: 1}
Did not match all atoms present	68797-52-4	COC1=C(C=C(C=C1)C(O)S(=O)(=O)O)OC.N	{1: 2, 3: 1, 14: 3, 20: 2, 22: 2, 29: 2}
Did not match all atoms present	68797-61-5	C1=NC(=C(C(=N1)Cl)Br)Cl	{17: 2, 18: 1, 35: 2, 14: 1}
Did not match all atoms present	68797-65-9	CCCCCCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]	{1: 5, 2: 25, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	68797-71-7	CC(C)(C)C1=CC2=C(CC(CC2)O)C=C1	{1: 3, 4: 1, 11: 3, 12: 1, 14: 3, 20: 1}
Did not match all atoms present	68797-73-9	CC1=CC(=C(C(=C1)C(C)(C)C)OCC=O)C(C)(C)C	{1: 7, 2: 1, 4: 2, 14: 2, 22: 1, 26: 1}
Did not match all atoms present	68797-79-5	CC/C=C/CC1OC1C/C=C/CCCCCCCC(=O)O.CC/C=C/CC1OC1C/C=C/CCCCCCCC(=O)O.CC/C=C/CC1OC1C/C=C/CCCCCCCC(=O)O.CC(O)C.[Ti]	{1: 5, 2: 30, 3: 1, 6: 12, 12: 6, 20: 1, 23: 3, 27: 3}
Did not match all atoms present	68797-91-1	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C	{1: 4, 33: 2, 14: 28, 24: 3, 29: 6, 31: 4}
Did not match all atoms present	688-37-9	CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Al+3]	{24: 3, 1: 3, 2: 42, 6: 6}
Did not match all atoms present	688-62-0	CCSP(SCC)SCC	{40: 3, 1: 3, 2: 3}
Did not match all atoms present	688-71-1	B(OCCC)(OCCC)OCCC	{1: 3, 2: 6, 22: 3}
Did not match all atoms present	688-73-3	CCCC[Sn](CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	688-74-4	B(OCCCC)(OCCCC)OCCCC	{1: 3, 2: 9, 22: 3}
Did not match all atoms present	68808-54-8	CC1=C(N=C(C2=C1NC3=CC=CC=C32)C)N.CC(=O)O	{32: 1, 1: 3, 35: 1, 14: 4, 27: 1, 30: 1}
Did not match all atoms present	68808-69-5	C1=CC=C2C(=C1)C(=C(C#N)C(=O)NC3=CC=C(C=C3)Cl)NC2=C(C#N)C(=O)NC4=CC(=C(C=C4)Cl)Cl	{32: 1, 37: 2, 7: 2, 14: 11, 17: 3, 24: 2, 31: 2}
Did not match all atoms present	68808-70-8	C1=CC=C2C(=C1)C(=C(C#N)C(=O)NC3=CC=C(C=C3)Cl)NC2=C(C#N)C(=O)NC4=CC=C(C=C4)Cl	{32: 1, 37: 2, 7: 2, 14: 12, 17: 2, 24: 2, 31: 2}
Did not match all atoms present	6881-57-8	C1=CC=C(C=C1)CP(=O)(O)O	{2: 1, 20: 2, 29: 1, 14: 5}
Did not match all atoms present	68814-11-9	CCCCOCCOCCOP(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 2: 7, 29: 3, 22: 3}
Did not match all atoms present	68814-13-1	CCCCCCCCCCCCCCCCO.OP(=O)(O)O	{1: 1, 2: 15, 20: 4, 29: 1}
Did not match all atoms present	68815-56-5	CCCCCCCCCCCCOCCOCC(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 15, 3: 1, 22: 2, 24: 1, 29: 3}
Did not match all atoms present	68815-68-9	CC(C)CCCCCO.C(CO)NCCO.OP(=O)(O)O	{1: 2, 2: 9, 3: 1, 20: 6, 29: 1, 31: 1}
Did not match all atoms present	68817-65-2	CC(=O)C1=CC2=C(C=C1)OCCOCCOC3=C(C=CC(=C3)C(=O)C)OCCOCCO2	{24: 2, 1: 2, 11: 8, 14: 6, 23: 6}
Did not match all atoms present	68817-71-0	C1=CC=C(C(=C1)N)NC2=CC=C(C=C2)Cl	{17: 1, 30: 1, 14: 8, 31: 1}
Did not match all atoms present	68818-86-0	CCOC1=C2C=CC=CC2=C(C3=CC=CC=C31)OCC	{1: 2, 2: 2, 22: 2, 14: 8}
Did not match all atoms present	68832-80-4	CCCCCCCCCCCCC1=C(C(=CC=C1)SC2=CC=CC(=C2[O-])CCCCCCCCCCCC)[O-].[Ba+2]	{40: 1, 1: 2, 2: 22, 14: 6}
Did not match all atoms present	68833-59-0	CCCCCCCCCCCCC1=CC(=C(C(=C1)CCl)C)CCl	{1: 2, 2: 13, 14: 2, 17: 2}
Did not match all atoms present	68833-60-3	CCCCCCCCCCCCC1=CC(=C(C=C1)C)CCl	{1: 2, 2: 12, 14: 3, 17: 1}
Did not match all atoms present	68833-63-6	CCCCCCCCCCCCCCCCCCOCN(COC)C1=NC(=NC(=N1)N(COCCCCCCCCCCCCCCCCCC)COC(=O)C)N(COC)COCC[N+](C)(CCO)CCO.COS(=O)(=O)[O-]	{1: 7, 2: 46, 35: 3, 33: 3, 20: 2, 22: 6, 28: 1, 29: 3}
Did not match all atoms present	68833-67-0	CCCCCCCCCC1=CC2=CC(=CC(=C2C=C1)S(=O)(=O)[O-])CCCCCCCCC.CC(C)(CO)[NH3+]	{1: 4, 2: 17, 4: 1, 14: 5, 20: 1, 29: 3}
Did not match all atoms present	68833-68-1	CCCCCCCCCC1=CC2=CC(=CC(=C2C=C1)S(=O)(=O)[O-])CCCCCCCCC.CC(C)(CO)[NH+](C)C	{1: 6, 2: 17, 4: 1, 14: 5, 20: 1, 29: 3}
Did not match all atoms present	68833-87-4	C1=CC(=C(C=C1S(=O)(=O)[O-])CN(CC2=C(C=CC(=C2)S(=O)(=O)[O-])O)CC(=O)[O-])O.[Fe+3]	{33: 1, 2: 3, 14: 6, 21: 2, 24: 1, 29: 6}
Did not match all atoms present	68833-88-5	C(=O)([O-])[O-].N.N.N.N.N.N.N.N.[OH-].[OH-].[Cu+2].[Cu+2]	{24: 1}
Did not match all atoms present	68833-89-6	[H+].[H+].[H+].CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])S(=O)(=O)[O-])Cl)[O-])C3=CC=CC=C3Cl.CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])S(=O)(=O)[O-])Cl)[O-])C3=CC=CC=C3Cl.[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 12, 17: 4, 29: 6}
Did not match all atoms present	68833-90-9	[H+].[H+].[H+].CC1=NN(C(=C1N=NC2=C(C(=CC3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=C(C=CC(=C4)Cl)Cl.CC1=NN(C(=C1N=NC2=C(C(=CC3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=C(C=CC(=C4)Cl)Cl.[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 16, 17: 4, 29: 6}
Did not match all atoms present	68833-91-0	C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(CO)N(CCOP(=O)(O)O)CCOP(=O)(O)O	{33: 4, 2: 24, 20: 14, 29: 2, 22: 2}
Did not match all atoms present	68833-93-2	C1=CC2=C(C(=C1)N)NC=C2.Cl	{32: 1, 17: 1, 30: 1, 14: 5}
Did not match all atoms present	68833-96-5	C1=CC2=C(C(=C1)C(=O)O)NC(=C2)C(=O)O	{32: 1, 27: 2, 14: 4}
Did not match all atoms present	68833-97-6	CCOC1=C(C(=CC(=C1)[N+](=O)[O-])CN(C)C)O	{1: 3, 2: 2, 38: 1, 33: 1, 14: 2, 21: 1, 22: 1}
Did not match all atoms present	68833-98-7	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N/NC3=CC4=C(C=CC=C4S(=O)(=O)CCOS(=O)(=O)O)C=C3)/C2=O)S(=O)(=O)O	{1: 1, 2: 2, 34: 1, 14: 9, 15: 2, 20: 3, 22: 1, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	68833-99-8	CC(=O)NC1=CC2=C(C=C1)C(=O)/C(=N\NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O)/C(=C2)S(=O)(=O)O	{1: 1, 2: 2, 34: 1, 14: 9, 15: 2, 20: 3, 22: 1, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	68834-00-4	C1=CC(=C(C=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl)NCCC#N	{2: 2, 37: 1, 38: 1, 34: 2, 14: 6, 17: 2, 31: 1}
Did not match all atoms present	68834-01-5	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=C(C=C5)C6=CC=C(C=C6)N=NC7=CC=C(C=C7)C8=CC=C(C=C8)C(=O)NC9=CC=CC1=C9C(=O)C2=CC=CC=C2C1=O	{24: 3, 25: 4, 34: 2, 14: 34, 31: 3}
Did not match all atoms present	68834-03-7	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC4=CC5=C(C=C4)C6=C7C(=CC=C8C7=C(C=C6)C(=O)C9=C8C=CC(=C9)NC1=C2C(=C(C=C1)NC(=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1C2=O)C5=O)C(=O)C1=CC=CC=C1C3=O	{24: 2, 25: 6, 14: 32, 31: 4}
Did not match all atoms present	68834-04-8	CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]	{1: 1, 34: 2, 3: 1, 38: 1, 14: 8, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	68834-05-9	C1=CC(=CC=C1OC(C(F)F)(F)F)Br	{3: 1, 4: 1, 14: 4, 16: 4, 18: 1, 22: 1}
Did not match all atoms present	68834-08-2	COC1=C(C=CC(=C1)N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O)NS(=O)(=O)C	{1: 2, 34: 2, 14: 8, 20: 2, 22: 1, 29: 6, 31: 1}
Did not match all atoms present	68835-89-2	CCC(C)(C)OC(=O)OC(=O)OC(C)(C)CC	{1: 6, 2: 2, 4: 2}
Did not match all atoms present	68836-13-5	C1=NC2=CC(=C(C=C2N=C1)[N+](=O)[O-])[N+](=O)[O-]	{35: 2, 38: 2, 14: 4}
Did not match all atoms present	6884-59-9	CNC(=O)OC1=CC=CC=C1C(OC)OC	{1: 3, 3: 1, 14: 4, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	68844-77-9	COC1=CC=C(C=C1)CCN2CCC(CC2)NC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F	{1: 1, 2: 3, 35: 1, 33: 2, 11: 4, 12: 1, 14: 12, 16: 1, 22: 1, 31: 1}
Did not match all atoms present	68845-12-5	CCO[Si](CCCNC(=O)NC1=CC=CC(=C1NC(=O)NCCC[Si](OCC)(OCC)OCC)C)(OCC)OCC	{1: 7, 2: 12, 14: 3, 22: 6, 24: 2, 31: 4}
Did not match all atoms present	68845-15-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)NC4=CC=CC5=C4C(=O)C6=C(C5=O)C(=CC=C6)NC(=O)C7=C(C8=C(C=C7)C(=O)C9=CC=CC=C9C8=O)N)N	{24: 2, 25: 6, 30: 2, 14: 18, 31: 2}
Did not match all atoms present	68845-16-9	CO[Si](CCCNCCNCCC[Si](OC)(OC)OC)(OC)OC	{1: 6, 2: 8, 22: 6, 31: 2}
Did not match all atoms present	68845-21-6	CC(=C)C(=O)OCCC1=NC(=NC(=N1)CCOC(=O)C(=C)C)CCOC(=O)C(=C)C	{1: 3, 2: 6, 35: 3, 5: 3, 7: 3, 28: 3}
Did not match all atoms present	68845-22-7	CC(C)CCCC(C)CC(O)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 4, 3: 3, 20: 1, 29: 3}
Did not match all atoms present	68845-34-1	CC(CC(C)(C)C)CN(C1=CC=CC=C1)C2=CC3=CC=CC=C3C=C2	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 12}
Did not match all atoms present	68845-38-5	CC1=CC(=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N)C=CC1=N.[O-]P=O.[Mo]	{1: 1, 36: 1, 7: 1, 14: 11, 15: 3, 29: 2, 30: 2}
Did not match all atoms present	68845-40-9	CCCCCCCCCCCCCO.CCCCCCCC/C=C\CCCCCCCC(=O)N(CCN)CCO.OP(=O)(O)O	{1: 2, 2: 30, 6: 2, 33: 1, 20: 5, 24: 1, 29: 1, 30: 1}
Did not match all atoms present	68846-65-1	C=C1CC2=CC=CC=C2C1	{11: 2, 5: 1, 14: 4, 15: 1}
Did not match all atoms present	6885-40-1	CC1=CC=C(C=C1)S(=O)(=O)OC2CCC3(C4CCC5(C(C4CC=C3C2)CCC5C(=O)C)C)C	{1: 4, 11: 8, 12: 5, 13: 2, 14: 5, 15: 1, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	6885-70-7	CCCC(C)(C)C1=CC=C(C=C1)O	{1: 3, 2: 2, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	68855-22-1	CCCCOCC1CO1.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N	{1: 1, 2: 5, 11: 1, 12: 1, 14: 8, 22: 1, 23: 1, 30: 2}
Did not match all atoms present	68855-23-2	CC1=C(C=CC=C1N=C=O)N=C=O.C1=CC=C(C(=C1)CC2=CC=CC=C2N)N.C1=CC(=C(C(=C1)N)Cl)CC2=C(C(=CC=C2)Cl)N	{1: 1, 2: 2, 8: 2, 34: 2, 14: 17, 17: 2, 29: 2, 30: 4}
Did not match all atoms present	68855-24-3	CCCCCCCCCCCCCCCCCCCCCCC1=CC=CC=C1	{1: 1, 2: 21, 14: 5}
Did not match all atoms present	68855-28-7	C(CSC(=N)[S-])SC(=N)[S-].[NH4+].[NH4+].[NH4+].[OH-].[O-]S(=O)(=O)[O-].[Zn+2]	{40: 2, 2: 2, 36: 2, 29: 4, 7: 2}
Did not match all atoms present	68855-29-8	C(CSC(=S)N)SC(=S)N.[NH4+].[NH4+].OO.[O-]S(=O)(=O)[O-]	{2: 2, 7: 2, 40: 2, 20: 2, 29: 4, 30: 2}
Did not match all atoms present	68855-33-4	C(CO)NCCO.S	{2: 4, 20: 2, 31: 1}
Did not match all atoms present	68855-35-6	CCCCCCCCCCCCC1=CC=CC=C1O.CN.C=O	{1: 2, 2: 11, 5: 1, 14: 4, 21: 1, 30: 1}
Did not match all atoms present	68855-37-8	CC1=CCC(CC1)C(=C)C.C=O	{1: 2, 5: 2, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1}
Did not match all atoms present	68856-26-8	CC1=CC(=CC(=C1)OC(C)(C)C)C	{1: 5, 4: 1, 22: 1, 14: 3}
Did not match all atoms present	68856-36-0	CCCCC(CC)C(=O)[O-].C[N+](C)(C)CCO	{24: 1, 1: 5, 2: 6, 3: 1, 20: 1}
Did not match all atoms present	68856-42-8	CC1=C(C(CCC1)(C)C)C[O-].[Na+]	{1: 3, 2: 1, 11: 3, 13: 1, 15: 2, 29: 1}
Did not match all atoms present	68858-20-8	CC(C)[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 2, 2: 1, 3: 2, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	6886-64-2	C1=CC=C2C(=C1)C3=C4C2=CC=CC4=C(C=C3)CCCC(=O)O	{2: 3, 27: 1, 14: 9}
Did not match all atoms present	68862-34-0	CC(C)CCCCCCCCCCO.CC(C)CCCCCCCCCCO.CC(C)CCCCCCCCCCO.CC(C)CCCCCCCCCCO.[Zr]	{1: 8, 2: 40, 3: 4, 20: 4}
Did not match all atoms present	68865-30-5	C=CC(=O)NC1=CC2=C(C=C1)OCCOCCOCCOCCO2	{5: 1, 6: 1, 11: 8, 14: 3, 23: 5, 24: 1, 31: 1}
Did not match all atoms present	68865-32-7	C=CC(=O)NC1=CC2=C(C=C1)OCCOCCOCCOCCOCCO2	{5: 1, 6: 1, 11: 10, 14: 3, 23: 6, 24: 1, 31: 1}
Did not match all atoms present	68867-55-0	CCCCCCCCCCCCCCCCCC1=NC2=C(N1C)C=CC=C2S(=O)(=O)[O-].[Na+]	{1: 2, 2: 16, 35: 1, 33: 1, 14: 3, 29: 3}
Did not match all atoms present	68867-65-2	CCCCCCCCCCCCCCCCCC1=NC2=CC=CC=C2N1C.COS(=O)(=O)O	{1: 3, 2: 16, 35: 1, 33: 1, 14: 4, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	68867-67-4	COP(=O)([O-])OP(=O)([O-])OC.[Zn+2]	{1: 2, 29: 4, 22: 3}
Did not match all atoms present	68876-89-1	CC(C)CO.CC(C)C[AlH]CC(C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{1: 6, 2: 3, 3: 3, 20: 1, 17: 4}
Did not match all atoms present	68877-28-1	CCCCCCCCCCCCC1=CC=CC=C1C[N+]2=CC=CC3=CC=CC=C32	{1: 1, 2: 12, 14: 11, 33: 1}
Did not match all atoms present	68877-30-5	CC1=C(C(=CC=C1)[NH3+])C.[Cl-]	{1: 2, 14: 3, 17: 1}
Did not match all atoms present	68877-36-1	CCN(CC)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=CC(=C2)Cl)Cl)OC	{1: 4, 2: 2, 33: 1, 34: 2, 14: 5, 17: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	68877-39-4	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C\3/C(=O)C(=C/C(=N\NC4=CC=C(C=C4)S(=O)(=O)[O-])/C3=O)N=NC5=CC=C(C6=CC=CC=C65)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{25: 2, 34: 4, 29: 9, 14: 17, 31: 2}
Did not match all atoms present	68877-59-8	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NC=[N+](N3C)C.COS(=O)(=O)[O-]	{1: 4, 2: 2, 35: 1, 33: 3, 34: 2, 14: 10, 22: 1, 29: 3}
Did not match all atoms present	68877-62-3	CC1=C(C(=NC(=C1N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])Cl)NCCCOCCCCO)N)C#N	{1: 1, 2: 7, 35: 1, 37: 2, 38: 1, 34: 2, 14: 2, 17: 1, 20: 1, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	68877-64-5	CC(=O)NC1=CC(=CC=C1)N(CCC#N)CC=C	{1: 1, 2: 3, 5: 1, 6: 1, 33: 1, 14: 4, 24: 1, 37: 1, 31: 1}
Did not match all atoms present	68881-59-4	CCOC(=O)N1CCC2=CC(=C(C=C2C1C#N)OC)OC	{1: 3, 2: 1, 37: 1, 33: 1, 11: 2, 12: 1, 14: 2, 22: 2, 28: 1}
Did not match all atoms present	68890-66-4	CC1=CC(=O)N(C(=C1)CC(C)CC(C)(C)C)O.C(CO)N	{1: 5, 2: 4, 3: 1, 4: 1, 33: 1, 14: 2, 20: 1, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	68891-01-0	CS(=O)(=O)N.C=O.C1=CC=CC=C1.C1(=NC(=NC(=N1)N)N)N	{1: 1, 35: 3, 5: 1, 14: 6, 29: 2, 30: 4}
Did not match all atoms present	68891-02-1	C1=CC=C(C=C1)S(=O)(=O)O.C(CO)NCCO	{2: 4, 20: 3, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	68892-04-6	C1=CC(=C(C=C1Cl)[N+](=O)[O-])OC2=C(C=C(C=C2)Cl)S(=O)(=O)O	{38: 1, 14: 6, 17: 2, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	68892-07-9	CN1C(=CNC1=S)C(=O)OC	{32: 1, 1: 2, 28: 1, 14: 1, 33: 1}
Did not match all atoms present	68892-09-1	CC1=NN(C(=O)C1=CC2=C(C=C(C=C2)N(C)C)Cl)C3=CC=C(C=C3)C(=O)O	{1: 3, 35: 1, 6: 1, 33: 2, 14: 7, 15: 2, 17: 1, 25: 1, 27: 1}
Did not match all atoms present	68892-10-4	CCCCCCCCCCCC1CC(=C(C1)O[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 2: 10, 11: 2, 12: 1, 15: 2, 22: 2}
Did not match all atoms present	68892-13-7	CCCCCCCC(=O)CC(=O)C1=CC=CC=C1	{24: 2, 1: 1, 2: 7, 14: 5}
Did not match all atoms present	68892-14-8	C1C(O1)C(=O)OCCC2=CC=CC=C2	{2: 2, 11: 1, 12: 1, 14: 5, 23: 1, 28: 1}
Did not match all atoms present	68892-16-0	CC(CNCC1=CC=CC=N1)O	{1: 1, 2: 2, 3: 1, 14: 4, 35: 1, 20: 1, 31: 1}
Did not match all atoms present	68892-17-1	CCCCCCCC/C=C\CCO[Al](CCCCCCCC)CCCCCCCC	{1: 3, 2: 23, 22: 1, 6: 2}
Did not match all atoms present	68892-18-2	CCCCCC/C=C\CCO[Al](CCCCCC)CCCCCC	{1: 3, 2: 17, 22: 1, 6: 2}
Did not match all atoms present	68892-19-3	CC(C)C/C=C\CCO[Al](CC(C)C)CC(C)C	{1: 6, 2: 5, 3: 3, 22: 1, 6: 2}
Did not match all atoms present	68892-20-6	CCCC/C=C\CCO[Al](CCCC)CCCC	{1: 3, 2: 11, 22: 1, 6: 2}
Did not match all atoms present	68892-21-7	CCC/C=C\CCO[Al](CCC)CCC	{1: 3, 2: 8, 22: 1, 6: 2}
Did not match all atoms present	68892-22-8	CC/C=C\CCO[Al](CC)CC	{1: 3, 2: 5, 22: 1, 6: 2}
Did not match all atoms present	68892-24-0	CCC/C=C\[Al](CCC)CCC	{1: 3, 2: 6, 6: 2}
Did not match all atoms present	68892-28-4	CC(C)C(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O	{1: 3, 3: 2, 14: 7, 25: 2}
Did not match all atoms present	68892-29-5	CC1=C(CC(CC1)C(=O)OC2=CC=C(C=C2)C(C)(C)C3=CC=C(C=C3)OC(=O)C4CCC(=C(C4)C)C)C	{1: 6, 4: 1, 11: 6, 12: 2, 14: 8, 15: 4, 28: 2}
Did not match all atoms present	68892-41-1	CC(C)C(=O)NC1=NC(=O)C2=C(N1)N(C=N2)[C@H]3C[C@@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)O	{32: 1, 1: 4, 2: 1, 3: 1, 4: 1, 33: 1, 11: 1, 12: 3, 14: 14, 35: 2, 20: 1, 22: 3, 23: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	689-93-0	CC[As]C	{1: 2, 2: 1}
Did not match all atoms present	68900-69-6	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O.CCN(CCN(CC)CC(C)O)CCN(CC(C)O)/C=C/C.COS(=O)(=O)OC	{1: 10, 2: 56, 3: 2, 6: 2, 33: 3, 20: 2, 22: 2, 27: 3, 29: 2}
Did not match all atoms present	68900-72-1	CC1=CC=CC=C1N2CN(CN(C2)C3=CC=CC=C3C)C4=CC=CC=C4C.Cl.Cl.Cl	{1: 3, 11: 3, 33: 3, 14: 12, 17: 3}
Did not match all atoms present	68900-73-2	C1C(COP(=O)(O1)[O-])O.[Na+]	{20: 1, 11: 2, 12: 1, 29: 2, 23: 2}
Did not match all atoms present	68900-74-3	CCCCCCCCCC/C=C/CCO[Al](CCCCCCCCCC)CCCCCCCCCC	{1: 3, 2: 29, 22: 1, 6: 2}
Did not match all atoms present	68900-75-4	CCCCCCCCCC/C=C/[Al](CCCCCCCCCC)CCCCCCCCCC	{1: 3, 2: 27, 6: 2}
Did not match all atoms present	68900-76-5	CCCCCCCC/C=C/CCO[Al](CCCCCCCC)CCCCCCCC	{1: 3, 2: 23, 22: 1, 6: 2}
Did not match all atoms present	68900-77-6	CCCCCCCC/C=C/[Al](CCCCCCCC)CCCCCCCC	{1: 3, 2: 21, 6: 2}
Did not match all atoms present	68900-78-7	CCCCCC/C=C/CCO[Al](CCCCCC)CCCCCC	{1: 3, 2: 17, 22: 1, 6: 2}
Did not match all atoms present	68900-79-8	CC(C)C/C=C/CCO[Al](CC(C)C)CC(C)C	{1: 6, 2: 5, 3: 3, 22: 1, 6: 2}
Did not match all atoms present	68900-80-1	CCCCCC/C=C/[Al](CCCCCC)CCCCCC	{1: 3, 2: 15, 6: 2}
Did not match all atoms present	68900-81-2	CCCC/C=C/CCO[Al](CCCC)CCCC	{1: 3, 2: 11, 22: 1, 6: 2}
Did not match all atoms present	68900-82-3	CC(C)C/C=C/[Al](CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 3, 6: 2}
Did not match all atoms present	68900-83-4	CCC/C=C/[Al](CCC)CCC	{1: 3, 2: 6, 6: 2}
Did not match all atoms present	68900-84-5	CC/C=C/CCO[Al](CC)CC	{1: 3, 2: 5, 22: 1, 6: 2}
Did not match all atoms present	68900-85-6	CC/C=C/[Al](CC)CC	{1: 3, 2: 3, 6: 2}
Did not match all atoms present	68900-90-3	CCCCCCCC[Si](CCCCCCCC)(CCCCCCCC)Br	{1: 3, 2: 21, 18: 1}
Did not match all atoms present	68900-97-0	COC(=O)CCC1(OCCO1)CC2=CC=CC=C2	{1: 1, 2: 3, 11: 2, 13: 1, 14: 5, 23: 2, 28: 1}
Did not match all atoms present	68900-98-1	COC1=C(C=CC(=C1)NC2=CC=CC=C2)[N+]#N.F[P-](F)(F)(F)(F)F	{1: 1, 34: 1, 14: 8, 16: 6, 22: 1, 31: 1}
Did not match all atoms present	68901-00-8	CC(C)OC1=CC(=C(C=C1N2CCN(CC2)C(=O)C3=CC=CC=C3)OC(C)C)[N+](=O)[O-]	{1: 4, 3: 2, 38: 1, 33: 2, 11: 4, 14: 7, 22: 2, 24: 1}
Did not match all atoms present	68901-02-0	CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCCCCC2.F[P-](F)(F)(F)(F)F	{1: 2, 2: 2, 33: 1, 11: 6, 34: 1, 14: 2, 16: 6, 22: 2}
Did not match all atoms present	68901-03-1	CCOC1=CC(=C(C=C1N2CCCCCC2)OCC)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 33: 1, 11: 6, 14: 2, 22: 2}
Did not match all atoms present	68901-04-2	CC(C)OC1=CC(=C(C=C1[N+]#N)OC(C)C)N2CCOCC2.OS(=O)(=O)[O-]	{1: 4, 34: 1, 3: 2, 33: 1, 11: 4, 14: 2, 20: 1, 22: 2, 23: 1, 29: 3}
Did not match all atoms present	68901-07-5	CN1C(=CSC1=C2C(=O)N(C(=S)S2)CC(=O)O)C3=CC=CC=C3	{1: 1, 2: 1, 33: 2, 41: 2, 14: 6, 15: 4, 25: 1, 27: 1}
Did not match all atoms present	68901-08-6	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC)NCC(COC)O	{1: 3, 2: 2, 3: 1, 38: 2, 34: 2, 14: 5, 20: 1, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	68901-09-7	CNS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)O	{1: 1, 14: 3, 17: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	68901-10-0	CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C	{1: 2, 38: 1, 14: 6, 17: 1, 29: 2, 31: 1}
Did not match all atoms present	68901-11-1	CC(C)C(=O)CC1=C(C(C(=O)C(=C1[O-])CC=C(C)C)(CC=C(C)C)O)[O-].[Pb+2]	{1: 6, 2: 3, 3: 1, 6: 2, 7: 2, 13: 1, 15: 4, 20: 1, 24: 1, 25: 1}
Did not match all atoms present	68901-12-2	C(C1C(C(C(C(O1)OP(=O)([O-])[O-])O)O)O)O.[Pb+2]	{2: 1, 12: 5, 20: 4, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	68901-16-6	CN1C=CN=C1SCNC(=O)NC2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 33: 1, 40: 1, 14: 7, 24: 1, 31: 2}
Did not match all atoms present	68901-17-7	C(CN(COP(=O)([O-])[O-])COP(=O)([O-])[O-])N(COP(=O)([O-])[O-])COP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]	{33: 2, 2: 6, 29: 12, 22: 4}
Did not match all atoms present	68901-18-8	C1=CC=NC(=C1)NCC(CCl)OCC(CCl)O	{2: 4, 3: 2, 14: 4, 17: 2, 35: 1, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	68901-24-6	C1=CC2=C(C=CC(=C2[O-])[N+]#N)C(=C1)S(=O)(=O)OC3=CC=C(C=C3)SC4=CC=C(C=C4)OS(=O)(=O)C5=CC=CC6=C5C=CC(=C6[O-])[N+]#N	{40: 1, 34: 2, 22: 2, 14: 18, 29: 4}
Did not match all atoms present	68901-25-7	C1=CC=C2C(=C1)C=CC(=C2OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)SC5=C(C6=CC=CC=C6C=C5)OS(=O)(=O)C7=CC=CC8=C7C=CC(=C8[O-])[N+]#N	{40: 1, 34: 2, 22: 2, 14: 22, 29: 4}
Did not match all atoms present	68906-88-7	CC(C)NC[C@H](COC1=CC=CC2=C1CC=C2)O.CC(C)NC[C@H](COC1=CC=CC2=C1C=CC2)O.Cl.Cl	{1: 4, 2: 4, 3: 4, 11: 2, 14: 10, 17: 2, 20: 2, 22: 2, 31: 2}
Did not match all atoms present	68908-43-0	[OH-].[OH-].[OH-].[O-]P(=O)([O-])[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3].[Al+3].[Al+3]	{29: 16}
Did not match all atoms present	68908-97-4	CCCCCCCCCCC[Al](CCCCCCCCCCC)CCCCCCCCCCC	{1: 3, 2: 30}
Did not match all atoms present	68909-18-2	C[N+]1(CC=CC=C1)CC2=CC=CC=C2.[Cl-]	{1: 1, 2: 1, 11: 1, 14: 9, 17: 1}
Did not match all atoms present	68909-80-8	C1=CC=C(C=C1)CCl.C1=CC=C2C=NC=CC2=C1.C1=CC=C2C(=C1)C=CC=N2	{17: 1, 2: 1, 35: 2, 14: 19}
Did not match all atoms present	68909-89-7	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O.[Na+].[Na+].S.[S-2]	{38: 2, 21: 1, 14: 3}
Did not match all atoms present	68909-96-6	CCCCCCCCCCOCCC[N+](C)(C)CCC[N+](C)(C)C	{1: 6, 2: 15, 22: 1}
Did not match all atoms present	68910-46-3	CCCCCCCCC/C=C/COS(=O)(=O)O	{1: 1, 2: 9, 6: 2, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	68911-96-6	CCN(CC)C1=C(C=C(C=C1)[N+]#N)C.F[P-](F)(F)(F)(F)F	{1: 3, 2: 2, 33: 1, 34: 1, 14: 3, 16: 6}
Did not match all atoms present	68911-97-7	C1=CC2=C(C=C(C=C2)O)C(=C1)N3C=NC(=NC3=N)N.Cl	{33: 1, 35: 2, 36: 1, 14: 7, 17: 1, 21: 1, 30: 1}
Did not match all atoms present	68911-98-8	CCC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2O	{1: 1, 2: 1, 14: 10, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	68911-99-9	CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=C(C=C3)N(C)C)Cl.[I-]	{1: 6, 2: 4, 33: 3, 7: 1, 14: 11, 15: 2, 17: 1, 19: 1}
Did not match all atoms present	68912-00-5	CC1=CC=CC=C1N(C(=O)CC(=O)C)C(=O)CC(=O)C	{24: 4, 1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	68912-03-8	CCN1C(=C(C2=CC=CC=C21)C(C3=CC=C(C=C3)N(C)C)S(=O)(=O)C4=CC=C(C=C4)C)C	{1: 5, 2: 1, 3: 1, 33: 2, 14: 12, 29: 2}
Did not match all atoms present	68912-08-3	CCCCCCCCCCCCCCCCCC1=NC=CN1.CCCCCCCCCCCCCCCCCC1=NC=CN1.CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ni+2]	{32: 2, 1: 4, 2: 44, 35: 2, 14: 4, 24: 2}
Did not match all atoms present	68912-14-1	CCC/C=C/CCO[Al](CCC)CCC	{1: 3, 2: 8, 22: 1, 6: 2}
Did not match all atoms present	68913-85-9	COC1=C(C(=C(C=C1)CC#N)OC)OC	{1: 3, 2: 1, 22: 3, 14: 2, 37: 1}
Did not match all atoms present	6892-33-7	CC1=CC=C(C=C1)/C=C/C2=CN=CC=C2	{1: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	6892-80-4	CCCCCCCC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 6, 28: 1, 14: 4}
Did not match all atoms present	68921-48-2	CC1(C2CCC(=C)C1C2)C.C=O	{1: 2, 5: 2, 11: 3, 12: 2, 13: 1, 15: 1}
Did not match all atoms present	68921-59-5	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C1CO1.N	{1: 1, 2: 11, 11: 2, 14: 4, 20: 1, 23: 1, 29: 2}
Did not match all atoms present	68921-69-7	CC(=O)NC1=C(C=C2C(C3=CC=CC=C3C(C2=C1)OS(=O)(=O)[O-])OS(=O)(=O)[O-])Cl.[K+].[K+]	{1: 1, 12: 2, 14: 6, 17: 1, 22: 2, 24: 1, 29: 6, 31: 1}
Did not match all atoms present	68921-70-0	CC(=O)NC1=CC(=C(C=C1NCCCC(=O)OC)Cl)Cl	{1: 2, 2: 3, 14: 2, 17: 2, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	68921-71-1	C1CO[Sn]O1	{11: 2, 23: 2}
Did not match all atoms present	68921-72-2	CCCCCCCCOP(=O)(O)O.C(CO)NCCO	{1: 1, 2: 11, 20: 4, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	68921-73-3	C1=CC=C2C=C(C(=CC2=C1)C(=O)NCCNCCN)O.Cl.Cl	{2: 4, 14: 6, 17: 2, 21: 1, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	68921-75-5	CCN\1C2=CC=CC=C2O/C1=C/C=C/3\C(=O)SC(=S)N3CC(=O)O.C1CCNCC1	{32: 1, 1: 1, 2: 2, 6: 2, 33: 2, 41: 1, 11: 5, 14: 4, 15: 3, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	68921-76-6	CCN\1CCS/C1=C\C=C/2\C(=O)SC(=S)N2CC(=O)O.C1CCNCC1	{32: 1, 1: 1, 2: 2, 6: 2, 33: 2, 41: 2, 11: 7, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	68921-77-7	C/C(=C/1\C(=O)SC(=S)N1CC(=O)O)/C=C/2\N(CCS2)C.C1CCNCC1	{32: 1, 1: 2, 2: 1, 33: 2, 6: 1, 7: 1, 41: 2, 11: 7, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	68921-79-9	CC1=CSC(=CC=CC2=[N+](C3=CC=CC=C3O2)CC4=CC=CC=C4)N1CC5=CC=CC=C5.[Br-]	{1: 1, 2: 2, 6: 3, 33: 2, 41: 1, 14: 15, 15: 2, 18: 1, 23: 1}
Did not match all atoms present	68921-81-3	CC1=CC=CC=C1NC(=O)C2=CC3=CC4=CC=CC=C4C=C3C=C2[O-].[Na+]	{24: 1, 1: 1, 14: 12, 31: 1}
Did not match all atoms present	68921-84-6	CCCCC(CC)COC(=O)C1=CC=CC=C1N(C)C	{1: 4, 2: 5, 3: 1, 33: 1, 14: 4, 28: 1}
Did not match all atoms present	68921-85-7	CC(C)(COP(=O)(OC(CCl)CCl)OC(CCl)CBr)CBr	{1: 2, 2: 6, 3: 2, 4: 1, 17: 3, 18: 2, 22: 3, 29: 1}
Did not match all atoms present	68921-89-1	COCC1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	68921-90-4	CC(C)(CO)C(C(=O)NCCS(=O)(=O)[O-])[O-].[Ca+2]	{1: 2, 2: 3, 3: 1, 4: 1, 20: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	68921-91-5	C1=CC=C(C=C1)C2=NC(=C(C(=N2)Cl)[N+](=O)[O-])Cl	{17: 2, 35: 2, 38: 1, 14: 5}
Did not match all atoms present	68921-92-6	C1=CC(=C(C=C1Cl)Cl)CC(C(=O)O)O	{2: 1, 3: 1, 14: 3, 17: 2, 20: 1, 27: 1}
Did not match all atoms present	68921-93-7	C1=CC(=C(C=C1CC(C(=O)O)O)Cl)Cl	{2: 1, 3: 1, 14: 3, 17: 2, 20: 1, 27: 1}
Did not match all atoms present	68921-95-9	C1=CC=C(C=C1)C2(NC=CC(=O)N2)O	{32: 2, 25: 1, 20: 1, 13: 1, 14: 7}
Did not match all atoms present	68921-97-1	CC(=O)C1=C(CCCC1)[O-].CC(=O)C1=C(CCCC1)[O-].CC(=O)C1=C(CCCC1)[O-].[F-].[F-].[F-].[F-].[F-].[F-].[Si+4].[Sb]	{16: 6, 1: 3, 11: 12, 24: 3, 15: 6}
Did not match all atoms present	68921-99-3	CCC(=CC1=CC=C(C=C1)OCCC(C)C)C	{1: 4, 2: 3, 3: 1, 6: 1, 7: 1, 14: 4, 22: 1}
Did not match all atoms present	68922-01-0	CCOC(=O)OC1=CC(=C(C=C1)C=O)OC	{1: 2, 2: 1, 26: 1, 22: 1, 14: 3}
Did not match all atoms present	68922-02-1	CCOC(=O)C1C(O1)C2=CC=CC=C2O	{1: 1, 2: 1, 12: 2, 14: 4, 21: 1, 23: 1, 28: 1}
Did not match all atoms present	68922-04-3	CC(C)CC(=O)OCC1=CC=C(C=C1)O	{1: 2, 2: 2, 3: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	68922-05-4	C1=COC(=C1)SCC=O	{40: 1, 2: 1, 26: 1, 14: 3, 23: 1}
Did not match all atoms present	68922-06-5	C1=COC(=C1)SCCC=O	{40: 1, 2: 2, 26: 1, 14: 3, 23: 1}
Did not match all atoms present	68922-08-7	CC(CNCC1=CC=CC=N1)O.CC(CNCC1=CC=CC=N1)O.OS(=O)(=O)O	{1: 2, 2: 4, 3: 2, 14: 8, 35: 2, 20: 4, 29: 2, 31: 2}
Did not match all atoms present	68922-18-9	C1=CC=NC(=C1)CCS(=O)(=O)O	{2: 2, 35: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	68922-23-6	CC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)OP(OC2=C(C=C(C(=C2)C)C(C)(C)C)C(C)(C)C)OC3=C(C=C(C(=C3)C)C(C)(C)C)C(C)(C)C	{1: 21, 4: 6, 22: 3, 14: 6}
Did not match all atoms present	68922-24-7	CC\1=C(C(=O)[NH2+]C(=O)/C1=N\NC2=CC=CC=C2)[N+]3=CC=CC=C3.CC(=O)[O-].CC(=O)[O-]	{1: 3, 34: 1, 33: 1, 14: 10, 15: 3, 24: 2, 25: 2, 31: 1}
Did not match all atoms present	68922-29-2	CC(C)C(C(C)(C)COC(=O)C(C)C)O.CN(C)C1=CC=C(C=C1)N(C)C.C(CCC(=O)O)CC(=O)O	{1: 10, 2: 5, 3: 3, 4: 1, 33: 2, 14: 4, 20: 1, 27: 2, 28: 1}
Did not match all atoms present	68928-30-3	CCCCCCCCCCCCCCCCCCN(C)C.CCCCP(CCCC)CCCC.[Cl-].[Cl-].[Pt+2]	{1: 6, 2: 26, 33: 1, 17: 2}
Did not match all atoms present	68928-32-5	CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)[O-].N.N.[Zn+2]	{24: 2, 1: 2, 2: 28, 6: 4}
Did not match all atoms present	68928-43-8	C(S)S(=O)(=O)[O-].[Na+]	{2: 1, 29: 3, 39: 1}
Did not match all atoms present	68928-49-4	CCCCCCCCCCCCCCCC(=O)OCCS[Sn](C)(C)SCCOC(=O)CCCCCCCCCCCCCCC	{40: 2, 1: 4, 2: 32, 28: 2}
Did not match all atoms present	68928-54-1	CC1=CC(=C(C=C1)N/N=C\2/C3=C(C=C(C=C3)S(=O)(=O)[O-])C=C(C2=O)S(=O)(=O)[O-])C.[Ba+2]	{1: 2, 34: 1, 14: 7, 15: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	68928-55-2	CCCCCCCCCCCC(=O)NCCOC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 13, 3: 1, 24: 2, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	68928-63-2	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCCC[N+](C)(C)C.[Cl-]	{1: 5, 2: 3, 4: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	68928-64-3	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO.C(CSCCC(=O)O)C(=O)O	{40: 1, 2: 10, 27: 4, 20: 2, 14: 4}
Did not match all atoms present	68928-73-4	C/C=C/C1=CC(=C(C=C1)O)OC.COC1=C(C=CC(=C1)CC=C)O	{1: 3, 2: 1, 5: 1, 6: 3, 14: 6, 21: 2, 22: 2}
Did not match all atoms present	68928-78-9	CCCC[Sn](CCCC)(SCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC(C)C)SCCOC(=O)C2=CC=CC=C2C(=O)OCCCCCC(C)C	{1: 6, 2: 20, 3: 2, 40: 2, 14: 8, 28: 4}
Did not match all atoms present	68928-83-6	CCCCCCCCCCCCCCCOCCCNC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 18, 3: 1, 22: 1, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	68928-92-7	CC1CO1.C=O.C1=CC=C(C=C1)O.N	{1: 1, 5: 1, 11: 1, 12: 1, 14: 5, 21: 1, 23: 1}
Did not match all atoms present	68929-06-6	C1=C2C(=C(C(=CC3=NC(=CC4=NC(=CC5=C(C(=C1N5)CCC(=O)O)CC(=O)O)C(=C4CC(=O)O)CCC(=O)O)C(=C3CC(=O)O)CCC(=O)O)N2)CCC(=O)O)CC(=O)O.Cl.Cl	{32: 2, 2: 12, 35: 2, 14: 4, 17: 2, 27: 8}
Did not match all atoms present	68929-08-8	CC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[K+]	{1: 1, 14: 9, 25: 2, 29: 5, 30: 1, 31: 1}
Did not match all atoms present	68929-09-9	C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[K+]	{25: 2, 30: 1, 29: 5, 14: 10, 31: 1}
Did not match all atoms present	68929-10-2	C1CC(=O)C2=C(C3=C(C=CC(=C3C(=C2C1=O)[O-])[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{25: 2, 11: 2, 14: 2}
Did not match all atoms present	68929-11-3	C1=CC(=C(C=C1O)O)CC(=O)N	{24: 1, 2: 1, 30: 1, 21: 2, 14: 3}
Did not match all atoms present	68929-12-4	CCCCC(CC)CC1=C(C2=C(C=CC=N2)C=C1)O	{1: 2, 2: 5, 3: 1, 14: 5, 35: 1, 21: 1}
Did not match all atoms present	68929-13-5	CC1=CC(=CC=C1)N=NC2=C(C3=C(C=CC(=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N=C(C4=CC=CC=C4)[O-])[O-].[Na+].[Na+].[Ba+2]	{1: 1, 34: 3, 29: 6, 14: 12, 7: 1}
Did not match all atoms present	68929-14-6	C[Si]1(CCCOS(=O)(=O)O1)Cl	{23: 2, 1: 1, 11: 3, 29: 2, 17: 1}
Did not match all atoms present	68929-15-7	CCN(CC)CC.CC(C)(C)C1=CC=C(C=C1)C(=O)O	{1: 6, 2: 3, 4: 1, 33: 1, 14: 4, 27: 1}
Did not match all atoms present	6893-02-3	C1=CC(=C(C=C1OC2=C(C=C(C=C2I)C[C@@H](C(=O)O)N)I)I)O	{2: 1, 3: 1, 14: 5, 19: 3, 21: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	6893-20-5	CC(=O)NC1=C(C2=C(C=C1)C3=CC=CC=C3C2)OC	{1: 2, 11: 1, 14: 6, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	6893-24-9	COC1=C(C=CC2=C1CC3=CC=CC=C32)[NH3+].[Cl-]	{1: 1, 11: 1, 22: 1, 14: 6, 17: 1}
Did not match all atoms present	68936-12-9	CC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N.Cl	{1: 1, 34: 2, 30: 2, 14: 7, 17: 1}
Did not match all atoms present	68936-85-6	CCCCCCCCCC1=CC=C(C=C1)OP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 8, 22: 1, 14: 4, 29: 3}
Did not match all atoms present	68936-91-4	CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(CO)(CO)COC(=O)C1=CC=CC=C1.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 1, 2: 16, 4: 1, 6: 4, 14: 9, 20: 2, 28: 4}
Did not match all atoms present	68936-92-5	CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(CO)O.C=CC1=CC=CC=C1.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 1, 2: 14, 3: 1, 5: 1, 6: 5, 14: 9, 20: 2, 28: 3}
Did not match all atoms present	68937-05-3	CC(=O)O.[O-2].OS(=O)(=O)O.O=[Si]=O.[Pb+2]	{1: 1, 27: 1, 20: 2, 29: 4}
Did not match all atoms present	68937-13-3	COC(=O)N.C=O	{1: 1, 28: 1, 5: 1, 30: 1}
Did not match all atoms present	68937-15-5	CCN1C(=[N+](C2=CC=CC=C21)CC)C.[Cl-].[Cl-].[Cl-].[Cl-].[Au+3]	{1: 3, 2: 2, 33: 2, 14: 4, 17: 4}
Did not match all atoms present	68937-24-6	C(CCCO)CCO.N	{2: 6, 20: 2}
Did not match all atoms present	68937-27-9	C1=CC(=C(C=C1C(=O)C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-].[Cu+2].[Cu+2]	{24: 5, 14: 6}
Did not match all atoms present	68937-41-7	CC(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C(C)C)OC3=CC=C(C=C3)C(C)C	{1: 6, 3: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	68937-42-8	CCCCCCCCCC1=CC=CC=C1O.C(CNCCN)N.C(CNCCNCCN)N	{1: 1, 2: 18, 14: 4, 21: 1, 30: 4, 31: 3}
Did not match all atoms present	68937-88-2	CCCCCCCCCCCCC1=CC=C(C=C1)N.CCCCOP(=O)(O)OCCCC	{1: 3, 2: 17, 14: 4, 20: 1, 22: 2, 29: 1, 30: 1}
Did not match all atoms present	68938-57-8	CN1C=CN=C1.CN1C=CN=C1.CN1C=CN=C1.CN1C=CN=C1.C1=C(C(=CC(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O	{1: 4, 27: 4, 35: 4, 14: 14, 33: 4}
Did not match all atoms present	68938-61-4	CCCCC(CC)COC(=O)NC1=C(C=CC(=C1)N=C=O)C	{1: 3, 2: 5, 3: 1, 8: 1, 34: 1, 14: 3, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	68938-64-7	CC(=O)OCCN(CCOC(=O)C)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)Cl	{1: 2, 2: 4, 38: 1, 33: 1, 34: 2, 14: 5, 17: 3, 28: 2}
Did not match all atoms present	68938-65-8	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]	{1: 1, 2: 3, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 12, 28: 1}
Did not match all atoms present	68938-67-0	C1=CC=C2C(=C1)C(=CC=C2[N+]#N)N=NC3=CC(=CC=C3)S(=O)(=O)O.C1=CC=C2C(=C1)C(=CC=C2[N+]#N)N=NC3=CC(=CC=C3)S(=O)(=O)O.[O-]S(=O)(=O)[O-]	{34: 6, 20: 2, 29: 8, 14: 20}
Did not match all atoms present	68938-69-2	C1=CC=C2C(=C1)C(=CC=C2[N+]#N)N=NC3=CC=CC4=C3C=CC=C4S(=O)(=O)O.C1=CC=C2C(=C1)C(=CC=C2[N+]#N)N=NC3=CC=CC4=C3C=CC=C4S(=O)(=O)O.[O-]S(=O)(=O)[O-]	{34: 6, 20: 2, 29: 8, 14: 24}
Did not match all atoms present	68938-74-9	CCCC(CC)COCC(C[N+](C)(C)C)OCC(C[N+](C)(C)C)O.[Cl-].[Cl-]	{1: 8, 2: 8, 3: 3, 17: 2, 20: 1, 22: 2}
Did not match all atoms present	68938-78-3	CCCCCCCCC=CCCCCCCCC(=O)C1=NCCN1CCO.OP(=O)(O)O	{1: 1, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 20: 4, 24: 1, 29: 1}
Did not match all atoms present	68938-80-7	C1=CC(=C(C(=C1Cl)C(=O)[O-])[O-])Cl.[K+].[K+]	{24: 1, 17: 2, 14: 2}
Did not match all atoms present	68938-81-8	C1=CC(=C(C=C1Cl)[O-])Cl.[K+]	{17: 2, 14: 3}
Did not match all atoms present	68938-85-2	C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCCO)CCO	{2: 7, 8: 2, 11: 5, 34: 2, 14: 8, 20: 2, 28: 1, 29: 2}
Did not match all atoms present	68938-90-9	CC(C)(C)NC1=NC(=NC(=N1)SNC(C)(C)C)NC(C)(C)C	{40: 1, 1: 9, 35: 3, 4: 3, 31: 3}
Did not match all atoms present	68938-91-0	CCCCCCC(O)C/C=C/CCCCCCCC(=O)O.CCCCCCC(O)C/C=C/CCCCCCCC(=O)O.CCCCCCC(O)C/C=C/CCCCCCCC(=O)O.CC(O)C.[Ti]	{1: 5, 2: 39, 3: 4, 6: 6, 20: 4, 27: 3}
Did not match all atoms present	68938-94-3	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[K+].[K+].[K+].[Os]	{17: 6}
Did not match all atoms present	68938-97-6	C=O.C1(=NC(=NC(=N1)N)N)N.[Cl-].[Cl-].[Sn+2]	{17: 2, 35: 3, 5: 1, 30: 3}
Did not match all atoms present	68941-04-8	CC1=C/C(=N\NC2=CC=C(C=C2)S(=O)(=O)O)/C(=O)C(=C1)C	{1: 2, 34: 1, 14: 6, 15: 3, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	68951-38-2	O.O.O.[O-2].[O-2].[O-2].[As].[As].[Sb+3].[Sb+3]	{}
Did not match all atoms present	68952-09-0	CCCCCCOC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 11, 3: 2, 28: 2, 29: 3}
Did not match all atoms present	68953-81-1	CCCCCCC(C)CC1=CC=CC=C1OCCOCCCl	{1: 2, 2: 10, 3: 1, 14: 4, 17: 1, 22: 2}
Did not match all atoms present	68953-86-6	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(C(CO)O)O	{1: 1, 2: 14, 3: 1, 6: 4, 14: 4, 20: 3, 27: 3}
Did not match all atoms present	68954-01-8	CCCC(C(C(CCCOC(COC(=O)C1=C(C=C(C(=C1)C(=O)O)C(=O)OCC(CCl)O)C(=O)OCC(CCl)O)CCl)(F)F)(F)F)(F)F	{1: 1, 2: 11, 3: 3, 4: 3, 14: 2, 16: 6, 17: 3, 20: 2, 22: 1, 27: 1, 28: 3}
Did not match all atoms present	68954-54-1	CC(C)(C)CCCCCC(=O)O.[O-2].[O-2].[O-2].[Sb+3].[Sb+3]	{1: 3, 2: 5, 27: 1, 4: 1}
Did not match all atoms present	68955-16-8	C(CO)N.OS(=O)(=O)O	{2: 2, 20: 3, 29: 2, 30: 1}
Did not match all atoms present	68955-18-0	C1=CC=C(C=C1)S(=O)(=O)N(CCCCCC(=O)O)CO.C(CO)N(CCO)CCO	{33: 2, 2: 12, 14: 5, 20: 4, 27: 1, 29: 2}
Did not match all atoms present	68955-22-6	CCCCO.CC(C)O.[Ti]	{1: 3, 2: 3, 3: 1, 20: 2}
Did not match all atoms present	68955-26-0	[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Zr+4]	{}
Did not match all atoms present	68955-57-7	C(CO)NCCO.C(COP(=O)(O)O)N(CCOP(=O)(O)O)CCOP(=O)(O)O	{33: 1, 2: 10, 20: 8, 22: 3, 29: 3, 31: 1}
Did not match all atoms present	68956-71-8	C(CNCCN)N.OP(O)O	{2: 4, 20: 3, 30: 2, 31: 1}
Did not match all atoms present	68957-16-4	CCCCCOS(=O)(=O)C	{1: 2, 2: 4, 29: 2, 22: 1}
Did not match all atoms present	68957-18-6	CCCCCCCCCCC(O)(OCC)OCC.OS(=O)(=O)O	{1: 3, 2: 11, 4: 1, 20: 3, 22: 2, 29: 2}
Did not match all atoms present	68957-31-3	CCN(CC(=O)O)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 5, 33: 1, 16: 11, 27: 1, 29: 2}
Did not match all atoms present	68957-32-4	CCN(CC(=O)O)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 6, 33: 1, 16: 13, 27: 1, 29: 2}
Did not match all atoms present	68957-33-5	CCN(CC(=O)O)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 4, 33: 1, 16: 9, 27: 1, 29: 2}
Did not match all atoms present	68957-34-6	CN(C)NCC1=CC=CC=C1.Cl	{1: 2, 2: 1, 33: 1, 14: 5, 17: 1, 31: 1}
Did not match all atoms present	68957-35-7	CN(C)CCCNC(=O)CCS(=O)(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl.C(=O)O	{1: 2, 2: 5, 35: 1, 33: 2, 11: 2, 14: 8, 15: 1, 17: 1, 24: 1, 26: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	68957-36-8	CC1=CC(=O)N(C(=C1C#N)O)C2=CC=C(C=C2)N	{1: 1, 37: 1, 33: 1, 14: 5, 21: 1, 25: 1, 30: 1}
Did not match all atoms present	68957-37-9	CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=C(C=C3)N	{1: 1, 2: 1, 33: 1, 14: 13, 29: 2, 30: 1}
Did not match all atoms present	68957-38-0	CCN(CC)C1=CC=CC(=C1)NC(=O)C(C)Cl	{1: 3, 2: 2, 3: 1, 33: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	68957-41-5	C1CCC(CC1)C2=CC=C(C=C2)OC3=CC(=C(C=C3)N)S(=O)(=O)O	{11: 5, 12: 1, 14: 7, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	68957-43-7	COC1=CC=CC=C1NC(=O)CC2=NC(=O)NC(=O)N2	{32: 2, 1: 1, 2: 1, 35: 1, 14: 4, 22: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	68957-44-8	CC1(C2=CC=CC=C2[N+](=C1C=NN(C)C3=CC=C(C=C3)OC)C)C.CC1(C2=CC=CC=C2[N+](=C1C=NN(C)C3=CC=C(C=C3)OC)C)C.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-]	{1: 10, 34: 2, 6: 2, 33: 4, 13: 2, 14: 22, 15: 2, 22: 2, 29: 6}
Did not match all atoms present	68957-48-2	CC1(C2=CC=CC=C2[N+](=C1C=CC3=CC=C(C=C3)N(C)CCC#N)C)C.CC1(C2=CC=CC=C2[N+](=C1C=CC3=CC=C(C=C3)N(C)CCC#N)C)C.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-]	{1: 8, 2: 4, 37: 2, 6: 4, 33: 4, 13: 2, 14: 22, 15: 2, 29: 6}
Did not match all atoms present	68957-49-3	CCOP(=S)(OCC)OC1=NN(C(=N1)Cl)C(C)(C)C	{1: 5, 2: 2, 35: 2, 4: 1, 33: 1, 17: 1, 22: 3}
Did not match all atoms present	68957-50-6	CC1=C(C=C(C(=N1)N)[N+](=O)[O-])Br	{1: 1, 35: 1, 38: 1, 14: 1, 18: 1, 30: 1}
Did not match all atoms present	68957-51-7	CCCCCCCCCCCCCCCCCC(=O)NCCN(CC)CCO.CCOS(=O)(=O)O	{1: 3, 2: 22, 33: 1, 20: 2, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68957-52-8	CC1(C2CCC13CP(=O)(C3C2)C4=CC=CC=C4)C	{1: 2, 11: 4, 12: 2, 13: 2, 14: 5, 29: 1}
Did not match all atoms present	68957-53-9	CCN(CC(=O)OCC)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 6, 33: 1, 16: 13, 28: 1, 29: 2}
Did not match all atoms present	68957-54-0	CCN(CC(=O)OCC)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 3, 4: 7, 33: 1, 16: 15, 28: 1, 29: 2}
Did not match all atoms present	68957-63-1	CCN(CC(=O)O)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 7, 33: 1, 16: 15, 27: 1, 29: 2}
Did not match all atoms present	68957-64-2	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[Ru+3]	{24: 3, 1: 3, 2: 18}
Did not match all atoms present	68957-65-3	CC1=CC(=C(C=C1N)N)N=NC2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)N=NC5=C(C=C6C=C(/C(=N/NC7=CC=CC=C7)/C(=O)C6=C5N)S(=O)(=O)O)S(=O)(=O)O	{32: 1, 1: 1, 34: 5, 35: 1, 14: 16, 15: 2, 20: 2, 25: 1, 29: 4, 30: 3, 31: 1}
Did not match all atoms present	68957-66-4	CC(=NOC(=O)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)N	{1: 1, 34: 1, 35: 1, 6: 2, 7: 1, 14: 12, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	68957-67-5	CCNC1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])[N+](=O)[O-])OCCOC	{1: 3, 2: 3, 38: 2, 34: 2, 14: 4, 17: 1, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	68957-68-6	C(CSCCC#N)CS(=O)(=O)O	{40: 1, 2: 5, 20: 1, 29: 2, 37: 1}
Did not match all atoms present	68957-69-7	CCCCCCC(=O)[O-].CCCCCCC(=O)[O-].CCCCCCC(=O)[O-].[Cr+3]	{24: 3, 1: 3, 2: 15}
Did not match all atoms present	68957-71-1	CC1=C(C=CC(=C1)S(=O)(=O)O)N2C(=O)C(C(=N2)C)N=NC3=C(C=CC(=C3)S(=O)(=O)O)C(=O)O	{1: 2, 34: 2, 35: 1, 33: 1, 12: 1, 14: 6, 15: 1, 20: 2, 25: 1, 27: 1, 29: 4}
Did not match all atoms present	68957-85-7	CC(=O)[O-].C[N+](C)(C)CC1=CC=CC=C1C=C.C=CC1=CC=CC=C1C=C	{1: 4, 2: 1, 5: 3, 6: 3, 14: 8, 24: 1}
Did not match all atoms present	68957-95-9	CCCP1(=O)OP(=O)(OP(=O)(O1)CCC)CCC.C1CO1	{1: 3, 2: 6, 11: 2, 29: 3, 23: 4}
Did not match all atoms present	68958-03-2	CC1=C(C=CC(=C1)C2(C3=CC=CC=C3NC2=O)C4=CC(=C(C=C4)O)C)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C(=O)(O)O	{32: 1, 1: 4, 4: 1, 13: 1, 14: 18, 21: 4, 25: 1, 27: 2}
Did not match all atoms present	68958-04-3	CC1=CC(=C(C=C1)O)CC2=CC(=CC(=C2O)CC3=C(C=CC(=C3)C)O)C.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C(=O)(O)O	{1: 5, 2: 2, 4: 1, 14: 16, 21: 5, 27: 2}
Did not match all atoms present	68958-17-8	CCOC(=O)C=C.CC(C)(C)NC(=O)C=C.C=CC(=O)[O-].[K+]	{1: 4, 2: 1, 4: 1, 5: 3, 6: 3, 24: 2, 28: 1, 31: 1}
Did not match all atoms present	68958-21-4	C1C(O1)CCl.C1=CC(=C(C=C1Br)Br)O	{2: 1, 11: 1, 12: 1, 14: 3, 17: 1, 18: 2, 21: 1, 23: 1}
Did not match all atoms present	68958-23-6	CCCCC(CC)CO.C(CO)O.O=P(=O)OP(=O)=O	{1: 2, 2: 7, 3: 1, 20: 3, 22: 1, 29: 4}
Did not match all atoms present	68958-28-1	CC(=C)C(=O)OC.C=CP(=O)(OCCCl)OCCCl.C=C(Cl)Cl	{1: 2, 2: 4, 5: 3, 6: 1, 7: 2, 17: 4, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	68958-37-2	CCCCCCCCCCCCCCC1CO1.CC(C)(C)C1=CC=C(C=C1)O.C=O	{1: 4, 2: 13, 4: 1, 5: 1, 11: 1, 12: 1, 14: 4, 21: 1, 23: 1}
Did not match all atoms present	68958-38-3	CCCCCCCCCCCCCCC1CO1.CC(C)(C)C1=CC=C(C=C1)O.C=O.C1CO1	{1: 4, 2: 13, 4: 1, 5: 1, 11: 3, 12: 1, 14: 4, 21: 1, 23: 2}
Did not match all atoms present	68958-40-7	CC1=NC=C(C=C1)C=C.C[N+]1=CC=CC(=C1)C=C.[Cl-]	{1: 2, 35: 1, 5: 2, 6: 2, 33: 1, 14: 7, 17: 1}
Did not match all atoms present	68958-53-2	CC(C)CCCCCC1=CC=C(C=C1)OC2=CC=C(C=C2)[N+](=O)[O-]	{1: 2, 2: 5, 3: 1, 38: 1, 14: 8, 22: 1}
Did not match all atoms present	68958-84-9	C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Cl-].[Cl-].[Pt+4]	{24: 2, 1: 4, 17: 2, 6: 2, 7: 2}
Did not match all atoms present	68958-86-1	[H+].C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[Ni+2]	{33: 2, 2: 6, 29: 12}
Did not match all atoms present	68958-87-2	[H+].C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+].[Ni+2]	{33: 2, 2: 6, 29: 12}
Did not match all atoms present	68958-88-3	[H+].C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Ni+2]	{33: 2, 2: 6, 29: 12}
Did not match all atoms present	68958-91-8	C1CN2CCN1CC2.[Cl-].[Cl-].[Cu+2]	{17: 2, 11: 6, 33: 2}
Did not match all atoms present	68958-98-5	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC(=CC=C3)S(=O)(=O)[O-])NN=C4C=CC(=O)C=C4.[Na+]	{34: 3, 14: 14, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	68959-06-8	CCC(C)O[Al](OC(C)CC)O[Si](OCC)(OCC)OCC	{1: 7, 2: 5, 3: 2, 22: 6}
Did not match all atoms present	68959-07-9	C[Si](C)(C)N1C2C3CC(C2N=N1)C4C3N(N=N4)[Si](C)(C)C	{1: 6, 11: 1, 12: 6, 35: 4, 33: 2}
Did not match all atoms present	68959-09-1	C1=CC=C2C=C(C(=CC2=C1)CC3=CC4=C(C=C3)C=C(C=C4)S(=O)(=O)O)S(=O)(=O)O	{2: 1, 20: 2, 29: 4, 14: 12}
Did not match all atoms present	68959-10-4	CC1=CC(=C(C=C1Cl)N/N=C/2\C(=O)C(=CC3=C2C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].CC1=CC(=C(C=C1Cl)N/N=C/2\C(=O)C(=CC3=C2C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Ba+2].[Ba+2].[Ba+2]	{1: 2, 34: 2, 14: 12, 15: 4, 17: 2, 25: 2, 29: 18, 31: 2}
Did not match all atoms present	68959-11-5	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)S(=O)(=O)O	{1: 5, 2: 1, 4: 2, 14: 3, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	68959-12-6	C1=CC(=CC\2=C1C=CC(=O)/C2=N/NC3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)O	{34: 1, 38: 1, 14: 9, 15: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	68959-14-8	C1=CC=C2C=C(C(=CC2=C1)CC3=C(C=CC(=C3)O)S(=O)(=O)C4=CC=C(C=C4)O)S(=O)(=O)[O-].[Na+]	{2: 1, 21: 2, 14: 13, 29: 5}
Did not match all atoms present	68959-15-9	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Na+].[Na+].[Na+].[Ti+4].[Ti+4].[Ti+4]	{24: 15, 20: 5, 2: 10, 4: 5}
Did not match all atoms present	68959-18-2	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C/3\C(=O)C=C/C(=N\NC4=CC=CC5=C4C=C(C=C5)S(=O)(=O)[O-])/C3=O.[Na+].[Na+]	{25: 2, 34: 2, 29: 6, 14: 14, 31: 2}
Did not match all atoms present	68959-20-6	CCCCCCCCCC[N+](C)(CCCCCCCCCC)CCC[Si](OC)(OC)OC.[Cl-]	{1: 6, 2: 21, 22: 3, 17: 1}
Did not match all atoms present	68959-27-3	C[N+](C)(CC1CO1)C2CCCO2.[Cl-]	{1: 2, 2: 1, 11: 4, 12: 2, 17: 1, 23: 2}
Did not match all atoms present	68959-29-5	C1=CC(=CC=C1N=NC2=CC=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{17: 1, 34: 4, 29: 3, 14: 11}
Did not match all atoms present	68959-30-8	COC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 34: 4, 14: 11, 17: 1, 22: 1, 29: 3}
Did not match all atoms present	68959-32-0	CC1=C(C=C(C=C1)[N+](=O)[O-])N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)O	{1: 1, 34: 1, 38: 1, 14: 8, 15: 2, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	68959-34-2	CCCCNC1=C2C(=C(C=C1)NC3CCCCC3)C(=O)C4=CC=CC=C4C2=O	{1: 1, 2: 3, 11: 5, 12: 1, 14: 6, 25: 2, 31: 2}
Did not match all atoms present	68959-36-4	CCN(CC)C1=CC=C(C=C1)C(C(C2=CC(=CC=C2)S(=O)(=O)O)NCC3=CC(=CC(=C3)C)C)C(C4=CC(=CC=C4)S(=O)(=O)O)NCC5=CC(=CC(=C5)C)C	{1: 6, 2: 4, 3: 3, 33: 1, 14: 18, 20: 2, 29: 4, 31: 2}
Did not match all atoms present	68959-37-5	CC1=CC(=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC4=CC5=C(C=C4)C(=O)/C(=N/NC6=CC=CC=C6OC)/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 3, 34: 2, 14: 15, 15: 4, 22: 1, 25: 2, 29: 6, 31: 3}
Did not match all atoms present	68959-38-6	CCCCOC1=C(C(=C(C(=C1[N+](=O)[O-])OCCCC)[N+](=O)[O-])OCCCC)[N+](=O)[O-]	{1: 3, 2: 9, 38: 3, 22: 3}
Did not match all atoms present	68959-40-0	CCCOC1=C(C(=C(C(=C1[N+](=O)[O-])OCCC)[N+](=O)[O-])OCCC)[N+](=O)[O-]	{1: 3, 2: 6, 38: 3, 22: 3}
Did not match all atoms present	68959-42-2	CC(C)OC1=C(C(=C(C(=C1[N+](=O)[O-])OC(C)C)[N+](=O)[O-])OC(C)C)[N+](=O)[O-]	{1: 6, 3: 3, 38: 3, 22: 3}
Did not match all atoms present	68959-43-3	COCCCNS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 3, 17: 1, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	68959-87-5	CC(C)[C-]1[CH-][CH-][CH-][CH-]1.CC(C)[C-]1C=CC=C1.CC(C)[C-]1C=CC=C1.[La]	{1: 6, 3: 3, 14: 12}
Did not match all atoms present	68964-17-0	CC(C)(CO)[C@H](C(=O)NCCS(=O)(=O)O)O	{1: 2, 2: 3, 3: 1, 4: 1, 20: 3, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	68966-31-4	C1=CC=C(C=C1)N=C2C=CC(=C(C3=CC=C(C=C3)N)C4=CC=C(C=C4)N)C=C2.Cl	{34: 1, 7: 1, 14: 17, 15: 2, 17: 1, 30: 2}
Did not match all atoms present	68966-32-5	C1=CC(=C(C(=C1)Cl)C(=O)[O-])C(=O)O.[Na+]	{24: 1, 17: 1, 27: 1, 14: 3}
Did not match all atoms present	68966-34-7	CCC12COCN1COC2.OS(=O)(=O)O	{1: 1, 2: 1, 33: 1, 11: 4, 13: 1, 20: 2, 23: 2, 29: 2}
Did not match all atoms present	68966-41-6	C1CCC(CC1)N.C1CCC(CC1)N.C1CCC(CC1)N.C(C1C(C(C(O1)(COP(=O)(O)O)O)O)O)OP(=O)(O)O	{2: 2, 11: 15, 12: 6, 13: 1, 20: 7, 22: 2, 23: 1, 29: 2, 30: 3}
Did not match all atoms present	68966-44-9	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O)OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)O)S(=O)(=O)[O-])OC.C(CO)NCCO.[Na+]	{1: 4, 2: 4, 34: 4, 14: 14, 20: 5, 22: 2, 24: 1, 29: 9, 31: 3}
Did not match all atoms present	68966-47-2	CC1=NN(C(=O)C1N=NC2=C(C3=CC=CC=C3C=C2)S(=O)(=O)O)C4=CC(=C(C=C4Cl)S(=O)(=O)[O-])Cl.C(CO)N(CCO)CCO.[Na+]	{1: 1, 2: 6, 35: 1, 33: 2, 12: 1, 34: 2, 14: 8, 15: 1, 17: 2, 20: 4, 25: 1, 29: 5}
Did not match all atoms present	68966-49-4	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O)OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)O)S(=O)(=O)O)OC.C(CO)NCCO	{1: 4, 2: 4, 34: 4, 14: 14, 20: 6, 22: 2, 24: 1, 29: 8, 31: 3}
Did not match all atoms present	68966-51-8	CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)O)S(=O)(=O)[O-])C)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)O)S(=O)(=O)O.[Na+]	{1: 2, 34: 4, 14: 16, 20: 3, 24: 1, 29: 9, 31: 2}
Did not match all atoms present	68966-53-0	C1=CC(=O)C=CC1=NNC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NN=C4C=CC(=O)C=C4)S(=O)(=O)[O-])S(=O)(=O)O.[Na+]	{34: 2, 6: 2, 14: 14, 15: 2, 20: 1, 25: 2, 29: 5, 31: 2}
Did not match all atoms present	68966-59-6	C1=CC=C(C(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CCO)CO	{2: 4, 27: 4, 20: 2, 14: 8}
Did not match all atoms present	68966-78-9	CC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])NC5=CC=C(C=C5)C)[N+](=O)[O-]	{1: 2, 31: 2, 38: 2, 14: 12, 25: 2}
Did not match all atoms present	68966-79-0	CC(=O)OCCC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 2, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	68966-81-4	CCC(C)(C)C1=C(C(=CC=C1)C(C)(C)CC)OP(=O)(O)OC2=C(C=CC=C2C(C)(C)CC)C(C)(C)CC	{1: 12, 2: 4, 4: 4, 14: 6, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	68966-84-7	CCC1=C(C(=C(C=C1)N)C)N	{1: 2, 2: 1, 30: 2, 14: 2}
Did not match all atoms present	68966-85-8	CC1=C(C2=C(C=C1)N=C(S2)C3=C(C=C(C=C3)N=NC(C(C)O)C(=O)NC4=CC=C(C5=CC=CC=C54)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 3: 2, 41: 1, 14: 11, 35: 1, 20: 1, 24: 1, 29: 9, 31: 1}
Did not match all atoms present	68966-90-5	C1=CC=C(C(=C1)N=NC2=C(C=C(C=C2)N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N/N=C\5/C(=O)C=CC(=C5[O-])N=NC6=C(C=CC(=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{34: 7, 6: 2, 14: 18, 15: 3, 25: 1, 29: 15, 31: 1}
Did not match all atoms present	68966-92-7	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=CC=C3.[Na+].[Cr+3]	{1: 4, 34: 4, 35: 2, 33: 2, 14: 16, 29: 4, 31: 2}
Did not match all atoms present	68966-97-2	[H+].CC1=CC(=C(C=C1Cl)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)[O-])[O-])S(=O)(=O)[O-].[Cd+2]	{1: 1, 34: 2, 14: 7, 17: 1, 24: 1, 29: 3}
Did not match all atoms present	68966-99-4	[H+].CC1=C(C=CC(=C1)S(=O)(=O)[O-])N2C(=O)/C(=N\NC3=C(C=CC(=C3)S(=O)(=O)[O-])C(=O)[O-])/C(=N2)C.[Cr+2]	{1: 2, 34: 1, 35: 1, 33: 1, 14: 6, 15: 2, 24: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	68969-72-2	CC1(P(P1C(C)(C)C)C(C)(C)C)C	{1: 8, 4: 2, 13: 1}
Did not match all atoms present	68969-73-3	CC(C)(C)P1CP1C(C)(C)C	{1: 6, 11: 1, 4: 2}
Did not match all atoms present	68971-82-4	CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=CC(=CC(=C5O)CC6=CC(=CC(=C6O)CC7=C(C(=CC(=C7)C(C)(C)C)CC8=C(C(=CC(=C8)C(C)(C)C)CC9=C(C(=CC(=C9)C(C)(C)C)C2)O)O)O)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)O	{1: 24, 11: 8, 4: 8, 21: 8, 14: 16}
Did not match all atoms present	68972-96-3	C1=CC=C(C=C1)COCC=CCOCC2=CC=CC=C2	{2: 4, 22: 2, 14: 10, 6: 2}
Did not match all atoms present	68974-77-6	CCCC[Sn](O[Sn](OC(=O)/C=C/C(=O)OCCCCCC(C)C)(CCCC)CCCC)(OC(=O)/C=C/C(=O)OCCCCCC(C)C)CCCC	{1: 8, 2: 22, 3: 2, 6: 4, 22: 1, 28: 4}
Did not match all atoms present	68975-49-5	CCN1CCCC2=C1C=C3C(=C2)C(=CC(=O)O3)C(F)(F)F	{1: 1, 2: 1, 4: 1, 33: 1, 11: 3, 14: 3, 16: 3, 28: 1}
Did not match all atoms present	68975-64-4	[C-]#N.[C-]#N.C(=N)(N)[S-].[Cu+2].[Au+]	{36: 1, 30: 1, 7: 1}
Did not match all atoms present	68975-66-6	CC(CN(CCN(CC(C)O)CC(C)O)CC(C)O)O.[O-]S(=O)(=O)[O-].[Cu+2]	{1: 4, 2: 6, 3: 4, 33: 2, 20: 4, 29: 4}
Did not match all atoms present	68975-68-8	CCCCCCCCCCCCCCCCCCN1CCN(C1=O)CCO.CCOS(=O)(=O)OCC	{1: 3, 2: 21, 33: 2, 11: 2, 20: 1, 22: 2, 25: 1, 29: 2}
Did not match all atoms present	68975-85-9	C1CCNCC1.C1CCN(CC1)C(=S)[S-].C1CCN(CC1)C(=S)[S-].[Zn+2]	{32: 1, 33: 2, 11: 15, 7: 2}
Did not match all atoms present	68979-48-6	C1C(C1C(=O)N=[N+]=[N-])C(=O)N=[N+]=[N-]	{24: 2, 34: 4, 11: 1, 12: 2}
Did not match all atoms present	6898-43-7	CC1=CC2=C(C=C1C)N=C(N2)C[NH+](CCCl)CCCl.[Cl-]	{32: 1, 1: 2, 2: 5, 35: 1, 14: 2, 17: 3}
Did not match all atoms present	6898-84-6	CCC[S-].[Na+]	{1: 1, 2: 2}
Did not match all atoms present	68983-70-0	CC1=CC=C(C=C1)C2(CCCC2)C#N	{1: 1, 11: 4, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	68986-77-6	CCCCCCCCCCCC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 10, 3: 1, 14: 10}
Did not match all atoms present	68987-23-5	C1C(O1)COS(=O)(=O)[O-].[NH4+]	{2: 1, 11: 1, 12: 1, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	68987-26-8	CCCCCCCCC(=O)OCC(CC)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{1: 2, 2: 11, 4: 1, 14: 7, 20: 2, 27: 3, 28: 3}
Did not match all atoms present	68987-30-4	B(O)(O)OC1=CC=CC=C1.C=O	{22: 1, 20: 2, 5: 1, 14: 5}
Did not match all atoms present	68987-31-5	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 1, 4: 1, 6: 2, 11: 1, 12: 1, 14: 8, 17: 1, 21: 2, 23: 1, 27: 2}
Did not match all atoms present	68988-42-1	CC1=CC(=C(C=C1)O[P+](OC2=CC=CC=C2)(OC3=CC=CC=C3)OC4=CC=CC(=C4)C(C)C)C	{1: 4, 3: 1, 22: 4, 14: 17}
Did not match all atoms present	68988-43-2	CC1=CC=C(C=C1)O[P+](OC2=CC=CC=C2)(OC3=CC=CC=C3)OC4=CC=CC(=C4)C(C)C	{1: 3, 3: 1, 22: 4, 14: 18}
Did not match all atoms present	68988-44-3	CC1=CC=C(C=C1)O[P+](OC2=CC=CC=C2)(OC3=C(C=C(C=C3)C)C)OC4=CC=CC(=C4)C(C)C	{1: 5, 3: 1, 22: 4, 14: 16}
Did not match all atoms present	68988-58-9	CCCC[Sn](=O)CCCC.CCCO[Si](OCCC)(OCCC)OCCC	{1: 6, 2: 14, 29: 1, 22: 4}
Did not match all atoms present	68989-01-5	CCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-]	{1: 3, 2: 14, 35: 1, 14: 9, 15: 1, 29: 2}
Did not match all atoms present	68991-91-3	CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].C(CO)NCCO.[Na+].[Na+].[Na+].[Na+]	{1: 2, 2: 4, 34: 4, 14: 16, 20: 2, 24: 1, 29: 12, 31: 3}
Did not match all atoms present	68991-99-1	C1=CC=C(C(=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=C(C=C(C=C5)NC6=NC(=NC(=N6)NC7=CC(=CC=C7)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 1, 35: 6, 14: 14, 15: 2, 17: 2, 25: 1, 29: 15, 31: 5}
Did not match all atoms present	68992-02-9	C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)[O-])NC3=NC(=NC(=N3)N)Cl)N=NC4=C5C=CC(=CC5=C(C=C4)N=NC6=CC(=C7C=CC=C(C7=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 4, 35: 3, 14: 15, 17: 1, 29: 12, 30: 1, 31: 1}
Did not match all atoms present	68992-04-1	CC\1=C(C(=O)N(C(=O)/C1=N/NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)P(=O)(O)O)S(=O)(=O)[O-])CCC4=CC=C(C=C4)S(=O)(=O)[O-])C(=O)N.[Na+].[Na+]	{1: 1, 2: 2, 33: 1, 34: 3, 14: 11, 15: 3, 20: 2, 24: 1, 25: 2, 29: 7, 30: 1, 31: 1}
Did not match all atoms present	68992-05-2	CC1CCNC2=CC=CC=C12.C1=CC=C(C=C1)CC(=O)O	{32: 1, 1: 1, 2: 1, 11: 2, 12: 1, 14: 9, 27: 1}
Did not match all atoms present	68992-07-4	C1CS(=O)(=O)CC1N(CP(=O)(O)O)CP(=O)(O)O	{33: 1, 2: 2, 11: 3, 12: 1, 20: 4, 29: 4}
Did not match all atoms present	68992-10-9	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CC(=C)C(=O)O.CC(C1=CC=C(C=C1)OCC2OC2)(C3=CC=C(C=C3)OCC4OC4)C	{1: 5, 2: 26, 4: 1, 5: 1, 6: 8, 7: 1, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2, 27: 3}
Did not match all atoms present	68992-11-0	C1=CC=C2C(=C1)C3=CC=CC=C3P(=O)(O2)CC(CC(=O)OCCO)C(=O)OCCO.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CO)O	{2: 8, 3: 1, 14: 12, 20: 4, 23: 1, 27: 2, 28: 2, 29: 1}
Did not match all atoms present	68992-17-6	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.CN(C)CCO.C1C(O1)CCl.OP(=O)(O)O	{1: 4, 2: 3, 4: 1, 33: 1, 11: 1, 12: 1, 14: 8, 17: 1, 20: 4, 21: 2, 23: 1, 29: 1}
Did not match all atoms present	68992-19-8	CCC(CO)(CO)CO.CO[Si](C)(C1=CC=CC=C1)O[Si](C2=CC=CC=C2)(OC)O[Si](C)(C3=CC=CC=C3)OC	{1: 6, 2: 4, 4: 1, 14: 15, 20: 3, 22: 5}
Did not match all atoms present	68992-20-1	CC1=CC=CC=C1NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C(=C4[O-])N=NC5=CC(=C6C=CC=C(C6=C5[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{1: 1, 34: 2, 35: 3, 14: 11, 17: 1, 29: 12, 31: 2}
Did not match all atoms present	68994-94-5	C1=CC2=C(C=C1S(=O)(=O)[O-])NC(=N2)[S-].[Na+].[Na+]	{32: 1, 35: 1, 29: 3, 14: 3}
Did not match all atoms present	69-09-0	CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.Cl	{1: 2, 2: 3, 33: 2, 41: 1, 14: 7, 17: 2}
Did not match all atoms present	69-23-8	C1CN(CCN1CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO	{33: 3, 2: 5, 4: 1, 41: 1, 11: 4, 14: 7, 16: 3, 20: 1}
Did not match all atoms present	69-24-9	C=C[C@H]1CNCC[C@H]1CCC(=O)C2=CC=NC3=CC=CC=C23	{32: 1, 2: 2, 35: 1, 5: 1, 6: 1, 11: 3, 12: 2, 14: 6, 24: 1}
Did not match all atoms present	69-33-0	C1=CN(C2=C1C(=NC=N2)N)C3C(C(C(O3)CO)O)O	{33: 1, 2: 1, 35: 2, 12: 4, 14: 3, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	69-52-3	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)[O-])C.[Na+]	{1: 2, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 24: 2, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	69-53-4	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)O)C	{1: 2, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	69-57-8	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C.[Na+]	{1: 2, 2: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 24: 2, 25: 1, 31: 1}
Did not match all atoms present	69-72-7	C1=CC=C(C(=C1)C(=O)O)O	{27: 1, 21: 1, 14: 4}
Did not match all atoms present	69-74-9	C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O.Cl	{33: 1, 2: 1, 35: 1, 12: 4, 14: 2, 17: 1, 20: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	69-78-3	C1=CC(=C(C=C1SSC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O)[N+](=O)[O-]	{40: 2, 27: 2, 38: 2, 14: 6}
Did not match all atoms present	69-89-6	C1=NC2=C(N1)C(=O)NC(=O)N2	{32: 3, 25: 2, 35: 1, 14: 1}
Did not match all atoms present	69-93-2	C12=C(NC(=O)N1)NC(=O)NC2=O	{32: 4, 25: 3}
Did not match all atoms present	690-64-2	CC(C)OP(=O)(C)OC	{1: 4, 3: 1, 29: 1, 22: 2}
Did not match all atoms present	6900-35-2	CC(=C)C(=O)[O-].[K+]	{24: 1, 1: 1, 5: 1, 7: 1}
Did not match all atoms present	69005-97-6	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.Br[Ta]Br	{18: 2, 14: 10}
Did not match all atoms present	69008-24-8	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)NC3=CC(=C(C4=C3C(=O)C5=CC=CC=C5C4=O)N)S(=O)(=O)[O-].[Na+]	{1: 1, 14: 13, 25: 2, 29: 5, 30: 1, 31: 2}
Did not match all atoms present	69011-07-0	[O-][Si]([O-])([O-])[O-].[O-][Cr](=O)(=O)[O-].[Pb+2].[Pb+2].[Pb+2]	{29: 8}
Did not match all atoms present	69011-09-2	[O-2].[O-2].[O-2].[Co].[Zr]	{}
Did not match all atoms present	69011-11-6	C(=O)(O)O.OS(=O)(=O)[O-].[Na+]	{27: 2, 20: 1, 29: 3}
Did not match all atoms present	69011-13-8	CCCCCCOCCOP(=O)(O)OP(=O)(O)OP(=O)(O)O	{1: 1, 2: 7, 20: 4, 29: 3, 22: 4}
Did not match all atoms present	69013-32-7	CC1=CC=C(C=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)C6=NC7=C(S6)C=C(C=C7)C)Cl)S(=O)(=O)O)S(=O)(=O)OS(=O)(=O)O	{1: 2, 34: 1, 35: 4, 41: 1, 14: 14, 15: 2, 17: 1, 20: 2, 22: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	69013-34-9	CN(CCOP(=O)(O)O)S(=O)(=O)C1=CC=C(C=C1)OC(=C(C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F	{1: 1, 2: 2, 4: 8, 33: 1, 7: 2, 14: 4, 16: 19, 20: 2, 22: 2, 29: 3}
Did not match all atoms present	69013-35-0	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC3=[N+](C4=C(C=CC(=C4)NC5=C(C=C(C=C5)NC6=NC(=NC(=N6)NC7=CC(=CC=C7)P(=O)(O)O)Cl)S(=O)(=O)[O-])N=C3C=C2)C8=CC(=C(C=C8)OC)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 2, 35: 4, 33: 2, 14: 20, 17: 1, 20: 2, 22: 1, 29: 10, 31: 3}
Did not match all atoms present	69020-17-3	CC1=C(C(=C(C(=C1C[Si](C)(C)C)C)C)C[Si](C)(C)C)C	{1: 10, 2: 2}
Did not match all atoms present	69020-18-4	CC1=C(C(=C(C(=C1C[Si](C)(C)C)C)C[Si](C)(C)C)C)C[Si](C)(C)C	{1: 12, 2: 3}
Did not match all atoms present	69020-19-5	CC1=CC(=C(C=C1C[Si](C)(C)C)C)C[Si](C)(C)C	{1: 8, 2: 2, 14: 2}
Did not match all atoms present	69020-20-8	C[Si]1(CC2=CC3=C(C[Si](C3)(C)C)C=C2C1)C	{1: 4, 11: 4, 14: 2}
Did not match all atoms present	69021-86-9	CC(C)[C-]1C=CC=C1.CC(C)[C-]1C=CC=C1.CC(C)[C-]1C=CC=C1.[Pr]	{1: 6, 3: 3, 14: 12}
Did not match all atoms present	69022-76-0	CC1=CC2=C(O1)C=NC=C2	{1: 1, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	69029-23-8	CCCCCCCCCCCC(=O)OC(=O)CCC(=O)O.C=CCO.C=CC1=CC=CC=C1	{1: 1, 2: 13, 5: 2, 6: 2, 14: 5, 20: 1, 27: 1, 28: 2}
Did not match all atoms present	69029-30-7	CC/C=C/C/C=C/C/C=C/CCCCCCCC(=O)O.CO[Si](C)(C1=CC=CC=C1)O[Si](C2=CC=CC=C2)(OC)O[Si](C)(C3=CC=CC=C3)OC.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(C(CO)O)O	{1: 6, 2: 12, 3: 1, 6: 6, 14: 19, 20: 3, 22: 5, 27: 3}
Did not match all atoms present	69029-31-8	CCCCCCCCC(=O)OC(=O)C1=CC=C(C=C1)C(C)(C)C.CC(CO)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(CCCC(=O)O)CCCC(=O)O	{1: 5, 2: 17, 4: 2, 14: 8, 20: 3, 27: 2, 28: 4}
Did not match all atoms present	69029-40-9	B(O)(O)O.CC(=CCC/C(=C/CO)/C)C	{1: 3, 2: 3, 20: 4, 6: 2, 7: 2}
Did not match all atoms present	69029-41-0	CCCCCCCCCCOP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 9, 29: 7, 22: 3}
Did not match all atoms present	69032-03-7	CC[Sn]1(SCC(S1)C)CC	{1: 3, 2: 2, 11: 1, 12: 1, 41: 2}
Did not match all atoms present	69034-13-5	CCOC(COC1=CC=C(C=C1)OC)OCC	{1: 3, 2: 3, 3: 1, 22: 4, 14: 4}
Did not match all atoms present	69038-81-9	CCOC1=CC=CC=C1C=CC(=O)O	{1: 1, 2: 1, 6: 2, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	69040-51-3	CCCCOC(=O)C(=C)C.CC(C)COC(=O)C(=C)C.C=CC1=CC=CC=C1	{1: 5, 2: 4, 3: 1, 5: 3, 6: 1, 7: 2, 14: 5, 28: 2}
Did not match all atoms present	69040-58-0	CC(C)(CCC(C)(C)OO)OO.CC(C)(C1=CC=C(C=C1)C(C)(C)O)O	{1: 8, 2: 2, 4: 4, 14: 4, 20: 4, 22: 2}
Did not match all atoms present	69040-60-4	CC(C)(CCC(C)(C)OO)OO.CC(C)(C1=CC(=CC=C1)C(C)(C)O)O	{1: 8, 2: 2, 4: 4, 14: 4, 20: 4, 22: 2}
Did not match all atoms present	69043-96-5	CCCCCCC(C)OC(=O)C1=CC=CC=C1C(=O)O.C1=CC=C(C=C1)OCCOC(=O)C2=CC=CC=C2C(=O)O	{1: 2, 2: 7, 3: 1, 14: 13, 22: 1, 27: 2, 28: 2}
Did not match all atoms present	69045-78-9	C1=CC(=NC=C1C(Cl)(Cl)Cl)Cl	{17: 4, 35: 1, 4: 1, 14: 3}
Did not match all atoms present	69045-84-7	C1=C(C=NC(=C1Cl)Cl)C(F)(F)F	{16: 3, 17: 2, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	6906-25-8	CC1=CC=CC(=C1)C=NC2=CC=CC=C2	{1: 1, 34: 1, 14: 9, 6: 1}
Did not match all atoms present	6907-59-1	C1=CC=C(C=C1)CC2=NC=CC3=CC=CC=C32	{2: 1, 35: 1, 14: 11}
Did not match all atoms present	69070-57-1	CCCCC/C=C/C/C=C/CCCCCCCC(=O)OCC(CC)(CO)COC(=O)C1=CC=CC=C1.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 2, 2: 16, 4: 1, 6: 4, 14: 9, 20: 1, 27: 2, 28: 2}
Did not match all atoms present	69070-59-3	CCCCOCCOCCOP(=O)(O)OP(=O)(O)OP(=O)(O)O	{1: 1, 2: 7, 20: 4, 29: 3, 22: 5}
Did not match all atoms present	69070-62-8	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=C=O)C)N=C=O.C1CCC(=O)OCC1.C(CCO)CO	{1: 2, 2: 4, 8: 2, 11: 5, 34: 2, 14: 6, 20: 2, 28: 1, 29: 2}
Did not match all atoms present	6908-41-4	COC(=O)C1=CC=C(C=C1)CO	{1: 1, 2: 1, 20: 1, 14: 4, 28: 1}
Did not match all atoms present	69088-96-6	CC(C)(C#CC1=CC(=CC=C1)N)O	{1: 2, 4: 1, 10: 2, 14: 4, 20: 1, 30: 1}
Did not match all atoms present	69089-42-5	CCCCCCCC(C)(C)C(C)(C)OCCC[N+](C)(C)CCC[N+](C)(C)C.[Cl-].[Cl-]	{1: 10, 2: 12, 4: 2, 22: 1, 17: 2}
Did not match all atoms present	6909-93-9	CC1=CC(=NC=C1N)N	{1: 1, 35: 1, 30: 2, 14: 2}
Did not match all atoms present	69093-18-1	CC(C)NC1=C2C(=C(C=C1)O)C(=O)C3=C(C=CC(=C3C2=O)O)N	{1: 2, 3: 1, 14: 4, 21: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	69094-37-7	C1=CC2=C(C(=O)SC2=O)N=C1	{25: 2, 35: 1, 14: 3, 41: 1}
Did not match all atoms present	69095-72-3	CC1=CC=CC=C1C2=NC(=NN2)C3=CC(=CC=C3)OC	{32: 1, 1: 2, 35: 2, 22: 1, 14: 8}
Did not match all atoms present	69095-74-5	CC1=CC=CC=C1C2=NC(=NN2)C3=CC=CC=C3Cl	{32: 1, 1: 1, 35: 2, 14: 8, 17: 1}
Did not match all atoms present	69095-83-6	CCC1=CC=CC(=C1)C2=NNC(=N2)C3=CC(=CC=C3)OC	{32: 1, 1: 2, 2: 1, 35: 2, 14: 8, 22: 1}
Did not match all atoms present	69097-20-7	C[Si](C)(C)OC=C(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 22: 3, 6: 1, 7: 1}
Did not match all atoms present	691-35-0	C[As](C)CC=C	{1: 2, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	691-88-3	CCC(C)[Hg]C(C)CC	{1: 4, 2: 2, 3: 2}
Did not match all atoms present	69102-79-0	O.O.O.O.[O-]S(=O)(=O)[O-].[Pt+2]	{29: 4}
Did not match all atoms present	69102-85-8	B([O-])([O-])[O-].[NH4+].[NH4+].[NH4+].[O-]P(=O)([O-])[O-].[Na+].[Na+].[Na+]	{29: 7}
Did not match all atoms present	69102-93-8	CCCCC/C(=C\C1=CC=CC=C1)/C=O.CC(CCCC(C)(C)O)CC=O.C1=CC=C2C(=C1)C=CN2	{32: 1, 1: 4, 2: 8, 3: 1, 4: 1, 6: 1, 7: 1, 14: 11, 20: 1, 26: 2}
Did not match all atoms present	69103-22-6	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NC=[N+](N3C)C.CC(=O)[O-]	{1: 4, 2: 2, 35: 1, 33: 3, 34: 2, 14: 10, 24: 1}
Did not match all atoms present	69103-84-0	[2H][Si]([2H])[2H]	{}
Did not match all atoms present	69103-91-9	CC1=C(OC2=C(C1=O)C=CC(=C2)OC)CCCN3CCN(CC3)C4=CC=CC=C4OC	{1: 3, 2: 3, 33: 2, 11: 4, 14: 7, 22: 2, 23: 1, 25: 1}
Did not match all atoms present	69103-95-3	CC1=C(OC2=CC=CC=C2C1=O)CCCN3CCN(CC3)C4=CC=CC=C4	{1: 1, 2: 3, 33: 2, 11: 4, 14: 9, 23: 1, 25: 1}
Did not match all atoms present	69103-96-4	CC1=C(OC2=C(C1=O)C=CC(=C2)F)CCCN3CCC(CC3)(C4=CC=C(C=C4)Cl)O	{1: 1, 2: 3, 33: 1, 11: 4, 13: 1, 14: 7, 16: 1, 17: 1, 20: 1, 23: 1, 25: 1}
Did not match all atoms present	69103-97-5	CC1=C(OC2=C(C1=O)C=CC(=C2)F)CCCN3CCN(CC3)C4=CC=CC=C4	{1: 1, 2: 3, 33: 2, 11: 4, 14: 8, 16: 1, 23: 1, 25: 1}
Did not match all atoms present	6911-51-9	C1=CSC(=C1)SSC2=CC=CS2	{40: 2, 41: 2, 14: 6}
Did not match all atoms present	69112-87-4	CCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.C1=CC(=CC=C1C(=O)[O-])N	{24: 1, 1: 3, 2: 18, 30: 1, 14: 9}
Did not match all atoms present	69113-59-3	C1=CC(=CC(=C1)I)C#N	{19: 1, 37: 1, 14: 4}
Did not match all atoms present	69119-80-8	COC1=C(C(=C(C=C1)C(=O)C2=CC=CC=C2)O)CC3=C(C=CC(=C3O)C(=O)C4=CC=CC=C4)OC	{1: 2, 2: 1, 14: 14, 21: 2, 22: 2, 24: 2}
Did not match all atoms present	69121-15-9	CC1=CC(=CC(=C1N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 1, 35: 2, 14: 6, 15: 2, 16: 2, 17: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	69121-21-7	C1=C(C(=CC(=C1Cl)S(=O)(=O)[O-])Cl)[N+]#N	{17: 2, 34: 1, 29: 3, 14: 2}
Did not match all atoms present	69121-22-8	CC(CN(CC(C)O)CC(C)O)O.C1=CC=C(C=C1)C(=O)O	{1: 3, 2: 3, 3: 3, 33: 1, 14: 5, 20: 3, 27: 1}
Did not match all atoms present	69121-23-9	CC1=C(C=CC(=C1)S(=O)(=O)[O-])N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 14: 17, 15: 4, 24: 1, 25: 2, 29: 12, 31: 4}
Did not match all atoms present	69121-24-0	C1=CC2=C(C(=C(C=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC3=CC(=CC(=C3[O-])NC4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Cu+2]	{34: 2, 35: 2, 14: 6, 16: 2, 17: 1, 29: 9, 31: 1}
Did not match all atoms present	69121-26-2	[Li+].CC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)Br)S(=O)(=O)[O-]	{1: 1, 14: 8, 18: 1, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	69123-95-1	C.C.CCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 4, 3: 1}
Did not match all atoms present	6913-13-9	CSC1=NSC(=N1)N	{40: 1, 1: 1, 35: 2, 30: 1, 41: 1}
Did not match all atoms present	6913-92-4	C1C=CCN1CC2=CC=CC=C2	{33: 1, 2: 1, 11: 2, 14: 7}
Did not match all atoms present	6914-07-4	[C-]#[NH+]	{36: 1}
Did not match all atoms present	6914-63-2	B(C)(N(C)C)N(C)C	{1: 5, 33: 2}
Did not match all atoms present	6914-90-5	CC(C)OS(=O)(=O)O	{1: 2, 3: 1, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	69140-59-6	CC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].[K+].[K+].[Co+2]	{1: 1, 4: 1, 29: 6, 20: 1}
Did not match all atoms present	69140-60-9	CC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+].[Co+2]	{1: 1, 4: 1, 29: 6, 20: 1}
Did not match all atoms present	69140-61-0	CC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].[K+].[K+].[Cu+2]	{1: 1, 4: 1, 29: 6, 20: 1}
Did not match all atoms present	69140-63-2	C1=CC(=C(C=C1NC2=C(C(=NC(=N2)F)F)Cl)N=NC3=C(C=C4C=C(/C(=N/NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 3, 35: 2, 14: 8, 15: 2, 16: 2, 17: 1, 25: 1, 29: 15, 30: 1, 31: 2}
Did not match all atoms present	69140-64-3	CC(C)CCCCCOC(=O)C[S-].[Cl-].[Pt+2]	{1: 2, 2: 6, 3: 1, 28: 1, 17: 1}
Did not match all atoms present	69155-42-6	C[Si](C)(C)O[Si](C)(CCCOCC1CO1)O[Si](C)(CCCOCC2CO2)O[Si](C)(C)C	{1: 8, 2: 8, 11: 2, 12: 2, 22: 5, 23: 2}
Did not match all atoms present	69163-06-0	CN(C)C1=CC=C(C2=CC=CC=C21)N=NC3=CC=C(C=C3)N=NC4=CC=C(C=C4)N=NC5=CC=C(C6=CC=CC=C65)N(C)C	{1: 4, 34: 6, 14: 20, 33: 2}
Did not match all atoms present	6917-76-6	CC[Si](C)(C)Cl	{1: 3, 2: 1, 17: 1}
Did not match all atoms present	69178-34-3	CC(O)(P(=O)(O)[O-])P(=O)(O)[O-].N.N.[Co+2]	{1: 1, 4: 1, 29: 4, 20: 3}
Did not match all atoms present	69178-37-6	C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 1, 35: 2, 6: 2, 38: 1, 14: 11, 29: 9}
Did not match all atoms present	69178-38-7	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C\3/C(=CC4=CC(=C(C=C4C3=O)N=NC5=C(C=C(C=C5)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 3, 14: 12, 15: 2, 25: 1, 29: 9, 30: 2, 31: 1}
Did not match all atoms present	69178-41-2	CCC1=CC=CC=C1N.C=O	{1: 1, 2: 1, 30: 1, 5: 1, 14: 4}
Did not match all atoms present	69178-42-3	CC(=O)/C(=N/NC1=C(C=CC(=C1)S(=O)(=O)NC)[O-])/C(=NC2=CC=CC=C2)[O-].CC(=O)/C(=N/NC1=C(C=CC(=C1)S(=O)(=O)NC)[O-])/C(=NC2=CC=CC=C2)[O-].[Co]	{1: 4, 34: 4, 7: 4, 14: 16, 24: 2, 29: 4, 31: 4}
Did not match all atoms present	69180-50-3	CC(=O)OI(C1=CC=CC(=C1)OC)OC(=O)C	{1: 3, 19: 1, 28: 2, 22: 1, 14: 4}
Did not match all atoms present	69180-59-2	CC1=CC=C(C=C1)I=O	{1: 1, 19: 1, 29: 1, 14: 4}
Did not match all atoms present	6919-61-5	CN(C(=O)C1=CC=CC=C1)OC	{24: 1, 1: 2, 22: 1, 14: 5, 33: 1}
Did not match all atoms present	69198-43-2	CC1=CC(=CC(=C1)P(C2=CC(=CC(=C2)C)C)C3=CC(=CC(=C3)C)C)C.CC1=CC(=CC(=C1)P(C2=CC(=CC(=C2)C)C)C3=CC(=CC(=C3)C)C)C.[Co+2].[Br-].[Br-]	{1: 12, 18: 2, 14: 18}
Did not match all atoms present	69199-05-9	CC1=C2C=C(C=C(C2=NC=C1)NCCCCCN)OC	{1: 2, 2: 5, 35: 1, 14: 4, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	692-42-2	CC[As]CC	{1: 2, 2: 2}
Did not match all atoms present	692-45-5	C=COC=O	{26: 1, 5: 1, 6: 1}
Did not match all atoms present	692-56-8	C[Si](C)(C)NN[Si](C)(C)C	{1: 6, 31: 2}
Did not match all atoms present	692-95-5	CCCCC[As](Cl)Cl	{1: 1, 2: 4, 17: 2}
Did not match all atoms present	69205-10-3	CC1=CC=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=CC=C6OC)/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 14: 16, 15: 4, 22: 1, 24: 1, 25: 2, 29: 6, 31: 4}
Did not match all atoms present	69205-13-6	CCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 11, 14: 5, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	69209-20-7	C[Si](C)(C)CSC1=CC=C(C=C1)SC[Si](C)(C)C	{40: 2, 1: 6, 2: 2, 14: 4}
Did not match all atoms present	6921-26-2	C1=CC=C2C(=C1)C(=CC=C2[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 6}
Did not match all atoms present	6921-34-2	[CH2-]C1=CC=CC=C1.[Mg+2].[Cl-]	{17: 1, 5: 1, 14: 5}
Did not match all atoms present	6921-43-3	CC1=CC=C(C=C1)C2CC2	{1: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	6921-64-8	CC1=CC(=C(C=C1)C(=O)C)O	{24: 1, 1: 2, 21: 1, 14: 3}
Did not match all atoms present	6921-83-1	CC1=CC=C(C=C1)C2=CC(=S)SS2	{1: 1, 14: 5, 41: 2}
Did not match all atoms present	6922-60-7	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)COCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C	{1: 12, 2: 2, 4: 4, 14: 4, 21: 2, 22: 1}
Did not match all atoms present	69226-39-7	CC1=C(C=CC(=C1)N)S(=O)(=O)NCCO	{1: 1, 2: 2, 14: 3, 20: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	69226-43-3	CCCCCCCCCCCC(=O)OC(=O)CS[Sn](CCCCCCCC)(CCCCCCCC)SCC(=O)OC(=O)CCCCCCCCCCC	{40: 2, 1: 4, 2: 36, 28: 4}
Did not match all atoms present	69226-44-4	CCCCCCCC[Sn]1(SCC(=O)OCCOC(=O)CS1)CCCCCCCC	{1: 2, 2: 14, 11: 4, 28: 2, 41: 2}
Did not match all atoms present	69226-45-5	CCCCCCCC[Sn]1(OC(=O)/C=C\C(=O)OCC(OC(=O)/C=C\C(=O)O1)C)CCCCCCCC	{1: 3, 2: 14, 11: 1, 12: 1, 14: 4, 28: 4}
Did not match all atoms present	69226-46-6	CCCCCCCC[Sn]1(SCC(=O)OCCCCOC(=O)CS1)CCCCCCCC	{1: 2, 2: 14, 11: 6, 28: 2, 41: 2}
Did not match all atoms present	69227-25-4	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.CC(CN(CC(C)O)CC(C)O)O.CC(CN(CC(C)O)C(=N)C(C)O)O	{1: 7, 2: 16, 3: 6, 36: 1, 33: 2, 7: 1, 14: 4, 20: 7, 29: 2}
Did not match all atoms present	69227-26-5	CCO[Si](CCCN=CC1=CC=CC=C1)(OCC)OCC	{1: 3, 34: 1, 6: 1, 2: 6, 14: 5, 22: 3}
Did not match all atoms present	69227-47-0	CC1=CC(=CC(=C1)P(C2=CC(=CC(=C2)C)C)C3=CC(=CC(=C3)C)C)C	{1: 6, 14: 9}
Did not match all atoms present	69227-51-6	CC[N+]1(CCCC1)C.[Br-]	{1: 2, 2: 1, 11: 4, 18: 1}
Did not match all atoms present	6923-52-0	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Sb+3]	{24: 3, 1: 3}
Did not match all atoms present	69235-02-5	[Li].[Li+].[Li+].[OH-]	{}
Did not match all atoms present	69238-83-1	C1CC=CC(C1)[Si](Cl)Cl	{17: 2, 11: 3, 12: 1, 14: 2}
Did not match all atoms present	69238-84-2	C1CC(CC=C1)[Si](Cl)Cl	{17: 2, 11: 3, 12: 1, 14: 2}
Did not match all atoms present	69238-89-7	C1CC(CC=C1)CC[Si](Cl)Cl	{17: 2, 2: 2, 11: 3, 12: 1, 14: 2}
Did not match all atoms present	69238-91-1	C1CC2CCC1[Si]2(Cl)Cl	{17: 2, 11: 4, 12: 2}
Did not match all atoms present	69238-92-2	C[Si]1(C2CCC1CC2)C	{1: 2, 11: 4, 12: 2}
Did not match all atoms present	69239-37-8	CCCCCCCCCCCCCCOC(=O)/C=C\C(=O)O[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)/C=C\C(=O)OCCCCCCCCC	{1: 4, 2: 35, 28: 4, 6: 4}
Did not match all atoms present	69242-96-2	CCCS(=O)(=O)NC1=CC(=C(C=C1)[NH2+]C2=C3C=CC=C(C3=NC4=CC=CC=C42)C(=O)N)OC.[Cl-]	{1: 2, 2: 2, 35: 1, 14: 10, 17: 1, 22: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	6925-42-4	CCCC(CC)C1=CC=C(C=C1)O	{1: 2, 2: 3, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	6925-48-0	C1=CC(=CC=C1C(=O)O)N=NC2=CC=C(C=C2)N	{34: 2, 27: 1, 30: 1, 14: 8}
Did not match all atoms present	69256-63-9	CCCCCCCCCC(CCCCCCCC(=O)O)OS(=O)(=O)O.C(CO)NCCO.C(CO)NCCO	{1: 1, 2: 23, 3: 1, 20: 5, 22: 1, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	6926-45-0	CCCCCCN=[N+]=[N-]	{1: 1, 2: 5, 34: 2}
Did not match all atoms present	6926-58-5	CN(C)C(=S)NN	{1: 2, 31: 1, 33: 1, 30: 1, 7: 1}
Did not match all atoms present	69260-83-9	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)CO)C=C[C@H]([C@@H]3O)O	{1: 1, 2: 1, 12: 2, 14: 8, 20: 3}
Did not match all atoms present	69260-85-1	C1=CC=C2C(=C1)C(=C3C=CC4=C(C3=C2CO)C=C[C@H]([C@@H]4O)O)CO	{20: 4, 2: 2, 12: 2, 14: 8}
Did not match all atoms present	69267-51-2	C1=CC=C2C(=C1)C=CC3=C2C=C(O3)[N+](=O)[O-]	{38: 1, 14: 7, 23: 1}
Did not match all atoms present	69278-36-0	CC(C)(C(=C)O[Si](C)(C)C)Br	{1: 5, 4: 1, 5: 1, 7: 1, 18: 1, 22: 1}
Did not match all atoms present	69278-53-1	CC(=O)N[C@@H](CSC(CO)C1=CC=CC=C1)C(=O)O	{1: 1, 2: 2, 3: 2, 40: 1, 14: 5, 20: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	69279-00-1	CCC(C)(C)C1=C(C=C(C(=C1)S)C)O	{1: 4, 2: 1, 4: 1, 39: 1, 14: 2, 21: 1}
Did not match all atoms present	6928-42-3	C(=N[GeH3])=O	{8: 1, 34: 1, 29: 1}
Did not match all atoms present	69286-06-2	CC1=C(N=C(N1)C2=NC(=C(N2)C)C)C	{32: 2, 1: 4, 35: 2}
Did not match all atoms present	69287-13-4	CCCCCCC(=O)C1=CC=C(C=C1)OC	{24: 1, 1: 2, 2: 5, 22: 1, 14: 4}
Did not match all atoms present	69293-81-8	CNC1=CC=C(C2=CC=CC=C21)N=NC3=CC=C(C=C3)N=NC4=CC=C(C=C4)N=NC5=CC=C(C6=CC=CC=C65)NC	{1: 2, 34: 6, 14: 20, 31: 2}
Did not match all atoms present	69293-82-9	CCNC1=CC=C(C2=CC=CC=C21)N=NC3=CC=C(C=C3)N=NC4=CC=C(C=C4)N=NC5=CC=C(C6=CC=CC=C65)NCC	{1: 2, 2: 2, 34: 6, 14: 20, 31: 2}
Did not match all atoms present	69298-66-4	CC1=NN(C=CC=C1)C(=O)C2=CC=CC=C2	{1: 1, 35: 1, 33: 1, 14: 9, 15: 1, 24: 1}
Did not match all atoms present	693-21-0	C(CO[N+](=O)[O-])OCCO[N+](=O)[O-]	{2: 4, 22: 3}
Did not match all atoms present	693-25-4	CCCC[CH2-].[Mg+2].[Br-]	{1: 1, 2: 3, 18: 1, 5: 1}
Did not match all atoms present	693-33-4	CCCCCCCCCCCCCCCC[N+](C)(C)CC(=O)[O-]	{24: 1, 1: 3, 2: 16}
Did not match all atoms present	693-90-3	CC1=CSN=C1	{1: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	693-92-5	CC1=NSC=C1	{1: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	693-93-6	CC1=COC=N1	{1: 1, 35: 1, 14: 2, 23: 1}
Did not match all atoms present	693-95-8	CC1=CSC=N1	{1: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	693-97-0	CC1=CC=NS1	{1: 1, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	693-98-1	CC1=NC=CN1	{32: 1, 1: 1, 35: 1, 14: 2}
Did not match all atoms present	69304-37-6	CC(C)[Si](C(C)C)(O[Si](C(C)C)(C(C)C)Cl)Cl	{1: 8, 3: 4, 22: 1, 17: 2}
Did not match all atoms present	69304-47-8	C1C(C(OC1N2C=C(C(=O)NC2=O)C=CBr)CO)O	{32: 1, 33: 1, 2: 1, 6: 2, 11: 1, 12: 3, 14: 1, 18: 1, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	6931-16-4	COC1=NC2=CC=CC=C2C=C1	{1: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	69316-08-1	COC(=O)C1=CC=C(C=C1)C(=O)CC#N	{1: 1, 2: 1, 37: 1, 14: 4, 24: 1, 28: 1}
Did not match all atoms present	69320-67-8	CN(C[Si](C)(C)C)C[Si](C)(C)C	{1: 7, 2: 2, 33: 1}
Did not match all atoms present	69320-68-9	CN1C[Si](C[Si](C1)(C)C)(C)C	{1: 5, 11: 3, 33: 1}
Did not match all atoms present	69321-17-1	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC(=C2)C=O	{1: 2, 26: 1, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	69321-60-4	CC1=C(C=CC=C1Br)Br	{1: 1, 18: 2, 14: 3}
Did not match all atoms present	69327-76-0	CC(C)N1C(=NC(C)(C)C)SCN(C1=O)C2=CC=CC=C2	{1: 5, 34: 1, 3: 1, 4: 1, 33: 2, 41: 1, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	6933-10-4	CC1=C(C=CC(=C1)N)Br	{1: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	6933-90-0	CC(C)NCC(C1=CC=CC=C1Cl)O.Cl	{1: 2, 2: 1, 3: 2, 14: 4, 17: 2, 20: 1, 31: 1}
Did not match all atoms present	69331-28-8	CCCCCCCCCCCCS.C=CC(=O)O.C(=C/[NH3+])\C#N	{1: 1, 2: 11, 5: 1, 6: 3, 39: 1, 27: 1, 37: 1}
Did not match all atoms present	69342-47-8	CCCCC1=CC=C(C=C1)N=C=O	{1: 1, 2: 3, 8: 1, 34: 1, 14: 4, 29: 1}
Did not match all atoms present	6935-06-4	CN(C)C(=O)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 28: 1, 33: 1, 14: 2, 17: 3}
Did not match all atoms present	6935-27-9	C1=CC=C(C=C1)CNC2=CC=CC=N2	{2: 1, 35: 1, 14: 9, 31: 1}
Did not match all atoms present	6935-29-1	C1=CC=C2C(=C1)N=CC=[N+]2[O-]	{33: 1, 35: 1, 29: 1, 14: 6}
Did not match all atoms present	6935-63-3	C1=CC(=CC=C1C=CC2=CC=C(C=C2)C(=N)N)C(=N)N	{30: 2, 36: 2, 14: 8, 6: 2, 7: 2}
Did not match all atoms present	6935-65-5	CC1=CC=CC(=C1)C(=O)N(C)C	{24: 1, 1: 3, 14: 4, 33: 1}
Did not match all atoms present	69352-40-5	C1C(CC2=CC=CC=C21)CCC(=O)OC(=O)N	{2: 2, 11: 2, 12: 1, 14: 4, 28: 2, 30: 1}
Did not match all atoms present	69352-67-6	COC1=CC=CC=C1C23CN4CC(C2=O)(CN(C3)C4)C5=CC=CC=C5OC	{1: 2, 33: 2, 11: 5, 13: 2, 14: 8, 22: 2, 25: 1}
Did not match all atoms present	69357-10-4	CCCCCOC(=O)C(C1=CC=CC=C1)[NH3+].[Cl-]	{1: 1, 2: 4, 3: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	69357-11-5	CCCCCCOC(=O)C(C1=CC=CC=C1)[NH3+].[Cl-]	{1: 1, 2: 5, 3: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	69357-13-7	CCCCCCCCOC(=O)C(C1=CC=CC=C1)[NH3+].[Cl-]	{1: 1, 2: 7, 3: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	69357-14-8	CCCCCCCCCOC(=O)C(C1=CC=CC=C1)[NH3+].[Cl-]	{1: 1, 2: 8, 3: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	6936-40-9	COC1=C(C(=CC(=C1Cl)Cl)Cl)Cl	{1: 1, 22: 1, 14: 1, 17: 4}
Did not match all atoms present	69360-26-5	C1=CC=C(C(=C1)C#N)S(=O)(=O)Cl	{17: 1, 29: 2, 14: 4, 37: 1}
Did not match all atoms present	69365-68-0	CC(=S)NC1=[NH+]C2=CC=CC=C2C=C1.[Cl-]	{32: 1, 1: 1, 7: 1, 14: 6, 17: 1, 31: 1}
Did not match all atoms present	69367-40-4	CCOC1=C(C=CC(=C1)C2OCC(CO2)(C)C)O	{1: 3, 2: 1, 11: 2, 12: 1, 13: 1, 14: 3, 21: 1, 22: 1, 23: 2}
Did not match all atoms present	6937-66-2	CN1C2=C(N=C1[Hg]C3=NC4=C(N3C)C(=O)N(C(=O)N4C)C)N(C(=O)N(C2=O)C)C	{1: 6, 35: 2, 33: 6, 25: 4}
Did not match all atoms present	69371-59-1	CC(=O)CCC=CC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 14: 5, 6: 2}
Did not match all atoms present	69375-11-7	CC(C)C1=CC(=CC(=C1)C2=CC=CC=C2)C(C)C	{1: 4, 3: 2, 14: 8}
Did not match all atoms present	69377-81-7	C(C(=O)O)OC1=NC(=C(C(=C1Cl)N)Cl)F	{2: 1, 35: 1, 16: 1, 17: 2, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	6938-06-3	CCCCOC(=O)C1=CN=CC=C1	{1: 1, 2: 3, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	6938-45-0	CCCCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 5, 28: 1, 14: 5}
Did not match all atoms present	6938-46-1	CCCCCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 4, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	69381-94-8	COC(=O)CCC=C=CC[C@H]1[C@H](C[C@H](C1/C=C/[C@H](COC2=CC=CC=C2)O)O)O	{1: 1, 2: 4, 3: 1, 6: 4, 8: 1, 11: 1, 12: 4, 14: 5, 20: 3, 22: 1, 28: 1}
Did not match all atoms present	69385-30-4	C1=CC(=C(C(=C1)F)CN)F	{16: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	69386-90-9	C1=CC=C2C(=C1)C=CC=C2C=NC3=CC=C(C=C3)N=NC4=CC=C(C=C4)N=CC5=CC=CC6=CC=CC=C65	{34: 4, 14: 22, 6: 2}
Did not match all atoms present	69388-84-7	CC1([C@@H](N2[C@H](S1(=O)=O)CC2=O)C(=O)[O-])C.[Na+]	{1: 2, 33: 1, 11: 1, 12: 2, 13: 1, 24: 1, 25: 1, 29: 2}
Did not match all atoms present	6939-12-4	C[N+]1=NOC(=C1)[O-]	{1: 1, 35: 1, 33: 1, 14: 1, 23: 1}
Did not match all atoms present	6939-30-6	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)N/N=C/3\C(=NC=N3)C(=O)N	{33: 1, 2: 2, 35: 2, 34: 1, 14: 11, 15: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6939-75-9	CC(=O)CCC(=O)OCC1=CC=CC=C1	{24: 1, 1: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	6939-89-5	C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)[O-].[NH4+]	{27: 1, 29: 3, 14: 4}
Did not match all atoms present	6939-93-1	C1=CC(=C(C=C1C(=O)O)C(=O)O)Br	{18: 1, 27: 2, 14: 3}
Did not match all atoms present	6939-99-7	C1CC[C@@H]([C@@H](C1)C(=O)C2=CC=CC=C2)C(=O)O	{24: 1, 27: 1, 11: 4, 12: 2, 14: 5}
Did not match all atoms present	694-31-5	CC1=CC=NN1C	{1: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	694-48-4	CC1=NN(C=C1)C	{1: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	694-52-0	C1=CN=CC=C1F	{16: 1, 35: 1, 14: 4}
Did not match all atoms present	694-53-1	C1=CC=C(C=C1)[Si]	{14: 5}
Did not match all atoms present	694-80-4	C1=CC=C(C(=C1)Cl)Br	{17: 1, 18: 1, 14: 4}
Did not match all atoms present	694-87-1	C1CC2=CC=CC=C21	{11: 2, 14: 4}
Did not match all atoms present	6940-31-4	CC(C)(C1=CC=C(C=C1)OCC(CN(CC=C)CC=C)O)C2=CC=C(C=C2)OCC(CN(CC=C)CC=C)O	{1: 2, 2: 8, 3: 2, 4: 1, 5: 4, 6: 4, 33: 2, 14: 8, 20: 2, 22: 2}
Did not match all atoms present	6940-49-4	C1=CC=C2C(=C1)C(OC2=O)Br	{28: 1, 18: 1, 12: 1, 14: 4}
Did not match all atoms present	6940-50-7	C1=CC(=CC=C1C(C(=O)O)O)Br	{27: 1, 18: 1, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	6940-53-0	COC1=CC(=C(C=C1[N+](=O)[O-])OC)Cl	{1: 2, 38: 1, 22: 2, 14: 2, 17: 1}
Did not match all atoms present	6940-57-4	CC1=CC=CC(=N1)C(=O)C	{24: 1, 1: 2, 35: 1, 14: 3}
Did not match all atoms present	6940-81-4	CC(CO)NCC1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	6940-96-1	CCCCCCCCCCCCOC1=CC=C(C=C1)C(C)(C)C	{1: 4, 2: 11, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	69402-04-6	B1(C(=O)/C(=C\N(/C=C(\C1=O)/C)CCN/2/C=C(\C(=O)B(C(=O)/C(=C2)/C)OCCCC)/C)/C)OCCCC	{1: 6, 2: 8, 33: 2, 14: 4, 15: 4, 22: 2, 25: 4}
Did not match all atoms present	69408-81-7	CN(C)CCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)N	{1: 2, 2: 2, 33: 2, 14: 5, 25: 2, 30: 1}
Did not match all atoms present	69409-94-5	CC(C)C(C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl	{1: 2, 3: 3, 4: 1, 37: 1, 14: 12, 16: 3, 17: 1, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	69409-98-9	C1=CC(=C(C=C1C(F)(F)F)F)N	{16: 4, 4: 1, 30: 1, 14: 3}
Did not match all atoms present	6942-39-8	COC(=O)C1=C(C=CC(=C1)F)Br	{16: 1, 1: 1, 18: 1, 28: 1, 14: 3}
Did not match all atoms present	6942-75-2	CC(C)CCOC(=O)C1=CC=C(C=C1)Cl	{1: 2, 2: 2, 3: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	6942-99-0	CC1=CC(=C(C(=C1Br)C)Br)C	{1: 3, 18: 2, 14: 1}
Did not match all atoms present	69427-41-4	CCOC(=O)/C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C(=C(C=C1C)OC)C)C	{1: 7, 2: 1, 6: 6, 7: 2, 14: 1, 22: 1, 28: 1}
Did not match all atoms present	6943-08-4	CC1=C(NC2=CC=CC=C2C1=O)C3=CC=CC=C3	{32: 1, 1: 1, 14: 9, 25: 1}
Did not match all atoms present	6943-20-0	CN(C)C(=S)NC1=CC(=CC=C1)Cl	{1: 2, 33: 1, 7: 1, 14: 4, 17: 1, 31: 1}
Did not match all atoms present	6943-34-6	CCCCN1C=NC2=CN=CN=C21	{1: 1, 2: 3, 35: 3, 14: 3, 33: 1}
Did not match all atoms present	6943-97-1	COC1=CC=CC(=C1)CCCBr	{1: 1, 2: 3, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	69432-31-1	CC1=CC(=CC(=C1N=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)N=NC4=C(C=C(C=C4C)N(C)C)C)C)N(C)C	{1: 8, 34: 6, 14: 12, 33: 2}
Did not match all atoms present	69432-33-3	CCN(CC)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)N=NC4=C(C=C(C=C4)N(CC)CC)C)C	{1: 6, 2: 4, 34: 6, 14: 14, 33: 2}
Did not match all atoms present	69432-35-5	CCNC1=CC=C(C2=CC=CC=C21)N=NC3=CC(=C(C=C3C)N=NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)N=NC6=C(C=C(C(=C6)C)N=NC7=CC=C(C8=CC=CC=C87)NCC)C)C	{1: 6, 2: 2, 34: 10, 14: 24, 31: 2}
Did not match all atoms present	69435-89-8	C[Si](C)(C)OC(=O)C1CCCCC1	{1: 3, 11: 5, 12: 1, 28: 1}
Did not match all atoms present	69443-71-6	CSC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)SC)[N+](=O)[O-])[N+](=O)[O-]	{40: 4, 1: 2, 38: 2, 14: 6}
Did not match all atoms present	69447-75-2	COC1=C(C=C(C=C1)[N+](=O)[O-])C=CC(=O)O	{1: 1, 6: 2, 38: 1, 14: 3, 22: 1, 27: 1}
Did not match all atoms present	6945-05-7	CC1=CC2=C(C=C1)C=C(C=C2)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 3, 21: 1, 14: 8}
Did not match all atoms present	6945-65-9	COC1=CC(=C(C=C1[N+]#N)OC)N2CCOCC2.COC1=CC(=C(C=C1[N+]#N)OC)N2CCOCC2.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 34: 2, 33: 2, 11: 8, 14: 4, 17: 4, 22: 4, 23: 2}
Did not match all atoms present	6945-68-2	C1=C(C(=NC=C1Br)N)[N+](=O)[O-]	{38: 1, 18: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	69454-53-1	CCCCOC1=C2C(=O)C=CC3=CC=CC(=C32)C=C1	{1: 1, 2: 3, 22: 1, 14: 7, 25: 1}
Did not match all atoms present	69454-54-2	CNC1=C2C(=O)C=CC3=CC=CC(=C32)C=C1	{1: 1, 31: 1, 14: 7, 25: 1}
Did not match all atoms present	69454-55-3	CN(C)C1=C2C(=O)C=CC3=CC=CC(=C32)C=C1	{1: 2, 33: 1, 14: 7, 25: 1}
Did not match all atoms present	69458-20-4	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](C)(C)C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)[N+](C)(C)C)C8=CC=C(C=C8)[N+](C)(C)C)C9=CC=C(C=C9)[N+](C)(C)C)N3	{32: 2, 1: 16, 35: 2, 29: 12, 14: 40}
Did not match all atoms present	69459-42-3	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)NC(=O)NC3=C(C=C(C=C3)N=NC4=CC(=CC=C4)S(=O)(=O)O)OC.C(CO)N(CCO)CCO	{1: 2, 2: 6, 33: 1, 34: 4, 14: 14, 20: 5, 22: 2, 24: 1, 29: 4, 31: 2}
Did not match all atoms present	6946-29-8	C1=CC(=C(C=C1N)O)C(=O)NN	{24: 1, 30: 2, 21: 1, 14: 3, 31: 1}
Did not match all atoms present	6946-35-6	CCCCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 3, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	6947-94-0	CC1=C(C=CO1)C(=O)O	{1: 1, 27: 1, 14: 2, 23: 1}
Did not match all atoms present	69470-50-4	CC(C)(C)C1=CC(=C(C=C1)O)CN(CCO)CCO	{1: 3, 2: 5, 4: 1, 33: 1, 14: 3, 20: 2, 21: 1}
Did not match all atoms present	69470-51-5	C1CCNC(C1)C(=O)[O-].[K+]	{24: 1, 32: 1, 11: 4, 12: 1}
Did not match all atoms present	6948-01-2	CC(C1=CC=CC=C1)NC=O	{1: 1, 26: 1, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	6948-47-6	CC1(SCC(S1)COC(=O)C2=CC=CC=C2)C	{1: 2, 2: 1, 41: 2, 11: 1, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	6948-55-6	C1OC2=C(O1)C=C(C=C2)/C=C(\C#N)/C3=CC=CC=C3	{37: 1, 6: 1, 7: 1, 11: 1, 14: 8, 23: 2}
Did not match all atoms present	6948-88-5	C1=CC=C(C=C1)C(C2=CC=C(C3=CC=CC=C32)O)(C4=CC=C(C5=CC=CC=C54)O)O	{20: 1, 4: 1, 21: 2, 14: 17}
Did not match all atoms present	6949-09-3	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N)N=NC3=CC(=C(C=C3)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 2, 34: 4, 14: 15, 24: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	6949-43-5	C1CCN(CC1)CCC2=CC=CC=C2	{33: 1, 2: 2, 11: 5, 14: 5}
Did not match all atoms present	6949-73-1	C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)O	{25: 1, 21: 1, 14: 7}
Did not match all atoms present	69492-91-7	CC1=CC(=C(C(=C1)I)O)[N+](=O)[O-]	{38: 1, 1: 1, 19: 1, 21: 1, 14: 2}
Did not match all atoms present	69494-21-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=NNN=C4C(=C3)S(=O)(=O)[O-].[K+]	{32: 1, 25: 2, 35: 2, 29: 3, 14: 5}
Did not match all atoms present	695-34-1	CC1=CC(=NC=C1)N	{1: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	695-37-4	C1=CC(=C[N+](=C1)[O-])F	{16: 1, 33: 1, 29: 1, 14: 4}
Did not match all atoms present	695-84-1	C=CC1=CC=CC=C1O	{14: 4, 5: 1, 6: 1, 21: 1}
Did not match all atoms present	695-96-5	C1=CC(=C(C=C1Cl)Br)O	{17: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	695-98-7	CC1=CC(=C(N=C1)C)C	{1: 3, 35: 1, 14: 2}
Did not match all atoms present	6950-43-2	C1=CC(=C(C=C1Br)C(=O)O)[N+](=O)[O-]	{18: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	6950-45-4	CC1=C(C(=C(C(=C1Cl)C2=C(C(=C(C(=C2Cl)[N+](=O)[O-])Cl)C)Cl)Cl)[N+](=O)[O-])Cl	{1: 2, 38: 2, 17: 6}
Did not match all atoms present	6950-79-4	CC(C)C1=CC=C(C=C1)NC	{1: 3, 3: 1, 14: 4, 31: 1}
Did not match all atoms present	6950-84-1	C1=CC=C2C(=C1)C=CC=C2NC(=O)N	{24: 1, 30: 1, 14: 7, 31: 1}
Did not match all atoms present	6950-88-5	COC1=C(C=CC(=C1)N2CCOCC2)[N+](=O)[O-]	{1: 1, 38: 1, 33: 1, 11: 4, 14: 3, 22: 1, 23: 1}
Did not match all atoms present	6950-92-1	CC1=CC(=C(C(=C1)C)CCO)C	{1: 3, 2: 2, 20: 1, 14: 2}
Did not match all atoms present	6951-08-2	CCOC(=O)C1=CC2=C(C=C1)OCO2	{1: 1, 2: 1, 11: 1, 14: 3, 23: 2, 28: 1}
Did not match all atoms present	69514-84-7	[O-][As](=O)([O-])[O-].[Cs+].[Cs+].[Cs+]	{29: 4}
Did not match all atoms present	69519-59-1	CC(CC1=CC(=C(C=C1OC)SC)OC)N	{1: 4, 2: 1, 3: 1, 40: 1, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	6952-59-6	C1=CC(=CC(=C1)Br)C#N	{18: 1, 37: 1, 14: 4}
Did not match all atoms present	6952-89-2	C1CC1C(=O)C2=CC=C(C=C2)Br	{24: 1, 18: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	6952-94-9	C1CNCCC1(C=O)C2=CC=CC=C2	{32: 1, 26: 1, 11: 4, 13: 1, 14: 5}
Did not match all atoms present	69520-93-0	CC(C)(C)C1=C/C(=N/NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])/C(=O)C=C1.[Na+]	{1: 3, 34: 3, 4: 1, 14: 11, 15: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	6953-30-6	CNC(=O)NCCC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 14: 5, 31: 2}
Did not match all atoms present	6953-78-2	C1=C(NC(=S)NC1=O)C(=O)O	{32: 2, 25: 1, 27: 1, 14: 1}
Did not match all atoms present	69531-41-5	C1=CC(=CC=C1N)N.C1=CC(=CC=C1N)OC2=CC=C(C=C2)N.C1=CC2=C(C=C1C(C3=CC4=C(C=C3)C(=O)OC4=O)(C(F)(F)F)C(F)(F)F)C(=O)OC2=O	{4: 3, 14: 18, 16: 6, 22: 1, 28: 4, 30: 4}
Did not match all atoms present	6954-48-9	C1=CC2=C(C=CC(=O)C2=O)C=C1Br	{25: 2, 18: 1, 14: 5}
Did not match all atoms present	6954-55-8	C1C2=CC=CC=C2C3=C(C=CC=C31)C(=O)O	{27: 1, 11: 1, 14: 7}
Did not match all atoms present	6954-77-4	C1=CC(=C(C=C1Cl)Cl)OCCBr	{17: 2, 2: 2, 22: 1, 18: 1, 14: 3}
Did not match all atoms present	69545-71-7	CCCCOC(=O)/C=C/C(=O)O[Sb](OC(=O)/C=C/C(=O)OCCCC)OCCCC	{1: 3, 2: 9, 28: 4, 22: 1, 6: 4}
Did not match all atoms present	6955-40-4	CCC(C1=CC(=C(C(=C1)OC)OC)OC)C(=O)CC	{1: 5, 2: 2, 3: 1, 14: 2, 22: 3, 24: 1}
Did not match all atoms present	69555-14-2	CCOC(=O)CN=C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 2, 7: 1, 34: 1, 14: 10, 28: 1}
Did not match all atoms present	6956-24-7	CNC(=O)NC1=CC=C(C=C1)N(C)C	{24: 1, 1: 3, 33: 1, 14: 4, 31: 2}
Did not match all atoms present	6956-37-2	CCOC(CCC1=CC=CC=C1)OCC	{1: 2, 2: 4, 3: 1, 22: 2, 14: 5}
Did not match all atoms present	69561-88-2	C[Si](C)C.C1=CC=C(C=C1)[Sb]C2=CC=CC=C2	{1: 3, 14: 10}
Did not match all atoms present	69563-80-0	C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[K+]	{25: 2, 30: 1, 29: 5, 14: 10, 31: 1}
Did not match all atoms present	69563-88-8	C1=CC(=CC=C1C(C2=CC=C(C=C2)OC3=CC=C(C=C3)N)(C(F)(F)F)C(F)(F)F)OC4=CC=C(C=C4)N	{16: 6, 30: 2, 4: 3, 22: 2, 14: 16}
Did not match all atoms present	6957-06-8	CCC(C1=CC=C(C=C1)C)C(=O)CC	{24: 1, 1: 3, 2: 2, 3: 1, 14: 4}
Did not match all atoms present	6957-09-1	CC1=CC=CC=C1C2(CCCCC2)O	{1: 1, 11: 5, 20: 1, 13: 1, 14: 4}
Did not match all atoms present	6957-25-1	CC1=NC2=CC3=CC=CC=C3C=C2S1	{1: 1, 35: 1, 14: 6, 41: 1}
Did not match all atoms present	6957-50-2	CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)N	{1: 1, 11: 1, 14: 6, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6957-71-7	C1C2=CC=CC=C2C3=C1C=C(C=C3)NC=O	{26: 1, 11: 1, 14: 7, 31: 1}
Did not match all atoms present	6957-91-1	C1=CC(=CC=C1/C=N\NC(=S)N)N	{34: 1, 6: 1, 7: 1, 14: 4, 30: 2, 31: 1}
Did not match all atoms present	69571-19-3	CN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(/C(=N\NC5=CC=CC=C5S(=O)(=O)O)/C4=O)S(=O)(=O)O)Cl	{1: 1, 34: 1, 35: 3, 33: 1, 14: 12, 15: 2, 17: 1, 20: 3, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	69577-65-7	C1=CC(=CC=C1C(C2=CC=C(C=C2)OC3=CC=C(C=C3)N)(C(F)(F)F)C(F)(F)F)OC4=CC=C(C=C4)N.C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{4: 3, 14: 22, 16: 6, 22: 2, 24: 1, 28: 4, 30: 2}
Did not match all atoms present	69579-13-1	C/C(=N\NC1=NN=C(C=C1)N2CCOCC2)/CC(=O)OC(C)(C)C	{1: 4, 2: 1, 35: 2, 4: 1, 33: 1, 7: 1, 11: 4, 34: 1, 14: 2, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	6958-44-7	C1=CC=C(C=C1)C=NNC2=C(C=C(C=C2Cl)Cl)Cl	{17: 3, 34: 1, 14: 7, 6: 1, 31: 1}
Did not match all atoms present	69584-87-8	C1=CC(=C(C=C1F)CC#N)F	{16: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	6959-47-3	C1=CC=NC(=C1)CCl.Cl	{17: 2, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	6959-48-4	C1=CC(=CN=C1)CCl.Cl	{17: 2, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	696-02-6	C1=CC(=C(C=C1Cl)F)F	{16: 2, 17: 1, 14: 3}
Did not match all atoms present	696-07-1	C1=C(C(=O)NC(=O)N1)I	{32: 2, 25: 2, 19: 1, 14: 1}
Did not match all atoms present	696-18-4	C1CN1C2=CC=CC=C2	{33: 1, 11: 2, 14: 5}
Did not match all atoms present	696-24-2	C1=CC=C(C=C1)[As](Br)Br	{18: 2, 14: 5}
Did not match all atoms present	696-26-4	C[As](C)C1=CC=CC=C1	{1: 2, 14: 5}
Did not match all atoms present	696-28-6	C1=CC=C(C=C1)[As](Cl)Cl	{17: 2, 14: 5}
Did not match all atoms present	696-30-0	CC(C)C1=CC=NC=C1	{1: 2, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	696-33-3	C1=CC=C(C=C1)I(=O)=O	{19: 1, 29: 2, 14: 5}
Did not match all atoms present	696-35-5	C1=CC=C(C=C1)[SiH](F)F	{16: 2, 14: 5}
Did not match all atoms present	696-40-2	C1=CC(=CC(=C1)I)CN	{2: 1, 19: 1, 30: 1, 14: 4}
Did not match all atoms present	696-41-3	C1=CC(=CC(=C1)I)C=O	{26: 1, 19: 1, 14: 4}
Did not match all atoms present	696-44-6	CC1=CC(=CC=C1)NC	{1: 2, 14: 4, 31: 1}
Did not match all atoms present	696-45-7	COC1=NC=NC(=C1)N	{1: 1, 30: 1, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	696-61-7	CC1=CC=[C-]C=C1.[Mg+2].[Cl-]	{1: 1, 14: 4, 17: 1}
Did not match all atoms present	696-62-8	COC1=CC=C(C=C1)I	{1: 1, 19: 1, 22: 1, 14: 4}
Did not match all atoms present	696-63-9	COC1=CC=C(C=C1)S	{1: 1, 22: 1, 14: 4, 39: 1}
Did not match all atoms present	696-82-2	C1=C(N=C(N=C1F)F)F	{16: 3, 35: 2, 14: 1}
Did not match all atoms present	696-99-1	B(F)(F)F.C1=CC=C(C=C1)CN	{16: 3, 2: 1, 30: 1, 14: 5}
Did not match all atoms present	6960-22-1	CC1=NC=C(C=C1)C(=O)N	{24: 1, 1: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	6960-42-5	C1=CC2=C(C(=C1)[N+](=O)[O-])NC=C2	{32: 1, 38: 1, 14: 5}
Did not match all atoms present	6960-45-8	C1=CC2=C(C(=C1)[N+](=O)[O-])NC(=C2)C(=O)O	{32: 1, 27: 1, 38: 1, 14: 4}
Did not match all atoms present	6960-46-9	CCOC(=O)C1=CC2=C(N1)C(=CC=C2)[N+](=O)[O-]	{32: 1, 1: 1, 2: 1, 38: 1, 14: 4, 28: 1}
Did not match all atoms present	69600-03-9	[O-][Sb](=O)([O-])[O-].[W]	{29: 4}
Did not match all atoms present	69604-00-8	CCOC(=O)C1=CC2=C(O1)C=CC(=C2)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4, 23: 1, 28: 1}
Did not match all atoms present	6961-41-7	C1=NC(=C(N1)C(=O)NN)[N+](=O)[O-]	{32: 1, 35: 1, 38: 1, 14: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	6961-82-6	C1=CC=C(C(=C1)S(=O)(=O)N)Cl	{17: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	69614-95-5	CC(=O)C1=CC=C(C=C1)CCCl	{24: 1, 1: 1, 2: 2, 14: 4, 17: 1}
Did not match all atoms present	6962-44-3	CC1=CC(=C(C=C1)OC)NC(=O)C	{24: 1, 1: 3, 22: 1, 14: 3, 31: 1}
Did not match all atoms present	69626-80-8	CCCCCCC(C)N=C=S	{8: 1, 1: 2, 2: 5, 3: 1, 34: 1}
Did not match all atoms present	6963-56-0	CCCC(=O)OCC1=CC=C(C=C1)OC	{1: 2, 2: 3, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	69631-55-6	C1CC2=C3CCC4=C1C=CC5=C4CCC3=C(CC5)C=C2	{11: 8, 14: 4}
Did not match all atoms present	69637-93-0	C1=CC=C2C(=C1)NC3=NC4=NC5=CC=CC=C5N=C4N=C3N2	{32: 2, 35: 4, 14: 8}
Did not match all atoms present	69639-29-8	[SiH2]=S	{}
Did not match all atoms present	6964-21-2	C1=CSC=C1CC(=O)O	{41: 1, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	69642-59-7	CN(C)C1=CC=C(C=C1)/C=C/S(=O)(=O)C	{1: 3, 33: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	69644-85-5	C1=CC(=CC=C1C(=O)O)NNC(=O)CC[C@@H](C(=O)O)N	{2: 2, 3: 1, 14: 4, 24: 1, 27: 2, 30: 1, 31: 2}
Did not match all atoms present	69645-14-3	CC1=C(C1C(=O)OC)C2=CC=C(C=C2)Cl	{1: 2, 12: 1, 14: 4, 15: 2, 17: 1, 28: 1}
Did not match all atoms present	69649-23-6	CC(=O)NC1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C5C=C(C=CC5=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 4, 14: 14, 24: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	6965-01-1	C1=CC(=CN=C1)CNC(=S)NCC2=CN=CC=C2	{35: 2, 2: 2, 31: 2, 14: 8, 7: 1}
Did not match all atoms present	6965-71-5	CC(C(=O)O)OC1=C(C=CC(=C1)Cl)Cl	{1: 1, 3: 1, 14: 3, 17: 2, 22: 1, 27: 1}
Did not match all atoms present	69654-93-9	CCN(CC)C(=S)SC(=O)N(C)C	{1: 4, 2: 2, 33: 2, 40: 1, 7: 1, 24: 1}
Did not match all atoms present	69655-76-1	C=C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)C=C)C=C)C=C)C=C)C=C)C=C)C=C	{5: 8, 6: 8, 23: 12}
Did not match all atoms present	69657-20-1	CC[Si]1(CC=CC1)CC	{1: 2, 2: 2, 11: 2, 14: 2}
Did not match all atoms present	69657-51-8	C1=NC2=C(N1COCCO)N=C(N=C2[O-])N.[Na+]	{33: 1, 2: 3, 35: 3, 14: 1, 20: 1, 22: 1, 30: 1}
Did not match all atoms present	69657-89-2	C1=CC=C(C=C1)CCNC2=C3C(=C(C=C2)NCCC4=CC=CC=C4)C(=O)C5=C(C=CC(=C5C3=O)O)O	{25: 2, 2: 4, 21: 2, 14: 14, 31: 2}
Did not match all atoms present	69658-13-5	C1=CC=C2C(=C1)C3=C4C(=C(C=C3)SCC(=O)O)C=CC=C4C2=O	{40: 1, 25: 1, 2: 1, 27: 1, 14: 9}
Did not match all atoms present	6966-10-5	CC1=C(C=C(C=C1)CO)C	{1: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	6966-64-9	C1=CC(=CC=C1N)N=NC2=CC=C(C=C2)[As](=O)(O)O	{30: 1, 34: 2, 20: 2, 29: 1, 14: 8}
Did not match all atoms present	69669-44-9	CCCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 9, 3: 1, 29: 3, 14: 4}
Did not match all atoms present	6967-29-9	CCC1=C(C(=CC=C1)CC)NC(=O)CCl	{1: 2, 2: 3, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	6967-82-4	CC1=CC(=C(C=C1)Br)C(=O)O	{1: 1, 18: 1, 27: 1, 14: 3}
Did not match all atoms present	69673-80-9	CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C(C)(C)O	{1: 3, 2: 11, 4: 1, 14: 4, 20: 1, 24: 1}
Did not match all atoms present	69673-85-4	CC(C)C1=CC=C(C=C1)C(=O)C(C)(C)O	{1: 4, 3: 1, 4: 1, 14: 4, 20: 1, 24: 1}
Did not match all atoms present	6968-24-7	CC1=CC(=C(C(=C1)Br)N)Br	{1: 1, 18: 2, 30: 1, 14: 2}
Did not match all atoms present	6968-28-1	C1=CC(=C(C=C1Br)C(=O)O)C(=O)O	{18: 1, 27: 2, 14: 3}
Did not match all atoms present	6968-70-3	CC1=CC=C(C=C1)C(CCCl)OC	{1: 2, 2: 2, 3: 1, 14: 4, 17: 1, 22: 1}
Did not match all atoms present	69687-78-1	CCC1=C(NC(=C1)C)C	{32: 1, 1: 3, 2: 1, 14: 1}
Did not match all atoms present	6969-28-4	C1=NC2=C(N1)C(=O)N=C(N2)NN	{32: 2, 35: 2, 14: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	6969-49-9	CCCCCCCCOC(=O)C1=CC=CC=C1O	{1: 1, 2: 7, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	6969-50-2	C1=C(C=C(N=C1C(Cl)(Cl)Cl)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{17: 9, 35: 1, 4: 3, 14: 2}
Did not match all atoms present	6969-52-4	C1=CN=C(C=C1C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{17: 6, 35: 1, 4: 2, 14: 3}
Did not match all atoms present	6969-90-0	CN(C)C(=O)OC1=CC=CC=C1	{1: 2, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	69695-61-0	C1=CC(=C(C=C1OC(F)(F)F)Cl)N	{4: 1, 14: 3, 16: 3, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	69696-98-6	CCCC[N+](CCCC)(CCCC)CCCCCC[N+](CCCC)(CCCC)CCCC.[Br-].[Br-]	{1: 6, 2: 24, 18: 2}
Did not match all atoms present	697-18-7	C1(C(S(=O)(=O)O1)(F)F)(F)F	{16: 4, 29: 2, 13: 2, 23: 1}
Did not match all atoms present	697-73-4	C1=CC(=C(C(=C1)F)CCl)F	{16: 2, 17: 1, 2: 1, 14: 3}
Did not match all atoms present	697-82-5	CC1=CC(=C(C(=C1)O)C)C	{1: 3, 21: 1, 14: 2}
Did not match all atoms present	697-83-6	C1(=C(N=C(N=C1F)F)F)Cl	{16: 3, 17: 1, 35: 2}
Did not match all atoms present	697-86-9	C1=C(C=C(C(=C1Cl)N)Br)Cl	{17: 2, 18: 1, 30: 1, 14: 2}
Did not match all atoms present	6970-01-0	CC1=C(C=C(C=C1)C(C)(C)C2=CC(=C(C=C2)C)C)C	{1: 6, 4: 1, 14: 6}
Did not match all atoms present	6970-19-0	CCOC1=CC(=CC(=C1OCC)OCC)C(=O)O	{1: 3, 2: 3, 27: 1, 22: 3, 14: 2}
Did not match all atoms present	6970-83-8	CCOC(=O)NCCC1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	69704-19-4	C(CC(=O)[O-])[C@@H](C(=O)[O-])N.O.O.O.O.[Ca+2]	{24: 2, 2: 2, 3: 1, 30: 1}
Did not match all atoms present	6971-33-1	CC1=CC(=C(C=C1)N=O)[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 29: 1, 14: 3}
Did not match all atoms present	6971-44-4	CNCC1=CC=NC=C1	{1: 1, 2: 1, 35: 1, 14: 4, 31: 1}
Did not match all atoms present	6971-51-3	COC1=CC=CC(=C1)CO	{1: 1, 2: 1, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	6971-74-0	CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	69712-56-7	CN1C(=NN=N1)SCC2=C(N3C([C@@](C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)O)S4)OC)SC2)C(=O)O	{1: 2, 2: 1, 35: 3, 33: 2, 7: 1, 40: 1, 41: 3, 11: 1, 12: 2, 13: 1, 15: 3, 22: 1, 24: 2, 25: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	6972-05-0	CN(C)C(=S)N	{1: 2, 33: 1, 30: 1, 7: 1}
Did not match all atoms present	6972-27-6	CN1C(=CC(=O)N(C1=O)C)Cl	{1: 2, 25: 2, 33: 2, 14: 1, 17: 1}
Did not match all atoms present	6972-37-8	CCOC(=O)C1=C(C(=C(NC1=O)C)[N+](=O)[O-])C	{32: 1, 1: 3, 2: 1, 38: 1, 25: 1, 28: 1}
Did not match all atoms present	6972-47-0	CC1=C(C(=C(C(=C1Cl)O)Cl)C)Cl	{1: 2, 21: 1, 17: 3}
Did not match all atoms present	6972-51-6	CC1=CC(=C(C=C1)C)CCO	{1: 2, 2: 2, 20: 1, 14: 3}
Did not match all atoms present	6972-71-0	CC1=CC(=C(C=C1C)[N+](=O)[O-])N	{1: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	6972-79-8	C1=CC=C(C=C1)COCC(COCC2=CC=CC=C2)O	{2: 4, 3: 1, 20: 1, 22: 2, 14: 10}
Did not match all atoms present	69723-93-9	[SiH2]Cl	{17: 1}
Did not match all atoms present	69726-15-4	CC(=C)C(=O)OCC[N+](C)(C)C.C=CC(=O)N.C=CC(=O)O.[Cl-]	{1: 4, 2: 2, 5: 3, 6: 2, 7: 1, 17: 1, 24: 1, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	69728-34-3	C[C-]1[C-]([C-]([C-]([C-]1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[CH-]=O.[CH-]=O.[Rh].[Rh]	{1: 10, 29: 2}
Did not match all atoms present	6973-08-6	COC1=C(C=C(C=C1)S(=O)(=O)N)N	{1: 1, 30: 2, 22: 1, 14: 3, 29: 2}
Did not match all atoms present	6973-13-3	CC1=CC(=C(C=C1Cl)S(=O)(=O)O)[N+](=O)[O-]	{1: 1, 38: 1, 14: 2, 17: 1, 20: 1, 29: 2}
Did not match all atoms present	6973-54-2	CC(=O)OCCN1C=NC2=C1N=CN=C2Cl	{1: 1, 2: 2, 35: 3, 33: 1, 14: 2, 17: 1, 28: 1}
Did not match all atoms present	6973-58-6	C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C=C2C(=O)O	{27: 1, 14: 11, 31: 1}
Did not match all atoms present	6973-60-0	CN1C=CC=C1C(=O)O	{1: 1, 27: 1, 14: 3, 33: 1}
Did not match all atoms present	69730-91-2	CCCC(=O)N1CCC[C@H]1C2=CN=CC=C2	{1: 1, 2: 2, 35: 1, 33: 1, 11: 3, 12: 1, 14: 4, 24: 1}
Did not match all atoms present	69739-34-0	CC(C)(C)[Si](C)(C)OS(=O)(=O)C(F)(F)F	{16: 3, 1: 5, 4: 2, 29: 2, 22: 1}
Did not match all atoms present	6974-32-9	CC(=O)O[C@H]1[C@@H]([C@@H]([C@H](O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4	{1: 1, 2: 1, 12: 4, 14: 15, 23: 1, 28: 4}
Did not match all atoms present	6974-47-6	C/C(=C\C1=CC2=C(C=C1)OCO2)/C=O	{1: 1, 6: 1, 7: 1, 11: 1, 14: 3, 23: 2, 26: 1}
Did not match all atoms present	6974-89-6	CCCCCCCCSC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 7, 35: 3, 40: 1, 14: 2}
Did not match all atoms present	6974-90-9	CCCCCCCCCCSC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 9, 35: 3, 40: 1, 14: 2}
Did not match all atoms present	69745-66-0	CCC(C)C1=CC(=C(C=C1)O)CCN(C)C	{1: 4, 2: 3, 3: 1, 33: 1, 14: 3, 21: 1}
Did not match all atoms present	6975-25-3	C1CC=CC(C1)N2C=NC3=C2N=CN=C3N	{33: 1, 35: 3, 11: 3, 12: 1, 14: 4, 30: 1}
Did not match all atoms present	6975-27-5	C1CC[C@H]([C@@H](C1)N2C=NC3=C2NC=NC3=O)O	{32: 1, 33: 1, 35: 2, 11: 4, 12: 2, 14: 2, 20: 1, 25: 1}
Did not match all atoms present	6975-29-7	CC(=O)NC1=C(C=C(C=C1)Cl)Cl	{24: 1, 1: 1, 31: 1, 14: 3, 17: 2}
Did not match all atoms present	6975-60-6	CC(=O)CC1=CC=CO1	{24: 1, 1: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	6976-69-8	CCCOC(=O)C1=CC=C(C=C1)C	{1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	6976-74-5	CCCCCOC(=O)C1=CC=C(C=C1)C	{1: 2, 2: 4, 28: 1, 14: 4}
Did not match all atoms present	69766-15-0	C1CC[NH+](CC1)CCCOC(=O)C2=CC=C(C=C2)N.[Cl-]	{2: 3, 11: 5, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	69766-22-9	CC1CCC[NH+](C1)CCCOC(=O)C2=CC=C(C=C2)N.[Cl-]	{1: 1, 2: 3, 11: 4, 12: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	69766-36-5	C1=CC(=CC=C1C=O)NC2=CC=C(C=C2)O	{26: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	69766-47-8	C[N+]12CCCC(C1)C(C2)OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{1: 1, 3: 1, 11: 5, 12: 2, 14: 10, 18: 1, 28: 1}
Did not match all atoms present	69766-48-9	C1CC2C[NH+](C1)CC2OC(=O)C3C4=CC=CC=C4C5=CC=CC=C35.[Cl-]	{17: 1, 11: 5, 12: 3, 14: 8, 28: 1}
Did not match all atoms present	69766-49-0	C1CC2C[NH+](C1)CC2OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]	{3: 1, 11: 5, 12: 2, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	69766-62-7	CC1(C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)[O-])O)C(=O)N)N(C)C)O)O.[Na+]	{1: 3, 33: 1, 12: 4, 13: 2, 14: 3, 15: 4, 20: 4, 21: 1, 24: 1, 25: 2, 29: 1, 30: 1}
Did not match all atoms present	69766-80-9	CCC(=CC1=[N+](C2=CC=CC=C2S1)C)C=C3N(C4=CC=CC=C4S3)C.[Br-]	{1: 3, 2: 1, 33: 2, 6: 2, 7: 1, 41: 2, 14: 8, 15: 1, 18: 1}
Did not match all atoms present	69770-20-3	C1=CC(=CC(=C1)OC2=CC=C(C=C2)Cl)C=O	{17: 1, 26: 1, 22: 1, 14: 8}
Did not match all atoms present	69770-23-6	CC(C)(C)C1=CC=C(C=C1)OC2=CC=CC(=C2)C=O	{1: 3, 26: 1, 4: 1, 22: 1, 14: 8}
Did not match all atoms present	69777-59-9	CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(C)CC	{1: 3, 2: 7, 3: 1, 14: 8, 22: 1, 28: 1}
Did not match all atoms present	69777-74-8	CCC(C)CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CC(C)CC	{1: 4, 2: 4, 3: 2, 28: 1, 14: 12}
Did not match all atoms present	69780-81-0	C(CF)C(C(=O)[O-])O.[Na+]	{16: 1, 24: 1, 2: 2, 3: 1, 20: 1}
Did not match all atoms present	69780-82-1	C1CC[NH2+]C(C1)CCOC(=O)C2=CC(=CC=C2)N.[Cl-]	{2: 2, 11: 4, 12: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	69780-83-2	C1CC[NH2+]C(C1)CCOC(=O)C2=CC=CC=C2N.[Cl-]	{2: 2, 11: 4, 12: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	69780-84-3	C1CC[NH2+]C(C1)CCOC(=O)C2=CC=C(C=C2)N.[Cl-]	{2: 2, 11: 4, 12: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	69781-71-1	CC[NH2+]CCCOCN(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-]	{1: 1, 2: 5, 33: 1, 14: 10, 17: 1, 22: 1}
Did not match all atoms present	69781-89-1	CC1=CC(=CC(=C1)OCCN[NH3+])C.[Cl-]	{1: 2, 2: 2, 14: 3, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	69781-93-7	CC1=CC=CC=C1OCCNN	{1: 1, 2: 2, 14: 4, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	69781-96-0	C1=CC=C(C=C1)OCCCN[NH3+].C(=C\C(=O)[O-])\C(=O)O	{2: 3, 6: 2, 14: 5, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	69782-00-9	CC(CSC1=CC=CC=C1)N[NH3+].C(=C\C(=O)[O-])\C(=O)O	{1: 1, 2: 1, 3: 1, 6: 2, 40: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	69782-01-0	CCC(COC1=CC=CC=C1)N[NH3+].[Cl-]	{1: 1, 2: 2, 3: 1, 14: 5, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	69782-05-4	C1=CC=C(C=C1)SCCCCN[NH3+].C(=C\C(=O)[O-])\C(=O)O	{2: 4, 6: 2, 40: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	69782-09-8	C1=CC=C(C=C1)OCCCCCN[NH3+].C(=C\C(=O)[O-])\C(=O)O	{2: 5, 6: 2, 14: 5, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	69782-11-2	C1=CC=C2C(=C1)C=CC=C2OCCN[NH3+].C(=C\C(=O)[O-])\C(=O)O	{2: 2, 6: 2, 14: 7, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	69782-16-7	C1=CC=C(C=C1)OCCCCN[NH3+].C(=C\C(=O)[O-])\C(=O)O	{2: 4, 6: 2, 14: 5, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	69782-18-9	COC1=C(C=C(C=C1)OCCNN)OC.Cl	{1: 2, 2: 2, 14: 3, 17: 1, 22: 3, 30: 1, 31: 1}
Did not match all atoms present	69782-24-7	C1=CC(=CC=C1OCCNN)Cl	{2: 2, 14: 4, 17: 1, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	69782-26-9	COC1=CC(=C(C=C1)OC)OCCNN.Cl	{1: 2, 2: 2, 14: 3, 17: 1, 22: 3, 30: 1, 31: 1}
Did not match all atoms present	69782-38-3	CN1CCC[C@@H]1C2=CN=CC=C2.Cl	{1: 1, 35: 1, 33: 1, 11: 3, 12: 1, 14: 4, 17: 1}
Did not match all atoms present	69782-42-9	CC1CCCC[NH+]1CCCOC(=O)C2=CN=CC=C2.[Cl-]	{1: 1, 2: 3, 35: 1, 11: 4, 12: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	69782-43-0	CC1CCCC([NH+]1CCCOC(=O)C2=CN=CC=C2)C.[Cl-]	{1: 2, 2: 3, 35: 1, 11: 3, 12: 2, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	69782-45-2	C1=CC(=CC=C1N)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{3: 2, 14: 4, 20: 2, 21: 1, 27: 2, 30: 1}
Did not match all atoms present	6979-94-8	CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2NC(=NC3=O)N)OC(=O)C)OC(=O)C	{32: 1, 1: 3, 2: 1, 35: 2, 33: 1, 12: 4, 14: 1, 23: 1, 25: 1, 28: 3, 30: 1}
Did not match all atoms present	69792-60-5	CC[C@H](CO)N.C1=CC=C(C=C1)[C@H](C(=O)O)O	{1: 1, 2: 2, 3: 2, 14: 5, 20: 2, 27: 1, 30: 1}
Did not match all atoms present	69795-70-6	C1C2=CC3=CC=CC4=C3C5=C(C=C4)C=CC(=C25)C1=O	{25: 1, 11: 1, 14: 8}
Did not match all atoms present	698-00-0	CN(C)C1=CC=CC=C1Br	{1: 2, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	698-01-1	CN(C)C1=CC=CC=C1Cl	{1: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	698-19-1	CNCC1=CC=CC=C1Br	{1: 1, 2: 1, 18: 1, 14: 4, 31: 1}
Did not match all atoms present	698-27-1	CC1=CC(=C(C=C1)C=O)O	{1: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	698-42-0	C1CCC2=C(C1)SC(=S)S2	{41: 2, 11: 4}
Did not match all atoms present	698-49-7	C1=CC(=CC(=O)C(=C1)O)N	{25: 1, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	698-53-3	C1CN1C2=CC=C(C=C2)F	{16: 1, 33: 1, 11: 2, 14: 4}
Did not match all atoms present	698-63-5	C1=C(OC(=C1)[N+](=O)[O-])C=O	{26: 1, 38: 1, 14: 2, 23: 1}
Did not match all atoms present	698-67-9	C1=CC(=CC=C1C(=O)N)Br	{24: 1, 18: 1, 30: 1, 14: 4}
Did not match all atoms present	698-69-1	CN(C)C1=CC=C(C=C1)Cl	{1: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	698-70-4	CN(C)C1=CC=C(C=C1)I	{1: 2, 19: 1, 14: 4, 33: 1}
Did not match all atoms present	698-71-5	CCC1=CC(=CC(=C1)C)O	{1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	698-87-3	CC(CC1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	69804-02-0	C1C2CC3CC1CC(C2)(C3)CN=C(CSP(=O)(O)O)N	{2: 2, 34: 1, 7: 1, 40: 1, 11: 6, 12: 3, 13: 1, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	69806-40-2	CC(C(=O)OC)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl	{1: 2, 3: 1, 4: 1, 14: 6, 16: 3, 17: 1, 35: 1, 22: 2, 28: 1}
Did not match all atoms present	69806-50-4	CCCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F	{1: 2, 2: 3, 3: 1, 4: 1, 14: 7, 16: 3, 35: 1, 22: 2, 28: 1}
Did not match all atoms present	69813-63-4	CC(COC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 2: 1, 3: 1, 22: 2, 14: 10}
Did not match all atoms present	69815-53-8	CC1=C(C2=CC=CC=C2C=C1)CC#N	{1: 1, 2: 1, 37: 1, 14: 6}
Did not match all atoms present	69815-54-9	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2OP(=O)([O-])[O-].[Na+].[Na+]	{24: 1, 31: 1, 22: 1, 14: 11, 29: 3}
Did not match all atoms present	69828-87-1	C1=CC=C2C(=C1)C(=CC=C2N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])[N+](=O)[O-])NCC(CO)O	{2: 2, 3: 1, 38: 2, 34: 2, 14: 8, 17: 1, 20: 2, 31: 1}
Did not match all atoms present	69828-92-8	CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C2=C4C5=CC=CC=C5C(=O)C6=CC=CC=C64)C=C(C1=O)C(C)(C)C	{1: 12, 4: 4, 25: 3, 14: 12, 15: 10}
Did not match all atoms present	69833-26-7	CCCC(=O)NC1=CC=CC(=C1)C	{24: 1, 1: 2, 2: 2, 14: 4, 31: 1}
Did not match all atoms present	69833-36-9	CCCCCCCCCCCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 10, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	69834-21-5	CCCCCCCCCCCCCCCCC1=C(C=C(C=C1)OC2=CC=CC=C2)CCCCCCCCCCCCCCCC	{1: 2, 2: 30, 22: 1, 14: 8}
Did not match all atoms present	69834-22-6	C1=CC(=CC=C1CCCCCCCCCCOCCCCCCCCCCC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O	{2: 20, 20: 2, 22: 1, 14: 8, 29: 4}
Did not match all atoms present	69834-23-7	CCCCCCCCCCCCC1=C(C=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[NH4+].[NH4+]	{1: 1, 2: 11, 22: 1, 14: 7, 29: 6}
Did not match all atoms present	69840-61-5	C1CN(C(=C[N+](=O)[O-])N1)CC2=CC=C(C=C2)Cl	{32: 1, 33: 1, 2: 1, 38: 1, 6: 1, 11: 2, 14: 4, 15: 1, 17: 1}
Did not match all atoms present	69847-37-6	CCCCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)NC2=CC=C(C=C2)OC(=O)OCC)N	{1: 2, 2: 17, 14: 7, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	69847-39-8	CCN(CC)C1=CC=CC=C1.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{1: 2, 2: 2, 27: 2, 14: 9, 33: 1}
Did not match all atoms present	69847-45-6	C1=CC(=CC=C1CC(C(=O)[O-])N)[O-].[Na+].[Na+]	{24: 1, 2: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	69847-46-7	CC1=CC=C(C=C1)OCCOCCOCCOCCOCCOP(=O)([O-])[O-].[K+].[K+]	{1: 1, 2: 10, 22: 6, 14: 4, 29: 3}
Did not match all atoms present	69847-48-9	CC1=CC(=C2C(=C1)N=C(O2)C=CC3=NC4=CC(=CC(=C4O3)C)C)C	{1: 4, 35: 2, 14: 4, 6: 2, 23: 2}
Did not match all atoms present	69847-49-0	CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=CC=C(C=C3)Cl	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 9, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	69847-50-3	CCOC1=CC=C(C=C1)N=NC2=C(C=C(C(=C2)C)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])OC.[Na+]	{1: 3, 2: 1, 34: 4, 14: 10, 22: 2, 29: 3}
Did not match all atoms present	69847-62-7	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC(=C1)N)N.C1=CC(=C(C=C1N)N)S(=O)(=O)O	{30: 4, 27: 2, 20: 1, 29: 2, 14: 11}
Did not match all atoms present	69853-15-2	[H+].[H+].C1COCCN1.C1COCCN1.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sn+4]	{32: 2, 17: 6, 11: 8, 23: 2}
Did not match all atoms present	69856-00-4	CC(C)(C1=CC=CC=C1)OCC=C	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 14: 5, 22: 1}
Did not match all atoms present	69856-03-7	CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC(=CC=C1O)O	{1: 3, 4: 1, 5: 1, 14: 8, 21: 3}
Did not match all atoms present	69856-04-8	CC(C)(C)C1=CC=C(C=C1)O.CC(C)(C)C1=CC(=C(C=C1)O)O.C=O.C1=CC=C(C=C1)C2=CC=C(C=C2)O	{1: 6, 4: 2, 5: 1, 14: 16, 21: 4}
Did not match all atoms present	69856-05-9	CC1CO1.C1CO1.C(CN)N.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.N	{1: 1, 2: 5, 11: 3, 12: 9, 13: 1, 20: 8, 22: 1, 23: 4, 30: 2}
Did not match all atoms present	69856-10-6	CCCCCC1=CC=CC=C1C2=CC=CC=C2	{1: 1, 2: 4, 14: 9}
Did not match all atoms present	69856-11-7	CCCCCCCCCC1=CC=CC=C1C2=CC=CC=C2	{1: 1, 2: 8, 14: 9}
Did not match all atoms present	69866-21-3	CC1=CNC2=C1C34CC3CN(C4=CC2=O)C(=O)C5=CC6=C7CCN(C7=C(C(=C6N5)OC)O)C(=O)C8=CC9=C1CCN(C1=C(C(=C9N8)OC)O)C(=O)N	{32: 3, 1: 3, 33: 3, 11: 6, 12: 1, 13: 1, 14: 4, 15: 1, 21: 2, 22: 2, 24: 3, 25: 1, 30: 1}
Did not match all atoms present	69868-09-3	C1=CC(=C(C=C1O)[O-])C(=O)O.[OH-].[Cu+2]	{27: 1, 21: 1, 14: 3}
Did not match all atoms present	69868-11-7	COC1=C(C=CC(=C1)C(=O)N)[N+]#N.COC1=C(C=CC(=C1)C(=O)N)[N+]#N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 2, 34: 2, 14: 6, 17: 4, 22: 2, 24: 2, 30: 2}
Did not match all atoms present	69868-12-8	CC1CO1.C=O.C1CO1.C1=CC=C(C=C1)O.C(CN)N.N	{1: 1, 2: 2, 5: 1, 11: 3, 12: 1, 14: 5, 21: 1, 23: 2, 30: 2}
Did not match all atoms present	69868-13-9	CC1=CC=CC=C1NCCNC2=CC=CC=C2	{1: 1, 2: 2, 14: 9, 31: 2}
Did not match all atoms present	69868-14-0	CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCOCC(=O)[O-])CC(=O)[O-].[OH-].[Na+].[Na+]	{1: 1, 2: 20, 35: 1, 11: 2, 15: 1, 22: 1, 24: 2}
Did not match all atoms present	69868-15-1	CCCC1=NCC[N+]1(CCOCC(=O)[O-])CC(=O)[O-].[OH-].[Na+].[Na+]	{1: 1, 2: 6, 35: 1, 11: 2, 15: 1, 22: 1, 24: 2}
Did not match all atoms present	69868-17-3	CC1=NC=CN1C(=O)C2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)C(=O)O	{1: 1, 35: 1, 33: 1, 14: 2, 17: 4, 24: 1, 27: 1}
Did not match all atoms present	69868-19-5	C1=CC2=C(C=C1C(=O)OCOCOCOCOC(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{2: 4, 28: 6, 22: 3, 14: 6}
Did not match all atoms present	6988-21-2	CNC(=O)OC1=CC=CC=C1C2OCCO2	{1: 1, 11: 2, 12: 1, 14: 4, 23: 2, 28: 1, 31: 1}
Did not match all atoms present	69882-12-8	CCCCCCCCC=CCCCCCCCC(=O)OCCS[Sn](CCC(=O)OCCCC)(SCCOC(=O)CCCCCCCC=CCCCCCCCC)SCCOC(=O)CCCCCCCC=CCCCCCCCC	{40: 3, 1: 4, 2: 53, 28: 4, 6: 6}
Did not match all atoms present	69882-18-4	CC(=O)O[Si](C=C)(OC(=O)C)OC(=O)C.CO[Si](CCCOCC1CO1)(OC)OC	{1: 6, 2: 4, 5: 1, 6: 1, 11: 1, 12: 1, 22: 4, 23: 1, 28: 3}
Did not match all atoms present	69883-99-4	CC1CC2(C(C2(C)C)C3C1(C4C=C(C(=O)C4(CC(=C3)COC(=O)C)O)C)O)OC(=O)CC5=CC=C(C=C5)OC(=O)C	{1: 6, 2: 2, 11: 2, 12: 4, 13: 4, 14: 6, 15: 2, 20: 2, 25: 1, 28: 3}
Did not match all atoms present	69891-92-5	C1COC(OC1)CC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{2: 2, 11: 3, 12: 1, 14: 15, 18: 1, 23: 2}
Did not match all atoms present	69898-15-3	C1=CC=C(C=C1)C(=O)OCCOCCO.C(=C/C(=O)O)\C(=O)O	{2: 4, 6: 2, 14: 5, 20: 1, 22: 1, 27: 2, 28: 1}
Did not match all atoms present	69898-19-7	[O-2].[O-2].[O-2].[Al+3].[Al+3].[Ag]	{}
Did not match all atoms present	69898-39-1	COC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC=CC(=C4)C(=O)NC5=CC=C(C=C5)S(=O)(=O)[O-])/C2=O.COC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC=CC(=C4)C(=O)NC5=CC=C(C=C5)S(=O)(=O)[O-])/C2=O.[Ca+2]	{1: 2, 34: 2, 14: 34, 15: 4, 22: 2, 24: 4, 25: 2, 29: 6, 31: 6}
Did not match all atoms present	69898-40-4	CCN1C(=C(C2=CC=CC=C21)C3(C4=C(C=CC=N4)C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC)C	{1: 5, 2: 4, 35: 1, 33: 2, 13: 1, 14: 10, 22: 1, 28: 1}
Did not match all atoms present	69898-41-5	CCN1C(=C(C2=CC=CC=C21)C3(C4=C(C(=O)O3)N=CC=C4)C5=C(C=C(C=C5)N(CC)CC)OCC)C	{1: 5, 2: 4, 35: 1, 33: 2, 13: 1, 14: 10, 22: 1, 28: 1}
Did not match all atoms present	69898-42-6	CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(C=CC=N3)C(=O)O)C	{1: 2, 2: 1, 35: 1, 33: 1, 14: 7, 24: 1, 27: 1}
Did not match all atoms present	69898-47-1	C(C(CN)(CN)CN)N.OS(=O)(=O)O.OS(=O)(=O)O	{20: 4, 2: 4, 4: 1, 29: 4, 30: 4}
Did not match all atoms present	69898-54-0	CCCCCCCCCCCCOC(=O)C(=C)C.CCCCOC(=O)C=C.CC(=C)C1=CC=CC=C1	{1: 4, 2: 14, 5: 3, 6: 1, 7: 2, 14: 5, 28: 2}
Did not match all atoms present	69898-60-8	CCN1C(=C(C2=CC=CC=C21)C3(C4=C(C=CC(=C4)C(=O)O)C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC)C	{1: 5, 2: 4, 33: 2, 13: 1, 14: 10, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	69898-61-9	CCN1C(=C(C2=CC=CC=C21)C3(C4=C(C=C(C=C4)C(=O)O)C(=O)O3)C5=C(C=C(C=C5)N(CC)CC)OCC)C	{1: 5, 2: 4, 33: 2, 13: 1, 14: 10, 22: 1, 27: 1, 28: 1}
Did not match all atoms present	69898-62-0	CCCCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(OC2=O)(C3=C(C=C(C=C3)N(CC)CC)OCC)C4=C(N(C5=CC=CC=C54)CC)C	{1: 6, 2: 19, 33: 2, 13: 1, 14: 10, 22: 1, 28: 2}
Did not match all atoms present	69898-63-1	CCCCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)OC2(C3=C(C=C(C=C3)N(CC)CC)OCC)C4=C(N(C5=CC=CC=C54)CC)C	{1: 6, 2: 19, 33: 2, 13: 1, 14: 10, 22: 1, 28: 2}
Did not match all atoms present	69898-64-2	CCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(OC2=O)(C3=C(C=C(C=C3)N(CC)CC)OCC)C4=C(N(C5=CC=CC=C54)CC)C	{1: 6, 2: 17, 33: 2, 13: 1, 14: 10, 22: 1, 28: 2}
Did not match all atoms present	69898-65-3	CCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)OC2(C3=C(C=C(C=C3)N(CC)CC)OCC)C4=C(N(C5=CC=CC=C54)CC)C	{1: 6, 2: 17, 33: 2, 13: 1, 14: 10, 22: 1, 28: 2}
Did not match all atoms present	69898-68-6	[H+].[H+].[H+].[H+].[H+].C1=CC(=CC(=C1)P(=O)([O-])[O-])NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=C(C=CC(=C4)[N+](=O)[O-])[O-])S(=O)(=O)[O-].C1=CC(=CC(=C1)P(=O)([O-])[O-])NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=C(C=CC(=C4)[N+](=O)[O-])[O-])S(=O)(=O)[O-].[Na+].[Na+].[Co+3]	{34: 4, 38: 2, 29: 12, 14: 22, 31: 2}
Did not match all atoms present	699-02-5	CC1=CC=C(C=C1)CCO	{1: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	699-08-1	CCOC1=CC=C(C=C1)I	{1: 1, 2: 1, 19: 1, 22: 1, 14: 4}
Did not match all atoms present	699-09-2	CCOC1=CC=C(C=C1)S	{1: 1, 2: 1, 22: 1, 14: 4, 39: 1}
Did not match all atoms present	699-10-5	CSSCC1=CC=CC=C1	{40: 2, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	699-12-7	C1=CC=C(C=C1)SCCO	{40: 1, 2: 2, 20: 1, 14: 5}
Did not match all atoms present	699-17-2	CC(=O)CCC1=CC=CO1	{24: 1, 1: 1, 2: 2, 14: 3, 23: 1}
Did not match all atoms present	699-18-3	C1=COC(=C1)/C=C/[N+](=O)[O-]	{38: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	699-20-7	CSC1=CC=C(C=C1)SC	{40: 2, 1: 2, 14: 4}
Did not match all atoms present	699-83-2	CC(=O)C1=C(C=CC=C1O)O	{24: 1, 1: 1, 21: 2, 14: 3}
Did not match all atoms present	699-98-9	C1=CC2=C(C(=O)OC2=O)N=C1	{35: 1, 28: 2, 14: 3}
Did not match all atoms present	6990-27-8	B(N(C)C)(N(C)C)Br	{1: 4, 18: 1, 33: 2}
Did not match all atoms present	6990-43-8	CCCCOP(=S)(OCCCC)[S-].CCCCOP(=S)(OCCCC)[S-].[Zn+2]	{1: 4, 2: 12, 22: 4}
Did not match all atoms present	69901-70-8	C1=CC=C2C(=C1)C3=CN=C(C=C3N2)N	{32: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	69912-93-2	CC1CC(N(C2=C1C=C(C=C2)C=C(C#N)C#N)CCOC(=O)C)(C)C	{1: 4, 2: 2, 33: 1, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1, 14: 3, 28: 1, 37: 2}
Did not match all atoms present	69912-94-3	CC(C)C(=O)C1=CC(=C(S1)N)C(=O)OC	{1: 3, 3: 1, 41: 1, 14: 1, 24: 1, 28: 1, 30: 1}
Did not match all atoms present	69912-95-4	CC1CCC2=CC(=C(C=C2N1CCO)C)N=NC3=C(C=C(S3)C(=O)C(C)C)C(=O)NCCO	{1: 4, 2: 4, 3: 1, 33: 1, 41: 1, 11: 2, 12: 1, 34: 2, 14: 3, 20: 2, 24: 2, 31: 1}
Did not match all atoms present	69915-28-2	C1=CC2=C3C(=C1)C=CC(=O)C3=C(C=C2)S	{25: 1, 14: 7, 39: 1}
Did not match all atoms present	69915-35-1	CNC1=C2C(=S)C=CC3=CC=CC(=C32)C=C1	{1: 1, 31: 1, 14: 7, 15: 1}
Did not match all atoms present	69915-36-2	CC(C)NC1=C2C(=S)C=CC3=CC=CC(=C32)C=C1	{31: 1, 1: 2, 3: 1, 14: 7, 15: 1}
Did not match all atoms present	6992-73-0	CC[N+]1=C(OC2=CC=CC=C21)C=CN(C3=CC=CC=C3)C(=O)C.[I-]	{1: 2, 2: 1, 6: 2, 33: 2, 14: 9, 19: 1, 23: 1, 24: 1}
Did not match all atoms present	6992-84-3	CC1=C(C=CC(=N1)N)N	{1: 1, 35: 1, 30: 2, 14: 2}
Did not match all atoms present	69921-20-6	CC1(OCC(CO1)(C)C2=CC=CC=C2)C	{1: 3, 11: 2, 13: 2, 14: 5, 23: 2}
Did not match all atoms present	69922-27-6	C1=CC(=C(C=C1C(F)(F)F)N=C=O)F	{34: 1, 4: 1, 8: 1, 14: 3, 16: 4, 29: 1}
Did not match all atoms present	69928-47-8	CC1CC(C(=O)C2=CC=CC=C12)C[NH+]3CCCCC3.[Cl-]	{1: 1, 2: 1, 11: 6, 12: 2, 14: 4, 17: 1, 25: 1}
Did not match all atoms present	69929-03-9	C1=CC(=CC=C1CCCCCCCCCCCCOCCCCCCCCCCCCC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O	{2: 24, 20: 2, 22: 1, 14: 8, 29: 4}
Did not match all atoms present	69929-04-0	CC(=O)O.CN(CC=C)CC=C.C=CC1=CC=CC=C1.C=CC(=O)N	{1: 2, 2: 2, 5: 4, 6: 4, 33: 1, 14: 5, 24: 1, 27: 1, 30: 1}
Did not match all atoms present	69929-09-5	CCCCCCCCCOC(=O)CC1=NC(CN1CC[O-])CC(=O)[O-].[Na+].[Na+]	{1: 1, 2: 12, 35: 1, 33: 1, 11: 1, 12: 1, 15: 1, 24: 1, 28: 1, 29: 1}
Did not match all atoms present	69929-14-2	C1=CC=C(C=C1)NC2=CC(=O)/C(=N\NC3=CC=C(C=C3)NC4=C(C=C(C=C4)N/N=C/5\C(=CC6=CC(=CC(=C6C5=O)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)/C=C2	{34: 2, 14: 18, 15: 4, 20: 3, 25: 2, 29: 6, 30: 1, 31: 4}
Did not match all atoms present	69929-18-6	CCC[CH2-].CCCCCCC[CH2-].[Mg+2]	{1: 2, 2: 8, 5: 2}
Did not match all atoms present	69938-68-7	CCN(CC)C1=C(C=C(C(=C1)C)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])[N+](=O)[O-])OC	{1: 4, 2: 2, 38: 2, 33: 1, 34: 2, 14: 4, 17: 1, 22: 1}
Did not match all atoms present	6994-14-5	CC(=O)N=C1C=CC=CN1O	{1: 1, 34: 1, 33: 1, 14: 4, 21: 1, 24: 1}
Did not match all atoms present	6994-25-8	CCOC(=O)C1=C(NN=C1)N	{32: 1, 1: 1, 2: 1, 35: 1, 14: 1, 28: 1, 30: 1}
Did not match all atoms present	6994-40-7	C1=CC(=CC=C1C(=O)C2=C(C=C(C=C2)O)O)[N+](=O)[O-]	{24: 1, 38: 1, 21: 2, 14: 7}
Did not match all atoms present	6994-51-0	C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)N3N=C4C=CC5=CC=CC=C5C4=N3)S(=O)(=O)OC6=CC=CC=C6	{33: 1, 35: 2, 6: 2, 14: 19, 22: 1, 29: 2}
Did not match all atoms present	6994-53-2	CN(C)CCCNS(=O)(=O)C1=C(C=CC(=C1)N2N=C3C=CC4=CC=CC=C4C3=N2)C=CC5=CC=CC=C5	{1: 2, 2: 3, 35: 2, 6: 2, 33: 2, 14: 14, 29: 2, 31: 1}
Did not match all atoms present	69943-47-1	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)F)Cl	{16: 1, 17: 1, 14: 8, 24: 1}
Did not match all atoms present	69943-64-2	COC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-].COC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-].[Na+].[Cr+3]	{1: 2, 34: 4, 14: 16, 28: 2, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	69943-68-6	CC(C)COC(=S)SC	{1: 3, 2: 1, 3: 1, 7: 1, 40: 1, 22: 1}
Did not match all atoms present	69943-71-1	CCCCCCCCCCCCCCCCCC(=O)N(CCCN(C)C)CCCN(C)C.COS(=O)(=O)OC	{1: 7, 2: 22, 33: 3, 22: 2, 24: 1, 29: 2}
Did not match all atoms present	69946-37-8	CC1=NC(=C(N1)C(=O)N)O	{32: 1, 1: 1, 35: 1, 21: 1, 24: 1, 30: 1}
Did not match all atoms present	69951-02-6	CC1=CC(=CC(=C1N)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 30: 1, 14: 2, 17: 1}
Did not match all atoms present	69957-42-2	CN(C)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)Cl	{1: 2, 33: 1, 14: 8, 6: 2, 17: 1}
Did not match all atoms present	69957-44-4	CS(=O)(=O)/C=C/C1=CC=C(C=C1)C#N	{1: 1, 37: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	6996-81-2	CCOP(=S)(C)OCC	{1: 3, 2: 2, 22: 2}
Did not match all atoms present	6996-92-5	C1=CC=C(C=C1)[Se](=O)O	{20: 1, 29: 1, 14: 5}
Did not match all atoms present	69966-44-5	CSCC1=CN=CC=C1	{40: 1, 1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	69975-86-6	CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3OCCO3	{1: 2, 2: 1, 35: 1, 33: 3, 11: 2, 12: 1, 14: 1, 23: 2, 25: 2}
Did not match all atoms present	6998-60-3	C[C@H]1/C=C/C=C(\C(=O)NC2=CC(=C3C(=C2O)C(=C(C4=C3C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)/C	{32: 1, 1: 9, 12: 8, 13: 1, 14: 6, 15: 1, 20: 2, 21: 3, 22: 1, 23: 2, 25: 2, 28: 1}
Did not match all atoms present	6999-03-7	C[Si](C)(C)C1=CC=C(C=C1)Br	{1: 3, 18: 1, 14: 4}
Did not match all atoms present	69991-76-0	C1=CC2=C(C(=C1)O)N=C(C=C2)Cl.[Zn]	{17: 1, 35: 1, 21: 1, 14: 5}
Did not match all atoms present	70-00-8	C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C(F)(F)F)CO)O	{32: 1, 33: 1, 2: 1, 4: 1, 11: 1, 12: 3, 14: 1, 16: 3, 20: 2, 23: 1, 25: 2}
Did not match all atoms present	70-07-5	COC1=CC=CC=C1OCC2CNC(=O)O2	{32: 1, 1: 1, 2: 1, 11: 1, 12: 1, 14: 4, 22: 2, 28: 1}
Did not match all atoms present	70-11-1	C1=CC=C(C=C1)C(=O)CBr	{24: 1, 2: 1, 18: 1, 14: 5}
Did not match all atoms present	70-29-1	CCS(=O)CC	{1: 2, 2: 2, 29: 1}
Did not match all atoms present	70-30-4	C1=C(C(=C(C(=C1Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)O)O)Cl	{17: 6, 2: 1, 21: 2, 14: 2}
Did not match all atoms present	70-34-8	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F	{16: 1, 38: 2, 14: 3}
Did not match all atoms present	70-38-2	CC1=CC(=C(C=C1)COC(=O)C2C(C2(C)C)C=C(C)C)C	{1: 6, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 3, 28: 1}
Did not match all atoms present	70-55-3	CC1=CC=C(C=C1)S(=O)(=O)N	{1: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	70-69-9	CCC(=O)C1=CC=C(C=C1)N	{24: 1, 1: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	70-70-2	CCC(=O)C1=CC=C(C=C1)O	{24: 1, 1: 1, 2: 1, 21: 1, 14: 4}
Did not match all atoms present	70-78-0	C1=CC(=C(C=C1C[C@@H](C(=O)O)N)I)O	{2: 1, 3: 1, 14: 3, 19: 1, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	700-00-5	CN1C=NC2=C1N=CN=C2N	{1: 1, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	700-02-7	C1=NC2=C(N(C=NC2=N1)O)N	{33: 1, 30: 1, 35: 3, 21: 1, 14: 2}
Did not match all atoms present	700-06-1	C1=CC=C2C(=C1)C(=CN2)CO	{32: 1, 2: 1, 20: 1, 14: 5}
Did not match all atoms present	700-12-9	CC1=CC(=C(C(=C1C)C)C)C	{1: 5, 14: 1}
Did not match all atoms present	700-13-0	CC1=CC(=C(C(=C1O)C)C)O	{1: 3, 21: 2, 14: 1}
Did not match all atoms present	700-16-3	C1(=C(C(=NC(=C1F)F)F)F)F	{16: 5, 35: 1}
Did not match all atoms present	700-17-4	C1=C(C(=C(C(=C1F)F)N)F)F	{16: 4, 30: 1, 14: 1}
Did not match all atoms present	700-38-9	CC1=CC(=C(C=C1)[N+](=O)[O-])O	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	700-44-7	COC1=CC=CC(=C1C=O)O	{1: 1, 22: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	700-49-2	C1=NC2=C(N1)C(=NC(=N2)F)N	{16: 1, 32: 1, 35: 3, 30: 1, 14: 1}
Did not match all atoms present	700-63-0	C1=CC=C(C=C1)C(C(=O)N)N	{24: 1, 3: 1, 30: 2, 14: 5}
Did not match all atoms present	700-75-4	CN(C)C1=CC=CC=C1OC	{1: 3, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	700-84-5	C1CC(=O)C2=C1C=C(C=C2)F	{16: 1, 25: 1, 11: 2, 14: 3}
Did not match all atoms present	700-87-8	COC1=CC=CC=C1N=C=O	{1: 1, 34: 1, 8: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	700-88-9	C1CCC(C1)C2=CC=CC=C2	{11: 4, 12: 1, 14: 5}
Did not match all atoms present	700-96-9	COC1=C(C=C(C=C1)S)OC	{1: 2, 22: 2, 14: 3, 39: 1}
Did not match all atoms present	7000-29-5	C(=O)([O-])OC(=O)[O-].C(=O)([O-])OC(=O)[O-].[Mg+2].[Ca+2]	{}
Did not match all atoms present	70008-54-7	C(C(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O)C(=O)O	{33: 1, 2: 3, 3: 1, 20: 4, 27: 2, 29: 2}
Did not match all atoms present	70021-42-0	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=C(C=C5)[N+](=O)[O-])C=C3	{38: 1, 14: 11}
Did not match all atoms present	70021-98-6	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C(C=CC(=C54)C=C3)[N+](=O)[O-]	{38: 1, 14: 11}
Did not match all atoms present	70024-58-7	C=CCOC(=O)C1=CC=CC=C1.C=CC1=CC=CC=C1.C1CC(=O)OC1=O	{2: 1, 5: 2, 6: 2, 11: 2, 14: 10, 28: 3}
Did not match all atoms present	70024-63-4	CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl	{1: 3, 2: 1, 4: 1, 11: 1, 12: 1, 14: 12, 17: 1, 20: 1, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	70024-64-5	CC(=C)/C=C/[Al]	{1: 1, 5: 1, 6: 2, 7: 1}
Did not match all atoms present	70024-82-7	CCCCCCCCCCCC1=NCCN1CCO.C(C(CCl)O)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 14, 3: 1, 33: 1, 11: 2, 15: 1, 17: 1, 35: 1, 20: 2, 29: 3}
Did not match all atoms present	7005-72-3	C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl	{17: 1, 22: 1, 14: 9}
Did not match all atoms present	70050-43-0	C1=C(NC=N1)CC(CF)(C(=O)O)N	{32: 1, 2: 2, 35: 1, 4: 1, 14: 2, 16: 1, 27: 1, 30: 1}
Did not match all atoms present	7006-52-2	CNC1=CC(=CC=C1)Cl	{1: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	7006-60-2	C1=CC=C(C=C1)C[N+](CCO)(CCO)CCO.[Cl-]	{17: 1, 2: 7, 20: 3, 14: 5}
Did not match all atoms present	7008-42-6	CC1(C=CC2=C3C(=C(C=C2O1)OC)C(=O)C4=CC=CC=C4N3C)C	{1: 4, 33: 1, 13: 1, 14: 7, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	7008-85-7	C1=N/C(=C(/N)\[O-])/C(=N1)[N+]#N	{34: 1, 35: 2, 7: 1, 14: 1, 15: 2, 30: 1}
Did not match all atoms present	70085-02-8	CC1CCC2=CC(=C(C=C2N1CCO)C)N=NC3=C(C=C(S3)C(=O)C(C)C)C(=O)OC	{1: 5, 2: 2, 3: 1, 33: 1, 41: 1, 11: 2, 12: 1, 34: 2, 14: 3, 20: 1, 24: 1, 28: 1}
Did not match all atoms present	70086-65-6	CSC1=CC=C(C=C1)[Se]C	{40: 1, 1: 2, 14: 4}
Did not match all atoms present	70086-66-7	C[Se]C1=CC=CC(=C1)N	{1: 1, 30: 1, 14: 4}
Did not match all atoms present	70086-67-8	C[Se]C1=CC=CC=C1N	{1: 1, 30: 1, 14: 4}
Did not match all atoms present	7009-49-6	C1CCC(CC1)(CC(=O)[O-])CO.[Na+]	{24: 1, 2: 2, 11: 5, 20: 1, 13: 1}
Did not match all atoms present	7009-61-2	CCCCCCCCCCCC[N+](C)(C)CCO.[Br-]	{1: 3, 2: 13, 20: 1, 18: 1}
Did not match all atoms present	7009-88-3	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C.CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C.C1C(NCC(N1)C2=CC=CC=C2)C3=CC=CC=C3	{32: 2, 1: 4, 2: 2, 33: 2, 41: 2, 11: 2, 12: 8, 13: 2, 14: 20, 24: 2, 25: 2, 27: 2, 31: 2}
Did not match all atoms present	70091-75-7	CCOC(=O)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4, 24: 1, 28: 1}
Did not match all atoms present	701-30-4	CC(C)(C)C1=CC=C(C=C1)F	{16: 1, 1: 3, 4: 1, 14: 4}
Did not match all atoms present	701-34-8	C1=CC(=CC=C1S(=O)(=O)N)Br	{18: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	701-35-9	CC1=CC=C(C=C1)[Si](Cl)(Cl)Cl	{1: 1, 14: 4, 17: 3}
Did not match all atoms present	701-47-3	CCC(C1=CC=C(C=C1)F)O	{1: 1, 2: 1, 3: 1, 14: 4, 16: 1, 20: 1}
Did not match all atoms present	701-51-9	C1=C(OC(=C1)[N+](=O)[O-])C(=O)N	{24: 1, 38: 1, 30: 1, 14: 2, 23: 1}
Did not match all atoms present	701-56-4	CN(C)C1=CC=C(C=C1)OC	{1: 3, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	701-57-5	CSC1=CC=C(C=C1)[N+](=O)[O-]	{40: 1, 1: 1, 38: 1, 14: 4}
Did not match all atoms present	701-70-2	CCC(CC1=CC=CC=C1)O	{1: 1, 2: 2, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	701-73-5	CSC(=S)NC1=CC=CC=C1	{40: 1, 1: 1, 31: 1, 14: 5, 7: 1}
Did not match all atoms present	701-82-6	C1=CC(=CC(=C1)O)NC(=O)N	{24: 1, 30: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	701-83-7	CC(=O)OC1=CC(=CC=C1)F	{16: 1, 1: 1, 28: 1, 14: 4}
Did not match all atoms present	701-99-5	C1=CC=C(C=C1)OCC(=O)Cl	{24: 1, 17: 1, 2: 1, 22: 1, 14: 5}
Did not match all atoms present	70114-87-3	COC(=O)CC[C@@H](C(=O)O)NC(=O)C1=CC=C(C=C1)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N	{32: 1, 1: 1, 2: 3, 3: 1, 14: 5, 35: 3, 24: 1, 25: 1, 27: 1, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	70116-35-7	CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CC(C)CC	{1: 3, 2: 9, 3: 1, 28: 1, 14: 12}
Did not match all atoms present	70117-12-3	CCCCCCCCCCCCCCCCCCNC(=O)NS(=O)(=O)CCCl	{1: 1, 2: 19, 17: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	7012-16-0	C1C2=C(C=CC(=C2)Cl)C3=C1C=C(C=C3)Cl	{17: 2, 11: 1, 14: 6}
Did not match all atoms present	7012-37-5	C1=CC(=CC=C1C2=C(C=C(C=C2)Cl)Cl)Cl	{17: 3, 14: 7}
Did not match all atoms present	70124-77-5	CC(C)C(C1=CC=C(C=C1)OC(F)F)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3	{1: 2, 3: 4, 37: 1, 14: 13, 16: 2, 22: 2, 28: 1}
Did not match all atoms present	70134-26-8	C1CCC(C(C1)Cl)[Se](C2CCCCC2Cl)(Cl)Cl	{17: 4, 11: 8, 12: 4}
Did not match all atoms present	70134-71-3	C1(=NO[N+](=C1Br)[O-])Br	{33: 1, 18: 2, 35: 1, 23: 1}
Did not match all atoms present	70136-01-5	CCCCCCCCCCOC(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 9, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	70145-54-9	C1=C(OC=C(C1=O)O)C[O-].[Na+]	{2: 1, 14: 2, 21: 1, 23: 1, 25: 1, 29: 1}
Did not match all atoms present	70145-55-0	C(C[Se][Se]CCC(=O)[O-])C(=O)O.[Na+]	{24: 1, 2: 4, 27: 1}
Did not match all atoms present	70145-56-1	COC(CC1C(=O)NC(=O)NC1=O)C[Hg].[OH-].[Na+]	{32: 2, 1: 1, 2: 2, 3: 1, 12: 1, 22: 1, 25: 3}
Did not match all atoms present	70145-60-7	CCCCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)[O-].CCCCC1=C(N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)[O-].[Ca+2]	{1: 2, 2: 6, 33: 4, 14: 20, 25: 2}
Did not match all atoms present	70145-80-1	C1=CN=CC=C1C2=NN=C(S2)N.Cl	{17: 1, 35: 3, 30: 1, 14: 4, 41: 1}
Did not match all atoms present	70145-82-3	COC1=CC=C(C=C1)SCCN[NH3+].C(=C\C(=O)[O-])\C(=O)O	{1: 1, 2: 2, 6: 2, 40: 1, 14: 4, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	70145-83-4	COC1=CC=C(C=C1)OCCN[NH3+].[Cl-]	{1: 1, 2: 2, 14: 4, 17: 1, 22: 2, 31: 1}
Did not match all atoms present	70145-99-2	CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC=C(C(=C1)C(=O)O)[O-].[Na+]	{1: 3, 4: 1, 5: 1, 14: 8, 21: 1, 27: 1}
Did not match all atoms present	70146-00-8	C=O.C1=CC=C(C=C1)O.[O-]S(=O)[O-].[O-]S(=O)[O-].[Na+].[Na+]	{29: 6, 5: 1, 14: 5, 21: 1}
Did not match all atoms present	70146-02-0	CC(C)(C)C1=CC=C(C=C1)O.C1=CC=C(C=C1)C=O.P(Cl)(Cl)Cl	{1: 3, 4: 1, 14: 9, 17: 3, 21: 1, 26: 1}
Did not match all atoms present	70146-05-3	CC1=C(C=CC(=C1)C(C)(C)C2=CC(=C(C=C2)OCC(C)OC(=O)C=C)C)OCC(C)OC(=O)C=C	{1: 6, 2: 2, 3: 2, 4: 1, 5: 2, 6: 2, 14: 6, 22: 2, 28: 2}
Did not match all atoms present	70146-06-4	CC1=C(C=CC(=C1)C(C)(C)C2=CC(=C(C=C2)OCC(C)OC(=O)C(=C)C)C)OCC(C)OC(=O)C(=C)C	{1: 8, 2: 2, 3: 2, 4: 1, 5: 2, 7: 2, 14: 6, 22: 2, 28: 2}
Did not match all atoms present	70146-07-5	C1=CC(=C(C=C1N)Cl)C2=C(C=C(C=C2)N)Cl.OS(=O)(=O)O	{17: 2, 30: 2, 20: 2, 29: 2, 14: 6}
Did not match all atoms present	70146-08-6	CCN(CC)C1=CC=CC(=C1)NC(=O)OCCOCC	{1: 3, 2: 5, 33: 1, 14: 4, 22: 1, 28: 1, 31: 1}
Did not match all atoms present	70146-09-7	CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)Cl)N	{1: 1, 30: 1, 29: 2, 14: 7, 17: 1}
Did not match all atoms present	70161-10-3	CC(CCC1=CC2=C(C=C1)OCO2)NCC(C3=CC(=C(C=C3)O)C(=O)N)O.Cl	{1: 1, 2: 3, 3: 2, 11: 1, 14: 6, 17: 1, 20: 1, 21: 1, 23: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	70161-13-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]	{35: 3, 14: 12, 17: 1, 25: 2, 29: 9, 30: 1, 31: 3}
Did not match all atoms present	70161-45-4	C=CC=C.C=CC#N.C=CC1=CC=CC=C1.C=O.C1=CC=C(C=C1)O	{14: 10, 37: 1, 5: 5, 6: 4, 21: 1}
Did not match all atoms present	70161-58-9	CC1=CC=C(C=C1)S(=O)(=O)OCC(COCC=C)O	{1: 1, 2: 3, 3: 1, 5: 1, 6: 1, 14: 4, 20: 1, 22: 2, 29: 2}
Did not match all atoms present	70179-69-0	CNS(=O)(=O)C1=C(C=C(C(=C1)[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-])Cl.CNS(=O)(=O)C1=C(C=C(C(=C1)[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-])Cl.[Na+].[Co]	{1: 2, 34: 4, 14: 16, 17: 2, 29: 4, 31: 2}
Did not match all atoms present	70179-77-0	CC1=CC(=C(C(=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OCCOCCOC)C)S(=O)(=O)[O-])C.[Na+]	{1: 4, 2: 4, 14: 6, 22: 3, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	70179-78-1	CCN(CC)C1=CC2=C(C=C1)C=C3C(=C(C(=N)N4C3=NC5=CC=CC=C5C4)C(=O)N)C2	{1: 2, 2: 2, 35: 1, 36: 1, 33: 2, 11: 2, 14: 8, 24: 1, 30: 1}
Did not match all atoms present	70179-79-2	C(=O)O.C(=O)O.C(=O)O.C(=O)O.N	{26: 4, 27: 4}
Did not match all atoms present	70179-80-5	CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOCCOCCOCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 22, 22: 7, 14: 4}
Did not match all atoms present	70179-81-6	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=CC(=O)C2=NN)S(=O)(=O)O	{34: 1, 38: 1, 14: 4, 15: 2, 20: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	70179-86-1	[H+].[H+].[H+].C.C.CN(C)C1=CC=C(C=C1)C(=N)C2=CC=C(C=C2)N(C)C.Cl	{1: 4, 36: 1, 33: 2, 7: 1, 14: 8, 17: 1}
Did not match all atoms present	70185-87-4	CC(=O)CC(=O)NC1=CC(=C(C=C1)NC(=O)CC(=O)C)S(=O)(=O)O	{1: 2, 2: 2, 14: 3, 20: 1, 24: 4, 29: 2, 31: 2}
Did not match all atoms present	70193-21-4	CCCCOC(C(Cl)(Cl)Cl)NC(=O)C1=CC=CC=C1O	{1: 1, 2: 3, 3: 1, 4: 1, 14: 4, 17: 3, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	70197-13-6	[CH3-].O=[Re](=O)=O	{29: 3}
Did not match all atoms present	70198-16-2	CC1(C2=CC=CC=C2N(C1=CN=NC3=CC=C(C=C3)NC4=CC=CC=C4)C)C	{1: 3, 34: 2, 6: 1, 33: 1, 13: 1, 14: 13, 15: 1, 31: 1}
Did not match all atoms present	70198-18-4	CCCCCCCCCCCCCCCCCOCCOCCOCCOCCOP(=O)(O)O	{1: 1, 2: 24, 20: 2, 29: 1, 22: 5}
Did not match all atoms present	70198-21-9	CC(CC1=CC=CC=C1OCCOCCS(=O)(=O)[O-])CC(C)(C)C.[Na+]	{1: 4, 2: 6, 3: 1, 4: 1, 14: 4, 22: 2, 29: 3}
Did not match all atoms present	70198-25-3	CC1=CC=CC=C1O.C=O.C(=O)(C(=O)O)O	{1: 1, 27: 2, 5: 1, 14: 4, 21: 1}
Did not match all atoms present	70198-27-5	C=O.C1=CC=C(C=C1)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{2: 2, 4: 1, 5: 1, 14: 5, 20: 1, 21: 1, 27: 3}
Did not match all atoms present	70198-30-0	C(CO)O.C(COCCO)O.O=P(=O)OP(=O)=O	{2: 6, 20: 4, 29: 4, 22: 2}
Did not match all atoms present	70198-64-0	[Ga+3].[OH-]	{}
Did not match all atoms present	702-16-9	CCCCC1=CN=C(C=C1)C	{1: 2, 2: 3, 35: 1, 14: 3}
Did not match all atoms present	702-23-8	COC1=CC=C(C=C1)CCO	{1: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	702-24-9	CNCC1=CC=C(C=C1)OC	{1: 2, 2: 1, 22: 1, 14: 4, 31: 1}
Did not match all atoms present	70209-90-4	COC1=C(C2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)N=NC3=C(C=C(C=C3)NC(=O)C4=CC(=CC=C4)N/N=C\5/C=CC(=O)C(=C5)C(=O)[O-])S(=O)(=O)[O-])N/N=C\6/C(=CC7=CC(=CC(=C7C6=O)NC(=O)C8=CC(=CC=C8)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 4, 14: 21, 15: 4, 22: 1, 24: 3, 25: 2, 29: 12, 30: 1, 31: 4}
Did not match all atoms present	70209-94-8	C1=C(C=C2C(=C1[N+](=O)[O-])NN(C2=O)C3=CC(=C(C=C3Cl)S(=O)(=O)[O-])Cl)[N+](=O)[O-].[Na+]	{32: 1, 33: 1, 38: 2, 14: 4, 17: 2, 25: 1, 29: 3}
Did not match all atoms present	70209-95-9	C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N.[Na+]	{36: 1, 14: 13, 15: 5, 22: 1, 25: 1, 29: 5, 31: 2}
Did not match all atoms present	7021-09-2	COC(C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	7021-46-7	C1=CC(=O)C(=CC=C1N)O	{25: 1, 30: 1, 21: 1, 14: 4}
Did not match all atoms present	70210-03-6	C[N+](C)(C)CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O.[Cl-]	{1: 3, 2: 1, 14: 10, 17: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	70210-04-7	CCCCCC1=CC=C(C=C1)OC2=CC=CC=C2N/N=C/3\C(=CC4=C(C=CC(=C4C3=O)NC(=O)COC5=CC=CC(=C5)NC(=O)CCl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 6, 34: 1, 14: 15, 15: 2, 17: 1, 22: 2, 24: 2, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	70210-07-0	C1=CC(=CC=C1N/N=C/2\C=C(C(=CC2=O)O)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])N=NC4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+]	{34: 5, 14: 14, 15: 3, 20: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	70210-13-8	CC1=CC(=C(C=C1N=NC2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC3=C4C=CC=C(C4=C(C=C3)NC5=NC(=NC(=N5)N)Cl)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 35: 3, 14: 10, 17: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	70210-16-1	CC1=CC(=C2C(=C1NC3=C4C(=C(C=C3)NC(=O)C5=CC=CC=C5)C(=O)C6=CC=CC=C6C4=O)C(=O)C7=CC=CC=C7C2=O)NC8=C9C(=C(C=C8)NC(=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1C9=O	{24: 2, 1: 1, 31: 4, 14: 27, 25: 6}
Did not match all atoms present	70210-18-3	C1=CC=C2C(=C1)C(=C/C(=N\NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)Cl)NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 1, 35: 3, 14: 11, 15: 2, 17: 1, 25: 1, 29: 12, 31: 3}
Did not match all atoms present	70210-19-4	COC1=CC(=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NCC4=NC(=NC(=N4)Cl)OC)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 1, 35: 3, 34: 1, 14: 7, 15: 2, 17: 1, 22: 2, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	70210-26-3	CC(C)OC1=NC(=NC(=N1)NC2=CC(=C(C=C2)N=NC3=C(C=C4C=C(C=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)Cl.[Na+].[Na+].[Na+]	{1: 2, 34: 2, 3: 1, 14: 7, 17: 1, 35: 3, 22: 1, 24: 1, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	70210-27-4	CCOCCOC1=NC(=NC(=N1)NC2=C(C(=C(C(=C2C)NC3=CC(=C(C4=C3C(=O)C5=CC=CC=C5C4=O)N)S(=O)(=O)[O-])C)S(=O)(=O)[O-])C)Cl.[Na+].[Na+]	{1: 4, 2: 3, 35: 3, 14: 5, 17: 1, 22: 2, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	70210-31-0	C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=O)/C(=N/NC4=C5C=CC(=CC5=C(C=C4)N=NC6=C7C=CC(=CC7=C(C=C6)N=NC8=CC(=C(C=C8)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 5, 14: 22, 15: 2, 24: 1, 25: 1, 29: 12, 30: 1, 31: 2}
Did not match all atoms present	70210-33-2	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=C4C(=C3O)C=CC(=C4N=NC5=C(C=C(C=C5)[N+](=O)[O-])C(=O)[O-])N)S(=O)(=O)[O-])OC)N=NC6=C(C=C7C(=C6O)C=CC(=C7N=NC8=C(C=C(C=C8)[N+](=O)[O-])C(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 8, 38: 2, 14: 18, 21: 2, 22: 2, 24: 2, 29: 6, 30: 2}
Did not match all atoms present	70210-35-4	COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=CC=CC=C4S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6N=NC7=CC(=CC=C7)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 7, 14: 18, 15: 2, 22: 2, 25: 1, 29: 12, 30: 1, 31: 1}
Did not match all atoms present	70210-36-5	CS(=O)(=O)C1=CC(=C(C=C1)O)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC=C(C=C4)NNC5=CC=C(C=C5)C(=O)NC6=CC7=C(C=C6)C(=O)/C(=N/N=C\8/C=C(C=CC8=O)S(=O)(=O)C)/C(=C7)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 3, 14: 22, 15: 6, 21: 1, 24: 2, 25: 3, 29: 10, 31: 5}
Did not match all atoms present	70210-38-7	C1=CC=C(C=C1)NC2=C(C=C(C=C2)NC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4C(=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{24: 2, 38: 1, 29: 3, 14: 15, 31: 2}
Did not match all atoms present	70210-43-4	C1=CC=C(C(=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NCC4=NC(=NC(=N4)Cl)NC5=CC=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 1, 35: 3, 34: 1, 14: 12, 15: 2, 17: 1, 25: 1, 29: 9, 31: 3}
Did not match all atoms present	70210-44-5	CC1=NNC(=O)C1NNC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)N=NC4=C/C(=N/N=C\5/C=C(C=CC5=O)N/N=C/6\C=CC(=O)C(=C6)C(=O)[O-])/C(=CC4=O)O.[Na+]	{32: 1, 1: 1, 34: 5, 35: 1, 12: 1, 14: 16, 15: 8, 20: 1, 24: 2, 25: 4, 31: 4}
Did not match all atoms present	70210-45-6	C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N)NNC5=C6C(=CC(=CC6=O)S(=O)(=O)[O-])C=CC5=N.[Na+].[Na+]	{36: 2, 14: 16, 15: 10, 25: 2, 29: 8, 31: 4}
Did not match all atoms present	70210-47-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)S(=O)(=O)[O-])NC5=NC(=NC(=N5)NC6=CC(=C(C=C6)N=NC7=C(C=C8C=C(C=C(C8=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)Cl)S(=O)(=O)[O-])N.[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 2, 35: 3, 14: 15, 17: 1, 24: 1, 25: 2, 29: 15, 30: 2, 31: 4}
Did not match all atoms present	70213-45-5	COC1=CC2=C(C(=C1)C(=O)OC)NC(=O)C(=C)O2	{32: 1, 1: 2, 5: 1, 14: 2, 15: 1, 22: 1, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	70218-66-5	CCC(CO)NCC1=CC=C(C=C1)Cl	{1: 1, 2: 3, 3: 1, 14: 4, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	70219-24-8	C1=CC(=C(C=C1CC(C(F)F)N)O)O	{2: 1, 3: 2, 14: 3, 16: 2, 21: 2, 30: 1}
Did not match all atoms present	70224-81-6	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[V].[V].[V].[V].[Hg+2]	{}
Did not match all atoms present	70224-83-8	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)Cl)NC4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)NC6=NC(=NC(=N6)NC7=CC(=C(C=C7)S(=O)(=O)[O-])N=NC8C(=NN(C8=O)C9=CC(=C(C=C9Cl)S(=O)(=O)[O-])Cl)C)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])C1=CC(=C(C=C1Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 35: 8, 6: 2, 33: 2, 12: 2, 14: 16, 15: 2, 17: 6, 25: 2, 29: 18, 31: 4}
Did not match all atoms present	70224-85-0	CC1=CC(=C(C=C1N=NC2=CC(=C(C=C2)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C)OC)NC(=O)C5=CC=C(C=C5)N/N=C/6\C=CC(=O)C(=C6)C(=O)[O-].[Na+].[Na+].[Na+]	{1: 3, 34: 5, 14: 17, 15: 2, 22: 1, 24: 2, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	70224-86-1	CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)[O-])C=C(/C(=N/NC3=C(C=CC(=C3)NC(=O)C(=C)Br)S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 1, 5: 1, 7: 1, 14: 6, 15: 2, 18: 1, 24: 2, 25: 1, 29: 9, 31: 3}
Did not match all atoms present	70224-88-3	CC(C)NC1=C2C(=C(C=C1)NC(C)CCC3=CC=CC=C3S(=O)(=O)[O-])C(=O)C4=CC=CC=C4C2=O.[Na+]	{1: 3, 2: 2, 3: 2, 14: 10, 25: 2, 29: 3, 31: 2}
Did not match all atoms present	70225-20-6	C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[O-]S(=O)(=O)[O-]	{1: 6, 2: 6, 4: 14, 16: 30, 29: 8, 31: 2}
Did not match all atoms present	70225-22-8	C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F.C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F.[O-]S(=O)(=O)[O-]	{1: 6, 2: 6, 4: 8, 16: 18, 29: 8, 31: 2}
Did not match all atoms present	70225-24-0	C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F.C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F.[O-]S(=O)(=O)[O-]	{1: 6, 2: 6, 4: 10, 16: 22, 29: 8, 31: 2}
Did not match all atoms present	70225-26-2	C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[O-]S(=O)(=O)[O-]	{1: 6, 2: 6, 4: 16, 16: 34, 29: 8, 31: 2}
Did not match all atoms present	70225-27-3	CC1CO1.C1CO1.C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O.N	{1: 1, 2: 2, 3: 4, 11: 3, 12: 1, 20: 6, 23: 2}
Did not match all atoms present	70225-28-4	CC1CO1.C1CO1.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O.N	{1: 1, 2: 3, 11: 3, 12: 9, 13: 1, 20: 8, 22: 1, 23: 4}
Did not match all atoms present	70236-40-7	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC(=CC=C3)Cl.COC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)C)[O-].[Na+].[Cr+3]	{1: 4, 34: 4, 35: 1, 33: 1, 14: 15, 17: 1, 28: 1, 29: 4, 31: 1}
Did not match all atoms present	70236-43-0	CC(CO)NS(=O)(=O)C1=CC2=C(C=C1)C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)Cl)[O-].CC(CO)NS(=O)(=O)C1=CC2=C(C=C1)C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)Cl)[O-].[Na+].[Cr+3]	{1: 2, 2: 2, 3: 2, 34: 4, 14: 16, 17: 2, 20: 2, 29: 4, 31: 2}
Did not match all atoms present	70236-44-1	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC=C(C=C3)Cl.[Na+].[Co+3]	{1: 4, 34: 4, 35: 2, 33: 2, 14: 14, 17: 2, 29: 4}
Did not match all atoms present	70236-46-3	CN1C=C[N+](=C1N=NC2=CC=C(C=C2)N(C)C)C.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 34: 2, 33: 3, 14: 6, 17: 3}
Did not match all atoms present	70236-54-3	C1=CC(=C(C2=C1C(=CC(=C2N)S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])NC4=C(C(=NC(=N4)Cl)Cl)Cl.[Na+].[Na+].[Na+].[Cu+2]	{34: 2, 35: 2, 14: 5, 17: 3, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	70239-57-5	CC1=C(C=C2C(=C1)C=C3C(=NC(=O)N(C3=O)C)N2C)C	{1: 4, 35: 1, 33: 2, 14: 3, 25: 2}
Did not match all atoms present	7024-33-1	B1(OCCC(O1)C)OCCN(C)C	{1: 3, 2: 2, 33: 1, 11: 2, 12: 1, 22: 1, 23: 2}
Did not match all atoms present	70244-12-1	C/C(=C(/C)\C1=CC=C(C=C1)OC(=O)C)/C2=CC=C(C=C2)OC(=O)C	{1: 4, 28: 2, 14: 8, 7: 2}
Did not match all atoms present	70247-25-5	CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 9, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	70247-32-4	C(#N)C1=NN=N[N-]1.N.N.N.[NH2-].[NH2-].[O-]Cl(=O)(=O)=O.[Co+3]	{17: 1, 35: 4, 29: 4, 37: 1}
Did not match all atoms present	70247-68-6	CC\1=NN(C(=N)/C1=N/NC2=CC=CC=C2S(=O)(=O)OC3=CC=CC=C3Cl)C4=C(C=CC(=C4)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 34: 1, 35: 1, 36: 1, 33: 1, 14: 11, 15: 3, 17: 2, 22: 1, 29: 5, 31: 1}
Did not match all atoms present	70247-72-2	C1=CC(=CC=C1NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=CC(=CC(=C4[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC5=C(C(=NC(=N5)Cl)Cl)Cl.[Na+].[Na+].[Na+].[Cu+2]	{34: 2, 35: 2, 14: 10, 17: 3, 29: 9, 31: 2}
Did not match all atoms present	70247-77-7	CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)N)C(=O)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)N)C(=O)[O-])[O-])C3=CC=C(C=C3)Cl.[Na+].[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 14, 17: 2, 24: 2, 29: 4, 30: 2}
Did not match all atoms present	70248-52-1	C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[O-]S(=O)(=O)[O-]	{1: 6, 2: 6, 4: 12, 16: 26, 29: 8, 31: 2}
Did not match all atoms present	70248-53-2	CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].C(CO)NCCO.[Na+].[Na+].[Na+].[Na+]	{1: 2, 2: 4, 34: 4, 14: 16, 20: 2, 24: 1, 29: 12, 31: 3}
Did not match all atoms present	7025-19-6	C1C(=O)N(C(=S)S1)CCC(=O)O	{33: 1, 2: 2, 41: 1, 11: 1, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	70254-65-8	CC1=C2C(=CC=C1)N=C3C(=NC(=O)N(C3=O)C)N2C	{1: 3, 35: 2, 33: 2, 14: 3, 25: 2}
Did not match all atoms present	70258-18-3	C1=CC(=NC=C1CCl)Cl	{17: 2, 2: 1, 35: 1, 14: 3}
Did not match all atoms present	70262-78-1	CCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)OCC	{1: 2, 34: 1, 6: 1, 2: 3, 14: 8, 22: 2}
Did not match all atoms present	70268-41-6	CCCCC(=O)[O-].CCCCC(=O)[O-].[Mn+2]	{24: 2, 1: 2, 2: 6}
Did not match all atoms present	70277-99-5	COC1=CC(=C(C(=C1)N)Br)OC	{1: 2, 18: 1, 30: 1, 22: 2, 14: 2}
Did not match all atoms present	70278-00-1	C1=CC=C(C=C1)N(Cl)Cl	{17: 2, 14: 5, 33: 1}
Did not match all atoms present	70281-39-9	CC(=O)/C(=N/NC1=C(C=CC(=C1)S(=O)(=O)C)[O-])/C(=NC2=CC=CC=C2)[O-].COC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)C)[O-].[Na+].[Cr+3]	{1: 4, 34: 4, 7: 2, 14: 16, 24: 1, 28: 1, 29: 4, 31: 2}
Did not match all atoms present	70281-40-2	CC1=CC=C(C=C1)N2C(=C(C(=N2)C)N=NC3=C(C=CC(=C3)S(=O)(=O)NC)[O-])[O-].CC1=CC=C(C=C1)N2C(=C(C(=N2)C)N=NC3=C(C=CC(=C3)S(=O)(=O)NC)[O-])[O-].[Na+].[Co+3]	{1: 6, 34: 4, 35: 2, 33: 2, 14: 14, 29: 4, 31: 2}
Did not match all atoms present	70288-75-4	COC(=O)C(CC1=CC=CC=C1)NC(=O)OC	{1: 2, 2: 1, 3: 1, 14: 5, 28: 2, 31: 1}
Did not match all atoms present	70288-95-8	CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=C(C=C3)S(=O)(=O)NC)[O-].CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=CC(=CC(=C3[O-])NC(=O)C)[N+](=O)[O-].[Na+].[Cr+3]	{1: 4, 34: 4, 38: 1, 14: 15, 24: 3, 29: 2, 31: 4}
Did not match all atoms present	70289-00-8	CC(C)OC(CCC#N)C1=CC=CC=C1	{1: 2, 2: 2, 3: 2, 37: 1, 14: 5, 22: 1}
Did not match all atoms present	70289-03-1	CCC(C)(CC#N)C1=CC=C(C=C1)Cl	{1: 2, 2: 2, 4: 1, 37: 1, 14: 4, 17: 1}
Did not match all atoms present	70289-04-2	CCC(C)(CC1=CC=CC=C1)C(C#N)C(=O)OCC	{1: 3, 2: 3, 3: 1, 4: 1, 37: 1, 14: 5, 28: 1}
Did not match all atoms present	70289-05-3	CCNP(=O)(C1=CC=C(C=C1)N)NCC	{1: 2, 2: 2, 14: 4, 29: 1, 30: 1, 31: 2}
Did not match all atoms present	70289-08-6	CCCC(C1=CC(=C(C=C1)OC)OC)C(=O)CC	{1: 4, 2: 3, 3: 1, 14: 3, 22: 2, 24: 1}
Did not match all atoms present	70289-10-0	CC1=C(C(=CC=C1)Cl)NC(=O)CN(C)C	{1: 3, 2: 1, 33: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	70289-11-1	CC1=C(C(=CC=C1)Cl)NC(=O)C(C)C	{1: 3, 3: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	70289-12-2	CCOC1=CC=CC=C1CC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	70289-13-3	C1=CC=C(C(=C1)CNC(=O)CCl)Cl	{24: 1, 17: 2, 2: 2, 14: 4, 31: 1}
Did not match all atoms present	70289-16-6	CC1=C(C=CC(=C1)OCN(C)C)Cl	{1: 3, 2: 1, 33: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	70289-19-9	CCCCCCCCN(CCCCC)CC1=CC=CC=C1	{1: 2, 2: 12, 14: 5, 33: 1}
Did not match all atoms present	70289-20-2	CCOC1=CC=CC=C1NCN2C(=O)CCC2=O	{1: 1, 2: 2, 33: 1, 11: 2, 14: 4, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	70289-21-3	C1CC(=O)N(C1=O)CNC2=CC(=CC=C2)Cl	{33: 1, 2: 1, 11: 2, 14: 4, 17: 1, 25: 2, 31: 1}
Did not match all atoms present	70289-23-5	C1CC(=O)N(C1=O)CNC2=CC3=CC=CC=C3N=C2	{33: 1, 2: 1, 35: 1, 11: 2, 14: 6, 25: 2, 31: 1}
Did not match all atoms present	70289-24-6	CC1CC2=C(CC1C)C3(C4=CC=CC=C4C2O3)C	{1: 3, 11: 2, 12: 3, 13: 1, 14: 4, 15: 2, 23: 1}
Did not match all atoms present	70289-27-9	CCCCCCCCOC1=CC=CC=N1	{1: 1, 2: 7, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	70289-28-0	COCCC1=CC=NC=C1	{1: 1, 2: 2, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	70289-29-1	CNCCOC1=CC=CC=C1Cl	{1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	70289-30-4	CC(COC1=CC=C(C=C1)Br)N	{1: 1, 2: 1, 3: 1, 14: 4, 18: 1, 22: 1, 30: 1}
Did not match all atoms present	70289-35-9	CC1=CC=CC(=N1)C=NOCC2=CC=CC=C2	{1: 1, 34: 1, 35: 1, 6: 1, 2: 1, 14: 8, 22: 1}
Did not match all atoms present	70289-36-0	CCC(C)(C)C1=CC(=C(C=C1)OC2=CC=CC=C2)N	{1: 3, 2: 1, 4: 1, 14: 8, 22: 1, 30: 1}
Did not match all atoms present	70289-38-2	CC(C)C1=CC=C(C=C1)C(=O)CCCCl	{1: 2, 2: 3, 3: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	70289-39-3	C1CC1C(C2=CC=C(C=C2)Br)O	{3: 1, 11: 2, 12: 1, 14: 4, 18: 1, 20: 1}
Did not match all atoms present	70289-44-0	CC(=O)OC1=CC=CC=C1.C=O	{1: 1, 28: 1, 5: 1, 14: 5}
Did not match all atoms present	70289-45-1	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2.CC1=CC=CC=C1C=C.C=O	{1: 2, 5: 2, 6: 1, 14: 13, 22: 1, 29: 2}
Did not match all atoms present	70289-46-2	CCCCCCCCC(=O)OCC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 10, 4: 1, 14: 4, 20: 2, 28: 3}
Did not match all atoms present	703-23-1	CC(=O)C1=C(C=CC=C1OC)O	{24: 1, 1: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	703-55-9	C1=CC=C2[C-]=CC=CC2=C1.[Mg+2].[Br-]	{18: 1, 14: 7}
Did not match all atoms present	703-56-0	C1COC(=O)N1C2=CC=CC=C2	{33: 1, 11: 2, 28: 1, 14: 5}
Did not match all atoms present	703-59-3	C1C2=CC=CC=C2C(=O)OC1=O	{11: 1, 28: 2, 14: 4}
Did not match all atoms present	703-61-7	C1=CC=C2C(=C1)C(=CC(=N2)Cl)Cl	{17: 2, 35: 1, 14: 5}
Did not match all atoms present	703-80-0	CC(=O)C1=CNC2=CC=CC=C21	{24: 1, 1: 1, 14: 5, 32: 1}
Did not match all atoms present	703-86-6	B1(N(B(N(B(N1C)Cl)C)Cl)C)Cl	{1: 3, 33: 3, 17: 3}
Did not match all atoms present	703-87-7	CC1=C(C(=C(C(=C1F)F)C)F)F	{16: 4, 1: 2}
Did not match all atoms present	703-95-7	C1(=C(NC(=O)NC1=O)C(=O)O)F	{16: 1, 25: 2, 27: 1, 32: 2}
Did not match all atoms present	70301-54-1	CN1CCN(CC1)C2=NN=C3C(=C2)N(CC4=CC=CC=C4O3)C5=NC=CS5	{1: 1, 35: 3, 33: 3, 41: 1, 11: 5, 14: 7, 23: 1}
Did not match all atoms present	70301-64-3	CN1CCN(CC1)C2=NN=C3C(=C2)N(CC4=CC=CC=C4O3)C5=CC=C(C=C5)OC	{1: 2, 35: 2, 33: 3, 11: 5, 14: 9, 22: 1, 23: 1}
Did not match all atoms present	70301-68-7	CC1=C(C=C(C=C1)N2CC3=CC=CC=C3OC4=NN=C(C=C42)N5CCN(CC5)C)C.C(=C/C(=O)O)\C(=O)O	{1: 3, 35: 2, 6: 2, 33: 3, 11: 5, 14: 8, 23: 1, 27: 2}
Did not match all atoms present	70303-46-7	CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)SCC	{40: 1, 1: 4, 2: 22}
Did not match all atoms present	70303-47-8	CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)SCCCC	{40: 1, 1: 4, 2: 24}
Did not match all atoms present	70304-37-9	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])OC)N(/N=C/3\C=C/C(=C/C=C/4\C=C/C(=N\[N+](=O)C5=C(C=C(C(=C5)C)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])OC)/C=C4S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 6, 6: 2, 33: 2, 14: 18, 15: 6, 22: 2, 29: 14}
Did not match all atoms present	70304-68-6	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.C1C(O1)CCl.C1=CC=C(C=C1)[O-].[NH4+]	{1: 2, 2: 1, 4: 1, 5: 1, 11: 1, 12: 1, 14: 13, 17: 1, 21: 2, 23: 1}
Did not match all atoms present	70321-82-3	COC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)OC)C(=O)N)/C2=O	{1: 2, 34: 1, 14: 12, 15: 2, 22: 2, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	70321-84-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=NNN=C4C(=C3)S(=O)(=O)[O-].[Na+]	{32: 1, 25: 2, 35: 2, 29: 3, 14: 5}
Did not match all atoms present	70321-85-6	CC(=O)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-].[K+]	{1: 1, 2: 1, 14: 4, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	7033-68-3	CC(C)CC1=C(C=C(C=N1)C(C)C)C(C)C	{1: 6, 2: 1, 3: 3, 14: 2, 35: 1}
Did not match all atoms present	70331-82-7	C(CS(=O)(=O)[O-])NC(CO)(CO)CO.[Na+]	{20: 3, 2: 5, 4: 1, 29: 3, 31: 1}
Did not match all atoms present	70333-07-2	[As].[Ag].[Ag]	{}
Did not match all atoms present	70340-04-4	C1=CC=C(C=C1)[P+](CC2=CC=CC=C2O)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{2: 1, 18: 1, 14: 19, 21: 1}
Did not match all atoms present	70343-15-6	CC1=C(C(=CC(=C1)[N+](=O)[O-])C(=O)O)[N+](=O)[O-]	{1: 1, 27: 1, 38: 2, 14: 2}
Did not match all atoms present	70343-45-2	CC1=CC(=C(C=C1)C(=O)N)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=C(C=C4)OC	{1: 2, 34: 1, 14: 12, 15: 2, 22: 1, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	70346-75-7	C1=CC=C2C(=C1)C3=C4C(=CC=C3)C5=C6C7=C(C=C5)C8=CC=CC9=C8C1=C(C=C3C=CC5=CC2=C4C6=C5C3=C71)C1=CC=CC=C91	{14: 20}
Did not match all atoms present	7035-02-1	COC1=CC=CC=C1CCl	{1: 1, 2: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	7035-03-2	COC1=CC=CC=C1CC#N	{1: 1, 2: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	70351-86-9	CCCCCCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC	{1: 6, 2: 30, 22: 6, 14: 6}
Did not match all atoms present	70353-84-3	CCOC1=CC=C(C=C1)N/C=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.[O-]S(=O)(=O)[O-]	{1: 4, 2: 1, 6: 2, 33: 1, 13: 1, 14: 8, 15: 1, 22: 1, 29: 4, 31: 1}
Did not match all atoms present	70356-03-5	C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)O)Cl.O	{33: 1, 3: 1, 41: 1, 11: 1, 12: 2, 14: 5, 15: 2, 17: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	70362-50-4	C1=CC(=CC=C1C2=CC(=C(C(=C2)Cl)Cl)Cl)Cl	{17: 4, 14: 6}
Did not match all atoms present	70383-86-7	CC1=CC2=CC=CC=C2OC13C=CC4=C(O3)C=C(C=C4)N5CCOCC5	{1: 1, 33: 1, 11: 4, 13: 1, 14: 10, 15: 1, 23: 3}
Did not match all atoms present	70384-29-1	CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCNC(C)C7=CC=CC=C7)O.OS(=O)(=O)O	{32: 1, 1: 5, 2: 9, 3: 10, 41: 2, 12: 10, 14: 9, 35: 5, 20: 10, 22: 2, 23: 2, 24: 7, 28: 1, 29: 2, 30: 5, 31: 7}
Did not match all atoms present	70389-13-8	CC1=CC2=C(C=C1CCC3=NC(=CC=C3)CC2)C	{1: 2, 11: 4, 14: 5, 35: 1}
Did not match all atoms present	70389-15-0	CC1=C(C2=C(C(=C1CCC3=NC(=CC=C3)CC2)C)C)C	{1: 4, 11: 4, 14: 3, 35: 1}
Did not match all atoms present	70389-16-1	CC1=CC2=NC(=C1)CCC3=CC=C(CC2)C=C3	{1: 1, 11: 4, 14: 6, 35: 1}
Did not match all atoms present	70389-17-2	CC1=CC/2=NC(=C1)/C=C\C3=CC=C(C=C3)/C=C2	{1: 1, 35: 1, 14: 10}
Did not match all atoms present	7039-09-0	C1C(=O)NC(=O)N1C2=NC=C(S2)[N+](=O)[O-]	{32: 1, 33: 1, 35: 1, 38: 1, 41: 1, 11: 1, 14: 1, 25: 2}
Did not match all atoms present	704-00-7	CC(=O)C1=CC=CC=C1C(=O)C	{24: 2, 1: 2, 14: 4}
Did not match all atoms present	704-01-8	CN(C)C1=CC=CC=C1N(C)C	{1: 4, 14: 4, 33: 2}
Did not match all atoms present	704-10-9	CC(=O)C1=CC(=C(C=C1Cl)Cl)F	{16: 1, 1: 1, 24: 1, 14: 2, 17: 2}
Did not match all atoms present	704-14-3	COC1=CC(=C(C=C1)[N+](=O)[O-])O	{1: 1, 22: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	704-38-1	C1=CSC(=C1)C(=O)C2=CC=CS2	{24: 1, 41: 2, 14: 6}
Did not match all atoms present	7040-42-8	CC(C)(C)C1=COC=C1	{1: 3, 4: 1, 14: 3, 23: 1}
Did not match all atoms present	7040-43-9	CC(C)(C)C1=CC=CO1	{1: 3, 4: 1, 14: 3, 23: 1}
Did not match all atoms present	7040-59-7	CC(C(C)(C)C)OP(=O)(C)OC	{1: 6, 3: 1, 4: 1, 29: 1, 22: 2}
Did not match all atoms present	70401-32-0	CC1=CC2=C(C=C1)N(C3=CC=CC=C3C=C2)C(=O)N	{24: 1, 1: 1, 30: 1, 14: 9, 33: 1}
Did not match all atoms present	7041-24-9	C1=C(C(=NC(=C1Cl)Cl)C(Cl)(Cl)Cl)Cl	{17: 6, 35: 1, 4: 1, 14: 1}
Did not match all atoms present	7041-25-0	C1=C(C=NC(=C1Cl)C(Cl)Cl)Cl	{17: 4, 3: 1, 14: 2, 35: 1}
Did not match all atoms present	70429-09-3	[Eu].[Bi]	{}
Did not match all atoms present	7044-02-2	CC1(C2=C(C=CC(=C2)C(=O)OC)N(C1=CC=C(C#N)C(=O)OCC3=CC=CC=C3)C)C	{1: 4, 2: 1, 33: 1, 6: 2, 7: 1, 13: 1, 14: 8, 15: 1, 28: 2, 37: 1}
Did not match all atoms present	7044-91-9	C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2C=O)C=O	{26: 2, 14: 8}
Did not match all atoms present	70441-82-6	CC1=CC=[N+](C=C1)COCN2C=CC(=C[NH+]=O)C=C2.[Cl-].[Cl-]	{1: 1, 2: 2, 6: 1, 33: 2, 14: 8, 15: 1, 17: 2, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	70441-84-8	CC1=CC=CC=[N+]1COCN\2C=CC=C/C2=C\[NH+]=O.[Cl-].[Cl-]	{1: 1, 2: 2, 6: 1, 33: 2, 14: 8, 15: 1, 17: 2, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	70441-85-9	CC1=CC=[N+](C=C1)COCN\2C=CC=C/C2=C\[NH+]=O.[Cl-].[Cl-]	{1: 1, 2: 2, 6: 1, 33: 2, 14: 8, 15: 1, 17: 2, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	70443-38-8	C1CC2=C(C=CC3=CC4=C(C=CC5=CC=CC=C54)C=C23)[C@@H]([C@H]1O)O	{20: 2, 11: 2, 12: 2, 14: 10}
Did not match all atoms present	70445-88-4	CC1=C(S(=O)C2=CC=CC=C12)C	{1: 2, 29: 1, 14: 4, 15: 2}
Did not match all atoms present	70446-10-5	[H-].[H-].[H-].[Eu+3]	{}
Did not match all atoms present	7045-83-2	C1=CC=C2C(=C1)C(=O)C=C(C2=O)S(=O)(=O)[O-].[Na+]	{25: 2, 29: 3, 14: 5, 15: 1}
Did not match all atoms present	70458-96-7	CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNCC3)F)C(=O)O	{32: 1, 1: 1, 2: 1, 33: 2, 11: 4, 14: 3, 16: 1, 25: 1, 27: 1}
Did not match all atoms present	7047-84-9	CCCCCCCCCCCCCCCCCC(=O)O[Al].O.O	{1: 1, 2: 16, 28: 1}
Did not match all atoms present	70476-82-3	C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO.Cl.Cl	{2: 8, 14: 4, 17: 2, 20: 2, 21: 2, 25: 2, 31: 4}
Did not match all atoms present	7048-96-6	CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)C3=C(C(=O)N(C3C4=C(C=CC(=C4)OC)OC)CC5=CN=CC=C5)O	{1: 3, 2: 1, 35: 2, 33: 1, 41: 1, 12: 1, 14: 12, 15: 2, 20: 1, 22: 2, 24: 1, 25: 1}
Did not match all atoms present	70481-66-2	CC1=C2C(=CC=C1)N(C3=NC(=O)N(C(=O)C3=N2)C)C	{1: 3, 35: 2, 33: 2, 14: 3, 25: 2}
Did not match all atoms present	70487-60-4	F[Mo](=S)(F)(F)F	{16: 4}
Did not match all atoms present	70490-93-6	C(OO[N+](=O)[O-])(Cl)(Cl)Cl	{17: 3, 4: 1, 22: 2}
Did not match all atoms present	70490-94-7	C(OO[N+](=O)[O-])(F)(Cl)Cl	{16: 1, 17: 2, 4: 1, 22: 2}
Did not match all atoms present	70490-95-8	C(OO[N+](=O)[O-])(F)(F)Cl	{16: 2, 17: 1, 4: 1, 22: 2}
Did not match all atoms present	70490-99-2	CC(=O)OC(C1=CC=CC=C1)N(CC2=CC=CC=C2)N=O	{1: 1, 2: 1, 3: 1, 33: 1, 34: 1, 14: 10, 28: 1, 29: 1}
Did not match all atoms present	70495-27-1	[Ag+].[Ag+].[Ag+].[Bi]	{}
Did not match all atoms present	70495-28-2	[Zr]#[Sb]	{}
Did not match all atoms present	70495-37-3	CCCCC(CC)COS(=O)(=O)[O-].[NH4+]	{1: 2, 2: 5, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	70495-39-5	CC(COC1=CC=CC=C1CC2=CC=CC=C2OCC(C)OC(=O)C=C)OC(=O)C=C	{1: 2, 2: 3, 3: 2, 5: 2, 6: 2, 14: 8, 22: 2, 28: 2}
Did not match all atoms present	705-15-7	CC(=O)C1=C(C=CC(=C1)OC)O	{24: 1, 1: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	705-21-5	C1=C(C=C(C=C1Cl)Cl)S(=O)(=O)Cl	{17: 3, 29: 2, 14: 3}
Did not match all atoms present	705-28-2	C#CC1=CC(=CC=C1)C(F)(F)F	{16: 3, 9: 1, 10: 1, 4: 1, 14: 4}
Did not match all atoms present	705-29-3	C1=CC(=CC(=C1)C(F)(F)F)CCl	{16: 3, 17: 1, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	705-60-2	CC(=CC1=CC=CC=C1)[N+](=O)[O-]	{1: 1, 38: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	705-76-0	COC1=CC(=CC(=C1)CO)OC	{1: 2, 2: 1, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	705-82-8	CC1=C(C=CC(=C1)OCCO)Cl	{1: 1, 2: 2, 14: 3, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	7051-13-0	COC1=CC(=C(C=C1)Cl)OC	{1: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	7051-16-3	COC1=CC(=CC(=C1)Cl)OC	{1: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	70516-49-3	CCCCCCN(C)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)C)NC6=CC=CC=C6	{1: 3, 2: 5, 33: 1, 13: 1, 14: 14, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	70516-51-7	CCCCCCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)C)NC6=CC=CC=C6	{1: 3, 2: 6, 33: 1, 13: 1, 14: 14, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	70516-52-8	CCCCCCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)NC6=CC=CC=C6	{1: 2, 2: 6, 33: 1, 13: 1, 14: 15, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	70516-54-0	CCCCCCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)N(C)C6=CC=CC=C6	{1: 3, 2: 6, 33: 2, 13: 1, 14: 15, 23: 1, 28: 1}
Did not match all atoms present	70519-09-4	CC(C)CCCCC(=O)[O-].[Fe+3]	{24: 1, 1: 2, 2: 4, 3: 1}
Did not match all atoms present	70528-98-2	CCCCCCCCC1=CC(=C(C=C1)O)CCCCCCCC.CCCCCCCCC1=C(C(=CC=C1)CCCCCCCC)O.CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC=C(C=C1)O	{1: 9, 2: 29, 4: 2, 5: 1, 14: 15, 21: 4}
Did not match all atoms present	70529-04-3	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.[Na+].[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 14, 17: 2, 29: 4, 30: 2}
Did not match all atoms present	7054-25-3	COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O	{1: 1, 2: 1, 3: 5, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 6, 22: 1, 27: 1}
Did not match all atoms present	70544-46-6	CCCCCCCCOC1=CC(=C(C=C1C(C)(C)CC)OCCCCCCCC)C(C)(C)CC	{1: 8, 2: 16, 4: 2, 22: 2, 14: 2}
Did not match all atoms present	70547-87-4	CC1=CC(=CC(=C1C=O)C)O	{1: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	70548-53-7	C(CC[NH3+])CC(CS)[NH3+].[Cl-].[Cl-]	{17: 2, 2: 5, 3: 1, 39: 1}
Did not match all atoms present	7055-03-0	CC1=CC=CC=C1C(=O)NC2=CC=CC=C2	{24: 1, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	70561-82-9	C(CCN)CC(CSP(=O)(O)O)N	{2: 5, 3: 1, 40: 1, 20: 2, 29: 1, 30: 2}
Did not match all atoms present	7057-68-3	C1=C(C=C(C(=C1N)Cl)N)S(=O)(=O)O	{17: 1, 30: 2, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	7057-73-0	C(CO[Si](OCCN)(OCCN)OCCN)N	{2: 8, 30: 4, 22: 4}
Did not match all atoms present	7057-92-3	CCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCC	{1: 2, 2: 22, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	70571-70-9	CN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)C(=O)/C(=N/NC5=C(C6=C(C=C5)C(=CC=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=C4)S(=O)(=O)[O-])F.[Na+].[Na+].[Na+]	{1: 1, 34: 1, 35: 3, 33: 1, 14: 14, 15: 2, 16: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	70571-78-7	C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)NC3=CC(=C(C4=C3C(=O)C5=CC=CC=C5C4=O)N)S(=O)(=O)[O-].[Na+]	{14: 14, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	7058-55-1	C1=CC=C(C(=C1)C(=O)[O-])N.[Cd]	{24: 1, 30: 1, 14: 4}
Did not match all atoms present	7059-24-7	C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O[C@H]2[C@@H](CC3=C(C2=O)C(=C4C(=C3)C=C(C(=C4O)C)O[C@H]5C[C@H]([C@H]([C@H](O5)C)OC(=O)C)O[C@@H]6C[C@H]([C@H]([C@H](O6)C)OC)O)O)[C@@H](C(=O)[C@H]([C@@H](C)O)O)OC)O[C@H]7C[C@H]([C@@H]([C@H](O7)C)O)O[C@H]8C[C@]([C@H]([C@@H](O8)C)OC(=O)C)(C)O)O	{1: 12, 3: 3, 11: 6, 12: 21, 13: 1, 14: 2, 20: 6, 21: 2, 22: 7, 23: 5, 24: 1, 25: 1, 28: 2}
Did not match all atoms present	7059-70-3	C1=CC=C2C=C(C=CC2=C1)C3=CC(=CC(=C3)C4=CC5=CC=CC=C5C=C4)C6=CC7=CC=CC=C7C=C6	{14: 24}
Did not match all atoms present	70591-20-7	C1=CC=C(C=C1)C(=NCC#N)C2=CC=CC=C2	{2: 1, 37: 1, 34: 1, 14: 10, 7: 1}
Did not match all atoms present	706-03-6	C1=CC=C(C=C1)CNCCC#N	{2: 3, 37: 1, 14: 5, 31: 1}
Did not match all atoms present	706-27-4	CC1=CC=C(C=C1)OC(F)(F)F	{16: 3, 1: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	706-93-4	C1=CC=C(C=C1)C(C(Cl)(Cl)Cl)(Cl)Cl	{17: 5, 4: 2, 14: 5}
Did not match all atoms present	7060-74-4	C[C@@H]1C[C@@H]([C@H]([C@@H](O1)O[C@H]2[C@H](C[C@@]3(CO3)C(=O)[C@@H]([C@H]([C@H]([C@H](OC(=O)[C@@H]([C@H]([C@@H]2C)O[C@H]4C[C@@H]([C@H]([C@@H](O4)C)O)OC)C)C)C)O)C)C)O)N(C)C.OP(=O)(O)O	{1: 11, 33: 1, 11: 4, 12: 17, 13: 1, 20: 6, 22: 3, 23: 3, 25: 1, 28: 1, 29: 1}
Did not match all atoms present	70601-54-6	CCN1CCC[C@H]1C(=O)N(C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=C(C(=C(C(=C2C)C)C)C)C)N)C(=O)[C@H](CC3=CC=C(C=C3)OCC4=CC=CC=C4)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CO)NC(=O)OCC7=CC=CC=C7.CC(=O)O	{32: 1, 1: 9, 2: 12, 3: 8, 33: 2, 7: 1, 11: 3, 12: 1, 34: 1, 14: 19, 20: 2, 22: 1, 24: 8, 27: 1, 28: 1, 30: 3, 31: 6}
Did not match all atoms present	70601-60-4	CCN1CCCC1C(=O)N(C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2=C(C(=C(C(=C2C)C)C)C)C)N)C(=O)[C@H](CC3=CC=C(C=C3)OCC4=CC=CC=C4)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CO)NC(=O)OCC7=CC=CC=C7.CC(=O)O	{32: 1, 1: 9, 2: 12, 3: 8, 33: 2, 7: 1, 11: 3, 12: 1, 34: 1, 14: 19, 20: 2, 22: 1, 24: 8, 27: 1, 28: 1, 30: 3, 31: 6}
Did not match all atoms present	70601-68-2	CCN1CCC[C@H]1C(=O)N(C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC=C(C=C2)OC)N)C(=O)[C@H](CC3=CC=C(C=C3)OCC4=CC=CC=C4)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CO)NC(=O)OCC7=CC=CC=C7.CC(=O)O	{32: 1, 1: 5, 2: 12, 3: 8, 33: 2, 7: 1, 11: 3, 12: 1, 34: 1, 14: 23, 20: 2, 22: 2, 24: 8, 27: 1, 28: 1, 30: 3, 31: 6}
Did not match all atoms present	70609-95-9	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C	{1: 3, 2: 2, 38: 1, 33: 1, 34: 2, 14: 6, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	70613-36-4	CC1CO1.CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4.C1CO1	{1: 3, 2: 2, 4: 1, 11: 5, 12: 3, 14: 8, 22: 2, 23: 4}
Did not match all atoms present	70615-15-5	CC1=CC2=C(C=C1)OC(=[N+]2CCCS(=O)(=O)[O-])C	{1: 2, 2: 3, 33: 1, 14: 3, 23: 1, 29: 3}
Did not match all atoms present	70615-17-7	C1=CC2=C(C=C1S(=O)(=O)O)C(=O)OC2=O.N	{28: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	70615-18-8	CC(=O)NC1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=C(C=C2)N)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 2, 14: 9, 24: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	70616-71-6	C1C(=NN(C1=O)C2=C(C=C(C=C2)N)S(=O)(=O)O)C(=O)O	{33: 1, 35: 1, 11: 1, 14: 3, 15: 1, 20: 1, 25: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	7062-96-6	CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3C4=CC=CC=C4CCN3C	{1: 2, 33: 2, 11: 6, 12: 2, 14: 8, 29: 2}
Did not match all atoms present	7062-97-7	CN1CCC2=CC=CC=C2C1C3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br	{1: 1, 33: 2, 41: 1, 11: 6, 12: 2, 14: 6, 18: 1, 29: 2}
Did not match all atoms present	70624-13-4	CC(C)CC1=C(C=CC=C1Cl)OC2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 14: 8, 17: 1, 22: 1}
Did not match all atoms present	70624-14-5	CC(C)CC1=C(C=CC(=C1CC(C)C)Cl)OC2=CC=CC=C2	{1: 4, 2: 2, 3: 2, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	70624-15-6	CC(C[N+](C)(C)C)O.C(C#N)C(=O)[O-]	{1: 4, 2: 2, 3: 1, 37: 1, 20: 1, 24: 1}
Did not match all atoms present	70624-16-7	CC1=CC(=CC(=C1)OP(=O)(OC2=CC(=CC(=C2)[N+](=O)[O-])C)OC3=CC(=CC(=C3)[N+](=O)[O-])C)[N+](=O)[O-]	{1: 3, 38: 3, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	70624-19-0	CN(C)C1=CC=C(C=C1)C(C2=C(C=C(C=C2)N(C)C)C(=O)[O-])C3=C(C=C(C=C3)N(C)C)N(C)C.[K+]	{24: 1, 1: 8, 3: 1, 14: 10, 33: 4}
Did not match all atoms present	70624-20-3	C[Si](C)(Cl)Cl.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O	{1: 2, 4: 2, 20: 2, 14: 20, 17: 2}
Did not match all atoms present	7063-95-8	CCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CCCC(=O)O)N3CCCCCC3	{1: 2, 2: 4, 37: 1, 6: 1, 33: 3, 41: 1, 11: 6, 15: 2, 25: 2, 27: 1}
Did not match all atoms present	70630-17-0	CC1=C(C(=CC=C1)C)N([C@H](C)C(=O)OC)C(=O)COC	{1: 5, 2: 1, 3: 1, 33: 1, 14: 3, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	70632-07-4	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=C4C=C(/C(=N\NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NN=C6C=CC(=O)C=C6.[Na+].[Na+].[Na+]	{1: 2, 34: 4, 14: 16, 15: 3, 22: 2, 25: 2, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	70632-08-5	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=C4C=C(/C(=N\NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C/6\C=CC(=O)C=C6N.[Na+].[Na+].[Na+]	{1: 2, 34: 4, 14: 15, 15: 4, 22: 2, 25: 2, 29: 9, 30: 2, 31: 2}
Did not match all atoms present	70632-09-6	[Li+].[Li+].CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=CC(=C3N)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])N)C)N/N=C/5\C=CC(=O)C(=C5)C(=O)[O-]	{1: 2, 34: 5, 14: 15, 15: 2, 24: 1, 25: 1, 29: 3, 30: 2, 31: 1}
Did not match all atoms present	70632-10-9	CC\1(C2=CC=CC=C2N(/C1=C/C=NC3=CC=C(C=C3)N4N=C5C=CC(=CC5=N4)N=C/C=C/6\C(C7=CC=CC=C7N6C)(C)C)C)C.Cl.Cl	{1: 6, 34: 2, 35: 2, 6: 4, 33: 3, 13: 2, 14: 15, 15: 2, 17: 2}
Did not match all atoms present	70632-11-0	CC1=CC2=C(C=C1N=NC3=C(C=C(C=C3)N)N)[N+](=C4C=C(C(=CC4=N2)C)N)C5=CC=CC=C5.[Cl-]	{1: 2, 34: 2, 35: 1, 33: 1, 14: 12, 17: 1, 30: 3}
Did not match all atoms present	70632-16-5	CCCCC(CC)COC(=O)C(=C)C.CC(=C)C(=O)O.C=CC1=CC=CC=C1	{1: 4, 2: 5, 3: 1, 5: 3, 6: 1, 7: 2, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	7064-71-3	CC1(C2=C(C=CC(=C2)C(=O)OC)N(C1=CC=C(C#N)C(=O)OCCCC3=CC=CC=C3)C)C	{1: 4, 2: 3, 33: 1, 6: 2, 7: 1, 13: 1, 14: 8, 15: 1, 28: 2, 37: 1}
Did not match all atoms present	70642-86-3	CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)O)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 21: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	70644-45-0	CCCOCCC1=CC=CC=N1	{1: 1, 2: 4, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	70644-46-1	C1CC(CC=C1)C2=CC=NC=C2	{35: 1, 11: 3, 12: 1, 14: 6}
Did not match all atoms present	70644-47-2	CC1=NC(=CC=C1)NCC2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 14: 8, 31: 1}
Did not match all atoms present	70644-51-8	CCCCOC(=O)C(=C)C.C[N+](C)(CC=C)CC=C.C=CC(=O)N.[Cl-]	{1: 4, 2: 5, 5: 4, 6: 3, 7: 1, 17: 1, 24: 1, 28: 1, 30: 1}
Did not match all atoms present	70648-26-9	C1=C2C(=CC(=C1Cl)Cl)OC3=C2C(=C(C(=C3Cl)Cl)Cl)Cl	{17: 6, 14: 2, 23: 1}
Did not match all atoms present	7065-22-7	C1=CC=C(C=C1)[Sb](C2=CC=CC=C2)O[Sb](C3=CC=CC=C3)C4=CC=CC=C4	{22: 1, 14: 20}
Did not match all atoms present	70656-87-0	CC1=C2C=CC=CC2=NC(=O)CN1	{32: 1, 1: 1, 35: 1, 11: 1, 14: 4, 15: 1, 25: 1}
Did not match all atoms present	7066-36-6	C1=CC=C2C(=C1)N=C(C(=N2)F)F	{16: 2, 35: 2, 14: 4}
Did not match all atoms present	70660-01-4	CN(C)P1(=NP(=NP(=N1)(N(C)C)F)(N(C)C)F)N(C)C	{16: 2, 1: 8, 35: 3, 33: 4}
Did not match all atoms present	70660-45-6	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)N=NC3=CC(=C(C=C3N)N)N/N=C/4\C=C(C=C(C4=O)C(=O)O)S(=O)(=O)O	{34: 3, 38: 1, 14: 11, 15: 3, 20: 2, 25: 1, 27: 1, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	70660-46-7	C1=CC(=CC=C1N=NC2=C(C(=CC(=C2O)N=NC3=CC(=CC(=C3O)[N+](=O)[O-])[N+](=O)[O-])N=NC4=C5C(=CC(=C4)S(=O)(=O)O)C=C(C=C5O)S(=O)(=O)O)N)[N+](=O)[O-]	{34: 6, 38: 3, 14: 11, 20: 2, 21: 3, 29: 4, 30: 1}
Did not match all atoms present	70660-47-8	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)N=NC3=CC(=C(C=C3N)N)N/N=C\4/C=C(C=CC4=O)S(=O)(=O)O	{34: 3, 38: 1, 14: 12, 15: 2, 20: 2, 25: 1, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	70660-48-9	CCCCN(CCOC(=O)NC1=CC(=C(C=C1)Cl)Cl)C2=CC=CC(=C2)C	{1: 2, 2: 5, 33: 1, 14: 7, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	70660-51-4	C[N+](C)(CCO)CC1=CC=C(C=C1)C=C.C=CC1=CC=C(C=C1)C=C.[Cl-]	{1: 2, 2: 3, 5: 3, 6: 3, 14: 8, 17: 1, 20: 1}
Did not match all atoms present	70660-52-5	C1=CC(=CC=C1NC2=CC=C(C=C2)[N+]#N)[N+]#N.Cl[Zn-](Cl)Cl.Cl[Zn-](Cl)Cl	{17: 6, 34: 2, 14: 8, 31: 1}
Did not match all atoms present	70660-53-6	CC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]	{1: 3, 2: 4, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 6, 28: 2}
Did not match all atoms present	70660-54-7	CC(=O)NC1=CC=C(C=C1)N/N=C\2/C=C(C=CC2=O)C3=CC=CC=C3	{1: 1, 34: 1, 14: 12, 15: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	70660-56-9	CCCCNS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC=C2)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 8, 29: 2, 31: 2}
Did not match all atoms present	70660-61-6	CC(C)CC(C)CC(C)COCCC[NH3+].CC(=O)[O-]	{24: 1, 1: 5, 2: 6, 3: 3, 22: 1}
Did not match all atoms present	70664-49-2	C1=C(OC(=C1[N+](=O)[O-])N=[N+]=[N-])[N+](=O)[O-]	{34: 2, 38: 2, 14: 1, 23: 1}
Did not match all atoms present	7067-44-9	CCCC[Sn](C1CCCCC1)(C2CCCCC2)C3CCCCC3	{1: 1, 2: 3, 11: 15, 12: 3}
Did not match all atoms present	70682-62-1	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C=C1N.[NH4+]	{30: 1, 29: 3, 14: 6}
Did not match all atoms present	70682-63-2	CN(CCO)S(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)O	{1: 1, 2: 2, 33: 1, 14: 6, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	70682-64-3	C1CCC(CC1)C2=CC=C(C=C2)OC3=CC=C(C=C3)N	{30: 1, 11: 5, 12: 1, 22: 1, 14: 8}
Did not match all atoms present	70682-68-7	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#N)CCNCCC#N.CCOS(=O)(=O)OCC	{1: 3, 2: 26, 37: 2, 33: 1, 22: 2, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	70682-69-8	CCCCCCCC1=NCCN1CCOCC(C)C(=O)[O-].[Na+]	{1: 2, 2: 9, 3: 1, 33: 1, 11: 2, 15: 1, 35: 1, 22: 1, 24: 1}
Did not match all atoms present	70682-72-3	CCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 13, 28: 1, 14: 5}
Did not match all atoms present	70691-95-1	C1=CC=C(C=C1)CN2C(=C(N=N2)CCl)CCl	{17: 2, 2: 3, 35: 2, 14: 5, 33: 1}
Did not match all atoms present	70692-93-2	[O-2].[O-2].[O-2].[Ni+2].[Zr+4]	{}
Did not match all atoms present	70692-94-3	[O-2].[O-2].[O-2].[Mn+2].[Zr+4]	{}
Did not match all atoms present	70692-95-4	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Al+3].[Al+3].[Zr+4].[Zr+4].[Zr+4]	{}
Did not match all atoms present	70693-30-0	CCCCCCCCCCCC(=O)O.CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{1: 3, 2: 24, 27: 5, 14: 4}
Did not match all atoms present	70693-33-3	COCN(CNN1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C(O4)C=CC(=C5)OC)C1=O)C6=NC(=NC(=N6)N(COC)COC)N(COC)COC	{1: 6, 2: 6, 35: 3, 33: 4, 14: 7, 22: 6, 23: 1, 25: 2, 31: 1}
Did not match all atoms present	70693-47-9	CC(=O)O[Si](C)(C)O[Si](C)(C)C	{1: 6, 28: 1, 22: 1}
Did not match all atoms present	70693-48-0	CC(C)(C)CC(C)(C)C1=CC(=NNC2=CC=CC=C2[N+](=O)[O-])C(=O)C(=C1)C(C)(C)CC(C)(C)C	{1: 10, 2: 2, 4: 4, 38: 1, 34: 1, 14: 6, 15: 3, 25: 1, 31: 1}
Did not match all atoms present	70693-49-1	CC(C)(C)CC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)C(C)(C)CC(C)(C)C	{1: 10, 2: 2, 35: 2, 4: 4, 33: 1, 14: 6, 21: 1}
Did not match all atoms present	70693-50-4	CC(C)(C1=CC=CC=C1)C2=C/C(=N\NC3=CC=CC=C3[N+](=O)[O-])/C(=O)C(=C2)C(C)(C)C4=CC=CC=C4	{1: 4, 34: 1, 4: 2, 38: 1, 14: 16, 15: 3, 25: 1, 31: 1}
Did not match all atoms present	70693-54-8	CCCCCCCCNCCCCCCCC.CCCCCCCCNCCCCCCCC.C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C\3/C4=C(C=C(C=C4)S(=O)(=O)O)C=C(C3=O)S(=O)(=O)O	{1: 4, 2: 28, 34: 3, 14: 13, 15: 2, 20: 2, 25: 1, 29: 4, 31: 3}
Did not match all atoms present	70693-58-2	CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]	{1: 1, 38: 1, 33: 1, 11: 5, 12: 1, 14: 4, 29: 2}
Did not match all atoms present	70693-59-3	CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2N	{1: 1, 33: 1, 11: 5, 12: 1, 14: 4, 29: 2, 30: 1}
Did not match all atoms present	70693-61-7	CCN(CC1=CC=CC=C1Cl)C2=CC(=C(C=C2)N=NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)O)C.C(CO)NCCO	{1: 2, 2: 6, 35: 1, 33: 1, 41: 1, 34: 2, 14: 10, 17: 1, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	70693-63-9	CCN(CC)C1=CC(=C(C=C1)N=NC2=NC=CS2)C	{1: 3, 2: 2, 35: 1, 33: 1, 41: 1, 34: 2, 14: 5}
Did not match all atoms present	70693-64-0	CCN(CC)C1=CC(=C(C=C1)N=NC2=NC=C(S2)[N+](=O)[O-])C	{1: 3, 2: 2, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 4}
Did not match all atoms present	70693-68-4	COC(=O)C1=CC=C(C=C1)C(=O)OC.C(CC(=O)O)CC(=O)O.C(CO)O	{1: 2, 2: 5, 14: 4, 20: 2, 27: 2, 28: 2}
Did not match all atoms present	70693-75-3	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#N)CCNC(=O)CCCCCCCCCCCCCCCCC.CCOS(=O)(=O)OCC	{1: 4, 2: 40, 37: 1, 33: 1, 22: 2, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	707-07-3	COC(C1=CC=CC=C1)(OC)OC	{1: 3, 4: 1, 22: 3, 14: 5}
Did not match all atoms present	707-15-3	CCCCCCC(CCC(CCCCCCCC(=O)OC)OS(=O)(=O)[O-])OS(=O)(=O)O.[Na+]	{1: 2, 2: 14, 3: 2, 20: 1, 22: 2, 28: 1, 29: 5}
Did not match all atoms present	707-61-9	CC1=CP(=O)(CC1)C2=CC=CC=C2	{1: 1, 11: 2, 29: 1, 14: 6, 15: 1}
Did not match all atoms present	70701-62-1	C1(C(C(C(C(C1OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{12: 6, 29: 18, 22: 6}
Did not match all atoms present	70701-76-7	C1=CC=C2C(=C1)C(=O)C(C2=O)C3=NC4=C(C(=CC=C4)Br)C(=C3O)Br	{35: 1, 12: 1, 14: 7, 18: 2, 21: 1, 25: 2}
Did not match all atoms present	70703-34-3	C1=CC=C2C(=C1)C=CC(=C2CS(=O)(=O)[O-])N/N=C/3\C4=CC=CC=C4C=C(C3=O)C(=O)[O-].[Sr+2]	{2: 1, 34: 1, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	70703-39-8	[CH3-].CC[CH2-].[Mg+2]	{1: 1, 2: 1, 5: 1}
Did not match all atoms present	70703-45-6	CCCCCCCCNCCCCCCCC.CCCCCCCCNCCCCCCCC.C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 2: 28, 34: 3, 14: 13, 15: 1, 20: 2, 25: 1, 29: 4, 31: 3}
Did not match all atoms present	70703-46-7	CC\1=NN(C(=N)/C1=N/NC2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl)C3=CC=C(C=C3)Cl.C(CO)N(CCO)CCO	{1: 1, 2: 6, 35: 1, 36: 1, 33: 2, 34: 1, 14: 6, 15: 3, 17: 3, 20: 4, 29: 2, 31: 1}
Did not match all atoms present	7071-12-7	CCOC(=O)C(P(=O)(OCC)OCC)Cl	{1: 3, 2: 3, 3: 1, 17: 1, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	70711-40-9	CC(=O)[O-].CC(=O)[O-].C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCC[NH2+]CCO)NCC[NH2+]CCO	{1: 2, 2: 8, 14: 6, 20: 2, 24: 2, 25: 2, 31: 2}
Did not match all atoms present	70714-63-5	[Se].[Sm].[Sm]	{}
Did not match all atoms present	70714-64-6	[O-2].[O-2].[O-2].[Cu+2].[Zr+4]	{}
Did not match all atoms present	70714-67-9	C1=CC2=C(C=CC(=C2C(=O)O)O)C=C1S(=O)(=O)Cl	{17: 1, 27: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	70714-68-0	C1=CC=C(C=C1)S(=O)(=O)OC2=C3C=CC(=CC3=CC(=C2)S(=O)(=O)[O-])N.[Na+]	{30: 1, 22: 1, 14: 10, 29: 5}
Did not match all atoms present	70714-69-1	C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)O)N)S(=O)(=O)O)S(=O)(=O)O.N.N	{30: 1, 20: 3, 29: 6, 14: 4}
Did not match all atoms present	70714-70-4	COC1=C(C=CC(=C1)[N+](=O)[O-])N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)O	{1: 1, 34: 1, 38: 1, 14: 8, 15: 2, 22: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	70714-71-5	C1=CC2=C(C=C(C=C2C=C1NC3=C(C(=NC(=N3)F)F)Cl)S(=O)(=O)[O-])O.[Na+]	{35: 2, 14: 5, 16: 2, 17: 1, 21: 1, 29: 3, 31: 1}
Did not match all atoms present	70714-72-6	CCCCOCC(CN(CC)C1=CC=CC(=C1)C)OP(=O)(O)OCCC	{1: 4, 2: 8, 3: 1, 33: 1, 14: 4, 20: 1, 22: 3, 29: 1}
Did not match all atoms present	70714-73-7	CCOC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)OCC	{1: 2, 2: 2, 14: 14, 22: 2, 25: 2, 31: 2}
Did not match all atoms present	70714-74-8	CC(C)(CC1=CC=CC=C1)OC(=O)C(=O)OC(C)(C)CC2=CC=CC=C2	{1: 4, 2: 2, 4: 2, 14: 10, 28: 2}
Did not match all atoms present	70714-75-9	C1CCC(CC1)C2=CC=C(C=C2)NC3=C4C(=C(C=C3)NC5=CC=C(C=C5)C6CCCCC6)C(=O)C7=CC=CC=C7C4=O	{25: 2, 11: 10, 12: 2, 14: 14, 31: 2}
Did not match all atoms present	70714-76-0	C=CC(=O)NC(CC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{2: 1, 3: 1, 5: 1, 6: 1, 24: 3, 31: 1}
Did not match all atoms present	70714-83-9	C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NN	{30: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	70714-84-0	CCN(CC)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2)Cl)C(F)(F)F)OC	{1: 4, 2: 2, 4: 1, 33: 1, 34: 2, 14: 5, 16: 3, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	70714-86-2	C1=CC(=CC=C1N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 8, 8: 2, 34: 2, 14: 4, 20: 2, 27: 2, 29: 2}
Did not match all atoms present	70714-87-3	CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O	{1: 2, 2: 3, 4: 1, 8: 2, 34: 2, 14: 12, 20: 2, 27: 2, 29: 2}
Did not match all atoms present	70714-93-1	CC1=C(C(=CC=C1)NC2=CC3=CC=CC=C3C=C2)C	{1: 2, 14: 10, 31: 1}
Did not match all atoms present	70714-97-5	CC(C)CCOP(=O)(O)O.N	{1: 2, 2: 2, 3: 1, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	70714-98-6	CC(C)CCOP(=O)(O)OP(=O)(OCCC(C)C)OCCC(C)C	{1: 6, 2: 6, 3: 3, 20: 1, 22: 4, 29: 2}
Did not match all atoms present	70714-99-7	CCCCCCCCCCCCCOP(=O)(O)OP(=O)(O)OCCCCCCCCCCCCC	{1: 2, 2: 24, 20: 2, 29: 2, 22: 3}
Did not match all atoms present	70715-00-3	CCCCCCCCCCCCCOP(=O)(O)OP(=O)(OCCCCCCCCCCCCC)OCCCCCCCCCCCCC	{1: 3, 2: 36, 20: 1, 29: 2, 22: 4}
Did not match all atoms present	70715-01-4	CCCCCCCCOP(=O)(O)OP(=O)(OCCCCCCCC)OCCCCCCCC	{1: 3, 2: 21, 20: 1, 29: 2, 22: 4}
Did not match all atoms present	70715-02-5	COP(=O)(O)OP(=O)(OC)OC	{1: 3, 20: 1, 29: 2, 22: 4}
Did not match all atoms present	70715-08-1	CC(C)(C)C1=CC=CC=C1O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl	{1: 5, 2: 1, 4: 2, 11: 1, 12: 1, 14: 12, 17: 1, 21: 3, 23: 1}
Did not match all atoms present	70715-09-2	CCCCOC(=O)CC(C(=O)OCCCC)SC(=S)N(CC)CC	{1: 4, 2: 9, 3: 1, 33: 1, 40: 1, 7: 1, 28: 2}
Did not match all atoms present	70715-16-1	CCCCCCCCCC[Si](C)(C)CCl	{1: 3, 2: 10, 17: 1}
Did not match all atoms present	70715-17-2	CC1=NC(=CC=C1)CCCOCCO	{1: 1, 2: 5, 35: 1, 14: 3, 20: 1, 22: 1}
Did not match all atoms present	70715-19-4	CC(C)OCCC1=CC=CC=N1	{1: 2, 2: 2, 3: 1, 14: 4, 35: 1, 22: 1}
Did not match all atoms present	7072-00-6	CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C=O	{1: 1, 26: 1, 14: 8}
Did not match all atoms present	7072-41-5	CC[N+](CC)(CC)CCC[N+](CC)(CC)CC.[Br-]	{1: 6, 2: 9, 18: 1}
Did not match all atoms present	7072-43-7	CC[N+](CC)(CC)CCCCCC[N+](CC)(CC)CC.[Br-].[Br-]	{1: 6, 2: 12, 18: 2}
Did not match all atoms present	70729-59-8	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=C(C=C4)C)C(=O)C5=CC(=C(C=C5C3=O)Cl)Cl	{1: 2, 31: 2, 25: 2, 14: 12, 17: 2}
Did not match all atoms present	70729-60-1	CCN(C1=CC=CC(=C1)C)C2=CC=CC=C2NC(=O)OCC	{1: 3, 2: 2, 33: 1, 14: 8, 28: 1, 31: 1}
Did not match all atoms present	70729-61-2	C1COCCN1.C(COP(=O)(O)O)N(CCOP(=O)(O)O)CCOP(=O)(O)O	{32: 1, 33: 1, 2: 6, 11: 4, 20: 6, 22: 3, 23: 1, 29: 3}
Did not match all atoms present	70729-63-4	CCCCN(CCCC)CCCC.C1=CC(=CC=C1O/C(=C(\C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)C(F)(F)F)/C(F)(F)F)/C(F)(F)F)S(=O)(=O)O	{1: 3, 2: 9, 4: 8, 33: 1, 7: 2, 14: 4, 16: 19, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	70729-64-5	C1=CC(=CC(=C1)P(=O)([O-])[O-])N=NC2=CC(=C(C=C2)N/N=C\3/C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)O)S(=O)(=O)[O-].[NH4+].[Na+].[Na+].[Na+]	{34: 3, 14: 11, 15: 1, 20: 1, 25: 1, 29: 11, 31: 1}
Did not match all atoms present	70729-66-7	C1=CC=C2C(=C(C=CC2=C1)N/N=C\3/C(=O)C(=CC4=C3C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].C1=CC=C2C(=C(C=CC2=C1)N/N=C\3/C(=O)C(=CC4=C3C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Ba+2].[Ba+2].[Ba+2]	{34: 2, 14: 20, 15: 4, 25: 2, 29: 18, 31: 2}
Did not match all atoms present	70729-67-8	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=CC4=C(C=C3)C=C(C=C4)S(=O)(=O)[O-])C(=O)[O-].[Ca+2]	{34: 1, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	70729-69-0	C[N+](C)(CC=C)CC(CCl)O.[Cl-]	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 17: 2, 20: 1}
Did not match all atoms present	70729-70-3	CC(=C)C(=O)NCCC[N+](C)(C)CC(CCl)O.[Cl-]	{1: 3, 2: 5, 3: 1, 5: 1, 7: 1, 17: 2, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	70729-83-8	CC1=C(C=CC=C1N=C=O)N=C=O.C1CCC(=O)OCC1.C(C(CO)(CO)CO)O	{1: 1, 2: 4, 4: 1, 8: 2, 11: 5, 34: 2, 14: 3, 20: 4, 28: 1, 29: 2}
Did not match all atoms present	70729-85-0	CC(C)CCCCCOP(=O)(O)OP(=O)(OCCCCCC(C)C)OCCCCCC(C)C	{1: 6, 2: 15, 3: 3, 20: 1, 22: 4, 29: 2}
Did not match all atoms present	7073-36-1	C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)Cl	{24: 1, 17: 2, 38: 1, 14: 3}
Did not match all atoms present	7073-93-0	CC(C)C1=CC(=CC=C1)Cl	{1: 2, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	7073-94-1	CC(C)C1=CC=CC=C1Br	{1: 2, 18: 1, 3: 1, 14: 4}
Did not match all atoms present	7073-98-5	CC(C)(C)C1=CC=CC=C1Cl	{1: 3, 4: 1, 14: 4, 17: 1}
Did not match all atoms present	7074-00-2	CC(C)(C1=CC=CC=C1)OOC(=O)C2=CC=CC=C2	{1: 2, 4: 1, 22: 1, 14: 10, 28: 1}
Did not match all atoms present	7074-59-1	C1=CC=C(C=C1)CN2C=NC3=C(C2=O)NC=N3	{32: 1, 33: 1, 2: 1, 35: 2, 14: 7, 25: 1}
Did not match all atoms present	70747-05-6	CC(C1=CC(=CC=C1)C(C)(C)C)O	{1: 4, 3: 1, 4: 1, 14: 4, 20: 1}
Did not match all atoms present	70748-80-0	CCCCCCC(CC=CCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1)O.[Cl-]	{1: 3, 2: 17, 3: 1, 6: 2, 14: 5, 17: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	7075-03-8	C1CCN(CC1)C2(CCN(CC2)CCCN3C4=CC=CC=C4CCC5=CC=CC=C53)C(=O)N.O.Cl.Cl	{33: 3, 2: 3, 11: 11, 13: 1, 14: 8, 17: 2, 24: 1, 30: 1}
Did not match all atoms present	70750-05-9	CCCCCCCCCC(=O)[O-].C(CNCCO)N.[Na+]	{1: 1, 2: 12, 20: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	70750-06-0	CC1=C(C=CC=C1N=C=O)N=C=O.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(COCCO)O	{1: 1, 2: 5, 8: 4, 11: 8, 12: 4, 34: 4, 14: 3, 20: 2, 22: 1, 29: 4}
Did not match all atoms present	70750-23-1	CCl.C=CC1=CC=NC=C1	{1: 1, 35: 1, 5: 1, 6: 1, 14: 4, 17: 1}
Did not match all atoms present	70756-39-7	[OH-].[OH-].[OH-].[Fe+2]	{}
Did not match all atoms present	70759-58-9	C1CC2=CC3=C4CCC5=C(CC3)C=C1C6=C5CCC4=C2CC6	{11: 10, 14: 2}
Did not match all atoms present	70766-47-1	COP(OC)OCC1CC2CC1C=C2	{1: 2, 2: 1, 11: 2, 12: 3, 14: 2, 22: 3}
Did not match all atoms present	70766-48-2	COP(OCC1CC2CC1C=C2)OCC3CC4CC3C=C4	{1: 1, 2: 2, 11: 4, 12: 6, 14: 4, 22: 3}
Did not match all atoms present	70766-51-7	COP(OCC1CC2CC1C=C2)OCC3CC4CC3C5C4C6CC5C=C6	{1: 1, 2: 2, 11: 5, 12: 10, 14: 4, 22: 3}
Did not match all atoms present	70766-52-8	CC1=C(C(=C(C(=C1)C(C)(C)C)C)C(C)(C)C)O	{1: 8, 4: 2, 21: 1, 14: 1}
Did not match all atoms present	70766-53-9	CC1=C(C(=C(C(=C1)C(C)(C)C)C)C)O	{1: 6, 4: 1, 21: 1, 14: 1}
Did not match all atoms present	70766-54-0	CC1=C(C(=C(C=C1C(C)(C)C)C(C)(C)C)O)C	{1: 8, 4: 2, 21: 1, 14: 1}
Did not match all atoms present	70769-71-0	CCC(C)S(=O)C	{1: 3, 2: 1, 3: 1, 29: 1}
Did not match all atoms present	7077-43-2	CCN(CC)P1N(CCO1)C	{1: 3, 2: 2, 11: 2, 33: 2, 23: 1}
Did not match all atoms present	7077-65-8	C1=CC(=CC=C1C(C#N)C#N)[N+](=O)[O-]	{38: 1, 3: 1, 37: 2, 14: 4}
Did not match all atoms present	70771-71-0	COC1=CC=C(C=C1)C(C2CO2)O	{1: 1, 3: 1, 11: 1, 12: 1, 14: 4, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	70776-16-8	CCCCC(C)CCOCC(CS(=O)(=O)[O-])OCC(CS(=O)(=O)[O-])OCC(CS(=O)(=O)[O-])O.[Na+].[Na+].[Na+]	{1: 2, 2: 11, 3: 4, 20: 1, 22: 3, 29: 9}
Did not match all atoms present	70776-17-9	C1C2(COP(=O)(O1)O)COP(=O)(OC2)O.C1(=NC(=NC(=N1)N)N)N.C1(=NC(=NC(=N1)N)N)N	{35: 6, 11: 4, 13: 1, 20: 2, 23: 4, 29: 2, 30: 6}
Did not match all atoms present	70776-18-0	CCCCCCCC(=O)NCC[N+](CCO)(CC(=O)[O-])CC(=O)[O-].[OH-].[Na+].[Na+]	{24: 3, 1: 1, 2: 12, 20: 1, 31: 1}
Did not match all atoms present	70776-20-4	C1=CC(=CC=C1NCC2=NC(=NC(=N2)Cl)Cl)N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{2: 1, 35: 3, 38: 1, 6: 2, 34: 2, 14: 10, 17: 2, 29: 6, 31: 1}
Did not match all atoms present	70776-21-5	CCO[Si](CC(C)C)(OC)OCC	{1: 5, 2: 3, 3: 1, 22: 3}
Did not match all atoms present	70776-22-6	CCO[Si](CC(C)C)(OC)OC	{1: 5, 2: 2, 3: 1, 22: 3}
Did not match all atoms present	70776-33-9	CCCCCC1=NCC[N+]1(CCOCC(=O)[O-])CC(=O)[O-].[OH-].[Na+].[Na+]	{1: 1, 2: 8, 35: 1, 11: 2, 15: 1, 22: 1, 24: 2}
Did not match all atoms present	70776-35-1	[CH3-].CCC[CH2-].[Mg+2]	{1: 1, 2: 2, 5: 1}
Did not match all atoms present	70776-40-8	CC(=O)OCC=C.C=CCO.C=CC1=CC=CC=C1	{1: 1, 2: 2, 5: 3, 6: 3, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	70776-59-9	CCCCCCCC1=[N+](CCN1CCC(=O)[O-])CCO	{1: 1, 2: 10, 33: 2, 11: 2, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	70776-61-3	CC\1=NN(C(=N)/C1=N/NC2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl)C3=CC=CC=C3.CC(CN(C)C)CO	{1: 4, 2: 2, 3: 1, 36: 1, 33: 2, 34: 1, 14: 7, 15: 3, 17: 2, 35: 1, 20: 2, 29: 2, 31: 1}
Did not match all atoms present	70776-62-4	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])OC)N=NC3=CC=C(C=C3)[O-].[Na+].[Na+]	{1: 2, 34: 4, 22: 1, 14: 10, 29: 3}
Did not match all atoms present	70776-63-5	CC1=CC(=C(C=C1N=NC2=CC(=CC=C2)S(=O)(=O)[O-])OC)N=NC3=CC=C(C=C3)OC.[Na+]	{1: 3, 34: 4, 22: 2, 14: 10, 29: 3}
Did not match all atoms present	70776-64-6	CCC(C)O[Si]1(O[Si](O[Si](O1)(OC(C)CC)O[Si](OC(C)CC)(OC(C)CC)OC(C)CC)(OC(C)CC)OC(C)CC)C	{1: 15, 2: 7, 3: 7, 22: 8, 23: 3}
Did not match all atoms present	70776-71-5	CCCCCCCCCCOCC(C[N+](CC)(CCO)CCO)O.CCOS(=O)(=O)[O-]	{1: 3, 2: 17, 3: 1, 20: 3, 22: 2, 29: 3}
Did not match all atoms present	70776-73-7	CCCCCCCCOCC(C[N+](CC)(CCO)CCO)O.CCOS(=O)(=O)[O-]	{1: 3, 2: 15, 3: 1, 20: 3, 22: 2, 29: 3}
Did not match all atoms present	70776-74-8	C(CS)C(=O)[O-].[NH4+]	{24: 1, 2: 2, 39: 1}
Did not match all atoms present	70776-75-9	CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)N/N=C\3/C(=NC(=NC3=O)NC#N)N	{1: 2, 34: 1, 35: 2, 37: 1, 14: 7, 15: 3, 22: 1, 24: 1, 25: 1, 30: 1, 31: 3}
Did not match all atoms present	70776-87-3	CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN(CCC(=O)C4=CC=CC=C4)CCC(=O)C5=CC=CC=C5)C	{1: 4, 2: 5, 3: 1, 33: 1, 11: 5, 12: 1, 13: 2, 14: 13, 24: 2}
Did not match all atoms present	70776-88-4	CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CN(CCC(=O)C)CCC(=O)C)C	{1: 6, 2: 5, 3: 1, 33: 1, 11: 5, 12: 1, 13: 2, 14: 3, 24: 2}
Did not match all atoms present	70776-89-5	CC=CCC(CC=CC)(CC=CC)C1=CC=NC=C1	{1: 3, 2: 3, 35: 1, 4: 1, 6: 6, 14: 4}
Did not match all atoms present	70776-97-5	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)Cl)[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)Cl)[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 14, 17: 2, 29: 4, 30: 2}
Did not match all atoms present	70776-98-6	CCCCC(CC)C(=O)O.C(=O)(C(F)(F)F)O.[Ni]	{1: 2, 2: 4, 3: 1, 4: 1, 16: 3, 27: 2}
Did not match all atoms present	70784-97-3	CS(=O)(=O)/C=C/C1=CC=C(C=C1)Cl	{1: 1, 29: 2, 14: 4, 6: 2, 17: 1}
Did not match all atoms present	70784-98-4	COC1=CC=C(C=C1)/C=C/S(=O)(=O)C	{1: 2, 22: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	70786-64-0	CC1=CC=CC=C1C2=CC(=C(C=C2)N=O)C	{1: 2, 34: 1, 29: 1, 14: 7}
Did not match all atoms present	70786-72-0	CC1=CC=CC=C1C2=CC(=C(C=C2)NO)C	{1: 2, 20: 1, 14: 7, 31: 1}
Did not match all atoms present	70788-31-7	CCCCCCCCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]	{1: 3, 2: 16, 3: 2, 28: 1, 29: 3}
Did not match all atoms present	70788-32-8	CCCCCCCCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[NH4+]	{1: 3, 2: 16, 3: 2, 28: 1, 29: 3}
Did not match all atoms present	70788-44-2	CC(CSC1=CC=CC=C1N)SC2=CC=CC=C2N.C=O.C1=CC(=C(C=C1CC2=CC(=C(C=C2)N)Cl)Cl)N	{1: 1, 2: 2, 3: 1, 5: 1, 40: 2, 14: 14, 17: 2, 30: 4}
Did not match all atoms present	70788-47-5	CCC(C)O[Si]1(O[Si](O[Si](O1)(OC(C)CC)OC(C)CC)(OC(C)CC)OC(C)CC)OC(C)CC	{1: 12, 2: 6, 3: 6, 22: 6, 23: 3}
Did not match all atoms present	70788-48-6	C1=CC=C(C=C1)C(=O)NC2=C3C(=C4C(=C2)C5=CC6=C7C(=C5N4)C=CC=C7C(=O)C8=CC=CC=C86)C(=O)C9=CC=CC=C9C3=O	{24: 1, 25: 3, 32: 1, 14: 18, 31: 1}
Did not match all atoms present	70788-49-7	C1=CC=C2C(=C1)C3=C4C(=C5C(=C3)C6=CC(=C7C(=C6N5)C(=O)C8=CC=CC=C8C7=O)N)C=CC=C4C2=O	{32: 1, 25: 3, 30: 1, 14: 13}
Did not match all atoms present	70788-50-0	CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 6, 33: 1, 14: 9, 20: 4, 24: 1, 25: 2, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	70788-51-1	C1=CC=C(C=C1)S(=O)(=O)NCC(CS(=O)(=O)[O-])O.[Na+]	{2: 2, 3: 1, 14: 5, 20: 1, 29: 5, 31: 1}
Did not match all atoms present	70788-53-3	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(C(=O)[O-])(F)F)(F)F)F)(F)F)F.C(=C(F)F)(F)F.[K+]	{16: 17, 24: 1, 4: 5, 22: 2, 7: 4}
Did not match all atoms present	70788-54-4	C1=C(C(=C(N=C1C(Cl)(Cl)Cl)Cl)Cl)Cl	{17: 6, 35: 1, 4: 1, 14: 1}
Did not match all atoms present	70788-56-6	C1=CC(=CC=C1C(Cl)Cl)C(=O)C2=C(C=CC(=C2)Cl)Cl	{24: 1, 17: 4, 3: 1, 14: 7}
Did not match all atoms present	70788-59-9	CN(C)CNC(=O)C=C.C=CC(=O)[O-].[Na+]	{1: 2, 2: 1, 5: 2, 6: 2, 33: 1, 24: 2, 31: 1}
Did not match all atoms present	70788-61-3	C1=CC(=C(C=C1C(=O)C2=CC(=CC(=C2)Cl)Cl)C(Cl)Cl)C(Cl)Cl	{24: 1, 17: 6, 3: 2, 14: 6}
Did not match all atoms present	70788-62-4	[H+].COC1=NC(=NC(=N1)NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=CC=CC=C4C(=O)[O-])S(=O)(=O)[O-])Cl.COC1=NC(=NC(=N1)NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=CC=CC=C4C(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Cr+3]	{1: 2, 34: 4, 35: 6, 14: 16, 17: 2, 22: 2, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	708-06-5	C1=CC=C2C(=C1)C=CC(=C2C=O)O	{26: 1, 21: 1, 14: 6}
Did not match all atoms present	708-64-5	C1=CC(=CC(=C1)F)C(=O)C(F)(F)F	{16: 4, 24: 1, 4: 1, 14: 4}
Did not match all atoms present	708-76-9	COC1=CC(=C(C(=C1)OC)C=O)O	{1: 2, 22: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	70801-03-5	B(O)(O)O.CC(C)(C)CCCCCC(=O)O.CC(C)(C)CCCCCC(=O)O.CC(C)(C)CCCCCC(=O)O.[Zn].[Zn].[Zn]	{1: 9, 2: 15, 27: 3, 4: 3, 20: 3}
Did not match all atoms present	70801-05-7	CC(C)C1=CC=C(C=C1)OC2=CC(=CC=C2)Cl	{1: 2, 3: 1, 22: 1, 14: 8, 17: 1}
Did not match all atoms present	70807-22-6	CC(=O)[CH-]C#N.[Na+]	{24: 1, 1: 1, 37: 1, 6: 1}
Did not match all atoms present	7081-53-0	CCN1CC(C(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3)CCN4CCOCC4.O.Cl	{1: 1, 2: 3, 33: 2, 11: 5, 12: 1, 13: 1, 14: 10, 17: 1, 23: 1, 25: 1}
Did not match all atoms present	70815-05-3	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(F)(F)S(=O)O)(F)F)F)(F)F)F.C(=C(F)F)(F)F	{4: 5, 7: 4, 16: 17, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	70815-07-5	C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)S(=O)(=O)[O-])NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N)Cl.[Na+].[Na+]	{36: 1, 14: 11, 15: 5, 17: 1, 24: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	70815-09-7	CC1=C(C=CC(=C1)S(=O)(=O)[O-])N=NC2C(=NN(C2=O)C3=CC(=C(C=C3Cl)S(=O)(=O)[O-])Cl)C.[Na+].[Na+]	{1: 2, 34: 2, 35: 1, 33: 1, 12: 1, 14: 5, 15: 1, 17: 2, 25: 1, 29: 6}
Did not match all atoms present	70815-15-5	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC(=C(C=C4O2)C)NC5=CC=CC=C5)C6=C(C=CC(=C6)C(=O)OCC)C(=O)O3	{1: 4, 2: 3, 33: 1, 13: 1, 14: 13, 23: 1, 28: 2, 31: 1}
Did not match all atoms present	70815-17-7	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=C(C=C(C3=O)S(=O)(=O)[O-])N([O-])[O-].[Cr+3]	{1: 1, 34: 4, 35: 1, 38: 1, 33: 1, 14: 16, 15: 4, 25: 2, 29: 3}
Did not match all atoms present	70815-21-3	C1=CC(=CC(=C1)P(=O)([O-])[O-])N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[NH4+].[NH4+].[NH4+].[NH4+].[Na+]	{34: 3, 14: 9, 15: 2, 20: 1, 25: 1, 29: 14, 30: 1, 31: 1}
Did not match all atoms present	70815-22-4	CC(=O)N(C)C1=CC2=C(C=C1)C=C(/C(=N\NC3=CC(=CC=C3)P(=O)(O)[O-])/C2=O)S(=O)(=O)[O-].[NH4+].[NH4+]	{1: 2, 34: 1, 33: 1, 14: 8, 15: 2, 20: 1, 24: 1, 25: 1, 29: 5, 31: 1}
Did not match all atoms present	70815-24-6	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(/C(=N\NC3=CC(=CC=C3)P(=O)(O)[O-])/C2=O)S(=O)(=O)[O-].[NH4+].[NH4+].[Na+]	{1: 1, 34: 1, 14: 7, 15: 2, 20: 1, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	70815-25-7	CCN1C(=O)C(=C(/C(=N/NC2=CC(=CC=C2)P(=O)([O-])[O-])/C1=O)C)C(=O)N.[K+].[K+]	{1: 2, 2: 1, 33: 1, 34: 1, 14: 4, 15: 3, 24: 1, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	70815-26-8	CC\1=C(C(=O)N(C(=O)/C1=N\NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)P(=O)([O-])[O-])S(=O)(=O)[O-])CCC4=CC=C(C=C4)S(=O)(=O)O)C(=O)N.[NH4+].[NH4+].[NH4+]	{1: 1, 2: 2, 33: 1, 34: 3, 14: 11, 15: 3, 20: 1, 24: 1, 25: 2, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	70815-27-9	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])N=[N+](C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=NC5=C(C=C(C=C5)N=NC6=CC(=CC=C6)S(=O)(=O)[O-])OC)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 6, 6: 2, 33: 2, 14: 20, 22: 2, 29: 14}
Did not match all atoms present	70815-29-1	CC1CCC(=C(C)C)CC1.C=O.C1=CC=C(C=C1)O	{1: 3, 5: 1, 7: 1, 11: 4, 12: 1, 14: 5, 15: 1, 21: 1}
Did not match all atoms present	7082-21-5	CC(CC(C1=CC=CC=C1)C2=CC=CC=C2)NC(C)(C)C.Cl	{1: 4, 2: 1, 3: 2, 4: 1, 14: 10, 17: 1, 31: 1}
Did not match all atoms present	7082-71-5	C1=CN=CC=C1C(=O)OC(=O)C2=CC=NC=C2	{35: 2, 28: 2, 14: 8}
Did not match all atoms present	7083-24-1	CC(CN1C=CC=C1C(=O)CC2=CC=CC=C2)[NH+](C)C.C(C(=O)O)C(CC(=O)O)(C(=O)[O-])O	{1: 3, 2: 4, 3: 1, 4: 1, 33: 1, 14: 8, 20: 1, 24: 2, 27: 2}
Did not match all atoms present	7083-63-8	C1C2=C(C3=CC=CC=C31)C(=CC=C2)N	{11: 1, 30: 1, 14: 7}
Did not match all atoms present	70833-36-2	[H+].C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])N=NC3=C(C(=C(C(=C3)N=NC4=CC(=CC(=C4[O-])[N+](=O)[O-])[N+](=O)[O-])[O-])N=NC5=CC=C(C=C5)[N+](=O)[O-])O.C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])N=NC3=C(C(=C(C(=C3)N=NC4=CC(=CC(=C4[O-])[N+](=O)[O-])[N+](=O)[O-])[O-])N=NC5=CC(=C(C=C5)[N+](=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+].[Na+].[Cr+3]	{34: 12, 38: 8, 14: 27, 21: 2, 29: 9, 31: 2}
Did not match all atoms present	70833-39-5	CCC(C)(C)OOC(=O)C1=CC=CC=C1C	{1: 4, 2: 1, 4: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	70833-42-0	CC(C)(C#CC(C)(C)OO)OO.CC(C)(C1=CC(=CC=C1)C(C)(C)O)O	{1: 8, 4: 4, 10: 2, 14: 4, 20: 4, 22: 2}
Did not match all atoms present	70833-46-4	CCN(CC)C1=CC(=O)/C(=N/NC2=CC=C(C=C2)N/N=C\3/C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=CC=C(C=C5)N/N=C/6\C=CC(=CC6=O)N(CC)CC)S(=O)(=O)O)S(=O)(=O)O)/C=C1	{1: 4, 2: 4, 33: 2, 34: 5, 14: 16, 15: 6, 20: 2, 25: 3, 29: 4, 30: 1, 31: 3}
Did not match all atoms present	70833-47-5	CC1=C(C(=CC=C1)Cl)N2C(=O)C(C(=N2)C)N=NC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)O	{1: 2, 34: 2, 35: 1, 33: 1, 12: 1, 14: 9, 15: 1, 17: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	70833-48-6	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)N)OC)N/N=C\3/C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=C(C=C(C(=C5)C)N=NC6=CC=C(C=C6)N)OC)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 34: 7, 14: 14, 15: 2, 20: 2, 22: 2, 25: 1, 29: 4, 30: 3, 31: 1}
Did not match all atoms present	70833-50-0	CCCCCCCCCCCC1C(C(=O)C(=C1C(=O)OCC)[O-])[N+](=O)[O-].[Na+]	{1: 2, 2: 11, 38: 1, 12: 2, 15: 2, 25: 1, 28: 1}
Did not match all atoms present	70833-51-1	CCCCCCCCCCCC(C[N+](=O)[O-])[O-].[Na+]	{1: 1, 2: 11, 3: 1, 29: 1, 38: 1}
Did not match all atoms present	70833-63-5	C1=C(C=C(C(=C1Cl)CC#N)Cl)Cl	{17: 3, 2: 1, 37: 1, 14: 2}
Did not match all atoms present	70833-64-6	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N=NC6=CC=CC=C6)S(=O)(=O)O)C=CC=C3S(=O)(=O)O	{34: 4, 20: 2, 29: 4, 14: 20, 31: 1}
Did not match all atoms present	7084-07-3	C[NH+](C)CCN(CC1=CC=CS1)C2=CC=CC=C2.[Cl-]	{1: 2, 2: 3, 33: 1, 41: 1, 14: 8, 17: 1}
Did not match all atoms present	70850-11-2	COC(=O)C1C2CC(C1C(=O)O)C=C2.C1=CC(=CC=C1N)N.C1=CC2=C(C=C1C(C3=CC4=C(C=C3)C(=O)OC4=O)(C(F)(F)F)C(F)(F)F)C(=O)OC2=O	{1: 1, 4: 3, 11: 1, 12: 4, 14: 12, 16: 6, 27: 1, 28: 5, 30: 2}
Did not match all atoms present	70850-86-1	CCO[PH+]([O-])OCC.CCO[PH+]([O-])OCC.CCO[PH+]([O-])OCC.[CH-]1C=CC=C1.[Na+].[Co+3]	{1: 6, 2: 6, 22: 6, 14: 5, 29: 3}
Did not match all atoms present	70850-92-9	CCCCCCCCCCCCCCCC(=O)OCC(CO)(CO)COC(=O)C1=CC=CC=C1.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 1, 2: 18, 4: 1, 14: 9, 20: 2, 28: 4}
Did not match all atoms present	70850-93-0	CC(C)(C)C1=CC=C(C=C1)C(=O)OCC(C)(C)CO.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O.C(CCC(=O)O)CC(=O)O	{1: 5, 2: 6, 4: 2, 14: 7, 20: 1, 27: 3, 28: 3}
Did not match all atoms present	70851-42-2	C1=CC(=CC(=C1)P(=O)(O)O)NC2=NC(=NC(=N2)Cl)NC3=C(C=C(C(=C3)S(=O)(=O)O)NC4=C(C5=C(C=C4)N=C6C(=C(C7=NC8=CC(=C(C=C8OC7=C6Cl)S(=O)(=O)[O-])NC9=CC(=C(C=C9S(=O)(=O)O)NC1=NC(=NC(=N1)NC1=CC(=CC=C1)P(=O)(O)O)Cl)S(=O)(=O)O)Cl)O5)S(=O)(=O)[O-])S(=O)(=O)O.[NH4+].[Na+]	{35: 8, 14: 16, 17: 4, 20: 8, 23: 2, 29: 16, 31: 6}
Did not match all atoms present	70851-43-3	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC(=C(C=C4O2)C)NC5=CC=CC=C5)C6=C(C=CC(=C6)C(=O)O)C(=O)O3	{1: 3, 2: 2, 33: 1, 13: 1, 14: 13, 23: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	70851-44-4	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC3=[N+](C4=C(C=CC(=C4)NC5=C(C=C(C=C5)NC6=NC(=NC(=N6)NC7=CC(=CC=C7)P(=O)(O)[O-])Cl)S(=O)(=O)[O-])N=C3C=C2)C8=CC(=C(C=C8)OC)S(=O)(=O)[O-].[NH4+].[NH4+].[NH4+]	{1: 2, 2: 2, 35: 4, 33: 2, 14: 20, 17: 1, 20: 1, 22: 1, 29: 11, 31: 3}
Did not match all atoms present	70851-46-6	CCO[Si](C)(CC(C)C1=CC=CC=C1)OCC	{1: 4, 2: 3, 3: 1, 22: 2, 14: 5}
Did not match all atoms present	70851-47-7	CCCCCCCCCCCC[Si](C)(C)CCl	{1: 3, 2: 12, 17: 1}
Did not match all atoms present	70851-48-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 29, 17: 3}
Did not match all atoms present	70851-49-9	C[Si]1(OCCOCCOCCOCCO1)C	{1: 2, 11: 8, 23: 5}
Did not match all atoms present	70851-50-2	CCCCCCCCCCCCCCCCCC[Si](C)(OC)OC	{1: 4, 2: 17, 22: 2}
Did not match all atoms present	70851-51-3	CO[Si](CCCN1C=CN=C1)(OC)OC	{1: 3, 2: 3, 35: 1, 33: 1, 14: 3, 22: 3}
Did not match all atoms present	70851-52-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](C)(C)Cl	{1: 3, 2: 29, 17: 1}
Did not match all atoms present	70851-53-5	CO[Si](CCCNCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N=[N+]=[N-])(OC)OC	{1: 3, 2: 5, 34: 2, 14: 4, 22: 3, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	70851-54-6	CO[Si](CCN1C2=CC=CC=C2C3=CC=CC=C31)(OC)OC	{1: 3, 2: 2, 22: 3, 14: 8, 33: 1}
Did not match all atoms present	70851-56-8	C(N(COP(=O)([O-])[O-])C(=O)N(COP(=O)([O-])[O-])COP(=O)([O-])[O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{24: 1, 33: 2, 2: 4, 29: 12, 22: 4}
Did not match all atoms present	70851-57-9	C(C(COP(=O)([O-])[O-])(COP(=O)([O-])[O-])COP(=O)([O-])[O-])OP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]	{2: 4, 4: 1, 29: 12, 22: 4}
Did not match all atoms present	70851-58-0	CC1=NC2=C(C=C1)C3=CC(=CC(=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 35: 1, 29: 6, 14: 6}
Did not match all atoms present	70865-19-9	CO[Si](CCC1=CC(=CC=C1)CN)(OC)OC	{1: 3, 2: 3, 30: 1, 22: 3, 14: 4}
Did not match all atoms present	70865-21-3	CCN(CC(CCl)O)C1=CC(=C(C=C1)N=NC2=NC=C(S2)[N+](=O)[O-])C	{1: 2, 2: 3, 3: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 4, 17: 1, 35: 1, 20: 1}
Did not match all atoms present	70865-25-7	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)[O-])C(=O)O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 1, 34: 2, 35: 4, 12: 1, 14: 11, 15: 1, 17: 1, 25: 1, 27: 1, 29: 9, 31: 2}
Did not match all atoms present	70865-26-8	COC1=CC(=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NCC4=NC(=NC(=N4)Cl)NC5=CC(=CC=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 2: 1, 35: 3, 34: 1, 14: 11, 15: 2, 17: 1, 22: 1, 25: 1, 29: 9, 31: 3}
Did not match all atoms present	70865-28-0	C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)O)N=NC3=C(C=C(C=C3)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{33: 1, 34: 2, 35: 4, 12: 1, 14: 7, 15: 1, 17: 2, 25: 1, 27: 1, 29: 6, 31: 1}
Did not match all atoms present	70865-32-6	C1=CC(=CC=C1N=NC2=CC(=C(C=C2Cl)S(=O)(=O)NCCCl)Cl)N(CCO)CCO	{33: 1, 2: 6, 34: 2, 14: 6, 17: 3, 20: 2, 29: 2, 31: 1}
Did not match all atoms present	70865-33-7	C1=CC=C2C(=C1)C(=CC=C2N=NC3=C(C=C(C=C3)S(=O)(=O)NCCCl)Cl)NCCO	{2: 4, 34: 2, 14: 9, 17: 2, 20: 1, 29: 2, 31: 2}
Did not match all atoms present	70865-34-8	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C2=O)C(=CC(=C3N)S(=O)(=O)[O-])NC4=CC=C(C=C4)N=NC5=C(C=C(C=C5)NC6=NC(=NC(=N6)Cl)Cl)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 35: 3, 14: 11, 17: 2, 25: 2, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	70865-35-9	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)N=NC5=C(C=C(C=C5)NC6=NC(=NC(=N6)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]	{34: 2, 35: 3, 14: 11, 17: 2, 25: 2, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	70865-36-0	C1=CC(=C(C=C1NC2=C3C(=C(C=C2)N)C(=O)C4=C(C3=O)C=CC(=C4S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC5=NC(=NC(=N5)Cl)Cl.[Na+].[Na+].[Na+]	{35: 3, 14: 7, 17: 2, 25: 2, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	70865-37-1	CCCCC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)CCCC)S(=O)(=O)[O-])C(=O)C5=C(C=CC(=C5C3=O)O)O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 6, 14: 10, 21: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	70865-38-2	CC1=CC(=CC=C1)N=NC2=CC=C(C3=CC=CC=C32)N=NC4=CC=CC=C4	{1: 1, 34: 4, 14: 15}
Did not match all atoms present	70865-39-3	C1=CC=C(C(=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=C(C=C(C=C5)S(=O)(=O)[O-])C(=O)[O-])Cl)S(=O)(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 1, 35: 3, 14: 10, 15: 2, 17: 1, 20: 1, 24: 1, 25: 1, 29: 11, 31: 3}
Did not match all atoms present	70869-38-4	C(COCC(CS(=O)(=O)O)O)C[Si](O)(O)O	{2: 5, 3: 1, 20: 5, 29: 2, 22: 1}
Did not match all atoms present	70880-04-5	[Li+].[Li+].C1=CC(=CC=C1NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)[O-])N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 14, 20: 4, 29: 12, 31: 4}
Did not match all atoms present	70880-05-6	CCO[Si](CCCNS(=O)(=O)C1=CC=CC2=C1C=CC=C2N(C)C)(OCC)OCC	{1: 5, 2: 6, 33: 1, 14: 6, 22: 3, 29: 2, 31: 1}
Did not match all atoms present	70880-06-7	CCCCCCCCCCCCCCCCCC(=O)O[Si](OCCC)(OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC	{1: 4, 2: 50, 28: 3, 22: 1}
Did not match all atoms present	70886-56-5	CS(=O)(=O)OC/C=C\COS(=O)(=O)C	{1: 2, 2: 2, 22: 2, 6: 2, 29: 4}
Did not match all atoms present	70892-33-0	C=O.C1=CC(=CC(=C1)N)N.S	{30: 2, 5: 1, 14: 4}
Did not match all atoms present	70892-49-8	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)OC)N.C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)/C=C/C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O.[Na+].[Na+].[S-2]	{1: 2, 34: 2, 38: 2, 6: 2, 14: 12, 20: 3, 22: 1, 29: 6, 30: 1}
Did not match all atoms present	70892-78-3	CCCCCCCCCCCC1=[N+](CCN1CCOCC(=O)[O-])CC(CS(=O)(=O)[O-])O.[OH-].[Na+].[Na+]	{1: 1, 2: 15, 3: 1, 33: 2, 11: 2, 15: 1, 20: 1, 22: 1, 24: 1, 29: 3}
Did not match all atoms present	70892-80-7	C(CCCCBr)CCC[Si](Cl)(Cl)Cl	{17: 3, 2: 8, 18: 1}
Did not match all atoms present	70892-81-8	CC(C)(C)[Si](C)(C(C)(C)C)Cl	{1: 7, 4: 2, 17: 1}
Did not match all atoms present	70892-82-9	C1=CN=CC=C1C(=O)N(CCO)CCO	{33: 1, 2: 4, 35: 1, 14: 4, 20: 2, 24: 1}
Did not match all atoms present	70892-83-0	C1=CC2=C(C=C1S(=O)(=O)O)C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])O.C(CON=C(N)N)[C@@H](C(=O)O)N	{2: 2, 3: 1, 38: 2, 7: 1, 34: 1, 14: 4, 20: 1, 21: 1, 22: 1, 27: 1, 29: 2, 30: 3}
Did not match all atoms present	70892-84-1	CC1=NN(C(=C1)N/N=C\2/C(=NC3=CC=CC=C32)C)C4=CC=CC=C4	{1: 2, 34: 1, 35: 2, 33: 1, 14: 10, 15: 2, 31: 1}
Did not match all atoms present	70892-86-3	C1=CC=C(C=C1)O.C1=COC(=C1)C=O.C(=O)([O-])[O-].[K+].[K+]	{24: 1, 26: 1, 21: 1, 14: 8, 23: 1}
Did not match all atoms present	70892-87-4	C=O.C1=CC=C(C=C1)N.C1=CC=C(C=C1)O.C(=O)(C(=O)O)O	{30: 1, 27: 2, 5: 1, 14: 10, 21: 1}
Did not match all atoms present	70892-94-3	[H+].C1=CC=C(C(=C1)C(=O)[O-])N=NC2=C(C=C3C(=C2[O-])C=CC(=C3)NC4=NC(=NC(=N4)Cl)NC5=C(C=C(C=C5)/C=C/C6=C(C=C(C=C6)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].C1=CC=C(C(=C1)C(=O)[O-])N=NC2=C(C=C3C(=C2[O-])C=CC(=C3)NC4=NC(=NC(=N4)Cl)NC5=C(C=C(C=C5)/C=C/C6=C(C=C(C=C6)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Cr+3]	{34: 4, 35: 6, 38: 2, 6: 4, 14: 28, 17: 2, 24: 2, 29: 18, 31: 4}
Did not match all atoms present	70893-52-6	CC1=C(C(=CC=C1)NC(=O)OCCOC(=O)C=C)NC(=O)OCCOC(=O)C=C	{1: 1, 2: 4, 5: 2, 6: 2, 14: 3, 28: 4, 31: 2}
Did not match all atoms present	70896-73-0	CCCCCCCCCCC(CS(=O)(=O)O)O	{1: 1, 2: 10, 3: 1, 20: 2, 29: 2}
Did not match all atoms present	709-09-1	COC1=C(C=C(C=C1)[N+](=O)[O-])OC	{1: 2, 38: 1, 22: 2, 14: 3}
Did not match all atoms present	709-19-3	CC1=NC2=C(N1)C=C(C=C2)C(=O)O	{32: 1, 1: 1, 27: 1, 14: 3, 35: 1}
Did not match all atoms present	709-49-9	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])I	{19: 1, 38: 2, 14: 3}
Did not match all atoms present	709-55-7	CCNCC(C1=CC(=CC=C1)O)O	{1: 1, 2: 2, 3: 1, 14: 4, 20: 1, 21: 1, 31: 1}
Did not match all atoms present	709-63-7	CC(=O)C1=CC=C(C=C1)C(F)(F)F	{16: 3, 1: 1, 4: 1, 14: 4, 24: 1}
Did not match all atoms present	709-90-0	CC(CC1=CC=CC=C1)OC(=O)N	{1: 1, 2: 1, 3: 1, 14: 5, 28: 1, 30: 1}
Did not match all atoms present	709-98-8	CCC(=O)NC1=CC(=C(C=C1)Cl)Cl	{1: 1, 2: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	70900-27-5	CC(CCOS(=O)(=O)C1=CC=CC=C1)N=C2C=CC(=NC(C)CCOS(=O)(=O)C3=CC=CC=C3)C4=C(C5=CC=CC=C5C(=C24)[O-])[O-].[Na+].[Na+]	{1: 2, 2: 4, 3: 2, 34: 2, 14: 16, 15: 2, 22: 2, 29: 4}
Did not match all atoms present	70900-29-7	C1=C(C=C(C(=C1O)C(=O)O)N)[N+](=O)[O-]	{38: 1, 30: 1, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	70900-30-0	CC(=O)NC1=CC(=C(C(=C1)S(=O)(=O)O)OC)N	{1: 2, 14: 2, 20: 1, 22: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	70900-41-3	CC1=C(C(=C(C(=C1NC2=NC(=NC(=N2)Cl)OC3=CC=C(C=C3)S(=O)(=O)[O-])C)S(=O)(=O)[O-])C)NC4=CC(=C(C5=C4C(=O)C6=CC=CC=C6C5=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 3, 35: 3, 14: 9, 17: 1, 22: 1, 25: 2, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	70900-42-4	C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)O)N=NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)Cl)NC5=CC(=C(C=C5)NC(=O)NC6=C(C=C(C=C6)NC7=NC(=NC(=N7)NC8=CC(=C(C=C8)S(=O)(=O)[O-])N=NC9C(=NN(C9=O)C1=CC=C(C=C1)S(=O)(=O)[O-])C(=O)O)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 2, 34: 4, 35: 8, 12: 2, 14: 20, 15: 2, 17: 2, 24: 1, 25: 2, 27: 2, 29: 18, 31: 6}
Did not match all atoms present	70900-43-5	CC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 3, 2: 4, 38: 1, 33: 1, 34: 2, 14: 7, 28: 2}
Did not match all atoms present	70900-44-6	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])N=NC3=CC=C(C=C3)[O-].[Na+].[Na+]	{1: 1, 34: 4, 22: 1, 14: 11, 29: 3}
Did not match all atoms present	70900-45-7	C1=CC(=CC=C1N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 1, 34: 2, 35: 4, 12: 1, 14: 7, 15: 1, 17: 2, 24: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	70900-48-0	CCCCOCCOCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCOCCOCCCC)C(=O)OCCOCCOCCCC	{1: 3, 2: 21, 28: 3, 22: 6, 14: 3}
Did not match all atoms present	70904-60-8	CCCCCCCCC=CCCCCCCCCNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 16, 3: 1, 6: 2, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	70907-55-0	CC(/C(=N\O)/N)OC1=CC=CC=C1C2CCCCC2	{1: 1, 34: 1, 3: 1, 7: 1, 11: 5, 12: 1, 14: 4, 20: 1, 22: 1, 30: 1}
Did not match all atoms present	70907-61-8	C1CCC(CC1)C2=CC=CC=C2OCCC3=NCC[NH2+]3.[Cl-]	{2: 2, 35: 1, 11: 7, 12: 1, 14: 4, 15: 1, 17: 1, 22: 1}
Did not match all atoms present	70911-39-6	C1=CC(=CC(=C1)P(=O)(O)O)N=NC2=CC=C(C=C2)N	{30: 1, 34: 2, 20: 2, 29: 1, 14: 8}
Did not match all atoms present	70911-42-1	CC1=CC(=O)N(C(=C1C(=O)N)O)CCC2=CC=C(C=C2)S(=O)(=O)O	{1: 1, 2: 2, 33: 1, 14: 5, 20: 1, 21: 1, 24: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	70911-48-7	C1=CC(=CC(=C1)P(=O)(O)O)N=NC2=CC(=C(C=C2)N)S(=O)(=O)O	{30: 1, 34: 2, 20: 3, 29: 3, 14: 7}
Did not match all atoms present	70917-34-9	CC(C)OC(=O)C1=CC(=C2C(=C1N)C(=O)C3=CC=CC=C3C2=O)N	{1: 2, 3: 1, 14: 5, 25: 2, 28: 1, 30: 2}
Did not match all atoms present	7093-10-9	C1CC2=C3C1=CC=CC3=CC4=C2C5=CC=CC=C5C=C4	{11: 2, 14: 10}
Did not match all atoms present	7093-29-0	COP1OCC2(CO1)COP(OC2)OC	{1: 2, 11: 4, 13: 1, 22: 2, 23: 4}
Did not match all atoms present	7093-41-6	CCOP1OCC2(CO1)COP(OC2)OCC	{1: 2, 2: 2, 11: 4, 13: 1, 22: 2, 23: 4}
Did not match all atoms present	7094-34-0	C1=CC(=CC(=C1)Cl)C(=O)C2=CC(=CC=C2)Cl	{24: 1, 17: 2, 14: 8}
Did not match all atoms present	70942-00-6	C(CS(=O)(=O)[O-])OCN1C(C(N(C1=O)CO)O)O.[Na+]	{33: 2, 2: 4, 12: 2, 20: 3, 22: 1, 25: 1, 29: 3}
Did not match all atoms present	70942-02-8	CCCCCCCCCC1=NCCN1CCOCCC(=O)[O-].[Na+]	{1: 1, 2: 12, 35: 1, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1}
Did not match all atoms present	70942-04-0	C1C(CC2=CC=CC=C2C1Br)C3=CC=C(C=C3)C4=CC=C(C=C4)Br	{18: 2, 11: 2, 12: 2, 14: 12}
Did not match all atoms present	70942-07-3	C1C=CCC2C1C(=O)OC2=O.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O.C(COCCO)O	{2: 4, 11: 2, 12: 2, 14: 5, 20: 2, 22: 1, 27: 1, 28: 4}
Did not match all atoms present	70942-11-9	CCCCCCCCCCCCS.CC(=C)C(=O)OCCN=C=O.C=CC1=CC=CC=C1	{1: 2, 2: 13, 5: 2, 6: 1, 7: 1, 8: 1, 39: 1, 34: 1, 14: 5, 28: 1, 29: 1}
Did not match all atoms present	70942-20-0	CC[N+](C)(C)CCCNC(=O)C(=C)C.CCOS(=O)(=O)[O-].C=CC(=O)N	{1: 5, 2: 5, 5: 2, 6: 1, 7: 1, 22: 1, 24: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	70942-21-1	CC(COC(=O)C=C)O.CC(=C)C(=O)O.C=CC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 5: 3, 6: 2, 7: 1, 14: 5, 20: 1, 27: 1, 28: 1}
Did not match all atoms present	70942-24-4	C(C[Si](O)(O)O)CS(=O)(=O)O	{2: 3, 20: 4, 29: 2}
Did not match all atoms present	70942-25-5	C(C[Si](O)(O)O)CS(=O)(=O)[O-].[Na+]	{2: 3, 20: 3, 29: 3}
Did not match all atoms present	70942-26-6	C(C[Si](O)(O)O)CS(=O)(=O)[O-].[K+]	{2: 3, 20: 3, 29: 3}
Did not match all atoms present	70942-27-7	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)Br)CCC(=O)O)C=C3N(C4=C(S3)C=C(C(=C4)C)C)CC.[I-]	{1: 4, 2: 4, 33: 2, 6: 2, 7: 1, 41: 2, 14: 5, 15: 1, 18: 1, 19: 1, 27: 1}
Did not match all atoms present	70942-28-8	COC(=O)CCCCC(=O)OCCS[Sn](C)(SCCOC(=O)CCCCC(=O)OC)SCCOC(=O)CCCCC(=O)OC	{40: 3, 1: 4, 2: 18, 28: 6}
Did not match all atoms present	70942-29-9	COC(=O)CCCC(=O)OCCS[Sn](C)(SCCOC(=O)CCCC(=O)OC)SCCOC(=O)CCCC(=O)OC	{40: 3, 1: 4, 2: 15, 28: 6}
Did not match all atoms present	70942-30-2	CCCC[Sn](CCCC)(OC(=O)CCC(=O)OCCN(C)C)OC(=O)CCC(=O)OCCN(C)C	{1: 6, 2: 14, 28: 4, 33: 2}
Did not match all atoms present	70942-31-3	CCCC[Sn](CCCC)(CC(=O)/C=C\C(=O)CCCN(C)C)CC(=O)/C=C\C(=O)OCCN(C)C	{1: 6, 2: 13, 6: 4, 33: 2, 24: 3, 28: 1}
Did not match all atoms present	70942-34-6	CCCC[Sn](CCCC)(SCCOC(=O)CCCC(=O)OC)SCCOC(=O)CCCC(=O)OC	{40: 2, 1: 4, 2: 16, 28: 4}
Did not match all atoms present	70942-35-7	CCCC[Sn](SCCOC(=O)CCCCC(=O)OC)(SCCOC(=O)CCCCC(=O)OC)SCCOC(=O)CCCCC(=O)OC	{40: 3, 1: 4, 2: 21, 28: 6}
Did not match all atoms present	70942-36-8	CCCC[Sn](SCCOC(=O)CCCC(=O)OC)(SCCOC(=O)CCCC(=O)OC)SCCOC(=O)CCCC(=O)OC	{40: 3, 1: 4, 2: 18, 28: 6}
Did not match all atoms present	70942-37-9	CC/C(=C\C1=[N+](C2=C([Se]1)C=CC(=C2)OC)CC)/C=C\3/N(C4=C(S3)C=C(C(=C4)C)OC)CCC(=O)O.[I-]	{1: 5, 2: 4, 33: 2, 6: 2, 7: 1, 41: 1, 14: 5, 15: 1, 19: 1, 22: 2, 27: 1}
Did not match all atoms present	70942-38-0	CCN1CCCC1=CC=CC2=[N+](CCC2)CCCS(=O)(=O)[O-]	{1: 1, 2: 4, 6: 3, 33: 2, 11: 6, 15: 2, 29: 3}
Did not match all atoms present	70942-39-1	CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)N3C(=O)C(C(=N3)OCC)SC4=NN=NN4C5=CC=CC=C5)C(C)(C)CC	{1: 7, 2: 4, 35: 4, 4: 2, 33: 2, 40: 1, 12: 1, 14: 12, 15: 1, 22: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	70942-44-8	CC(=C)C(=O)NCCC[N+](C)(C)CCO.CC(=O)[O-]	{1: 4, 2: 5, 5: 1, 7: 1, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	70942-46-0	CCCCCCCCCCCCCCOC(=O)CCS[Sn](CCCC)(CCCC)SCCC(=O)OCCCCCCCCCCCCCC	{40: 2, 1: 4, 2: 36, 28: 2}
Did not match all atoms present	70942-47-1	CCCCCCCCCCCCCOC(=O)CCS[Sn](CCCC)(CCCC)SCCC(=O)OCCCCCCCCCCCCC	{40: 2, 1: 4, 2: 34, 28: 2}
Did not match all atoms present	70951-83-6	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3[C@@H]([C@H]([C@@H]5[C@H]4O5)O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	70953-85-4	CCCCCCCCCCC(CS(=O)(=O)[O-])O.[NH4+]	{1: 1, 2: 10, 3: 1, 20: 1, 29: 3}
Did not match all atoms present	70955-53-2	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCC(=O)O.CC(C)CCCCC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{27: 6, 1: 5, 2: 22, 3: 1, 14: 4}
Did not match all atoms present	70955-54-3	CCCCCCCCCCC(=O)O.CCCCCCCCC(=O)O.CCCCCCC(=O)O.CC(C)CCCCC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{27: 6, 1: 5, 2: 25, 3: 1, 14: 4}
Did not match all atoms present	70955-55-4	CCCCCCCCC(=O)O.CCCCCCC(=O)O.CC(C)CCCCC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{27: 5, 1: 4, 2: 16, 3: 1, 14: 4}
Did not match all atoms present	70955-56-5	CCCCCCCCC(=O)O.CCCCCCC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O	{1: 2, 2: 12, 27: 4, 14: 4}
Did not match all atoms present	70955-60-1	CCC(=O)O.C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O	{1: 1, 2: 1, 27: 4, 14: 3}
Did not match all atoms present	70955-70-3	CC1(C2CCC(C2)C1=C)C.COC1=CC=CC=C1O	{1: 3, 5: 1, 11: 3, 12: 2, 13: 1, 14: 4, 15: 1, 21: 1, 22: 1}
Did not match all atoms present	70955-74-7	CC(C)CCCCCCCCCCO[P+](=O)OCCCCCCCCCCC(C)C	{1: 4, 2: 20, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	70955-78-1	C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C(=O)OC3=CC=CC=C3.C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N.OS(=O)(=O)O	{28: 2, 30: 4, 20: 2, 29: 2, 14: 20}
Did not match all atoms present	70969-51-6	CCC(C)O[Si]1(O[Si](O[Si](O1)(OC(C)CC)O[Si](OC(C)CC)(OC(C)CC)OC(C)CC)(OC(C)CC)OC(C)CC)OC(C)CC	{1: 16, 2: 8, 3: 8, 22: 9, 23: 3}
Did not match all atoms present	70969-52-7	CCC(C)O[Si]1(O[Si](O[Si](O[Si](O1)(OC(C)CC)OC(C)CC)(OC(C)CC)OC(C)CC)(OC(C)CC)OC(C)CC)C	{1: 15, 2: 7, 3: 7, 22: 7, 23: 4}
Did not match all atoms present	70969-53-8	CCC(C)O[Si]1(O[Si](O[Si](O1)(OC(C)CC)OC(C)CC)(C)O[Si](OC(C)CC)(OC(C)CC)OC(C)CC)OC(C)CC	{1: 15, 2: 7, 3: 7, 22: 8, 23: 3}
Did not match all atoms present	70969-56-1	CCC(C)O[Si]1(O[Si](O[Si](O[Si](O1)(OC(C)CC)OC(C)CC)(OC(C)CC)OC(C)CC)(OC(C)CC)OC(C)CC)OC(C)CC	{1: 16, 2: 8, 3: 8, 22: 8, 23: 4}
Did not match all atoms present	70969-63-0	CCCCCCCCCCCCCCCOC(=O)CCS[Sn](CCCC)(CCCC)SCCC(=O)OCCCCCCCCCCCCCCC	{40: 2, 1: 4, 2: 38, 28: 2}
Did not match all atoms present	70969-67-4	COC(=O)CCCCC(=O)OCCS[Sn](C)(C)SCCOC(=O)CCCCC(=O)OC	{40: 2, 1: 4, 2: 12, 28: 4}
Did not match all atoms present	70969-68-5	COC(=O)CCCC(=O)OCCS[Sn](C)(C)SCCOC(=O)CCCC(=O)OC	{40: 2, 1: 4, 2: 10, 28: 4}
Did not match all atoms present	70969-69-6	C(CS[Sb](SCCO)SCCO)O	{40: 3, 2: 6, 20: 3}
Did not match all atoms present	70969-72-1	CCCC[Sn](CCCC)(SCCOC(=O)CCCCC(=O)OC)SCCOC(=O)CCCCC(=O)OC	{40: 2, 1: 4, 2: 18, 28: 4}
Did not match all atoms present	70983-50-5	C(=O)([O-])[O-].OS(=O)(=O)O.[O-][Si]([O-])([O-])[O-].[Na+].[Na+].[Zr+4]	{24: 1, 20: 2, 29: 6}
Did not match all atoms present	70984-16-6	C[C@H]([C@@H]([C@@H]([C@H](C=O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C=O)[O-])[O-])[O-])[O-])O.C(=O)[C@@H]([C@H]([C@@H]([C@@H](C(=O)O)O)O)O)O.[Na+].[K+].[Ca+2]	{1: 1, 2: 1, 3: 12, 20: 9, 26: 3, 27: 1, 29: 4}
Did not match all atoms present	70987-78-9	CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2CO2	{1: 1, 2: 1, 11: 1, 12: 1, 14: 4, 22: 1, 23: 1, 29: 2}
Did not match all atoms present	7099-19-6	C1CCCC2=C3CCCCCCC3=C4CCCCCCC4=C2CC1	{11: 18}
Did not match all atoms present	7099-43-6	C1CC2=C(C1)C3=CC4=C(C=C3C=C2)C5=CC=CC=C5C=C4	{11: 3, 14: 10}
Did not match all atoms present	71-00-1	C1=C(NC=N1)C[C@@H](C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 2, 35: 1, 27: 1, 30: 1}
Did not match all atoms present	71-27-2	C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C.[Cl-].[Cl-]	{1: 6, 2: 6, 28: 2, 17: 2}
Did not match all atoms present	71-30-7	C1=C(NC(=O)N=C1)N	{32: 1, 25: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	71-47-6	O=C[O-]	{26: 1}
Did not match all atoms present	71-48-7	CC(=O)[O-].CC(=O)[O-].[Co+2]	{24: 2, 1: 2}
Did not match all atoms present	71-50-1	CC(=O)[O-]	{24: 1, 1: 1}
Did not match all atoms present	71-52-3	O=C([O-])O	{27: 1}
Did not match all atoms present	71-62-5	CC1CCC2C(C3(C(CC4(C5CCC6C7(C5(CC4(C3CN2C1)O)OC6(C(CC7)OC(=O)C8=CC(=C(C=C8)OC)OC)O)C)O)O)O)(C)O	{1: 5, 33: 1, 11: 10, 12: 7, 13: 7, 14: 3, 20: 6, 22: 2, 23: 1, 28: 1}
Did not match all atoms present	71-67-0	C1=CC(=C(C=C1C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O2)C4=CC(=C(C=C4)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{13: 1, 14: 6, 18: 4, 21: 2, 28: 1, 29: 6}
Did not match all atoms present	71-68-1	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3C(=O)CC4.Cl	{1: 1, 33: 1, 11: 5, 12: 3, 13: 1, 14: 2, 17: 1, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	71-78-3	C1CCNC(C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O.Cl	{32: 1, 4: 1, 11: 4, 12: 1, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	71-79-4	CN(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl	{1: 2, 2: 2, 4: 1, 33: 1, 14: 10, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	71-81-8	CC(C)[N+](C)(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N)C(C)C.[I-]	{1: 5, 2: 2, 3: 2, 4: 1, 14: 10, 19: 1, 24: 1, 30: 1}
Did not match all atoms present	71-82-9	C=CCN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{33: 1, 2: 1, 3: 2, 5: 1, 6: 1, 11: 7, 12: 2, 13: 1, 14: 3, 20: 2, 21: 1, 27: 2}
Did not match all atoms present	71-91-0	CC[N+](CC)(CC)CC.[Br-]	{1: 4, 2: 4, 18: 1}
Did not match all atoms present	710-15-6	C1=CC=C(C=C1)CCNS(=O)(=O)N	{2: 2, 30: 1, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	710-18-9	COC1=CC=C(C=C1)OC(F)(F)F	{16: 3, 1: 1, 4: 1, 22: 2, 14: 4}
Did not match all atoms present	710-25-8	C=C(C1=CC=C(O1)[N+](=O)[O-])C(=O)N	{5: 1, 38: 1, 7: 1, 14: 2, 23: 1, 24: 1, 30: 1}
Did not match all atoms present	710-40-7	CCCCCCC1=CN=C(C=C1)C	{1: 2, 2: 5, 35: 1, 14: 3}
Did not match all atoms present	71002-14-7	CC(C)(CO)[N+](=O)[O-].C=O.C(=O)(N)N	{1: 2, 2: 1, 4: 1, 5: 1, 38: 1, 20: 1, 24: 1, 30: 2}
Did not match all atoms present	71002-15-8	CCCCCCCCCC1=CC=C(C=C1)OC2=NC(=NC(=N2)NC3=CC(=C(C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C\4/C(=C(C(=O)N(C4=O)CC)C(=O)N)C)Cl.[Na+].[Na+]	{1: 3, 2: 9, 35: 3, 33: 1, 34: 1, 14: 6, 15: 3, 17: 1, 22: 1, 24: 1, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	71002-16-9	CC1=C(C=C(C=C1N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=NC(=NC(=N6)NC7=CC=C(C=C7)S(=O)(=O)O)Cl.[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 7, 33: 1, 12: 1, 14: 13, 15: 1, 17: 2, 20: 1, 24: 1, 25: 1, 29: 11, 31: 4}
Did not match all atoms present	71002-18-1	CC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=NC3=C(S2)C=C(C=C3)SC#N	{1: 3, 2: 4, 35: 1, 37: 1, 33: 1, 40: 1, 41: 1, 34: 2, 14: 6, 28: 2}
Did not match all atoms present	71002-19-2	CC(=O)NC1=CC=C(C=C1)N=NC2=CC(=C3C=C/C(=N\NC4=CC=CC=C4)/C(=O)C3=C2N)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 3, 14: 12, 15: 1, 24: 1, 25: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	71002-22-7	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=C(C4=CC(=C(C(=C4C=C3)[O-])N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{34: 2, 35: 3, 14: 10, 17: 1, 29: 12, 31: 2}
Did not match all atoms present	71002-24-9	C1C2CC(C1C=C2)COP(OC3=CC=CC=C3)OC4=CC=CC=C4	{2: 1, 11: 2, 12: 3, 22: 3, 14: 12}
Did not match all atoms present	71002-25-0	C1C2CC(C1C=C2)COP(OCC3CC4CC3C=C4)OC5=CC=CC=C5	{2: 2, 11: 4, 12: 6, 22: 3, 14: 9}
Did not match all atoms present	71002-26-1	C1C2CC(C1COP(OCC3CC4CC3C5C4C6CC5C=C6)OC7=CC=CC=C7)C8C2C9CC8C=C9	{2: 2, 11: 6, 12: 14, 22: 3, 14: 9}
Did not match all atoms present	71002-27-2	C1C2CC(C1C=C2)CC(CC3CC4CC3C=C4)(C5CC6CC5C7C6C8CC7C=C8)OP(O)O	{2: 2, 4: 1, 11: 7, 12: 13, 14: 6, 20: 2, 22: 1}
Did not match all atoms present	71002-28-3	C1C2CC(C1COP(OC3=CC=CC=C3)OC4=CC=CC=C4)C5C2C6CC5C=C6	{2: 1, 11: 3, 12: 7, 22: 3, 14: 12}
Did not match all atoms present	71002-29-4	C1C2CC(C1C=C2)COP(OCC3CC4CC3C5C4C6CC5C=C6)OC7=CC=CC=C7	{2: 2, 11: 5, 12: 10, 22: 3, 14: 9}
Did not match all atoms present	71002-30-7	C1C2CC(C1COP(OCC3CC4CC3C5C4C6CC5C=C6)OCC7CC8CC7C9C8C1CC9C=C1)C1C2C2CC1C=C2	{2: 3, 11: 9, 12: 21, 22: 3, 14: 6}
Did not match all atoms present	71002-31-8	[Li+].CC1=CC2=C(C(=C1)S(=O)(=O)[O-])SC(=N2)C3=CC=C(C=C3)N	{1: 1, 35: 1, 41: 1, 14: 6, 29: 3, 30: 1}
Did not match all atoms present	71002-32-9	COP(OCC1CC2CC1C3C2C4CC3C=C4)OC(C5CC6CC5C=C6)C7CC8CC7C9C8C1CC9C=C1	{1: 1, 2: 1, 3: 1, 11: 8, 12: 17, 14: 6, 22: 3}
Did not match all atoms present	71002-34-1	CCCCCCCC/C=C/CCCCCCCC1=[N+](C=CN1CC)CCO.CCOS(=O)(=O)[O-]	{1: 3, 2: 18, 6: 2, 33: 2, 14: 2, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	71002-37-4	CC(=C)C(=O)NC(=O)C(=C)C.CC(=C)C(=O)OC.C=CC1=CC=CC=C1	{1: 4, 5: 4, 6: 1, 7: 3, 14: 5, 24: 2, 28: 1, 31: 1}
Did not match all atoms present	71002-39-6	CC1CO1.C12=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)OC2=O.OP(=O)(O)O	{1: 1, 11: 1, 12: 1, 17: 4, 20: 3, 23: 1, 28: 2, 29: 1}
Did not match all atoms present	71002-67-0	CCCCOP(=O)(CC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 14: 4, 22: 2, 29: 1}
Did not match all atoms present	7101-31-7	C[Se][Se]C	{1: 2}
Did not match all atoms present	7101-51-1	COC(=O)[C@H](CC1=CC(=C(C=C1)O)O)N	{1: 1, 2: 1, 3: 1, 14: 3, 21: 2, 28: 1, 30: 1}
Did not match all atoms present	7101-57-7	CCN(CC)C(=O)C1=C2CCCCC2=NC3=CC=CC=C31	{1: 2, 2: 2, 35: 1, 33: 1, 11: 4, 14: 4, 24: 1}
Did not match all atoms present	7101-58-8	C1CCN(CC1)C(=O)C2=C3CCCCC3=NC4=CC=CC=C42	{24: 1, 33: 1, 11: 9, 14: 4, 35: 1}
Did not match all atoms present	7101-64-6	CCN(CC)C(=O)C1=C2CCCCCC2=NC3=CC=CC=C31	{1: 2, 2: 2, 35: 1, 33: 1, 11: 5, 14: 4, 24: 1}
Did not match all atoms present	7101-65-7	C1CCC2=C(C3=CC=CC=C3N=C2CC1)C(=O)N4CCOCC4	{33: 1, 35: 1, 11: 9, 14: 4, 23: 1, 24: 1}
Did not match all atoms present	7101-96-4	C1=CC2=NC=C(C=C2C=C1N)Br	{18: 1, 35: 1, 30: 1, 14: 5}
Did not match all atoms present	71010-65-6	CCC(CO)(CO)COC(=O)CCCCCC(C)C.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 3, 2: 9, 3: 1, 4: 1, 14: 4, 20: 2, 28: 3}
Did not match all atoms present	71010-67-8	C=CCO.C=CC1=CC=CC=C1.C1=CC=C(C=C1)C(=O)OC(=O)CCC(=O)O	{2: 3, 5: 2, 6: 2, 14: 10, 20: 1, 27: 1, 28: 2}
Did not match all atoms present	71011-00-2	C1C(O1)CCl.C(=O)(N)N.[NH4+].[OH-]	{2: 1, 11: 1, 12: 1, 17: 1, 23: 1, 24: 1, 30: 2}
Did not match all atoms present	71017-42-0	C1CN(C2CC1C=C2)S(=O)(=O)C3=CC=CC=C3	{33: 1, 11: 3, 12: 2, 29: 2, 14: 7}
Did not match all atoms present	71022-43-0	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CO	{2: 1, 20: 1, 38: 2, 14: 3}
Did not match all atoms present	71032-91-2	CC1=CC2=C(C(=C1)S(=O)(=O)[O-])SC(=N2)C3=CC=C(C=C3)N.[K+]	{1: 1, 35: 1, 41: 1, 14: 6, 29: 3, 30: 1}
Did not match all atoms present	71032-96-7	CCCCCCCCCCCCCOCCOCCOCCOCCOCCOP(=O)(O)[O-].[Na+]	{1: 1, 2: 22, 20: 1, 29: 2, 22: 6}
Did not match all atoms present	71032-97-8	CCN(CCOC(=O)NC1=CC=CC=C1)C2=CC(=C(C=C2)C=C(C#N)C(=O)OCC)C	{1: 3, 2: 4, 33: 1, 6: 1, 7: 1, 14: 8, 28: 2, 37: 1, 31: 1}
Did not match all atoms present	71033-00-6	C1=CC=C(C=C1)NC2=C(C=C(C(=C2)C(=O)O)Br)C(=O)O	{18: 1, 27: 2, 14: 7, 31: 1}
Did not match all atoms present	71033-01-7	CC(=O)C(C1=NC(=NC(=N1)Cl)Cl)C(=O)NC2=CC=CC=C2OC	{1: 2, 3: 1, 14: 4, 17: 2, 35: 3, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	71033-05-1	CC(C)OC1=NC(=NC(=N1)NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)Cl)NC4=C5C(=CC(=C4)S(=O)(=O)[O-])C=C(/C(=N\NC6=CC=CC=C6S(=O)(=O)[O-])/C5=O)S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 1, 3: 1, 14: 10, 15: 2, 17: 2, 35: 6, 22: 1, 25: 1, 29: 12, 31: 4}
Did not match all atoms present	71033-06-2	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N)N=NC3=CC(=C(C=C3)N=NC4=CC(=C(C=C4)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)O)S(=O)(=O)O)C)C	{1: 3, 34: 6, 14: 18, 20: 2, 24: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	71033-07-3	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N)N=NC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)O)S(=O)(=O)O)C	{1: 2, 34: 4, 14: 19, 20: 2, 24: 2, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	71033-08-4	CCCCOCC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(COCCCC)OCC3CO3)OCC4CO4	{1: 4, 2: 12, 3: 2, 4: 1, 11: 2, 12: 2, 14: 8, 22: 6, 23: 2}
Did not match all atoms present	71033-09-5	C1=CC=C2C(=C1)C(=CC=C2N=NC3=CC(=CC=C3)S(=O)(=O)[O-])N/N=C\4/C(=CC5=C(C4=O)C=CC(=C5)NC(=O)C6=CC=C(C=C6)N/N=C/7\C(=CC8=C(C7=O)C=CC(=C8)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 4, 14: 22, 15: 4, 24: 1, 25: 2, 29: 9, 30: 1, 31: 3}
Did not match all atoms present	71033-10-8	C1=CC(=C(C=C1N)S(=O)(=O)[O-])N=NC2=C3C=CC(=CC3=C(C=C2)N/N=C/4\C(=CC5=C(C4=O)C=CC(=C5)NC6=CC7=C(C=C6)C(=O)/C(=N/NC8=C9C=CC(=CC9=C(C=C8)N=NC1=C(C=C(C=C1)N)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 6, 14: 24, 15: 4, 25: 2, 29: 18, 30: 2, 31: 3}
Did not match all atoms present	71033-14-2	CN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C.CN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 8, 2: 6, 37: 2, 33: 2, 34: 4, 14: 16, 17: 4, 24: 2}
Did not match all atoms present	71033-15-3	CN(C)CCCN1C(=O)C2=C(C1=O)C=C3C(=C2)C(=O)C4=CC=CC=C4C3=O	{1: 2, 2: 3, 33: 2, 14: 6, 25: 4}
Did not match all atoms present	71033-17-5	COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C/5\C(=CC6=C(C5=O)C=CC(=C6)NC(=O)C7=CC=C(C=C7)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 5, 14: 18, 15: 2, 22: 2, 24: 1, 25: 1, 29: 12, 30: 1, 31: 2}
Did not match all atoms present	71033-19-7	CC\1=NN(C(=N)/C1=N/NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N/N=C\4/C(=NN(C4=N)C5=CC(=CC=C5)S(=O)(=O)[O-])C)C6=CC(=CC=C6)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 35: 2, 36: 2, 33: 2, 14: 16, 15: 6, 29: 8, 31: 2}
Did not match all atoms present	71033-20-0	CCOCCOC1=NC(=NC(=N1)NC2=C3C(=C(C=C2)N=NC4=C(C=C(C(=C4)C)N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C=CC=C3S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 3, 2: 3, 35: 3, 34: 4, 14: 10, 17: 1, 22: 2, 29: 9, 31: 1}
Did not match all atoms present	71033-52-8	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N(C)C(=O)[C@@H]1CCCN1C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC3=CC=C(C=C3)OCC4=CC=CC=C4)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CO)NC(=O)OCC7=CC=CC=C7.CC(=O)O	{32: 1, 1: 5, 2: 11, 3: 8, 33: 2, 7: 1, 11: 3, 12: 1, 34: 1, 14: 24, 20: 2, 22: 1, 24: 8, 27: 1, 28: 1, 30: 2, 31: 7}
Did not match all atoms present	71033-59-5	CCN1CCC[C@H]1C(=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CCC(=O)N)NC(=O)OCC6=CC=CC=C6.CC(=O)O	{32: 1, 1: 4, 2: 11, 3: 7, 33: 2, 7: 1, 11: 6, 12: 2, 34: 1, 14: 14, 20: 1, 21: 1, 24: 9, 27: 1, 28: 1, 30: 3, 31: 7}
Did not match all atoms present	71033-66-4	CCN1CCC[C@H]1C(=O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCSC)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CCC(=O)N)NC(=O)OCC5=CC=CC=C5.Cl	{32: 1, 1: 4, 2: 13, 3: 8, 33: 1, 7: 1, 40: 1, 11: 3, 12: 1, 34: 1, 14: 14, 17: 1, 20: 1, 21: 1, 24: 9, 28: 1, 30: 3, 31: 8}
Did not match all atoms present	71033-69-7	CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]([C@H](C2=CC=CC=C2)O)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CCC(=O)N)NC(=O)OCC6=CC=CC=C6.CC(=O)O	{32: 1, 1: 4, 2: 11, 3: 9, 33: 1, 7: 1, 11: 3, 12: 1, 34: 1, 14: 19, 20: 2, 21: 1, 24: 9, 27: 1, 28: 1, 30: 3, 31: 8}
Did not match all atoms present	71033-93-7	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)CNC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@@H](CCC(=O)NCC5=CC=CC=C5)NC(=O)OCC6=CC=CC=C6.Cl	{32: 1, 1: 2, 2: 13, 3: 7, 33: 1, 7: 1, 11: 3, 12: 1, 34: 1, 14: 19, 17: 1, 20: 1, 21: 1, 24: 10, 28: 1, 30: 3, 31: 9}
Did not match all atoms present	71033-95-9	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)CNC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CC(C)C)NC(=O)OCC5=CC=CC=C5.Cl	{32: 1, 1: 4, 2: 11, 3: 8, 33: 1, 7: 1, 11: 3, 12: 1, 34: 1, 14: 14, 17: 1, 20: 1, 21: 1, 24: 9, 28: 1, 30: 3, 31: 8}
Did not match all atoms present	71034-07-6	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CC6=CC=CC=C6)NC(=O)[C@@H]7CCC(=O)N7.Cl	{32: 2, 1: 2, 2: 10, 3: 8, 33: 1, 7: 1, 11: 5, 12: 2, 34: 1, 14: 19, 17: 1, 20: 1, 21: 1, 24: 10, 25: 1, 30: 3, 31: 8}
Did not match all atoms present	71042-54-1	C1C2C=CC1C(C2P(C3=CC=CC=C3)C4=CC=CC=C4)P(C5=CC=CC=C5)C6=CC=CC=C6	{11: 1, 12: 4, 14: 22}
Did not match all atoms present	71042-72-3	CCOC(=O)C1=C2CCCC2=C(C=C1)C	{1: 2, 2: 1, 11: 3, 28: 1, 14: 2}
Did not match all atoms present	71042-75-6	CC1=C2CCCC2=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 11: 3, 14: 2, 17: 1}
Did not match all atoms present	71042-78-9	C1=CC=C(C=C1)OS(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)Cl	{17: 1, 22: 1, 14: 9, 29: 4}
Did not match all atoms present	71042-80-3	C(N1C2=C(N(C(=O)NC2=O)CO)N(C1=O)CO)O	{32: 1, 25: 3, 2: 3, 20: 3, 33: 3}
Did not match all atoms present	71042-81-4	C(N1C2=C(NC1=O)N(C(=O)NC2=O)CO)O	{32: 2, 25: 3, 2: 2, 20: 2, 33: 2}
Did not match all atoms present	71042-88-1	CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	71042-91-6	C[N+](C)(C)CCO.C1(C(=O)NC(=O)N1)NC(=O)N	{32: 2, 1: 3, 2: 2, 12: 1, 20: 1, 24: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	71042-92-7	C(N1C2=C(N(C1=O)CO)N(C(=O)N(C2=O)CO)CO)O	{25: 3, 2: 4, 20: 4, 33: 4}
Did not match all atoms present	71042-94-9	C(NC(=O)NC1C(=O)NC(=O)N1CO)NC(=O)NC2C(=O)NC(=O)N2C[O-].[Na+]	{32: 2, 33: 2, 2: 3, 12: 2, 20: 1, 24: 2, 25: 4, 29: 1, 31: 4}
Did not match all atoms present	71042-98-3	CNC1=C2C(=C(C=C1)CC3=C4C(=C(C=C3)NC)O4)O2	{1: 2, 2: 1, 31: 2, 14: 4, 23: 2}
Did not match all atoms present	71048-99-2	CC(C(=O)NC(C)C(=O)[O-])NC(=O)C(CCP(=O)(C)O)N.[Na+]	{1: 3, 2: 2, 3: 3, 20: 1, 24: 3, 29: 1, 30: 1, 31: 2}
Did not match all atoms present	71050-54-9	CC1=C(C=C(C=C1)N=NC2C=NN(C2=O)C3=CC(=C(C=C3Cl)S(=O)(=O)[O-])Cl)N(CC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)N=NC6C=NN(C6=O)C7=CC(=C(C=C7Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 1, 2: 1, 35: 2, 33: 3, 12: 2, 34: 4, 14: 18, 17: 4, 24: 1, 25: 2, 29: 6}
Did not match all atoms present	71050-57-2	CC(=O)[O-].CC(=O)[O-].CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.[Ni+2]	{1: 7, 2: 1, 4: 2, 5: 1, 14: 4, 21: 1, 24: 2}
Did not match all atoms present	71050-59-4	CCC(CO)(CO)N.C=O.C(CCCC(=O)O)CCCC(=O)O	{1: 1, 2: 10, 4: 1, 5: 1, 20: 2, 27: 2, 30: 1}
Did not match all atoms present	71050-63-0	CCN(CC)C(=O)NC1=CC=C(C=C1)NC(=O)N(CC)CC	{1: 4, 2: 4, 33: 2, 14: 4, 24: 2, 31: 2}
Did not match all atoms present	71052-74-9	CC(=O)CSC1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)O)O	{1: 1, 2: 2, 35: 3, 33: 1, 40: 1, 12: 4, 14: 2, 20: 3, 23: 1, 24: 1}
Did not match all atoms present	71060-57-6	C.CCCCCCCCOCC	{1: 2, 2: 8, 22: 1}
Did not match all atoms present	71066-00-7	CC(C)(C)OC(=O)NC1(CC2=CC=CC=C2C1)C(=O)O	{1: 3, 4: 1, 11: 2, 13: 1, 14: 4, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71076-98-7	[H+].CCCCC(CC)CN.CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=C(C=C3)Cl.C1CCC(CC1)NC2CCCCC2.[Cr+3]	{1: 6, 2: 5, 3: 1, 33: 2, 11: 10, 12: 2, 34: 4, 14: 14, 17: 2, 35: 2, 29: 4, 30: 1, 31: 3}
Did not match all atoms present	71077-10-6	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.CO[Si](CCCCl)(OC)OC.C1=CC(=CC=C1S(=O)(=O)C2=CC=C(C=C2)Cl)Cl	{1: 5, 2: 3, 4: 1, 14: 16, 17: 3, 21: 2, 22: 3, 29: 2}
Did not match all atoms present	71077-14-0	C1=CC(=CC=C1N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)O)C(=O)O)S(=O)(=O)O.C(=N)(N)N.Cl	{33: 1, 34: 2, 35: 1, 36: 1, 7: 1, 12: 1, 14: 8, 15: 1, 17: 1, 20: 2, 25: 1, 27: 1, 29: 4, 30: 2}
Did not match all atoms present	71077-29-7	CC\1=CC(=O)C=C/C1=N/NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])OC.[Na+]	{1: 2, 34: 3, 14: 10, 15: 2, 22: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	71077-33-3	CCCCOC(=O)C(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 1, 2: 3, 3: 1, 14: 8, 21: 2, 28: 1}
Did not match all atoms present	71077-34-4	CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)[O-])N.[Na+]	{1: 1, 14: 7, 24: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	71077-36-6	C[N+]1=C(SC=C1)N=NC2=CC=C(C=C2)N(C)CC3=CC=CC=C3.COS(=O)(=O)[O-]	{1: 3, 2: 1, 33: 2, 41: 1, 34: 2, 14: 11, 22: 1, 29: 3}
Did not match all atoms present	71077-37-7	COCCOC1=C(C=C(C=C1)N)N	{1: 1, 2: 2, 30: 2, 22: 2, 14: 3}
Did not match all atoms present	71077-38-8	CCNC1=C(C=CC(=C1)NC(=O)C)OCCOC	{1: 3, 2: 3, 14: 3, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	71077-39-9	CN(C)C(C1=CC=C(C=C1)C(F)(F)F)[O-].[Mg+2].[Cl-]	{1: 2, 3: 1, 4: 1, 33: 1, 14: 4, 16: 3, 17: 1, 29: 1}
Did not match all atoms present	71077-40-2	CCC(N(C)C)[O-].[Mg+2].[Br-]	{33: 1, 2: 1, 3: 1, 1: 3, 18: 1, 29: 1}
Did not match all atoms present	71098-88-9	C1=CC=C(C=C1)[Se]N2C(=O)C3=CC=CC=C3C2=O	{25: 2, 14: 9, 33: 1}
Did not match all atoms present	711-33-1	CCC(=O)C1=CC=C(C=C1)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	711-38-6	COC1=CC=C(C=C1)C(=O)C(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 22: 1, 24: 1}
Did not match all atoms present	711-79-5	CC(=O)C1=C(C2=CC=CC=C2C=C1)O	{24: 1, 1: 1, 21: 1, 14: 6}
Did not match all atoms present	711-82-0	C1=CC=C2C(=C1)C=CC=C2OCCO	{2: 2, 20: 1, 22: 1, 14: 7}
Did not match all atoms present	7110-06-7	C[Si](C1=CC=CC=C1)O	{1: 1, 20: 1, 14: 5}
Did not match all atoms present	71105-17-4	C1=CC=C(C(=C1)N=C=S)N=C=S	{8: 2, 34: 2, 14: 4}
Did not match all atoms present	71106-52-0	C1=CC=C(C=C1)C(C2=CC=CC=C2NC(=O)NCC3=CC(=CC=C3)N=C=O)N	{2: 1, 3: 1, 8: 1, 34: 1, 14: 13, 24: 1, 29: 1, 30: 1, 31: 2}
Did not match all atoms present	7111-76-4	CC1=CC=CC=C1C2=CC=CC=C2CO	{1: 1, 2: 1, 20: 1, 14: 8}
Did not match all atoms present	7111-96-8	CC1=NN(C(=S)S1)C	{1: 2, 35: 1, 41: 1, 33: 1}
Did not match all atoms present	71113-18-3	CC1=C(C=C(C=C1N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC(=CC=C5)S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])NC6=NC(=NC(=N6)NC7=CC(=CC=C7)S(=O)(=O)O)Cl.[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 7, 33: 1, 12: 1, 14: 13, 15: 1, 17: 2, 20: 1, 24: 1, 25: 1, 29: 11, 31: 4}
Did not match all atoms present	71113-19-4	CCOC1=CC=CC=C1NC(=O)C2=C(C=C3C4=CC=CC=C4OC3=C2)[O-].[Na+]	{1: 1, 2: 1, 14: 10, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	71113-21-8	CN(C)CCCN(CP(=O)(O)O)CP(=O)(O)O.Cl	{1: 2, 2: 5, 33: 2, 17: 1, 20: 4, 29: 2}
Did not match all atoms present	71113-22-9	CC(C)(C1=CC=CC=C1)C2=CC(=C(C=C2)O)CC3=C(C=CC(=C3)C(C)(C)C4=CC=CC=C4)O	{1: 4, 2: 1, 4: 2, 21: 2, 14: 16}
Did not match all atoms present	71113-23-0	CC(C)(C1=CC=CC=C1)C2=CC(=C(C(=C2)C(C)(C)C3=CC=CC=C3)O)CC4=C(C(=CC(=C4)C(C)(C)C5=CC=CC=C5)C(C)(C)C6=CC=CC=C6)O	{1: 8, 2: 1, 4: 4, 21: 2, 14: 24}
Did not match all atoms present	71119-22-7	C1COCCN1CCCS(=O)(=O)[O-].[Na+]	{33: 1, 2: 3, 11: 4, 29: 3, 23: 1}
Did not match all atoms present	71119-44-3	[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Ti+4].[La+3].[La+3].[Pr+3].[Pr+3].[Nd+3].[Nd+3]	{}
Did not match all atoms present	71119-47-6	CCCCOCC1CO1.C[Sn](Cl)(Cl)Cl	{1: 2, 2: 4, 11: 1, 12: 1, 17: 3, 22: 1, 23: 1}
Did not match all atoms present	71119-48-7	C[Sn](Cl)(Cl)Cl.C1CO1	{23: 1, 1: 1, 11: 2, 17: 3}
Did not match all atoms present	71119-49-8	C1C(O1)CCl.Cl[Sb](Cl)Cl	{17: 4, 2: 1, 11: 1, 12: 1, 23: 1}
Did not match all atoms present	7112-00-7	CN1C(=NN(C1=S)C)C2=CC=CC=C2	{1: 2, 35: 1, 14: 5, 33: 2}
Did not match all atoms present	7113-10-2	C1=CC=C(C=C1)C2=NC(=CS2)C(=O)O	{35: 1, 27: 1, 14: 6, 41: 1}
Did not match all atoms present	71130-08-0	CCCC(CC)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 2, 2: 3, 3: 1, 14: 9}
Did not match all atoms present	71130-10-4	CCN1C2=C(C=CC(=C2)C(=O)C3=CC=CC=C3)OC1=CC=CC4=[N+](C5=C(O4)C=CC(=C5)C(=O)C6=CC=CC=C6)CC.[I-]	{1: 2, 2: 2, 6: 3, 33: 2, 14: 16, 15: 1, 19: 1, 23: 2, 24: 2}
Did not match all atoms present	71130-11-5	CC(C)(C)C1=CC2=C(C=C1)C(C3=CC=CC=C3C2=O)C4C5=C(C=C(C=C5)C(C)(C)C)C(=O)C6=CC=CC=C46	{1: 6, 4: 2, 14: 14, 12: 2, 25: 2}
Did not match all atoms present	71130-12-6	CCC1=CC2=C(C=C1)C(C3=CC=CC=C3C2=O)C4C5=C(C=C(C=C5)CC)C(=O)C6=CC=CC=C46	{1: 2, 2: 2, 12: 2, 14: 14, 25: 2}
Did not match all atoms present	71130-15-9	COC1=CC2=CC=CC=C2C=C1C(=O)N=NC3=C(C(=CC4=CC=CC=C43)OC)C(=O)O	{1: 2, 34: 2, 14: 11, 22: 2, 24: 1, 27: 1}
Did not match all atoms present	71130-18-2	CC(=O)CC(=O)NC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC4=CC=C(C=C4)NC(=O)CC(=O)C)Cl)Cl	{1: 2, 2: 2, 34: 4, 14: 14, 17: 2, 24: 4, 31: 2}
Did not match all atoms present	71130-49-9	CCN(CC)C1=CC=C(C=C1)N.CC1=CC=C(C=C1)S(=O)(=O)O	{1: 3, 2: 2, 33: 1, 14: 8, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	71130-51-3	C1=CC(=CC=C1S(=O)(=O)O)[AsH2]=O	{20: 1, 29: 3, 14: 4}
Did not match all atoms present	71130-52-4	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)NC4=CC=CC=C4S(=O)(=O)[O-].[Na+]	{25: 2, 31: 1, 21: 1, 14: 10, 29: 3}
Did not match all atoms present	71130-53-5	CCN1C2=CC(=C(C=C2N(C1=CC=C3C(=O)N(C(=S)N(C3=O)CC)CC)CCCCS(=O)(=O)O)Cl)Cl	{1: 3, 2: 7, 6: 2, 33: 4, 14: 2, 15: 3, 17: 2, 20: 1, 25: 2, 29: 2}
Did not match all atoms present	71130-54-6	C1=CC=C(C=C1)OC(=O)NC2=CC=C(C=C2)C#N	{28: 1, 37: 1, 14: 9, 31: 1}
Did not match all atoms present	71130-55-7	CCCCCCCCCCCCCCOC1=CC=CC=C1N.Cl	{1: 1, 2: 13, 14: 4, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	71130-56-8	CNCC1=C(C=CC(=C1)[N+](=O)[O-])NC	{1: 2, 2: 1, 38: 1, 14: 3, 31: 2}
Did not match all atoms present	71130-57-9	CNC1=C(C=C(C=C1)N)CN(C)C(=O)C(F)(F)F	{1: 2, 2: 1, 4: 1, 33: 1, 14: 3, 16: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	71130-58-0	CC(=O)N(C=CC=CC1=[N+](C2=CC=CC=C2O1)CCCS(=O)(=O)[O-])C3=CC=CC=C3	{1: 1, 2: 3, 6: 4, 33: 2, 14: 9, 23: 1, 24: 1, 29: 3}
Did not match all atoms present	71130-59-1	CCCS(=O)(=O)NC1=CC=C(C=C1)C(=O)CCl	{1: 1, 2: 3, 14: 4, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	71130-60-4	CCNCC1=C(C=CC(=C1)[N+](=O)[O-])O	{1: 1, 2: 2, 38: 1, 14: 3, 21: 1, 31: 1}
Did not match all atoms present	71130-61-5	CONC=CC(=CC=NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2=CC=CC=C2	{1: 1, 34: 1, 38: 2, 6: 4, 7: 1, 14: 8, 22: 1, 31: 1}
Did not match all atoms present	71130-63-7	COC(=O)C1=CC(=CC(=C1)NC(=S)S)C(=O)OC.C1CN2CCN1CC2	{1: 2, 33: 2, 7: 1, 11: 6, 14: 3, 39: 1, 28: 2, 31: 1}
Did not match all atoms present	71130-64-8	COC1=C(C=C(C=C1)N)CCC(=O)O.Cl	{1: 1, 2: 2, 14: 3, 17: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	71130-66-0	CC[N+]1=C(SC2=C1C=C(C=C2)C3=CC=CC=C3)C.[I-]	{1: 2, 2: 1, 33: 1, 41: 1, 14: 8, 19: 1}
Did not match all atoms present	71130-67-1	C1=CC(=CC=C1NC2=C(C(=NC(=N2)Cl)Cl)Cl)N=NC3=CC(=C4C=C(C=C(C4=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 2, 35: 2, 14: 8, 17: 3, 20: 3, 29: 6, 31: 1}
Did not match all atoms present	71130-68-2	CCN1CCCC2=C1C=C(C=C2)O	{1: 1, 2: 1, 33: 1, 11: 3, 14: 3, 21: 1}
Did not match all atoms present	71130-69-3	CCCCCCCCCCCCC(C(=O)OC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 11, 3: 1, 38: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	71130-70-6	[Li+].[Li+].CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NC5=C(C=C(C=C5)C)S(=O)(=O)[O-])S(=O)(=O)[O-]	{1: 2, 14: 10, 21: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	7114-03-6	CC[N+](C)(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C	{1: 7, 2: 1, 33: 2, 7: 1, 14: 12, 15: 2}
Did not match all atoms present	7114-39-8	CN(C)P1OCCO1	{1: 2, 11: 2, 33: 1, 23: 2}
Did not match all atoms present	71145-03-4	CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC	{32: 1, 1: 3, 4: 1, 38: 1, 12: 1, 14: 4, 15: 4, 16: 3, 28: 1}
Did not match all atoms present	71156-00-8	CCN(CC)C1=CC(=C(C=C1)C[C@H]2CC3=C(O2)C=CCC3=O)C	{1: 3, 2: 3, 33: 1, 11: 2, 12: 1, 14: 5, 15: 2, 23: 1, 25: 1}
Did not match all atoms present	71156-02-0	CC/C(=N\[O-])/C(=N\[O-])/CC.[Na+].[Na+]	{1: 2, 2: 2, 34: 2, 29: 2, 7: 2}
Did not match all atoms present	71156-03-1	C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O	{2: 10, 27: 5, 20: 2, 14: 3}
Did not match all atoms present	71156-05-3	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](C)(C)CCCNC1=C2C(=C(C=C1)NCCC[N+](C)(C)C)C(=O)C3=C(C=CC(=C3C2=O)NCCC[N+](C)(C)C)NCCC[N+](C)(C)C	{1: 16, 2: 12, 14: 20, 25: 2, 29: 12, 31: 4}
Did not match all atoms present	71159-31-4	CC(=O)OC(COC1=CC=CC=C1)COC2=CC=CC=C2	{1: 1, 2: 2, 3: 1, 14: 10, 22: 2, 28: 1}
Did not match all atoms present	7116-95-2	CC(C)C1=CC=C(C=C1)C2=CC=CC=C2	{1: 2, 3: 1, 14: 9}
Did not match all atoms present	7116-96-3	CCCCCC1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 2: 4, 14: 9}
Did not match all atoms present	7117-41-1	C1CS1=O	{11: 2, 29: 1}
Did not match all atoms present	71172-14-0	COC1=CC=C(C=C1)OCCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC	{1: 3, 2: 2, 38: 1, 22: 4, 14: 6}
Did not match all atoms present	71172-35-5	CC(CC1=CC=C(C=C1)NC2=CC=CC=C2)CC(C)(C)C	{1: 4, 2: 2, 3: 1, 4: 1, 14: 9, 31: 1}
Did not match all atoms present	71172-47-9	CC1=CC=C(C=C1)C(C2CC2)(C3CC3)O	{1: 1, 4: 1, 11: 4, 12: 2, 14: 4, 20: 1}
Did not match all atoms present	71172-78-6	CC1=CC=C(C=C1)C2(CC2)C#N	{1: 1, 11: 2, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	71173-06-3	CC1=C(C(=C(C=C1)SC2=C(C(=C(C=C2)C)OC(=O)C)C(C)(C)C)C(C)(C)C)OC(=O)C	{40: 1, 1: 10, 4: 2, 14: 4, 28: 2}
Did not match all atoms present	71173-07-4	C1CNCCC1S(=O)(=O)N2CCOCC2	{32: 1, 33: 1, 11: 8, 12: 1, 23: 1, 29: 2}
Did not match all atoms present	71173-10-9	CCOC(=O)CN1C(=O)C=CC(=N1)Cl	{1: 1, 2: 2, 35: 1, 33: 1, 14: 2, 17: 1, 25: 1, 28: 1}
Did not match all atoms present	71173-12-1	CCC1(C2=C(C=C(C=C2)[N+](=O)[O-])C(N1CC)(CC)CC)CC	{1: 5, 2: 5, 38: 1, 33: 1, 13: 2, 14: 3}
Did not match all atoms present	71173-13-2	CCS(=O)(=O)N(C1=CC=C(C=C1)C)C(=O)C	{1: 3, 2: 1, 33: 1, 14: 4, 24: 1, 29: 2}
Did not match all atoms present	71173-14-3	CCCCN(C(=O)C)S(=O)(=O)C1=CC=C(C=C1)C	{1: 3, 2: 3, 33: 1, 14: 4, 24: 1, 29: 2}
Did not match all atoms present	71173-15-4	CC(=O)OC1CC2CCC1(C2)C3=CC=CC=C3	{1: 1, 11: 4, 12: 2, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	71173-16-5	CCC1(C2=C(C=C(C=C2)N)C(N1CC=C)(CC)CC)CC	{1: 4, 2: 5, 5: 1, 6: 1, 33: 1, 13: 2, 14: 3, 30: 1}
Did not match all atoms present	71173-17-6	CCCCN1C(C2=C(C1(CC)CC)C=C(C=C2)[N+](=O)[O-])(CC)CC	{1: 5, 2: 7, 38: 1, 33: 1, 13: 2, 14: 3}
Did not match all atoms present	71173-18-7	CC1=CC(=NC(=C1C(C)O)C)C	{1: 4, 3: 1, 20: 1, 14: 1, 35: 1}
Did not match all atoms present	71173-19-8	C1=CC=C(C=C1)C2(C3=CC=CC=C3OC2=O)CCCl	{17: 1, 2: 2, 28: 1, 13: 1, 14: 9}
Did not match all atoms present	71173-20-1	CC1=CC=C(C=C1)NC(=O)C(C)O	{1: 2, 3: 1, 14: 4, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	71173-49-4	C1(=S)C(=S)N1	{32: 1}
Did not match all atoms present	71173-50-7	C1=CC=C(C=C1)C2=CC(=O)[C@](O2)(CC(=O)C3=CC=CC=C3)O	{2: 1, 13: 1, 14: 11, 15: 1, 20: 1, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	71173-51-8	CC12CC3C(CC1O2)C(=O)C4=CC=CC=C4C3=O	{1: 1, 11: 2, 12: 3, 13: 1, 14: 4, 23: 1, 25: 2}
Did not match all atoms present	71173-52-9	C1=CC=C(C=C1)C2=CC(=O)[C@@](O2)(CC(=O)C3=CC=CC=C3)O	{2: 1, 13: 1, 14: 11, 15: 1, 20: 1, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	71173-53-0	CC12CC3=C(CC1O2)C(=O)C4=CC=CC=C4C3=O	{1: 1, 11: 2, 12: 1, 13: 1, 14: 4, 15: 2, 23: 1, 25: 2}
Did not match all atoms present	71173-56-3	CCNC1=CC2=C(C=C1)C=CC(=O)O2	{1: 1, 2: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	71173-63-2	CC(=O)O.C1=C(NC=N1)C[C@@H](C(=O)O)N	{32: 1, 1: 1, 2: 1, 3: 1, 14: 2, 35: 1, 27: 2, 30: 1}
Did not match all atoms present	71173-69-8	CCCCCCCCNCCCCCCCC.CCCCCCCCNCCCCCCCC.CCCCCCCCNCCCCCCCC.C1=CC(=CC(=C1)S(=O)(=O)O)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O	{1: 6, 2: 42, 38: 1, 34: 3, 14: 10, 15: 2, 20: 3, 25: 1, 29: 6, 30: 1, 31: 4}
Did not match all atoms present	71173-70-1	CC1(C2=CC=CC=C2[N+](=C1/C=N/N(C)C3=CC=CC=C3)C)C.CS(=O)(=O)[O-]	{1: 5, 34: 1, 6: 1, 33: 2, 13: 1, 14: 9, 15: 1, 29: 3}
Did not match all atoms present	71173-71-2	CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)NC(=O)NC(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C	{1: 8, 3: 2, 33: 4, 14: 16, 24: 1, 31: 2}
Did not match all atoms present	71173-73-4	CC[N+]1=C(SC2=C1C=CC(=C2)OC)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 1, 33: 1, 41: 1, 14: 7, 22: 1, 29: 3}
Did not match all atoms present	71173-74-5	CNC1=C(C=C(C=C1)[N+](=O)[O-])CN(C)C(=O)C(F)(F)F	{1: 2, 2: 1, 4: 1, 38: 1, 33: 1, 14: 3, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	71173-75-6	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)NC)CN(C)C(=O)C(F)(F)F	{1: 3, 2: 1, 4: 1, 33: 1, 14: 7, 16: 3, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	71173-76-7	CCCC[N+]1=CC=C(C2=CC=CC=C21)C=CN(C3=CC=CC=C3)C(=O)C.[I-]	{1: 2, 2: 3, 6: 2, 33: 2, 14: 11, 19: 1, 24: 1}
Did not match all atoms present	71173-78-9	CC(C)N=CC1=C(C=CC(=C1)[N+](=O)[O-])Cl	{1: 2, 34: 1, 3: 1, 38: 1, 6: 1, 14: 3, 17: 1}
Did not match all atoms present	71173-79-0	C1=CC(=CC(=C1)S(=O)(=O)F)S(=O)(=O)NC2=CC=CC3=C2C=CC(=C3O)C(=O)Cl	{14: 9, 16: 1, 17: 1, 21: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	71173-80-3	C1=CC(=CC(=C1)S(=O)(=O)F)S(=O)(=O)NC2=CC=CC3=C2C=CC(=C3O)C(=O)O	{14: 9, 16: 1, 21: 1, 27: 1, 29: 4, 31: 1}
Did not match all atoms present	71173-81-4	CN1C(=O)C2=C(C1=O)C(=CC=C2)N(C)C(=O)Cl	{1: 2, 33: 2, 14: 3, 17: 1, 24: 1, 25: 2}
Did not match all atoms present	71173-82-5	CS(=O)(=O)NC1=CC=CC2=C1C=CC(=C2O)S(=O)(=O)[O-].[Na+]	{1: 1, 31: 1, 21: 1, 14: 5, 29: 5}
Did not match all atoms present	71173-83-6	C1=CC=C(C=C1)SC2=CC=[N+](C=C2)CCO.[Br-]	{33: 1, 2: 2, 40: 1, 14: 9, 18: 1, 20: 1}
Did not match all atoms present	71173-84-7	C1=CC=C(C(=C1)S(=O)(=O)C2=CC=CC=C2S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{29: 8, 14: 8}
Did not match all atoms present	71185-87-0	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O	{24: 3, 1: 3, 2: 60, 3: 6, 20: 18}
Did not match all atoms present	7119-00-8	CCO[Si](CCCNC(=O)NC(C)C1=CC=CC=C1)(OCC)OCC	{1: 4, 2: 6, 3: 1, 14: 5, 22: 3, 24: 1, 31: 2}
Did not match all atoms present	71195-66-9	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)C)S(=O)(=O)[O-])C(=O)C5=CC=CC=C5C3=O.[Na+]	{1: 2, 31: 2, 29: 3, 14: 13, 25: 2}
Did not match all atoms present	71195-67-0	CCCCCCCCCCCCC1=CC=C(C=C1)CC2=CC=CC=C2C(=O)O	{1: 1, 2: 12, 27: 1, 14: 8}
Did not match all atoms present	71195-68-1	CC(C)C1=CC=C(C=C1)CC2=CC=CC=C2C(=O)O	{27: 1, 1: 2, 2: 1, 3: 1, 14: 8}
Did not match all atoms present	71195-74-9	C1=CC(=CC=C1C(=O)O)NS(=O)(=O)O	{27: 1, 20: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	712-09-4	COC1=CC2=C(C=C1)NC=C2CCO	{32: 1, 1: 1, 2: 2, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	712-24-3	C1=CC(=C(C=C1N)[N+](=O)[O-])S(=O)(=O)O	{30: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	712-48-1	C1=CC=C(C=C1)[As](C2=CC=CC=C2)Cl	{17: 1, 14: 10}
Did not match all atoms present	712-50-5	C1CCC(CC1)C(=O)C2=CC=CC=C2	{24: 1, 11: 5, 12: 1, 14: 5}
Did not match all atoms present	712-68-5	C1=C(OC(=C1)[N+](=O)[O-])C2=NN=C(S2)N	{35: 2, 38: 1, 41: 1, 14: 2, 23: 1, 30: 1}
Did not match all atoms present	712-74-3	C1=C(C(=CC(=C1C#N)C#N)C#N)C#N	{37: 4, 14: 2}
Did not match all atoms present	712-97-0	C1OC2=C(O1)C=C(C(=C2)C=O)[N+](=O)[O-]	{26: 1, 11: 1, 38: 1, 14: 2, 23: 2}
Did not match all atoms present	7120-73-2	CCOC1=C(C(=C(C(=C1[N+](=O)[O-])OCC)[N+](=O)[O-])OCC)[N+](=O)[O-]	{1: 3, 2: 3, 38: 3, 22: 3}
Did not match all atoms present	71205-32-8	C1=CC(=CC(=C1)N)N2C(=S)N=NN2.Cl	{32: 1, 33: 1, 35: 2, 14: 4, 17: 1, 30: 1}
Did not match all atoms present	71205-33-9	CCOC(=O)NC1=CC(=CC=C1)S(=O)(=O)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	71205-34-0	CCCCCOC1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)OCCCCC)C3CCCCC3=O	{1: 2, 2: 9, 3: 1, 11: 4, 12: 1, 14: 8, 22: 2, 24: 1, 25: 1}
Did not match all atoms present	71205-36-2	CC(=O)N(C1=CC=CC2=C1C=CC(=C2OC(=O)C)S(=O)(=O)Cl)S(=O)(=O)C	{1: 3, 33: 1, 14: 5, 17: 1, 24: 1, 28: 1, 29: 4}
Did not match all atoms present	71205-37-3	CC(=O)N(C1=CC=CC2=C1C=CC(=C2OC(=O)C)S(=O)(=O)[O-])S(=O)(=O)C.[Na+]	{1: 3, 33: 1, 14: 5, 24: 1, 28: 1, 29: 5}
Did not match all atoms present	71205-38-4	CCOC(=O)C1=C2C3=CC=CC=C3C(=O)C4=C(C=CC(=C42)N(C1=O)C)Br	{1: 2, 2: 1, 33: 1, 14: 6, 18: 1, 25: 2, 28: 1}
Did not match all atoms present	71205-39-5	CCCCC1=CC=C(C=C1)C=NC2=CC=C(C=C2)O	{1: 1, 2: 3, 6: 1, 34: 1, 14: 8, 21: 1}
Did not match all atoms present	71205-40-8	CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)C.[I-]	{1: 2, 2: 1, 33: 1, 41: 1, 14: 6, 19: 1}
Did not match all atoms present	71205-41-9	CSC1=CC=CC(=C1)NC(=S)N	{1: 1, 7: 1, 40: 1, 14: 4, 30: 1, 31: 1}
Did not match all atoms present	71205-43-1	CC1=[N+](C2=CC=CC=C2C=C1)CCCCS(=O)(=O)[O-].[Na+].[I-]	{1: 1, 2: 4, 33: 1, 14: 6, 19: 1, 29: 3}
Did not match all atoms present	71205-44-2	CC(C)(C)OC1=C(C(=C(C(=C1[N+](=O)[O-])OC(C)(C)C)[N+](=O)[O-])OC(C)(C)C)[N+](=O)[O-]	{1: 9, 4: 3, 38: 3, 22: 3}
Did not match all atoms present	71205-45-3	CCOC(=O)NC1=CC(=CC=C1)S(=O)(=O)NCC(=O)[O-].[Na+]	{1: 1, 2: 2, 14: 4, 24: 1, 28: 1, 29: 2, 31: 2}
Did not match all atoms present	71205-46-4	C=CCNC1=NC2=C(C=C(C=C2)Cl)N=C1NCC=C	{2: 2, 35: 2, 5: 2, 6: 2, 14: 3, 17: 1, 31: 2}
Did not match all atoms present	71205-47-5	C1=CC(=CC=C1N)N=NC2=C(C=CC(=C2)S(=O)(=O)O)Cl	{34: 2, 14: 7, 17: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	71205-48-6	C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N=NC3=C(C=CC4=C(C=C(C=C43)S(=O)(=O)O)S(=O)(=O)O)N)S(=O)(=O)O	{34: 2, 6: 2, 14: 10, 20: 4, 29: 8, 30: 2}
Did not match all atoms present	71215-57-1	CCCCC/C=C\C/C=C\CCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 13, 22: 1, 6: 4, 29: 3}
Did not match all atoms present	71215-62-8	C/C(=C/1\C(=O)N(C(=S)O1)CCCS(=O)(=O)O)/C=C/2\N(C3=CC=CC=C3O2)C	{1: 2, 2: 3, 33: 2, 6: 1, 7: 1, 14: 4, 15: 3, 20: 1, 23: 2, 25: 1, 29: 2}
Did not match all atoms present	71215-71-9	CCCCCCCCCCCCOC(=O)C(=C)C.CCN(CC)CCOC(=O)C(=C)C.CC[N+](C)(CC)CCOC(=O)C(=C)C.COS(=O)(=O)[O-]	{1: 10, 2: 19, 5: 3, 7: 3, 22: 1, 33: 1, 28: 3, 29: 3}
Did not match all atoms present	71215-72-0	C(C[S-])O.C(C[S-])O.C(C[S-])O.[Sb+3]	{2: 6, 20: 3}
Did not match all atoms present	71215-74-2	[H+].[H+].C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])N=NC3=CC(=C(C(=C3N)N=NC4=CC=C(C=C4)[N+](=O)[O-])[O-])N=NC5=C6C=CC(=CC6=C(C=C5[O-])S(=O)(=O)[O-])[N+](=O)[O-].[Cu+2]	{34: 6, 38: 3, 14: 16, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	71215-75-3	[H+].[H+].C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])N=NC3=C(C(=C(C(=C3)N=NC4=C5C=CC(=CC5=C(C=C4[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-])N=NC6=CC=C(C=C6)[N+](=O)[O-])O.[Cu+2]	{34: 6, 38: 3, 14: 16, 21: 1, 29: 6, 31: 1}
Did not match all atoms present	71215-80-0	C1=CC2=CC=C1C(=O)OC3=C(C(=C(C(=C3Br)Br)Br)Br)OC2=O	{18: 4, 28: 2, 14: 4}
Did not match all atoms present	71215-81-1	CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)N)Cl)C	{1: 2, 14: 6, 17: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	71215-85-5	CCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(N(C6=CC=CC=C65)CC)C)C	{1: 4, 2: 4, 33: 2, 13: 1, 14: 12, 28: 1}
Did not match all atoms present	71215-86-6	CCCCCOC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)OCCCCC	{1: 2, 2: 8, 6: 2, 14: 8, 22: 2, 24: 1}
Did not match all atoms present	71215-87-7	CNC1=C(C=C(C=C1)[N+](=O)[O-])C=NC	{1: 2, 34: 1, 6: 1, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	71215-88-8	CC1=CC(=C(C=C1)SC#N)[N+](=O)[O-]	{40: 1, 1: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	71215-89-9	CC1=NC2=C(S1)C=CC(=C2)C3=CC=CC=C3	{1: 1, 35: 1, 14: 8, 41: 1}
Did not match all atoms present	71215-91-3	CCCC[N+]1=CC=C(C2=CC=CC=C21)C=CNC3=CC=CC=C3.[I-]	{1: 1, 2: 3, 6: 2, 33: 1, 14: 11, 19: 1, 31: 1}
Did not match all atoms present	71215-92-4	COC(=O)CCC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 2, 28: 1, 14: 14, 33: 1}
Did not match all atoms present	71215-93-5	CCOC(=O)NC1=CC(=CC=C1)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 14: 4, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	71215-96-8	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)N(C)C(=O)Cl)CN(C)C(=O)C(F)(F)F	{1: 3, 2: 1, 4: 1, 33: 2, 14: 7, 16: 3, 17: 1, 24: 2, 29: 2, 31: 1}
Did not match all atoms present	71216-00-7	CCCCCCCCCCCCCNC(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(=O)NCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 25, 14: 8, 31: 4}
Did not match all atoms present	71216-02-9	C(COC(=O)OC1=C(C(=C(C(=C1Br)Br)Br)Br)Br)OC(=O)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br	{2: 2, 18: 10}
Did not match all atoms present	71216-03-0	CC(C)(C1=CC(=C(C(=C1)Br)OC(=O)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br)Br)C3=CC(=C(C(=C3)Br)OC(=O)OC4=C(C(=C(C(=C4Br)Br)Br)Br)Br)Br	{1: 2, 18: 14, 4: 1, 14: 4}
Did not match all atoms present	71216-04-1	C1=C(C=C(C(=C1Br)OC(=O)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br)Br)Br	{18: 8, 14: 2}
Did not match all atoms present	71216-05-2	C1=CC=C(C=C1)C(=O)NC2=C3C=C(C=CC3=C(C=C2)N)O	{24: 1, 30: 1, 21: 1, 14: 10, 31: 1}
Did not match all atoms present	71229-51-1	CC1CN2CC(O[Si](O1)(OC(C2)C)C)C	{1: 4, 11: 3, 12: 3, 33: 1, 23: 3}
Did not match all atoms present	71230-62-1	CC(CCC1=NC(=NC(=N1)N)N)C2=NC(=NC(=N2)N)N.C=O	{1: 1, 2: 2, 3: 1, 5: 1, 35: 6, 30: 4}
Did not match all atoms present	71230-63-2	CC(CCC1=NC(=NC(=N1)N)N)C2=NC(=NC(=N2)N)N.C=O.C1(=NC(=NC(=N1)N)N)N	{1: 1, 2: 2, 3: 1, 5: 1, 35: 9, 30: 7}
Did not match all atoms present	71230-65-4	CCC(=O)NC1=CC(=C(C=C1)OCCOC)N	{1: 2, 2: 3, 14: 3, 22: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	71230-67-6	C1=CC=C(C=C1)NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 16, 20: 4, 29: 6, 31: 4}
Did not match all atoms present	71230-69-8	C1CN(CCN1C=O)C(P(=O)(O)O)P(=O)(O)O	{33: 2, 3: 1, 11: 4, 20: 4, 26: 1, 29: 2}
Did not match all atoms present	71230-70-1	C1CN(CCN1C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O	{11: 4, 33: 2, 3: 2, 20: 8, 29: 4}
Did not match all atoms present	71230-71-2	CC1=C(C=C(C=C1)NC(=O)C)N.Cl	{1: 2, 14: 3, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	71230-75-6	COC1=CC(=C(C=C1N2CCCC2)OC)N	{1: 2, 33: 1, 11: 4, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	71230-76-7	CN(C)C1=C(C=C(C(=C1)OC)[N+]#N)OC.F[P-](F)(F)(F)(F)F	{1: 4, 34: 1, 33: 1, 14: 2, 16: 6, 22: 2}
Did not match all atoms present	71230-77-8	COC1=CC(=C(C=C1N2CCCC2)OC)[N+](=O)[O-]	{1: 2, 38: 1, 33: 1, 11: 4, 14: 2, 22: 2}
Did not match all atoms present	71230-78-9	CCCCNCCCC.CCCCNCCCC.CCCCNCCCC.OP(=O)(O)O	{1: 6, 2: 18, 20: 3, 29: 1, 31: 3}
Did not match all atoms present	71239-85-5	CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=N1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71243-35-1	CCN1C(=O)C(=C(C)C=C2N(CCS2)C)OC1=S	{1: 3, 2: 1, 33: 2, 6: 1, 7: 1, 41: 1, 11: 2, 15: 3, 23: 1, 25: 1}
Did not match all atoms present	71243-42-0	C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O.C(C(CO)O)O	{27: 3, 2: 2, 3: 1, 20: 3, 14: 3}
Did not match all atoms present	71243-43-1	CCC(COC(=C)C)(COC(=C)C)COC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O	{1: 3, 2: 4, 4: 1, 5: 2, 7: 2, 14: 3, 22: 2, 27: 2, 28: 1}
Did not match all atoms present	71243-74-8	C.N.[Al].[Si]	{}
Did not match all atoms present	71243-75-9	S.[Se].[Cd]	{}
Did not match all atoms present	71243-85-1	[B].[Si].[Zr].[Mo]	{}
Did not match all atoms present	71243-91-9	C.[Zr].[Ta]	{}
Did not match all atoms present	71243-95-3	C=O.C(CCO)CO.C1(=NC(=NC(=N1)N)N)N	{2: 4, 35: 3, 20: 2, 5: 1, 30: 3}
Did not match all atoms present	71243-97-5	[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[Na+].[Co+3]	{17: 1, 34: 4, 38: 1, 29: 3, 14: 19}
Did not match all atoms present	71257-86-8	CC1=CC(=C(C=C1S(=O)(=O)[O-])N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC4=NC(=NC(=N4)Cl)N(C)C5=CC=CC=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 1, 35: 3, 33: 1, 14: 11, 15: 2, 17: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	71265-25-3	CC1C2=CC=CC=C2C3=C1C4=CC=CC=C4C=C3	{1: 1, 12: 1, 14: 10}
Did not match all atoms present	71267-22-6	C1C=CCN([C@@H]1C2=CN=CC=C2)N=O	{33: 1, 34: 1, 35: 1, 11: 2, 12: 1, 14: 6, 29: 1}
Did not match all atoms present	7127-19-7	C1COC(=N1)C2=CC=CC=C2	{23: 1, 35: 1, 11: 2, 14: 5, 15: 1}
Did not match all atoms present	71275-32-6	C1=CC=CC(C=C1)CCC2=CC=CC=C2	{2: 2, 12: 1, 14: 11}
Did not match all atoms present	71275-47-3	CCCCCCCCCCCCC1=C(C(=CC=C1)S(=O)(=O)O)OC2=CC=CC=C2S(=O)(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 1, 2: 23, 33: 2, 14: 7, 20: 8, 22: 1, 29: 4}
Did not match all atoms present	71277-79-7	C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)[O-])O)O)O[C@@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)[O-])O)O)O)C)(C)C(=O)O.[Na+].[Na+]	{1: 7, 11: 9, 12: 14, 13: 6, 14: 1, 15: 1, 20: 5, 22: 2, 23: 2, 24: 2, 25: 1, 27: 1}
Did not match all atoms present	71278-26-7	C[N+](C)(C)CNC(=O)C=C.C=CC(=O)N.C=CC(=O)O.[Cl-]	{1: 3, 2: 1, 5: 3, 6: 3, 17: 1, 24: 2, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	71278-40-5	CCN(C1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])C(=O)C.[Na+]	{1: 2, 2: 1, 33: 1, 14: 9, 24: 1, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	71278-41-6	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)O)OC)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6N=NC7=C(C=C(C=C7)[N+](=O)[O-])C(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 5, 38: 1, 14: 18, 15: 2, 20: 1, 22: 2, 24: 1, 25: 1, 29: 5, 30: 1, 31: 1}
Did not match all atoms present	7128-64-5	CC(C)(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(S3)C4=NC5=C(O4)C=CC(=C5)C(C)(C)C	{1: 6, 35: 2, 4: 2, 41: 1, 14: 8, 23: 2}
Did not match all atoms present	7128-82-7	CC[N+](CC)(CC)CCCCC[N+](CC)(CC)CC.[Br-].[Br-]	{1: 6, 2: 11, 18: 2}
Did not match all atoms present	7129-66-0	C1=CN=CC#C1	{35: 1, 14: 3}
Did not match all atoms present	7129-91-1	C1CC2=C(C1)C3=C(C=C2)C4=C5C(=CC=CC5=C3)CC4	{11: 5, 14: 6}
Did not match all atoms present	71292-84-7	CC/C(=C(/CC)\C1=CC(=C(C(=C1)F)O)F)/C2=CC(=C(C(=C2)F)O)F	{1: 2, 2: 2, 7: 2, 14: 4, 16: 4, 21: 2}
Did not match all atoms present	71297-15-9	CCCCCCCCCCCCOC(=O)C(C)OC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)N2C(=O)N(N(C2=O)C3=CC=CC=C3)CC4=CC=CC=C4	{1: 5, 2: 12, 3: 2, 4: 1, 33: 3, 14: 13, 17: 1, 24: 2, 25: 2, 28: 2, 31: 1}
Did not match all atoms present	713-36-0	CC1=CC=CC=C1CC2=CC=CC=C2	{1: 1, 2: 1, 14: 9}
Did not match all atoms present	713-46-2	CC(C)(C)C1=CC=C(C=C1)OCCO	{1: 3, 2: 2, 4: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	713-57-5	CCOC(=O)C1=CC=C(C=C1)C(=O)O	{1: 1, 2: 1, 27: 1, 28: 1, 14: 4}
Did not match all atoms present	713-65-5	C1=CC(=CC=C1[N+](=O)[O-])OC(F)(F)F	{16: 3, 38: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	713-68-8	C1=CC=C(C=C1)OC2=CC=CC(=C2)O	{22: 1, 21: 1, 14: 9}
Did not match all atoms present	71302-68-6	CN(C1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)C(=O)C(F)(F)F	{1: 1, 4: 1, 33: 1, 14: 7, 16: 3, 24: 1, 25: 2}
Did not match all atoms present	71302-73-3	CCCCCCCCCC1=C(C(=CC=C1)CCCCCCCCC)OP(OC2=C(C=CC=C2CCCCCCCCC)CCCCCCCCC)OC3=C(C=CC=C3CCCCCCCCC)CCCCCCCCC	{1: 6, 2: 48, 22: 3, 14: 9}
Did not match all atoms present	71309-70-1	C[Si](C)(C)OC1=CCCCO1	{1: 3, 11: 3, 14: 1, 15: 1, 22: 1, 23: 1}
Did not match all atoms present	71310-13-9	CC1=C2N(CCS2)C(=O)C=C1	{1: 1, 33: 1, 41: 1, 11: 2, 14: 2, 25: 1}
Did not match all atoms present	71310-14-0	CC1=CSC2=CC=CC(=O)N12	{1: 1, 41: 1, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	71310-15-1	CC1=C2N(C(=CS2)C)C(=O)C=C1	{1: 2, 41: 1, 33: 1, 14: 3, 25: 1}
Did not match all atoms present	71317-07-2	CC(=O)C(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N=NC3=CC=CC=C3C(=O)OC	{32: 2, 1: 2, 34: 2, 3: 1, 14: 7, 24: 2, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	71317-11-8	[Li+].CC1=CC(=C(C=C1N=NC2=CC(=CC=C2)S(=O)(=O)[O-])OC)NN=C3C=CC(=O)C=C3	{1: 2, 34: 3, 14: 10, 15: 1, 22: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	71317-39-0	CCCCCCOS(=O)(=O)[O-].CCCCCCOS(=O)(=O)[O-].[Ca+2]	{1: 2, 2: 10, 29: 6, 22: 2}
Did not match all atoms present	71317-41-4	CCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 29, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	71317-42-5	CC(C)OC(=O)C(CC(=O)OC1CCCCC1)S(=O)(=O)[O-].[Na+]	{1: 2, 2: 1, 3: 2, 11: 5, 12: 1, 28: 2, 29: 3}
Did not match all atoms present	71317-44-7	CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[K+]	{1: 1, 2: 21, 29: 3, 22: 1}
Did not match all atoms present	71317-46-9	CCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 31, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	71317-47-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 27, 29: 3, 22: 1}
Did not match all atoms present	71317-49-2	CCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 23, 29: 3, 22: 1}
Did not match all atoms present	71317-50-5	CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 25, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	71317-51-6	CCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 25, 29: 3, 22: 1}
Did not match all atoms present	71317-52-7	CCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]	{1: 1, 2: 25, 29: 3, 22: 1}
Did not match all atoms present	71317-54-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 33, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	71317-55-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 27, 29: 3, 22: 1}
Did not match all atoms present	71317-57-2	CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 21, 29: 3, 22: 1}
Did not match all atoms present	71317-58-3	CCCCCCCCCCOS(=O)(=O)O.CC(C)N	{1: 3, 2: 9, 3: 1, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	71317-59-4	CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 27, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	71317-60-7	CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[K+]	{1: 1, 2: 19, 29: 3, 22: 1}
Did not match all atoms present	71320-77-9	C1COCCN1CCNC(=O)C2=CC=C(C=C2)Cl	{33: 1, 2: 2, 11: 4, 14: 4, 17: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	71328-66-0	CC(C)(C)N=P(C)(C)C	{1: 6, 34: 1, 4: 1}
Did not match all atoms present	71329-04-9	CC1=CC=C(C=C1)NC2=C(CC(=C(C2)C(=O)OC)NC3=CC=C(C=C3)C)C(=O)OC	{1: 4, 11: 2, 14: 8, 15: 4, 28: 2, 31: 2}
Did not match all atoms present	7133-68-8	CC(CCO)(C1=CC=CC=C1)O	{1: 1, 2: 2, 4: 1, 14: 5, 20: 2}
Did not match all atoms present	71332-83-7	CCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCC	{1: 2, 2: 6, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	71332-85-9	CCCCCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCCCCC	{1: 2, 2: 14, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	71332-86-0	CCCCCCCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCCCCCCC	{1: 2, 2: 18, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	71334-38-8	CCCCC1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O	{1: 1, 2: 3, 14: 10, 21: 1, 25: 2, 31: 1}
Did not match all atoms present	71334-46-8	CCCCCCCCCOC1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O	{1: 1, 2: 8, 14: 10, 21: 1, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	71334-59-3	CCC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)CC	{1: 2, 2: 2, 31: 2, 14: 14, 25: 2}
Did not match all atoms present	71334-64-0	CCCCCOC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)OCCCCC	{1: 2, 2: 8, 14: 14, 22: 2, 25: 2, 31: 2}
Did not match all atoms present	71335-92-7	CC(C)C1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)C(C)C	{31: 2, 1: 4, 3: 2, 14: 14, 25: 2}
Did not match all atoms present	71338-73-3	C1=CC=C(C=C1)CCO[Si](CF)(C(F)(F)F)F	{16: 5, 2: 3, 4: 1, 22: 1, 14: 5}
Did not match all atoms present	71338-91-5	C[Si](C)OC1(C(C(=C(C(=C1F)F)F)F)C2=CC=CC=C2)F	{1: 2, 12: 1, 13: 1, 14: 5, 15: 4, 16: 5, 22: 1}
Did not match all atoms present	71342-92-2	CCCCCCCCCCCCCCCCCC(=O)O.COS(=O)(=O)OC.C(CNCCO)N.C(=O)(N)N	{1: 3, 2: 20, 20: 1, 22: 2, 24: 1, 27: 1, 29: 2, 30: 3, 31: 1}
Did not match all atoms present	71360-31-1	COC1=C(C=C(C=C1)C2=C(NC(=N2)C3=CC=CC=C3Cl)C4=CC=CC=C4Cl)OC	{32: 1, 1: 2, 35: 1, 14: 11, 17: 2, 22: 2}
Did not match all atoms present	71360-74-2	[Ag].[Au].[Au].[Au]	{}
Did not match all atoms present	7137-54-4	CCCC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 14: 4}
Did not match all atoms present	7137-55-5	CCCCC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 4}
Did not match all atoms present	7137-56-6	C1CCC(CC1)C2=CC=CC=C2[N+](=O)[O-]	{11: 5, 12: 1, 38: 1, 14: 4}
Did not match all atoms present	7137-86-2	CN1CCN(P1OC)C	{1: 3, 11: 2, 22: 1, 33: 2}
Did not match all atoms present	7137-97-5	CCCCC(=O)C1=CC=CC=N1	{24: 1, 1: 1, 2: 3, 35: 1, 14: 4}
Did not match all atoms present	71371-38-5	CCN(CC)C1=CC=C(C=C1)C(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	71382-50-8	C1=CC=C2C3=C4C(=CC2=C1)C5C(N5)C6=CC=CC(=C64)C=C3	{32: 1, 12: 2, 14: 10}
Did not match all atoms present	7139-89-1	C1=C(C(=CC(=C1S(=O)(=O)O)N)S(=O)(=O)O)N	{30: 2, 20: 2, 29: 4, 14: 2}
Did not match all atoms present	71393-85-6	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4OC5=C3C6=C(C=C5)C(=CC=C6)N)OC2=O	{1: 2, 2: 2, 33: 1, 13: 1, 14: 12, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	71393-86-7	C1=CC(=CC=C1N/N=C\2/C=CC(=O)C(=C2)C(=O)[O-])N=NC3=C4C=C(C=CC4=C(C=C3)N/N=C\5/C(=CC6=C(C5=O)C=C(C=C6)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 4, 14: 16, 15: 4, 24: 1, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	71393-87-8	C1=CC(=CC=C1N/N=C/2\C=CC(=O)C(=C2)C(=O)O)N=NC3=C4C=C(C=CC4=C(C=C3)N)S(=O)(=O)O	{34: 3, 14: 12, 15: 2, 20: 1, 25: 1, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	71393-88-9	CC(=O)NC1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=C(C=C2)[N+]#N)S(=O)(=O)[O-]	{1: 1, 34: 3, 14: 9, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	71394-08-6	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)[O-].C1C(O1)CCl.[NH4+]	{1: 2, 2: 1, 4: 1, 11: 1, 12: 1, 14: 8, 17: 1, 21: 1, 23: 1}
Did not match all atoms present	71394-09-7	C=CC1=CC=CC=C1.C=CC(=O)NCO.C=CC(=O)[O-].[NH4+]	{2: 1, 5: 3, 6: 3, 14: 5, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	71394-11-1	CCOCNC(=O)C=C.C=CC1=CC=CC=C1.C=CC(=O)O	{1: 1, 2: 2, 5: 3, 6: 3, 14: 5, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	71394-34-8	CCCCCC[C@H](C/C=C\CCCCCCCC(=O)OCCO)O.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O	{1: 1, 2: 16, 3: 1, 6: 2, 8: 2, 34: 2, 14: 8, 20: 2, 28: 1, 29: 2}
Did not match all atoms present	714-87-4	C1C2(COP(=O)(O1)Cl)COP(=O)(OC2)Cl	{17: 2, 11: 4, 29: 2, 13: 1, 23: 4}
Did not match all atoms present	7140-45-6	C1CN2CCN1C3=CC=CC=C32	{33: 2, 11: 4, 14: 4}
Did not match all atoms present	71400-24-3	CC(C1=CC=CC=C1)(C2=CC(=CC=C2)C(C)(C3=CC=CC=C3)O)O	{1: 2, 4: 2, 14: 14, 20: 2}
Did not match all atoms present	71400-29-8	[Li+].[Li+].CCC(C)C[C-](C1=CC=CC=C1)C2=CC(=CC=C2)[C-](CC(C)CC)C3=CC=CC=C3	{1: 4, 2: 4, 3: 2, 14: 14, 7: 2}
Did not match all atoms present	71400-34-5	C1=CC2=C(C=C1[N+](=O)[O-])OC3=C(O2)C=CC(=C3)[N+](=O)[O-]	{38: 2, 14: 6, 23: 2}
Did not match all atoms present	71412-36-7	C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)[O-])NC3=NC(=NC(=N3)N)Cl)N=NC4=C5C=C(C=CC5=C(C=C4)N=NC6=CC(=C7C=CC=C(C7=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 4, 35: 3, 14: 15, 17: 1, 29: 12, 30: 1, 31: 1}
Did not match all atoms present	71412-38-9	COC1=CC=CC=C1NC2=C3C(=C(C=C2)N)C(=O)C4=C(C=CC(=C4C3=O)O)[N+](=O)[O-]	{1: 1, 38: 1, 14: 8, 21: 1, 22: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	71412-39-0	CCCCCCCCCCCCCCCCCC(=O)NC1=CC=C(C=C1)[O-].CCCCCCCCCCCCCCCCCC(=O)NC1=CC=C(C=C1)[O-].[Ca+2]	{24: 2, 1: 2, 2: 32, 14: 8, 31: 2}
Did not match all atoms present	71412-40-3	CC1=C(C=C(C=C1)NC(=O)OCC(C)C)NC(=O)OCC(C)C	{1: 5, 2: 2, 3: 2, 14: 3, 28: 2, 31: 2}
Did not match all atoms present	71412-41-4	CC[C@@H](C)COC(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(=O)OC[C@H](C)CC	{1: 4, 2: 5, 3: 2, 14: 8, 28: 2, 31: 2}
Did not match all atoms present	71412-83-4	COCCOC(C1=CC=CC=C1)OCCOC	{1: 2, 2: 4, 3: 1, 22: 4, 14: 5}
Did not match all atoms present	71414-47-6	[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].C1C=CC=[C-]1.[Cl-].[Cl-].[Cl-].[Cl-].[Ta]	{17: 4, 11: 1, 14: 3}
Did not match all atoms present	7142-09-8	CC1=NC(=O)C2=C(N1)C=CC(=C2)Cl	{32: 1, 1: 1, 35: 1, 14: 3, 17: 1, 25: 1}
Did not match all atoms present	71422-67-8	C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=CC(=C(C(=C2)Cl)OC3=C(C=C(C=N3)C(F)(F)F)Cl)Cl)F	{35: 1, 4: 1, 14: 7, 16: 5, 17: 3, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	71423-38-6	C=CC1=CC=C(C=C1)COC(=O)CCl	{2: 2, 5: 1, 6: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	71426-87-4	CCCCCCCCC=CCCCCCCCCNCCCNP1(=O)OCC(CO1)(C)C	{1: 3, 2: 18, 6: 2, 11: 2, 13: 1, 23: 2, 29: 1, 31: 2}
Did not match all atoms present	71426-88-5	C=CCOC(=O)OCC(COC(=O)OCC=C)(COC(=O)OCC=C)COC(=O)OCC=C	{2: 8, 4: 1, 5: 4, 6: 4}
Did not match all atoms present	71426-89-6	CCCC[C@@H](CC)COP(=S)(OC[C@H](CC)CCCC)SSP(=S)(OC[C@H](CC)CCCC)OC[C@H](CC)CCCC	{40: 2, 1: 8, 2: 20, 3: 4, 22: 4}
Did not match all atoms present	71426-91-0	CCCCCCCCC=CCCCCCCCCNP1(=O)OCC(CO1)(C)C	{1: 3, 2: 15, 6: 2, 11: 2, 13: 1, 23: 2, 29: 1, 31: 1}
Did not match all atoms present	71426-93-2	CCCCC(CC)COP(=S)(OCC(CC)CCCC)[S-].C[N+](C)(C)CC1=CC=CC=C1	{1: 7, 2: 11, 3: 2, 22: 2, 14: 5}
Did not match all atoms present	7143-01-3	CS(=O)(=O)OS(=O)(=O)C	{1: 2, 29: 4, 22: 1}
Did not match all atoms present	7143-69-3	CC(=CCCC(C)(C=C)OC(=O)CC1=CC=CC=C1)C	{1: 3, 2: 3, 4: 1, 5: 1, 6: 2, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	71431-36-2	CCCOP(=O)(CC)C=C	{1: 2, 2: 3, 5: 1, 6: 1, 22: 1, 29: 1}
Did not match all atoms present	71435-43-3	C1CC2=C(C=C1)C=CC3=C2C=CC4=CC=CC=C43	{11: 2, 14: 10}
Did not match all atoms present	71439-68-4	C1NC(=NC1)N/N=C/C2=C3C(=C(C4=CC=CC=C24)/C=N/NC5=NCCN5)C=CC=C3.Cl	{32: 2, 34: 2, 35: 2, 6: 2, 11: 4, 14: 8, 15: 2, 17: 1, 31: 2}
Did not match all atoms present	7144-15-2	COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC	{24: 2, 1: 2, 22: 2, 14: 12, 31: 2}
Did not match all atoms present	7144-16-3	CC1=[N+](C=C(C=C1)C=C)C.COS(=O)(=O)[O-]	{1: 3, 5: 1, 6: 1, 33: 1, 14: 3, 22: 1, 29: 3}
Did not match all atoms present	7144-20-9	CC1=CC(=NC(=C1C(=O)N)N)C	{24: 1, 1: 2, 35: 1, 30: 2, 14: 1}
Did not match all atoms present	7144-65-2	C1C(O1)COC2=CC=CC=C2C3=CC=CC=C3	{2: 1, 11: 1, 12: 1, 14: 9, 22: 1, 23: 1}
Did not match all atoms present	7144-81-2	CC1=CC=C(C=C1)C2=CC=C(C2)C3=CC=CC=C3	{1: 1, 11: 1, 14: 11, 15: 2}
Did not match all atoms present	71441-09-3	CCOC(=O)C1=CC=C(C=C1)/C=C(\C)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C	{1: 6, 2: 1, 6: 1, 7: 1, 11: 2, 13: 2, 14: 7, 28: 1}
Did not match all atoms present	71441-28-6	C/C(=C\C1=CC=C(C=C1)C(=O)O)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C	{1: 5, 6: 1, 7: 1, 11: 2, 13: 2, 14: 7, 27: 1}
Did not match all atoms present	71441-30-0	C/C(=C\C1=CC=C(C=C1)CO)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C	{1: 5, 2: 1, 6: 1, 7: 1, 11: 2, 13: 2, 14: 7, 20: 1}
Did not match all atoms present	7145-82-6	C1=C(C(=CC(=C1Cl)I)Cl)Cl	{17: 3, 19: 1, 14: 2}
Did not match all atoms present	7145-92-8	C[As+](C)(C)C1=CC=CC(=C1)N.[Cl-]	{1: 3, 30: 1, 14: 4, 17: 1}
Did not match all atoms present	7145-99-5	CC1=CC2=C(C=C1)OCO2	{1: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	7146-67-0	CC1=CC=C(C=C1)S(=O)(=O)N(CCO)CCO	{1: 1, 2: 4, 33: 1, 14: 4, 20: 2, 29: 2}
Did not match all atoms present	71461-97-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{25: 2, 29: 6, 14: 6}
Did not match all atoms present	71463-34-8	CCCCCCCCCCCC1=NCC[N+]1(CCO)CC(=O)[O-].OS(=O)(=O)[O-].[Na+]	{1: 1, 2: 13, 35: 1, 11: 2, 15: 1, 20: 2, 24: 1, 29: 3}
Did not match all atoms present	71463-55-3	C1CC1(C#N)C2=C(C=C(C=C2)Cl)Cl	{17: 2, 11: 2, 13: 1, 14: 3, 37: 1}
Did not match all atoms present	71463-64-4	CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCN)CCN	{1: 3, 2: 7, 34: 2, 8: 2, 11: 3, 12: 1, 13: 2, 14: 4, 27: 2, 29: 2, 30: 2}
Did not match all atoms present	71463-67-7	[CH-]=CC1=CC=CC=C1.C1C(O1)COCCCCOCC2CO2.C1=CC(=O)OC1=O.[NH4+]	{2: 6, 6: 1, 11: 2, 12: 2, 14: 7, 22: 2, 23: 2, 28: 2}
Did not match all atoms present	71463-70-2	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C6=CC=CC=C6C(=C5)OC	{1: 3, 2: 2, 33: 1, 13: 1, 14: 12, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	71463-71-3	C1=C(C(=C(C(=C1I)I)I)C(=O)O)I	{27: 1, 19: 4, 14: 1}
Did not match all atoms present	71463-72-4	CC1=C(C=CC(=C1)O)SC2=C(C=C(C=C2)OP(=O)(OC3=CC(=C(C=C3)SC4=C(C=C(C=C4)O)C)C)OC5=CC(=C(C=C5)SC6=C(C=C(C=C6)O)C)C)C	{1: 6, 40: 3, 14: 18, 21: 3, 22: 3, 29: 1}
Did not match all atoms present	71463-74-6	C1CCNCC1.C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{32: 1, 4: 8, 11: 5, 16: 17, 20: 1, 29: 2}
Did not match all atoms present	71463-77-9	C(C[Si]([O-])([O-])[O-])CS(=O)(=O)[O-].[Na+].[Na+].[K+].[K+]	{2: 3, 29: 6}
Did not match all atoms present	71463-78-0	CCN(CCCP(=O)(O)O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 8, 33: 1, 16: 17, 20: 2, 29: 3}
Did not match all atoms present	71463-79-1	CCN(CCCP(=O)(O)O)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 7, 33: 1, 16: 15, 20: 2, 29: 3}
Did not match all atoms present	71463-80-4	CCN(CCCP(=O)(OCC)OCC)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 3, 2: 6, 4: 8, 33: 1, 16: 17, 22: 2, 29: 3}
Did not match all atoms present	71463-81-5	CCN(CCCP(=O)(OCC)OCC)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 3, 2: 6, 4: 7, 33: 1, 16: 15, 22: 2, 29: 3}
Did not match all atoms present	71463-82-6	CCC(C)COC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2	{1: 2, 2: 3, 3: 1, 28: 2, 14: 9}
Did not match all atoms present	71463-83-7	CC(C)COC(=O)CCC(=O)OCC1=CC=CC=C1	{1: 2, 2: 4, 3: 1, 28: 2, 14: 5}
Did not match all atoms present	7147-89-9	CC1=CC(=C(C=C1Cl)[N+](=O)[O-])O	{1: 1, 38: 1, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	71475-35-9	CCNC(=O)NCC1=CC(=CC=C1)Cl	{1: 1, 2: 2, 14: 4, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	71477-81-1	C1C[C-]2CCC1C2.[Na+]	{11: 5, 12: 1, 15: 1}
Did not match all atoms present	71477-88-8	C1CCC(=O)NCC1.C1=CC=C(C(=C1)C(=O)O)C(=O)O.C(C(CO)(CO)CO)O	{32: 1, 2: 4, 4: 1, 11: 5, 14: 4, 20: 4, 25: 1, 27: 2}
Did not match all atoms present	7148-03-0	CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)O	{1: 1, 27: 1, 14: 8}
Did not match all atoms present	7148-24-5	CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 4, 3: 1, 38: 1, 14: 4, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	7148-50-7	CCCC1(COC(=O)OC1)C	{1: 2, 2: 2, 11: 2, 13: 1}
Did not match all atoms present	7148-78-9	CCOC(/C=C/C1=CC=CC=C1)OCC	{1: 2, 2: 2, 3: 1, 6: 2, 14: 5, 22: 2}
Did not match all atoms present	7148-92-7	C1=CC=C2C(=C1)C3=CC=CC4=CN=CC2=C43	{35: 1, 14: 9}
Did not match all atoms present	71481-55-5	N(P(F)F)P(F)(F)(F)F	{16: 6, 31: 1}
Did not match all atoms present	71484-80-5	C(C(=O)O)N(CC(=O)[O-])CC(=O)[O-].N.[Cu+2]	{24: 2, 33: 1, 2: 3, 27: 1}
Did not match all atoms present	71486-43-6	C1CCC(CC1)(C#N)C2=CC=C(C=C2)F	{16: 1, 11: 5, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	71486-48-1	CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)OC2CCCCC2	{1: 2, 2: 5, 3: 1, 11: 5, 12: 1, 14: 4, 28: 2}
Did not match all atoms present	71487-07-5	C(COCC(CS(=O)(=O)[O-])O)C[Si]([O-])([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{2: 5, 3: 1, 20: 1, 29: 6, 22: 1}
Did not match all atoms present	71487-09-7	C1=CC=C(C=C1)N(CCC#N)CCC#N.C1=CC=C(C=C1)N(CCC#N)CCC#N.OS(=O)(=O)O	{33: 2, 2: 8, 37: 4, 14: 10, 20: 2, 29: 2}
Did not match all atoms present	71487-10-0	CC(=O)O.CC(=O)OCCN(CCC#N)C1=CC=CC=C1	{1: 2, 2: 4, 37: 1, 33: 1, 14: 5, 27: 1, 28: 1}
Did not match all atoms present	71487-19-9	C(COCC(CS(=O)(=O)[O-])O)C[Si]OC(O)O.[Na+]	{2: 5, 3: 2, 20: 3, 29: 3, 22: 2}
Did not match all atoms present	7149-24-8	CCOC(C(C)CC1=CC=C(C=C1)C(C)C)OCC	{1: 5, 2: 3, 3: 3, 22: 2, 14: 4}
Did not match all atoms present	7149-26-0	CC(=CCCC(C)(C=C)OC(=O)C1=CC=CC=C1N)C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 2, 7: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	7149-70-4	CC1=C(C=CC(=C1)[N+](=O)[O-])Br	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	7149-75-9	CC1=C(C=CC(=C1)N)Cl	{1: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	7149-79-3	CC1=C(C=C(C=C1)NC(=O)C)Cl	{24: 1, 1: 2, 31: 1, 14: 3, 17: 1}
Did not match all atoms present	715-48-0	CC1=CC2=C(C=C[N+](=C2C=C1)[O-])[N+](=O)[O-]	{1: 1, 38: 1, 29: 1, 14: 5, 33: 1}
Did not match all atoms present	7150-55-2	C1=CC(=CC=C1C(=O)CCCCl)O	{24: 1, 17: 1, 2: 3, 21: 1, 14: 4}
Did not match all atoms present	71501-16-1	C1=CC2=C(C=CC3=C2C(=C1)C(=O)OC3=O)S(=O)(=O)[O-].[K+]	{28: 2, 29: 3, 14: 5}
Did not match all atoms present	71501-44-5	C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)Cl	{24: 1, 17: 2, 11: 4, 13: 1, 14: 4}
Did not match all atoms present	71501-61-6	CCCCCCCCCC1=CC(=CC(=C1)C2CO2)CCCCCCCCC.CC1CO1.[NH4+].OS(=O)(=O)[O-]	{1: 3, 2: 16, 11: 2, 12: 2, 14: 3, 20: 1, 23: 2, 29: 3}
Did not match all atoms present	71501-62-7	CCCCCCCCCC1=CC(=CC(=C1)C2CO2)CCCCCCCCC.CC1CO1.OS(=O)(=O)[O-].[Na+]	{1: 3, 2: 16, 11: 2, 12: 2, 14: 3, 20: 1, 23: 2, 29: 3}
Did not match all atoms present	7151-39-5	CNC(=O)NCCNC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 2, 35: 3, 14: 2, 24: 1, 31: 3}
Did not match all atoms present	7151-68-0	CC1=C(C=C(C=C1)C(=O)O)OC	{1: 2, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	7151-75-9	C1CN2C(=CC=NC2=S)N1CCCl	{33: 2, 2: 2, 35: 1, 11: 2, 14: 2, 17: 1}
Did not match all atoms present	7151-76-0	CS(=O)(=O)NC1=CC=C(C=C1)C(=O)O	{1: 1, 27: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	7151-77-1	CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C	{1: 2, 2: 1, 14: 4, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	71519-78-3	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)OC6=O.C1=CC=C(C=C1)N.C1=CC(=CC(=C1)N)N	{1: 2, 4: 1, 14: 23, 22: 2, 28: 4, 30: 3}
Did not match all atoms present	71519-79-4	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)OC6=O.C1=CC(=CC(=C1)N)N.C1=CC(=CC=C1N)N	{1: 2, 4: 1, 14: 22, 22: 2, 28: 4, 30: 4}
Did not match all atoms present	71519-93-2	CCOC(=O)CC(C)NC1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC	{1: 4, 2: 2, 3: 1, 38: 2, 34: 2, 14: 4, 18: 1, 22: 1, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	71519-94-3	CCOC(=O)CC(C)NC1=C(C=CC(=C1)NC(=O)C)OC	{1: 4, 2: 2, 3: 1, 14: 3, 22: 1, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	71519-95-4	CC1(COP(OC1)OC2=C(C=C(C=C2)C(C)(C)C)C(C)(C)C)C	{1: 8, 4: 2, 11: 2, 13: 1, 14: 3, 22: 1, 23: 2}
Did not match all atoms present	71519-97-6	CC(C)(C)C1=CC(=C2C(=C1)C3=CC(=CC(=C3OP(O2)OCCCCCCOP4OC5=C(C=C(C=C5C6=CC(=CC(=C6O4)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 24, 2: 6, 4: 8, 14: 8, 22: 2, 23: 4}
Did not match all atoms present	71519-98-7	C(N(CP(=O)(O)O)C1=NC(=NC(=N1)N(CP(=O)(O)O)CP(=O)(O)O)N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O	{33: 3, 2: 6, 35: 3, 20: 12, 29: 6}
Did not match all atoms present	71519-99-8	CC(=O)NC1=CC(=CC=C1)N(CCC(=O)O)CCC(=O)O	{1: 1, 2: 4, 33: 1, 14: 4, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	7152-03-6	COC1=CC=C(C=C1)C(=O)C2CC2	{1: 1, 11: 2, 12: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	7152-19-4	CC1=CC(=O)N=C(N1)NC#N	{32: 1, 1: 1, 35: 1, 37: 1, 14: 1, 25: 1, 31: 1}
Did not match all atoms present	7152-24-1	CSC1=NC2=CC=CC=C2N1	{32: 1, 1: 1, 35: 1, 14: 4, 40: 1}
Did not match all atoms present	7152-40-1	C1=CC=C(C=C1)N2C(=C(C(=N2)CC#N)C#N)N	{33: 1, 2: 1, 35: 1, 37: 2, 14: 5, 30: 1}
Did not match all atoms present	7152-66-1	CN1C=CC(=NC1=O)OC	{1: 2, 35: 1, 33: 1, 14: 2, 22: 1, 25: 1}
Did not match all atoms present	7152-80-9	CN(C)C1=CC=C(C=C1)SC#N	{40: 1, 1: 2, 37: 1, 14: 4, 33: 1}
Did not match all atoms present	7152-88-7	CC(C)COC(=O)C1=CC(=C(C=C1)O)OC	{1: 3, 2: 1, 3: 1, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	71520-01-9	CC(=C)C(=O)OCCOC(=O)NC1=CC=CC=C1NC(=O)OCCOC(=O)C(=C)C	{1: 2, 2: 4, 5: 2, 7: 2, 14: 4, 28: 4, 31: 2}
Did not match all atoms present	71520-02-0	CC(=C)C1=CC=CC=C1C(C)(C)OOC(C)(C)C	{1: 6, 4: 2, 5: 1, 7: 1, 14: 4, 22: 2}
Did not match all atoms present	71520-04-2	CC(=C)C1=CC=C(C=C1)C(C)(C)O	{1: 3, 4: 1, 5: 1, 7: 1, 14: 4, 20: 1}
Did not match all atoms present	71520-05-3	CC(=O)C1=CC(=CC=C1)C(C)(C)OOC(C)(C)C	{24: 1, 1: 6, 4: 2, 22: 2, 14: 4}
Did not match all atoms present	71521-92-1	CC(=O)NC1=NNC(=S)N1C	{32: 1, 1: 2, 35: 1, 33: 1, 24: 1, 31: 1}
Did not match all atoms present	71522-58-2	C1=CC(=C(C=C1[C@@H](C(=O)O)N)O)CO	{2: 1, 3: 1, 14: 3, 20: 1, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	7153-22-2	CCOC(=O)C1=CC=C(C=C1)C#N	{1: 1, 2: 1, 28: 1, 37: 1, 14: 4}
Did not match all atoms present	7153-86-8	C1=CC(=C(C=C1Cl)[N+](=O)[O-])NC(=O)N	{38: 1, 14: 3, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	7154-16-7	CCOC(=O)CNC(=O)NC1=CNC(=O)NC1=O	{32: 2, 1: 1, 2: 2, 14: 1, 24: 1, 25: 2, 28: 1, 31: 2}
Did not match all atoms present	7154-66-7	C1=CC=C(C(=C1)C(=O)Cl)Br	{24: 1, 17: 1, 18: 1, 14: 4}
Did not match all atoms present	7155-12-6	CCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 6, 28: 1, 14: 5}
Did not match all atoms present	71550-11-3	C=CCN(CP(=O)(O)O)CP(=O)(O)O	{33: 1, 2: 3, 5: 1, 6: 1, 20: 4, 29: 2}
Did not match all atoms present	71550-13-5	C=CCN(CP(=O)(O)O)CP(=O)(O)O.C=CC(=O)O	{33: 1, 2: 3, 5: 2, 6: 2, 20: 4, 27: 1, 29: 2}
Did not match all atoms present	71550-18-0	CC1=C(C=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])C.[Na+]	{1: 2, 14: 8, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	71550-19-1	CC1=CC(=C(C=C1)C)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+]	{1: 2, 14: 8, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	71550-20-4	CC1=CC(=C(C=C1)Cl)C(=O)C2=CC=CC=C2C(=O)O	{24: 1, 1: 1, 27: 1, 14: 7, 17: 1}
Did not match all atoms present	71550-23-7	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 2, 33: 1, 34: 2, 14: 17, 29: 5, 31: 1}
Did not match all atoms present	71550-25-9	CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)/C=C(\C#N)/C(=O)OCC[N+](C)(C)C)C.[Cl-]	{1: 5, 2: 4, 33: 1, 6: 1, 7: 1, 14: 8, 17: 1, 28: 1, 37: 1}
Did not match all atoms present	71550-26-0	C([C@@H](C(=O)[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{24: 2, 33: 1, 2: 3, 3: 1, 29: 6}
Did not match all atoms present	71550-27-1	C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N=NC3C(=NN(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)[O-])N=NC5C(=NN(C5=O)C6=CC(=CC=C6)[N+](=O)[O-])C(=O)[O-].[Na+].[Na+]	{33: 2, 34: 4, 35: 2, 38: 2, 12: 2, 14: 16, 15: 2, 24: 3, 25: 2, 31: 1}
Did not match all atoms present	71550-28-2	C1=CC2=C(C=C(C=C2C=C1NC(=O)NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)[O-])S(=O)(=O)O)O.[Na+]	{14: 10, 20: 1, 21: 2, 24: 1, 29: 5, 31: 2}
Did not match all atoms present	71550-29-3	C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N=NC3C(=NN(C3=O)C4=CC(=CC=C4)N)C(=O)[O-])N=NC5C(=NN(C5=O)C6=CC(=CC=C6)N)C(=O)[O-].[Na+].[Na+]	{33: 2, 34: 4, 35: 2, 12: 2, 14: 16, 15: 2, 24: 3, 25: 2, 30: 2, 31: 1}
Did not match all atoms present	71550-30-6	C1=CC(=C(C=C1N/N=C\2/C3=C(C(=C(C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])N)C(=O)C=C2)S(=O)(=O)[O-])/C=C/C4=C(C=C(C=C4)N/N=C\5/C6=C(C(=C(C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])N)C(=O)C=C5)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 2, 6: 2, 14: 12, 15: 2, 25: 2, 29: 18, 30: 2, 31: 2}
Did not match all atoms present	71550-31-7	CCCCCCCCCCCC(CCCCCCCCCCC)NCC1=CC=CC=C1	{1: 2, 2: 21, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	71550-33-9	CCCCCCCCCCOC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OCCCCCCCCCC	{1: 2, 2: 18, 22: 2, 14: 14, 25: 2}
Did not match all atoms present	71550-34-0	CCCCCCC(=O)OC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OC(=O)CCCCCC	{1: 2, 2: 10, 28: 2, 14: 14, 25: 2}
Did not match all atoms present	71550-35-1	C[C@@](N(C)C)(P(=O)(O)O)Cl	{1: 3, 4: 1, 33: 1, 17: 1, 20: 2, 29: 1}
Did not match all atoms present	71550-38-4	CCC[C@H]([C@@H](CC)[C@@H](O)OC(=O)C1=CC2=C(C=C1)C(=O)OC2=O)O	{1: 2, 2: 3, 3: 3, 14: 3, 20: 2, 28: 3}
Did not match all atoms present	71550-41-9	CC(CC[Si]1(O[Si](O[Si](O[Si](O1)(C)CCC(C)C#N)(C)CCC(C)C#N)(C)CCC(C)C#N)C)C#N	{1: 8, 2: 8, 3: 4, 37: 4, 23: 4}
Did not match all atoms present	71550-47-5	CCOC(=O)C1=C(C=C(C=C1)C(C2=CC(=C(C=C2)C(=O)OCC)C(=O)O)(C(F)(F)F)C(F)(F)F)C(=O)O	{1: 2, 2: 2, 4: 3, 14: 6, 16: 6, 27: 2, 28: 2}
Did not match all atoms present	71550-48-6	CCCCP(=S)(CCCC)[S-].[Na+]	{1: 2, 2: 6}
Did not match all atoms present	71550-49-7	CC[C@H](CO)N.C1=CC=C(C=C1)C(C(=O)O)O	{1: 1, 2: 2, 3: 2, 14: 5, 20: 2, 27: 1, 30: 1}
Did not match all atoms present	71550-50-0	CN(C)C1=CC(=C(C=C1OC)[N+](=O)[O-])OC	{1: 4, 38: 1, 22: 2, 14: 2, 33: 1}
Did not match all atoms present	71550-51-1	CC1=C(C=C(C(=C1Cl)O)S(=O)(=O)O)Cl	{1: 1, 14: 1, 17: 2, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	71550-54-4	CCCOC1=CC(=C(C=C1N2CCCC2)OCCC)N	{1: 2, 2: 4, 33: 1, 11: 4, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	71550-55-5	CCCOC1=CC(=C(C=C1N2CCCC2)OCCC)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 33: 1, 11: 4, 14: 2, 22: 2}
Did not match all atoms present	71550-56-6	[B-](F)(F)(F)F.CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCCC2	{1: 2, 2: 6, 33: 1, 11: 4, 34: 1, 14: 2, 16: 4, 22: 2}
Did not match all atoms present	71550-57-7	CC(C)(C1=CC=C(C=C1)OC2=CC=C(C=C2)N=[N+]=N)C3=CC=C(C=C3)OC4=CC=C(C=C4)N=[N+]=N	{1: 2, 34: 4, 4: 1, 14: 16, 22: 2, 36: 2}
Did not match all atoms present	71550-62-4	CC(CC[Si](C)(Cl)Cl)C#N	{1: 2, 2: 2, 3: 1, 37: 1, 17: 2}
Did not match all atoms present	71550-63-5	C[Si](CCCOC(=O)C=C)(Cl)Cl	{1: 1, 2: 3, 5: 1, 6: 1, 17: 2, 28: 1}
Did not match all atoms present	71550-64-6	C[Si]1(O[Si](O[Si](O[Si](O1)(C)CCCOC(=O)C=C)(C)CCCOC(=O)C=C)(C)CCCOC(=O)C=C)CCCOC(=O)C=C	{1: 4, 2: 12, 5: 4, 6: 4, 23: 4, 28: 4}
Did not match all atoms present	71550-68-0	CC1(C(=O)N(C(=O)N1)CCC[Si](OC)(OC)OC)C	{32: 1, 1: 5, 2: 3, 33: 1, 13: 1, 22: 3, 25: 2}
Did not match all atoms present	71550-69-1	CC1=C(C=CC(=C1)C(C)(C)CC(C)(C)C)OCCOCCN(C)C	{1: 8, 2: 5, 4: 2, 33: 1, 14: 3, 22: 2}
Did not match all atoms present	71552-62-0	CN1C(=O)CC(=O)[N-]C1=O.[Na+]	{1: 1, 11: 1, 33: 1, 35: 1, 25: 3}
Did not match all atoms present	71561-11-0	CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)OCC(=O)C3=CC=CC=C3)C	{1: 2, 2: 1, 35: 1, 33: 1, 14: 8, 17: 2, 22: 1, 24: 2}
Did not match all atoms present	71566-22-8	C1=CC=C2C(=C1)C3=NC4=C5C=CC(=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=C(C=C(C=C9)S(=O)(=O)[O-])C(=NC2=N3)[N-]8)S(=O)(=O)[O-].[NH4+].[NH4+].[Cu+2]	{35: 8, 29: 6, 14: 14}
Did not match all atoms present	71566-27-3	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.C1CCC(CC1)N.[Co+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 11: 5, 12: 1, 14: 16, 15: 4, 25: 2, 30: 1}
Did not match all atoms present	71566-29-5	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC(C)C)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC(C)C)[O-])[O-])C3=CC=CC=C3.CC(C)N.[Cr+3]	{1: 8, 34: 4, 3: 3, 33: 2, 14: 16, 35: 2, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	71566-31-9	[H+].CC(C)N.CC(C)NS(=O)(=O)C1=CC(=C(C=C1)[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].CC(C)NS(=O)(=O)C1=CC(=C(C=C1)[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].[Cr+3]	{1: 6, 34: 4, 3: 3, 14: 18, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	71566-33-1	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)O.CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC=CC=C4.[Cr+2]	{1: 5, 2: 4, 35: 1, 33: 3, 34: 2, 14: 20, 23: 1, 27: 1, 29: 3}
Did not match all atoms present	71566-34-2	[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])[O-])[NH-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=C(C=C3)[N+](=O)[O-])[O-])[NH-].[Co+3]	{34: 4, 36: 2, 38: 2, 14: 18}
Did not match all atoms present	71566-43-3	CN(C)[C@H](P(=O)(O)O)Cl	{1: 2, 3: 1, 33: 1, 17: 1, 20: 2, 29: 1}
Did not match all atoms present	71566-50-2	CC(C)C1=CC=C(C=C1)C(C)(C)OOC(C)(C)C2=CC=CC=C2	{1: 6, 3: 1, 4: 2, 22: 2, 14: 9}
Did not match all atoms present	71566-56-8	CCCCN.CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=C(C=CC(=C3)S(=O)(=O)O)Cl	{1: 2, 2: 3, 35: 1, 33: 1, 12: 1, 34: 2, 14: 8, 15: 1, 17: 1, 20: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	71566-79-5	C1=CC=C(C=C1)SC2=C(C3=C(C(=O)C(C3=O)C4=NC5=CC=CC=C5C=C4O)C(=C2SC6=CC=CC=C6)Cl)Cl	{35: 1, 40: 2, 12: 1, 14: 15, 17: 2, 21: 1, 25: 2}
Did not match all atoms present	71566-80-8	CC(=O)[O-].CN(C)C1=CC=C(C=C1)C=C2C=CC(=[N+](C)C)C=C2	{1: 5, 6: 1, 33: 2, 14: 8, 15: 2, 24: 1}
Did not match all atoms present	7157-29-1	C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)N4CCOCC4	{33: 1, 35: 1, 11: 8, 14: 4, 23: 1, 24: 1}
Did not match all atoms present	71573-09-6	C1=CC(=C(C=C1N2C(=O)C=CC2=O)O)O	{25: 2, 21: 2, 14: 5, 33: 1}
Did not match all atoms present	71579-71-0	N([SiH3])([SiH3])P(F)F	{16: 2, 33: 1}
Did not match all atoms present	71579-72-1	N([SiH3])(P(F)F)P(F)F	{16: 4, 33: 1}
Did not match all atoms present	7158-32-9	C1=CC(=CC=C1C(=O)Cl)OC2=CC=C(C=C2)C(=O)Cl	{24: 2, 17: 2, 22: 1, 14: 8}
Did not match all atoms present	71583-13-6	CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCCC2.F[P-](F)(F)(F)(F)F	{1: 2, 2: 6, 33: 1, 11: 4, 34: 1, 14: 2, 16: 6, 22: 2}
Did not match all atoms present	7159-34-4	COC1=NC(=CC(=C1)C(Cl)(Cl)Cl)Cl	{1: 1, 35: 1, 4: 1, 14: 2, 17: 4, 22: 1}
Did not match all atoms present	7159-96-8	CCOC(=O)NC1=CC(=CC=C1)O	{1: 1, 2: 1, 14: 4, 21: 1, 28: 1, 31: 1}
Did not match all atoms present	71591-81-6	CC(C)(C(=O)C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)OC	{24: 2, 1: 3, 4: 1, 22: 1, 14: 9}
Did not match all atoms present	71598-15-7	C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)N=NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 1, 34: 4, 29: 12, 14: 18, 31: 2}
Did not match all atoms present	71598-16-8	C1=CC=C2C(=C1)C3=CC4=C5C6=C(C=CC(=C36)C2=O)C7=C8C5=C(N4)C=C9C8=C(C=C7)C(=O)C1=CC=CC=C19	{32: 1, 25: 2, 14: 14}
Did not match all atoms present	71598-18-0	CC1=CC=CC=C1S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OC	{1: 2, 14: 9, 22: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	71598-19-1	CCC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCOCCC#N)CCOCCC#N	{1: 2, 2: 9, 37: 2, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	71598-20-4	CC1=CC=C(C=C1)N=NC2=C3C=CC=C(C3=C(C=C2)NC4=CC=CC=C4)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 2, 29: 3, 14: 14, 31: 1}
Did not match all atoms present	71598-28-2	CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCCC2.F[P-](F)(F)(F)(F)F	{1: 2, 2: 2, 33: 1, 11: 4, 34: 1, 14: 2, 16: 6, 22: 2}
Did not match all atoms present	71598-30-6	C1=CC=C(C=C1)N2C3=CC(=C(C=C3N=C4C2=CC5=NC6=CC(=C(C=C6N(C5=C4)C7=CC=CC=C7)NC8=CC(=CC=C8)S(=O)(=O)[O-])N)N)NC9=CC(=CC=C9)S(=O)(=O)[O-].[Na+].[Na+]	{33: 2, 35: 2, 14: 24, 29: 6, 30: 2, 31: 2}
Did not match all atoms present	71598-31-7	COC1=C(C=CC(=C1)[N+]#N)N2CCCC2.C=O.Cl[Zn-](Cl)Cl	{1: 1, 34: 1, 5: 1, 33: 1, 11: 4, 14: 3, 17: 3, 22: 1}
Did not match all atoms present	71598-32-8	[H+].CCC1=CC=CC=C1N2C(=C(C(=N2)C)N=NC3=CC=CC=C3C(=O)[O-])[O-].CCC1=CC=CC=C1N2C(=C(C(=N2)C)N=NC3=CC=CC=C3C(=O)[O-])[O-].[Cr+3]	{1: 4, 2: 2, 35: 2, 33: 2, 34: 4, 14: 16, 24: 2}
Did not match all atoms present	71598-33-9	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC(=CC=C3)Cl.CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)C)[O-].[Cr+3]	{1: 4, 34: 4, 35: 1, 33: 1, 14: 15, 17: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	71598-35-1	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC(=CC=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC(=CC=C3)Cl.[Cr+3]	{1: 4, 34: 4, 35: 2, 33: 2, 14: 14, 17: 2, 29: 4}
Did not match all atoms present	716-39-2	C1=CC=C2C=C3C(=CC2=C1)C(=O)OC3=O	{28: 2, 14: 6}
Did not match all atoms present	716-53-0	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2Cl	{17: 1, 14: 9}
Did not match all atoms present	716-61-0	C1=CC(=CC=C1[C@H]([C@@H](CO)N)O)[N+](=O)[O-]	{2: 1, 3: 2, 38: 1, 14: 4, 20: 2, 30: 1}
Did not match all atoms present	716-79-0	C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2	{32: 1, 35: 1, 14: 9}
Did not match all atoms present	716-96-1	CC1=CC(=C(C=C1)O)CC2=CC=CC=C2	{1: 1, 2: 1, 21: 1, 14: 8}
Did not match all atoms present	7160-01-2	CC1=CC=C(C=C1)NC(=O)N(C)C	{24: 1, 1: 3, 33: 1, 14: 4, 31: 1}
Did not match all atoms present	7160-22-7	CC(C)(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl	{1: 3, 4: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	71600-20-9	C1CCC23CC=CCC2(C1)CS(=O)C3	{11: 8, 13: 2, 14: 2, 29: 1}
Did not match all atoms present	71605-88-4	CCCCCCOC(=O)C1=CC=CC=C1OC	{1: 2, 2: 5, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	71606-01-4	CC(C)(C1=CC=CC=C1)C2=CC(=C(C=C2)OC3=C(C4=C(C(=C3)O)C(=O)[C@H]5C=CC=C[C@@H]5C4=O)N)S(=O)(=O)O	{1: 2, 4: 1, 12: 2, 14: 13, 20: 1, 21: 1, 22: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	71607-26-6	CCCCCCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 5, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	71608-10-1	CC1=C(C(=C(C=C1)C)O)[N+](=O)[O-]	{1: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	71608-69-0	CCCCCCCCCC1=CC(=CC(=C1)OS(=O)(=O)O)CCCCCCCCC.CC1CO1.C1CO1.C(CO)N(CCO)CCO	{1: 3, 2: 22, 33: 1, 11: 3, 12: 1, 14: 3, 20: 4, 22: 1, 23: 2, 29: 2}
Did not match all atoms present	71608-70-3	C=O.C1=CC(=CC=C1O)S(=O)(=O)[O-].C(=O)(N)N.[Na+]	{5: 1, 14: 4, 21: 1, 24: 1, 29: 3, 30: 2}
Did not match all atoms present	71609-22-8	CC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)N(C(=O)C)O	{1: 2, 33: 1, 14: 8, 20: 1, 24: 2, 31: 1}
Did not match all atoms present	71609-39-7	COC1=CC=C(C=C1)CC2=NCCN2	{32: 1, 1: 1, 2: 1, 35: 1, 11: 2, 14: 4, 15: 1, 22: 1}
Did not match all atoms present	71615-27-5	C[C@H]1C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)OC(=O)C)C)[C@@]4(C1=CC(=O)CC4)C.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)CCC4CCCC4)CCC5=C3C=CC(=C5)O	{1: 6, 2: 2, 11: 17, 12: 9, 13: 4, 14: 4, 15: 1, 21: 1, 24: 1, 25: 1, 28: 2}
Did not match all atoms present	71617-14-6	CC1CCC(C(C1)OC(=O)C2=CC=CC=C2)C(C)C	{1: 3, 3: 1, 11: 3, 12: 3, 14: 5, 28: 1}
Did not match all atoms present	71617-29-3	CCCOCCCN1C(=O)C2=C(C3=C(C(=O)[C@H]4C=CC=C[C@@H]4C3=O)C(=C2C1=O)N)N	{1: 1, 2: 5, 33: 1, 12: 2, 14: 4, 22: 1, 25: 4, 30: 2}
Did not match all atoms present	7162-59-6	CCCCCCOC1=CC=CC=C1C=O	{1: 1, 2: 5, 26: 1, 22: 1, 14: 4}
Did not match all atoms present	71626-11-4	CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2	{1: 4, 2: 1, 3: 1, 33: 1, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	71626-98-7	O.[Ca+2].[I-].[I-]	{19: 2}
Did not match all atoms present	71628-96-1	C[C@@]1(C[C@@H](C2=C(C1)C=C3C(=C2O)C(=O)C4=C(C=C5C(=C4C3=O)OC6[C@H]([C@@H]([C@H](C5(O6)C)O)N(C)C)O)O)OC)O	{1: 5, 33: 1, 11: 2, 12: 5, 13: 2, 14: 2, 20: 3, 21: 2, 22: 1, 23: 2, 25: 2}
Did not match all atoms present	7163-25-9	CCOC(=O)C1=CC2=CC=CC=C2C=C1O	{1: 1, 2: 1, 28: 1, 21: 1, 14: 6}
Did not match all atoms present	71633-43-7	CC1=CC2=C(C=C1)C(=CC(=N2)C)C	{1: 3, 35: 1, 14: 4}
Did not match all atoms present	71637-34-8	C1=CSC=C1CO	{41: 1, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	7164-43-4	C1(=C(NC(=O)NC1=O)C(=O)O)N	{32: 2, 25: 2, 27: 1, 30: 1}
Did not match all atoms present	7164-98-9	C1=CC=C(C=C1)N2C=CN=C2	{33: 1, 35: 1, 14: 8}
Did not match all atoms present	71642-16-5	CC1=C(C(=C(C=C1Br)Br)N)Br	{1: 1, 18: 3, 30: 1, 14: 1}
Did not match all atoms present	71648-39-0	CC1=CC(=CC=C1)OCCCCCl	{1: 1, 2: 4, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	71648-45-8	CC(=O)C1=C(C=CC(=C1)C(F)(F)F)Cl	{1: 1, 4: 1, 14: 3, 16: 3, 17: 1, 24: 1}
Did not match all atoms present	71653-63-9	CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2OC(F)F)C(=O)OC	{32: 1, 1: 4, 3: 1, 12: 1, 14: 4, 15: 4, 16: 2, 22: 1, 28: 2}
Did not match all atoms present	71653-64-0	C1=CC=C(C(=C1)C=O)OC(F)F	{16: 2, 26: 1, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	71656-72-9	C1CCC23CS(=O)CC2(C1)C=CC=C3	{11: 6, 13: 2, 14: 4, 29: 1}
Did not match all atoms present	7166-19-0	C1=CC=C(C=C1)C=C([N+](=O)[O-])Br	{18: 1, 38: 1, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	71662-46-9	CCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC	{1: 2, 2: 15, 28: 2, 14: 4}
Did not match all atoms present	71662-55-0	C=O.C1=CC=C(C=C1)N.C(CCCN)CCN.Cl	{17: 1, 2: 6, 30: 3, 5: 1, 14: 5}
Did not match all atoms present	71662-60-7	CCCCCCCCCCCCCCCC[C@@H](C)[N+](C)(C)[O-]	{1: 4, 2: 15, 3: 1, 29: 1}
Did not match all atoms present	71662-64-1	CCCCCCCCCCCCCC[C@@H](C)[N+](C)(C)[O-]	{1: 4, 2: 13, 3: 1, 29: 1}
Did not match all atoms present	71662-65-2	CCCCCCCCCCCCN(CCN(CCNC(=O)CC(C(=O)[O-])S(=O)(=O)O)CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 18, 3: 1, 33: 2, 20: 1, 24: 4, 29: 2, 31: 1}
Did not match all atoms present	71662-66-3	CCCCCCCCCCNCCNCCNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 14, 3: 1, 24: 2, 29: 3, 31: 3}
Did not match all atoms present	71672-75-8	CCOC1=CC=CC=C1CO	{1: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	71672-88-3	CC1=C(C=CC(=C1)N=C=S)Br	{8: 1, 1: 1, 18: 1, 34: 1, 14: 3}
Did not match all atoms present	71673-01-3	C[C@@H]1CC(N(C2=C1C=CC(=C2)C)CCOS(=O)(=O)O)(C)C	{1: 4, 2: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 3, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	71673-02-4	CCOCCOCCN1C2=C(C=CC(=C2)NC(=O)C)[C@@H](CC1(C)C)C	{1: 5, 2: 5, 33: 1, 11: 1, 12: 1, 13: 1, 14: 3, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	71673-03-5	C1CC(CCC1CNC2=C3C(=C(C=C2)NCC4CCC(CC4)CO)C(=O)C5=CC=CC=C5C3=O)CO	{2: 4, 11: 8, 12: 4, 14: 6, 20: 2, 25: 2, 31: 2}
Did not match all atoms present	71673-04-6	CCSC1=NN=C(S1)N=NC2=C(C=C3C(=C2)C(CC(N3CCOS(=O)(=O)[O-])(C)C)C)C.[Na+]	{1: 5, 2: 3, 34: 2, 33: 1, 40: 1, 41: 1, 11: 1, 12: 1, 13: 1, 14: 2, 35: 2, 22: 1, 29: 3}
Did not match all atoms present	71673-05-7	CCN(CCS(=O)(=O)[O-])C1=CC(=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)C)C.[K+]	{1: 3, 2: 3, 35: 1, 33: 1, 41: 1, 34: 2, 14: 6, 29: 3}
Did not match all atoms present	71673-06-8	CCN(CCS(=O)(=O)[O-])C1=CC=C(C=C1)N=NC2=NC3=C(S2)C=C(C=C3)C.[K+]	{1: 2, 2: 3, 35: 1, 33: 1, 41: 1, 34: 2, 14: 7, 29: 3}
Did not match all atoms present	71673-07-9	CCCN(CCC)C1=CC=CC(=C1)NC(=O)C2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	71673-08-0	CCN(CCO)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)S(=O)(=O)C)Cl)C.OS(=O)(=O)[O-].[K+]	{1: 3, 2: 3, 33: 1, 34: 2, 14: 6, 17: 1, 20: 2, 29: 5}
Did not match all atoms present	71673-10-4	CCN(CC(CO)O)C1=CC(=C(C=C1)C=O)C.OS(=O)(=O)O	{1: 2, 2: 3, 3: 1, 33: 1, 14: 3, 20: 4, 26: 1, 29: 2}
Did not match all atoms present	71673-12-6	CCOCCOCCN1C2=CC(=C(C=C2[C@@H](CC1(C)C)C)N=NC3=C(C=C(C=C3C#N)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C	{1: 5, 2: 5, 34: 2, 37: 1, 38: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 4, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	71673-13-7	CCOCCOCCN1C2=CC(=C(C=C2[C@@H](CC1(C)C)C)N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C	{1: 5, 2: 5, 34: 2, 38: 2, 33: 1, 11: 1, 12: 1, 13: 1, 14: 4, 18: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	71673-14-8	CCOCCOCCN1C2=C(C=CC(=C2)N)C(CC1(C)C)C	{1: 4, 2: 5, 33: 1, 11: 1, 12: 1, 13: 1, 14: 3, 22: 2, 30: 1}
Did not match all atoms present	71673-15-9	C1=CC2=C(C(=C1)SC3=NN(C=N3)CCO)C(=O)C4=C(C2=O)C(=CC=C4)SC5=NN(C=N5)CCO	{33: 2, 2: 4, 35: 4, 40: 2, 14: 8, 20: 2, 25: 2}
Did not match all atoms present	71673-16-0	CCN(CCS(=O)(=O)[O-])C1=CC=CC=C1.[K+]	{1: 1, 2: 3, 29: 3, 14: 5, 33: 1}
Did not match all atoms present	71673-17-1	CCN(CCS(=O)(=O)[O-])C1=CC=CC(=C1)C.[K+]	{1: 2, 2: 3, 29: 3, 14: 4, 33: 1}
Did not match all atoms present	71673-18-2	C1CC(CCC1CNC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NCC5CCC(CC5)CO)CO	{2: 4, 11: 8, 12: 4, 14: 6, 20: 2, 25: 2, 31: 2}
Did not match all atoms present	71673-19-3	CCOCCOCCN1C2=C(C=CC(=C2)[N+](=O)[O-])[C@@H](CC1(C)C)C	{1: 4, 2: 5, 38: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 3, 22: 2}
Did not match all atoms present	71673-20-6	CCOCCOCCN1C2=CC=CC=C2C(CC1(C)C)C	{1: 4, 2: 5, 33: 1, 11: 1, 12: 1, 13: 1, 14: 4, 22: 2}
Did not match all atoms present	7168-55-0	CC1=CC(=C(C=C1)OC)C2=C(C=CC(=C2)C)OC	{1: 4, 22: 2, 14: 6}
Did not match all atoms present	7169-34-8	C1C(=O)C2=CC=CC=C2O1	{25: 1, 11: 1, 14: 4, 23: 1}
Did not match all atoms present	71693-92-0	C1=COC(=C1)CO.C(CO)N1C(=O)N(C(=O)N(C1=O)CCO)CCO	{33: 3, 2: 7, 14: 3, 20: 4, 23: 1, 25: 3}
Did not match all atoms present	717-21-5	C1=CC=C(C=C1)C(=O)C=CC2=CC=CO2	{24: 1, 14: 8, 6: 2, 23: 1}
Did not match all atoms present	717-47-5	CC(=O)OC1=CC(=C(C=C1)O)C(C)(C)C	{1: 4, 4: 1, 21: 1, 14: 3, 28: 1}
Did not match all atoms present	717-74-8	CC(C)C1=CC(=CC(=C1)C(C)C)C(C)C	{1: 6, 3: 3, 14: 3}
Did not match all atoms present	7170-38-9	C1=CC=C(C=C1)OCCC(=O)O	{2: 2, 27: 1, 22: 1, 14: 5}
Did not match all atoms present	7170-44-7	C1=CC=C(C=C1)OCCCCCCCCCCC(=O)O	{2: 10, 27: 1, 22: 1, 14: 5}
Did not match all atoms present	7170-76-5	CC1=C(SC(=N1)N)C.Br	{1: 2, 18: 1, 35: 1, 30: 1, 41: 1}
Did not match all atoms present	7170-77-6	C1=CC2=C(C=C1SC#N)SC(=N2)N	{35: 1, 37: 1, 40: 1, 41: 1, 14: 3, 30: 1}
Did not match all atoms present	71701-07-0	CCCCCCCCCCCCNCCNCCNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 16, 3: 1, 24: 2, 29: 3, 31: 3}
Did not match all atoms present	71701-08-1	CCCCCCCCCCN(CCN(CCNC(=O)CC(C(=O)[O-])S(=O)(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 16, 3: 1, 33: 2, 24: 4, 29: 3, 31: 1}
Did not match all atoms present	71701-13-8	CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=C(C=C3)Cl.[Na+].[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 16, 17: 2, 24: 2}
Did not match all atoms present	71701-16-1	CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=CC(=C3)C#N.CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=CC(=C3)C#N.[Na+].[Cr+3]	{1: 4, 34: 4, 35: 2, 37: 2, 33: 2, 14: 14, 29: 4, 31: 2}
Did not match all atoms present	71701-18-3	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5S(=O)(=O)[O-].[K+].[K+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 20, 15: 2, 29: 9}
Did not match all atoms present	71701-19-4	CCN(CC1=CC(=CC=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)C(=C3C=CC(=[N+](CC)CC4=CC(=CC=C4)S(=O)(=O)[O-])C=C3)C5=CC=CC=C5S(=O)(=O)[O-].[Na+].[K+]	{1: 2, 2: 4, 33: 2, 7: 1, 14: 20, 15: 2, 29: 9}
Did not match all atoms present	71701-20-7	C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)[O-])OC5=C3C=CC(=C5)[O-].[Na+].[K+]	{28: 1, 13: 1, 14: 10, 23: 1}
Did not match all atoms present	71701-22-9	CC1=C(C=CC=C1N=C=O)N=C=O.CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4.C(C(CO)O)O	{1: 3, 2: 4, 3: 1, 4: 1, 8: 2, 11: 2, 12: 2, 34: 2, 14: 11, 20: 3, 22: 2, 23: 2, 29: 2}
Did not match all atoms present	71701-23-0	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])N=NC3C(=NN(C3=O)C4=CC(=CC=C4)N/N=C/5\C(=CC6=C(C5=O)C=CC(=C6)NC(=O)C7=CC=C(C=C7)N)S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 5, 35: 1, 33: 1, 12: 1, 14: 19, 15: 3, 22: 1, 24: 2, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	71701-24-1	CCC(C)(C)C1=C/C(=N/NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)/C(=O)C=C1	{1: 3, 2: 1, 4: 1, 34: 1, 14: 12, 15: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	71701-25-2	CC(C)(C)C1=C/C(=N/NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)/C(=O)C=C1	{1: 3, 34: 1, 4: 1, 14: 12, 15: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	71701-26-3	CC1=C/C(=N/NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)/C(=O)C=C1	{1: 1, 34: 1, 14: 12, 15: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	71701-27-4	CC1=NN(C(=O)C1N/N=C\2/C=C(C=CC2=O)S(=O)(=O)NC3=CC=CC=C3C(=O)[O-])C4=CC=CC=C4.[Na+]	{1: 1, 34: 1, 35: 1, 33: 1, 12: 1, 14: 12, 15: 3, 24: 1, 25: 2, 29: 2, 31: 2}
Did not match all atoms present	71701-28-5	CCOC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])C.[Na+]	{1: 2, 2: 1, 34: 4, 14: 11, 22: 1, 29: 3}
Did not match all atoms present	71701-29-6	CCC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCO)CCOCCC#N	{1: 2, 2: 7, 37: 1, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 20: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	71701-30-9	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4)C)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 3, 14: 19, 15: 2, 22: 1, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	71701-32-1	CCN(CCOC(=O)NC1=CC=CC=C1)C2=CC(=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)C)C	{1: 3, 2: 3, 33: 1, 6: 1, 7: 1, 14: 12, 37: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	71701-33-2	CC1=CC(=C(C(=C1)C)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OC5=CC=C(C=C5)C(C)(C)CC(C)(C)C)C	{1: 8, 2: 1, 4: 2, 14: 11, 22: 1, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	71712-04-4	CC(C1=CC=C(C=C1)OC)C2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)O	{1: 8, 3: 1, 4: 2, 14: 6, 21: 1, 22: 1}
Did not match all atoms present	71720-87-1	COC(=O)CCNC1=C2C(=C(C=C1)O)C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 2, 14: 6, 21: 1, 25: 2, 28: 1, 31: 1}
Did not match all atoms present	71720-90-6	C1=CC(=O)/C(=N\NC2=C(C=CC(=C2)NC3=C(C(=NC(=N3)Cl)Cl)Cl)S(=O)(=O)[O-])/C4=C(C=C(C=C41)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 35: 2, 14: 7, 15: 1, 17: 3, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	71720-91-7	C1=CC2=C(C=C1NC3=C(C(=NC(=N3)F)F)Cl)C=C(/C(=N\NC4=C(C=C5C=C(C=C(C5=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 1, 35: 2, 14: 8, 15: 2, 16: 2, 17: 1, 25: 1, 29: 12, 31: 2}
Did not match all atoms present	71720-92-8	C1=CC(=CC=C1NC2=CC(=NC(=N2)Cl)Cl)N=NC3=CC(=C4C=C(C=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 35: 2, 14: 9, 17: 2, 29: 9, 31: 1}
Did not match all atoms present	71720-93-9	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC3=CC(=NC(=N3)Cl)Cl)S(=O)(=O)[O-])C4=CC(=C(C=C4Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 1, 34: 2, 35: 3, 33: 1, 12: 1, 14: 6, 15: 1, 17: 4, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	71728-47-7	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC4=C3C=CC(=[N+]=N)C4=O	{1: 2, 34: 1, 4: 1, 14: 14, 15: 1, 22: 1, 25: 1, 29: 2, 36: 1}
Did not match all atoms present	7173-51-5	CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.[Cl-]	{1: 4, 2: 18, 17: 1}
Did not match all atoms present	7173-54-8	CCCCCCCCCCCC[N+](C)(CCCCCCCCCCCC)CCCCCCCCCCCC.[Cl-]	{1: 4, 2: 33, 17: 1}
Did not match all atoms present	7173-84-4	CCOP(=O)(OCC)SCSC1=CC=C(C=C1)Cl	{1: 2, 2: 3, 40: 2, 14: 4, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	71731-58-3	C[N@+]12CCCC[C@@H]1CCC(=C(C3=CC=CS3)C4=CC=CS4)C2.[Br-]	{1: 1, 7: 1, 41: 2, 11: 7, 12: 1, 14: 6, 15: 1, 18: 1}
Did not match all atoms present	71735-31-4	C1(=C(C(=C(C(=C1F)F)S(=O)(=O)O)F)F)F	{16: 5, 20: 1, 29: 2}
Did not match all atoms present	71735-54-1	[H+].[H+].[H+].[H+].CC1=NN(C(=C1N=NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N=NC4=C(C=C5C(=C4[O-])C=CC(=C5[O-])N=NC6=C(C7=C(C=C(C=C7C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])[O-])[O-])[O-])C8=CC=CC=C8.[Cu+2].[Cu+2].[Cu+2]	{1: 1, 34: 6, 35: 1, 33: 1, 14: 17, 29: 12}
Did not match all atoms present	71735-57-4	[H+].[H+].[H+].C1=CC(=C(C=C1S(=O)(=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=C(C(=NC(=N4)Cl)Cl)Cl)[O-])[O-].[Cu+2]	{34: 2, 35: 2, 14: 6, 17: 3, 29: 9, 31: 1}
Did not match all atoms present	71735-63-2	C1=CC(=CC(=C1)N=NC2=CC(=CC=C2)NC3=C(C(=NC(=N3)Cl)Cl)Cl)/C(=N/N=C/4\C=CC(=CC4=C([O-])[O-])S(=O)(=O)[O-])/N=NC5=CC(=CC(=C5[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{34: 6, 35: 2, 7: 2, 14: 13, 15: 3, 17: 3, 29: 9, 31: 1}
Did not match all atoms present	71735-64-3	COC1=C(C=C(C=C1N=NC2=CC(=C(C=C2)N=NC3=C(C4=C(C=C(C=C4C=C3S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])NC5=NC=NC=C5)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{1: 1, 34: 4, 35: 2, 14: 11, 22: 1, 29: 12, 31: 1}
Did not match all atoms present	71735-68-7	C1=CC=NC(=C1)CNCCO.OS(=O)(=O)O	{2: 3, 35: 1, 14: 4, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	71735-71-2	S(Br)(Br)(Br)(Br)(Br)Br	{18: 6}
Did not match all atoms present	71735-75-6	COC1=NC(=NC(=N1)CNC2=CC3=C(C=C2)C(=O)/C(=N\NC4=CC=CC=C4S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 1, 2: 1, 35: 3, 34: 1, 14: 8, 15: 2, 17: 1, 22: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	71745-63-6	CCC(C)(C)C1=CC(=C(C=C1)O)C	{1: 4, 2: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	7175-74-8	[2H]C([2H])([2H])S	{1: 1, 39: 1}
Did not match all atoms present	71750-84-0	CC1=C(C=CC(=C1)NC2=C(C(=NC(=N2)Cl)Cl)Cl)N=NC3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)N=NC5C(=NN(C5=O)C6=C(C=CC(=C6)S(=O)(=O)O)S(=O)(=O)O)C)S(=O)(=O)O	{1: 2, 34: 4, 35: 3, 33: 1, 12: 1, 14: 13, 15: 1, 17: 3, 20: 3, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	71757-14-7	C1=C(C=C(C(=C1Br)N)C(F)(F)F)Br	{16: 3, 18: 2, 4: 1, 30: 1, 14: 2}
Did not match all atoms present	71767-17-4	CCN(CC)C1=CC=C(C=C1)C=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)N=CC4=CC=C(C=C4)N(CC)CC	{1: 4, 2: 4, 6: 2, 33: 2, 34: 4, 14: 16}
Did not match all atoms present	7177-45-9	C[C@@H]([C@@H](C1=CC=CC=C1)O)NC.CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C	{1: 4, 2: 1, 3: 2, 33: 1, 41: 1, 12: 3, 13: 1, 14: 10, 20: 1, 24: 1, 25: 1, 27: 1, 31: 2}
Did not match all atoms present	71771-37-4	C1CN2CCN3P2(=O)N1CC3	{33: 3, 11: 6, 29: 1}
Did not match all atoms present	71771-38-5	C1CN2CCN3P2(=S)N1CC3	{33: 3, 11: 6}
Did not match all atoms present	71771-39-6	C1CN2CCN3P2(=[Se])N1CC3	{33: 3, 11: 6}
Did not match all atoms present	71771-90-9	COC1=C(C=C(C=C1)CCNC[C@H](C2=CC=C(C=C2)O)O)OC	{1: 2, 2: 3, 3: 1, 14: 7, 20: 1, 21: 1, 22: 2, 31: 1}
Did not match all atoms present	71779-89-0	CC1=C2CCC3=C(C(=C(CCC(=C1C)C=C2)C=C3)C)C	{1: 4, 11: 4, 14: 4}
Did not match all atoms present	71786-27-1	C1=CC2=C(C=C(C=C2C=C1NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{31: 1, 21: 2, 14: 10, 29: 6}
Did not match all atoms present	71786-42-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl.C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)N)N.C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C(=CC=C3)Cl	{17: 3, 30: 2, 14: 19, 25: 6}
Did not match all atoms present	71786-62-4	CCCCCCCC/C=C\CCCCCCCCOP(=S)(SCCCCCCCC/C=C\CCCCCCCC)[O-].CCCCCCCC/C=C\CCCCCCCCOP(=S)(SCCCCCCCC/C=C\CCCCCCCC)[O-].[Zn+2]	{1: 4, 2: 60, 6: 8, 40: 2, 22: 2, 29: 2}
Did not match all atoms present	71786-64-6	B(O)(O)O.CCCCCCCC/C=C\CCCCCCCCNCCCN	{1: 1, 2: 18, 6: 2, 20: 3, 30: 1, 31: 1}
Did not match all atoms present	71786-65-7	CC\1=C(C(=O)NC(=O)/C1=C\NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C#N	{32: 1, 1: 1, 37: 1, 6: 1, 14: 7, 15: 3, 25: 4, 31: 1}
Did not match all atoms present	71786-66-8	CC1=C(C(=O)NC(=O)C1=CNC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=CC=C5)C#N	{32: 1, 1: 1, 37: 1, 6: 1, 14: 11, 15: 3, 24: 1, 25: 4, 31: 2}
Did not match all atoms present	71786-67-9	CN(CC1=CC=CC=C1)CC(=O)C2=CC(=CC=C2)O.Cl	{1: 1, 2: 2, 33: 1, 14: 9, 17: 1, 21: 1, 24: 1}
Did not match all atoms present	71786-68-0	CCCCCCCCCCCCCCCCCCP(=O)(OC)OC.CCCCCCCC/C=C\CCCCCCCCN	{1: 4, 2: 32, 6: 2, 22: 2, 29: 1, 30: 1}
Did not match all atoms present	71789-10-1	C[Si](C)(C)C#CCC#C	{1: 3, 2: 1, 10: 3, 9: 1}
Did not match all atoms present	71793-51-6	COC1=C(C=C(C=C1)[N+](=O)[O-])N=C=S	{1: 1, 34: 1, 38: 1, 8: 1, 14: 3, 22: 1}
Did not match all atoms present	71799-69-4	CCN(CC)C1=CC(=C(C=C1)[C@@]2(C3=C(C=CC(=C3)C(=O)O)C(=O)O2)C4=C(C=CC(=C4)NC5=CC=CC=C5)OCC)O	{1: 3, 2: 3, 33: 1, 13: 1, 14: 14, 21: 1, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71799-70-7	CCN(CC)C1=CC(=C(C=C1)[C@@]2(C3=C(C=C(C=C3)C(=O)O)C(=O)O2)C4=C(C=CC(=C4)NC5=CC=CC=C5)OCC)O	{1: 3, 2: 3, 33: 1, 13: 1, 14: 14, 21: 1, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71799-71-8	CCN(CC)C1=CC2=C(C=C1)[C@]3(C4=C(C=CC(=C4)C(=O)O)C(=O)O3)C5=C(O2)C=CC(=C5)NC6=CC=CC=C6	{1: 2, 2: 2, 33: 1, 13: 1, 14: 14, 23: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71799-72-9	CCN(CC)C1=CC2=C(C=C1)[C@]3(C4=C(C=C(C=C4)C(=O)O)C(=O)O3)C5=C(O2)C=CC(=C5)NC6=CC=CC=C6	{1: 2, 2: 2, 33: 1, 13: 1, 14: 14, 23: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71799-73-0	CCN(CC)C1=CC2=C(C=C1)[C@]3(C4=C(C=CC(=C4)C(=O)OCC)C(=O)O3)C5=C(O2)C=CC(=C5)NC6=CC=CC=C6	{1: 3, 2: 3, 33: 1, 13: 1, 14: 14, 23: 1, 28: 2, 31: 1}
Did not match all atoms present	71799-75-2	CCOC1=CC=C(C=C1)C2=CC(=C3C(=C2N)C(=O)C4=C(C=CC(=C4C3=O)N)O)O	{1: 1, 2: 1, 14: 7, 21: 2, 22: 1, 25: 2, 30: 2}
Did not match all atoms present	71799-92-3	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)O)O.[Mn+2]	{24: 2, 20: 1, 2: 2, 27: 1, 4: 1}
Did not match all atoms present	71799-98-9	CN(C(=O)OCC1=NC(=CC=C1)COC(=O)N(C)N=O)N=O	{1: 2, 2: 2, 35: 1, 33: 2, 34: 2, 14: 3, 28: 2, 29: 2}
Did not match all atoms present	718-36-5	CC(C)(C)N=CC1=CC=C(C=C1)[N+](=O)[O-]	{1: 3, 34: 1, 4: 1, 6: 1, 38: 1, 14: 4}
Did not match all atoms present	718-64-9	C1=CC=C(C=C1)C(C(F)(F)F)(C(F)(F)F)O	{16: 6, 20: 1, 4: 3, 14: 5}
Did not match all atoms present	71808-64-5	CO[Si](CCCOCC1CO1)(CCCCl)OC	{1: 2, 2: 7, 11: 1, 12: 1, 17: 1, 22: 3, 23: 1}
Did not match all atoms present	71808-65-6	CCCCCCCCCCCCCCCCCC[Si](C)(C)OC	{1: 4, 2: 17, 22: 1}
Did not match all atoms present	71808-66-7	C(C[Si](CC[Si](Cl)(Cl)Cl)(CC[Si](Cl)(Cl)Cl)CC[Si](Cl)(Cl)Cl)[Si](CC[Si](Cl)(Cl)Cl)(CC[Si](Cl)(Cl)Cl)CC[Si](Cl)(Cl)Cl	{17: 18, 2: 14}
Did not match all atoms present	71808-67-8	CO[Si](CCCN(CCN(C(=O)[O-])C(=O)[O-])C(=O)[O-])(OC)OC.[Na+].[Na+].[Na+]	{24: 3, 1: 3, 2: 5, 22: 3, 33: 2}
Did not match all atoms present	71808-72-5	CCCCOC(=O)C=C.CC(=O)OC=C.COC(=O)/C=C\C(=O)[O-].[NH4+].[Na]	{1: 3, 2: 3, 5: 2, 6: 4, 24: 1, 28: 3}
Did not match all atoms present	7182-99-2	CCOC(=O)C1=CC=C(C=C1)N=CC2=CC=CC=C2	{1: 1, 2: 1, 6: 1, 34: 1, 14: 9, 28: 1}
Did not match all atoms present	71820-28-5	CCCCCCC(=O)OCC(CO)(CO)COP(=O)(OCCCC)OCCCC	{1: 3, 2: 15, 4: 1, 20: 2, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	71820-46-7	CCCCCC/C=C/C1=CC=C(C=C1)OC	{1: 2, 2: 5, 22: 1, 14: 4, 6: 2}
Did not match all atoms present	71820-49-0	CCCC(=O)C(=CC1=CC=CC=C1)CC	{1: 2, 2: 3, 6: 1, 7: 1, 14: 5, 24: 1}
Did not match all atoms present	71829-80-6	C/C=C/C1C(C(=O)OC1=O)/C(=C(/C)\C=C\C)/C=C/C.CC1=CC=CC2=NNN=C12	{32: 1, 1: 5, 35: 2, 6: 6, 7: 2, 12: 2, 14: 3, 28: 2}
Did not match all atoms present	71832-33-2	CCN(C1=C(C=CC(=C1)N=C=O)C)C(=O)Cl	{1: 2, 2: 1, 33: 1, 8: 1, 34: 1, 14: 3, 17: 1, 24: 1, 29: 1}
Did not match all atoms present	71832-61-6	CCN(CC)C1=CC2=C(C=C1)[C@]3(C4=C(C=C(C=C4)C(=O)OCC)C(=O)O3)C5=C(O2)C=CC(=C5)NC6=CC=CC=C6	{1: 3, 2: 3, 33: 1, 13: 1, 14: 14, 23: 1, 28: 2, 31: 1}
Did not match all atoms present	71832-64-9	CC1CCC(CC1)C(=C)C.C=O.C1=CC=C(C=C1)O	{1: 2, 5: 2, 7: 1, 11: 4, 12: 2, 14: 5, 21: 1}
Did not match all atoms present	71832-69-4	CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C5C(=O)C6=CC=CC=C6C5=O)S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 6, 35: 2, 33: 1, 41: 1, 12: 1, 14: 11, 20: 4, 25: 2, 29: 2}
Did not match all atoms present	71832-70-7	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)NC(=O)OCCOCCOC(=O)NC3=CC=C(C=C3)CC4=CC=C(C=C4)N=C=O	{2: 6, 8: 2, 34: 2, 14: 16, 22: 1, 28: 2, 29: 2, 31: 2}
Did not match all atoms present	71832-72-9	CCNC1=C2C(=O)/C(=N/NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N/N=C\5/C(=O)C6=C(C=C(C=C6C=C5S(=O)(=O)O)S(=O)(=O)O)NCC)S(=O)(=O)O)S(=O)(=O)O)/C(=CC2=CC(=C1)S(=O)(=O)O)S(=O)(=O)O.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO	{1: 2, 2: 38, 6: 2, 33: 6, 34: 2, 14: 12, 15: 4, 20: 24, 25: 2, 29: 12, 31: 4}
Did not match all atoms present	71832-73-0	CCCCCCCCC=CCCCCCCCC(=O)N(C)CC(=O)[O-].[NH4+]	{24: 2, 1: 2, 2: 15, 6: 2, 33: 1}
Did not match all atoms present	71832-75-2	CC(C)CCCCCCC[O-].CC(C)CCCCCCC[O-].CC(C)CCCCCCC[O-].CC(C)CCCCCCC[O-].[Ti+4]	{1: 8, 2: 28, 3: 4, 29: 4}
Did not match all atoms present	71832-80-9	CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O.C=O.C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)[O-].[Na+]	{1: 1, 2: 11, 5: 1, 14: 11, 20: 1, 29: 5}
Did not match all atoms present	71832-82-1	C1=CC=C\2C(=C1)C=CC(=O)/C2=C\3/N/C(=C/4\C(=O)C=CC5=CC=CC=C54)/N=C(N3)C6=C7C=CC8=CC=CC9=C8C7=C(C=C9)C=C6	{32: 2, 25: 2, 35: 1, 14: 21, 15: 5}
Did not match all atoms present	71832-84-3	CC1=C(C=C(C=C1)C(=O)OC(C)C)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC(=C(C=C4C)NC(=O)C5=CC6=CC=CC=C6/C(=N/NC7=C(C=CC(=C7)C(=O)OC(C)C)C)/C5=O)Cl	{1: 7, 34: 2, 3: 2, 14: 18, 15: 4, 17: 1, 24: 2, 25: 2, 28: 2, 31: 4}
Did not match all atoms present	71836-03-8	CN(SSN(C)S(=O)C1=CC=CC=C1)S(=O)C2=CC=CC=C2	{40: 2, 1: 2, 29: 2, 14: 10, 33: 2}
Did not match all atoms present	71838-68-1	CC1=CC(=CC(=C1N)[S-])N.CC1=C(C(=CC(=C1N)SC2=C(C=CC(=C2)NC=O)N=C[O-])N)S.[Na+].[Na+]	{1: 2, 34: 1, 6: 1, 39: 1, 40: 1, 14: 6, 26: 1, 30: 4, 31: 1}
Did not match all atoms present	71839-05-9	C1=CC=C2C(=C1)C3=C4C(=C2COS(=O)(=O)O)C=CC5=CC=CC(=C54)C=C3	{2: 1, 20: 1, 22: 1, 14: 11, 29: 2}
Did not match all atoms present	71839-42-4	B(O)(O)O.CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\CCCCCCCC)(COC(=O)CCCCCCC/C=C/CCCCCCCC)CO	{1: 3, 2: 46, 4: 1, 6: 6, 20: 4, 28: 3}
Did not match all atoms present	71839-43-5	B(O)(O)OCCCCCCCC/C=C\CCCCCCCC	{1: 1, 2: 15, 20: 2, 22: 1, 6: 2}
Did not match all atoms present	71839-46-8	CCCCCCCCCCCCCCCCCC(=O)OCCO.C1=CC(=CC=C1C(=O)O)C(=O)O.C(C(CO)(CO)CO)O	{1: 1, 2: 22, 4: 1, 14: 4, 20: 5, 27: 2, 28: 1}
Did not match all atoms present	71839-74-2	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC(C)C)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC(C)C)[O-])[O-])C3=CC=CC=C3.CC(C)N.[Co+3]	{1: 8, 34: 4, 3: 3, 33: 2, 14: 16, 35: 2, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	71839-76-4	[H+].CC(C)N.CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)NC)[O-].CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)NC)[O-].[Co+3]	{1: 6, 34: 4, 3: 1, 14: 16, 24: 2, 29: 4, 30: 1, 31: 4}
Did not match all atoms present	71839-79-7	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=C(C=C3)Cl.C(CCCN)CCN.[Cr+3]	{1: 2, 2: 6, 35: 2, 33: 2, 34: 4, 14: 14, 17: 2, 29: 4, 30: 4}
Did not match all atoms present	71840-26-1	CCOP(=O)(C)OCCN(C(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 33: 1, 22: 2, 29: 1}
Did not match all atoms present	71850-58-3	CCN(CC)C1=CC2=C(C(=C1)OCC)N=C3C=CC(=[N+](CC)CC)C=C3O2.CS(=O)(=O)[O-]	{1: 6, 2: 5, 35: 1, 33: 2, 14: 5, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	71850-61-8	CC1=CC(=C(C(=C1NC2=C3C(=C(C=C2)NC4=C(C(=C(C=C4C)C)S(=O)(=O)NC5=CC=CC=C5)C)C(=O)C6=CC=CC=C6C3=O)C)S(=O)(=O)NC7=CC=CC=C7)C	{1: 6, 31: 4, 29: 4, 14: 18, 25: 2}
Did not match all atoms present	71850-71-0	CCCCOC(=O)/C=C/C(=O)O[Sb](OCCCC)OCCCC	{1: 3, 2: 9, 28: 2, 22: 2, 6: 2}
Did not match all atoms present	71850-72-1	CCCCOC(=O)/C=C/C(=O)O[Sb](OC(=O)/C=C/C(=O)OCCCC)OC(=O)/C=C/C(=O)OCCCC	{1: 3, 2: 9, 28: 6, 6: 6}
Did not match all atoms present	71850-73-2	CCOCC1=CC=C(C=C1)C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 2: 2, 22: 1, 14: 9}
Did not match all atoms present	71850-77-6	CC1=CC(=C(C(=C1[N+](=O)[O-])C)[N+](=O)[O-])C(C)(C)C	{1: 5, 4: 1, 38: 2, 14: 1}
Did not match all atoms present	71850-79-8	CC1=C(C=C(C(=C1)OC)C(C)(C)C)[N+](=O)[O-]	{1: 5, 38: 1, 4: 1, 22: 1, 14: 2}
Did not match all atoms present	71850-81-2	CCCCCC[C@@H](C/C=C/CCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)O)O	{1: 3, 2: 17, 3: 1, 6: 2, 20: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	71850-82-3	COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N.[Na+]	{1: 1, 34: 2, 14: 7, 22: 1, 29: 3, 30: 1}
Did not match all atoms present	71850-83-4	COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)[O-])NC(=O)NC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 2, 34: 4, 14: 14, 22: 2, 24: 1, 29: 6, 31: 2}
Did not match all atoms present	71850-84-5	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])OC)NC(=O)NC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 3, 34: 4, 14: 13, 22: 2, 24: 1, 29: 6, 31: 2}
Did not match all atoms present	71850-85-6	CC1=NC(=NC=C1)C(=O)C	{24: 1, 1: 2, 35: 2, 14: 2}
Did not match all atoms present	71850-86-7	CC(CCCCCOC(=O)/C=C\C(=O)O[Sb](OC(=O)/C=C\C(=O)OCCCCCC(C)C)OCCCCCC(C)C)C	{1: 6, 2: 15, 3: 3, 6: 4, 22: 1, 28: 4}
Did not match all atoms present	71850-88-9	CC(C)CCCCCOC(=O)/C=C\C(=O)O[Sb](OCCCCCC(C)C)OCCCCCC(C)C	{1: 6, 2: 15, 3: 3, 6: 2, 22: 2, 28: 2}
Did not match all atoms present	71859-30-8	C1=C(C(=CC(=C1Cl)Cl)Cl)OC2=CC(=C(C=C2Cl)Cl)Cl	{17: 6, 22: 1, 14: 4}
Did not match all atoms present	7187-01-1	C1=COC(=C1)/C=C/C#N	{37: 1, 14: 3, 6: 2, 23: 1}
Did not match all atoms present	7187-55-5	CCN\1C2=CC=CC=C2S/C1=C/C=C/C=C/C3=[N+](C4=CC=CC=C4S3)CC	{1: 2, 2: 2, 6: 5, 33: 2, 41: 2, 14: 8, 15: 1}
Did not match all atoms present	71873-42-2	CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=C(C=C3)N=NC4C(=NN(C4=O)C5=CC(=C(C=C5Cl)S(=O)(=O)[O-])Cl)C.[Na+]	{1: 2, 2: 1, 35: 1, 33: 2, 12: 1, 34: 2, 14: 15, 15: 1, 17: 2, 25: 1, 29: 5}
Did not match all atoms present	71873-48-8	CC(=O)NC1=CC2=C(C=C1)C=C(/C(=N/NC3=CC=C(C4=CC=CC=C43)N=NC5=C6C=C(C=CC6=C(C=C5)N=NC7=CC8=C(C=C(C=C8C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 5, 14: 20, 15: 2, 24: 1, 25: 1, 29: 12, 31: 2}
Did not match all atoms present	71873-52-4	CCOCCOC(=O)NC1=CC=CC2=C1/C(=N/NC3=C(C=CC(=C3)S(=O)(=O)NC4=CC=CC=C4S(=O)(=O)O)O)/C(=O)C=C2	{1: 1, 2: 3, 34: 1, 14: 12, 15: 1, 20: 1, 21: 1, 22: 1, 25: 1, 28: 1, 29: 4, 31: 3}
Did not match all atoms present	71873-53-5	CCOC(=O)NC1=CC=CC2=C1/C(=N/NC3=CC(=CC(=C3O)S(=O)(=O)[O-])[N+](=O)[O-])/C(=O)C=C2.[Na+]	{1: 1, 2: 1, 38: 1, 34: 1, 14: 7, 15: 1, 21: 1, 25: 1, 28: 1, 29: 3, 31: 2}
Did not match all atoms present	71873-55-7	CCN(CC[N+](C)(C)C)C1=CC(=C(C=C1)N=NC2=NC(=NS2)C3=CC=CC=C3)C.[O-]S(=O)(=O)[O-]	{1: 5, 2: 3, 35: 2, 33: 1, 41: 1, 34: 2, 14: 8, 29: 4}
Did not match all atoms present	71876-31-8	CNC1=C2C(=C(C=C1)O)C(=O)C3=C(C=CC(=C3C2=O)O)N(C)C	{1: 3, 33: 1, 14: 4, 21: 2, 25: 2, 31: 1}
Did not match all atoms present	71878-19-8	CC1(CC(CC(N1)(C)C)NCCCCCCN(C2CC(NC(C2)(C)C)(C)C)C3=NC=NC(=N3)NC(C)(C)CC(C)(C)C)C	{32: 2, 1: 13, 2: 7, 35: 3, 4: 2, 33: 1, 11: 4, 12: 2, 13: 4, 14: 1, 31: 2}
Did not match all atoms present	7188-38-7	CC(C)(C)[N+]#[C-]	{1: 3, 34: 1, 4: 1}
Did not match all atoms present	71880-02-9	C1=CC=C(C=C1)SC[N+]2=CC=CC=C2	{40: 1, 33: 1, 2: 1, 14: 10}
Did not match all atoms present	71888-82-9	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=C5C(=CC(=C4)S(=O)(=O)O)C=C(C=C5O)S(=O)(=O)O)C=CC=C3S(=O)(=O)O.C(=N)(N)N.C(=N)(N)N.C(=N)(N)N	{34: 2, 36: 3, 7: 3, 14: 14, 20: 3, 21: 1, 29: 6, 30: 6, 31: 1}
Did not match all atoms present	71888-90-9	CC[C@H](C)CCOC(=O)C1=CC=CC=C1C(=O)O	{1: 2, 2: 3, 3: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	71888-97-6	CCO[Si](CCCN)(OCC)OCC.O=[Si]=O	{1: 3, 2: 6, 30: 1, 29: 2, 22: 3}
Did not match all atoms present	71889-06-0	C1CCC(CC1)NC2=C3C(=C(C=C2)NCCC(=O)NC4=CC=CC=C4S(=O)(=O)[O-])C(=O)C5=CC=CC=C5C3=O.[Na+]	{2: 2, 11: 5, 12: 1, 14: 10, 24: 1, 25: 2, 29: 3, 31: 3}
Did not match all atoms present	71889-07-1	CCCC[C@@H](CC)COP(=S)(OC[C@@H](CC)CCCC)SSC(Cl)(Cl)Cl	{1: 4, 2: 10, 3: 2, 4: 1, 40: 2, 17: 3, 22: 2}
Did not match all atoms present	71889-08-2	CCCCCCCCCCCCCCCCCCCO[P+](=O)OCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 36, 29: 1, 22: 2}
Did not match all atoms present	71889-10-6	CCCCCCCCCCCCN(C)C.CCCCOP(=S)(OCCCC)S	{1: 5, 2: 17, 39: 1, 22: 2, 33: 1}
Did not match all atoms present	71889-11-7	CCC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OCCOC)N(CC)CC	{1: 4, 2: 5, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	71889-12-8	CCN(CC)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OCCOC	{1: 4, 2: 4, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	71889-13-9	C1=CC(=CC(=C1)[N+](=O)[O-])N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 2, 38: 1, 34: 3, 14: 10, 15: 2, 22: 1, 25: 1, 29: 11, 30: 1, 31: 1}
Did not match all atoms present	71889-14-0	CCC(C)(C)C1=CC(=C(C=C1)O)C2CCCCC2	{1: 3, 2: 1, 4: 1, 11: 5, 12: 1, 14: 3, 21: 1}
Did not match all atoms present	71889-15-1	CC1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)CC(C)(C)C)O	{1: 9, 2: 1, 4: 3, 21: 1, 14: 2}
Did not match all atoms present	71889-21-9	[H+].[H+].[H+].CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC=CC=C4.CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC=CC=C4.C(CCCN)CCN.[Cr+3]	{1: 2, 2: 6, 35: 2, 33: 2, 34: 4, 14: 20, 29: 6, 30: 2}
Did not match all atoms present	7189-41-5	C1=CC=C(C=C1)C2=C(N(C(=N2)C3=CC=CC=C3)C4(N=C(C(=N4)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8	{33: 1, 35: 3, 13: 1, 14: 30, 15: 2}
Did not match all atoms present	71897-24-0	CC1=CC=C(C=C1)C[N+]2=CC=CC=C2	{1: 1, 2: 1, 14: 9, 33: 1}
Did not match all atoms present	71897-27-3	C1=CC=[N+](C=C1)CC2=CC=C(C=C2)Cl	{17: 1, 2: 1, 14: 9, 33: 1}
Did not match all atoms present	719-03-9	CC(C)(C)CC(C)(C)C1=C(C=CC(=C1)O)O	{1: 5, 2: 1, 4: 2, 21: 2, 14: 3}
Did not match all atoms present	719-32-4	C1(=C(C(=C(C(=C1Cl)Cl)C(=O)Cl)Cl)Cl)C(=O)Cl	{24: 2, 17: 6}
Did not match all atoms present	719-38-0	C(#N)C(C#N)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 3: 1, 37: 2}
Did not match all atoms present	719-54-0	CN1C2=CC=CC=C2C(=O)C3=CC=CC=C31	{1: 1, 33: 1, 14: 8, 25: 1}
Did not match all atoms present	719-59-5	C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)N	{24: 1, 17: 1, 30: 1, 14: 8}
Did not match all atoms present	719-79-9	CCCC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 2, 3: 1, 14: 10}
Did not match all atoms present	719-80-2	CCOP(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 10}
Did not match all atoms present	71902-07-3	CC1=CC(=C(C=C1N=NC2=CC(=C(C(=C2)C(=O)[O-])[O-])S(=O)(=O)[O-])OC)N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)N/N=C/7\C=CC(=O)C(=C7)C(=O)O)NC8=CC=CC=C8)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 35: 3, 14: 19, 15: 4, 22: 1, 24: 1, 25: 2, 27: 1, 29: 9, 31: 5}
Did not match all atoms present	71902-24-4	CC1=C(C=CC(=C1)O)C2CCCCC2	{1: 1, 11: 5, 12: 1, 21: 1, 14: 3}
Did not match all atoms present	71902-28-8	[H+].CC1=NN(C(=C1N=NC2=CC(=C(C=C2[O-])S(=O)(=O)N)Cl)[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=CC(=C(C=C2[O-])S(=O)(=O)N)Cl)[O-])C3=CC=CC=C3.C(CCCN)CCN.[Cr+3]	{1: 2, 2: 6, 35: 2, 33: 2, 34: 4, 14: 14, 17: 2, 29: 4, 30: 4}
Did not match all atoms present	71906-42-8	COC1=CC2=C(C=C1)C3CC2C=C3C#N	{1: 1, 37: 1, 11: 1, 12: 2, 14: 4, 15: 1, 22: 1}
Did not match all atoms present	71906-48-4	COC1=CC=CC2=C1C3CC2C=C3C#N	{1: 1, 37: 1, 11: 1, 12: 2, 14: 4, 15: 1, 22: 1}
Did not match all atoms present	71906-50-8	COC1=CC=CC2=C1C3CC2C(=C3)C#N	{1: 1, 37: 1, 11: 1, 12: 2, 14: 4, 15: 1, 22: 1}
Did not match all atoms present	71906-57-5	C1C2C=C(C1C3=CC=CC=C23)C#N	{11: 1, 12: 2, 37: 1, 14: 5, 15: 1}
Did not match all atoms present	7191-35-7	CC1CS[Sn]2(S1)SCC(S2)C	{1: 2, 11: 2, 12: 2, 41: 4}
Did not match all atoms present	71925-30-9	C1C2C=C(C1C3=C2C=C(C=C3)C#N)C#N	{11: 1, 12: 2, 37: 2, 14: 4, 15: 1}
Did not match all atoms present	71925-31-0	C1C2C=C(C1C3=C2C=CC(=C3)C#N)C#N	{11: 1, 12: 2, 37: 2, 14: 4, 15: 1}
Did not match all atoms present	71925-32-1	C1C2C=C(C1C3=CC=CC(=C23)C#N)C#N	{11: 1, 12: 2, 37: 2, 14: 4, 15: 1}
Did not match all atoms present	71925-33-2	C1C2C=C(C1C3=C(C=CC=C23)C#N)C#N	{11: 1, 12: 2, 37: 2, 14: 4, 15: 1}
Did not match all atoms present	7194-19-6	CC1=CC(=NO1)C2=CC=C(O2)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 3, 23: 2}
Did not match all atoms present	71949-29-6	C1=CC(=CC=C1C(=O)O)C(=O)OCCO	{28: 1, 2: 2, 27: 1, 20: 1, 14: 4}
Did not match all atoms present	7195-27-9	CC1(CCCO1)CN(C)S(=O)(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N	{1: 2, 2: 1, 33: 1, 11: 3, 13: 1, 14: 3, 17: 1, 23: 1, 29: 4, 30: 1}
Did not match all atoms present	71964-72-2	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=CC(=C3O)O	{1: 2, 21: 2, 14: 8}
Did not match all atoms present	71965-16-7	CCCCCCCCCCCCC[O-].CCCCCCCCCCCCC[O-].CCCCCCCCCCCCC[O-].CCCCCCCCCCCCC[O-].[Ti+4]	{1: 4, 2: 48, 29: 4}
Did not match all atoms present	71965-23-6	CCCCCCCCCCCCCOP(=O)(O)O.CC1CO1.C1CO1	{1: 2, 2: 12, 11: 3, 12: 1, 20: 2, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	71965-24-7	CCCCCCCCCCCCCOP(=O)([O-])[O-].CC1CO1.C1CO1.[K+].[K+]	{1: 2, 2: 12, 11: 3, 12: 1, 22: 1, 23: 2, 29: 3}
Did not match all atoms present	71965-25-8	CC1=C(C=CC(=C1)[C@H]2C[C@@H]3CC[C@]2(C3(C)C)C)O	{1: 4, 11: 3, 12: 2, 13: 2, 14: 3, 21: 1}
Did not match all atoms present	7197-96-8	C1CCC2=C(CC1)N=CC=C2	{35: 1, 11: 5, 14: 3}
Did not match all atoms present	71977-49-6	CCCCCCC1=CC=C(C=C1)C=NNCC2=CC=C(C=C2)CCC	{1: 2, 2: 8, 6: 1, 34: 1, 14: 8, 31: 1}
Did not match all atoms present	71977-87-2	CC(=C)C(=O)OCC1CO1.C=CC1=CC(=CC=C1)Cl	{1: 1, 2: 1, 5: 2, 6: 1, 7: 1, 11: 1, 12: 1, 14: 4, 17: 1, 23: 1, 28: 1}
Did not match all atoms present	71982-66-6	CCCCCCCCCCCCCCSCCC(=O)OC1=C(C=C(C(=C1)C)SC2=CC(=C(C=C2C)OC(=O)CCSCCCCCCCCCCCCCC)C(C)(C)C)C(C)(C)C	{1: 10, 2: 30, 4: 2, 40: 3, 14: 4, 28: 2}
Did not match all atoms present	71989-14-5	CC(C)(C)OC(=O)C[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 3, 2: 2, 3: 1, 4: 1, 12: 1, 14: 8, 27: 1, 28: 2, 31: 1}
Did not match all atoms present	71989-16-7	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC(=O)N)C(=O)O	{2: 2, 3: 1, 12: 1, 14: 8, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	71989-20-3	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCC(=O)N)C(=O)O	{2: 3, 3: 1, 12: 1, 14: 8, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	71989-23-6	CC[C@H](C)[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 2, 2: 2, 3: 2, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71989-26-9	CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 3, 2: 5, 3: 1, 4: 1, 12: 1, 14: 8, 27: 1, 28: 2, 31: 2}
Did not match all atoms present	71989-28-1	CSCC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 1, 2: 3, 3: 1, 40: 1, 12: 1, 14: 8, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71989-31-6	C1C[C@H](N(C1)C(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(=O)O	{33: 1, 2: 1, 11: 3, 12: 2, 14: 8, 27: 1, 28: 1}
Did not match all atoms present	71989-33-8	CC(C)(C)OC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13	{1: 3, 2: 2, 3: 1, 4: 1, 12: 1, 14: 8, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71989-35-0	C[C@H]([C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)OC(C)(C)C	{1: 4, 2: 1, 3: 2, 4: 1, 12: 1, 14: 8, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	71989-96-3	COC1=C(C(=C(C=C1)CO)OC)OC	{1: 3, 2: 1, 20: 1, 22: 3, 14: 2}
Did not match all atoms present	7199-29-3	C1CC2=CC=CC=C2C(C3=CC=CC=C31)C(=O)N	{24: 1, 11: 2, 12: 1, 30: 1, 14: 8}
Did not match all atoms present	71990-00-6	CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CC(C)CC	{1: 3, 2: 8, 3: 1, 28: 1, 14: 12}
Did not match all atoms present	72-00-4	CCOP(=O)(OCC)OC=C(Cl)Cl	{1: 2, 2: 2, 6: 1, 7: 1, 17: 2, 22: 3, 29: 1}
Did not match all atoms present	72-03-7	CCC(=O)[O-]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	72-14-0	C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CS2	{35: 1, 41: 1, 14: 6, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	72-17-3	CC(C(=O)[O-])O.[Na+]	{24: 1, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	72-33-3	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)OC	{1: 2, 9: 1, 10: 1, 11: 6, 12: 3, 13: 2, 14: 3, 20: 1, 22: 1}
Did not match all atoms present	72-40-2	C1=NC(=C(N1)C(=O)N)N.Cl	{32: 1, 35: 1, 14: 1, 17: 1, 24: 1, 30: 2}
Did not match all atoms present	72-43-5	COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)C(Cl)(Cl)Cl	{1: 2, 3: 1, 4: 1, 14: 8, 17: 3, 22: 2}
Did not match all atoms present	72-44-6	CC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)C	{1: 2, 35: 1, 33: 1, 14: 8, 25: 1}
Did not match all atoms present	72-48-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)O	{25: 2, 21: 2, 14: 6}
Did not match all atoms present	72-54-8	C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C(Cl)Cl)Cl	{17: 4, 3: 2, 14: 8}
Did not match all atoms present	72-55-9	C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)Cl)Cl	{17: 4, 14: 8, 7: 2}
Did not match all atoms present	72-56-0	CCC1=CC=C(C=C1)C(C2=CC=C(C=C2)CC)C(Cl)Cl	{1: 2, 2: 2, 3: 2, 14: 8, 17: 2}
Did not match all atoms present	72-57-1	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C\3/C(=O)C4=C(C=C(C=C4C=C3S(=O)(=O)O)S(=O)(=O)O)N)C)N/N=C\5/C(=O)C6=C(C=C(C=C6C=C5S(=O)(=O)O)S(=O)(=O)O)N	{1: 2, 34: 2, 14: 12, 15: 4, 20: 4, 25: 2, 29: 8, 30: 2, 31: 2}
Did not match all atoms present	72-69-5	CNCCC=C1C2=CC=CC=C2CCC3=CC=CC=C31	{1: 1, 2: 2, 6: 1, 11: 2, 14: 8, 15: 1, 31: 1}
Did not match all atoms present	72-80-0	CC1=NC2=C(C=C1)C(=CC(=C2O)Cl)Cl	{1: 1, 35: 1, 21: 1, 14: 3, 17: 2}
Did not match all atoms present	720-44-5	COC1=CC=C(C=C1)C(C2=CC=CC=C2)O	{1: 1, 3: 1, 20: 1, 22: 1, 14: 9}
Did not match all atoms present	720-69-4	C1=C(OC(=C1)[N+](=O)[O-])C2=NC(=NC(=N2)N)N	{38: 1, 35: 3, 30: 2, 14: 2, 23: 1}
Did not match all atoms present	720-75-2	COC(=O)C1=CC=C(C=C1)C2=CC=CC=C2	{1: 1, 28: 1, 14: 9}
Did not match all atoms present	72010-26-5	CCCCCC1=CC=C(C=C1)C=NNCC2=CC=C(C=C2)CCC	{1: 2, 2: 7, 6: 1, 34: 1, 14: 8, 31: 1}
Did not match all atoms present	72010-27-6	CCCCCCC1=CC=C(C=C1)CNN=CC2=CC=C(C=C2)CCCC	{1: 2, 2: 9, 6: 1, 34: 1, 14: 8, 31: 1}
Did not match all atoms present	72010-28-7	CCCCCCCCC1=CC=C(C=C1)CNN=CC2=CC=C(C=C2)C	{1: 2, 2: 8, 6: 1, 34: 1, 14: 8, 31: 1}
Did not match all atoms present	72010-29-8	CCCCCCCCC1=CC=C(C=C1)C=NNCC2=CC=C(C=C2)CCC	{1: 2, 2: 10, 6: 1, 34: 1, 14: 8, 31: 1}
Did not match all atoms present	72010-87-8	CCCCOCCN(CCOCCCC)C1=CC(=C(C=C1)N=NC2=NC=C(S2)[N+](=O)[O-])NC(=O)C	{1: 3, 2: 10, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 4, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	72017-28-8	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC4=CC=CC=C4C=C3	{1: 2, 31: 1, 33: 2, 14: 12, 25: 1}
Did not match all atoms present	72017-60-8	CC(=O)O.CC(=O)O.CC(=O)O.N.[Sb]	{1: 3, 27: 3}
Did not match all atoms present	72017-86-8	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)NC3=CC=CC=C3	{1: 2, 4: 1, 14: 14, 31: 1}
Did not match all atoms present	72017-87-9	C(#N)[S-].C(#N)[S-].O=[Zr+2]	{29: 1, 37: 2}
Did not match all atoms present	72017-90-4	COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)N)N	{1: 1, 30: 2, 34: 2, 22: 1, 14: 7}
Did not match all atoms present	72017-97-1	CCC(CO)(COCC=C)COCC=C.CC1CO1.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 6, 4: 1, 5: 2, 6: 2, 11: 1, 12: 1, 14: 4, 20: 1, 22: 2, 23: 1, 28: 2}
Did not match all atoms present	72017-98-2	CC(CO)O.CC(COC1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)OCC(C)O)O.C(CCC(=O)O)CC(=O)O	{1: 5, 2: 7, 3: 3, 4: 1, 14: 8, 20: 4, 22: 2, 27: 2}
Did not match all atoms present	72018-03-2	CCCC(C1=CC(=C(C=C1C)OP2OCC(CO2)(C)C)C(C)(C)C)C3=CC(=C(C=C3C)OP4OCC(CO4)(C)C)C(C)(C)C	{1: 13, 2: 2, 3: 1, 4: 2, 11: 4, 13: 2, 14: 4, 22: 2, 23: 4}
Did not match all atoms present	72018-04-3	CC1=CC(=C(C(=C1)C)OP2OCC(CO2)(C)C)C	{1: 5, 11: 2, 13: 1, 14: 2, 22: 1, 23: 2}
Did not match all atoms present	72018-05-4	COC1=C(C=C(C=C1)CCC(=O)C2=C(C=C(C=C2O)OCC[C@@H](C(=O)O)N)O)O.Cl	{1: 1, 2: 4, 3: 1, 14: 5, 17: 1, 21: 3, 22: 2, 24: 1, 27: 1, 30: 1}
Did not match all atoms present	72018-06-5	CCOC(=O)CCC1=C(C=CC(=C1)OC)OC	{1: 3, 2: 3, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	72018-07-6	CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=C(C=CC(=C2)OC)OC	{1: 3, 2: 3, 22: 3, 14: 7, 29: 2}
Did not match all atoms present	72018-08-7	COC1=CC(=C(C=C1)OC)CC(C(=O)O)C(=O)O	{1: 2, 2: 1, 3: 1, 14: 3, 22: 2, 27: 2}
Did not match all atoms present	72018-09-8	CC1=CC(=C(C(=C1)C)OP2(=O)OCC(CO2)(C)C)C	{1: 5, 11: 2, 13: 1, 14: 2, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	72018-13-4	C=CNC=O.C=CS(=O)(=O)[O-].[Na+]	{26: 1, 31: 1, 5: 2, 6: 2, 29: 3}
Did not match all atoms present	72018-21-4	CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 19, 29: 3, 22: 1}
Did not match all atoms present	72018-22-5	CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Mg+2]	{1: 2, 2: 38, 29: 6, 22: 2}
Did not match all atoms present	72018-23-6	CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Mg+2]	{1: 2, 2: 42, 29: 6, 22: 2}
Did not match all atoms present	72018-24-7	CCCCCCOS(=O)(=O)[O-].[NH4+]	{1: 1, 2: 5, 29: 3, 22: 1}
Did not match all atoms present	72018-25-8	CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Ca+2]	{1: 2, 2: 42, 29: 6, 22: 2}
Did not match all atoms present	72018-26-9	CCCCCCCC/C=C\CCCCCCCCOS(=O)(=O)[O-].CCCCCCCC/C=C\CCCCCCCCOS(=O)(=O)[O-].[Ca+2]	{1: 2, 2: 30, 22: 2, 6: 4, 29: 6}
Did not match all atoms present	72018-27-0	CCCCCCOS(=O)(=O)[O-].CCCCCCOS(=O)(=O)[O-].[Mg+2]	{1: 2, 2: 10, 29: 6, 22: 2}
Did not match all atoms present	72018-28-1	CCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCOS(=O)(=O)[O-].[Ca+2]	{1: 2, 2: 24, 29: 6, 22: 2}
Did not match all atoms present	72018-29-2	CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-].[Ca+2]	{1: 2, 2: 38, 29: 6, 22: 2}
Did not match all atoms present	7202-55-3	CC1=CC(=O)C(=C(N1C)[O-])C(=O)C	{24: 1, 1: 3, 33: 1, 14: 1, 25: 1}
Did not match all atoms present	7203-90-9	CN(C)N=NC1=CC=C(C=C1)Cl	{1: 2, 34: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	7203-92-1	CN(C)N=NC1=CC=C(C=C1)OC	{1: 3, 34: 2, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	7203-95-4	CN(C)N=NC1=CC=C(C=C1)C2=CC=CC=C2	{1: 2, 34: 2, 14: 9, 33: 1}
Did not match all atoms present	72030-11-6	COC1=CC=C(C=C1)/C=C(\C#N)/C2=CC=C(C=C2)Cl	{1: 1, 37: 1, 6: 1, 7: 1, 14: 8, 17: 1, 22: 1}
Did not match all atoms present	72036-52-3	CC1=CC=C(C=C1)C2=CC(=O)CC(C2)(C)C	{1: 3, 11: 2, 13: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	72036-53-4	CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)C3=CC=CC=C3)C	{1: 2, 11: 2, 13: 1, 14: 10, 15: 1, 25: 1}
Did not match all atoms present	72036-54-5	CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)Br)C	{1: 2, 11: 2, 13: 1, 14: 5, 15: 1, 18: 1, 25: 1}
Did not match all atoms present	72036-55-6	CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)F)C	{1: 2, 11: 2, 13: 1, 14: 5, 15: 1, 16: 1, 25: 1}
Did not match all atoms present	72036-56-7	CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)C#N)C	{1: 2, 37: 1, 11: 2, 13: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	72036-57-8	CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)N)C	{1: 2, 11: 2, 13: 1, 14: 5, 15: 1, 25: 1, 30: 1}
Did not match all atoms present	72041-34-0	C1CC(=O)C2=CC3=C4C(=C21)C=CC5=C4C(=CC=C5)C3	{25: 1, 11: 3, 14: 6}
Did not match all atoms present	72047-94-0	CC(=O)OCC(=C)C[Si](C)(C)C	{1: 4, 2: 2, 28: 1, 5: 1, 7: 1}
Did not match all atoms present	7205-90-5	C1=CC(=CC=C1SCCl)Cl	{40: 1, 17: 2, 2: 1, 14: 4}
Did not match all atoms present	7205-91-6	C1=CC=C(C=C1)SCCl	{40: 1, 17: 1, 2: 1, 14: 5}
Did not match all atoms present	72050-78-3	CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)C[NH+](C)C.C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)[O-]	{1: 4, 2: 3, 3: 1, 4: 1, 14: 17, 28: 1, 29: 3}
Did not match all atoms present	7206-52-2	CC1=C2C=CC=C2C(=CC=C1)C	{1: 2, 14: 6}
Did not match all atoms present	7206-70-4	COC1=CC(=C(C=C1C(=O)O)Cl)N	{1: 1, 14: 2, 17: 1, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	7206-76-0	CCC(C1=CC=CC=C1)(C(=O)N)C(=O)N	{1: 1, 2: 1, 4: 1, 14: 5, 24: 2, 30: 2}
Did not match all atoms present	72060-61-8	[Sn].[Sn].[Sn].[Ba]	{}
Did not match all atoms present	72066-32-1	[H+].[CH3-].C(C[S-])C[S-].[Hg+2]	{2: 3}
Did not match all atoms present	72066-71-8	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)OC6=O.CC(C)(C1=CC=C(C=C1)OC2=CC=CC3=C2C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)OC6=O.C1=CC(=CC(=C1)N)N	{1: 4, 4: 2, 14: 32, 22: 4, 28: 8, 30: 2}
Did not match all atoms present	72066-72-9	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)OC6=O.C1=CC(=CC(=C1)N)N	{1: 2, 4: 1, 14: 18, 22: 2, 28: 4, 30: 2}
Did not match all atoms present	72066-74-1	CC1=CC(=C(C=C1)OC)N.C=O.Cl	{1: 2, 5: 1, 14: 3, 17: 1, 22: 1, 30: 1}
Did not match all atoms present	72066-78-5	CN(C)C1=C(C=C(C(=C1)OC)N)OC	{1: 4, 30: 1, 22: 2, 14: 2, 33: 1}
Did not match all atoms present	72066-79-6	CC(C)(C1=CC=C(C=C1)OC2=CC(=C(C=C2)C(=O)O)C(=O)O)C3=CC=C(C=C3)OC4=CC=CC(=C4C(=O)O)C(=O)O	{1: 2, 27: 4, 4: 1, 22: 2, 14: 14}
Did not match all atoms present	72066-80-9	CC(C)(C1=CC=C(C=C1)OC2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C3=CC=C(C=C3)OC4=CC=CC(=C4C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 4, 1: 2, 4: 1, 22: 2, 14: 14}
Did not match all atoms present	72066-81-0	CC(C)(C1=CC=C(C=C1)OC2=CC=CC(=C2C(=O)[O-])C(=O)[O-])C3=CC=C(C=C3)OC4=CC=CC(=C4C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{24: 4, 1: 2, 4: 1, 22: 2, 14: 14}
Did not match all atoms present	72066-82-1	C1=CC=C(C(=C1)C(=O)O)C(=O)O.C1(=NC(=NC(=N1)N)N)N	{35: 3, 27: 2, 30: 3, 14: 4}
Did not match all atoms present	72066-83-2	C(=O)O.C1(=NC(=NC(=N1)N)N)N	{35: 3, 26: 1, 27: 1, 30: 3}
Did not match all atoms present	72066-84-3	CCC(=O)NC1=CC=CC(=C1)N.Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	72066-85-4	C1=CC(=C(C(=C1)Cl)Cl)N.C1=CC(=C(C(=C1)Cl)Cl)N.OS(=O)(=O)O	{17: 4, 30: 2, 20: 2, 29: 2, 14: 6}
Did not match all atoms present	72066-86-5	CCNC1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OCCOC	{1: 3, 2: 3, 38: 2, 34: 2, 14: 4, 18: 1, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	72066-87-6	CCC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OCCOC)NCC	{1: 3, 2: 4, 38: 2, 34: 2, 14: 4, 18: 1, 22: 2, 24: 1, 31: 2}
Did not match all atoms present	72066-88-7	C1=CC=C(C=C1)NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC(=C(C=C4)NC5=CC=C(C=C5)NN=C6C=CC(=O)C=C6N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 4, 14: 17, 15: 4, 20: 3, 25: 2, 29: 6, 30: 2, 31: 3}
Did not match all atoms present	72066-91-2	C[Si](C)(CCCCCl)O[Si](C)(C)CCCCCl	{1: 4, 2: 8, 22: 1, 17: 2}
Did not match all atoms present	72074-68-1	C1=CC=C2C(=C1)C=CC3=C2[C@H]4[C@H](O4)[C@@H]([C@H]3O)O	{20: 2, 12: 4, 14: 6, 23: 1}
Did not match all atoms present	72074-69-2	C1=CC=C2C(=C1)C=CC3=C2[C@H]([C@H]([C@H]4[C@H]3O4)O)O	{20: 2, 12: 4, 14: 6, 23: 1}
Did not match all atoms present	72076-40-5	CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC6=C(C=C5)C(=O)OC6=O.CC(C)(C1=CC=C(C=C1)OC2=CC3=C(C=C2)C(=O)OC3=O)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)OC6=O.C1=CC(=CC(=C1)N)N	{1: 4, 4: 2, 14: 32, 22: 4, 28: 8, 30: 2}
Did not match all atoms present	72076-42-7	CCCCCCCCCCCCCCCCCC(=O)O.C1(=NC(=NC(=N1)N)N)N	{1: 1, 2: 16, 27: 1, 30: 3, 35: 3}
Did not match all atoms present	72076-45-0	CCCCC(C(=O)O)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 5, 3: 1, 4: 2, 14: 3, 22: 1, 27: 1}
Did not match all atoms present	72076-47-2	CC(=O)NC1=CC=CC2=C1C=CC(=C2OC(=O)C)S(=O)(=O)O.C1=CC=NC=C1	{1: 2, 35: 1, 14: 10, 20: 1, 24: 1, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	72076-48-3	CC(C)C(=NN(C)C1=CC=CC=N1)C	{1: 4, 34: 1, 3: 1, 33: 1, 7: 1, 14: 4, 35: 1}
Did not match all atoms present	72076-49-4	CCN1C(=O)C(C(=O)N(C1=S)CC)/C=C/C=C/C=C2C(=O)N(C(=S)N(C2=O)CC)CC.CCN(CC)CC	{1: 7, 2: 7, 6: 5, 33: 5, 12: 1, 15: 3, 25: 4}
Did not match all atoms present	72076-50-7	COC(=O)C1=CC(=CC(=C1)N=C=S)C(=O)OC	{8: 1, 1: 2, 34: 1, 28: 2, 14: 3}
Did not match all atoms present	72076-51-8	COC(=O)C1=CC(=CC(=C1)N2C(=S)N=NN2)C(=O)OC	{32: 1, 1: 2, 35: 2, 33: 1, 14: 3, 28: 2}
Did not match all atoms present	72076-52-9	CCN(CC)CC.COC(=O)C1=CC(=CC(=C1)NC(=S)S)C(=O)OC	{1: 5, 2: 3, 33: 1, 7: 1, 39: 1, 14: 3, 28: 2, 31: 1}
Did not match all atoms present	72076-53-0	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC2=C(C=C1)[N+](=CC=C2)C	{1: 3, 29: 3, 14: 10, 33: 1}
Did not match all atoms present	72076-54-1	CC1=CC2=C(C=C1)N=C(C=C2)SC3=CC=CC=C3	{40: 1, 1: 1, 35: 1, 14: 10}
Did not match all atoms present	72076-55-2	C=C1CC(=C(C1=O)O)[NH+]2CCCCC2.[Cl-]	{5: 1, 11: 6, 15: 3, 17: 1, 20: 1, 25: 1}
Did not match all atoms present	72076-56-3	CC1=C(SC(=N1)SSC2=NC(=C(S2)[N+](=O)[O-])C)[N+](=O)[O-]	{40: 2, 1: 2, 35: 2, 38: 2, 41: 2}
Did not match all atoms present	72079-76-6	C1=CC=C(C=C1)CN2C=NC(=C2C=CC3=CC=CC=C3)[N+](=O)[O-]	{33: 1, 2: 1, 35: 1, 6: 2, 38: 1, 14: 11}
Did not match all atoms present	7208-05-1	CC1=COC(=N1)C	{1: 2, 35: 1, 14: 1, 23: 1}
Did not match all atoms present	72083-19-3	CC(C)(C)C1=CC(=C(C=C1)O)C(=O)C2=CC=C(C=C2)Cl	{1: 3, 4: 1, 14: 7, 17: 1, 21: 1, 24: 1}
Did not match all atoms present	72087-91-3	C(=S)(SCl)Cl	{40: 1, 17: 2, 7: 1}
Did not match all atoms present	72088-83-6	C1CC(OC1)CN.OS(=O)(=O)O	{2: 1, 11: 3, 12: 1, 20: 2, 23: 1, 29: 2, 30: 1}
Did not match all atoms present	72088-84-7	CC(=O)O.C1=CC=C(C=C1)CNCC2=CC=CC=C2	{1: 1, 2: 2, 27: 1, 14: 10, 31: 1}
Did not match all atoms present	72088-86-9	CCC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=CC(=C(C=C4)Cl)Cl)/C2=O	{1: 1, 2: 1, 34: 1, 14: 12, 15: 2, 17: 2, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	72088-87-0	CCC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=C(C=C(C=C4)OC)[N+](=O)[O-])/C2=O	{1: 2, 2: 1, 38: 1, 34: 1, 14: 12, 15: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	72089-06-6	CCN(CC)C1=CC2=C(C=C1)[C@@]3(C4=C(O2)C=C(C=C4)C)C5=CC=CC=C5C(=O)O3	{1: 3, 2: 2, 33: 1, 13: 1, 14: 10, 23: 1, 28: 1}
Did not match all atoms present	72089-09-9	C1=CC=C(C=C1)CCCCCCCCCCCCCCCCCC(=O)[O-].[Na+]	{24: 1, 2: 17, 14: 5}
Did not match all atoms present	72089-10-2	CCCCCCCCC(CCCCCCCCCOC=O)C1=CC=CC=C1	{1: 1, 2: 16, 3: 1, 26: 1, 14: 5}
Did not match all atoms present	72089-11-3	CCCC=NC1=CC=C(C=C1)CC2=CC=C(C=C2)N=CCCC	{1: 2, 2: 5, 34: 2, 14: 8, 6: 2}
Did not match all atoms present	72089-12-4	C1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=C(C=C2)[N+]#N)S(=O)(=O)O.[Cl-]	{17: 1, 34: 3, 20: 1, 29: 2, 14: 10}
Did not match all atoms present	72089-14-6	C1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=C(C=C2)[N+]#N)S(=O)(=O)O.C1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=C(C=C2)[N+]#N)S(=O)(=O)O.[O-]S(=O)[O-]	{34: 6, 20: 2, 29: 7, 14: 20}
Did not match all atoms present	72089-15-7	CC1=C(C2=CC=CC=C2N1)/C=C/C3=[N+](C4=CC=CC=C4C3(C)C)C.OS(=O)(=O)[O-]	{32: 1, 1: 4, 6: 2, 33: 1, 13: 1, 14: 8, 15: 1, 20: 1, 29: 3}
Did not match all atoms present	72089-17-9	C1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=C(C=C2)[N+]#N)S(=O)(=O)O.OS(=O)(=O)[O-]	{34: 3, 20: 2, 29: 5, 14: 10}
Did not match all atoms present	72089-18-0	CC1=C(C2=CC=CC=C2N1)C=CC3=[N+](C4=CC=CC=C4C3(C)C)C.CC(=O)[O-]	{32: 1, 1: 5, 6: 2, 33: 1, 13: 1, 14: 8, 15: 1, 24: 1}
Did not match all atoms present	72089-19-1	C[N+]1=C(SC2=C1C=CC(=C2)OC)N=NC3=CC=C(C=C3)N(C)CCO.COS(=O)(=O)[O-]	{1: 4, 2: 2, 33: 2, 41: 1, 34: 2, 14: 7, 20: 1, 22: 2, 29: 3}
Did not match all atoms present	72089-21-5	C1=CC(=CC=C1CC2=CC(=C(C=C2)N/N=C/3\C=C(C(=CC3=O)[O-])N=NC4=C(C=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)O)N/N=C\5/C=C(C(=CC5=O)O)N=NC6=C(C=C(C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{2: 1, 34: 6, 14: 17, 15: 6, 20: 1, 25: 2, 27: 1, 29: 12, 31: 2}
Did not match all atoms present	721-00-6	COC(=O)C1=CC2=C(C=C1[N+](=O)[O-])OCO2	{1: 1, 38: 1, 11: 1, 14: 2, 23: 2, 28: 1}
Did not match all atoms present	721-37-9	C1=CC(=CC(=C1)C(F)(F)F)C(=O)C(F)(F)F	{16: 6, 24: 1, 4: 2, 14: 4}
Did not match all atoms present	721-50-6	CCCNC(C)C(=O)NC1=CC=CC=C1C	{1: 3, 2: 2, 3: 1, 14: 4, 24: 1, 31: 2}
Did not match all atoms present	721-91-5	CCOC1=CC=C(C=C1)NC2CCCCC2	{1: 1, 2: 1, 11: 5, 12: 1, 14: 4, 22: 1, 31: 1}
Did not match all atoms present	7210-76-6	CCOC(=O)C1=C(N=C(S1)N)C	{1: 2, 2: 1, 35: 1, 41: 1, 28: 1, 30: 1}
Did not match all atoms present	7210-92-6	CCN(CC)CC(=O)NC1=C(C=CC=C1C)C(=O)OC.Cl	{1: 4, 2: 3, 33: 1, 14: 3, 17: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	72102-49-9	CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)S(=O)(=O)[O-].[K+]	{1: 2, 2: 15, 3: 1, 28: 2, 29: 3}
Did not match all atoms present	72102-58-0	CC1=C(C=CC(=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C)N.CC(=O)[O-]	{1: 6, 33: 2, 7: 1, 14: 11, 15: 2, 24: 1, 30: 1}
Did not match all atoms present	72102-59-1	CC1=C(C=CC(=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C)N.[Cl-]	{1: 5, 33: 2, 7: 1, 14: 11, 15: 2, 17: 1, 30: 1}
Did not match all atoms present	72102-61-5	CC(=O)NC1=C(C=C(C(=C1)OC)[N+]#N)OC.F[P-](F)(F)(F)(F)F	{1: 3, 34: 1, 14: 2, 16: 6, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	72102-63-7	COC1=CC(=C(C=C1[N+]#N)OC)NC(=O)OC.F[P-](F)(F)(F)(F)F	{1: 3, 34: 1, 14: 2, 16: 6, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	72102-69-3	CC(C)(C)C1=CC(=C(C=C1)O[P@](C2=CC=CC=C2)Cl)C(C)(C)C	{1: 6, 4: 2, 22: 1, 14: 8, 17: 1}
Did not match all atoms present	72102-70-6	CC1=CC(=C(C(=C1)C(C)(C)C)OP(C2=CC=CC=C2)OC3=C(C=C(C=C3)C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 13, 4: 4, 22: 2, 14: 10}
Did not match all atoms present	72102-76-2	C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC=C(C=C4)N)S(=O)(=O)[O-].[Na+]	{33: 1, 30: 1, 35: 2, 29: 3, 14: 9}
Did not match all atoms present	72102-77-3	C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]	{38: 1, 33: 1, 35: 2, 29: 3, 14: 9}
Did not match all atoms present	72102-78-4	C1=CC=C2C(=C1)C(=CC(=C2N)N=NC3=CC=C(C=C3)N)S(=O)(=O)[O-].[Na+]	{30: 2, 34: 2, 29: 3, 14: 9}
Did not match all atoms present	72102-79-5	C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC=C(C=C4)[N+]#N)S(=O)(=O)O	{33: 1, 34: 1, 35: 2, 14: 9, 20: 1, 29: 2}
Did not match all atoms present	72102-81-9	COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)NC(=O)NC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)O)OC.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 2, 2: 12, 33: 2, 34: 4, 14: 14, 20: 8, 22: 2, 24: 1, 29: 4, 31: 2}
Did not match all atoms present	72102-83-1	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)OC)NC(=O)NC3=C(C=C(C(=C3)C)N=NC4=CC=C(C=C4)S(=O)(=O)O)OC.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 4, 2: 12, 33: 2, 34: 4, 14: 12, 20: 8, 22: 2, 24: 1, 29: 4, 31: 2}
Did not match all atoms present	72102-86-4	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)OC)NC(=O)NC3=C(C=C(C=C3)N=NC4=CC=C(C=C4)S(=O)(=O)O)OC.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 3, 2: 12, 33: 2, 34: 4, 14: 13, 20: 8, 22: 2, 24: 1, 29: 4, 31: 2}
Did not match all atoms present	72102-88-6	[B-](F)(F)(F)F.CCOC(=O)N1CC[N+](=C2CC(CC(=C2)C)(C)C)CC1	{1: 4, 2: 1, 33: 2, 11: 6, 13: 1, 14: 1, 15: 2, 16: 4, 28: 1}
Did not match all atoms present	72102-89-7	CC1=C(C(=CC=C1)C)OCC=O	{1: 2, 2: 1, 26: 1, 22: 1, 14: 3}
Did not match all atoms present	72102-91-1	C1CC2=C3C(=C4C(=C2)C(=C5C=C6CCC[N+]7=C6C(=C5O4)CCC7)C8=CC=CC=C8C(=O)O)CCCN3C1.[O-]Cl(=O)(=O)=O	{33: 2, 11: 12, 14: 6, 15: 1, 17: 1, 23: 1, 27: 1, 29: 4}
Did not match all atoms present	72102-92-2	CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C3=NC4=CC=CC=C4S3)C	{1: 3, 2: 2, 35: 1, 33: 1, 41: 1, 14: 7, 28: 1}
Did not match all atoms present	72102-93-3	CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C3=NC4=C(S3)C=C(C=C4)OCC)C	{1: 4, 2: 3, 35: 1, 33: 1, 41: 1, 14: 6, 22: 1, 28: 1}
Did not match all atoms present	7211-39-4	C[P+](=O)C	{1: 2, 29: 1}
Did not match all atoms present	7212-69-3	CCCCCCCCC=CCCCCCCCC[N+](C)(C)CCCCCCCCC=CCCCCCCCC.[Cl-]	{1: 4, 2: 30, 6: 4, 17: 1}
Did not match all atoms present	72121-43-8	O.O.O.O.O.O.O[Sb](=O)O.F	{16: 1, 20: 2, 29: 1}
Did not match all atoms present	72121-71-2	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N\NC3=C(C(=CC=C3)Cl)Cl)C(=O)O	{34: 1, 14: 8, 15: 2, 17: 2, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	72121-72-3	CC(C)CCCCCCCCCCCCCCC(=O)N(CCO)CCOC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[NH4+].[Na+]	{1: 2, 2: 19, 3: 2, 33: 1, 20: 1, 24: 2, 28: 1, 29: 3}
Did not match all atoms present	72121-79-0	C1=CC=C(C=C1)N=C=O.C(CCl)OP(=O)(OCCCl)OCCCl	{2: 6, 8: 1, 34: 1, 14: 5, 17: 3, 22: 3, 29: 2}
Did not match all atoms present	72121-80-3	CC1=C(SC(=C1C#N)N=NC2=NC(=CC(=C2)N)N)C(=O)OC	{1: 2, 34: 2, 35: 1, 37: 1, 41: 1, 14: 2, 28: 1, 30: 2}
Did not match all atoms present	72121-81-4	CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)OC)S(=O)(=O)CCOS(=O)(=O)[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 2, 35: 1, 33: 1, 12: 1, 34: 2, 14: 7, 15: 1, 22: 2, 25: 1, 29: 8}
Did not match all atoms present	72121-82-5	CCCCOP(=S)(OCCCC)SSC(Cl)(Cl)Cl	{1: 2, 2: 6, 4: 1, 40: 2, 17: 3, 22: 2}
Did not match all atoms present	72121-83-6	CC1=CC(=C(C=C1)C)OP(=O)(OC2=CC=CC=C2)OC3=C(C=CC(=C3)C)C	{1: 4, 22: 3, 14: 11, 29: 1}
Did not match all atoms present	72121-85-8	C[N+]1=C(SC2=C1C=CC(=C2)OC)N=NC3=CC=C(C=C3)N(C)CCO.[Cl-]	{1: 3, 2: 2, 33: 2, 41: 1, 34: 2, 14: 7, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	7213-59-4	CC1=CC(=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)OC)O	{1: 2, 22: 1, 21: 3, 14: 3, 25: 2}
Did not match all atoms present	7213-65-2	CC(=O)OC1=C2C3CC(C2=C(C=C1)OC(=O)C)C=C3	{1: 2, 11: 1, 12: 2, 14: 4, 28: 2}
Did not match all atoms present	72136-46-0	CO[Si](CCCOC1=CC=C(C=C1)C=O)(OC)OC	{1: 3, 2: 3, 26: 1, 22: 4, 14: 4}
Did not match all atoms present	72138-84-2	CC(C)(C)C1=CC=CC=C1OP(=O)(OC2=CC=CC=C2C(C)(C)C)Cl	{1: 6, 4: 2, 14: 8, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	72138-85-3	CCOC1=CC=C(C=C1)N=NC2=C(C=C(C(=C2)C)N=NC3=CC(=CC=C3)S(=O)(=O)[O-])OC.[Na+]	{1: 3, 2: 1, 34: 4, 14: 10, 22: 2, 29: 3}
Did not match all atoms present	72138-86-4	CC1=CC=C(C=C1)C(=O)OCCCOCCCOC(=O)C2=CC=CC=C2	{1: 1, 2: 6, 28: 2, 22: 1, 14: 9}
Did not match all atoms present	72138-87-5	CC1=CC=C(C=C1)C(=O)OCCCOCCCOC(=O)C2=CC=C(C=C2)C	{1: 2, 2: 6, 28: 2, 22: 1, 14: 8}
Did not match all atoms present	72138-89-7	CCCC[N+](CCCC)(CCCC)CCCC.C/C=C/C=C/C(=O)[O-]	{24: 1, 1: 5, 2: 12, 6: 4}
Did not match all atoms present	72138-90-0	C/C=C/C=C/C(=O)[O-].C[N+](C)(C)C	{24: 1, 1: 5, 6: 4}
Did not match all atoms present	72138-91-1	CC1=C(C(=CC=C1)C)OCC(OC)OC	{1: 4, 2: 1, 3: 1, 22: 3, 14: 3}
Did not match all atoms present	72138-92-2	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[O-].[Na+]	{38: 2, 14: 7, 31: 1}
Did not match all atoms present	72138-93-3	CC1=NN(C(=O)C1N=NC2=CC(=CC(=C2C)NC3=C(C(=NC(=N3)F)F)Cl)S(=O)(=O)[O-])C4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 35: 3, 33: 1, 12: 1, 14: 6, 15: 1, 16: 2, 17: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	72138-94-4	CN(C)CCCNC(=O)C1=CC2=C(C=C1)C(=O)C(C2=O)C3=NC4=CC=CC=C4C=C3O.Cl	{1: 2, 2: 3, 35: 1, 33: 1, 12: 1, 14: 8, 17: 1, 21: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	72138-95-5	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C5=C(C=C4)C6=CC7=C(C=C6N5)C(=O)C8=C(N7)C9=C(C=C8)C(=O)C1=CC=CC=C1C9=O	{24: 1, 25: 5, 32: 2, 14: 18, 31: 1}
Did not match all atoms present	72138-98-8	CC1=CC(=C(C=C1)N=NC2=C/C(=N\NC3=CC=C(C=C3)S(=O)(=O)O)/C(=O)C=C2O)C	{1: 2, 34: 3, 14: 9, 15: 3, 20: 2, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	72139-01-6	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)N/N=C\3/C=C(C(=CC3=O)O)N=NC4=C5C(=CC(=C4)S(=O)(=O)O)C=C(/C(=N\NC6=C(C=C(C=C6)[N+](=O)[O-])Cl)/C5=O)S(=O)(=O)O	{34: 4, 38: 2, 14: 15, 15: 5, 17: 1, 20: 4, 25: 2, 29: 6, 31: 3}
Did not match all atoms present	72139-02-7	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)N=NC3=C(C=C(C=C3)NC4=CC(=C(C=C4N=NC5=CC=C(C=C5)NC6=C(C=C(C=C6)[N+](=O)[O-])S(=O)(=O)O)N=NC7=CC=C(C=C7)NC8=C(C=C(C=C8)[N+](=O)[O-])S(=O)(=O)O)O)O	{34: 6, 38: 3, 14: 26, 20: 3, 21: 2, 29: 6, 31: 4}
Did not match all atoms present	72139-03-8	C1=CC(=CC=C1NN=C2C(=O)C(=CC(=NNC3=CC=C(C=C3)S(=O)(=O)O)C2=O)N=NC4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-]	{34: 4, 38: 2, 14: 12, 20: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	72139-04-9	CC1=CC(=C(C=C1)NC2=CC3=C(C=C2)C4(C5=C(O3)C=C(C=C5)NC6=C(C(=C(C=C6)S(=O)(=O)O)C)C)C7=CC=CC=C7S(O4)([O-])[O-])C.[Na+]	{1: 4, 13: 1, 14: 15, 20: 1, 23: 2, 29: 4, 31: 2}
Did not match all atoms present	72139-07-2	[H+].C1=CC(=C(C2=CC(=CC(=C21)[O-])N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])N/N=C\4/C(=O)C(=CC(=C4)S(=O)(=O)[O-])C(=O)[O-])N.C1=CC(=C(C2=CC(=CC(=C21)[O-])N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])N/N=C\4/C(=O)C(=CC(=C4)S(=O)(=O)[O-])C(=O)[O-])N.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Cr+3]	{34: 6, 38: 2, 14: 16, 15: 6, 24: 2, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	72139-11-8	C1=CC2=C(C(=CC(=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC3=C(C=CC4=C(C(=CC(=C43)S(=O)(=O)[O-])N=NC5=CC(=CC(=C5[O-])NC6=C(C(=NC(=N6)Cl)Cl)Cl)S(=O)(=O)[O-])[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{34: 4, 35: 2, 14: 9, 17: 3, 29: 12, 31: 1}
Did not match all atoms present	72139-12-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)NC5=C(C(=NC(=N5)Cl)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{35: 2, 14: 8, 17: 3, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	72139-13-0	C1=CC(=CC(=C1)NC2=C(C(=NC(=N2)F)F)Cl)C(=O)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(/C(=N\NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 1, 35: 2, 14: 10, 15: 2, 16: 2, 17: 1, 24: 1, 25: 1, 29: 12, 31: 3}
Did not match all atoms present	72139-16-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4S(=O)(=O)[O-])S(=O)(=O)[O-])NC5=C(C(=NC(=N5)Cl)Cl)Cl)S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]	{35: 2, 14: 7, 17: 3, 25: 2, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	72139-18-5	C1=CC2=C(C=C1NC3=C(C(=NC(=N3)Cl)Cl)Cl)C=C(/C(=N/NC4=C(C=C(C=C4)Cl)S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 35: 2, 14: 7, 15: 2, 17: 4, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	72139-19-6	C1=CC=C(C=C1)NC2=C(C3=CC(=C(C(=C3C=C2)O)N=NC4=C(C=C(C=C4)C5=CC(=C(C=C5)N=NC6=C(C=C7C(=C6O)C=CC(=C7N=NC8=C(C=CC(=C8)S(=O)(=O)N)O)NC9=CC=CC=C9)S(=O)(=O)[O-])C(=O)[O-])C(=O)[O-])S(=O)(=O)[O-])N=NC1=C(C=CC(=C1)S(=O)(=O)N)O.[Na+].[Na+].[Na+].[Na+]	{34: 8, 14: 28, 21: 4, 24: 2, 29: 10, 30: 2, 31: 2}
Did not match all atoms present	72139-22-1	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)NC3=C(C(=NC(=N3)F)F)Cl)C4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 2, 35: 3, 33: 1, 12: 1, 14: 7, 15: 1, 16: 2, 17: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	72150-17-5	CC12CCN(CC(C1)CC3=C2C=C(C=C3)O)C.Br	{1: 2, 33: 1, 11: 5, 12: 1, 13: 1, 14: 3, 18: 1, 21: 1}
Did not match all atoms present	72150-93-7	C1=CC=C(C=C1)N=NC2=C3C=C(C=CC3=C(C=C2)N)S(=O)(=O)O	{30: 1, 34: 2, 20: 1, 29: 2, 14: 10}
Did not match all atoms present	72152-44-4	CC1=CC(=C(C=C1OC)[N+]#N)N=NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C.OS(=O)(=O)[O-]	{1: 3, 34: 3, 38: 1, 14: 5, 20: 1, 22: 1, 29: 5}
Did not match all atoms present	72152-46-6	CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])NC3=C(C(=NC(=N3)F)F)Cl)S(=O)(=O)[O-])[O-])C4=C(C=CC(=C4)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Cu+2]	{1: 1, 34: 2, 35: 3, 33: 1, 14: 5, 16: 2, 17: 2, 29: 6, 31: 1}
Did not match all atoms present	72152-47-7	CC1=NN(C(=C1N=NC2=CC(=CC(=C2[O-])NC3=C(C(=NC(=N3)Cl)Cl)Cl)S(=O)(=O)[O-])[O-])C4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2]	{1: 1, 34: 2, 35: 3, 33: 1, 14: 5, 17: 3, 29: 9, 31: 1}
Did not match all atoms present	72152-48-8	CC1=CC(=C(C=C1)NC2=C3C4=C(C(=C2)C)NC(=O)C(=C4C5=CC=CC=C5C3=O)C(=O)C6=CC=CC=C6)S(=O)(=O)[O-].[Na+]	{32: 1, 1: 2, 14: 13, 24: 1, 25: 2, 29: 3, 31: 1}
Did not match all atoms present	72152-51-3	C1=CC2=C(C=CC(=C2N=NC3=C(C=CC(=C3)NC4=C(C=CC(=C4)NC5=C(C(=NC(=N5)F)F)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])N)C(=C1)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 35: 2, 14: 11, 16: 2, 17: 1, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	72152-52-4	CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=O)/C(=N/NC4=C(C=C(C=C4)C(=O)NC5=CC6=C(C=C5)C(=O)/C(=N/NC7=CC=CC=C7C(=O)[O-])/C(=C6)S(=O)(=O)[O-])C)/C(=C3)S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 18, 15: 4, 24: 3, 25: 2, 29: 6, 30: 1, 31: 4}
Did not match all atoms present	72152-57-9	C1=CC(=C(C=C1N2C(=O)C(C=N2)N/N=C/3\C=C(C=C(C3=O)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)O)[O-].[Na+].[Na+].[Na+]	{33: 1, 34: 1, 35: 1, 12: 1, 14: 6, 15: 3, 25: 2, 27: 1, 29: 6, 31: 1}
Did not match all atoms present	72152-58-0	CC1=NN(C(=O)C1NNC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\N=C\4/C=C(C=C(C4=O)[N+](=O)[O-])S(=O)(=O)[O-])/C3=O)S(=O)(=O)[O-])C5=CC=CC=C5.[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 1, 38: 1, 33: 1, 12: 1, 14: 10, 15: 6, 25: 3, 29: 9, 31: 2}
Did not match all atoms present	72152-64-8	CC1=CC(=C(C=C1N=NC2=CC(=C(C=C2)O)C(=O)[O-])OC)N=NC3=C(C=C4C=C(C=CC4=C3O)NC5=CC6=CC(=C(C(=C6C=C5)O)N=NC7=CC(=C(C=C7O)[N+](=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 6, 38: 1, 14: 15, 17: 1, 21: 4, 22: 1, 24: 1, 29: 6, 31: 1}
Did not match all atoms present	72152-66-0	CC1=CC2=C(C(=C1)S(=O)(=O)O)N=C(S2)C3=CC=C(C=C3)N/N=C/4\C=C(C(=CC4=O)O)N=NC5=C6C(=CC(=C5)S(=O)(=O)O)C=C(/C(=N/NC7=CC=C(C=C7)[N+](=O)[O-])/C6=O)S(=O)(=O)O	{1: 1, 34: 4, 35: 1, 38: 1, 41: 1, 14: 15, 15: 5, 20: 4, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	72152-67-1	CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)C(=O)/C(=N/NC4=C(C=C(C=C4)C(=O)NC5=CC=C(C=C5)N/N=C/6\C=CC(=O)C(=C6)C(=O)[O-])C)/C(=C3)S(=O)(=O)[O-])N.[Na+].[Na+]	{1: 2, 34: 2, 14: 17, 15: 4, 24: 3, 25: 2, 29: 3, 30: 1, 31: 4}
Did not match all atoms present	72152-73-9	CC(C)(C)C1=CC=C(C=C1)OCC(OC)OC	{1: 5, 2: 1, 3: 1, 4: 1, 14: 4, 22: 3}
Did not match all atoms present	72152-81-9	CC1=CC[C@H](C[C@H]1OC(=O)CC2=CC=CC=C2)C(=C)C	{1: 2, 2: 1, 5: 1, 7: 1, 11: 2, 12: 2, 14: 6, 15: 1, 28: 1}
Did not match all atoms present	72152-82-0	CCC1=CC=C(C=C1)OCC(OC)OC	{1: 3, 2: 2, 3: 1, 22: 3, 14: 4}
Did not match all atoms present	72152-86-4	CC1=NN(C(=O)[C@@H]1N=NC2=CC=C(C=C2)N=NC3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 1, 34: 4, 35: 1, 33: 1, 12: 1, 14: 13, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	72152-87-5	CC(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=CC=C3	{1: 1, 2: 4, 37: 1, 33: 1, 34: 4, 14: 13, 28: 1}
Did not match all atoms present	72152-88-6	CC\1=C(C(=O)N(C(=O)/C1=N/NC2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3)CCCOC)C#N	{1: 2, 2: 3, 37: 1, 33: 1, 34: 1, 14: 9, 15: 3, 22: 2, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	72152-89-7	C1=CC(=CC=C1N/N=C/2\C=CC(=O)C(=C2)C(=O)O)[N+]#N	{34: 2, 14: 7, 15: 2, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	72152-90-0	C1=CC(=CC=C1N/N=C\2/C=CC(=O)C(=C2)C(=O)[O-])N=NC3=C4C=C(C=CC4=C(C=C3)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 4, 14: 16, 15: 4, 24: 1, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	72152-91-1	C1=CC(=CC=C1N/N=C\2/C=CC(=O)C(=C2)C(=O)O)N=NC3=C4C=C(C=CC4=C(C=C3)[N+]#N)S(=O)(=O)O	{34: 4, 14: 12, 15: 2, 20: 1, 25: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	72152-92-2	COC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])OC.[Na+]	{1: 2, 34: 4, 22: 2, 14: 11, 29: 3}
Did not match all atoms present	72152-93-3	COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=NC3=CC=C(C=C3)[O-].[Na+].[Na+]	{1: 1, 34: 4, 22: 1, 14: 11, 29: 3}
Did not match all atoms present	72152-94-4	COC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)[N+]#N	{1: 1, 34: 3, 14: 7, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	7216-18-4	C1COC2=CC=CC=C2OC1	{11: 3, 14: 4, 23: 2}
Did not match all atoms present	72162-08-4	[O-][Si](=O)[O-].[O-][Si](=O)[O-].[O-][Si](=O)[O-].[Mg+2].[Zn+2].[Ba+2]	{29: 9}
Did not match all atoms present	72162-10-8	CCC[C@H](CC)CC[C@@H](C)CC1=CC=CC=C1	{1: 3, 2: 6, 3: 2, 14: 5}
Did not match all atoms present	72162-36-8	CCOCNC(=O)C=C.C=CC1=CC=CC=C1.C=CC(=O)[O-].[NH4+]	{1: 1, 2: 2, 5: 3, 6: 3, 14: 5, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	72162-38-0	CC(=C)C(=O)OCCO.C1C(O1)COC2=CC=CC=C2.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 1, 2: 3, 5: 1, 7: 1, 11: 1, 12: 1, 14: 9, 20: 1, 22: 1, 23: 1, 28: 3}
Did not match all atoms present	7217-01-8	B(C=C)(C=C)C=C	{5: 3, 6: 3}
Did not match all atoms present	7217-59-6	COC1=CC=CC=C1S	{1: 1, 22: 1, 14: 4, 39: 1}
Did not match all atoms present	7217-71-2	CC(=O)OC(C=C)C1=CC=CC=C1	{1: 1, 3: 1, 5: 1, 6: 1, 14: 5, 28: 1}
Did not match all atoms present	72175-18-9	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=CC5=C(C=C4C(=N3)NC6=C7C(=C8C(=C6)C(=O)C9=CC=CC=C9N8)C(=O)C1=CC=CC=C1C7=O)C(=O)C1=CC=CC=C1C5=O	{32: 1, 25: 5, 35: 2, 14: 24, 31: 1}
Did not match all atoms present	72175-19-0	CCC(C)(C)C1=CC=C(C=C1)OC2=CC=CC=C2N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 4, 2: 1, 4: 1, 34: 1, 14: 11, 15: 2, 22: 1, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	72175-34-9	C=O.C1=CC(=CC(=C1)O)O.C1=COC(=C1)CO.C(=O)(N)N	{2: 1, 5: 1, 14: 7, 20: 1, 21: 2, 23: 1, 24: 1, 30: 2}
Did not match all atoms present	72175-35-0	C1=CC=C(C=C1)OC(=O)/C=C\C(=O)[O-].[Na+]	{24: 1, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	72175-37-2	C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2C(=O)[O-].[Na+]	{24: 1, 28: 1, 14: 9}
Did not match all atoms present	72175-38-3	CCCC[C@@H](CC)CCC(=C)C1=C(C2=C(C=CC=N2)C=C1)O	{1: 2, 2: 6, 3: 1, 5: 1, 7: 1, 14: 5, 35: 1, 21: 1}
Did not match all atoms present	72178-02-0	CS(=O)(=O)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]	{1: 1, 4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	7218-44-2	C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)NS(=O)(=O)C4=CC=CC=C4	{31: 2, 22: 1, 14: 18, 29: 8}
Did not match all atoms present	7218-46-4	C1=CC=C(C=C1)S(=O)(=O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)NS(=O)(=O)C4=CC=CC=C4	{29: 8, 14: 18, 31: 2}
Did not match all atoms present	7218-82-8	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)NN=C3C=C(C=CC3=O)C(C)(C)CC(C)(C)C)C)NN=C4C=C(C=CC4=O)C(C)(C)CC(C)(C)C	{1: 12, 2: 2, 4: 4, 34: 2, 14: 12, 15: 4, 25: 2, 31: 2}
Did not match all atoms present	72187-20-3	C1CCC(CC1)NC2=CC(C(C3=C2C(=O)C4=CC=CC=C4C3=O)(N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{11: 5, 12: 2, 13: 1, 14: 5, 15: 3, 25: 2, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	72187-21-4	CC1=C(C(=C(C=C1)S(=O)(=O)[O-])C)NC2=C3C(=C(C=C2)NC4=C(C=CC(=C4C)S(=O)(=O)[O-])C)C(=O)C5=CC(=C(C=C5C3=O)Cl)Cl.[Na+].[Na+]	{1: 4, 14: 8, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	72187-35-0	CC1=C(C=C(C=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O)S(=O)(=O)O)NC(=O)C5=CC(=NN=C5Cl)Cl	{1: 1, 35: 2, 14: 8, 17: 2, 20: 2, 24: 1, 25: 2, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	72187-37-2	C1=CC(=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[K+].[K+].[K+]	{2: 2, 34: 1, 14: 8, 15: 2, 22: 1, 25: 1, 29: 11, 31: 1}
Did not match all atoms present	72187-39-4	C1=CC=C(C=C1)COCCC2=CC=CC=N2	{2: 3, 35: 1, 22: 1, 14: 9}
Did not match all atoms present	72189-54-9	C[Si](C)(C)OC(=[Si]([Si](C)(C)C)[Si](C)(C)C)C12CC3CC(C1)CC(C3)C2	{1: 9, 7: 1, 11: 6, 12: 3, 13: 1, 22: 1}
Did not match all atoms present	72190-38-6	O=[Ge].F.F	{16: 2, 29: 1}
Did not match all atoms present	72194-24-2	CC(C)(C)C1=CC=C(C=C1)C(=S)C(C)(C)C	{1: 6, 4: 2, 14: 4, 7: 1}
Did not match all atoms present	722-01-0	C1=CC=C(C=C1)CC(=O)OC2=CC=CC=C2	{2: 1, 28: 1, 14: 10}
Did not match all atoms present	722-23-6	CC1=CC(=CC=C1)N=NC2=CC=C(C=C2)N	{1: 1, 34: 2, 30: 1, 14: 8}
Did not match all atoms present	722-25-8	CC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N	{1: 1, 34: 2, 30: 1, 14: 8}
Did not match all atoms present	722-27-0	C1=CC(=CC=C1N)SSC2=CC=C(C=C2)N	{40: 2, 30: 2, 14: 8}
Did not match all atoms present	722-56-5	C1=CC=C(C=C1)[I+]C2=CC=CC=C2.[N+](=O)([O-])[O-]	{19: 1, 14: 10}
Did not match all atoms present	7220-56-6	C1=CC(=C2C(=C1)SC3=C(N2)C=C(C=C3)C(F)(F)F)C(=O)O	{32: 1, 4: 1, 41: 1, 14: 6, 16: 3, 27: 1}
Did not match all atoms present	7220-81-7	COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4[C@@H]5CCO[C@@H]5OC4=C1	{1: 1, 11: 4, 12: 2, 14: 1, 22: 1, 23: 2, 25: 1, 28: 1}
Did not match all atoms present	72200-74-9	CC/C=C/CCOC(=O)C1=CC=CC=C1	{1: 1, 2: 3, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	72207-58-0	CCCCC[C@@H](CCCC)CCC1=CC(=C(C=C1O)CC[C@H](CCCC)CCCCC)O	{1: 4, 2: 18, 3: 2, 21: 2, 14: 2}
Did not match all atoms present	72207-59-1	CC(C)CCCCCCCCCCCCCCCC1=C(C=CC(=C1)O)O	{1: 2, 2: 15, 3: 1, 21: 2, 14: 3}
Did not match all atoms present	72207-94-4	CCOC1=C(C=CC(=C1)C=O)OC(=O)C	{1: 2, 2: 1, 14: 3, 22: 1, 26: 1, 28: 1}
Did not match all atoms present	72207-95-5	C1=CC=C2C(=C1)C(=CC=C2N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-])N/N=C/5\C=CC(=O)C(=C5[O-])C(=O)O.[Na+].[Na+]	{34: 2, 14: 12, 15: 5, 25: 2, 27: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	72207-96-6	CCN(CC)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)N=NC3=CC=CC(=C3)C)C	{1: 4, 2: 2, 34: 4, 14: 11, 33: 1}
Did not match all atoms present	72207-97-7	C1=CC=C(C(=C1)C(F)(F)F)N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])N.[Na+]	{34: 2, 4: 1, 14: 9, 16: 3, 29: 3, 30: 1}
Did not match all atoms present	72207-98-8	CCN(CC1=CC=C(C=C1)S(=O)(=O)[O-])C2=CC=C(C=C2)N=NC3=CC=C(C4=CC=CC=C43)N=NC5=CC(=CC=C5)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 2, 33: 1, 34: 4, 14: 18, 29: 6}
Did not match all atoms present	72207-99-9	CCN(C1=CC=CC=C1NNC2=C3C(=CC(=CC3=O)S(=O)(=O)[O-])C=CC2=N)S(=O)(=O)C4=CC=CC=C4.[Na+]	{1: 1, 2: 1, 36: 1, 33: 1, 14: 13, 15: 5, 25: 1, 29: 5, 31: 2}
Did not match all atoms present	72208-01-6	CN1C[N+](=C(N1C)N=NC2=CC=C(C=C2)N(C)CC3=CC=CC=C3)C.CN1C[N+](=C(N1C)N=NC2=CC=C(C=C2)N(C)CC3=CC=CC=C3)C.Cl[Zn-2](Cl)(Cl)Cl	{1: 8, 2: 2, 33: 8, 11: 2, 34: 4, 14: 18, 15: 2, 17: 4}
Did not match all atoms present	72208-03-8	CCN1/C(=C/C=C/C2=C3C=CC(=CC3=[N+](C=C2)CC)Cl)/SC4=C1C5=CC=CC=C5C=C4.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 3, 2: 2, 6: 3, 33: 2, 41: 1, 14: 15, 15: 1, 17: 1, 29: 3}
Did not match all atoms present	72208-08-3	CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2C)N=NC3C(=NN(C3=O)C4=CC(=C(C=C4Cl)S(=O)(=O)[O-])Cl)C.[Na+]	{1: 3, 2: 1, 35: 1, 33: 2, 12: 1, 34: 2, 14: 10, 15: 1, 17: 2, 25: 1, 29: 5}
Did not match all atoms present	72208-22-1	CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)O)S(=O)(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 1, 2: 12, 35: 2, 33: 2, 41: 1, 12: 1, 14: 10, 20: 7, 25: 2, 27: 1, 29: 2}
Did not match all atoms present	72208-27-6	CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.C1=CC(=CC(=C1)S(=O)(=O)O)N/N=C\2/C=C(C(=CC2=O)O)N=NC3=CC(=CC=C3)S(=O)(=O)O	{1: 4, 34: 5, 7: 2, 14: 26, 15: 3, 20: 3, 25: 1, 29: 4, 30: 2, 31: 3}
Did not match all atoms present	72208-29-8	CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 34: 5, 7: 2, 14: 29, 15: 1, 20: 2, 25: 1, 29: 4, 30: 2, 31: 3}
Did not match all atoms present	72208-33-4	CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)CCC#N)C=C3O2.CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](C)CCC#N)C=C3O2.Cl[Zn-2](Cl)(Cl)Cl	{1: 6, 2: 8, 35: 2, 37: 2, 33: 4, 14: 12, 17: 4, 23: 2}
Did not match all atoms present	72209-26-8	C1CC1NC(=O)[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C3N=CN(C4=N)O)O)O	{33: 2, 35: 2, 36: 1, 11: 2, 12: 5, 14: 2, 20: 2, 21: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	72209-27-9	CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN(C3=N)O)O)O	{1: 1, 2: 1, 35: 2, 36: 1, 33: 2, 12: 4, 14: 2, 20: 2, 21: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	72214-01-8	CCCCC(CC)COS(=O)(=O)[O-]	{1: 2, 2: 5, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	72214-19-8	CCOCCOC1=NC(=NC(=N1)NC2=CC(=C(C=C2)S(=O)(=O)[O-])N=NC3C(=NN(C3=O)C4=CC(=C(C=C4Cl)S(=O)(=O)[O-])Cl)C)Cl.[Na+].[Na+]	{1: 2, 2: 3, 35: 4, 33: 1, 12: 1, 34: 2, 14: 5, 15: 1, 17: 3, 22: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	72214-25-6	CC1(C2=CC=CC=C2[N+](=C1/C=C/C3=CC=C(C=C3)N(C)C)C)C.OP(=O)(O)[O-]	{1: 5, 6: 2, 33: 2, 13: 1, 14: 8, 15: 1, 20: 2, 29: 2}
Did not match all atoms present	7223-30-5	C1=CC=C(C=C1)C#CC(=O)N	{24: 1, 10: 2, 30: 1, 14: 5}
Did not match all atoms present	72230-93-4	CCCCC(CCCC)C1=CC(=NC=C1)C2=NC=CC(=C2)C(CCCC)CCCC	{1: 4, 2: 12, 3: 2, 14: 6, 35: 2}
Did not match all atoms present	72231-00-6	CCC(CO)(CO)CO.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CO)O	{1: 1, 2: 7, 4: 1, 8: 2, 34: 2, 14: 8, 20: 5, 29: 2}
Did not match all atoms present	72231-02-8	CC(CCCCCOC(=O)/C=C/C(=O)O[Sn](OC(=O)/C=C/C(=O)OCCCCCC(C)C)(OC(=O)/C=C/C(=O)OCCCCCC(C)C)C)C	{1: 7, 2: 15, 3: 3, 28: 6, 6: 6}
Did not match all atoms present	72235-52-0	C1=CC(=C(C=C1F)F)CN	{16: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	72235-53-1	C1=CC(=C(C=C1CN)F)F	{16: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	72235-56-4	C1=CC(=C(C=C1CN)Cl)F	{16: 1, 17: 1, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	72244-95-2	CC1CO1.CC(=O)OP(=O)(O)O.C1CO1	{1: 2, 11: 3, 12: 1, 20: 2, 23: 2, 28: 1, 29: 1}
Did not match all atoms present	72245-21-7	C1=CC(=CC(=C1)S(=O)(=O)[O-])N.C1=CC(=CC=C1N)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-].C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)[O-])N.C1=C/C(=N/NC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])/C(=CC1=O)O.[Na+].[Na+].[Na+]	{34: 1, 38: 4, 14: 19, 15: 2, 20: 1, 21: 1, 25: 1, 29: 9, 30: 3, 31: 2}
Did not match all atoms present	72245-28-4	CCC(CC)CCCO[N+](=O)[O-]	{1: 2, 2: 5, 3: 1, 22: 1}
Did not match all atoms present	72245-38-6	CCCCN1C(CC(CC1(C)C)N)(C)C.CC1(CC(CC(N1)(C)C)NCCCCCCN)C.C1(=NC(=NC(=N1)Cl)Cl)Cl	{32: 1, 1: 9, 2: 9, 35: 3, 33: 1, 11: 4, 12: 2, 13: 4, 17: 3, 30: 2, 31: 1}
Did not match all atoms present	72245-47-7	COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\5/C(=CC6=C(C5=O)C=C(C=C6)NC(=O)C7=CC=C(C=C7)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 5, 14: 18, 15: 2, 22: 2, 24: 1, 25: 1, 29: 12, 30: 1, 31: 2}
Did not match all atoms present	72245-50-2	CC1=C(C=CC(=C1)S(=O)(=O)[O-])N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N/NC6=CC=C(C=C6)C(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].C(CO)N(CCO)CCO.[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 6, 33: 1, 34: 2, 14: 15, 15: 4, 20: 3, 24: 2, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	72245-57-9	C1=CC=C(C=C1)N/N=C\2/C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)N/N=C/6\C=CC(=O)C=C6N)S(=O)(=O)O)S(=O)(=O)O	{34: 4, 14: 18, 15: 4, 20: 2, 24: 1, 25: 2, 29: 4, 30: 2, 31: 3}
Did not match all atoms present	72245-59-1	CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\5/C(=CC6=CC(=CC(=C6C5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 14: 12, 15: 4, 22: 1, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	72245-60-4	CCCCC(CC)CNCC(CC)CCCC.C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 4, 2: 10, 3: 2, 34: 3, 14: 13, 15: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	72245-61-5	CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 2, 3: 1, 6: 2, 14: 10, 22: 1, 24: 2, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	72245-63-7	CCN(CCCl)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OCC)CCC(=O)N.CCN(CCCl)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OCC)CCC(=O)N.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 4, 2: 12, 33: 4, 41: 2, 34: 4, 14: 14, 17: 6, 22: 2, 24: 2, 30: 2}
Did not match all atoms present	72247-96-2	CN1C2=C(C=C(C=C2)F)N=C3C1=NC(=O)N(C3=O)C	{1: 2, 35: 2, 33: 2, 14: 3, 16: 1, 25: 2}
Did not match all atoms present	72252-42-7	CCN1C(=S)N(C(=O)C(C1=O)/C=C/C=C/C=C2C(=O)N(C(=S)N(C2=O)CC)CC)CC.CCN1C(=S)N(C(=O)C(C1=O)/C=C/C=C/C=C2C(=O)N(C(=S)N(C2=O)CC)CC)CC.CCN(CC)CC.[Ag+]	{1: 11, 2: 11, 6: 10, 33: 9, 12: 2, 15: 6, 25: 8}
Did not match all atoms present	72252-43-8	CCOC1=CC=C(C=C1)NC=CC2=[N+](C3=CC=CC=C3C2(C)C)C.CC(=O)[O-]	{1: 5, 2: 1, 6: 2, 33: 1, 13: 1, 14: 8, 15: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	72252-44-9	CCN(CCCl)C1=CC(=C(C=C1)/C=C/C2=[N+](C3=CC=CC=C3C2(C)C)C)C.CC(=O)[O-]	{1: 6, 2: 3, 6: 2, 33: 2, 13: 1, 14: 7, 15: 1, 17: 1, 24: 1}
Did not match all atoms present	72252-45-0	CC(=O)[O-].CC1(C2=CC=CC=C2[N+](=C1C=CC3=CC=C(C=C3)N(C)CCCl)C)C	{1: 5, 2: 2, 6: 2, 33: 2, 13: 1, 14: 8, 15: 1, 17: 1, 24: 1}
Did not match all atoms present	72252-48-3	C1=CC(=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C(=O)[O-].[K+]	{4: 1, 14: 7, 16: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	72254-58-1	CC1=C2C3=CC=CC=C3NC2=CC(=N1)N.CC(=O)O	{32: 1, 1: 2, 35: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	72259-17-7	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)Cl)NC4=CC(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])C5=CC(=C(C=C5Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 4, 33: 1, 12: 1, 14: 9, 15: 1, 17: 3, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	72259-65-5	CCCCCCCCCCCCCCOC(=O)CS[Sn](CCCC)(SCC(=O)OCCCCCCCCCCCCCC)SCC(=O)OCCCCCCCCCCCCCC	{40: 3, 1: 4, 2: 45, 28: 3}
Did not match all atoms present	72259-80-4	CC(C1C/C(=C\C2=CC=C(C=C2)N=[N+]=[N-])/C(=O)/C(=C/C3=CC=C(C=C3)N=[N+]=[N-])/C1)(C)C	{1: 3, 34: 4, 4: 1, 6: 2, 11: 2, 12: 1, 14: 8, 15: 2, 25: 1}
Did not match all atoms present	72259-82-6	C1COCCN1CCCNC(=S)S	{33: 1, 2: 3, 7: 1, 11: 4, 23: 1, 39: 1, 31: 1}
Did not match all atoms present	72259-83-7	C1COCCN1CCCN.C1COCCN1CCCNC(=S)S	{33: 2, 2: 6, 7: 1, 11: 8, 23: 2, 39: 1, 30: 1, 31: 1}
Did not match all atoms present	72259-86-0	CC1=C(C=C(C=C1)N=C=O)N=C=O.CN(CCO)CCO.C1CCC(=O)NCC1	{32: 1, 1: 2, 2: 4, 33: 1, 8: 2, 11: 5, 34: 2, 14: 3, 20: 2, 25: 1, 29: 2}
Did not match all atoms present	72259-87-1	CCO[Si](C=C)(OCC)OCC.C[Si](Cl)(Cl)Cl.C(CO)O	{1: 4, 2: 5, 5: 1, 6: 1, 17: 3, 20: 2, 22: 3}
Did not match all atoms present	72264-74-5	C1=CC(=CC(=C1)S(=O)(=O)[O-])NC2=NC(=NC(=N2)Cl)NC3=CC(=CC(=C3)N=NC4=C(C=C\5C(=C4[O-])C=CC(=O)/C5=N\NC6=C(C7=C(C=C(C=C7C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{34: 3, 35: 3, 14: 13, 15: 1, 17: 1, 25: 1, 29: 18, 31: 3}
Did not match all atoms present	72269-38-6	CC(C)CC1=CC(=CC=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 2, 2: 1, 3: 1, 14: 14, 22: 3, 29: 1}
Did not match all atoms present	72269-47-7	CCN(CC[N+](C)(C)CC(C)O)C1=CC=CC=C1.CCN(CC[N+](C)(C)CC(C)O)C1=CC=CC=C1.[O-]S(=O)(=O)[O-]	{1: 8, 2: 8, 3: 2, 33: 2, 14: 10, 20: 2, 29: 4}
Did not match all atoms present	72269-49-9	[Li+].CC\1=NN(C(=N)/C1=N/NC2=CC(=C(C=C2Cl)S(=O)(=O)[O-])Cl)C3=CC=CC=C3.[Na]	{1: 1, 34: 1, 35: 1, 36: 1, 33: 1, 14: 7, 15: 3, 17: 2, 29: 3, 31: 1}
Did not match all atoms present	72269-50-2	C1=CC=C(C=C1)C(=O)NC2=C(C=C3C(=C2)C=CC(=C3O)S(=O)(=O)O)S(=O)(=O)O	{14: 9, 20: 2, 21: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	72269-54-6	CC(C)(C)C1=CC=CC=C1CC#N	{1: 3, 2: 1, 4: 1, 37: 1, 14: 4}
Did not match all atoms present	72269-55-7	C1=CC=C(C=C1)OCC(=O)OCCN(CCC#N)C2=CC=C(C=C2)N=NC3=CC=C(C=C3)[N+](=O)[O-]	{33: 1, 2: 5, 37: 1, 38: 1, 34: 2, 14: 13, 22: 1, 28: 1}
Did not match all atoms present	72269-56-8	CN(C1=CC2=C(C=C1)C=C(/C(=N/NC3=C(C=C(C=C3)OC)S(=O)(=O)O)/C2=O)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O	{1: 2, 2: 2, 33: 1, 34: 1, 14: 7, 15: 2, 20: 3, 22: 2, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	72269-60-4	C1=CC(=CC=C1N)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)[O-])C=CC2=N.[Na+]	{36: 1, 14: 8, 15: 5, 25: 1, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	72269-62-6	CC1=CC=C(C=C1)[O-].CC1=CC=C(C=C1)[O-].CC1=CC=C(C=C1)[O-].[Al+3]	{1: 3, 14: 12}
Did not match all atoms present	7227-91-0	CN(C)N=NC1=CC=CC=C1	{1: 2, 34: 2, 14: 5, 33: 1}
Did not match all atoms present	7227-92-1	CN(C)N=NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 34: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	7227-96-5	COCCO[Al].COCCO[Al](OCCOC)OCCOC	{1: 4, 2: 8, 22: 8}
Did not match all atoms present	72275-67-3	CC([C@@H]1CC[C@H]([C@H](O1)O[C@@H]2[C@H]([C@@H]([C@@H]([C@H]([C@H]2O)N(C)C(=O)CN)OC)O)N)N)N.OS(=O)(=O)O.OS(=O)(=O)O	{1: 3, 2: 1, 3: 1, 33: 1, 11: 2, 12: 9, 20: 6, 22: 2, 23: 1, 24: 1, 29: 4, 30: 4}
Did not match all atoms present	72275-80-0	B(O)(O)O.CC(CC(C)(C)O)O.C1=CC=C(C(=C1)O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 20: 5, 21: 2}
Did not match all atoms present	72275-96-8	C1=CC=C2C(=C1)/C(=C\3/C=C4C5=C(C=C(C=C5)Cl)C(=O)C6=C4C(=C(C=C6)Br)S3=O)/C7=C(C2=O)C=C(C=C7)Cl	{14: 13, 15: 3, 17: 2, 18: 1, 25: 2, 29: 1}
Did not match all atoms present	72275-97-9	C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)O)NCO)O	{2: 1, 14: 4, 20: 1, 21: 2, 25: 2, 30: 1, 31: 1}
Did not match all atoms present	72276-05-2	CN(CCOC(=O)C=C)S(=O)(=O)CCC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 10, 5: 1, 6: 1, 33: 1, 16: 21, 28: 1, 29: 2}
Did not match all atoms present	72276-06-3	CN(CCOC(=O)C=C)S(=O)(=O)CCC(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 12, 5: 1, 6: 1, 33: 1, 16: 25, 28: 1, 29: 2}
Did not match all atoms present	72276-07-4	CN(CCOC(=O)C=C)S(=O)(=O)CCC(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 14, 5: 1, 6: 1, 33: 1, 16: 29, 28: 1, 29: 2}
Did not match all atoms present	72276-08-5	CN(CCOC(=O)C=C)S(=O)(=O)CCC(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 16, 5: 1, 6: 1, 33: 1, 16: 33, 28: 1, 29: 2}
Did not match all atoms present	7228-38-8	C1OC2=C(O1)C=C(C=C2)Cl	{17: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	7228-47-9	CC(C1=CC2=CC=CC=C2C=C1)O	{1: 1, 3: 1, 20: 1, 14: 7}
Did not match all atoms present	72282-75-8	C1CC2CCC1N3N2CC4=CC=CC=C4C3	{33: 2, 11: 6, 12: 2, 14: 4}
Did not match all atoms present	72283-33-1	C1=CC=C(C=C1)OCCOP(=O)([O-])[O-].[Na+].[Na+]	{2: 2, 22: 2, 14: 5, 29: 3}
Did not match all atoms present	72283-34-2	CCCCOCCOP(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 2: 5, 29: 3, 22: 2}
Did not match all atoms present	72283-38-6	CCCCCCCCC(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C(CNCCNCCN)N	{1: 3, 2: 14, 4: 1, 11: 1, 12: 1, 14: 8, 17: 1, 21: 2, 23: 1, 27: 1, 30: 2, 31: 2}
Did not match all atoms present	72283-40-0	CCCCOCCOP(=O)(O)O.C(CO)NCCO	{1: 1, 2: 9, 20: 4, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	72283-41-1	CCCCOCCOP(=O)(O)O.C(CO)N(CCO)CCO	{1: 1, 2: 11, 33: 1, 20: 5, 22: 2, 29: 1}
Did not match all atoms present	72283-42-2	C1=CC=C(C=C1)OCCOP(=O)(O)O.C(CO)NCCO	{2: 6, 14: 5, 20: 4, 22: 2, 29: 1, 31: 1}
Did not match all atoms present	72286-34-1	C1CSC(NC1=O)C2=CC=CC=C2	{32: 1, 41: 1, 11: 2, 12: 1, 14: 5, 25: 1}
Did not match all atoms present	723-46-6	CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 1, 14: 5, 23: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	723-62-6	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)O	{27: 1, 14: 9}
Did not match all atoms present	723-89-7	C1=CC=C(C=C1)N2C3=CC=CC=C3C(=O)C2=O	{25: 2, 14: 9, 33: 1}
Did not match all atoms present	72302-06-8	CC1=CC=C(C=C1)S(=O)(=O)O.CN1C(=N)C=CC2=NN(N=C21)C3=CC=C(C=C3)OC	{1: 3, 35: 2, 36: 1, 33: 2, 14: 10, 20: 1, 22: 1, 29: 2}
Did not match all atoms present	72318-77-5	CCC=C.CCN(CC)O.C[Si]1(O[Si]O[Si]O[Si](O1)(C)C)C	{1: 7, 2: 3, 5: 1, 6: 1, 33: 1, 20: 1, 23: 4}
Did not match all atoms present	72318-78-6	CCN(CC)O.C[Si]1(O[Si](O[Si](O1)(C)C)(C)C)C.C[Si]1(O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)C.C[Si](C)(C)N[Si](C)(C)C	{1: 22, 2: 2, 33: 1, 20: 1, 23: 7, 31: 1}
Did not match all atoms present	72318-88-8	CC(C)(C1=CC(=C(C(=C1)Br)O)Br)C2=CC(=C(C(=C2)Br)O)Br.C1C(O1)CC2(C(O2)C3=CC=CC=C3Br)CCl	{1: 2, 2: 2, 4: 1, 11: 1, 12: 2, 13: 1, 14: 8, 17: 1, 18: 5, 21: 2, 23: 2}
Did not match all atoms present	72318-99-1	C[Si](C)(C)N[Si](C)(C)C.N.O=[Si]=O	{1: 6, 29: 2, 31: 1}
Did not match all atoms present	72319-11-0	[H+].[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-].[Fe+2]	{17: 2, 34: 4, 14: 18}
Did not match all atoms present	72319-12-1	C=CC1=CC=CC=C1CCl.C=C(C(=C)Cl)Cl	{2: 1, 5: 3, 6: 1, 7: 2, 14: 4, 17: 3}
Did not match all atoms present	72319-13-2	CC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC(=C(C=C4)Cl)C(F)(F)F)/C2=O	{1: 1, 34: 1, 4: 1, 14: 12, 15: 2, 16: 3, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	72319-19-8	C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ni+2]	{29: 6, 14: 6}
Did not match all atoms present	72319-20-1	C1=CC=C(C(=C1)N)SC2=CC=C(C=C2)N.Cl.Cl	{40: 1, 17: 2, 30: 2, 14: 8}
Did not match all atoms present	72319-21-2	C1=CC=C(C(=C1)N)SC2=CC=CC=C2N.Cl.Cl	{40: 1, 17: 2, 30: 2, 14: 8}
Did not match all atoms present	72319-23-4	CCN(CCC#N)C1=CC=C(C=C1)/C=C/C2=[N+](C3=C(C2(C)C)C=C(C=C3)Cl)C.[Cl-]	{1: 4, 2: 3, 37: 1, 6: 2, 33: 2, 13: 1, 14: 7, 15: 1, 17: 2}
Did not match all atoms present	72319-24-5	CC(C)(C1=CC=C(C=C1)OCCCOC2=CC=C(C=C2)C(C)(C)C3=CC=C(C=C3)OCC4CO4)C5=CC=C(C=C5)OCCCOC6=CC=C(C=C6)C(C)(C)C7=CC=C(C=C7)OCC8CO8	{1: 6, 2: 8, 4: 3, 11: 2, 12: 2, 14: 24, 22: 6, 23: 2}
Did not match all atoms present	72320-60-6	CCN1CCN(CC1)C2=NC3=CC=CC=C3C(=C2)C4=CC=CC=C4.Cl.Cl	{1: 1, 2: 1, 35: 1, 33: 2, 11: 4, 14: 10, 17: 2}
Did not match all atoms present	72333-07-4	C1=CC=C(C=C1)OCCOP(=O)(O)O.C(CO)N(CCO)CCO	{33: 1, 2: 8, 14: 5, 20: 5, 22: 2, 29: 1}
Did not match all atoms present	72333-13-2	C(N(CP(=O)(O)[O-])CP(=O)([O-])[O-])P(=O)(O)O.[NH4+].[NH4+].[NH4+]	{33: 1, 2: 3, 20: 3, 29: 6}
Did not match all atoms present	72333-16-5	CC(=O)CC(=O)[C@H](C1=CC=CC=C1)C(=O)N	{1: 1, 2: 1, 3: 1, 14: 5, 24: 3, 30: 1}
Did not match all atoms present	7234-09-5	C[C@@H]([C@@H](C1=CC=CC=C1)OP(=O)(O)O)NC	{1: 2, 3: 2, 14: 5, 20: 2, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	7234-49-3	C(CCC(=O)[O-])CCN.[Na+]	{24: 1, 2: 5, 30: 1}
Did not match all atoms present	72344-34-4	C(=PC(F)(F)F)(F)F	{16: 5, 4: 1, 7: 1}
Did not match all atoms present	72347-84-3	CCCCC(CC)C(=O)OCC(CC)(CO)CO.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 5, 2: 10, 3: 1, 4: 2, 14: 4, 20: 4, 27: 2, 28: 1}
Did not match all atoms present	72347-85-4	CCCCCCCCC(=O)OCC(CC)(CO)CO.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 4, 2: 13, 4: 2, 14: 4, 20: 4, 27: 2, 28: 1}
Did not match all atoms present	7236-30-8	C1=C(C=C(C(=C1[N+](=O)[O-])O)Br)[N+](=O)[O-]	{18: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	7236-47-7	CC(=CC1=CC=CC=C1)CC(=O)N	{1: 1, 2: 1, 6: 1, 7: 1, 14: 5, 24: 1, 30: 1}
Did not match all atoms present	7236-83-1	CN1CCCC1C2=CNC3=CC=CC=C32	{32: 1, 1: 1, 33: 1, 11: 3, 12: 1, 14: 5}
Did not match all atoms present	72361-17-2	COC1=C(C(=C(C=C1)Cl)Cl)OC	{1: 2, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	72361-35-4	CC(C)CCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCCCCC(C)C)C(=O)OCCCCCCCCCCC(C)C	{1: 6, 2: 30, 3: 3, 28: 3, 14: 3}
Did not match all atoms present	72361-37-6	CC(C)(C)C1=C(C(=C(C=C1)O)O)SC2=C(C=CC(=C2O)O)C(C)(C)C	{40: 1, 1: 6, 4: 2, 21: 4, 14: 4}
Did not match all atoms present	72361-38-7	CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C)N=NC3=CC=C(C4=CC=CC=C43)N=NC5=CC(=CC=C5)S(=O)(=O)[O-].[Na+]	{1: 2, 34: 4, 22: 1, 14: 17, 29: 5}
Did not match all atoms present	72361-39-8	CCN(CC[N+]1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=CC(=C(C=C3Cl)S(=O)(=O)N(C)C)Cl.[Cl-]	{1: 3, 2: 3, 33: 3, 34: 2, 14: 11, 17: 3, 29: 2}
Did not match all atoms present	72361-42-3	CC1=NN(C(=CC=C(C#N)C(=S)N2CCCC2)O1)C	{1: 2, 35: 1, 33: 2, 6: 2, 7: 2, 11: 4, 15: 2, 23: 1, 37: 1}
Did not match all atoms present	72361-43-4	CC1=CC=C(C=C1)S(=O)(=O)O.C1COCCN1CCS	{1: 1, 2: 2, 33: 1, 11: 4, 14: 4, 20: 1, 23: 1, 39: 1, 29: 2}
Did not match all atoms present	72361-44-5	CC1(CC(=O)CC(N1)(C)C)C.OS(=O)(=O)O	{32: 1, 1: 4, 11: 2, 13: 2, 20: 2, 25: 1, 29: 2}
Did not match all atoms present	72361-45-6	CC1(CC(CC(N1)(C)C)(C#N)O)C.OS(=O)(=O)O	{32: 1, 1: 4, 37: 1, 11: 2, 13: 3, 20: 3, 29: 2}
Did not match all atoms present	72361-46-7	CC1(CC(CC(N1)(C)C)(C(=O)OC)O)C.OS(=O)(=O)O	{32: 1, 1: 5, 11: 2, 13: 3, 20: 3, 28: 1, 29: 2}
Did not match all atoms present	72361-47-8	CC1(CC(CC([NH2+]1)(C)C)(C(=O)OC)O)C.[Cl-]	{1: 5, 11: 2, 13: 3, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	72361-48-9	CN(CCCCCC(=O)O)S(=O)(=O)C1=CC=CC=C1.C1CCC(CC1)N	{1: 1, 2: 5, 33: 1, 11: 5, 12: 1, 14: 5, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	72361-51-4	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C[Si](C)(CCCCOC1=CC=CC(=C1)N)O[Si](C)(C)CCCCOC2=CC=CC(=C2)N.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 6, 2: 8, 4: 1, 14: 20, 21: 2, 22: 3, 28: 2, 30: 2}
Did not match all atoms present	72361-52-5	CC(=C)C(=O)OCC[N+](C)(C)C.CC(=C)C(=O)OCC[N+](C)(C)C.C=CC(=O)N.[O-]S(=O)(=O)[O-]	{1: 8, 2: 4, 5: 3, 6: 1, 7: 2, 24: 1, 28: 2, 29: 4, 30: 1}
Did not match all atoms present	72361-55-8	COS(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 6, 33: 1, 20: 4, 22: 1, 29: 2}
Did not match all atoms present	72362-98-2	CCCCCCN1[C@H]([C@H]([C@@H]([C@@H](C1=O)C#N)C)N=NC2=CC=C(C=C2)C(=O)NCC=C)O	{1: 2, 2: 6, 5: 1, 6: 1, 33: 1, 12: 4, 34: 2, 14: 4, 20: 1, 24: 1, 25: 1, 37: 1, 31: 1}
Did not match all atoms present	7237-34-5	C1=CC=C(C=C1)[P+](CCO)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{2: 2, 20: 1, 18: 1, 14: 15}
Did not match all atoms present	72378-89-3	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Na].[Sn+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	72379-40-9	C1=C(C2=C(C(=CC(=C2O)Br)N)C(=C1Br)O)N	{18: 2, 30: 2, 21: 2, 14: 2}
Did not match all atoms present	72379-42-1	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC(=O)CCl)S(=O)(=O)[O-])C3=CC(=C(C=C3Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 1, 2: 1, 35: 1, 33: 1, 12: 1, 34: 2, 14: 5, 15: 1, 17: 3, 24: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	72379-43-2	C1=CC2=C(C=C1N)C(=O)/C(=N\NC3=C(C=C(C=C3)NC4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])/C(=C2)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 35: 2, 14: 7, 15: 2, 16: 2, 17: 1, 25: 1, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	72379-44-3	CCOC(=O)C1=C2C3=CC=CC=C3CC4=C(C=C(C(=C42)NC1=O)C)NC5=C(C=C(C=C5)Cl)S(=O)(=O)[O-].[Na+]	{32: 1, 1: 2, 2: 1, 11: 1, 14: 8, 17: 1, 25: 1, 28: 1, 29: 3, 31: 1}
Did not match all atoms present	72379-46-5	CCN(CC[N+](C)(C)N)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])C.[Cl-]	{1: 4, 2: 3, 38: 2, 33: 1, 34: 2, 14: 5, 17: 1, 18: 1, 30: 1}
Did not match all atoms present	72379-50-1	CCN(CC[N+](C)(C)N)C1=CC=C(C=C1)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)N(C)C)Cl.CC(=O)[O-]	{1: 6, 2: 3, 33: 2, 34: 2, 14: 6, 17: 2, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	72379-51-2	CCN(CC[N+](C)(C)N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2Cl)S(=O)(=O)N(C)C)Cl.[Cl-]	{1: 5, 2: 3, 33: 2, 34: 2, 14: 6, 17: 3, 29: 2, 30: 1}
Did not match all atoms present	72379-52-3	C1=CC=C(C=C1)NC2=CC3=[N+](C4=CC(=C5C(=C4N=C3C6=C2C(=CC=C6)S(=O)(=O)[O-])C=CC=C5S(=O)(=O)[O-])NC7=CC=CC=C7)C8=CC=CC=C8.[Na+]	{33: 1, 35: 1, 29: 6, 14: 23, 31: 2}
Did not match all atoms present	72379-53-4	C1=CC(=CC=C1C(=O)[O-])N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NS(=O)(=O)C4=CC(=C(C=C4)[O-])C(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 1, 14: 10, 15: 2, 24: 1, 25: 1, 27: 1, 29: 8, 31: 2}
Did not match all atoms present	72379-54-5	CC\1=CC(=O)C(=C/C1=N/NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N/N=C/4\C(=CC(=O)C(=C4)C(=O)[O-])C)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 10, 15: 6, 24: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	72379-55-6	C1=CC(=C(C=C1N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NS(=O)(=O)C4=CC(=C(C=C4)[O-])C(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/5\C=CC(=O)C(=C5)C(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 12, 15: 4, 24: 1, 25: 2, 27: 1, 29: 11, 31: 3}
Did not match all atoms present	72379-56-7	CCOC1=C(C2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)N/N=C/3\C=C(C(=O)C(=C3)S(=O)(=O)[O-])C(=O)[O-])N/N=C/4\C(=CC5=CC(=CC(=C5C4=O)NS(=O)(=O)C6=CC(=C(C=C6)[O-])C(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 1, 34: 2, 14: 12, 15: 5, 22: 1, 24: 1, 25: 2, 27: 1, 29: 14, 31: 3}
Did not match all atoms present	72379-58-9	CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)/C(=N\NC3=CC(=CC(=C3O)S(=O)(=O)[O-])Cl)/C=C2.[Na+]	{1: 1, 34: 1, 14: 9, 15: 2, 17: 1, 21: 1, 22: 1, 25: 1, 29: 5, 31: 1}
Did not match all atoms present	72379-59-0	C1C2=C(C3=CC=CC=C3C(=C2C4=C(C1=O)C5=C(N4)C6=C(C=C7C=C(C=CC7=C6)OS(=O)(=O)[O-])C8=C5C9=C(N8)C1=CC2=C(CC(=O)C(=C2C=C1C=C9)NC(=O)C1=CC=CC=C1)OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-].[K+].[K+].[K+].[K+]	{32: 2, 11: 2, 14: 18, 15: 2, 22: 4, 24: 1, 25: 2, 29: 12, 31: 1}
Did not match all atoms present	72379-60-3	C1=CC=C2C(=C1)C(=C3C=CC4=C(C3=C2OS(=O)(=O)[O-])NC5=C6C(=C7C(=C45)C8=C9C1=C(C2=C(C3=CC=CC=C3C(=C2C=C1)OS(=O)(=O)[O-])OS(=O)(=O)[O-])NC9=C1C(=C8N7)C(=O)C2=CC=CC=C2C1=O)C(=O)C1=CC=CC=C1C6=O)OS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{32: 3, 25: 4, 22: 4, 14: 20, 29: 12}
Did not match all atoms present	72379-61-4	CC1=NN(C(=O)C1N=NC2=CC(=C3C=C(C=C(C3=C2)S(=O)(=O)[O-])NC4=C(C(=NC(=N4)Cl)Cl)Cl)S(=O)(=O)[O-])C5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 3, 33: 1, 12: 1, 14: 7, 15: 1, 17: 3, 25: 1, 29: 12, 31: 1}
Did not match all atoms present	72379-62-5	CC1=C(C=CC(=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC=C(C=C4)N)S(=O)(=O)[O-])NNC5=CC=C(C=C5)C(=O)N=C6C=CC(=O)C(=C6)C(=O)[O-].[Na+].[Na+]	{1: 1, 34: 2, 14: 18, 15: 4, 24: 3, 25: 2, 29: 3, 30: 1, 31: 4}
Did not match all atoms present	72382-90-2	C1=CC=C2C(=C1)C=CC3=CC4=C5C6=C(C=C4)C=C7C=CC8=CC=CC=C8C7=C6C9=CC=CC=C9C5=C32	{14: 20}
Did not match all atoms present	72382-91-3	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C=C5C=CC6=CC7=C(C8=CC=CC=C8C9=CC=CC=C97)C1=C6C5=C4C2=CC=CC=C21	{14: 24}
Did not match all atoms present	72382-92-4	C1=CC=C2C(=C1)C=C3C=CC4=CC5=CC=CC=C5C6=C4C3=C2C7=CC8=C(C=C76)C9=C1C(=CC2=CC=CC=C29)C=CC2=CC3=CC=CC=C3C8=C21	{14: 26}
Did not match all atoms present	72389-79-8	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)NC6=CC=CC=C6Cl	{1: 2, 2: 2, 33: 1, 13: 1, 14: 14, 17: 1, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	7239-21-6	CN(C)N=NC1=CC=C(C=C1)Br	{1: 2, 18: 1, 34: 2, 14: 4, 33: 1}
Did not match all atoms present	72391-18-5	CC1=CC(=C(C=C1)NC(=NC2=C(C=C(C=C2)C)C)N)C.C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N=NC5=CC=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 34: 9, 6: 2, 7: 1, 14: 28, 20: 4, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	72391-19-6	CC1=CC(=C(C=C1[C@@H](C2=CC=CC=C2)C3=CC(=C(C=C3)N=N[C@H]4C(=NN(C4=O)C5=CC=CC=C5)C)C)C)N=N[C@H]6C(=NN(C6=O)C7=CC=CC=C7)C	{1: 5, 34: 4, 3: 1, 33: 2, 12: 2, 14: 20, 15: 2, 35: 2, 25: 2}
Did not match all atoms present	72391-21-0	CC(C)CC(C1=CC=C(C=C1)S(=O)(=O)O)C(C)CC(C)(C)C.C(CO)N	{1: 6, 2: 4, 3: 3, 4: 1, 14: 4, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	72391-22-1	CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)/C=C(\C)/NC4=CC=C(C=C4)C.[I-]	{1: 3, 2: 1, 33: 1, 6: 1, 7: 1, 41: 1, 14: 10, 19: 1, 31: 1}
Did not match all atoms present	724-13-0	C1CC[C@H]([C@H](C1)N2C=NC3=C2N=CN=C3N)O	{33: 1, 35: 3, 11: 4, 12: 2, 14: 2, 20: 1, 30: 1}
Did not match all atoms present	724-31-2	C1C2=C(C=CC(=C2)Br)C3=CC(=C(C(=C31)Br)N)Br	{18: 3, 11: 1, 30: 1, 14: 4}
Did not match all atoms present	724-34-5	C1=CC=C(C=C1)CSC2=NC=NC3=C2NC=N3	{32: 1, 40: 1, 2: 1, 35: 3, 14: 7}
Did not match all atoms present	724-98-1	C1=CC=C(C=C1)OCC2=CC=CC=C2C(=O)O	{2: 1, 27: 1, 22: 1, 14: 9}
Did not match all atoms present	7240-90-6	C1=CC(=C(C2=C1NC=C2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)Cl)Br	{32: 1, 2: 1, 12: 5, 14: 3, 17: 1, 18: 1, 20: 4, 22: 1, 23: 1}
Did not match all atoms present	72403-03-3	COC1=C(C(=CC=C1)Cl)O	{1: 1, 22: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	72403-27-1	C[Si](C)(CCCCOC1=CC=CC(=C1)N)O[Si](C)(C)CCCCOC2=CC=CC(=C2)N.C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{1: 4, 2: 8, 14: 14, 22: 3, 24: 1, 28: 4, 30: 2}
Did not match all atoms present	72403-31-7	CCCCC(CN=C([O-])/C(=N/NC1=C(C=CC(=C1)S(=O)(=O)N)[O-])/C(=O)C)CC.CCCCC(CN=C([O-])/C(=N/NC1=C(C=CC(=C1)S(=O)(=O)N)[O-])/C(=O)C)CC.[Na+].[Co+3]	{1: 6, 2: 10, 3: 2, 7: 4, 34: 4, 14: 6, 24: 2, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	72403-56-6	CCCCOC(=O)C=C.C=CCCC1=NC(=NC(=N1)N)N.C=CC(=O)O	{1: 1, 2: 5, 35: 3, 5: 3, 6: 3, 27: 1, 28: 1, 30: 2}
Did not match all atoms present	72403-57-7	CCOC(=O)C=C.C=CCCC1=NC(=NC(=N1)N)N.C=CC(=O)O	{1: 1, 2: 3, 35: 3, 5: 3, 6: 3, 27: 1, 28: 1, 30: 2}
Did not match all atoms present	72403-58-8	CCOC(=O)C=C.CC(=C)C(=O)O.C=CCCC1=NC(=NC(=N1)N)N	{1: 2, 2: 3, 35: 3, 5: 3, 6: 2, 7: 1, 27: 1, 28: 1, 30: 2}
Did not match all atoms present	72403-61-3	CN(C)C(=S)N[C@@H]1C[C@H]2C[C@@H]1[C@H]3[C@@H]2CCC3	{1: 2, 33: 1, 11: 5, 12: 5, 7: 1, 31: 1}
Did not match all atoms present	72403-62-4	C1C[C@H]2[C@@H](C1)[C@H]3C[C@@H]2C[C@H]3N=C=S	{8: 1, 34: 1, 11: 5, 12: 5}
Did not match all atoms present	72403-63-5	C1C=C[C@H]2[C@@H]1[C@H]3C[C@@H]2C[C@H]3N=C=S	{8: 1, 34: 1, 11: 3, 12: 5, 14: 2}
Did not match all atoms present	72403-65-7	CCOCCOC1=NC(=NC(=N1)NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=C5C=CC(=CC5=C(C=C4[O-])S(=O)(=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-])Cl.CCOCCOC1=NC(=NC(=N1)NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=C5C=CC(=CC5=C(C=C4[O-])S(=O)(=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+].[Na+].[Cr+3]	{1: 2, 2: 6, 35: 6, 38: 2, 34: 4, 14: 16, 17: 2, 22: 4, 29: 12, 31: 2}
Did not match all atoms present	7241-98-7	COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4C5CCOC5OC4=C1	{1: 1, 11: 4, 12: 2, 14: 1, 22: 1, 23: 2, 28: 2}
Did not match all atoms present	7242-16-2	C1=CC(=CC=C1NC(=O)/C=C\C(=O)O)Cl	{6: 2, 14: 4, 17: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	7242-17-3	C1=CC=C(C=C1)OC(=O)C=CC(=O)OC2=CC=CC=C2	{28: 2, 14: 10, 6: 2}
Did not match all atoms present	72429-02-8	CC(=O)NC1=CC2=C(C=C1)C=C(/C(=N\NC3=CC(=C(C=C3)OC)S(=O)(=O)CCOS(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 2, 34: 1, 14: 7, 15: 2, 22: 2, 24: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	72429-03-9	CC(=CCCC(=CC=NC1=CC=CC=C1)C)C	{1: 3, 2: 2, 6: 3, 7: 2, 34: 1, 14: 5}
Did not match all atoms present	72429-12-0	C1=CC(=C(C=C1Cl)N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=C(C(=NC(=N4)Cl)Cl)Cl)[O-])[O-].C1=CC(=C(C=C1Cl)N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=C(C(=NC(=N4)Cl)Cl)Cl)[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Cr+3]	{34: 4, 35: 4, 14: 12, 17: 8, 29: 12, 31: 2}
Did not match all atoms present	72432-14-5	COC1=CC=C(C=C1)C(=O)NCCCC(=O)O	{1: 1, 2: 3, 14: 4, 22: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	72437-38-8	C(CC1=NC(=NC(=N1)N)N)CC(CCC2=NC(=NC(=N2)N)N)C3=NC(=NC(=N3)N)N.C1(=O)NC(=O)NC(=O)N1	{32: 3, 2: 5, 3: 1, 35: 9, 25: 3, 30: 6}
Did not match all atoms present	7244-67-9	C[C@@H](C(=O)OC)NC(=O)C1=CC=CC=C1	{1: 2, 3: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	7244-78-2	CCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	72443-10-8	C1=CC(=C=[Se])C=C1	{8: 1, 14: 4, 15: 1}
Did not match all atoms present	72447-65-5	CC1(CC#CCC(S1(=O)=O)(C)C)C	{1: 4, 10: 2, 11: 2, 13: 2, 29: 2}
Did not match all atoms present	72447-66-6	CC1(CSCC(C2=C1SS2)(C)C)C	{1: 4, 11: 2, 13: 2, 41: 3}
Did not match all atoms present	72447-67-7	CC1(CS(=O)(=O)CC(C2=C1SS2)(C)C)C	{1: 4, 41: 2, 11: 2, 13: 2, 29: 2}
Did not match all atoms present	72453-56-6	CCCCCCC(=O)NC1=CC=C(C=C1)N([C@H](C)CC)[C@H](C)CC	{1: 5, 2: 7, 3: 2, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	72453-57-7	CCCCCCCCCCCCOC(CCC)N1C(=S)SC(=S)N1	{32: 1, 1: 2, 2: 13, 3: 1, 33: 1, 41: 1, 22: 1}
Did not match all atoms present	72453-58-8	CCC(C)(C)C1=CC=C(C=C1)OC2=C3C4=C(C(=C2)NC5=CC=CC=C5)C(=O)C6=CC=CC=C6C4=C(C(=O)N3)C(=O)C7=CC=CC=C7	{32: 1, 1: 3, 2: 1, 4: 1, 14: 19, 22: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	72453-59-9	[Li+].[Li+].[Li+].[Li+].[Li+].C1=CC2=C(C=C1N)C(=O)/C(=N\NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N/N=C/5\C(=CC6=CC(=CC(=C6C5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=C2)S(=O)(=O)[O-]	{34: 2, 6: 2, 14: 13, 15: 4, 25: 2, 29: 15, 30: 2, 31: 2}
Did not match all atoms present	72454-47-8	C1C=CC2=CC=CC=C21.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 11: 1, 21: 1, 14: 8}
Did not match all atoms present	72454-49-0	C1=CC=C2C(=C1)C3=CC=CC=C3C4=CC=CC=C24.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 21: 1, 14: 14}
Did not match all atoms present	72454-54-7	CC(=O)/C=C/C1=CC=CC=C1Br	{24: 1, 1: 1, 18: 1, 14: 4, 6: 2}
Did not match all atoms present	7246-21-1	CCCC(=O)NC1=C(C=C(C(=C1I)CC(CC)C(=O)[O-])I)I.[Na+]	{1: 2, 2: 4, 3: 1, 14: 1, 19: 3, 24: 2, 31: 1}
Did not match all atoms present	72479-28-8	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3Cl)C4=C(C=CC(=C4)S(=O)(=O)[O-])Cl.[Na+]	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 10, 15: 1, 17: 3, 22: 1, 25: 1, 29: 3}
Did not match all atoms present	72479-29-9	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC(=C(C=C3)[O-])C=NC4=C(C=CC(=C4)S(=O)(=O)[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[Na+].[Na+].[Na+].[Cr+3]	{34: 7, 38: 1, 14: 25, 6: 1, 29: 6}
Did not match all atoms present	72479-31-3	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC(=C(C=C3)[O-])C=NC4=C(C=CC(=C4)S(=O)(=O)[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC(=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[Na+].[Na+].[Na+].[Cr+3]	{34: 7, 38: 1, 14: 23, 6: 1, 29: 6}
Did not match all atoms present	72479-32-4	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])N=NC3=C(C(=CC(=C3)N=NC4=CC=C(C=C4)[N+](=O)[O-])N=NC5=CC(=CC(=C5[O-])[N+](=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+].[Cu+2]	{34: 6, 38: 3, 29: 6, 14: 15, 31: 1}
Did not match all atoms present	72479-34-6	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].[Fe+3]	{1: 1, 34: 2, 35: 1, 38: 1, 33: 1, 14: 7, 29: 3}
Did not match all atoms present	72479-85-7	C1CC(OC1)COP(=O)([O-])[O-].[Na+].[Na+]	{2: 1, 11: 3, 12: 1, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	72479-87-9	C1CC(OC1)COP(=O)([O-])[O-].[K+].[K+]	{2: 1, 11: 3, 12: 1, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	7248-16-0	COC1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2C4=CC=C(C=C4)OC	{1: 2, 35: 2, 22: 2, 14: 12}
Did not match all atoms present	72480-07-0	CC1=C(C=CC(=C1)S(=O)(=O)O)N.C1=CC(=CC(=C1)O)[O-].C1=CC2=C(C(=C1)O)C(=C(C=C2S(=O)(=O)O)S(=O)(=O)O)N.C1=CC(=CC=C1N)[N+](=O)[O-].C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)O)S(=O)(=O)O.C1=C(C=C(C(=C1[N+](=O)[O-])O)N)[N+](=O)[O-].[Na+].[Fe]	{1: 1, 38: 3, 14: 21, 20: 5, 21: 4, 29: 10, 30: 5}
Did not match all atoms present	72480-09-2	CC1=C(C=CC(=C1)S(=O)(=O)O)N.C1=CC(=CC(=C1)O)[O-].C1=CC2=C(C(=C1)O)C(=C(C=C2S(=O)(=O)O)S(=O)(=O)O)N.C1=CC(=CC=C1N)[N+](=O)[O-].C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)O)S(=O)(=O)O.C1=C(C=C(C(=C1[N+](=O)[O-])O)N)[N+](=O)[O-].[Na+]	{1: 1, 38: 3, 14: 21, 20: 5, 21: 4, 29: 10, 30: 5}
Did not match all atoms present	72480-20-7	CCCCCCCCCCCCOP(=O)(OCC(C)C)OCC(C)C	{1: 5, 2: 13, 3: 2, 29: 1, 22: 3}
Did not match all atoms present	72480-22-9	CC(C)CCCCCCCCCCC/C=C/CCCCCCCOP(=O)(O)OCC(C)C	{1: 4, 2: 19, 3: 2, 6: 2, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	72480-24-1	CCCCCCCCCCCCOP(=O)(OCCC(C)C)OCCC(C)C	{1: 5, 2: 15, 3: 2, 29: 1, 22: 3}
Did not match all atoms present	72482-64-5	C1=CC(=C(C=C1F)F)C(=O)Cl	{16: 2, 17: 1, 14: 3, 24: 1}
Did not match all atoms present	72485-26-8	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C6=C(O6)C(C5O)O)C=C2	{20: 2, 23: 1, 12: 2, 14: 8, 15: 2}
Did not match all atoms present	72490-01-8	CCOC(=O)NCCOC1=CC=C(C=C1)OC2=CC=CC=C2	{1: 1, 2: 3, 14: 9, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	72494-14-5	CCCC[C@@H](C(=O)NC1=CC(=C(C=C1)NC(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F)O)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC	{1: 7, 2: 5, 3: 2, 4: 5, 14: 6, 16: 8, 21: 1, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	72496-86-7	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)[O-].CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.[Na+].[Na+].[Fe+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 14: 14, 15: 4, 25: 2, 29: 5, 30: 1}
Did not match all atoms present	72496-87-8	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.[Na+].[Fe+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 14: 14, 15: 4, 25: 2, 29: 4, 30: 2}
Did not match all atoms present	72496-91-4	CC1=NC2=C(N1NC3=CC=CC=C3Cl)C4=C(C=C2)C=C(/C(=N/NC5=C(C=CC(=C5)NC(=O)C(=C)Br)S(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 35: 1, 5: 1, 7: 1, 14: 10, 15: 2, 17: 1, 18: 1, 24: 1, 25: 1, 33: 1, 29: 6, 31: 3}
Did not match all atoms present	725-00-8	CCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 2, 6: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	725-04-2	CC(=O)NC1=C(C=C(C=C1)C2=CC=CC=C2)F	{16: 1, 1: 1, 31: 1, 14: 8, 24: 1}
Did not match all atoms present	725-06-4	CC(=O)NC1=CC=C(C=C1)C2=CC(=CC=C2)F	{16: 1, 1: 1, 31: 1, 14: 8, 24: 1}
Did not match all atoms present	725-12-2	C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CC=C3	{35: 2, 14: 10, 23: 1}
Did not match all atoms present	725-89-3	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)O	{16: 6, 27: 1, 4: 2, 14: 3}
Did not match all atoms present	725-92-8	CCOC(=O)C1=CC(=O)C=C(O1)C(=O)OCC	{1: 2, 2: 2, 14: 2, 23: 1, 25: 1, 28: 2}
Did not match all atoms present	7250-60-4	C1=CC=C(C(=C1)C(=O)[O-])Cl.C1=CC=C(C(=C1)C(=O)[O-])Cl.[Ni+2]	{24: 2, 17: 2, 14: 8}
Did not match all atoms present	7250-70-6	CC1=CC=CC=C1N2CCCCC2	{1: 1, 11: 5, 14: 4, 33: 1}
Did not match all atoms present	7250-71-7	CC(=O)OCC(COC1=CC=CC=C1)OC(=O)C	{1: 2, 2: 2, 3: 1, 14: 5, 22: 1, 28: 2}
Did not match all atoms present	7250-94-4	CC(=O)C1=CC=CC=C1OC(=O)C	{24: 1, 1: 2, 28: 1, 14: 4}
Did not match all atoms present	72505-21-6	C1=CC(=CC=C1C(=S)N)C(F)(F)F	{16: 3, 4: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	72506-83-3	CC(CNC1=CC=C(C=C1)Cl)O	{1: 1, 2: 1, 3: 1, 14: 4, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	72509-80-9	CCCCCCCC/C=C/CCCCCCCCOP(=O)(OCC(C)C)OCC(C)C	{1: 5, 2: 17, 3: 2, 6: 2, 22: 3, 29: 1}
Did not match all atoms present	72509-81-0	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)Cl)[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)Cl)[O-])[O-])C3=CC(=CC=C3)S(=O)(=O)N.[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 15, 17: 2, 29: 2, 30: 1}
Did not match all atoms present	7251-36-7	C1=CC=C2C(=C1)N=CC(=N2)C(Br)(Br)Br	{18: 3, 35: 2, 4: 1, 14: 5}
Did not match all atoms present	7251-61-8	CC1=NC2=CC=CC=C2N=C1	{1: 1, 35: 2, 14: 5}
Did not match all atoms present	7252-86-0	CC(C)(C)C1=CC=C(C=C1)SC	{40: 1, 1: 4, 4: 1, 14: 4}
Did not match all atoms present	72520-94-6	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.O.O.O.O.[Ce+3].[Ce+3]	{24: 3}
Did not match all atoms present	72537-17-8	C1=C(C=NC(=C1Cl)F)C(F)(F)F	{16: 4, 17: 1, 35: 1, 4: 1, 14: 2}
Did not match all atoms present	72558-82-8	CC(C)(C(=O)O)ON=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC=C4)C(=O)[O-]	{1: 2, 2: 1, 35: 1, 4: 1, 33: 2, 7: 1, 41: 2, 11: 1, 12: 2, 34: 1, 14: 6, 15: 2, 22: 1, 24: 2, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	7256-20-4	CCN1C2=C(C(=NC(=N2)N)N)N=N1	{1: 1, 2: 1, 35: 4, 30: 2, 33: 1}
Did not match all atoms present	72571-82-5	CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)O.O.O.O	{32: 1, 1: 1, 2: 1, 35: 2, 33: 2, 11: 4, 14: 2, 25: 1, 27: 1}
Did not match all atoms present	7258-22-2	C1=CC=C(C(=C1)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Zn+2]	{17: 4, 34: 1, 14: 4}
Did not match all atoms present	7258-52-8	C1CC2=C(C1)C3=C(C=C2)C=CC4=CC=CC=C43	{11: 3, 14: 8}
Did not match all atoms present	7258-91-5	C1CC2=C3C1=CC=CC3=C4C=C5C=CC6=CC=CC=C6C5=CC4=C2	{11: 2, 14: 12}
Did not match all atoms present	72586-67-5	CC(=O)C1=CC=C(C=C1)NC(=O)N(C)N=O	{1: 2, 34: 1, 33: 1, 14: 4, 24: 2, 29: 1, 31: 1}
Did not match all atoms present	72586-68-6	CN(C1=CC=CC=C1)C(=O)N(C)N=O	{1: 2, 34: 1, 33: 2, 14: 5, 24: 1, 29: 1}
Did not match all atoms present	7259-89-4	C1=C(C=C(C=C1C(=O)OCCO)[N+](=O)[O-])C(=O)OCCO	{28: 2, 2: 4, 20: 2, 38: 1, 14: 3}
Did not match all atoms present	72595-17-6	CCN(CCC(=O)OC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)NC(=O)C	{1: 3, 2: 3, 37: 1, 38: 1, 33: 1, 34: 2, 14: 6, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	72595-96-1	CCOC1=CC(=C(C=C1)N)N.Cl[Pt]Cl	{1: 1, 2: 1, 14: 3, 17: 2, 22: 1, 30: 2}
Did not match all atoms present	72595-97-2	COC1=CC(=C(C=C1)N)N.Cl[Pt]Cl	{1: 1, 30: 2, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	72595-99-4	COC(=O)C1=CC(=C(C=C1)N)N.[Cl-].[Cl-].[Pt+2]	{1: 1, 28: 1, 30: 2, 14: 3, 17: 2}
Did not match all atoms present	72596-00-0	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)N)N.[Cl-].[Cl-].[Pt+2]	{24: 1, 17: 2, 30: 2, 14: 8}
Did not match all atoms present	72596-01-1	C1=C(C(=C(C(=C1Cl)Cl)Cl)N)N.[Cl-].[Cl-].[Pt+2]	{17: 5, 30: 2, 14: 1}
Did not match all atoms present	72596-02-2	C1=CC(=C(C=C1[N+](=O)[O-])[NH-])[NH-].Cl[Pt+2]Cl	{17: 2, 36: 2, 38: 1, 14: 3}
Did not match all atoms present	726-17-0	C1=CC(=CC=C1CC2=CC=C(C=C2)[N+](=O)[O-])N	{2: 1, 38: 1, 30: 1, 14: 8}
Did not match all atoms present	726-25-0	C1=CC=C(C=C1)CNC(=S)NC2=CC=CC=C2	{2: 1, 31: 2, 14: 10, 7: 1}
Did not match all atoms present	726-26-1	C1=CC=C(C=C1)CCC(=O)OC2=CC=CC=C2	{2: 2, 28: 1, 14: 10}
Did not match all atoms present	726-42-1	CC1=CC=C(C=C1)N=C=NC2=CC=C(C=C2)C	{8: 1, 1: 2, 34: 2, 14: 8}
Did not match all atoms present	726-44-3	C1=CC=C(C=C1)OCCCOC2=CC=CC=C2	{2: 3, 22: 2, 14: 10}
Did not match all atoms present	7260-11-9	C1=CC=C(C=C1)OC(=O)C2=CC3=CC=CC=C3C=C2O	{28: 1, 21: 1, 14: 11}
Did not match all atoms present	7261-97-4	C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]	{32: 1, 33: 1, 34: 1, 38: 1, 6: 1, 11: 1, 14: 6, 23: 1, 25: 2}
Did not match all atoms present	72619-34-2	CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)C(C)C(=O)O)C(=O)C2	{1: 2, 3: 1, 11: 1, 14: 6, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	7262-34-2	C[Sn](C)C.C[Sn](C)C.[Se]	{1: 6}
Did not match all atoms present	7262-75-1	CN(C)[C@H](CC1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 14: 10, 33: 1}
Did not match all atoms present	72620-20-3	CC1=C(C(=CC=C1)OCC(CNC(C)(C)C)O)[N+](=O)[O-]	{1: 4, 2: 2, 3: 1, 4: 1, 38: 1, 14: 3, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	72623-67-7	CCCCC(CC)COP(=O)(O)O.CC1CO1.C1CO1	{1: 3, 2: 5, 3: 1, 11: 3, 12: 1, 20: 2, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	72623-82-6	CCCCCCCCCCCCCCCC1=[N+](CCN1CCCCCCCCCCCCCCC)C.COS(=O)(=O)[O-]	{1: 4, 2: 28, 33: 2, 11: 2, 15: 1, 22: 1, 29: 3}
Did not match all atoms present	72624-00-1	C=O.C(CO)NCCO	{2: 4, 20: 2, 5: 1, 31: 1}
Did not match all atoms present	7263-60-7	[2H]C([2H])([2H])[O]	{1: 1, 29: 1}
Did not match all atoms present	72639-24-8	CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=CC(=C(C=C2N=NC3=CC(=C4C=C(C=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N)Cl.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 35: 2, 14: 6, 17: 1, 29: 14, 30: 1, 31: 1}
Did not match all atoms present	72639-25-9	CC1=C(C=CC(=C1)S(=O)(=O)[O-])N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=C(C=CC(=C3)NC4=NC(=NC(=C4Cl)C)S(=O)(=O)C)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 3, 34: 2, 35: 3, 33: 1, 12: 1, 14: 6, 15: 1, 17: 1, 24: 1, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	72639-27-1	CC[N+]1=C(C2=CC=CC3=C2C1=CC=C3)C4=CC5=C(C=C4)N(C(CC5C)(C)C)CCO.CC(=O)[O-]	{1: 5, 2: 3, 33: 2, 11: 1, 12: 1, 13: 1, 14: 9, 15: 1, 20: 1, 24: 1}
Did not match all atoms present	72639-28-2	COC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC5=C(C=C4)NC(=O)NC5=O)/C2=O	{32: 2, 1: 1, 34: 1, 14: 12, 15: 2, 22: 1, 24: 1, 25: 3, 31: 2}
Did not match all atoms present	72639-30-6	CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)NC(=O)C3=CC4=C(C=C3)N=C(C(=N4)Cl)Cl)S(=O)(=O)[O-])CC(=O)[O-].[Na+].[Na+]	{1: 1, 2: 1, 35: 3, 33: 1, 12: 1, 34: 2, 14: 6, 15: 1, 17: 2, 24: 2, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	72639-32-8	CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=CC3=C(C=C2)C(=O)/C(=N/NC4=C(C5=CC(=CC(=C5C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 1, 35: 2, 14: 8, 15: 2, 17: 1, 25: 1, 29: 14, 31: 2}
Did not match all atoms present	72639-33-9	CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=C(C=C(C(=C2)NC3=CC(=C(C4=C3C(=O)C5=CC=CC=C5C4=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[K+].[K+].[K+]	{1: 2, 35: 2, 14: 7, 17: 1, 25: 2, 29: 11, 30: 1, 31: 2}
Did not match all atoms present	72639-34-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C5=CC6=C(C=C5)N=C(C(=N6)Cl)Cl)S(=O)(=O)[O-])N.[Na+].[Na+].[Na+]	{35: 2, 14: 10, 17: 2, 24: 1, 25: 2, 29: 9, 30: 1, 31: 2}
Did not match all atoms present	72639-35-1	CCS(=O)(=O)C1=NC2=C(S1)C=C(C=C2)N=NC3C(=NN(C3=O)CCC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{1: 1, 2: 3, 35: 2, 33: 1, 41: 1, 12: 1, 34: 2, 14: 3, 15: 1, 24: 2, 25: 1, 29: 2}
Did not match all atoms present	72639-36-2	CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=CC=CC=C4S(=O)(=O)[O-])/C3=O)S(=O)(=O)[O-])Cl.[Na+].[K+].[K+]	{1: 2, 34: 1, 35: 2, 14: 7, 15: 2, 17: 1, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	72639-38-4	CC1=NN(C(=O)C1N=NC2=CC=CC=C2C(=O)[O-])C3=CC=CC=C3Cl.[Na+]	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 8, 15: 1, 17: 1, 24: 1, 25: 1}
Did not match all atoms present	72659-67-7	CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=C3C(=C(C=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=CC=CC=C4S(=O)(=O)[O-])/C3=O)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 2, 34: 1, 35: 2, 14: 7, 15: 2, 17: 1, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	72659-69-9	CCOC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=C(C=CC(=C4)S(=O)(=O)NCCNS(=O)(=O)C5=CC(=C(C=C5)OC)N/N=C\6/C(=O)C(=CC7=CC=CC=C67)C(=O)NC8=CC=C(C=C8)OCC)OC)/C2=O	{1: 4, 2: 4, 34: 2, 14: 24, 15: 4, 22: 4, 24: 2, 25: 2, 29: 4, 31: 6}
Did not match all atoms present	72659-71-3	CC1=CC(=C(C(=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])C)CN(C)C5=C(C(=NC(=N5)F)F)Cl)S(=O)(=O)[O-].[Na+].[Na+]	{1: 3, 2: 1, 35: 2, 33: 1, 14: 6, 16: 2, 17: 1, 25: 2, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	72661-33-7	[CH3-].C#[C-].[U+2]	{9: 1}
Did not match all atoms present	72662-55-6	CC(C)N1CCCN(C(=S)C1=S)C(C)C	{11: 3, 1: 4, 3: 2, 33: 2, 15: 2}
Did not match all atoms present	72667-36-8	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N(CCCN)CCCl	{33: 1, 2: 5, 35: 1, 14: 8, 17: 1, 30: 1}
Did not match all atoms present	72672-54-9	CCC(C)C1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C(C)CC)C(C)(C)C)O	{1: 10, 2: 3, 3: 2, 4: 2, 14: 4, 21: 2}
Did not match all atoms present	72672-55-0	CCC(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)C2=C(C(=CC(=C2)C(C)CC)C(C)(C)C)O	{1: 11, 2: 2, 3: 3, 4: 2, 14: 4, 21: 2}
Did not match all atoms present	72676-73-4	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(C)C)/C(=C/[N+]#N)/[O-]	{1: 3, 2: 1, 3: 2, 6: 1, 7: 1, 34: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	72676-74-5	CC[C@@H](C)[C@H](/C(=C/[N+]#N)/[O-])NS(=O)(=O)C1=CC=C(C=C1)C	{1: 3, 2: 1, 3: 2, 6: 1, 7: 1, 34: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	72676-77-8	CC1=CC=C(C=C1)S(=O)(=O)NCCCCC/C(=C/[N+]#N)/[O-]	{1: 1, 2: 5, 6: 1, 7: 1, 34: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	72676-78-9	CC[C@@H](C)[C@H](C(=O)CCl)NS(=O)(=O)C1=CC=C(C=C1)C	{1: 3, 2: 2, 3: 2, 14: 4, 17: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	72678-19-4	C1=C(C=C(C(=C1Br)N)Br)C(F)(F)F	{16: 3, 18: 2, 4: 1, 30: 1, 14: 2}
Did not match all atoms present	72679-97-1	C1=CC=C2C(=C1)N(C(=O)S2)CO	{33: 1, 2: 1, 41: 1, 14: 4, 20: 1, 25: 1}
Did not match all atoms present	727-49-1	C12=C(C(=C(C(=C1F)O)F)F)C(=C(C(=C2F)F)F)F	{16: 7, 21: 1}
Did not match all atoms present	727-99-1	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 9}
Did not match all atoms present	72705-22-7	CC1=CC(=C(C=C1S(=O)(=O)[O-])OC)NC(=O)CC(=O)C.[NH4+]	{1: 3, 2: 1, 14: 2, 22: 1, 24: 2, 29: 3, 31: 1}
Did not match all atoms present	72714-63-7	C1=CC(=CC(=C1)OC2=CC=C(C=C2)Cl)CO	{17: 1, 2: 1, 20: 1, 22: 1, 14: 8}
Did not match all atoms present	72727-59-4	CC(C)(CC1=CC=CC=C1)C(OC)OC	{1: 4, 2: 1, 3: 1, 4: 1, 14: 5, 22: 2}
Did not match all atoms present	72727-62-9	CC(C(C)(C)CC1=CC=CC=C1)OC(=O)C	{1: 4, 2: 1, 3: 1, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	72727-63-0	C=CCCCCCCCCC(=O)OCCC1=CC=CC=C1	{2: 10, 14: 5, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	72727-68-5	CC(CC1CC2CCC1C2)C=NC3=CC=CC=C3C(=O)OC	{1: 2, 2: 1, 3: 1, 6: 1, 11: 4, 12: 3, 34: 1, 14: 4, 28: 1}
Did not match all atoms present	72727-69-6	CC1=CC(=C(C=C1Br)Br)OCC2CO2	{1: 1, 2: 1, 11: 1, 12: 1, 14: 2, 18: 2, 22: 1, 23: 1}
Did not match all atoms present	72727-70-9	CCCC(=O)OC1=CC=C(C=C1)CCC(=O)C	{24: 1, 1: 2, 2: 4, 28: 1, 14: 4}
Did not match all atoms present	72727-73-2	CN(CCC#N)C1=NC(=NC(=N1)NC2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)N(C)CCC#N)NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 2: 4, 35: 6, 37: 2, 6: 2, 33: 2, 14: 12, 29: 18, 31: 4}
Did not match all atoms present	72731-15-8	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C=C(C#N)C#N	{37: 2, 14: 9, 6: 1, 7: 1}
Did not match all atoms present	72732-50-4	CC1=CC(=C(C=C1O)C(C)C)OCCNC	{1: 4, 2: 2, 3: 1, 14: 2, 21: 1, 22: 1, 31: 1}
Did not match all atoms present	72738-89-7	CCCCCCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42	{1: 1, 2: 5, 35: 1, 14: 12, 29: 2, 31: 2}
Did not match all atoms present	72738-90-0	COC(=O)NC1=CC=CC2=NC3=CC=CC=C3C(=C21)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 2, 35: 1, 14: 11, 28: 1, 29: 2, 31: 3}
Did not match all atoms present	72738-98-8	CS(=O)(=O)NC1=C(C=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 11, 29: 2, 31: 2}
Did not match all atoms present	72739-00-5	CS(=O)(=O)NC1=C(C=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42)N	{1: 1, 35: 1, 14: 11, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	72749-62-3	CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)OS(=O)(=S)[O-])OC)C3=CC=CC=C3.[Na+]	{1: 2, 34: 2, 35: 1, 33: 1, 12: 1, 14: 8, 15: 1, 22: 2, 25: 1, 29: 2}
Did not match all atoms present	72749-63-4	CCOP(=O)(CO)OCCOC(=O)N	{1: 1, 2: 4, 20: 1, 22: 2, 28: 1, 29: 1, 30: 1}
Did not match all atoms present	72749-64-5	COC1=C(C=C(C=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O	{1: 1, 2: 2, 34: 1, 14: 7, 15: 2, 20: 3, 22: 2, 25: 1, 29: 8, 31: 1}
Did not match all atoms present	72749-67-8	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=[N+](C=NN3C)C.CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=[N+](C=NN3C)C.[O-]S(=O)(=O)[O-]	{1: 6, 2: 6, 35: 2, 33: 6, 34: 4, 14: 20, 28: 2, 29: 4}
Did not match all atoms present	72749-69-0	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN(C=[N+]3C)C.OS(=O)(=O)[O-]	{1: 3, 2: 3, 35: 1, 33: 3, 34: 2, 14: 10, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	72749-71-4	CCC1=NN(N=C1C)C2=CC3=C(C=C2)C=C(C(=O)O3)N4C=[N+](C=N4)C.CCC1=NN(N=C1C)C2=CC3=C(C=C2)C=C(C(=O)O3)N4C=[N+](C=N4)C.[O-]S(=O)(=O)[O-]	{1: 6, 2: 2, 35: 6, 33: 6, 14: 12, 28: 2, 29: 4}
Did not match all atoms present	72749-73-6	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=NC(=NS2)C3=CC=CC=C3.[O-]S(=O)(=O)[O-]	{1: 4, 2: 3, 35: 2, 33: 1, 41: 1, 34: 2, 14: 9, 29: 4}
Did not match all atoms present	72749-74-7	CCC1=NN(N=C1C)C2=CC3=C(C=C2)C=C(C(=O)O3)N4C=[N+](C=N4)C.OS(=O)(=O)[O-]	{1: 3, 2: 1, 35: 3, 33: 3, 14: 6, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	72749-75-8	CCC1=NN(N=C1C)C2=CC3=C(C=C2)C=C(C(=O)O3)N4C=[N+](C=N4)C.[Cl-]	{1: 3, 2: 1, 35: 3, 33: 3, 14: 6, 17: 1, 28: 1}
Did not match all atoms present	72749-76-9	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N=NC3=C4C=C(C=CC4=C(C=C3)N/N=C/5\C(=CC6=CC(=CC(=C6C5=O)N=NC7=C/C(=N/NC8=CC=C(C=C8)[N+](=O)[O-])/C(=O)C=C7O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 6, 38: 1, 14: 20, 15: 5, 20: 1, 25: 2, 29: 12, 31: 2}
Did not match all atoms present	72749-83-8	CC(=O)C(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)[O-])OC)N=NC2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=C(C=CC(=C4)S(=O)(=O)[O-])OC)C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 4, 3: 2, 14: 12, 22: 2, 24: 7, 29: 6, 31: 4}
Did not match all atoms present	72749-84-9	CCOC1=C(C2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)N=NC3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4)S(=O)(=O)[O-])N/N=C\5/C(=CC6=CC(=CC(=C6C5=O)NC(=O)C7=CC=CC=C7)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 1, 34: 3, 14: 20, 15: 2, 22: 1, 24: 2, 25: 1, 29: 12, 31: 3}
Did not match all atoms present	72749-85-0	CC(=O)C(C(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-])N=NC2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)N=NC(C(=O)C)C(=O)NC4=CC=C(C=C4)S(=O)(=O)[O-])C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 3: 2, 14: 14, 24: 7, 29: 6, 31: 4}
Did not match all atoms present	72749-86-1	C1=CC(=CC=C1N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC4=C(C(=C(C(=C4)N=NC5=CC(=CC(=C5O)[N+](=O)[O-])[N+](=O)[O-])O)N=NC6=CC=C(C=C6)[N+](=O)[O-])O)O)[N+](=O)[O-].[Na+].[Na+]	{34: 8, 38: 4, 21: 4, 14: 14, 29: 6}
Did not match all atoms present	72749-89-4	C12=C(NC(=O)N1)NC(=O)N2	{32: 4, 25: 2}
Did not match all atoms present	72752-52-4	C1CCN(CC1)C2=CC=CC=C2C#N	{33: 1, 11: 5, 37: 1, 14: 4}
Did not match all atoms present	7276-58-6	CCCCCCCCCCCCN1C2=CC=CC=C2[N+](=C1C3=CC=CC=C3)C.CCCCCCCCCCCCN1C2=CC=CC=C2[N+](=C1C3=CC=CC=C3)C.CCCCCCCCCCCCN1C2=CC=CC=C2[N+](=C1C3=CC=CC=C3)C.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+3]	{1: 6, 2: 33, 14: 27, 33: 6}
Did not match all atoms present	72765-45-8	C1=CC(=CC=C1N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC4=C(C(=C(C(=C4)N=NC5=CC(=CC(=C5O)[N+](=O)[O-])[N+](=O)[O-])O)N=NC6=CC(=CC(=C6O)[N+](=O)[O-])[N+](=O)[O-])O)O)[N+](=O)[O-].[Na+].[Na+]	{34: 8, 38: 5, 21: 5, 14: 12, 29: 6}
Did not match all atoms present	72765-51-6	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCO)C(=O)CCCCCCCCCCCCCCCCC.CCOS(=O)(=O)OCC	{1: 4, 2: 38, 33: 1, 20: 1, 22: 2, 24: 2, 29: 2, 31: 1}
Did not match all atoms present	72765-60-7	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=C(C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ba+2]	{34: 1, 14: 9, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	72765-61-8	C1=CC=C2/C(=N/NC3=CC=CC=C3S(=O)(=O)[O-])/C(=O)C=CC2=C1.C1=CC=C2/C(=N/NC3=CC=CC=C3S(=O)(=O)[O-])/C(=O)C=CC2=C1.[Ba+2]	{34: 2, 14: 20, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	7277-87-4	CC1=NN(C(=O)C1)C2=CC3=CC(=CC(=C3C=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 35: 1, 33: 1, 11: 1, 14: 5, 15: 1, 20: 2, 25: 1, 29: 4}
Did not match all atoms present	72779-11-4	[H+].[H+].[H+].[H+].[H+].COC1=CC=CC=C1N=NC2=C(C(=C(C(=C2)N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-])N=NC5=CC(=C(C=C5)NC6=CC=CC=C6)S(=O)(=O)[O-])O.COC1=CC=CC=C1N=NC2=C(C(=C(C(=C2)N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-])N=NC5=CC(=C(C=C5)NC6=CC=CC=C6)S(=O)(=O)[O-])O.[Fe+3]	{1: 2, 34: 12, 38: 2, 14: 34, 21: 2, 22: 2, 29: 12, 31: 2}
Did not match all atoms present	72785-08-1	CN(C)CCCN(CCCS(=O)(=O)O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 6, 4: 8, 33: 2, 16: 17, 20: 1, 29: 4}
Did not match all atoms present	72785-09-2	CCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC=C(C=C3)C#N	{1: 1, 2: 4, 35: 2, 37: 1, 11: 4, 12: 2, 14: 6}
Did not match all atoms present	72785-10-5	CCCCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC=C(C=C3)C#N	{1: 1, 2: 6, 35: 2, 37: 1, 11: 4, 12: 2, 14: 6}
Did not match all atoms present	72785-11-6	CCC1CCC(CC1)C2=CN=C(N=C2)C3=CC=C(C=C3)C#N	{1: 1, 2: 1, 35: 2, 37: 1, 11: 4, 12: 2, 14: 6}
Did not match all atoms present	72785-17-2	CCC(C)CCCC(C)(C)OC=O	{1: 4, 2: 4, 3: 1, 4: 1, 26: 1}
Did not match all atoms present	72796-88-4	CC[N+](C)(CC)CCOC12C=CC=CC1(C=C2)C3=CC=C(C=C3)C4=CC=C(C=C4)C56C=CC=CC5(C=C6)OCC[N+](C)(CC)CC.COS(=O)(=O)[O-]	{1: 7, 2: 8, 13: 4, 14: 20, 22: 3, 29: 3}
Did not match all atoms present	72796-89-5	CC1=CC(=O)N2C(=N1)N=C(N2)CS	{32: 1, 1: 1, 2: 1, 35: 2, 33: 1, 39: 1, 14: 1, 25: 1}
Did not match all atoms present	72796-90-8	C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-].[Cl-]	{17: 1, 38: 1, 14: 19}
Did not match all atoms present	72796-91-9	CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=CC=C(C=C4)OC)/C3=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 1, 14: 11, 15: 2, 22: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	72796-92-0	CC1=NN(C(=O)C1=CC=C2N(C3=CC=CC=C3O2)CCC(=O)O)C4=CC=C(C=C4)S(=O)(=O)O	{1: 1, 2: 2, 35: 1, 6: 2, 33: 2, 14: 8, 15: 3, 20: 1, 23: 1, 25: 1, 27: 1, 29: 2}
Did not match all atoms present	72796-93-1	CC1=NN(C(=O)C1/C=C/C=C/C=C\2/C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C)C4=CC=C(C=C4)S(=O)(=O)[O-].[K+].[K+]	{1: 2, 35: 2, 6: 5, 33: 2, 12: 1, 14: 8, 15: 3, 25: 2, 29: 6}
Did not match all atoms present	72796-94-2	C=CS(=O)(=O)CC(CS(=O)(=O)C=C)(CS(=O)(=O)C=C)CS(=O)(=O)C=C.C(CS(=O)(=O)[O-])N.[K+]	{2: 6, 4: 1, 5: 4, 6: 4, 29: 11, 30: 1}
Did not match all atoms present	72796-99-7	[H+].[H+].[H+].CC(=O)/C(=N\NC1=CC(=CC(=C1[O-])S(=O)(=O)[O-])[N+](=O)[O-])/C(=NC2=CC=CC=C2)[O-].CC(=O)/C(=N\NC1=CC(=CC(=C1[O-])S(=O)(=O)[O-])[N+](=O)[O-])/C(=NC2=CC=CC=C2)[O-].[Cr+3]	{1: 2, 34: 4, 38: 2, 7: 4, 14: 14, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	72797-06-9	[H+].CC1=NN(C(=C1N=NC2=C(C(=CC(=C2)CC(C)(C)C)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=C(C2=O)N([O-])[O-])CC(C)(C)C)C3=CC=CC=C3.[Cr+3]	{1: 8, 2: 2, 35: 2, 4: 2, 38: 1, 33: 2, 34: 4, 14: 14, 15: 5, 25: 2}
Did not match all atoms present	72797-14-9	[H+].CCCCN.CC(=O)/C(=N/NC1=C(C=CC(=C1)[N+](=O)[O-])[O-])/C(=NC2=CC=CC=C2)[O-].CC(=O)/C(=N/NC1=C(C=CC(=C1)[N+](=O)[O-])[O-])/C(=NC2=CC=CC=C2)[O-].[Co+3]	{1: 3, 2: 3, 38: 2, 7: 4, 34: 4, 14: 16, 24: 2, 30: 1, 31: 2}
Did not match all atoms present	72797-16-1	CCOC1=NC=CN=C1C(C)C	{1: 3, 2: 1, 3: 1, 14: 2, 35: 2, 22: 1}
Did not match all atoms present	72797-19-4	CCCCN(CCCC)C1=NC(=C(C(=N1)NCCC2=CC=C(C=C2)S(=O)(=O)O)N=NC3=CC(=C(C=C3Cl)S(=O)(=O)O)Cl)C	{1: 3, 2: 8, 35: 2, 33: 1, 34: 2, 14: 6, 17: 2, 20: 2, 29: 4, 31: 1}
Did not match all atoms present	72797-21-8	CCN1C=C/C(=C\C=C\2/C(=O)[N+](=C(S2)/C=C\3/N(C4=C(S3)C=CC5=CC=CC=C54)CC)CC)/C6=CC=CC=C61.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 4, 2: 3, 6: 3, 33: 3, 41: 2, 14: 16, 15: 4, 25: 1, 29: 3}
Did not match all atoms present	72797-22-9	CCN1C2=CC(=C(C=C2SC1=CC3=CC(=CC4=[N+](C5=CC=CC=C5S4)CCCS(=O)(=O)[O-])CC(C3)(C)C)OC)OC	{1: 5, 2: 4, 6: 2, 33: 2, 41: 2, 11: 2, 13: 1, 14: 7, 15: 3, 22: 2, 29: 3}
Did not match all atoms present	72797-28-5	CCOC1=C(C=C(C=C1)C(OCC)OCC)OC	{1: 4, 2: 3, 3: 1, 22: 4, 14: 3}
Did not match all atoms present	72797-29-6	CC(=CC1=CC=CC=C1)COC(=O)C	{1: 2, 2: 1, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	728-40-5	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)[N+](=O)[O-]	{1: 6, 38: 1, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	728-81-4	C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 9}
Did not match all atoms present	728-84-7	C1=CC=C(C=C1)C(=O)C(C(=O)C2=CC=CC=C2)Br	{24: 2, 18: 1, 3: 1, 14: 10}
Did not match all atoms present	728-86-9	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 9}
Did not match all atoms present	728-87-0	COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)O	{1: 2, 3: 1, 20: 1, 22: 2, 14: 8}
Did not match all atoms present	728-88-1	CC1=CC=C(C=C1)C(=O)C(C)CN2CCCCC2	{1: 2, 2: 1, 3: 1, 33: 1, 11: 5, 14: 4, 24: 1}
Did not match all atoms present	728-90-5	C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2[N+](=O)[O-]	{24: 1, 38: 1, 14: 9, 31: 1}
Did not match all atoms present	7280-37-7	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)OS(=O)(=O)O.C1CNCCN1	{32: 2, 1: 1, 11: 10, 12: 3, 13: 1, 14: 3, 20: 1, 22: 1, 25: 1, 29: 2}
Did not match all atoms present	7280-83-3	C1=NC2=C(N1)C(=NC(=N2)N)N.OS(=O)(=O)O	{32: 1, 35: 3, 14: 1, 20: 2, 29: 2, 30: 2}
Did not match all atoms present	7281-04-1	CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Br-]	{1: 3, 2: 12, 18: 1, 14: 5}
Did not match all atoms present	72812-24-9	[H+].[H+].[H+].CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[Cr+3]	{1: 6, 34: 7, 38: 2, 7: 3, 14: 44, 29: 6, 30: 3, 31: 3}
Did not match all atoms present	72812-34-1	[H+].CCCCC(CC)COCCCN.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=CC(=CC3=O)N([O-])[O-].[Cr+3]	{1: 2, 2: 8, 3: 1, 38: 1, 34: 4, 14: 18, 15: 3, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	72812-35-2	[H+].CCCCC(CC)COCCCN.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=C(C=CC3=O)N([O-])[O-].[Cr+3]	{1: 2, 2: 8, 3: 1, 38: 1, 34: 4, 14: 18, 15: 3, 22: 1, 25: 2, 30: 1}
Did not match all atoms present	72814-85-8	CC1=CC(=C(C=C1)C)C=CC2=CC=C(C=C2)C3=CC=C(C=C3)C=CC4=C(C=CC(=C4)C)C	{1: 4, 14: 14, 6: 4}
Did not match all atoms present	7282-28-2	CCCCCCOP(=S)(OCCCCCC)[S-].CCCCCCOP(=S)(OCCCCCC)[S-].[Zn+2]	{1: 4, 2: 20, 22: 4}
Did not match all atoms present	7282-87-3	C#C[GeH3]	{9: 1, 10: 1}
Did not match all atoms present	72820-33-8	CCN(CC)CCCC(C)NC1=CC(=C2C(=C1OC)C(=CC(=N2)C)C)OC.C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O	{1: 7, 2: 5, 3: 1, 33: 1, 14: 8, 35: 1, 20: 2, 22: 2, 29: 4, 31: 1}
Did not match all atoms present	72828-13-8	CCCCCCCCCCCC(=O)OCC(CC)(CO)COC(=O)C1=CC=CC=C1.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 14, 4: 1, 14: 9, 20: 1, 28: 4}
Did not match all atoms present	72828-55-8	B([O-])([O-])[O-].[O-]P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{29: 7}
Did not match all atoms present	72828-66-1	CCN(CC)C1=CC(=C(C=C1)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)[N-]CCS(=O)(=O)[O-])Cl)C.[Na+].[K+]	{1: 3, 2: 4, 33: 1, 34: 3, 14: 5, 17: 2, 29: 5}
Did not match all atoms present	72828-70-7	C1=CC(=C(C=C1NC2=C(C(=NC(=N2)F)F)Cl)N=NC3=C(C=C4C=C(/C(=N\NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[K+].[K+]	{34: 3, 35: 2, 14: 8, 15: 2, 16: 2, 17: 1, 25: 1, 29: 15, 30: 1, 31: 2}
Did not match all atoms present	72828-71-8	CCS(=O)(=O)C1=NC2=C(S1)C=C(C=C2)N=NC3=C(C=C4C=C(/C(=N\NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 1, 35: 1, 41: 1, 34: 3, 14: 8, 15: 2, 25: 1, 29: 14, 30: 1, 31: 1}
Did not match all atoms present	72828-72-9	CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=CC(=C(C=C2)S(=O)(=O)[O-])N=NC3=C(C=C4C=C(/C(=N\NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[K+].[K+].[K+]	{1: 2, 34: 3, 35: 2, 14: 8, 15: 2, 17: 1, 25: 1, 29: 17, 30: 1, 31: 2}
Did not match all atoms present	72828-74-1	CC1CC2=CC=CC=C2N1N=CC3=CC=[N+](C4=CC=CC=C34)C.[Cl-]	{1: 2, 34: 1, 6: 1, 33: 2, 11: 1, 12: 1, 14: 10, 17: 1}
Did not match all atoms present	72828-75-2	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl.[O-]S(=O)(=O)[O-]	{1: 4, 2: 3, 38: 1, 33: 1, 34: 2, 14: 6, 17: 2, 29: 4}
Did not match all atoms present	72828-78-5	CCCCCCCCCCCCS(=O)(=O)CC(C)C(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)N2C(=O)N(N(C2=O)C3=CC=CC=C3)CC4=CC=CC=C4	{1: 5, 2: 13, 3: 2, 4: 1, 33: 3, 14: 13, 17: 1, 24: 3, 25: 2, 29: 2, 31: 2}
Did not match all atoms present	72828-79-6	C1=CC=C(C=C1)C(=O)NC2=NNC(=S)N2C(=O)C3=CC=CC=C3	{32: 1, 33: 1, 35: 1, 14: 10, 24: 2, 31: 1}
Did not match all atoms present	72828-81-0	CC[C@H](C(=O)NC1=CC(=C(C(=C1O)Cl)C)OCC(=O)OC)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC	{1: 9, 2: 4, 3: 1, 4: 2, 14: 4, 17: 1, 21: 1, 22: 2, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	72828-85-4	C1=CC(=CC(=C1)N)N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)N=NC5C(=NN(C5=O)C6=CC(=CC=C6)N)C(=O)[O-].[Na+].[Na+]	{33: 2, 34: 4, 35: 2, 12: 2, 14: 16, 15: 2, 24: 3, 25: 2, 30: 2, 31: 1}
Did not match all atoms present	72828-86-5	CC1=C(C=CC(=C1)N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=NC4=CC(=C(C=C4)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C)S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC7=CC(=C8C=CC=C(C8=C7)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 8, 14: 22, 6: 2, 29: 18}
Did not match all atoms present	72828-89-8	CC1=CC=C(C=C1)N=NC2=C(C=C(C(=C2)C)N)N.Cl	{1: 2, 34: 2, 30: 2, 14: 6, 17: 1}
Did not match all atoms present	72828-94-5	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=[N+](C=NN3C)C.OS(=O)(=O)[O-]	{1: 3, 2: 3, 35: 1, 33: 3, 34: 2, 14: 10, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	72829-00-6	C=CC1=CC=CC=C1.C1=CC(=CC=C1C(=O)[O-])NC(=O)/C=C/C(=O)[O-].[Na+].[Na+]	{24: 3, 14: 9, 5: 1, 6: 3, 31: 1}
Did not match all atoms present	72829-01-7	C=O.C1CCC(=O)CC1.OS(=O)[O-].[Na+]	{25: 1, 11: 5, 20: 1, 5: 1, 29: 2}
Did not match all atoms present	72829-02-8	CC1=CC=C(C=C1)O.C=O.C1CO1.C(CCCN)CCN	{1: 1, 2: 6, 5: 1, 11: 2, 14: 4, 21: 1, 23: 1, 30: 2}
Did not match all atoms present	72829-05-1	CC1CO1.CC1=CC=C(C=C1)S(=O)(=O)OC.C1CO1.C(CO)N(CCO)CCO.C(C(CO)O)O	{1: 3, 2: 8, 3: 1, 33: 1, 11: 3, 12: 1, 14: 4, 20: 6, 22: 1, 23: 2, 29: 2}
Did not match all atoms present	72829-07-3	CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CC1CO1.C1CO1.C(CO)N(CCO)CCO.C(C(CO)O)O	{1: 2, 2: 19, 3: 1, 33: 1, 11: 3, 12: 1, 14: 4, 20: 7, 23: 2, 29: 2}
Did not match all atoms present	72829-12-0	CC1=CC(=C(C(=C1N)N=NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-])N)N=NC5=CC=C(C=C5)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 5, 14: 16, 15: 2, 24: 2, 25: 1, 29: 3, 30: 2, 31: 2}
Did not match all atoms present	72829-15-3	CC(CO)(CO)COC(=O)C1=CC=CC=C1C(=O)OCC(C)(CO)CO	{1: 2, 2: 6, 4: 2, 14: 4, 20: 4, 28: 2}
Did not match all atoms present	72829-18-6	C1=CC2=C(C=C/C(=N\NC3=C(C=C(C=C3O)[N+](=O)[O-])[N+](=O)[O-])/C2=O)C(=C1)S(=O)(=O)[O-].[Na+]	{34: 1, 38: 2, 14: 7, 15: 1, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	72829-20-0	CCCCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)CCO.COS(=O)(=O)[O-]	{1: 4, 2: 20, 20: 1, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	72829-24-4	CC1=C(C=CC(=C1)S(=O)(=O)[O-])NC2=NC(=NC(=N2)Cl)NC3=C(C=CC(=C3)NC4=CC(=C(C5=C4C(=O)C6=CC=CC=C6C5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 35: 3, 14: 11, 17: 1, 25: 2, 29: 9, 30: 1, 31: 3}
Did not match all atoms present	72829-26-6	CC1=C(C=CC(=C1)S(=O)(=O)[O-])NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N=NC4C(=NN(C4=O)C5=CC(=C(C=C5Cl)S(=O)(=O)[O-])Cl)C)Cl.[Na+].[Na+].[Na+]	{1: 2, 34: 2, 35: 4, 33: 1, 12: 1, 14: 8, 15: 1, 17: 3, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	72829-27-7	CC(=O)NC1=C(C=CC(=C1)NC2=NC(=NC(=N2)Cl)NCCS(=O)(=O)[O-])N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 2: 2, 35: 3, 34: 2, 14: 8, 17: 1, 24: 1, 29: 9, 31: 3}
Did not match all atoms present	72829-28-8	CC1=CC(=C(C=C1S(=O)(=O)[O-])N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 1, 35: 2, 14: 6, 15: 2, 16: 2, 17: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	72829-29-9	C1=CC=C(C=C1)NC2=C(C=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4)[N+](=O)[O-])S(=O)(=O)O	{38: 1, 20: 1, 29: 4, 14: 16, 31: 3}
Did not match all atoms present	72829-30-2	C1=CC=C(C=C1)NC2=C(C=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-])S(=O)(=O)O	{38: 1, 14: 11, 20: 1, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	72829-33-5	[H+].[H+].C1=CC=C(C=C1)[N-]C2=C(C3=CC=CC=C3C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)NC5=CC=CC(=C5)C(=O)[O-])[O-].C1=CC=C(C=C1)[N-]C2=C(C3=CC=CC=C3C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)NC5=CC=CC(=C5)C(=O)[O-])[O-].[Na+].[Co+2]	{24: 2, 34: 6, 29: 4, 14: 36, 31: 2}
Did not match all atoms present	72829-37-9	CN(C)C1=C2C(=C(C=C1)O)C(=O)C3=C(C=CC(=C3C2=O)O)N	{1: 2, 33: 1, 14: 4, 21: 2, 25: 2, 30: 1}
Did not match all atoms present	72829-39-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)NC(=O)CO)S(=O)(=O)[O-])N.[Na+]	{2: 1, 14: 9, 20: 1, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	72829-41-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)NC(=O)CO)S(=O)(=O)[O-])N.[Na+]	{2: 1, 14: 9, 20: 1, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	72829-42-6	CC(=O)NC1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[Na+]	{1: 1, 11: 4, 12: 2, 14: 5, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	7283-41-2	C1=CC=C(C(=C1)C(=O)S)O	{24: 1, 21: 1, 14: 4, 39: 1}
Did not match all atoms present	7283-49-0	C=C(CCC(=C)C1=CC=CC=C1)C2=CC=CC=C2	{2: 2, 5: 2, 14: 10, 7: 2}
Did not match all atoms present	7283-77-4	CC(C)CN(CC(C)C)C(=S)S	{1: 4, 2: 2, 3: 2, 33: 1, 39: 1, 7: 1}
Did not match all atoms present	7283-96-7	C1=C(SC(=C1)Cl)C=O	{17: 1, 26: 1, 14: 2, 41: 1}
Did not match all atoms present	72845-29-5	C=CC1=CC=CC=C1.C(C(C(F)F)(F)F)OC(=O)/C=C/C(=O)O.C(=C/C(=O)[O-])\C(=O)[O-].[Na+].[Na+]	{2: 1, 3: 1, 4: 1, 5: 1, 6: 5, 14: 5, 16: 4, 24: 2, 27: 1, 28: 1}
Did not match all atoms present	72845-31-9	C1=CC=C2C(=CC=C(C2=C1)N/N=C\3/C(=O)C4=C(C=C3S(=O)(=O)[O-])C=C(C=C4)NC(=O)NC5=CC6=C(C(=O)/C(=N/NC7=CC=C(C8=CC=CC=C78)S(=O)(=O)[O-])/C(=C6)S(=O)(=O)[O-])C=C5)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 14: 20, 15: 4, 24: 1, 25: 2, 29: 12, 31: 4}
Did not match all atoms present	72845-34-2	[Li+].[Li+].[Li+].[O-][As]([O-])[O-]	{29: 3}
Did not match all atoms present	72845-36-4	CC=C(C)CCOC(=O)C1=CC=CC=C1	{1: 2, 2: 2, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	72845-39-7	CCCCOCCOC(=O)C=CC1=CC=C(C=C1)OC	{1: 2, 2: 5, 6: 2, 14: 4, 22: 2, 28: 1}
Did not match all atoms present	72845-43-3	CC1COC2=CC=C(C=C2)C(C3=CC=C(C=C3)OCC(OC(=O)C4C(CC5C4C(=O)OC5=O)C(=O)O1)C)(C)C	{1: 4, 11: 3, 12: 6, 13: 1, 14: 8, 23: 2, 28: 4}
Did not match all atoms present	72845-49-9	C1CCC(CC1)CNS(=O)(=O)C2=CC=CC=C2NC3=C4C(=C(C=C3)NC5=CC=CC=C5S(=O)(=O)NCC6CCCCC6)C(=O)C7=CC(=C(C=C7C4=O)Cl)Cl	{2: 2, 11: 10, 12: 2, 14: 12, 17: 2, 25: 2, 29: 4, 31: 4}
Did not match all atoms present	72845-77-3	CC(C)CCOC(=O)COC1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	72845-81-9	COC1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O	{1: 1, 2: 1, 14: 8, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	72845-85-3	CC(C)C1=CC=C(C=C1)CC(C)C2OCCO2	{1: 3, 2: 1, 3: 2, 11: 2, 12: 1, 14: 4, 23: 2}
Did not match all atoms present	72845-86-4	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=CC4=CC(=C(C=C4C3=O)N/N=C\5/C=CC(=CC5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N/N=C\6/C(=CC7=C(C6=O)C=C(C=C7)N/N=C/8\C=CC(=CC8=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 14: 19, 15: 8, 25: 4, 29: 9, 30: 2, 31: 4}
Did not match all atoms present	72845-87-5	CN(CCS(=O)(=O)O)C1=CC2=C(C=C1)C3(C4C=CC(=NC5=CC(=CC=C5)S(=O)(=O)CCOS(=O)(=O)O)C=C4O2)C6=CC=CC=C6S(=O)(=O)O3	{1: 1, 2: 4, 34: 1, 33: 1, 12: 1, 13: 1, 14: 14, 15: 2, 20: 2, 22: 1, 23: 2, 29: 8}
Did not match all atoms present	72845-88-6	C1=CC=C(C=C1)N/N=C\2/C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N/N=C\5/C6=C(C=CC5=O)C=C(C=C6)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{34: 4, 14: 16, 15: 3, 20: 3, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	72845-90-0	C1=CC(=CC=C1N=NC2=CC(=C(C=C2)[N+]#N)Cl)[N+](=O)[O-].OS(=O)(=O)[O-]	{34: 3, 38: 1, 14: 7, 17: 1, 20: 1, 29: 3}
Did not match all atoms present	72845-91-1	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O)/C2=O	{34: 1, 14: 17, 15: 2, 24: 1, 25: 3, 31: 2}
Did not match all atoms present	72845-94-4	C1=CC2=C3C(=CC=C4C3=C1C5=CC(=CC(=C5O4)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)N(C2=O)CCO.C(CO)[NH3+].C(CO)[NH3+]	{33: 1, 2: 6, 14: 6, 20: 3, 23: 1, 25: 2, 29: 6}
Did not match all atoms present	72845-98-8	CC1=CC(=CC=C1)NC2=CC=C(C=C2)C(=C3C=CC(=[NH+]C4=CC=CC(=C4)C)C=C3)C5=CC=C(C=C5)Cl.CC1=CC(=CC=C1)NC2=CC=C(C=C2)C(=C3C=CC(=[NH+]C4=CC=CC(=C4)C)C=C3)C5=CC=C(C=C5)Cl.[O-]S(=O)(=O)[O-]	{1: 4, 7: 2, 14: 40, 15: 4, 17: 2, 29: 4, 31: 4}
Did not match all atoms present	72846-00-5	C1=CC=C(C=C1)CN2C(=O)C(C(=O)NC2=O)C3=CC=CC=C3	{32: 1, 33: 1, 2: 1, 12: 1, 14: 10, 25: 3}
Did not match all atoms present	72846-02-7	COC1=CC=C(C=C1)/C=C/C2=C(C(C3=C(O2)C=CC(=C3)OC)C4=CC(=[O+]C5=CC=CC=C54)C6=CC=CC=C6)C7=CC=CC=C7.[O-]Cl(=O)(=O)=O	{1: 2, 6: 2, 12: 1, 14: 22, 15: 2, 17: 1, 22: 2, 23: 2, 29: 4}
Did not match all atoms present	7285-32-7	C1C=CS1(=O)=O	{11: 1, 29: 2, 14: 2}
Did not match all atoms present	7285-77-0	C1=CC(=CC=C1C2=CC=C(C=C2)I)N	{19: 1, 30: 1, 14: 8}
Did not match all atoms present	72850-64-7	C1=CC=C(C=C1)COC(=O)C2=C(N=C(S2)Cl)C(F)(F)F	{2: 1, 35: 1, 4: 1, 41: 1, 14: 5, 16: 3, 17: 1, 28: 1}
Did not match all atoms present	72851-41-3	C1=CC=C2C(=C1)C(=C3C4=CC=CC5=C4C(=CC=C5)C3=C2C#N)C#N	{37: 2, 14: 10}
Did not match all atoms present	72854-04-7	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N=NC5=CC=C(C=C5)[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 1, 34: 7, 14: 22, 6: 2, 29: 13}
Did not match all atoms present	72854-05-8	C1=CC(=CC=C1N=[N+](C2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)[N+](=NC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{33: 4, 34: 4, 14: 22, 6: 2, 29: 16}
Did not match all atoms present	72854-06-9	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=NC5=CC=C(C=C5)[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 34: 6, 14: 22, 6: 2, 29: 14}
Did not match all atoms present	72854-07-0	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=[N+](C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)N=NC5=CC=C(C=C5)[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 34: 6, 14: 22, 6: 2, 29: 14}
Did not match all atoms present	72854-08-1	C1=CC(=CC=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=NC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{33: 2, 34: 6, 14: 22, 6: 2, 29: 14}
Did not match all atoms present	72854-09-2	C1=CC(=CC=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)[N+](=NC4=CC=C(C=C4)[N+](=NC5=CC=C(C=C5)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{33: 3, 34: 5, 14: 22, 6: 2, 29: 15}
Did not match all atoms present	72854-10-5	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=[N+](C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=NC5=CC=C(C=C5)[N+](=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+]	{33: 3, 34: 5, 14: 22, 6: 2, 29: 15}
Did not match all atoms present	72854-11-6	CC1=C(C=CC(=C1)N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=[N+](C4=CC(=C(C=C4)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC7=CC8=C(C=CC(=C8C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 7, 6: 2, 33: 1, 14: 22, 29: 19}
Did not match all atoms present	72854-12-7	CC1=C(C=CC(=C1)N(/N=C/2\C=C/C(=C/C=C\3/C=C/C(=N\[N+](=O)C4=CC(=C(C=C4)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C)/C=C3S(=O)(=O)[O-])/C(=C2)S(=O)(=O)[O-])[O-])N=NC7=CC(=C8C=CC=C(C8=C7)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 6, 6: 2, 33: 2, 14: 22, 15: 6, 29: 20}
Did not match all atoms present	72854-13-8	COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O	{1: 1, 2: 1, 3: 5, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 6, 22: 1, 27: 1}
Did not match all atoms present	72854-38-7	CC[N+](=C1C=CC2=NC3=C(C=C(C(=C3)C)N)OC2=C1)CC.Cl[Zn-](Cl)Cl	{1: 3, 2: 2, 35: 1, 33: 1, 14: 5, 17: 3, 23: 1, 30: 1}
Did not match all atoms present	7286-69-3	CCC(C)NC1=NC(=NC(=N1)NCC)Cl	{1: 3, 2: 2, 3: 1, 17: 1, 35: 3, 31: 2}
Did not match all atoms present	7286-84-2	COC(=O)C1=CC(=CC(=C1Cl)N)Cl	{1: 1, 28: 1, 30: 1, 14: 2, 17: 2}
Did not match all atoms present	72869-19-3	CCCCCCCCCCCC(=O)OCC=C.C=CC1=CC=CC=C1.C1CC(=O)OC1=O	{1: 1, 2: 11, 5: 2, 6: 2, 11: 2, 14: 5, 28: 3}
Did not match all atoms present	72869-20-6	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])N=NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=NC5=CC=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{33: 1, 34: 7, 14: 22, 6: 2, 29: 13}
Did not match all atoms present	72869-92-2	CN(CCO)CCO.CN(CCO)CCO.CN(CCO)CCO.COC1=CC=CC=C1N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)O)/C(=C5)S(=O)(=O)O)S(=O)(=O)O	{1: 4, 2: 12, 33: 3, 34: 2, 14: 18, 15: 4, 20: 9, 22: 1, 24: 1, 25: 2, 29: 6, 31: 4}
Did not match all atoms present	7287-19-6	CC(C)NC1=NC(=NC(=N1)SC)NC(C)C	{40: 1, 1: 5, 3: 2, 35: 3, 31: 2}
Did not match all atoms present	7287-36-7	CCCC(C)(C)C(=O)NC1=CC=C(C=C1)Cl	{1: 3, 2: 2, 4: 1, 14: 4, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	7287-82-3	CC1=CC=CC=C1C(C)O	{1: 2, 3: 1, 20: 1, 14: 4}
Did not match all atoms present	7288-28-0	CC1=CN=C(N=C1O[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 35: 2, 22: 2, 14: 1}
Did not match all atoms present	7289-92-1	C[N-]C.C[N-]C.C[N-]C.[Sb+3]	{1: 6, 34: 3}
Did not match all atoms present	72894-18-9	C1=CC(=CC=C1N)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC(=C(C=C4)NC5=CC=C(C=C5)N=NC6=C(C=C(C=C6)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 5, 14: 16, 15: 2, 25: 1, 29: 9, 30: 4, 31: 2}
Did not match all atoms present	72894-19-0	CC(=O)NC1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC(=C(C=C4)NC5=CC=C(C=C5)N=NC6=C(C=C(C=C6)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 5, 14: 16, 15: 2, 24: 1, 25: 1, 29: 9, 30: 3, 31: 3}
Did not match all atoms present	72894-20-3	CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCOCC=C)CCOCC=C	{1: 2, 2: 6, 5: 2, 6: 2, 33: 1, 34: 2, 14: 4, 18: 1, 22: 3, 24: 1, 38: 2, 31: 1}
Did not match all atoms present	72894-21-4	CCOC1=CC=C2C3=C(C=CC(=C13)OC)C(=O)N(C2=O)CC4=CC=CC=C4	{1: 2, 2: 2, 33: 1, 14: 9, 22: 2, 25: 2}
Did not match all atoms present	72894-22-5	CCOC1=C2C(=CC=C3C2=C(C=C1)C(=O)N(C3=O)CC4=CC=CC=C4)OCC	{1: 2, 2: 3, 33: 1, 14: 9, 22: 2, 25: 2}
Did not match all atoms present	72894-24-7	CCOC1=CC=C(C=C1)CNC2=CC=C(C=C2)C=CC3=[N+](C4=CC=CC=C4C3(C)C)C.[Cl-]	{1: 4, 2: 2, 6: 2, 33: 1, 13: 1, 14: 12, 15: 1, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	72894-25-8	C1=CC(=CC=C1N=NC2=CC(=C(C(=C2O)N=NC3=CC=C(C=C3)[N+](=O)[O-])O)N=NC4=C5C(=CC(=C4)S(=O)(=O)[O-])C=C(C(=C5O)N=NC6=CC=C(C=C6)[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-].[Na+].[Na+]	{34: 8, 38: 3, 21: 3, 14: 16, 29: 6}
Did not match all atoms present	72894-26-9	CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=C(C5=CC=CC=C5C=C4)S(=O)(=O)[O-])/C3=O)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 2, 34: 1, 35: 2, 14: 9, 15: 2, 17: 1, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	72894-30-5	CC1=C(C(=NC(=N1)S(=O)(=O)C)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=CC=CC=C4)/C3=O)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 2, 34: 1, 35: 2, 14: 8, 15: 2, 17: 1, 25: 1, 29: 8, 31: 2}
Did not match all atoms present	729-43-1	CC(=NN=C(C)C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 34: 2, 14: 10, 7: 2}
Did not match all atoms present	729-46-4	C1COCCN1C(=S)SSC(=S)N2CCOCC2	{23: 2, 33: 2, 11: 8, 40: 2, 7: 2}
Did not match all atoms present	729-81-7	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 9, 4: 3, 14: 3}
Did not match all atoms present	729-99-7	CC1=C(OC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C	{1: 2, 35: 1, 14: 4, 23: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	7290-99-5	CN(C)C(=O)C1=CC(=CC=C1)OC	{24: 1, 1: 3, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	72905-57-8	C1=CC(=CC(=C1)S(=O)(=O)[O-])N=NC2=C3C=CC=NC3=C(C=C2)[O-].C1=CC(=CC(=C1)S(=O)(=O)[O-])N=NC2=C3C=CC=NC3=C(C=C2)[O-].[Na+].[Co+3]	{34: 4, 35: 2, 29: 6, 14: 18}
Did not match all atoms present	72905-86-3	B(O)(O)O.CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O	{1: 1, 2: 18, 3: 1, 20: 5, 28: 1}
Did not match all atoms present	72906-10-6	CC(C)CCCCOP(=S)(OCCCCC(C)C)S	{1: 4, 2: 8, 3: 2, 22: 2, 39: 1}
Did not match all atoms present	72906-15-1	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC(=C(C=C4)NC5=CC=C(C=C5)N=NC6=C(C=C(C=C6)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 5, 14: 17, 15: 2, 25: 1, 29: 9, 30: 3, 31: 2}
Did not match all atoms present	72906-16-2	CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C3=CC=CC=C3	{1: 2, 2: 2, 38: 2, 33: 1, 34: 2, 14: 10, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	72906-17-3	COC1=C(C=C(C=C1)S(=O)(=O)[O-])N/N=C\2/C=C(C(=CC2=O)O)N=NC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 3, 38: 1, 14: 8, 15: 3, 20: 1, 22: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	72906-18-4	CC1(C2=C(C=CC(=C2)[N+](=O)[O-])[N+](=C1/C=N/NCC3=CC=C(C=C3)OC)C)C.[Cl-]	{1: 4, 2: 1, 34: 1, 38: 1, 6: 1, 33: 1, 13: 1, 14: 7, 15: 1, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	72906-23-1	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)NC(=O)NC3=CC=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-]	{1: 6, 2: 3, 34: 3, 14: 22, 15: 2, 20: 1, 22: 1, 23: 1, 24: 2, 25: 1, 28: 1, 29: 2, 31: 5}
Did not match all atoms present	72906-28-6	CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=C(C=CC(=C1)C(C2=CC=C(C=C2)OC)C3=CC(=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)O)C)C)N=NC6C(=NN(C6=O)C7=CC=C(C=C7)S(=O)(=O)O)C	{1: 9, 34: 6, 3: 1, 33: 2, 7: 2, 12: 2, 14: 34, 15: 2, 35: 2, 20: 2, 22: 1, 25: 2, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	72906-30-0	C1=CC(=O)C=CC1=CNC2=CC=C(C=C2)CC3=CC=C(C=C3)NC=C4C=CC(=O)C=C4	{2: 1, 6: 2, 14: 16, 15: 2, 25: 2, 31: 2}
Did not match all atoms present	72906-31-1	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N=NC5=C(C=C(C=C5)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[K].[K].[K]	{34: 5, 14: 13, 15: 2, 25: 1, 29: 9, 30: 3, 31: 1}
Did not match all atoms present	72906-32-2	CC1=C(C=CC(=C1)S(=O)(=O)O)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N/NC6=CC=C(C=C6)C(=O)O)/C(=C5)S(=O)(=O)O)S(=O)(=O)O.C(CO)NCCO.C(CO)NCCO.C(CO)NCCO.C(CO)NCCO	{1: 1, 2: 16, 34: 2, 14: 15, 15: 4, 20: 11, 24: 1, 25: 2, 27: 1, 29: 6, 31: 8}
Did not match all atoms present	72906-33-3	CC1=C(C=CC(=C1)S(=O)(=O)O)N/N=C/2\C(=O)C3=C(C=C2S(=O)(=O)O)C=C(C=C3)NC(=O)NC4=CC5=C(C(=O)/C(=N\NC6=C(C=C(C=C6)S(=O)(=O)O)C)/C(=C5)S(=O)(=O)O)C=C4.C(NCCO)CO.C(NCCO)CO.C(NCCO)CO.C(NCCO)CO	{1: 2, 2: 16, 34: 2, 14: 14, 15: 4, 20: 12, 24: 1, 25: 2, 29: 8, 31: 8}
Did not match all atoms present	72906-34-4	C1=CC(=CC=C1C(=O)O)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=C(C=C6)C(=O)O)/C(=C5)S(=O)(=O)O)S(=O)(=O)O.C(CO)NCCO.C(CO)NCCO.C(CO)NCCO.C(CO)NCCO	{2: 16, 34: 2, 14: 16, 15: 4, 20: 10, 24: 1, 25: 2, 27: 2, 29: 4, 31: 8}
Did not match all atoms present	72906-35-5	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN(C=[N+]3C)C.CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN(C=[N+]3C)C.[O-]S(=O)(=O)[O-]	{1: 6, 2: 6, 35: 2, 33: 6, 34: 4, 14: 20, 28: 2, 29: 4}
Did not match all atoms present	72906-37-7	CC1=CC=C(C=C1)NC2=C3C4=C(C=C2)[N+](=C5C=CC(=CC5=C4C6=CC=CC=C6C3=O)C)C.COS(=O)(=O)[O-]	{1: 4, 33: 1, 14: 13, 22: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	72906-38-8	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=NC(=NS2)C3=CC=CC=C3.COS(=O)(=O)[O-]	{1: 5, 2: 3, 35: 2, 33: 1, 41: 1, 34: 2, 14: 9, 22: 1, 29: 3}
Did not match all atoms present	72906-39-9	CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=NC(=NS2)C3=CC=CC=C3.[O-]P(=O)([O-])[O-]	{1: 4, 2: 3, 35: 2, 33: 1, 41: 1, 34: 2, 14: 9, 29: 4}
Did not match all atoms present	72906-45-7	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=C4C=C(/C(=N\NC5=CC=C(C=C5)S(=O)(=O)[O-])/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC6=C(C=C(C=C6)N)N.[Na+].[Na+].[Na+]	{1: 2, 34: 5, 14: 15, 15: 2, 25: 1, 29: 9, 30: 3, 31: 1}
Did not match all atoms present	72906-46-8	C1=CC(=CC=C1N)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 10, 15: 2, 25: 1, 29: 6, 30: 3, 31: 1}
Did not match all atoms present	72906-47-9	C1=CC=C(C=C1)N=NCOC2=CC=C(C=C2)CC3=CC=C(C=C3)OCN=NC4=CC=CC=C4	{2: 3, 34: 4, 22: 2, 14: 18}
Did not match all atoms present	72906-48-0	CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)N/N=C/3\C4=CC=CC=C4C=CC3=O)C)C5=CC=C(C=C5)OC)N/N=C/6\C7=CC=CC=C7C=CC6=O	{1: 3, 34: 2, 3: 1, 14: 22, 15: 2, 22: 1, 25: 2, 31: 2}
Did not match all atoms present	72906-52-6	CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(/C(=N\NC4=CC=CC=C4)/C3=O)S(=O)(=O)O.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N	{1: 5, 34: 3, 7: 2, 14: 28, 15: 2, 20: 2, 25: 1, 29: 6, 30: 2, 31: 4}
Did not match all atoms present	72906-54-8	CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)S(=O)(=O)O)S(=O)(=O)O)C6=CC=CC=C6	{1: 6, 34: 6, 35: 2, 33: 2, 7: 2, 12: 2, 14: 32, 15: 2, 20: 2, 25: 2, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	72906-56-0	CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)C(C3=CC=CC=C3)C4=CC(=C(C=C4)N=NC5C(=NN(C5=O)C6=CC=C(C=C6)S(=O)(=O)O)C)OC)OC)C7=CC=C(C=C7)S(=O)(=O)O.C1=CC=C(C=C1)NC(=NC2=CC=CC=C2)N.C1=CC=C(C=C1)NC(=NC2=CC=CC=C2)N	{1: 4, 34: 6, 3: 1, 33: 2, 7: 2, 12: 2, 14: 39, 15: 2, 35: 2, 20: 2, 22: 2, 25: 2, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	72906-57-1	CCNC1=CC(=C(C=C1)[N+]#N)C.Cl[Zn-](Cl)Cl	{1: 2, 2: 1, 34: 1, 14: 3, 17: 3, 31: 1}
Did not match all atoms present	72906-61-7	C1=CC(=C(C=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)[O-])[O-].[NH4+].[NH4+].[NH4+].[Cu+2].[Cu+2]	{34: 4, 29: 9, 14: 15}
Did not match all atoms present	72906-62-8	C1=CC(=C(C=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{34: 4, 29: 9, 14: 15}
Did not match all atoms present	72906-63-9	[Li+].[Li+].[Li+].C1=CC(=C(C=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)[O-])[O-].[Cu+2].[Cu+2]	{34: 4, 29: 9, 14: 15}
Did not match all atoms present	72906-64-0	[H+].[H+].[H+].C1=CC(=C(C=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)[O-])[O-].C(CO)NCCO.C(CO)NCCO.C(CO)NCCO.[Cu+2].[Cu+2]	{2: 12, 34: 4, 14: 15, 20: 6, 29: 9, 31: 3}
Did not match all atoms present	72906-65-1	CC1=C(C=CC(=C1)S(=O)(=O)[O-])NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C(=C4[O-])N=NC5=C(C=C(C6=CC=CC=C65)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{1: 1, 34: 2, 35: 3, 14: 11, 17: 1, 29: 12, 31: 2}
Did not match all atoms present	7291-00-1	CN(C)C(=O)C1=CC=C(C=C1)OC	{24: 1, 1: 3, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	7291-01-2	CN(C)C(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{24: 1, 1: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	7291-02-3	CN(C)C(=O)C1=CC(=CC=C1)[N+](=O)[O-]	{24: 1, 1: 2, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	7291-41-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C=CC4=C3C=CC(=C4)O	{1: 1, 11: 4, 12: 4, 13: 1, 14: 5, 20: 1, 21: 1}
Did not match all atoms present	72917-35-2	CC1=CC(=C(C2=C1NC3=C2C=C(C=C3)O)C)[N+](=O)[O-]	{32: 1, 1: 2, 38: 1, 21: 1, 14: 4}
Did not match all atoms present	72918-26-4	CNC1=C(C(=C(C2=C1C(=O)C3=CC=CC=C3C2=O)NC)Cl)Cl	{1: 2, 31: 2, 25: 2, 14: 4, 17: 2}
Did not match all atoms present	72918-27-5	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N=NC5=C(C=C(C=C5)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC6=CC(=C(C=C6N)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 7, 14: 15, 15: 2, 25: 1, 29: 9, 30: 5, 31: 1}
Did not match all atoms present	72918-30-0	CNC1=C2C(=C(C=C1)O)C(=O)C3=C(C2=O)C(=C(C=C3NC)S(=O)(=O)[O-])[O-].[NH4+].[Na+]	{1: 2, 14: 3, 21: 1, 25: 2, 29: 3, 31: 2}
Did not match all atoms present	7292-08-2	CC1=CC(=C(C=C1CNC(=O)OC)CNC(=O)OC)C	{1: 4, 2: 2, 28: 2, 14: 2, 31: 2}
Did not match all atoms present	7292-14-0	CC1=CC(=C(C(=C1)C(CC(C)CC(C)(C)C)C2=CC(=CC(=C2O)C)C)O)C	{1: 8, 2: 2, 3: 2, 4: 1, 14: 4, 21: 2}
Did not match all atoms present	7292-16-2	CCCOP(=O)(OCCC)OC1=CC=C(C=C1)SC	{1: 3, 2: 4, 40: 1, 14: 4, 22: 3, 29: 1}
Did not match all atoms present	72926-13-7	O1[Sb]2O[Sb]3O[Sb]1O[Sb](O2)O3	{23: 6}
Did not match all atoms present	72927-73-2	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N/NC3=C(C=CC(=C3)Cl)Cl)C(=O)NC4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)NC(=O)C6=CC7=CC=CC=C7/C(=N/NC8=C(C=CC(=C8)Cl)Cl)/C6=O	{34: 2, 14: 24, 15: 4, 17: 4, 24: 3, 25: 2, 31: 5}
Did not match all atoms present	72927-74-3	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N=NC5=CC(=C(C=C5N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC6=CC(=C(C=C6N)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 7, 14: 14, 15: 2, 25: 1, 29: 12, 30: 5, 31: 1}
Did not match all atoms present	72927-76-5	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)S(=O)(=O)[O-])S(=O)(=O)[O-])C6=CC=CC=C6	{1: 12, 2: 6, 35: 2, 33: 2, 12: 2, 34: 4, 14: 32, 15: 2, 23: 2, 25: 2, 28: 2, 29: 6, 31: 4}
Did not match all atoms present	72927-78-7	CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)S(=O)(=O)O)S(=O)(=O)O)C6=CC=CC=C6.CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C	{1: 14, 34: 4, 35: 2, 33: 8, 7: 2, 12: 2, 14: 40, 15: 6, 20: 2, 25: 2, 29: 4}
Did not match all atoms present	72927-79-8	C\1=C(C=C(C(=O)/C1=N/NC2=CC(=C(C=C2N)N)Cl)S(=O)(=O)O)[N+](=O)[O-]	{34: 1, 38: 1, 14: 4, 15: 3, 17: 1, 20: 1, 25: 1, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	72927-83-4	C[C@H]1C(C2=C(C1(C)C)C=C(C=C2)C(C)(C)O)(C)C	{1: 7, 4: 1, 12: 1, 13: 2, 14: 3, 20: 1}
Did not match all atoms present	72927-90-3	CC1=CC(=CC(=C1[O-])C(=O)[O-])/C(=C/2\C=C(C(=O)C(=C2)C(=O)O)C)/C3=C(C=C(C=C3)N(C)C)Cl.[Na+].[Na+]	{1: 4, 33: 1, 7: 1, 14: 7, 15: 3, 17: 1, 24: 1, 25: 1, 27: 1}
Did not match all atoms present	72927-91-4	COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])NC3=NC(=NC(=N3)Cl)NC4=C(C=CC(=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 3, 14: 10, 17: 1, 22: 1, 29: 9, 31: 2}
Did not match all atoms present	72927-92-5	CC1=CC(=C(C=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)N5CCOCC5)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 1, 35: 3, 33: 1, 11: 4, 14: 6, 15: 2, 17: 1, 23: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	72927-93-6	CC1=C(C(=C(C(=C1NC2=NC(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)[O-])Cl)C)S(=O)(=O)[O-])C)NC4=CC(=C(C5=C4C(=O)C6=CC=CC=C6C5=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 3, 35: 3, 14: 9, 17: 1, 25: 2, 29: 9, 30: 1, 31: 3}
Did not match all atoms present	72927-95-8	C1=CC(=CC=C1NC2=C(C(=NC(=N2)Cl)Cl)Cl)N=NC3=CC(=C4C=C(C=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 35: 2, 14: 8, 17: 3, 29: 9, 31: 1}
Did not match all atoms present	72927-98-1	C1COCCN1C2=NC(=NC(=N2)NC3=C(C=C(C=C3)NC4=CC(=C(C5=C4C(=O)C6=CC=CC=C6C5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])NC7=CC=C(C=C7)N/N=C/8\C=CC(=O)C(=C8)C(=O)O.[Na+].[Na+]	{33: 1, 34: 1, 35: 3, 11: 4, 14: 15, 15: 2, 23: 1, 25: 3, 27: 1, 29: 6, 30: 1, 31: 4}
Did not match all atoms present	72928-02-0	CCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC	{1: 2, 2: 4, 11: 4, 12: 2, 14: 8, 28: 1}
Did not match all atoms present	72928-03-1	CCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3CCC(CC3)CC	{1: 2, 2: 3, 11: 8, 12: 4, 14: 4, 28: 1}
Did not match all atoms present	72928-09-7	C1=CC2=C(C=C1[N+](=O)[O-])NC=N2.Cl	{32: 1, 17: 1, 35: 1, 38: 1, 14: 4}
Did not match all atoms present	72928-10-0	CC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=C(C=C4)Cl)C)/C2=O)C	{1: 3, 34: 1, 14: 11, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	72928-11-1	CCCCC1=CC=C(C=C1)C(=NN=C(C)C2=CC=C(C=C2)CCCC)C	{1: 4, 2: 6, 34: 2, 14: 8, 7: 2}
Did not match all atoms present	72928-12-2	CC1=CN(C2=CC=CC=C12)C(C[C@@H](C)CCCC(C)(C)O)N3C=C(C4=CC=CC=C43)C	{1: 5, 2: 4, 3: 2, 4: 1, 33: 2, 14: 10, 20: 1}
Did not match all atoms present	72928-16-6	CC1=C(C=CC(=C1)N(CCC#N)CCO)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl	{1: 1, 2: 4, 37: 1, 38: 1, 33: 1, 34: 2, 14: 5, 17: 2, 20: 1}
Did not match all atoms present	72928-19-9	CCNC(=O)CCCCCCCCCCCCCCCCC[N+](CCO)(CCO)CCO.[N+](=O)([O-])[O-]	{24: 1, 1: 1, 2: 24, 20: 3, 31: 1}
Did not match all atoms present	72928-20-2	CCCCCCCCCCCCOP(=O)(O)O.C(CO)N.C(CO)N	{1: 1, 2: 15, 20: 4, 22: 1, 29: 1, 30: 2}
Did not match all atoms present	72928-21-3	CCCCCCCCCC(CCCCC/C=C/C)C1=NC=CN1CCOCCC(=O)[O-].[Na+]	{1: 2, 2: 17, 3: 1, 6: 2, 33: 1, 14: 2, 35: 1, 22: 1, 24: 1}
Did not match all atoms present	72928-29-1	CCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N	{1: 1, 2: 10, 22: 1, 14: 8, 37: 1}
Did not match all atoms present	72928-30-4	CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N	{1: 1, 2: 6, 28: 1, 37: 1, 14: 16}
Did not match all atoms present	72928-31-5	CCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCC	{1: 2, 2: 5, 11: 8, 12: 4, 14: 4, 28: 1}
Did not match all atoms present	72928-32-6	CCCC1CCC(CC1)C2=CC=C(C=C2)OC(=O)CCC	{1: 2, 2: 4, 11: 4, 12: 2, 14: 4, 28: 1}
Did not match all atoms present	72928-38-2	CC(=O)OC(C)(C1=CC=CC=C1)O	{1: 2, 4: 1, 28: 1, 14: 5, 20: 1}
Did not match all atoms present	72928-39-3	C#CCOC(=O)CC1=CC=CC=C1	{9: 1, 2: 2, 28: 1, 10: 1, 14: 5}
Did not match all atoms present	72928-43-9	CC(CCC(C)(C)O)C=CCN1C=CC2=CC=CC=C21	{1: 3, 2: 3, 3: 1, 4: 1, 6: 2, 33: 1, 14: 6, 20: 1}
Did not match all atoms present	72928-54-2	CCC1CCC(CC1)C2=CC=C(C=C2)C#N	{1: 1, 2: 1, 37: 1, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	72928-55-3	CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N	{1: 1, 2: 4, 37: 1, 11: 4, 12: 2, 14: 8, 28: 1}
Did not match all atoms present	72928-56-4	CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCC	{1: 2, 2: 8, 28: 2, 22: 1, 14: 12}
Did not match all atoms present	72928-58-6	CC(=C)C(=O)OC1C2(C3(N1CC4=CC=CC=C4CN23)OC(=O)C(=C)C)O.[CH2]C([CH2])O	{1: 2, 3: 1, 5: 4, 7: 2, 11: 2, 12: 1, 13: 2, 14: 4, 20: 2, 33: 2, 28: 2}
Did not match all atoms present	72928-74-6	CCN(C1=CC2=C(C(=C3C(=CC(=[N+](CC)CC)C=C3)O2)C4=CC=CC=C4C(=O)O)C=C1)CC.CCN(C1=CC2=C(C(=C3C(=CC(=[N+](CC)CC)C=C3)O2)C4=CC=CC=C4C(=O)O)C=C1)CC.CCN(C1=CC2=C(C(=C3C(=CC(=[N+](CC)CC)C=C3)O2)C4=CC=CC=C4C(=O)O)C=C1)CC.CC(=O)/C(=N\NC1=CC(=CC(=C1[O-])S(=O)(=O)[O-])[N+](=O)[O-])/C(=NC2=CC=CC=C2)[O-].CC(=O)/C(=N\NC1=CC(=CC(=C1[O-])S(=O)(=O)[O-])[N+](=O)[O-])/C(=NC2=CC=CC=C2)[O-].[Cr+3]	{1: 14, 2: 12, 33: 6, 38: 2, 7: 4, 34: 4, 14: 44, 23: 3, 24: 2, 27: 3, 29: 6, 31: 2}
Did not match all atoms present	72928-80-4	[H+].CC1=NN(C(=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-].[Cr+3]	{1: 1, 34: 4, 35: 1, 38: 1, 33: 1, 14: 17, 17: 1}
Did not match all atoms present	72928-81-5	[H+].CC1=NN(C(=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=CC=C3.[Cr+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 14: 16, 15: 4, 25: 2}
Did not match all atoms present	72928-82-6	[H+].CC1=CC(=C(C(=C1)[N+](=O)[O-])[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].CC1=CC(=NN=C2C(=O)C=CC3=CC=CC=C32)C(=O)C(=C1)N([O-])[O-].[Cr+3]	{1: 2, 34: 4, 38: 1, 14: 16, 15: 4, 25: 2}
Did not match all atoms present	72928-83-7	[H+].CC1=CC(=C(C(=C1)[N+](=O)[O-])[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=C(C=CC3=O)N([O-])[O-].[Cr+3]	{1: 1, 34: 4, 38: 1, 14: 17, 15: 3, 25: 2}
Did not match all atoms present	72928-84-8	[H+].CC1=CC(=C(C(=C1)[N+](=O)[O-])[O-])N=NC2=C(C=CC3=CC=CC=C32)[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=CC(=CC3=O)N([O-])[O-].[Cr+3]	{1: 1, 34: 4, 38: 1, 14: 17, 15: 3, 25: 2}
Did not match all atoms present	72928-85-9	[H+].CC1=CC(=C(C(=C1)[N+](=O)[O-])[O-])N=NC2=C(N(N=C2C)C3=CC=CC=C3)[O-].CC1=CC(=NN=C2C(=NN(C2=O)C3=CC=CC=C3)C)C(=O)C(=C1)N([O-])[O-].[Cr+3]	{1: 4, 34: 4, 35: 2, 38: 1, 33: 2, 14: 14, 15: 5, 25: 2}
Did not match all atoms present	72928-86-0	[H+].CC1=NN(C(=C1N=NC2=C(C(=CC(=C2)CC(C)(C)C)[N+](=O)[O-])[O-])[O-])C3=CC(=CC=C3)S(=O)(=O)N.CC1=NN(C(=O)C1=NN=C2C=C(C=C(C2=O)N([O-])[O-])CC(C)(C)C)C3=CC(=CC=C3)S(=O)(=O)N.[Cr+3]	{1: 8, 2: 2, 35: 2, 4: 2, 38: 1, 33: 2, 34: 4, 14: 12, 15: 5, 25: 2, 29: 4, 30: 2}
Did not match all atoms present	72928-87-1	[H+].CC1=CC(=NN=C2C(=NN(C2=O)C3=CC=CC=C3)C)C(=O)C(=C1)N([O-])[O-].CC1=NN(C(=C1N=NC2=C(C(=CC(=C2)CC(C)(C)C)[N+](=O)[O-])[O-])[O-])C3=CC(=CC=C3)S(=O)(=O)N.[Cr+3]	{1: 6, 2: 1, 35: 2, 4: 1, 38: 1, 33: 2, 34: 4, 14: 13, 15: 5, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	72928-89-3	[H+].C1=CC(=NN=C2C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)[O-])C(=O)C=C1N([O-])[O-].C1=CC(=C(C=C1[N+](=O)[O-])[O-])N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])[O-].[Cr+3]	{34: 4, 38: 1, 14: 16, 15: 3, 25: 2, 29: 6}
Did not match all atoms present	72928-91-7	[H+].CC(=O)/C(=N/NC1=C(C=CC(=C1)S(=O)(=O)N)[O-])/C(=NC2=CC=CC=C2)[O-].CC(=O)/C(=N/NC1=C(C=CC(=C1)S(=O)(=O)N)[O-])/C(=NC2=CC=CC=C2)[O-].[Co+3]	{1: 2, 34: 4, 7: 4, 14: 16, 24: 2, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	72929-03-4	CCCCCCC(CCCCCCCCCCC(=O)OCC(C)NP(=O)(N1CC1C)N2CC2C)O	{1: 4, 2: 16, 3: 2, 33: 2, 11: 2, 12: 2, 20: 1, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	72934-37-3	C1CC1(C2=CC=C(C=C2)Cl)C(=O)O	{27: 1, 17: 1, 11: 2, 13: 1, 14: 4}
Did not match all atoms present	72939-46-9	CCCCCCC(=CC1=CC=CC=C1)C(N2C=CC3=CC=CC=C32)N4C=CC5=CC=CC=C54	{1: 1, 2: 5, 3: 1, 33: 2, 6: 1, 7: 1, 14: 17}
Did not match all atoms present	72939-47-0	CC(C1=CC=CC=C1)OC(=O)CCl	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	72939-48-1	CO[C@H](CC1=CC=CC=C1)OCCCCCCCCC=C	{1: 1, 2: 9, 3: 1, 5: 1, 6: 1, 14: 5, 22: 2}
Did not match all atoms present	72939-51-6	CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)S(=O)(=O)O)S(=O)(=O)O)C6=CC=CC=C6.CN(C)C1=CC=C(C=C1)C(=N)C2=CC=C(C=C2)N(C)C.CN(C)C1=CC=C(C=C1)C(=N)C2=CC=C(C=C2)N(C)C	{1: 10, 34: 4, 35: 2, 36: 2, 33: 6, 7: 2, 12: 2, 14: 32, 15: 2, 20: 2, 25: 2, 29: 4}
Did not match all atoms present	72939-52-7	C1=CC(=CC=C1N)N=NC2=C(C=C3C=C(/C(=N/NC4=CC(=C(C=C4)NC5=CC=C(C=C5)N=NC6=C(C=C(C=C6)N)N)S(=O)(=O)O)/C(=O)C3=C2N)S(=O)(=O)O)S(=O)(=O)O	{34: 5, 14: 16, 15: 2, 20: 3, 25: 1, 29: 6, 30: 4, 31: 2}
Did not match all atoms present	72939-54-9	C1=CC=C(C=C1)NC2=C(C3=CC(=C(C(=C3C=C2)O)N=NC4=C(C=C(C=C4)C5=CC(=C(C=C5)N=NC6=C(C=C7C(=C6O)C=CC(=C7N=NC8=C(C=CC(=C8)S(=O)(=O)N)O)NC9=CC=CC=C9)S(=O)(=O)[O-])C(=O)O)C(=O)O)S(=O)(=O)[O-])N=NC1=C(C=CC(=C1)S(=O)(=O)N)O.[Na+].[Na+]	{34: 8, 14: 28, 21: 4, 27: 2, 29: 10, 30: 2, 31: 2}
Did not match all atoms present	72939-55-0	C1=CC2=CC(=C(C(=C2C(=C1)S(=O)(=O)[O-])[O-])N=NC3=C(C=C(C=C3)C4=CC(=C(C=C4)N=NC5=C(C=C6C=CC=C(C6=C5[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{34: 4, 29: 12, 14: 14}
Did not match all atoms present	72939-58-3	[H+].C1=CC(=C(C2=CC(=C(C(=C21)[O-])N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-])N=NC4=C(C(=CC(=C4)S(=O)(=O)[O-])C(=O)[O-])O)N.[Na+].[Na+].[Cr+3]	{34: 4, 38: 1, 14: 7, 21: 1, 24: 1, 29: 9, 30: 1}
Did not match all atoms present	72939-64-1	CC1=NN2C=NN=C2C(=C1)[O-].[Na+]	{1: 1, 35: 3, 14: 2, 33: 1}
Did not match all atoms present	72939-65-2	CC1=CC(=O)C2=NN=CN2N1.C(CO)N	{32: 1, 1: 1, 2: 2, 35: 2, 33: 1, 14: 2, 20: 1, 25: 1, 30: 1}
Did not match all atoms present	72939-66-3	C1=CC=C2C(=C1)N=NN2O.C(CO)N	{33: 1, 2: 2, 35: 2, 14: 4, 20: 1, 21: 1, 30: 1}
Did not match all atoms present	72939-67-4	CC1=C(C(=NC(=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)N)NCCCOCCCCO)C#N	{1: 1, 2: 7, 35: 1, 37: 1, 38: 1, 34: 2, 14: 3, 17: 1, 20: 1, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	72939-69-6	CCC1=C2C=C3C(=C4C(=O)[C@@H](C(=C5[C@H]([C@@H](C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)O)C	{32: 2, 1: 5, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 25: 1, 27: 2}
Did not match all atoms present	72939-70-9	CCC1=C2C=C3C(=C4C(=O)[C@@H](C(=C5[C@H]([C@@H](C(=N5)C=C6C(=C(C(=CC(=C1C=O)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)O)C	{32: 2, 1: 4, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 25: 1, 26: 1, 27: 2}
Did not match all atoms present	7295-44-5	CCCCC(=O)C1=CC=C(C=C1)Br	{24: 1, 1: 1, 2: 3, 18: 1, 14: 4}
Did not match all atoms present	7295-48-9	CCCCCCCC(=O)C1=CC=C(C=C1)Br	{24: 1, 1: 1, 2: 6, 18: 1, 14: 4}
Did not match all atoms present	7295-76-3	COC1=CN=CC=C1	{1: 1, 35: 1, 22: 1, 14: 4}
Did not match all atoms present	72950-02-8	C#CC1=CC(=CC=C1)N=CC2=CC=C(C=C2)C=NC3=CC=CC(=C3)C#C	{9: 2, 10: 2, 34: 2, 14: 12, 6: 2}
Did not match all atoms present	72953-47-0	CC1=CN(C2=CC=CC=C12)C(C=CC3=CC=CC=C3)N4C=C(C5=CC=CC=C54)C	{1: 2, 3: 1, 14: 15, 6: 2, 33: 2}
Did not match all atoms present	72953-51-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCOC4=C(C(=CC=C4)Br)Br)N	{2: 2, 14: 8, 18: 2, 21: 1, 22: 2, 25: 2, 30: 1}
Did not match all atoms present	72953-52-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCOC4=CC=CC=C4Br)N	{2: 2, 14: 9, 18: 1, 21: 1, 22: 2, 25: 2, 30: 1}
Did not match all atoms present	72953-55-0	CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C4[N-]3)C5=NC(=CC6=NC(=C2)C(=C6C)C=C)C(C5CCC(=O)[O-])C)C(=O)[O-])[O-])C)C=O.[K+].[K+].[Cu+2]	{1: 4, 2: 3, 35: 4, 5: 1, 6: 1, 12: 3, 14: 3, 15: 12, 24: 2, 26: 1}
Did not match all atoms present	7296-20-0	CC1=NC2=C(C=C1)C=CC3=C2N=C(C=C3)C.Cl	{1: 2, 35: 2, 14: 6, 17: 1}
Did not match all atoms present	72960-42-0	C1=CC=C(C(=C1)CC2=CC=CC=C2N=C=O)N=C=O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O	{2: 11, 8: 2, 34: 2, 14: 8, 20: 2, 27: 2, 29: 2}
Did not match all atoms present	72968-53-7	CC1=CC(=C(C(=C1)[C@H]2C[C@@]3(CC[C@H]2C3(C)C)C)O)C	{1: 5, 11: 3, 12: 2, 13: 2, 14: 2, 21: 1}
Did not match all atoms present	72968-65-1	C1CO1.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O	{2: 4, 4: 1, 11: 2, 14: 4, 20: 4, 23: 1, 28: 2}
Did not match all atoms present	72968-66-2	C1=CC(=CC=C1N)OC2=CC=C(C=C2)N.C1=CC(=CC=C1N)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)N.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{14: 27, 22: 3, 27: 1, 28: 2, 29: 2, 30: 4}
Did not match all atoms present	72968-67-3	C1=CC(=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC(=C4)N)N.C1=CC(=CC=C1N)OC2=CC=C(C=C2)N.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{14: 27, 22: 3, 27: 1, 28: 2, 29: 2, 30: 4}
Did not match all atoms present	72968-68-4	CC1=C(C=CC(=C1)NCCO)N=NC2=C(C=CC(=C2)Cl)C#N	{1: 1, 2: 2, 37: 1, 34: 2, 14: 6, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	72968-75-3	C1=CC=C(C=C1)C\2=NC3=CC=CC=C3/C2=N\NC4=CC(=C(C=C4Cl)S(=O)(=O)NCCS(=O)(=O)[O-])Cl.[Na+]	{2: 2, 35: 1, 34: 1, 14: 11, 15: 2, 17: 2, 29: 5, 31: 2}
Did not match all atoms present	72968-77-5	COC1=CC=CC=C1NC2=C(C=C3C(=C2)[N+](=C4C=C(C5=C(C4=N3)C=CC=C5S(=O)(=O)[O-])NC6=CC=CC=C6)C7=CC=CC=C7)S(=O)(=O)[O-].[Na+]	{1: 1, 35: 1, 33: 1, 14: 20, 22: 1, 29: 6, 31: 2}
Did not match all atoms present	72968-79-7	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=CC3=CC=CC=C3S(=O)(=O)O	{34: 1, 6: 1, 14: 13, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	7297-25-8	C(C(C(CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{2: 2, 3: 2, 22: 4}
Did not match all atoms present	7297-53-2	C1=CC(=CC(=C1)Cl)C=CC2=CC=C(C=C2)[N+](=O)[O-]	{17: 1, 38: 1, 14: 8, 6: 2}
Did not match all atoms present	7297-95-2	B(C1=C(C=C(C=C1C)C)C)(C2=C(C=C(C=C2C)C)C)C3=C(C=C(C=C3C)C)C	{1: 9, 14: 6}
Did not match all atoms present	72975-30-5	C1=CC=C(C=C1)[SiH2]	{14: 5}
Did not match all atoms present	7298-65-9	CCCC(=O)OC1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)OC(=O)CCC)C5=CC=CC=C5C(=O)O3	{1: 2, 2: 4, 13: 1, 14: 10, 23: 1, 28: 3}
Did not match all atoms present	7298-93-3	C1=CC(=C[N+](=C1)[C@@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@H](O3)N4C=NC5=C4N=CN=C5N)O)O)O)O)C(=O)N	{33: 2, 2: 2, 35: 3, 12: 8, 14: 6, 20: 5, 22: 3, 23: 2, 24: 1, 29: 3, 30: 2}
Did not match all atoms present	72983-69-8	CCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCC	{1: 2, 2: 4, 11: 8, 12: 4, 14: 4, 28: 1}
Did not match all atoms present	72983-70-1	CCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCC	{1: 2, 2: 6, 11: 8, 12: 4, 14: 4, 28: 1}
Did not match all atoms present	72984-30-6	CCC1=C(C2=CC3=NC(=CC4=NC(=C(C5=NC(=C(C5=C([O-])[O-])C)C=C1[N-]2)CC(=O)[O-])C(C4C)CCC(=O)[O-])C(=C3C=C)C)C.[K+].[K+].[K+].[Cu+2]	{1: 5, 2: 4, 35: 4, 5: 1, 6: 1, 7: 1, 12: 2, 14: 3, 15: 11, 24: 2}
Did not match all atoms present	72984-31-7	CCC\1=C2C=C3C(=C(C(=C(C4=NC(=CC5=NC(=CC(=N2)/C1=C/[O-])C(=C5C)C=C)C(C4CCC(=O)[O-])C)CC(=O)[O-])[N-]3)C(=O)[O-])C.[K+].[K+].[K+].[Cu+2]	{1: 4, 2: 4, 35: 4, 5: 1, 6: 2, 12: 2, 14: 3, 15: 11, 24: 3}
Did not match all atoms present	72984-32-8	CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C4[N-]3)C5=NC(=CC6=NC(=C2)C(=C6C)C=C)C(C5CCC(=O)[O-])C)C(=O)[O-])[O-])C)C.[K+].[K+].[Cu+2]	{1: 5, 2: 3, 35: 4, 5: 1, 6: 1, 12: 3, 14: 3, 15: 12, 24: 2}
Did not match all atoms present	72984-33-9	CCC1=C2C=C3C(=C4C(=O)[C@@H](C(=C5[C@H]([C@@H](C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)[O-])C4=N3)C(=O)[O-])C.[Na+].[Na+]	{32: 2, 1: 5, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 24: 2, 25: 1}
Did not match all atoms present	72984-34-0	CCC1=C2C=C3C(=C4C(=O)[C@@H](C(=C5[C@H]([C@@H](C(=N5)C=C6C(=C(C(=CC(=C1C=O)N2)N6)C=C)C)C)CCC(=O)[O-])C4=N3)C(=O)[O-])C.[Na+].[Na+]	{32: 2, 1: 4, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 24: 2, 25: 1, 26: 1}
Did not match all atoms present	72984-35-1	CCC1=C2C=C3C(=C4C(=O)[C@@H](C(=C5[C@H]([C@@H](C(=N5)C=C6C(=C(C(=CC(=C1C=O)N2)N6)C=C)C)C)CCC(=O)[O-])C4=N3)C(=O)[O-])C.[K+].[K+]	{32: 2, 1: 4, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 24: 2, 25: 1, 26: 1}
Did not match all atoms present	72984-37-3	CCC1=C2C=C3C(=C(C(=N3)C(=C4[C@H]([C@@H](C(=N4)C=C5C(=C(C(=CC(=C1C)N2)N5)C)C)C)CCC(=O)[O-])CC(=O)[O-])C(=O)[O-])C=C.[K+].[K+].[K+]	{32: 2, 1: 5, 2: 4, 35: 2, 5: 1, 6: 1, 12: 2, 14: 3, 24: 3}
Did not match all atoms present	72986-48-2	CCNC1=C(C=C2C(=C3C(=CC(=[NH+]CC)C(=C3)C)OC2=C1)C4=CC=CC=C4C(=O)OCC)C.CCNC1=C(C=C2C(=C3C(=CC(=[NH+]CC)C(=C3)C)OC2=C1)C4=CC=CC=C4C(=O)OCC)C.CCNC1=C(C=C2C(=C3C(=CC(=[NH+]CC)C(=C3)C)OC2=C1)C4=CC=CC=C4C(=O)OCC)C.CC(=O)/C(=N\NC1=CC(=CC(=C1[O-])S(=O)(=O)[O-])[N+](=O)[O-])/C(=NC2=CC=CC=C2)[O-].CC(=O)/C(=N\NC1=CC(=CC(=C1[O-])S(=O)(=O)[O-])[N+](=O)[O-])/C(=NC2=CC=CC=C2)[O-].[Cr+3]	{1: 17, 2: 9, 38: 2, 7: 4, 34: 4, 14: 38, 23: 3, 24: 2, 28: 3, 29: 6, 31: 8}
Did not match all atoms present	72986-53-9	C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CO)O	{2: 2, 27: 4, 20: 2, 14: 12}
Did not match all atoms present	72986-54-0	C1=CC(=CC=C1S(=O)(=O)C2=CC=C(C=C2)Cl)Cl.C1=CC(=CC=C1Cl)Cl.[Na+].[Na+].[S-2]	{17: 4, 29: 2, 14: 12}
Did not match all atoms present	72987-18-9	C1=CC(=CC=C1NC2=C(C=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N=NC5=C(C=C(C=C5)N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/6\C(=CC7=C(C6=O)C=C(C=C7)N=NC8=CC(=C(C=C8N)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 6, 14: 20, 15: 4, 25: 2, 29: 12, 30: 4, 31: 3}
Did not match all atoms present	72987-19-0	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN(C=[N+]3C)C.COS(=O)(=O)[O-]	{1: 4, 2: 3, 35: 1, 33: 3, 34: 2, 14: 10, 22: 1, 28: 1, 29: 3}
Did not match all atoms present	72987-22-5	CCCCCC=CCC=CCCCCCCCC(=O)NCCC[N+](C)(CCCNC(=O)CCCCCCCC=CCC=CCCCCC)[O-]	{1: 3, 2: 30, 6: 8, 24: 2, 29: 1, 31: 2}
Did not match all atoms present	72987-23-6	CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)O)S(=O)(=O)O)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)O)S(=O)(=O)O.CN(CCO)CCO.CN(CCO)CCO.CN(CCO)CCO.CN(CCO)CCO	{1: 6, 2: 16, 33: 4, 34: 4, 14: 16, 20: 12, 24: 1, 29: 8, 31: 2}
Did not match all atoms present	72987-24-7	CCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(CCCNC(=O)CCCCCCCCCCCCCCC)[O-]	{24: 2, 1: 3, 2: 34, 29: 1, 31: 2}
Did not match all atoms present	72987-25-8	CCCCCCCCC=CCCCCCCCC(=O)NCCC[N+](C)(CCCNC(=O)CCCCCCCC=CCCCCCCCC)[O-]	{1: 3, 2: 34, 6: 4, 24: 2, 29: 1, 31: 2}
Did not match all atoms present	72987-26-9	CCCCCCCC/C=C/CCCCCCCC(=O)NCCC[N@+](C)(CCO)[O-]	{1: 2, 2: 19, 6: 2, 20: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	72987-27-0	CCCCCCCCCCCCCCCC(=O)NCCC[N@+](C)(CCO)[O-]	{1: 2, 2: 19, 20: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	72987-28-1	CCCCC/C=C/C/C=C/CCCCCCCC(=O)NCCC[N@+](C)(CCO)[O-]	{1: 2, 2: 17, 6: 4, 20: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	72987-30-5	CC(C)(C)C1=CC=C(C=C1)C(=O)C2CCCCC2C(=O)O.CC(C)(C)C1=CC=C(C=C1)C(=O)C2CCCCC2C(=O)O.C1CCCCC1	{1: 6, 4: 2, 11: 14, 12: 4, 14: 8, 24: 2, 27: 2}
Did not match all atoms present	72987-31-6	CCCCCCCCCCCCCCCCCCCCCC(=O)OCN(COC)C1=NC(=NC(=N1)N(COC)COC(=O)CCCCCCCCCCCCCCCCCCC)N(COC)COC(=O)CCCCCCCCCCCCCCCCCCC	{1: 6, 2: 62, 35: 3, 33: 3, 22: 3, 28: 3}
Did not match all atoms present	72987-32-7	CCCCCCCCCCCCCCCCCCCC(=O)O/C(=N\COC)/C1=NC(=NC(=N1)/C(=N/COC)/OC(=O)CCCCCCCCCCCCCCCCCCC)/C(=N/COC)/OC(=O)CCCCCCCCCCCCCCCCCCC	{1: 6, 2: 57, 35: 3, 7: 3, 34: 3, 22: 3, 28: 3}
Did not match all atoms present	72987-33-8	CC1=NC2=C(O1)C=C(C=C2)C(=O)C3=CC=CC=C3	{24: 1, 1: 1, 35: 1, 14: 8, 23: 1}
Did not match all atoms present	72987-35-0	CC(C)(C)C1=CC=C(C=C1)C2=NNC(=O)C3=C2CCCC3	{32: 1, 1: 3, 35: 1, 4: 1, 11: 4, 14: 4, 25: 1}
Did not match all atoms present	72987-36-1	CCC(CC1=NC(=NC(=N1)N)N)C2=NC(=NC(=N2)N)N	{1: 1, 2: 2, 3: 1, 30: 4, 35: 6}
Did not match all atoms present	72987-38-3	CCC(=O)NC1=C(C=CC(=C1)NCCOC(=O)C)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C	{1: 3, 2: 3, 38: 1, 34: 2, 14: 6, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	72987-39-4	C1=CC(=CC(=C1)S(=O)(=O)O)NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(/C(=N\NC5=CC=C(C=C5)S(=O)(=O)CCOS(=O)(=O)O)/C4=O)S(=O)(=O)O	{2: 2, 35: 3, 34: 1, 14: 11, 15: 2, 17: 1, 20: 4, 22: 1, 25: 1, 29: 10, 31: 3}
Did not match all atoms present	72987-42-9	CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=NC=C(S2)[N+](=O)[O-]	{1: 1, 2: 4, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 4, 20: 2}
Did not match all atoms present	72987-50-9	CC(CC1=NC(=NC(=N1)N)N)CC2=NC(=NC(=N2)N)N.C=O	{1: 1, 2: 2, 3: 1, 5: 1, 35: 6, 30: 4}
Did not match all atoms present	72987-53-2	CCCCC(CC)COC(=O)C=C.CC(C)COC(=O)C(=C)C.CC(C)(C)C1=CC=CC=C1C=C	{1: 8, 2: 6, 3: 2, 4: 1, 5: 3, 6: 2, 7: 1, 14: 4, 28: 2}
Did not match all atoms present	72987-57-6	CC(C)OC(=O)C=CC1=CC=CO1	{1: 2, 3: 1, 6: 2, 14: 3, 23: 1, 28: 1}
Did not match all atoms present	72987-62-3	CCC1=NC=CN=C1SC	{40: 1, 1: 2, 2: 1, 35: 2, 14: 2}
Did not match all atoms present	7299-89-0	CCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CC	{1: 4, 2: 6, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	7299-93-6	CCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CC	{24: 2, 1: 2, 2: 4, 14: 2}
Did not match all atoms present	73-03-0	C1[C@H](O[C@H]([C@@H]1O)N2C=NC3=C2N=CN=C3N)CO	{33: 1, 2: 1, 35: 3, 11: 1, 12: 3, 14: 2, 20: 2, 23: 1, 30: 1}
Did not match all atoms present	73-22-3	C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	73-24-5	C1=NC2=C(N1)C(=NC=N2)N	{32: 1, 35: 3, 30: 1, 14: 2}
Did not match all atoms present	73-31-4	CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC	{32: 1, 1: 2, 2: 2, 14: 4, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	73-40-5	C1=NC2=C(N1)C(=O)N=C(N2)N	{32: 2, 25: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	73-48-3	C1=CC=C(C=C1)CC2NC3=C(C=C(C(=C3)C(F)(F)F)S(=O)(=O)N)S(=O)(=O)N2	{32: 2, 2: 1, 4: 1, 12: 1, 14: 7, 16: 3, 29: 4, 30: 1}
Did not match all atoms present	73-49-4	CCC1NC2=CC(=C(C=C2C(=O)N1)S(=O)(=O)N)Cl	{32: 2, 1: 1, 2: 1, 12: 1, 14: 2, 17: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	73-66-5	CCOCC1=CN=C(N=C1N)C	{1: 2, 2: 2, 35: 2, 14: 1, 22: 1, 30: 1}
Did not match all atoms present	73-78-9	CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.Cl	{1: 4, 2: 3, 33: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	730-23-4	C1=CC(=CC(=C1)[N+](=O)[O-])N=NC2=CC=C(C=C2)N	{34: 2, 38: 1, 30: 1, 14: 8}
Did not match all atoms present	730-40-5	C1=CC(=CC=C1N)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{34: 2, 38: 1, 30: 1, 14: 8}
Did not match all atoms present	7300-26-7	C1=CC(=CC=C1NC2=CC=C(C=C2)N=[N+]=[N-])N=[N+]=[N-]	{34: 4, 14: 8, 31: 1}
Did not match all atoms present	73000-03-0	CC(C)(C)[Si](C)(C1=C(C(=C(C(=C1F)F)F)F)F)Cl	{16: 5, 1: 4, 4: 1, 17: 1}
Did not match all atoms present	73002-55-8	C1=CC(=CC=C1C(=O)O)C(=O)O.C(CCCCCC(=O)O)CCCCCN.C(CCO)CO	{2: 15, 27: 3, 20: 2, 30: 1, 14: 4}
Did not match all atoms present	73003-20-0	C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCCCC(=O)O)CCCCCN.C(CCO)CO	{2: 15, 27: 3, 20: 2, 30: 1, 14: 4}
Did not match all atoms present	73003-33-5	[H+].[H+].CC1=NN(C(=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC=CC=C4.[Cr+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 14: 18, 29: 3}
Did not match all atoms present	73003-37-9	CC(C)CC1=CC2=CC=CC=C2C(=C1S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 2: 1, 3: 1, 29: 6, 14: 5}
Did not match all atoms present	73003-39-1	CC(C)CC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])CC(C)C.[Na+].[Na+]	{1: 4, 2: 2, 3: 2, 29: 6, 14: 4}
Did not match all atoms present	73003-51-7	CC1CCCC2C1C(=O)OC2=O.CC1CO1.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 4, 4: 1, 11: 4, 12: 4, 14: 8, 21: 2, 23: 1, 28: 2}
Did not match all atoms present	73003-52-8	CC1CO1.CC1C=CCC2C1C(=O)OC2=O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 4, 4: 1, 11: 2, 12: 4, 14: 10, 21: 2, 23: 1, 28: 2}
Did not match all atoms present	73003-56-2	CC/C(=N\O)/C.CC1=C(C=CC=C1N=C=O)N=C=O.C1CCC(=O)OCC1	{1: 3, 2: 1, 7: 1, 8: 2, 11: 5, 34: 3, 14: 3, 20: 1, 28: 1, 29: 2}
Did not match all atoms present	73003-59-5	CC1CO1.C[Si](C)(O)O	{1: 3, 11: 1, 12: 1, 20: 2, 23: 1}
Did not match all atoms present	73003-60-8	CC(=O)NC1=C2C(=C(C=C1)S(=O)(=O)[O-])C=C(/C(=N\NC3=C(C=CC(=C3)CN(C)C4=C(C(=NC(=N4)F)F)Cl)S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 2: 1, 35: 2, 33: 1, 34: 1, 14: 6, 15: 2, 16: 2, 17: 1, 24: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	73003-61-9	C1=CC(=C(C=C1NC2=C(C(=NC(=N2)F)F)Cl)S(=O)(=O)[O-])NNC3=C4C(=C(C=CC4=O)S(=O)(=O)[O-])C=CC3=N.[Na+].[Na+]	{35: 2, 36: 1, 14: 7, 15: 5, 16: 2, 17: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	73003-66-4	CNC1=C2C(=C(C=C1)NCCC[N+](C)(C)C)C(=O)C3=CC=CC=C3C2=O.[Cl-]	{1: 4, 2: 3, 14: 6, 17: 1, 25: 2, 31: 2}
Did not match all atoms present	73003-67-5	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN(C=[N+]3C)C.[Cl-]	{1: 3, 2: 3, 35: 1, 33: 3, 34: 2, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	73003-68-6	C1=CC(=CC=C1NC2=C(C=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N=NC5=CC(=C(C=C5N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/6\C(=CC7=C(C6=O)C=C(C=C7)N=NC8=C(C=C(C=C8)N)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 6, 14: 20, 15: 4, 25: 2, 29: 12, 30: 4, 31: 3}
Did not match all atoms present	73003-69-7	C1=CC(=CC=C1NC2=C(C=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N=NC5=CC(=C(C=C5N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/6\C(=CC7=C(C6=O)C=C(C=C7)N=NC8=CC(=C(C=C8N)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 6, 14: 19, 15: 4, 25: 2, 29: 15, 30: 4, 31: 3}
Did not match all atoms present	73003-70-0	CCCCCCCC[Sn](OC(=O)/C=C/C(=O)O)(OC(=O)/C=C/C(=O)O)CCCCCCCC	{1: 2, 2: 14, 27: 2, 28: 2, 6: 4}
Did not match all atoms present	73003-72-2	CCOC1=C(C=C(C=C1)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N/NC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)O)/C(=C5)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.CN(CCO)CCO.CN(CCO)CCO.CN(CCO)CCO.CN(CCO)CCO	{1: 5, 2: 17, 33: 4, 34: 2, 14: 17, 15: 4, 20: 12, 22: 1, 24: 1, 25: 2, 29: 8, 31: 4}
Did not match all atoms present	73003-74-4	CCSC1=NC=CN=C1CC(C)C	{1: 3, 2: 2, 3: 1, 40: 1, 14: 2, 35: 2}
Did not match all atoms present	73003-79-9	CCCOC(=O)C1=CC(=C(C(=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N)OS(=O)(=O)C4=CC=CC5=C4C=CC(=C5[O-])[N+]#N)OS(=O)(=O)C6=CC=CC7=C6C=CC(=C7[O-])[N+]#N	{1: 1, 2: 2, 34: 3, 14: 17, 22: 3, 28: 1, 29: 6}
Did not match all atoms present	73003-81-3	CCOC(=O)C1=CC(=C(C(=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N)OS(=O)(=O)C4=CC=CC5=C4C=CC(=C5[O-])[N+]#N)OS(=O)(=O)C6=CC=CC7=C6C=CC(=C7[O-])[N+]#N	{1: 1, 2: 1, 34: 3, 14: 17, 22: 3, 28: 1, 29: 6}
Did not match all atoms present	73003-85-7	CC1=C(C=CC(=C1)S(=O)(=O)O)N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=CC(=CC(=C5C=C4)O)S(=O)(=O)O)S(=O)(=O)O.C(CO)NCCO.C(CO)NCCO.C(CO)NCCO	{1: 1, 2: 12, 34: 1, 14: 12, 15: 2, 20: 9, 21: 1, 24: 1, 25: 1, 29: 6, 31: 6}
Did not match all atoms present	73003-87-9	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.CC1=C(C=CC(=C1)C(C2=CC=C(C=C2)OC)C3=CC(=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)[O-])C)C)N=NC6C(=NN(C6=O)C7=CC=C(C=C7)S(=O)(=O)[O-])C	{1: 15, 2: 6, 3: 1, 33: 2, 12: 2, 34: 4, 14: 34, 15: 2, 35: 2, 22: 1, 23: 2, 25: 2, 28: 2, 29: 6, 31: 4}
Did not match all atoms present	73003-88-0	CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)C3=C(C=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)S(=O)(=O)O)S(=O)(=O)O)C6=CC=CC=C6.CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3Cl.CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3Cl	{1: 10, 34: 4, 35: 2, 33: 6, 7: 2, 12: 2, 14: 40, 15: 6, 17: 2, 20: 2, 25: 2, 29: 4}
Did not match all atoms present	73003-89-1	CC[NH+]=C1C=CC(=C(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC)C4=CC=CC=C14.CC[NH+]=C1C=CC(=C(C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC)C4=CC=CC=C14.C1=CC(=CC2=CC(=C(C=C21)O)S(=O)(=O)[O-])S(=O)(=O)[O-]	{1: 10, 2: 10, 33: 4, 7: 2, 14: 33, 15: 4, 21: 1, 29: 6, 31: 2}
Did not match all atoms present	73003-98-2	[H+].[H+].C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].C1=CC=C2C(=C1)C=CC(=O)C2=NN=C3C=CC(=CC3=O)N([O-])[O-].[Cr+3]	{34: 4, 38: 1, 14: 17, 15: 3, 25: 2, 29: 3}
Did not match all atoms present	73018-27-6	CCOCCOCCOP(=O)([O-])[O-].[Na+].[Na+]	{1: 1, 2: 5, 29: 3, 22: 3}
Did not match all atoms present	73018-35-6	C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2C=CC(=C3[O-])[N+]#N.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O	{2: 1, 8: 2, 34: 3, 14: 18, 22: 1, 29: 4}
Did not match all atoms present	73018-40-3	CCCCCCCCCCCCC1=CC=CC=C1[N+](=O)[O-].C1=CC=C(C=C1)N.C1=CC=C(C=C1)[N+](=O)[O-].Cl.[Fe]	{1: 1, 2: 11, 38: 2, 14: 14, 17: 1, 30: 1}
Did not match all atoms present	73018-81-2	CN1/C(=N/N=C/2\[N+]3=C(SC=C3)N=C2C4=CC=CC=C4)/SC=C1.CN1/C(=N/N=C/2\[N+]3=C(SC=C3)N=C2C4=CC=CC=C4)/SC=C1.Cl[Zn-2](Cl)(Cl)Cl	{1: 2, 34: 4, 35: 2, 33: 4, 41: 4, 14: 18, 15: 4, 17: 4}
Did not match all atoms present	73018-84-5	[H+].[H+].CC(=O)/C(=N\NC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)[O-])[O-])/C(=NC3=CC=CC=C3)[O-].CC(=O)/C(=N\NC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)[O-])[O-])/C(=NC3=CC=CC=C3)[O-].[Na+].[Co+3]	{1: 2, 34: 4, 7: 4, 14: 24, 24: 4, 29: 4, 31: 4}
Did not match all atoms present	73018-85-6	[H+].CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=C(C=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=C(C=C3)Cl.[Cr+3]	{1: 4, 34: 4, 35: 2, 33: 2, 14: 14, 17: 2, 29: 4, 31: 2}
Did not match all atoms present	73018-86-7	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=C(C=C3)Cl.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC)[O-])[O-])C3=CC(=CC=C3)Cl.[Cr+3]	{1: 4, 34: 4, 35: 2, 33: 2, 14: 14, 17: 2, 29: 4, 31: 2}
Did not match all atoms present	73018-98-1	C(C(CON=[N+]=[N-])O)O	{2: 2, 3: 1, 20: 2, 34: 2, 22: 1}
Did not match all atoms present	73019-01-9	CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)O.CC(C)NC(C)C	{1: 5, 3: 2, 38: 1, 14: 3, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	73019-05-3	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=C(C=C4)NC(=O)NC5=CC=C(C=C5)N/N=C\6/C=CC(=O)C(=C6)C(=O)[O-])S(=O)(=O)[O-])N.[NH4+].[Na+]	{34: 1, 14: 16, 15: 2, 24: 2, 25: 3, 29: 3, 30: 1, 31: 4}
Did not match all atoms present	73019-10-0	CCN(CCOC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=[N+](C=NN3C)C.[Cl-]	{1: 3, 2: 3, 35: 1, 33: 3, 34: 2, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	73019-17-7	CN(C)C(=O)NC1=CC=CC2=C1C=CC=C2NC(=O)N(C)C	{24: 2, 1: 4, 33: 2, 14: 6, 31: 2}
Did not match all atoms present	73019-18-8	CCCCCC1=CC=C(C=C1)C(=NN=C(C)C2=CC=C(C=C2)CCCCC)C	{1: 4, 2: 8, 34: 2, 14: 8, 7: 2}
Did not match all atoms present	73019-19-9	CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)CC2=CC=C(C=C2)C(=O)NCCN(CCC)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 22, 4: 8, 33: 1, 14: 8, 16: 17, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	73019-20-2	CCCN(CCNC(=O)C1=CC(=C(C=C1)C)C(=O)NCCN(C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 3, 2: 6, 4: 16, 33: 2, 14: 3, 16: 34, 24: 2, 29: 4, 31: 2}
Did not match all atoms present	73019-24-6	CC1=NSC(=C1C#N)N=NC2=C(C=C(C=C2)N(CCC#N)CC=CCl)NC(=O)C	{1: 2, 2: 3, 35: 1, 37: 2, 6: 2, 33: 1, 41: 1, 34: 2, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	73019-25-7	C1=CC=C\2C(=C1)C=CC(=O)/C2=N/NC3=C4C=CC(=CC4=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Ca+2]	{34: 1, 14: 11, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	73019-26-8	C1=CC=C\2C(=C1)C=C(C(=O)/C2=N\NC3=CC4=C(C=C3)C=C(C=C4)S(=O)(=O)[O-])C(=O)[O-].[Mn+2]	{34: 1, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	73019-27-9	C1=CC=C2C(=C1)C=CC(=C2N/N=C/3\C4=CC=CC=C4C=C(C3=O)C(=O)[O-])S(=O)(=O)[O-].[Ca+2]	{34: 1, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	73023-02-6	C1CN2CCCN(C1)C3=CC=CC=C32	{33: 2, 11: 6, 14: 4}
Did not match all atoms present	73023-80-0	[Si]1([Si]([Si]([Si]1(Cl)Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 8}
Did not match all atoms present	73032-94-7	CC(C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)CC5=CC=CC=C5)CC(=O)N)CCCCN)NC(=O)CNC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCC(=O)O)NC(=O)C(CCCNC(=N)N)NC(=O)C6CCCN6C(=O)C(C)NC(=O)C(CCSC)NC(=O)C(C)NC(=O)C7CCCN7C(=O)C(CC(=O)N)NC(=O)C(CO)NC(=O)C(CC(=O)N)NC(=O)C(C)NC(=O)C(CO)N)C(=O)O)CO)C(C)O)CC8=CC=CC=C8)O	{32: 12, 1: 7, 2: 33, 3: 15, 36: 2, 33: 2, 7: 2, 40: 1, 41: 2, 11: 8, 12: 14, 14: 20, 20: 5, 24: 19, 25: 11, 27: 2, 30: 9, 31: 16}
Did not match all atoms present	73033-58-6	C1=CC(=C(C=C1Cl)CO)[N+](=O)[O-]	{17: 1, 2: 1, 20: 1, 38: 1, 14: 3}
Did not match all atoms present	73038-27-4	CC1=CC(CC2C1C(=O)OC2=O)C3CC(=O)OC3=O.C1=CC(=CC=C1N)OC2=CC=C(C=C2)N	{1: 1, 11: 2, 12: 4, 14: 9, 15: 1, 22: 1, 28: 4, 30: 2}
Did not match all atoms present	73038-33-2	CCCN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.CC1CO1.CC(=C)C(=O)O.C1CO1	{1: 3, 2: 4, 4: 8, 5: 2, 6: 1, 7: 1, 11: 3, 12: 1, 16: 17, 23: 2, 33: 1, 27: 1, 28: 1, 29: 2}
Did not match all atoms present	73038-34-3	C[C@H]1[C@@H](C(=O)N(N1)C2=CC=CC=C2)N=N[C@H]3CC4=C(C3)C=C(C=C4)OC	{32: 1, 1: 2, 34: 2, 33: 1, 11: 2, 12: 3, 14: 8, 22: 1, 25: 1}
Did not match all atoms present	7304-48-5	CC(C)C[Sn](CC(C)C)(CC(C)C)F	{16: 1, 1: 6, 2: 3, 3: 3}
Did not match all atoms present	7304-99-6	CN(C)C(=O)OC1=CC=CC(=C1)[N+](=O)[O-]	{1: 2, 28: 1, 38: 1, 14: 4, 33: 1}
Did not match all atoms present	73049-31-7	C=CCO.C=CC1=CC=CC=C1.C(=C/C(=O)O)\C(=O)O	{2: 1, 5: 2, 6: 4, 14: 5, 20: 1, 27: 2}
Did not match all atoms present	73049-89-5	CCCCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OC[C@@H](COC(C)(O)O)O	{1: 2, 2: 19, 3: 1, 4: 1, 14: 4, 20: 3, 22: 1, 28: 2}
Did not match all atoms present	7305-03-5	CN(C)C(=O)OC1=CC=C(C=C1)Cl	{1: 2, 28: 1, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	7305-08-0	CC1=CC=C(C=C1)OC(=O)N(C)C	{1: 3, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	7305-10-4	CN(C)C(=O)OC1=CC=C(C=C1)OC	{1: 3, 28: 1, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	7305-71-7	CC1=CN=C(S1)N	{1: 1, 35: 1, 30: 1, 14: 1, 41: 1}
Did not match all atoms present	73050-02-9	CCOC(OCC)[Si]CCP(=O)(OCC)OCC.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{1: 4, 2: 6, 3: 1, 17: 4, 22: 4, 29: 1}
Did not match all atoms present	73050-06-3	CCCCCCCCCCCCCCCCCCCCCCCCCC[C@H](COP(=O)(O)O)O	{1: 1, 2: 26, 3: 1, 20: 3, 22: 1, 29: 1}
Did not match all atoms present	73050-11-0	C=CC#N.C1=CC(=CC(=C1)CN)CN	{2: 2, 5: 1, 6: 1, 14: 4, 30: 2, 37: 1}
Did not match all atoms present	73050-13-2	CCCCCCCCCCCCCCCCCCO.CC(C)O.[Ti]	{1: 3, 2: 17, 3: 1, 20: 2}
Did not match all atoms present	73050-14-3	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)COC2=CC=CC=C2.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{1: 2, 2: 1, 4: 1, 11: 1, 12: 1, 14: 16, 21: 2, 22: 1, 23: 1, 27: 1, 28: 2}
Did not match all atoms present	73052-41-2	C1=CC=[N+](C=C1)CC2=CC=C(C=C2)S(=O)(=O)[O-]	{33: 1, 2: 1, 29: 3, 14: 9}
Did not match all atoms present	73057-78-0	C1=COC=C1C[Hg]Cl	{17: 1, 2: 1, 14: 3, 23: 1}
Did not match all atoms present	73057-79-1	C1=CSC=C1[Hg]Cl	{17: 1, 14: 3, 41: 1}
Did not match all atoms present	73057-80-4	C1=CSC=C1C[Hg]Cl	{17: 1, 2: 1, 14: 3, 41: 1}
Did not match all atoms present	7306-05-0	CC1(CCC1)C2=CC=CC=C2	{1: 1, 11: 3, 13: 1, 14: 5}
Did not match all atoms present	7306-46-9	COC1=C(C=C(C=C1)CCl)OC	{1: 2, 2: 1, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	73070-48-1	CCCCC(CC)COP(=O)(O)O.C(CO)NCCO	{1: 2, 2: 9, 3: 1, 20: 4, 22: 1, 29: 1, 31: 1}
Did not match all atoms present	73070-49-2	CC(C)CCCCCOP(=O)(O)O.C(CO)N(CCO)CCO	{1: 2, 2: 11, 3: 1, 33: 1, 20: 5, 22: 1, 29: 1}
Did not match all atoms present	73074-20-1	C1=CC(=CN=C1)N.Cl	{17: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	73075-59-9	C1=CC(=C2C=NC=CC2=C1Cl)Cl	{17: 2, 35: 1, 14: 5}
Did not match all atoms present	73076-88-7	C[As](C)[Se]C	{1: 3}
Did not match all atoms present	73080-51-0	CC1=C(C2=C(C=C1)C3=C(C(=O)C=C(O3)C(=O)OCCC(C)C)C(=O)N2)C	{32: 1, 1: 4, 2: 2, 3: 1, 14: 3, 23: 1, 25: 2, 28: 1}
Did not match all atoms present	73081-88-6	C1CC(=O)N(C1)C2=CC=C(C=C2)C(F)(F)F	{33: 1, 4: 1, 11: 3, 14: 4, 16: 3, 25: 1}
Did not match all atoms present	73085-26-4	COC1=CC(=CC(=C1OC)OC)CCNCCC2=CC(=C(C(=C2)OC)OC)OC.COC1=CC(=CC(=C1OC)OC)CCNCCC2=CC(=C(C(=C2)OC)OC)OC.Cl[Mn](Cl)(Cl)Cl	{1: 12, 2: 8, 14: 8, 17: 4, 22: 12, 31: 2}
Did not match all atoms present	73090-70-7	CCOC1=CC(=CC(=C1N2C=CC=C2)OCC)CC3=CN=C(N=C3N)N	{1: 2, 2: 3, 35: 2, 33: 1, 14: 7, 22: 2, 30: 2}
Did not match all atoms present	73096-42-1	C1=CC=C(C(=C1)C2=NNN=N2)Br	{32: 1, 18: 1, 35: 3, 14: 4}
Did not match all atoms present	731-27-1	CC1=CC=C(C=C1)N(SC(F)(Cl)Cl)S(=O)(=O)N(C)C	{1: 3, 4: 1, 33: 2, 40: 1, 14: 4, 16: 1, 17: 2, 29: 2}
Did not match all atoms present	7310-74-9	C1=CC=C(C=C1)C=CC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{2: 1, 18: 1, 14: 20, 6: 2}
Did not match all atoms present	7310-87-4	CCN1C2=CC=CC=C2[Se]C1=CC(=CC3=[N+](C4=CC=CC=C4[Se]3)CC)C.[I-]	{1: 3, 2: 2, 33: 2, 6: 2, 7: 1, 14: 8, 15: 1, 19: 1}
Did not match all atoms present	7310-95-4	CC1=CC(=C(C(=C1)C=O)O)C=O	{1: 1, 26: 2, 21: 1, 14: 2}
Did not match all atoms present	73106-12-4	CC(=O)NC1=C(C2=C(C=C1)C3=CC=CC=C3C2)N(C4=CC5=C(C=C4)C6=CC=CC=C6C5)C(=O)C	{1: 2, 33: 1, 11: 2, 14: 13, 24: 2, 31: 1}
Did not match all atoms present	7311-34-4	COC1=CC(=CC(=C1)C=O)OC	{1: 2, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	73118-22-6	CC(=O)C(C1=CC=CC=C1)(C(=O)OC(CN(C)C)C2=CC=CC=C2)O	{1: 3, 2: 1, 3: 1, 4: 1, 33: 1, 14: 10, 20: 1, 24: 1, 28: 1}
Did not match all atoms present	73118-23-7	COC([CH2-])CC1=C(N(C(=O)NC1=O)CC([CH2-])OC)[O-].[OH-].[OH-].[Na].[Na+].[Hg+2].[Hg+2]	{32: 1, 1: 2, 2: 2, 3: 2, 5: 2, 33: 1, 22: 2, 25: 2}
Did not match all atoms present	73118-24-8	COC(CC1(C(=O)NC(=O)NC1=O)CC(C[Hg])OC)C[Hg].[OH-].[OH-].[Na+].[Na+]	{32: 2, 1: 2, 2: 4, 3: 2, 13: 1, 22: 2, 25: 3}
Did not match all atoms present	73121-56-9	COC(=O)CCC=C=CC[C@@H]1[C@H]([C@@H](CC1=O)O)/C=C/[C@H](COC2=CC=CC=C2)O	{1: 1, 2: 4, 3: 1, 6: 4, 8: 1, 11: 1, 12: 3, 14: 5, 20: 2, 22: 1, 25: 1, 28: 1}
Did not match all atoms present	73128-36-6	[OH-].[OH-].[OH-].[OH-].[Fe+2]	{}
Did not match all atoms present	73128-65-1	[H+].[H+].[H+].[H+].C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Hg+2]	{24: 6, 33: 2, 2: 6}
Did not match all atoms present	73138-90-6	CCCCCCCCCCCCNS(=O)O	{1: 1, 2: 11, 20: 1, 29: 1, 31: 1}
Did not match all atoms present	7314-06-9	C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)N)N	{30: 2, 14: 8, 6: 2}
Did not match all atoms present	7314-08-1	CC1(CC=C(C=C1)C=CC2=CC=CC=C2)N	{1: 1, 6: 2, 11: 1, 13: 1, 14: 8, 15: 1, 30: 1}
Did not match all atoms present	7314-37-6	CCCCCCCCCCCCCCS(=O)(=O)O	{1: 1, 2: 13, 20: 1, 29: 2}
Did not match all atoms present	7314-44-5	COC1=CC(=C(C=C1)CO)OC	{1: 2, 2: 1, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	7315-17-5	C1=CC=C(C(=C1)CCC#N)Cl	{17: 1, 2: 2, 37: 1, 14: 4}
Did not match all atoms present	7315-27-7	CCCCO/N=C(\C)/C1CC2=CC=CC=C12	{1: 2, 2: 3, 7: 1, 11: 1, 12: 1, 34: 1, 14: 4, 22: 1}
Did not match all atoms present	7315-32-4	C=CC1=CC2=C(C=C1)OCO2	{14: 3, 11: 1, 5: 1, 6: 1, 23: 2}
Did not match all atoms present	73157-44-5	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N=NC5=CC(=C(C=C5N)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC6=C(C=C(C=C6)N)N.[Na+].[Na+].[Na+]	{34: 7, 14: 15, 15: 2, 25: 1, 29: 9, 30: 5, 31: 1}
Did not match all atoms present	73157-47-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=CC(=C4)CS(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{2: 3, 14: 9, 22: 1, 25: 2, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	73157-48-9	C1=CC=C(C(=C1)N/N=C/2\C(=CC3=C(C=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 1, 14: 11, 15: 2, 17: 1, 22: 1, 25: 1, 29: 14, 31: 3}
Did not match all atoms present	73157-50-3	C1=CC(=CC=C1C2=CC=C(C=C2)N=NC3=NC=C(S3)[N+](=O)[O-])NCCO	{2: 2, 35: 1, 38: 1, 41: 1, 34: 2, 14: 9, 20: 1, 31: 1}
Did not match all atoms present	73157-53-6	CCC(=O)NC1=C(C=CC(=C1)NC(C)C)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 3, 2: 1, 3: 1, 38: 1, 34: 2, 14: 6, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	73157-54-7	C1=CC=C(C(=C1)N=NC2=C(C=C3C=C(/C(=N\NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)[O-])/C(=O)C3=C2N)S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{2: 2, 34: 3, 14: 10, 15: 2, 17: 1, 22: 1, 25: 1, 29: 11, 30: 1, 31: 1}
Did not match all atoms present	73157-55-8	C1=CC(=C(C(=C1)Cl)Cl)N=NC2=C(C=C3C=C(/C(=N\NC4=CC=C(C=C4)S(=O)(=O)CCOS(=O)(=O)[O-])/C(=O)C3=C2N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 2, 34: 3, 14: 9, 15: 2, 17: 2, 22: 1, 25: 1, 29: 11, 30: 1, 31: 1}
Did not match all atoms present	7316-37-2	CCOP(=O)(CC1CO1)OCC	{1: 2, 2: 3, 11: 1, 12: 1, 22: 2, 23: 1, 29: 1}
Did not match all atoms present	7316-90-7	CC1=CC2=C(C=CC(=O)O2)C(=O)O1	{1: 1, 28: 2, 14: 3}
Did not match all atoms present	73160-32-4	CCC(=NO[Si](C)(C=C)ON=C(C)CC)C	{1: 5, 2: 2, 5: 1, 6: 1, 7: 2, 34: 2, 22: 2}
Did not match all atoms present	73176-66-6	CC1([C@H]([C@@H]1C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)/C=C(\C(F)(F)F)/F)C	{1: 2, 2: 1, 4: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 9, 16: 4, 22: 1, 28: 1}
Did not match all atoms present	73177-67-0	CCCC(C)C(C1=CC=CC=C1)O	{1: 2, 2: 2, 3: 2, 20: 1, 14: 5}
Did not match all atoms present	73179-37-0	CC1=C(C(=CC=C1)C)OP(=O)(OC2=C(C=CC=C2C)C)OC3=C(C=C(C=C3C)C)C	{1: 7, 22: 3, 14: 8, 29: 1}
Did not match all atoms present	73179-39-2	CC1=CC(=C(C=C1SC2=CC(=C(C=C2C)P(C3=C(C=C(C(=C3)C)SC4=CC(=C(C=C4C)O)C(C)(C)C)C(C)(C)C)C5=C(C=C(C(=C5)CO)SC6=CC(=C(C=C6C)O)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)O	{1: 23, 2: 1, 4: 6, 40: 3, 14: 12, 20: 1, 21: 3}
Did not match all atoms present	73179-41-6	CC1=C(C(=CC=C1)C)OP(=O)(OC2=CC=CC=C2)OC3=C(C=C(C=C3C)C)C	{1: 5, 22: 3, 14: 10, 29: 1}
Did not match all atoms present	73179-43-8	CC1=CC(=C(C(=C1)C)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)C	{1: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	73179-44-9	CC1=CC(=C(C(=C1)C)OP(=O)(OC2=CC=CC=C2)OC3=C(C=C(C=C3C)C)C)C	{1: 6, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	7318-71-0	B(N(C)C)(N(C)C)I	{1: 4, 19: 1, 33: 2}
Did not match all atoms present	7318-72-1	B(N(C)C)(I)I	{1: 2, 19: 2, 33: 1}
Did not match all atoms present	7318-78-7	B(C)(Cl)Cl	{1: 1, 17: 2}
Did not match all atoms present	7318-81-2	B(C)(OC)OC	{1: 3, 22: 2}
Did not match all atoms present	7318-82-3	B(CC)(OC)OC	{1: 3, 2: 1, 22: 2}
Did not match all atoms present	7318-93-6	B1(N(N(B(N(N1C)C)C)C)C)C	{1: 6, 33: 4}
Did not match all atoms present	73183-34-3	B1(OC(C(O1)(C)C)(C)C)B2OC(C(O2)(C)C)(C)C	{1: 8, 13: 4, 23: 4}
Did not match all atoms present	7319-86-0	CCCCCCCC(=O)[O-].CCCCCCCC(=O)[O-].[PbH2+2]	{24: 2, 1: 2, 2: 12}
Did not match all atoms present	73195-13-8	CC1=C(C(=CC=C1)C)OP(=O)(OC2=C(C=C(C=C2C)C)C)OC3=C(C=C(C=C3C)C)C	{1: 8, 22: 3, 14: 7, 29: 1}
Did not match all atoms present	73195-17-2	CC(CNS(=O)(=O)C1=CC2=C(C=C1)C(=C(C=C2)[NH-])N=NC3=C(C(=CC=C3)[N+](=O)[O-])[O-])O.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-].[Na+].[Co+3]	{1: 1, 2: 1, 3: 1, 36: 1, 38: 1, 34: 4, 14: 17, 17: 1, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	732-11-6	COP(=S)(OC)SCN1C(=O)C2=CC=CC=C2C1=O	{1: 2, 2: 1, 33: 1, 40: 1, 14: 4, 22: 2, 25: 2}
Did not match all atoms present	732-26-3	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 9, 4: 3, 21: 1, 14: 2}
Did not match all atoms present	7320-34-5	[O-]P(=O)([O-])OP(=O)([O-])[O-].[K+].[K+].[K+].[K+]	{29: 6, 22: 1}
Did not match all atoms present	7320-53-8	CC1=CC=CC2=C1OC3=CC=CC=C23	{1: 1, 14: 7, 23: 1}
Did not match all atoms present	7321-53-1	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Fe+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	7322-37-4	CCCC[N+](CCC(C)C)(CCC(C)C)CCC(C)C.[Br-]	{1: 7, 2: 9, 3: 3, 18: 1}
Did not match all atoms present	7322-46-5	C1CC2C=CC1C3=CC=CC=C23	{11: 2, 12: 2, 14: 6}
Did not match all atoms present	7323-63-9	CC(C)(C)C1=CC(=C(C=C1OC)C(C)(C)C)OC	{1: 8, 4: 2, 22: 2, 14: 2}
Did not match all atoms present	73231-04-6	CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C(=O)[O-].[Na+]	{24: 1, 1: 3, 2: 14, 3: 2, 28: 1}
Did not match all atoms present	7324-77-8	CCCCCCCCCCCCOC(=O)/C=C\C(=O)O[Sn](OC(=O)/C=C\C(=O)OCCCCCCCCCCCC)(CCCCCCCC)CCCCCCCC	{1: 4, 2: 36, 28: 4, 6: 4}
Did not match all atoms present	7324-87-0	CCOC(=O)C(=CC1=C(C=CC(=C1)OC)OC)C(=O)OCC	{1: 4, 2: 2, 6: 1, 7: 1, 14: 3, 22: 2, 28: 2}
Did not match all atoms present	73245-91-7	CC(C1CCC(C(O1)OC2C(C(C(C(C2O)N(C)C(=O)CN=CN)OC)O)N)N)N.OS(=O)(=O)O.OS(=O)(=O)O	{1: 3, 2: 1, 3: 1, 6: 1, 33: 1, 11: 2, 12: 9, 34: 1, 20: 6, 22: 2, 23: 1, 24: 1, 29: 4, 30: 4}
Did not match all atoms present	7325-16-8	[2H]OCC(CO[2H])O[2H]	{2: 2, 3: 1, 20: 3}
Did not match all atoms present	7325-26-0	CCCCCCCC[Al](CCCCCCCC)Cl	{1: 2, 2: 14, 17: 1}
Did not match all atoms present	7325-46-4	C1=CC(=CC=C1CC(=O)O)CC(=O)O	{2: 2, 27: 2, 14: 4}
Did not match all atoms present	7325-84-0	CCCCCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 21, 17: 3}
Did not match all atoms present	73250-68-7	CN(C1=CC=CC=C1)C(=O)COC2=NC3=CC=CC=C3S2	{1: 1, 2: 1, 35: 1, 33: 1, 41: 1, 14: 9, 22: 1, 24: 1}
Did not match all atoms present	7326-19-4	C1=CC=C(C=C1)C[C@H](C(=O)O)O	{27: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	73263-34-0	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=CC(=O)O.C1CO1	{1: 2, 4: 1, 5: 1, 6: 1, 11: 2, 14: 8, 21: 2, 23: 1, 27: 1}
Did not match all atoms present	73263-35-1	CCN(CC)C1=C(C=C(C(=C1)NC(=O)C2=CC=CC=C2)N=NC3=CC=C(C4=CC=CC=C43)N=NC5=CC=C(C=C5)[N+](=O)[O-])OC	{1: 3, 2: 2, 38: 1, 33: 1, 34: 4, 14: 17, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	73263-37-3	CC1=CC(=C(C=C1Cl)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=CC=C4OC)S(=O)(=O)[O-].[Na+]	{1: 2, 34: 1, 14: 11, 15: 2, 17: 1, 22: 1, 24: 1, 25: 1, 29: 3, 31: 2}
Did not match all atoms present	73263-38-4	CC1=CC(=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)N/N=C\3/C4=CC=CC=C4C=C(C3=O)C(=O)NC5=C(C=CC(=C5)Cl)OC)C	{1: 4, 34: 1, 14: 14, 15: 2, 17: 1, 22: 1, 24: 2, 25: 1, 31: 3}
Did not match all atoms present	73263-40-8	CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=CC2=O.CC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C=CC2=O.[Sr+2]	{1: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	73263-55-5	B(C)(C)N(B(C)N(C)C)C	{1: 6, 33: 2}
Did not match all atoms present	7327-87-9	C1=CC=C2C(=C1)C(=NN=C2NN)NN.OS(=O)(=O)O	{35: 2, 14: 4, 20: 2, 29: 2, 30: 2, 31: 2}
Did not match all atoms present	73275-56-6	CC1=CC=CC=C1N2C(=C(C(=N2)C)N=NC3=CC=CC=C3C(=O)[O-])[O-].CC1=NN(C(=C1N=NC2=CC=CC=C2C(=O)[O-])[O-])C3=CC=CC=C3.[Na+].[Cr+3]	{1: 3, 34: 4, 35: 2, 33: 2, 14: 17, 24: 2}
Did not match all atoms present	73275-57-7	CC1=CC=C(C=C1)N2C(=C(C(=N2)C)N=NC3=CC=CC=C3C(=O)[O-])[O-].CC1=CC(=CC=C1)N2C(=C(C(=N2)C)N=NC3=CC=CC=C3C(=O)[O-])[O-].[Na+].[Cr+3]	{1: 4, 34: 4, 35: 2, 33: 2, 14: 16, 24: 2}
Did not match all atoms present	73275-58-8	CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.CC(=C)C(=O)OCCO.C1CO1	{1: 3, 2: 2, 5: 1, 7: 1, 8: 2, 11: 3, 12: 1, 34: 2, 14: 3, 20: 1, 23: 2, 28: 1, 29: 2}
Did not match all atoms present	73275-64-6	C1=CC(=C(C=C1NC2=NC(=NC(=N2)Cl)NCCS(=O)(=O)[O-])NC(=O)N)N=NC3=C(C=C4C=C(C=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 2, 14: 7, 17: 1, 24: 1, 29: 12, 30: 1, 31: 3}
Did not match all atoms present	73275-65-7	CCOC(=O)OCCN(CCOC(=O)OCC)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=NC=C(S2)[N+](=O)[O-])OC	{1: 4, 2: 6, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	73275-66-8	CCOC(=O)OCCN(CCOC(=O)OCC)C1=CC(=C(C=C1)N=NC2=NC=C(S2)[N+](=O)[O-])NC(=O)C	{1: 3, 2: 6, 35: 1, 38: 1, 33: 1, 41: 1, 34: 2, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	73276-70-7	CCN1C2=C(C=C(C=C2)C=NN(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C51	{1: 1, 2: 1, 6: 1, 33: 2, 34: 1, 14: 17}
Did not match all atoms present	7328-05-4	CCC[Sn](CCC)(CCC)S[Sn](CCC)(CCC)CCC	{40: 1, 1: 6, 2: 12}
Did not match all atoms present	7328-28-1	C(C(CBr)OP(=O)(OC(CCl)CBr)OC(CCl)CBr)Cl	{2: 6, 3: 3, 17: 3, 18: 3, 22: 3, 29: 1}
Did not match all atoms present	73287-39-5	[H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)Cl)[O-])[O-].[Cr+3]	{1: 1, 34: 4, 35: 1, 38: 1, 33: 1, 14: 17, 17: 1}
Did not match all atoms present	73287-47-5	C1=CC=C(C=C1)NC2=CC3=CC(=C(C(=C3C=C2)[O-])N=NC4=C(C=C(C=C4)C5=CC(=C(C=C5)N=NC6=CC(=C7C=CC=C(C7=C6[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{34: 4, 29: 9, 14: 19, 31: 1}
Did not match all atoms present	73287-48-6	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=CC(=C4C=CC=C(C4=C3[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])N=NC5=C(C=C6C=C(C=CC6=C5)NC7=CC=CC=C7)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu+2]	{1: 1, 34: 4, 14: 20, 22: 1, 29: 9, 31: 1}
Did not match all atoms present	73287-49-7	CCC(=O)NC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C	{1: 4, 2: 5, 38: 1, 33: 1, 34: 2, 14: 6, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	73287-50-0	CN(C)CCNC(=O)CCS(=O)(=O)C1=CC=C(C=C1)N2CCC(=N2)C3=CC=C(C=C3)Cl.C(=O)O	{1: 2, 2: 4, 35: 1, 33: 2, 11: 2, 14: 8, 15: 1, 17: 1, 24: 1, 26: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	73287-54-4	CC(=O)NC1=C(C=CC(=C1)N(CCOC(=O)C)CCOC(=O)C)N=NC2=NC3=C(S2)C=C(C=C3)Br	{1: 3, 2: 4, 35: 1, 33: 1, 41: 1, 34: 2, 14: 6, 18: 1, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	73287-56-6	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=CC(=C4)N)S(=O)(=O)[O-])OC)N/N=C\5/C(=CC6=CC(=CC(=C6C5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 13, 15: 4, 22: 2, 25: 2, 29: 9, 30: 2, 31: 2}
Did not match all atoms present	73287-57-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)C5=C6C(=C7C(=C5N4)C(=O)C8=CC=CC=C8C7=O)NC9=C(C=C(C=C9C6=O)Cl)Cl	{32: 2, 17: 2, 14: 12, 25: 5}
Did not match all atoms present	73287-59-9	CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C(=O)C(=NNC4=C(C=CC5=C4C=CC(=C5)S(=O)(=O)O)N)C=C3	{1: 1, 34: 1, 33: 1, 14: 11, 20: 1, 25: 3, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	73287-60-2	CN1C=C[N+](=C1N=NC2=CC(=C(C=C2OC)N(C)C)OC)C.[Cl-]	{1: 6, 34: 2, 33: 3, 14: 4, 17: 1, 22: 2}
Did not match all atoms present	73287-62-4	C1=CC(=CC=C1N=CCOCC=NC2=CC=C(C=C2)N=NC3=C(C=C(C=C3Br)[N+](=O)[O-])Cl)N=NC4=C(C=C(C=C4Br)[N+](=O)[O-])Cl	{2: 2, 38: 2, 6: 2, 34: 6, 14: 12, 17: 2, 18: 2, 22: 1}
Did not match all atoms present	73287-65-7	CCCCN(CCO)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OC)C.COS(=O)(=O)[O-]	{1: 4, 2: 5, 33: 2, 41: 1, 34: 2, 14: 7, 20: 1, 22: 2, 29: 3}
Did not match all atoms present	73287-66-8	CC1=NN(C=C1N=NC2=C(C3=CC=CC=C3C=C2)S(=O)(=O)[O-])C4=CC(=C(C=C4Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+]	{1: 1, 34: 2, 35: 1, 33: 1, 14: 9, 17: 2, 29: 6}
Did not match all atoms present	73287-68-0	CCCN1C(=O)C2=C(C3=C(C(=C2C1=O)N)C(=O)C4=CC=CC=C4C3=O)N	{1: 1, 2: 2, 33: 1, 14: 4, 25: 4, 30: 2}
Did not match all atoms present	73287-69-1	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)N=NC4=CC(=C(C=C4)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)O)S(=O)(=O)O)C	{1: 2, 34: 4, 14: 20, 20: 2, 24: 2, 29: 4, 31: 2}
Did not match all atoms present	73287-71-5	C[N+](C)(C)CCOC1=C(C2=C(C(=C1)NC3=CC=CC=C3)C(=O)C4=CC=CC=C4C2=O)N.COS(=O)(=O)[O-]	{1: 4, 2: 2, 14: 10, 22: 2, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	73289-27-7	CC1=CC(=CN=C1)C.CC1=CC(=CN=C1)C.Cl[Pt]Cl	{1: 4, 35: 2, 14: 6, 17: 2}
Did not match all atoms present	7329-29-5	C1C(O1)COCCN(CCOCC2CO2)C3=CC=CC=C3	{33: 1, 2: 6, 11: 2, 12: 2, 14: 5, 22: 2, 23: 2}
Did not match all atoms present	73296-87-4	C=CC(=O)O.C=CC(=O)O.C1C(O1)CCl.C1=CC=C(C(=C1)CC2=CC=CC=C2O)O	{2: 2, 5: 2, 6: 2, 11: 1, 12: 1, 14: 8, 17: 1, 21: 2, 23: 1, 27: 2}
Did not match all atoms present	73297-02-6	CN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(/C(=N/NC5=C(C6=CC=CC=C6C=C5)S(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 1, 34: 1, 35: 3, 33: 1, 14: 14, 15: 2, 17: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	73297-05-9	CC1=CC=C(C=C1)N/C=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.[Cl-]	{1: 4, 6: 2, 33: 1, 13: 1, 14: 8, 15: 1, 17: 1, 31: 1}
Did not match all atoms present	73297-06-0	COCCOC1=C(C2=C(C=C1)C(=O)[C@@H]3C=CC=C[C@H]3C2=O)N	{1: 1, 2: 2, 12: 2, 14: 6, 22: 2, 25: 2, 30: 1}
Did not match all atoms present	73297-08-2	CN1C(=CC=[N+](C1=O)C)/C=N/N(C)C2=CC=CC=C2.[Cl-]	{1: 3, 34: 1, 6: 1, 33: 3, 14: 7, 17: 1, 25: 1}
Did not match all atoms present	73297-21-9	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])N/N=C/2\C(=O)C=C(C(=C2)CC3=C/C(=N/NC4=CC(=CC(=C4[O-])[N+](=O)[O-])S(=O)(=O)[O-])/C(=O)C=C3[O-])[O-])S(=O)(=O)[O-].Cl.Cl.[Fe+3].[Fe+3]	{2: 1, 38: 2, 34: 2, 14: 8, 15: 6, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	73297-31-1	C1C(=O)C=CC2=C1C=C3C(=C2)C(=C4C5=C3N=C6C(=CC7=C8C(=CC(=O)C=C8NC9=CC=CC1=C9C(=O)C2=CC=CC=C2C1=O)C1(C2=C7C6=C5C(=C2Cl)S4=O)OO1)Cl)Cl	{35: 1, 11: 1, 13: 1, 14: 14, 15: 3, 17: 3, 23: 2, 25: 4, 29: 1, 31: 1}
Did not match all atoms present	73297-32-2	CC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O)S(=O)(=O)N	{1: 1, 14: 8, 20: 1, 25: 2, 29: 4, 30: 2, 31: 1}
Did not match all atoms present	733-07-3	CC1=CC(=C(C(=C1)C)CC2=C(C=C(C=C2C)C)C)C	{1: 6, 2: 1, 14: 4}
Did not match all atoms present	733-44-8	CC[N+](CC)(CC)CC.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 5, 2: 4, 29: 3, 14: 4}
Did not match all atoms present	733-51-7	CCN(CC)C1=CC=C(C=C1)[N+]#N.F[P-](F)(F)(F)(F)F	{1: 2, 2: 2, 33: 1, 34: 1, 14: 4, 16: 6}
Did not match all atoms present	73308-98-2	B1(C2CCCC1CCC2)N3C4CCCC3CCC4	{33: 1, 11: 12, 12: 4}
Did not match all atoms present	73309-43-0	C1=CC=C2C(=C1)C(=C/C(=N/NC3=C(C=C(C=C3)NC4=NC(=NC(=N4)Cl)NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 1, 35: 3, 14: 11, 15: 2, 17: 1, 25: 1, 29: 12, 31: 3}
Did not match all atoms present	73309-44-1	CC[C@@H](C)COC(=O)C1=CC(=C(C=C1)O)OC	{1: 3, 2: 2, 3: 1, 14: 3, 21: 1, 22: 1, 28: 1}
Did not match all atoms present	73309-51-0	CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)[O-])C=CC2=N.[Na+]	{1: 2, 2: 2, 36: 1, 14: 7, 15: 5, 25: 1, 28: 2, 29: 3, 31: 2}
Did not match all atoms present	73309-52-1	CC(C)C(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])C#N	{1: 2, 2: 4, 3: 1, 37: 2, 38: 1, 33: 1, 34: 2, 14: 7, 28: 1}
Did not match all atoms present	73309-75-8	CC12CCC3C(C1(CCC2C4=COC(=O)C=C4)O)CCC5=CC(CCC35C=O)OC6C(C(C(C(O6)CO)O)O)O	{1: 1, 2: 1, 11: 8, 12: 9, 13: 3, 14: 4, 15: 1, 20: 5, 22: 1, 23: 1, 26: 1, 28: 1}
Did not match all atoms present	7331-84-2	CCCN([Si](C)(C)C)[Si](C)(C)C	{1: 7, 2: 2, 33: 1}
Did not match all atoms present	7332-46-9	CCCCOCCOCCOP(=O)(OCCOCCOCCCC)OCCOCCOCCCC	{1: 3, 2: 21, 29: 1, 22: 9}
Did not match all atoms present	73321-09-2	CC(C)(C)C1=CC=C(C=C1)N2C3CCCC2CC(=O)C3	{1: 3, 4: 1, 33: 1, 11: 5, 12: 2, 14: 4, 25: 1}
Did not match all atoms present	73321-10-5	CC(C)(C)C1=CC=C(C=C1)N2C3CCCC2CCC3	{1: 3, 4: 1, 33: 1, 11: 6, 12: 2, 14: 4}
Did not match all atoms present	73324-75-1	CP1P2P(P3P1P3P2C)C	{1: 3}
Did not match all atoms present	7333-63-3	C1=CC=C(C=C1)[P+](CCCCBr)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]	{2: 4, 18: 2, 14: 15}
Did not match all atoms present	7333-65-5	C1=CC=C(C=C1)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5	{14: 25, 7: 1}
Did not match all atoms present	7333-86-0	CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 17, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	7334-33-0	C1=CC=C(C(=C1)N=NC2=CC=CC=C2Cl)Cl	{17: 2, 34: 2, 14: 8}
Did not match all atoms present	73341-70-5	CC1C(C(C2=C(O1)C(=O)C3=CC(=CC(=C3C2=O)O)OC)OC(=O)C)O	{1: 3, 12: 3, 14: 2, 15: 2, 20: 1, 21: 1, 22: 1, 23: 1, 25: 2, 28: 1}
Did not match all atoms present	73341-73-8	C[C@H]1C[C@H]([C@H]([C@@H](/C=C(/C([C@H](/C=C\C=C(\C(=O)NC2=C(C(=CC(=C2)O)[C@@H]1OC)O)/C)C)OC(=O)N)\C)C)OC)OC	{32: 1, 1: 8, 11: 1, 12: 7, 14: 6, 15: 2, 21: 2, 22: 3, 25: 1, 28: 1, 30: 1}
Did not match all atoms present	73343-67-6	CC1=CC(=C(C(=C1)C)C2=C(C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)OC)C	{24: 1, 1: 4, 22: 1, 14: 10, 23: 1}
Did not match all atoms present	73343-69-8	CC1=CC(=C(C(=C1)C)C2=CC3=C(C=CC=C3O2)C(=O)C4=CC=C(C=C4)O)C	{24: 1, 1: 3, 21: 1, 14: 10, 23: 1}
Did not match all atoms present	73343-70-1	CC1=CC(=C(C(=C1)C)C2=C(C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)O)C	{24: 1, 1: 3, 21: 1, 14: 10, 23: 1}
Did not match all atoms present	73343-71-2	CCN(CC)CCOC1=CC=C(C=C1)C(=O)C2=C(OC3=CC=CC=C32)C4=C(C=C(C=C4C)C)C.Cl	{1: 5, 2: 4, 33: 1, 14: 10, 17: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	73343-72-3	CC1=CC(=C(C(=C1)C)C2=C(C3=CC=CC=C3O2)C(=O)C4=CC(=C(C(=C4)I)O)I)C	{1: 3, 14: 8, 19: 2, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	73343-74-5	CC1=CC(=C(C(=C1)C)C2=C(C3=CC=CC=C3O2)C(=O)C4=CC(=C(C(=C4)Br)O)Br)C	{1: 3, 14: 8, 18: 2, 21: 1, 23: 1, 24: 1}
Did not match all atoms present	73347-79-2	CCCCCCCCC(CCCCCCC)CC(=O)OCC(CS(=O)(=O)[O-])O.[Na+]	{1: 2, 2: 16, 3: 2, 20: 1, 28: 1, 29: 3}
Did not match all atoms present	73347-81-6	CC1=CC(=C(C=C1S(=O)(=O)N)[O-])N=NC2=C(C3=CC=CC=C3C=C2)[O-].COC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-].[Na+].[Cr+3]	{1: 2, 34: 4, 14: 16, 28: 1, 29: 4, 30: 2, 31: 1}
Did not match all atoms present	7335-25-3	CCOC(=O)C1=CC=CC=C1Cl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	7335-26-4	CCOC(=O)C1=CC=CC=C1OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	7335-27-5	CCOC(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	73357-16-1	C[SiH](C1=COC=C1)C2=COC=C2	{1: 1, 14: 6, 23: 2}
Did not match all atoms present	7336-36-9	CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)O)OC	{1: 4, 11: 2, 12: 1, 14: 4, 21: 1, 22: 3, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	7336-54-1	CC(=O)NC1=NC=C(S1)Br	{1: 1, 35: 1, 41: 1, 14: 1, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	73360-57-3	CCCCCCCCCC1=CC=CC=C1OP(=O)([O-])[O-].[NH4+].[NH4+]	{1: 1, 2: 8, 22: 1, 14: 4, 29: 3}
Did not match all atoms present	73360-58-4	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)N=[N+](C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)[N+](=NC5=CC=C(C=C5)N=NC6=CC=C(C=C6)S(=O)(=O)O)[O-])S(=O)(=O)O)S(=O)(=O)O)[O-]	{33: 2, 34: 6, 6: 2, 14: 22, 20: 4, 29: 10}
Did not match all atoms present	73360-59-5	C1=CC=C(C(=C1)N/N=C\2/C(=O)C3=C(C=C(/C(=N\NC4=CC=CC=C4P(=O)(O)O)/C3=O)S(=O)(=O)[O-])C=C2S(=O)(=O)[O-])P(=O)(O)O.[Na+].[Na+]	{34: 2, 14: 10, 20: 4, 25: 2, 29: 8, 31: 2}
Did not match all atoms present	73361-47-4	C1C(O1)CCl.C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)[O-].[Fe+2]	{2: 4, 3: 8, 11: 1, 12: 1, 17: 1, 20: 10, 23: 1, 24: 1, 29: 1}
Did not match all atoms present	7337-44-2	CCCCCCCCC(=O)C1=C(C=CC(=C1)O)O	{24: 1, 1: 1, 2: 7, 21: 2, 14: 3}
Did not match all atoms present	7337-45-3	[B].CC(C)(C)N	{1: 3, 4: 1, 30: 1}
Did not match all atoms present	73372-63-1	CC1=C(C(=C(C(=N1)C)C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC	{1: 3, 35: 1, 38: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	73378-57-1	Br[Xe]Br	{18: 2}
Did not match all atoms present	7338-94-5	C1=CC=C(C=C1)C#CC(=O)C2=CC=CC=C2	{24: 1, 10: 2, 14: 10}
Did not match all atoms present	73384-59-5	CN1C(=NC(=O)C(=O)N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N\OC)/C4=CSC(=N4)N)SC2)C(=O)O	{32: 1, 1: 2, 2: 1, 35: 2, 33: 2, 7: 1, 40: 1, 41: 2, 11: 1, 12: 2, 34: 1, 14: 1, 15: 2, 22: 1, 24: 1, 25: 3, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	73384-77-7	CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OC)C.[Cl-]	{1: 4, 2: 2, 33: 2, 41: 1, 34: 2, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	73384-82-4	C(CS(=O)(=O)O)CBr	{2: 3, 20: 1, 18: 1, 29: 2}
Did not match all atoms present	73384-83-5	CCOC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)C(=O)N)OC)/C2=O	{1: 2, 2: 1, 34: 1, 14: 12, 15: 2, 22: 2, 24: 2, 25: 1, 30: 1, 31: 2}
Did not match all atoms present	73384-84-6	CCOC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=C(C=C4)C=O)OC)/C2=O	{1: 2, 2: 1, 34: 1, 14: 12, 15: 2, 22: 2, 24: 1, 25: 1, 26: 1, 31: 2}
Did not match all atoms present	73384-85-7	C[C@H]1[C@@H](C(=O)N(N1)C2=C(C=C(C=C2)Cl)Cl)N=NC3=CC=C(C=C3)C(=O)N	{32: 1, 1: 1, 34: 2, 33: 1, 12: 2, 14: 7, 17: 2, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	73384-86-8	CC1=CC(=C(C=C1)N=NC(C(=O)C)C(=O)NC2=CC=CC=C2OC)S(=O)(=O)[O-].CC1=CC(=C(C=C1)N=NC(C(=O)C)C(=O)NC2=CC=CC=C2OC)S(=O)(=O)[O-].[Ba+2]	{1: 6, 34: 4, 3: 2, 14: 14, 22: 2, 24: 4, 29: 6, 31: 2}
Did not match all atoms present	73384-87-9	C1C(C(=O)N(C1=O)C2=CC=C(C=C2)CC3=CC=C(C=C3)N4C(=O)CC(C4=O)NC5=CC(=CC=C5)O)NC6=CC(=CC=C6)O	{33: 2, 2: 1, 11: 2, 12: 2, 14: 16, 21: 2, 25: 4, 31: 2}
Did not match all atoms present	73384-88-0	CC(=C)C(=O)OCC(COC1=CC=CC=C1CC2=CC=CC=C2OCC(COC(=O)C(=C)C)O)O	{1: 2, 2: 5, 3: 2, 5: 2, 7: 2, 14: 8, 20: 2, 22: 2, 28: 2}
Did not match all atoms present	73384-89-1	CN(C)C1=CC=C(C=C1)C=NC2=CC=C(C=C2)CC3=CC=C(C=C3)N=CC4=CC=C(C=C4)N(C)C	{1: 4, 2: 1, 6: 2, 33: 2, 34: 2, 14: 16}
Did not match all atoms present	73384-90-4	C1=CC(=O)C=CC1=CNC2=CC=C(C=C2)CC3=CC=C(C=C3)N	{2: 1, 6: 1, 14: 12, 15: 1, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	73384-91-5	CC1=CC(=C(C=C1Cl)N/N=C/2\C(=O)C(=CC3=CC=CC=C23)C(=O)NC4=CC=CC=C4OC)S(=O)(=O)[O-].CC1=CC(=C(C=C1Cl)N/N=C/2\C(=O)C(=CC3=CC=CC=C23)C(=O)NC4=CC=CC=C4OC)S(=O)(=O)[O-].[Mn+2]	{1: 4, 34: 2, 14: 22, 15: 4, 17: 2, 22: 2, 24: 2, 25: 2, 29: 6, 31: 4}
Did not match all atoms present	73384-93-7	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN=CN3C.COS(=O)(=O)OC	{1: 4, 2: 2, 35: 2, 33: 2, 34: 2, 14: 10, 22: 2, 29: 2}
Did not match all atoms present	73384-96-0	CC(N(CO)CO)(P(=O)([O-])[O-])P(=O)([O-])[O-].[K+].[K+].[K+].[K+]	{1: 1, 2: 2, 4: 1, 33: 1, 20: 2, 29: 6}
Did not match all atoms present	73384-97-1	CN(CCS(=O)(=O)O)C1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)NCCC5=CC=C(C=C5)S(=O)(=O)CCOS(=O)(=O)O)C6=CC=CC=C6S(=O)(=O)O3	{1: 1, 2: 6, 33: 1, 13: 1, 14: 14, 20: 2, 22: 1, 23: 2, 29: 8, 31: 1}
Did not match all atoms present	73384-98-2	C1C(=O)C2=C(N1)C(=C(C(=C2Cl)Cl)Cl)Cl	{32: 1, 17: 4, 11: 1, 25: 1}
Did not match all atoms present	73384-99-3	CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)O)NC(=O)NC3=CC=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)O	{1: 3, 34: 4, 7: 1, 14: 22, 15: 2, 20: 1, 22: 1, 24: 1, 25: 1, 27: 1, 29: 2, 30: 1, 31: 4}
Did not match all atoms present	73385-00-9	CC1=C(C(=CC(=C1)C2=CC(=C(C=C2S(=O)(=O)[O-])N=NC3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4)C)S(=O)(=O)[O-])N/N=C/5\C=C(C6=CC=CC=C6C5=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 3, 14: 18, 15: 2, 22: 1, 25: 1, 29: 11, 31: 1}
Did not match all atoms present	73385-01-0	C1=CC2=C3C(=C1)N=C4C5=CC=CC6=C(C=CC(=C65)C(=O)N4C3=CC=C2)NCCO	{33: 1, 2: 2, 35: 1, 14: 11, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	73385-02-1	C1=CC2=C3C(=C1)N=C4C5=C6C(=C(C=C5)NCCO)C=CC=C6C(=O)N4C3=CC=C2	{33: 1, 2: 2, 35: 1, 14: 11, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	73385-03-2	CC(=O)C(C(=O)NC1=CC=C(C=C1)OC)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].CC(=O)C(C(=O)NC1=CC=C(C=C1)OC)N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-].[Ca+2]	{1: 4, 34: 4, 3: 2, 38: 2, 14: 14, 22: 2, 24: 4, 29: 6, 31: 2}
Did not match all atoms present	73385-31-6	[2H]C#CCCC#C[2H]	{9: 2, 2: 2, 10: 2}
Did not match all atoms present	73398-70-6	C[N+](C)(C)CC[N+](C)(C)CC1=CC=CC=C1C=C.C[N+](C)(C)CC1=CC=CC=C1C=C.C=CC1=CC=CC=C1.[Cl-].[Cl-].[Cl-]	{1: 8, 2: 4, 5: 3, 6: 3, 14: 13, 17: 3}
Did not match all atoms present	73398-71-7	C1CC(OC1)CO.C(CO)NCCO.OP(=O)(O)O	{2: 5, 11: 3, 12: 1, 20: 6, 23: 1, 29: 1, 31: 1}
Did not match all atoms present	73398-73-9	CCOC(=O)CC(=NC1=CC=C(C=C1)[N+](=O)[O-])NNC2=C(C=C(C=C2Cl)Cl)Cl	{1: 1, 2: 2, 38: 1, 7: 1, 34: 1, 14: 6, 17: 3, 28: 1, 31: 2}
Did not match all atoms present	73398-74-0	CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.C(=O)(C(=O)[O-])O	{1: 4, 2: 2, 35: 1, 33: 3, 34: 2, 14: 5, 24: 1, 27: 1}
Did not match all atoms present	73398-75-1	CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.[O-]P(=O)([O-])[O-]	{1: 12, 2: 6, 35: 3, 33: 9, 34: 6, 14: 15, 29: 4}
Did not match all atoms present	73398-76-2	CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.C(=O)(C(=O)[O-])[O-]	{1: 8, 2: 4, 35: 2, 33: 6, 34: 4, 14: 10, 24: 2}
Did not match all atoms present	73398-77-3	CCN(CC)C1=CC=C(C=C1)N=NC2[NH+](N=CN2C)C.[Cl-]	{1: 4, 2: 2, 35: 1, 33: 2, 12: 1, 34: 2, 14: 5, 17: 1}
Did not match all atoms present	73398-78-4	CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](C=NN2C)C.OP(=O)([O-])[O-]	{1: 8, 2: 4, 35: 2, 33: 6, 34: 4, 14: 10, 20: 1, 29: 3}
Did not match all atoms present	73398-80-8	CCOC1=CC=C(C=C1)N/C=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.CCOC1=CC=C(C=C1)N/C=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.[O-]S(=O)(=O)[O-]	{1: 8, 2: 2, 6: 4, 33: 2, 13: 2, 14: 16, 15: 2, 22: 2, 29: 4, 31: 2}
Did not match all atoms present	73398-81-9	C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)N=NC6C(=O)NC(=O)NC6=O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{32: 2, 33: 1, 34: 2, 35: 2, 6: 2, 12: 1, 14: 11, 25: 3, 29: 9}
Did not match all atoms present	73398-82-0	CCOC(=O)C[C@H](NC1=C(C=CC(=C1)N)Cl)N/N=C/C2=C(C=C(C=C2Cl)Cl)Cl	{1: 1, 2: 2, 3: 1, 6: 1, 34: 1, 14: 5, 17: 4, 28: 1, 30: 1, 31: 2}
Did not match all atoms present	73398-94-4	B(=O)O.B(=O)O.B(=O)O.B(=O)O.B(=O)O.CNC	{1: 2, 20: 5, 29: 5, 31: 1}
Did not match all atoms present	73398-95-5	CCCCCCCCCCCCCCCCCC(=O)NCC[N+](C)(CCO)CCO.[Cl-]	{1: 2, 2: 22, 17: 1, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	73398-97-7	CC1=CC(=C(C=C1N=NC2=C(N=C(C(=C2C)C#N)NCCCOC)NCCCCCCCCOC)C)N=NC3=CC=C(C=C3)C(=O)NCCCOCCOC4=CC=CC=C4	{1: 5, 2: 16, 35: 1, 37: 1, 34: 4, 14: 11, 22: 4, 24: 1, 31: 3}
Did not match all atoms present	734-25-8	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 1, 38: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	734-88-3	CCOC(=O)C1=CC2=C(C=CC3=CC=CC=C32)OC1=O	{1: 1, 2: 1, 28: 2, 14: 7}
Did not match all atoms present	7340-90-1	CC1=C(C=C(C=C1)C(C)(C)C)S	{1: 4, 4: 1, 14: 3, 39: 1}
Did not match all atoms present	7341-63-1	C=CCNC(=S)NC1=CC=CC=C1	{2: 1, 5: 1, 6: 1, 7: 1, 14: 5, 31: 2}
Did not match all atoms present	73419-42-8	C[N+](C)(C)C(CC1=CN=C(N1)[S-])C(=O)[O-].C[N+](C)(C)C(CC1=CN=C(N1)[S-])C(=O)[O-].[Cd+2]	{32: 2, 1: 6, 2: 2, 3: 2, 14: 2, 35: 2, 24: 2}
Did not match all atoms present	7342-13-4	COC1=NC(=NC(=N1)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)OC)S(=O)(=O)O)S(=O)(=O)O)NC6=CC=CC=C6	{1: 2, 35: 6, 6: 2, 14: 16, 20: 2, 22: 2, 29: 4, 31: 4}
Did not match all atoms present	7342-38-3	CC(C)C[Sn](CC(C)C)(CC(C)C)Cl	{1: 6, 2: 3, 3: 3, 17: 1}
Did not match all atoms present	7342-45-2	CCC[Sn](CCC)(CCC)I	{1: 3, 2: 6, 19: 1}
Did not match all atoms present	7342-47-4	CCCC[Sn](CCCC)(CCCC)I	{1: 3, 2: 9, 19: 1}
Did not match all atoms present	7342-82-7	C1=CC=C2C(=C1)C(=CS2)Br	{41: 1, 18: 1, 14: 5}
Did not match all atoms present	7343-06-8	CC1=C(C2=C(C=C1)C=CC3=C2C(=C(C=C3)C)C)C	{1: 4, 14: 6}
Did not match all atoms present	7343-31-9	CSC1=CC=CC2=C1C(=CC=C2)SC	{40: 2, 1: 2, 14: 6}
Did not match all atoms present	7343-33-1	C1=NNC(=N1)Br	{32: 1, 18: 1, 35: 2, 14: 1}
Did not match all atoms present	7343-34-2	CC1=NC(=NN1)C	{32: 1, 1: 2, 35: 2}
Did not match all atoms present	7343-61-5	C1=CC=C(C=C1)CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{40: 1, 2: 1, 38: 2, 14: 8}
Did not match all atoms present	7344-34-5	CC1=CC=CC2=C1C=CC2	{1: 1, 11: 1, 14: 5}
Did not match all atoms present	7344-40-3	CN(C)[Ge](N(C)C)(N(C)C)N(C)C	{1: 8, 33: 4}
Did not match all atoms present	7345-79-1	C1=CC=C(C(=C1)/C=C/C(=O)O)Br	{18: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	73452-31-0	[B]N([Si](C)(C)C)[Si](C)(C)C	{1: 6, 33: 1}
Did not match all atoms present	73452-32-1	[B]N(C(C)(C)C)[Si](C)(C)C	{1: 6, 4: 1, 33: 1}
Did not match all atoms present	73455-01-3	CCC(C1=CC2=C(C=C1)OCO2)OC(=O)C	{1: 2, 2: 1, 3: 1, 11: 1, 14: 3, 23: 2, 28: 1}
Did not match all atoms present	73459-03-7	CC1=CC2=C(C=CO2)C3=C1C=CC(=O)O3	{1: 1, 28: 1, 14: 5, 23: 1}
Did not match all atoms present	7346-46-5	COC(=O)C(CC1=CC=CC=C1Cl)C#N	{1: 1, 2: 1, 3: 1, 37: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	7346-61-4	CCCCCCCCOP(OCC(CC)CCCC)OC1=CC=CC=C1	{1: 3, 2: 12, 3: 1, 22: 3, 14: 5}
Did not match all atoms present	73467-77-3	CCCC(C)C(CCC)C(C)CC1=CC(=CC=C1)OCCOC(=O)Cl	{1: 4, 2: 7, 3: 3, 14: 4, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	73468-51-6	C1=CC(=C2C(=C1N)C(=O)C3=C(C2=O)C(=C(C=C3O)Br)N)O	{25: 2, 18: 1, 30: 2, 21: 2, 14: 3}
Did not match all atoms present	7347-19-5	C=CC(=O)OCCOC1=C(C=C(C=C1Br)Br)Br	{2: 2, 5: 1, 6: 1, 14: 2, 18: 3, 22: 1, 28: 1}
Did not match all atoms present	7347-46-8	CC1=NC=CC(=C1)N=NC2=CC=C(C=C2)[N+](C)(C)[O-]	{1: 3, 34: 2, 35: 1, 29: 1, 14: 7}
Did not match all atoms present	7347-49-1	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=[N+](C=C2)[O-]	{1: 2, 2: 2, 33: 2, 34: 2, 14: 8, 29: 1}
Did not match all atoms present	73475-28-2	CN(C)C(=[Te])C1=CC=CC=C1	{1: 2, 33: 1, 14: 5, 7: 1}
Did not match all atoms present	73476-18-3	C[Si](C)(C)CCS(=O)(=O)C1=CC=CC=C1	{1: 3, 2: 2, 29: 2, 14: 5}
Did not match all atoms present	73482-96-9	CCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCCC(=O)O.[Rh].[Rh]	{1: 4, 2: 24, 27: 4}
Did not match all atoms present	7349-99-7	CC1=CC(=CC(=[N+]1[O-])C)N=NC2=CC=C(C=C2)N(C)C	{1: 4, 34: 2, 29: 1, 14: 6, 33: 2}
Did not match all atoms present	73491-34-6	O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Hg+2]	{17: 2, 29: 8}
Did not match all atoms present	735-06-8	CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2F	{1: 1, 38: 1, 14: 7, 16: 1, 24: 1, 31: 1}
Did not match all atoms present	7350-72-3	CC(=C1C2C=CC1C3=CC=CC=C23)C	{1: 2, 15: 1, 12: 2, 14: 6, 7: 1}
Did not match all atoms present	7350-77-8	CC(=C1C2CCC1C3=CC=CC=C23)C	{1: 2, 7: 1, 11: 2, 12: 2, 14: 4, 15: 1}
Did not match all atoms present	7350-86-9	C1C2=C3C(=CC=C4C3=C(C=C2)C5=CC=CC=C5C4)C6=CC=CC=C61	{11: 2, 14: 12}
Did not match all atoms present	7350-91-6	CCCCCCC1=CC=C2C3=CC=CC4=C3C(=CC=C4)C5=C2C1=CC=C5	{1: 1, 2: 5, 14: 11}
Did not match all atoms present	73502-97-3	C1=CC=C(C=C1)P2(=NP(=NP(=N2)(F)F)(C3=CC=CC=C3)F)F	{16: 4, 35: 3, 14: 10}
Did not match all atoms present	73502-98-4	C1=CC=C(C=C1)P2(=NP(=NP(=N2)(F)F)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5	{16: 2, 35: 3, 14: 20}
Did not match all atoms present	73506-32-8	NN.O[Se](=O)(=O)O	{20: 2, 29: 2, 30: 2}
Did not match all atoms present	73507-38-7	CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].C1=CC=C2C(=C1)NC=N2.[Au+3]	{32: 1, 1: 9, 2: 15, 35: 1, 4: 3, 14: 5, 24: 3}
Did not match all atoms present	73507-47-8	C1=CC=C(C=C1)C2=CC=C(C=C2)NNC(=S)N=NC3=CC=C(C=C3)C4=CC=CC=C4	{34: 2, 31: 2, 14: 18, 7: 1}
Did not match all atoms present	73507-48-9	C1=CC(=CC=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=NC4=CC=C(C=C4)OCCCO)S(=O)(=O)[O-])S(=O)(=O)[O-])OCCCO.[Na+].[Na+]	{2: 6, 6: 2, 34: 4, 14: 14, 20: 2, 22: 2, 29: 6}
Did not match all atoms present	73507-51-4	C1=CC(=CC=C1N/N=C/2\C(=O)C=C(C(=C2)N=NC3=C(C=C(C=C3)CC4=CC(=C(C=C4)N=NC5=C/C(=N/NC6=CC=C(C=C6)S(=O)(=O)O)/C(=O)C=C5O)C(=O)O)C(=O)O)O)S(=O)(=O)O	{2: 1, 34: 6, 14: 18, 15: 6, 20: 4, 25: 2, 27: 2, 29: 4, 31: 2}
Did not match all atoms present	73507-52-5	CC1=C(C=CC(=C1)N/N=C\2/C3=C(C=CC2=O)C=C(C=C3)S(=O)(=O)O)CC4=C(C=C(C=C4)N/N=C\5/C6=C(C=C(C=C6)S(=O)(=O)O)C=C(C5=O)S(=O)(=O)O)C	{1: 2, 2: 1, 34: 2, 14: 15, 15: 3, 20: 3, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	73507-53-6	CC1=C(C=CC(=C1)N)N=NC2=[N+](C3=CC=CC=C3S2)C.[Cl-]	{1: 2, 34: 2, 33: 1, 41: 1, 14: 7, 17: 1, 30: 1}
Did not match all atoms present	73507-57-0	CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](N(C3=CC=CC=C32)C)C.CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](N(C3=CC=CC=C32)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 8, 2: 4, 33: 6, 34: 4, 14: 16, 17: 4}
Did not match all atoms present	7351-08-8	CC1(CC2=C(C(=O)C1)C3=C(C=C2)C(=O)C4=C(C3=O)C=CC=C4O)O	{1: 1, 11: 2, 13: 1, 14: 5, 20: 1, 21: 1, 25: 3}
Did not match all atoms present	7351-61-3	CC(=C)C(=O)OCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 3, 5: 1, 7: 1, 17: 3, 28: 1}
Did not match all atoms present	7351-74-8	C1=CC2=C(C=CC=C2Br)C(=C1)Br	{18: 2, 14: 6}
Did not match all atoms present	73513-57-2	C1=CC(=C(C(=C1Cl)Cl)I)I	{17: 2, 19: 2, 14: 2}
Did not match all atoms present	73513-58-3	C1=C(C(=CC(=C1I)I)Cl)Cl	{17: 2, 19: 2, 14: 2}
Did not match all atoms present	73529-24-5	C1C(O1)C2=CC3=CC=CC4=C3C5=C(C=CC=C25)C=C4	{11: 1, 12: 1, 14: 9, 23: 1}
Did not match all atoms present	73529-25-6	C=CC1=CC2=CC=CC3=C2C4=C(C=CC=C14)C=C3	{14: 9, 5: 1, 6: 1}
Did not match all atoms present	73539-59-0	COC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)[O-].C=O.C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N	{1: 1, 34: 1, 5: 1, 14: 16, 21: 1, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	73545-10-5	CC(C)CC/C(=C\C1=CC=CC=C1)/C(N2C=CC3=CC=CC=C32)N4C=CC5=CC=CC=C54	{1: 2, 2: 2, 3: 2, 33: 2, 6: 1, 7: 1, 14: 17}
Did not match all atoms present	73545-14-9	CCCCCCC1C(=O)C(CC1(C(=O)[O-])C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 2: 5, 11: 1, 12: 2, 13: 1, 24: 3, 25: 1}
Did not match all atoms present	73545-20-7	C1=CC=C2C(=C1)[C@H](C3=C(C2=O)C=CC4=C3NC5=C(N4)C6=C(C=C5)C(=O)C7=CC=CC=C7[C@@H]6O)O	{32: 2, 20: 2, 12: 2, 14: 12, 25: 2}
Did not match all atoms present	73545-21-8	C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(/C(=N\NC4=CC=C(C=C4)NC5=CC=C(C=C5)N/N=C\6/C(=CC7=CC(=CC(=C7C6=O)NC(=O)C8=CC=CC=C8)S(=O)(=O)O)S(=O)(=O)O)/C3=O)S(=O)(=O)O	{34: 2, 14: 24, 15: 4, 20: 4, 24: 2, 25: 2, 29: 8, 31: 5}
Did not match all atoms present	73545-22-9	CC\1(C2=CC=CC=C2N(/C1=C/C=[N+]3CCCC4=C3C=CC(=C4)OC)C)C.OS(=O)(=O)[O-]	{1: 4, 6: 2, 33: 2, 11: 3, 13: 1, 14: 7, 15: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	73545-23-0	CCCCCCCCC(=O)NCCNCCNCCNCCNCCC[Si](OCCOC)(OCCOC)OCCOC.Cl	{1: 4, 2: 24, 17: 1, 22: 6, 24: 1, 31: 5}
Did not match all atoms present	73548-55-7	CC1=CN(C(=O)N(C1=O)C)C2C(C(C(O2)COC)OC)OC	{1: 5, 2: 1, 33: 2, 12: 4, 14: 1, 22: 3, 23: 1, 25: 2}
Did not match all atoms present	7355-22-8	C1=C(C(=CC(=C1Br)O)O)C(=O)O	{18: 1, 27: 1, 21: 2, 14: 2}
Did not match all atoms present	73551-05-0	O=[Si](Cl)Cl	{17: 2, 29: 1}
Did not match all atoms present	73559-40-7	C[C@@H](CC1=CC=CC=C1C2=CC=NC=C2)Cl	{1: 1, 2: 1, 3: 1, 14: 8, 17: 1, 35: 1}
Did not match all atoms present	73559-49-6	CCCCCCCCC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)CCCCCCCC)OP(=O)(O)O	{1: 2, 2: 14, 14: 8, 20: 2, 22: 3, 29: 2}
Did not match all atoms present	7356-11-8	CC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]	{1: 2, 28: 1, 38: 1, 14: 3}
Did not match all atoms present	7356-41-4	CC1=CC(=C(C=C1)C)OCC(=O)O	{1: 2, 2: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	73560-78-8	C1C2=CC=CC=C2C3=C1C4=CC=CC=C4C5=CC=CC=C53	{11: 1, 14: 12}
Did not match all atoms present	7357-14-4	COC1=CC=C(C=C1)OP(=O)(OC)OC	{1: 3, 22: 4, 14: 4, 29: 1}
Did not match all atoms present	7357-70-2	C(C#N)C(=S)N	{2: 1, 37: 1, 30: 1, 7: 1}
Did not match all atoms present	7357-71-3	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N/N=C\3/C4=C(C=CC3=O)C=C(C=C4)S(=O)(=O)[O-])C.[Na+]	{1: 2, 34: 3, 14: 12, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	7357-96-2	C1=CC(=CC=C1CCC2=CC=C(C=C2)[N+](=O)[O-])N	{2: 2, 38: 1, 30: 1, 14: 8}
Did not match all atoms present	73573-42-9	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)/C=C/C6=CC(=C(C=C6)O)OC	{32: 1, 1: 4, 6: 2, 33: 1, 11: 5, 12: 6, 14: 6, 21: 1, 22: 3, 28: 2}
Did not match all atoms present	73588-42-8	C[C@](CC(Cl)(Cl)Cl)(C1=CC(=CC(=C1)Cl)Cl)Cl	{1: 1, 2: 1, 4: 2, 14: 3, 17: 6}
Did not match all atoms present	7359-72-0	CC1=C(C(=C(C=C1)Cl)Cl)Cl	{1: 1, 14: 2, 17: 3}
Did not match all atoms present	73597-22-5	CN(C)CNC(=O)C=C.C[N+](C)(CC=C)CC=C.[Cl-]	{1: 4, 2: 3, 5: 3, 6: 3, 33: 1, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	73597-24-7	COC1=CC=C(C=C1)O.C=CC(=O)OCCCCCCOC(=O)C=C.C1=CC(=O)OC1=O	{1: 1, 2: 6, 5: 2, 6: 2, 14: 6, 21: 1, 22: 1, 28: 4}
Did not match all atoms present	73598-93-3	CC(=C)C(=O)O.C=C.C1CCC(=NCC1)[O-].C1CCC(=NCC1)[O-].[Zn+2]	{1: 1, 35: 2, 5: 3, 7: 1, 11: 10, 15: 2, 27: 1}
Did not match all atoms present	73599-93-6	C1C2CC3(CC1CC(C2)(C3)C(=O)CO)C4=CC=CC=C4	{2: 1, 11: 6, 12: 2, 13: 2, 14: 5, 20: 1, 24: 1}
Did not match all atoms present	736-30-1	C1=CC(=CC=C1CCC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{2: 2, 38: 2, 14: 8}
Did not match all atoms present	736-40-3	CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2	{1: 1, 2: 1, 14: 9, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	7360-53-4	C(=O)[O-].C(=O)[O-].C(=O)[O-].[Al+3]	{26: 3}
Did not match all atoms present	7360-64-7	B(N(C)C)(Br)Br	{1: 2, 18: 2, 33: 1}
Did not match all atoms present	73608-52-3	C1CC2=CC=C3C=C(CCC4=CC5=CC=C1C=CC5=C4)C=C3C=C2	{11: 4, 14: 12}
Did not match all atoms present	73609-36-6	C[Si](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(Cl)Cl	{16: 13, 1: 1, 2: 2, 4: 6, 17: 2}
Did not match all atoms present	7361-31-1	CC(CC1=CC=C(C=C1)O)(C(=O)OC)N.Cl	{1: 2, 2: 1, 4: 1, 14: 4, 17: 1, 21: 1, 28: 1, 30: 1}
Did not match all atoms present	7361-61-7	CC1=C(C(=CC=C1)C)NC2=NCCCS2	{1: 2, 35: 1, 41: 1, 11: 3, 14: 3, 15: 1, 31: 1}
Did not match all atoms present	7361-89-9	CCC[Se][Se]CCC	{1: 2, 2: 4}
Did not match all atoms present	73612-27-8	CCOC1=CC=CC=C1N=NN2C(=NN(C2=O)C(=N)N)C.Cl	{1: 2, 2: 1, 35: 1, 36: 1, 33: 2, 7: 1, 34: 2, 14: 4, 17: 1, 22: 1, 25: 1, 30: 1}
Did not match all atoms present	73612-28-9	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)N=NC4=C(C=C5C=C(C=C(C5=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)S(=O)(=O)CCOS(=O)(=O)[O-].[K+].[K+].[K+].[K+]	{2: 2, 35: 3, 34: 2, 14: 11, 17: 1, 22: 1, 24: 1, 29: 14, 30: 1, 31: 3}
Did not match all atoms present	73612-29-0	CC1=CC(=C(C=C1)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-].[Sr+2]	{1: 1, 34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	73612-30-3	CCC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C(=O)C=C2.CCC1=CC(=C(C=C1Cl)S(=O)(=O)[O-])N/N=C\2/C3=CC=CC=C3C(=O)C=C2.[Ba+2]	{1: 2, 2: 2, 34: 2, 14: 16, 15: 2, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	73612-33-6	C1=CC=C2C(=C1)C=CC(=C2N/N=C/3\C4=CC=CC=C4C=C(C3=O)C(=O)[O-])S(=O)(=O)[O-].[Sr+2]	{34: 1, 14: 11, 15: 2, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	73612-35-8	C1=CC=C2C(=C(C=CC2=C1)S(=O)(=O)[O-])N/N=C\3/C4=CC=CC=C4C(=O)C=C3.C1=CC=C2C(=C(C=CC2=C1)S(=O)(=O)[O-])N/N=C\3/C4=CC=CC=C4C(=O)C=C3.[Ba+2]	{34: 2, 14: 24, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	73612-36-9	C1=CC=C2C(=C(C=CC2=C1)S(=O)(=O)[O-])N/N=C\3/C4=CC=CC=C4C=CC3=O.C1=CC=C2C(=C(C=CC2=C1)S(=O)(=O)[O-])N/N=C\3/C4=CC=CC=C4C=CC3=O.[Ca+2]	{34: 2, 14: 24, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	73612-38-1	C1=CC=C2C(=O)C=C/C(=N\NC3=C(C4=C(C=C3)C(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=C1.[Ba+2]	{34: 1, 14: 11, 15: 1, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	73612-39-2	C1=CC=C2C(=C(C=CC2=C1)N/N=C\3/C4=CC=CC=C4C(=O)C=C3)S(=O)(=O)[O-].C1=CC=C2C(=C(C=CC2=C1)N/N=C\3/C4=CC=CC=C4C(=O)C=C3)S(=O)(=O)[O-].[Ba+2]	{34: 2, 14: 24, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	73622-67-0	CC1=[NH+]C=C(C(=C1O)CSC(=O)C)CSC(=O)C.[Br-]	{32: 1, 1: 3, 2: 2, 40: 2, 14: 1, 18: 1, 21: 1, 24: 2}
Did not match all atoms present	73624-47-2	B1(C2CCCC1CCC2)[C@@H]3C[C@@H]4C[C@H]([C@H]3C)C4(C)C	{1: 3, 11: 8, 12: 6, 13: 1}
Did not match all atoms present	73637-11-3	COC1=CC(=C(C=C1)C=O)CCl	{1: 1, 2: 1, 14: 3, 17: 1, 22: 1, 26: 1}
Did not match all atoms present	73637-16-8	CC(=O)C1=C2C(=CC3=C1C(=C(C=C3)O)O)C=CC=C2O	{24: 1, 1: 1, 21: 3, 14: 6}
Did not match all atoms present	73639-62-0	C[Si]1(OCC(O1)CCl)C	{1: 2, 2: 1, 11: 1, 12: 1, 17: 1, 23: 2}
Did not match all atoms present	7364-19-4	CCC1=CC=C(C=C1)C(C)(C)C	{1: 4, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	7364-20-7	CCC1=CC=C(C=C1)C(=O)OC	{1: 2, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	7364-25-2	C1=CC=C2C(=C1)C(=O)NN2	{32: 2, 25: 1, 14: 4}
Did not match all atoms present	7365-44-8	C(CS(=O)(=O)O)NC(CO)(CO)CO	{20: 4, 2: 5, 4: 1, 29: 2, 31: 1}
Did not match all atoms present	7365-45-9	C1CN(CCN1CCO)CCS(=O)(=O)O	{33: 2, 2: 4, 11: 4, 20: 2, 29: 2}
Did not match all atoms present	7365-82-4	C(CS(=O)(=O)O)NCC(=O)N	{2: 3, 20: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	73650-66-5	C1CC2=CC3=CC=CC=C3C=C2CCC4=CC=C1N4	{32: 1, 11: 4, 14: 8}
Did not match all atoms present	73650-67-6	C1CC2=CC=C(N2)CCC3=CC=C1N3	{32: 2, 11: 4, 14: 4}
Did not match all atoms present	73650-69-8	C1CC2=CC=C(S2)CCC3=CC=C1S3	{41: 2, 11: 4, 14: 4}
Did not match all atoms present	73650-94-9	C1CC2=CC=C(O2)CCC3=CC=C1N3	{32: 1, 11: 4, 14: 4, 23: 1}
Did not match all atoms present	73651-49-7	C1=C(C=C2C(=C1N)C(=O)C3=C(C2=O)C(=C(C=C3N)S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+]	{25: 2, 30: 2, 21: 1, 14: 3, 29: 6}
Did not match all atoms present	73663-86-2	C1CCC2=NC3=C(C=CC=C3Cl)C(=C2C1)N4CCOCC4.Cl	{33: 1, 35: 1, 11: 8, 14: 3, 17: 2, 23: 1}
Did not match all atoms present	73663-97-5	COC1=CC=CC=C1NC2=NC=NC3=C2NC=N3	{32: 1, 1: 1, 35: 3, 14: 6, 22: 1, 31: 1}
Did not match all atoms present	73671-79-1	C[C@@H](C1=CC=CC2=CC=CC=C21)N=C=O	{1: 1, 34: 1, 3: 1, 8: 1, 14: 7, 29: 1}
Did not match all atoms present	7368-12-9	CC1=NN(C(=C1)OCC[N+](C)(C)C)CC2=CC=CC=C2.[I-]	{1: 4, 2: 3, 35: 1, 33: 1, 14: 6, 19: 1, 22: 1}
Did not match all atoms present	7368-65-2	CC[P+](CC)(CC)CC.[Cl-]	{1: 4, 2: 4, 17: 1}
Did not match all atoms present	73680-58-7	O.[O-]S(=O)(=O)F.[O-]S(=O)(=O)F.[O-]S(=O)(=O)F.[Al+3]	{16: 3, 29: 9}
Did not match all atoms present	73688-63-8	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NC4=CC=C(C=C4)OC5=CC=C(C=C5)S(=O)(=O)O)NC6=CC=C(C=C6)OC7=CC=C(C=C7)S(=O)(=O)O	{14: 22, 20: 2, 22: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	73688-85-4	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[As](=O)(O)O.Cl	{1: 2, 34: 2, 33: 1, 14: 8, 17: 1, 20: 2, 29: 1}
Did not match all atoms present	7369-50-8	CCC1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 4}
Did not match all atoms present	73693-97-7	CCOC1=CC=C(C=C1)NC(=O)C[NH+]2CCCCC2.[Cl-]	{1: 1, 2: 2, 11: 5, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	73698-75-6	CC[NH+](CC)CCOCCOCCOCCOCCOC(=O)C1=CC=C(C=C1)N.[Cl-]	{1: 2, 2: 12, 14: 4, 17: 1, 22: 4, 28: 1, 30: 1}
Did not match all atoms present	73698-76-7	CC[NH+](CC)CCOCCOCCOCCOC(=O)C1=CC=C(C=C1)N.[Cl-]	{1: 2, 2: 10, 14: 4, 17: 1, 22: 3, 28: 1, 30: 1}
Did not match all atoms present	73698-77-8	CC[NH+](CC)CCOCCOCCOC(=O)C1=CC=C(C=C1)N.[Cl-]	{1: 2, 2: 8, 14: 4, 17: 1, 22: 2, 28: 1, 30: 1}
Did not match all atoms present	73698-78-9	CC[NH+](CC)CCOCCOC(=O)C1=CC=C(C=C1)N.[Cl-]	{1: 2, 2: 6, 14: 4, 17: 1, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	737-22-4	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=CC=C3F	{16: 1, 1: 2, 14: 9}
Did not match all atoms present	737-31-5	CC(=O)NC1=C(C(=C(C(=C1I)C(=O)[O-])I)NC(=O)C)I.[Na+]	{24: 3, 1: 2, 19: 3, 31: 2}
Did not match all atoms present	737-89-3	C1=CC=C2C(=C1)C=CC=C2NC3=CC=CC4=CC=CC=C43	{14: 14, 31: 1}
Did not match all atoms present	73713-56-1	C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)Br	{24: 2, 18: 1, 14: 9, 31: 2}
Did not match all atoms present	73713-75-4	CCC1CN2CCC3=CC(=C(C=C3C2CC1CC4C5=CC(=C(C=C5CCN4)OC)OC)OC)OC.O.O.O.O.Cl.Cl	{32: 1, 1: 5, 2: 2, 33: 1, 11: 6, 12: 4, 14: 4, 17: 2, 22: 4}
Did not match all atoms present	7372-85-2	CC1=CC(=C(C=C1)C)C2=CC=CC=C2	{1: 2, 14: 8}
Did not match all atoms present	7372-86-3	CCC1=CC2=C(C=C1)C=C(C=C2)C	{1: 2, 2: 1, 14: 6}
Did not match all atoms present	7372-87-4	CC1=CC=CC2=C1C=CC3=C2C=CC=C3C	{1: 2, 14: 8}
Did not match all atoms present	7372-88-5	CC1=CC=CC2=C1SC3=CC=CC=C23	{1: 1, 14: 7, 41: 1}
Did not match all atoms present	7372-92-1	CC1=CC=CC2=C1CC=C2	{1: 1, 11: 1, 14: 5}
Did not match all atoms present	7372-93-2	C1=CC=C(C=C1)OC2=CC(=CC=C2)SC3=CC=CC(=C3)OC4=CC=CC=C4	{40: 1, 22: 2, 14: 18}
Did not match all atoms present	7372-94-3	C1=CC=C(C=C1)OC2=CC(=CC=C2)SC3=CC=CC(=C3)SC4=CC=CC=C4	{40: 2, 22: 1, 14: 18}
Did not match all atoms present	7372-99-8	C1=CC=C(C=C1)OC2=CC(=CC=C2)SC3=CC=CC=C3	{40: 1, 22: 1, 14: 14}
Did not match all atoms present	73728-78-6	CC1=CC(=C(C(=C1)C)C2=CC(=C(C=C2)N)C)C	{1: 4, 30: 1, 14: 5}
Did not match all atoms present	73728-79-7	CC1=CC(=C(C=C1)C)C2=CC(=C(C=C2)N)C	{1: 3, 30: 1, 14: 6}
Did not match all atoms present	73728-82-2	C1=CC=C(C=C1)C2=CC(=C(C=C2)[NH3+])O.OS(=O)(=O)[O-]	{20: 1, 21: 1, 14: 8, 29: 3}
Did not match all atoms present	7374-66-5	C1=CC=C2C(=C1)C=CC3=C2C4=C(N3)C5=CC=CC=C5C(=O)O4	{32: 1, 28: 1, 14: 10}
Did not match all atoms present	7374-80-3	CC(C)(C1=CC=C(C=C1)C(C)(C)Cl)Cl	{1: 4, 4: 2, 14: 4, 17: 2}
Did not match all atoms present	73747-29-2	CC(C)[NH+](CCOC(C(C)[NH3+])C(=O)C1=CC=CC=C1)C(C)C.[Cl-].[Cl-]	{1: 5, 2: 2, 3: 4, 14: 5, 17: 2, 22: 1, 24: 1}
Did not match all atoms present	73747-51-0	CCCCC/C(=N/O)/C1CC2=CC=CC=C12	{1: 1, 2: 4, 7: 1, 11: 1, 12: 1, 34: 1, 14: 4, 20: 1}
Did not match all atoms present	73747-53-2	CCC(=O)N1C=CC2=CC=CC=C21	{24: 1, 1: 1, 2: 1, 14: 6, 33: 1}
Did not match all atoms present	73747-54-3	CC(CC1=CC(=CC=C1)C(F)(F)F)NCC(=O)N2CCCCC2	{1: 1, 2: 2, 3: 1, 4: 1, 33: 1, 11: 5, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	73754-27-5	CC1(CC(CC(N1CCOC(=O)CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)(C)C)OC(=O)CCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C	{1: 16, 2: 6, 4: 4, 33: 1, 11: 2, 12: 1, 13: 2, 14: 4, 21: 2, 28: 2}
Did not match all atoms present	73758-18-6	B(OC(C(C)CC)C(C)CC)(OC(C(C)CC)C(C)CC)OC(C(C)CC)C(C)CC	{1: 12, 2: 6, 3: 9, 22: 3}
Did not match all atoms present	73758-56-2	C1=CC(=C(C=C1C2=CC(=C(C=C2)OCCCC(=O)O)N)N)OCCCC(=O)O	{30: 2, 2: 6, 27: 2, 22: 2, 14: 6}
Did not match all atoms present	73758-57-3	C1=CC=C(C=C1)C(CCS)(C2=CC=CC=C2)C(=O)O	{2: 2, 27: 1, 4: 1, 14: 10, 39: 1}
Did not match all atoms present	73758-63-1	CC1=CC(=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC(=C3)C)N.Cl.Cl	{1: 2, 4: 1, 30: 1, 14: 13, 17: 2}
Did not match all atoms present	73758-64-2	C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(N(CP(=O)(O)O)CP(=O)([O-])[O-])P(=O)(O)O.[Na+].[Na+]	{33: 4, 2: 21, 20: 13, 29: 5}
Did not match all atoms present	7376-52-5	C1=CC(=CC=C1NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)O)NC5=CC=C(C=C5)OCCOCCOCCO)OCCOCCOCCO	{2: 12, 14: 12, 20: 2, 21: 2, 22: 6, 25: 2, 31: 2}
Did not match all atoms present	7376-66-1	CC(C)NCC(C1=CC=C(C=C1)O)O	{1: 2, 2: 1, 3: 2, 14: 4, 20: 1, 21: 1, 31: 1}
Did not match all atoms present	7377-08-4	C1=CC(=CC=C1C(=O)NCCC(=O)O)N	{2: 2, 14: 4, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	7377-26-6	COC(=O)C1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	73771-13-8	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-].O.[Na+]	{38: 3, 14: 2}
Did not match all atoms present	73771-72-9	CC1=C2C(CC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1)F	{16: 1, 1: 1, 11: 1, 12: 1, 14: 9}
Did not match all atoms present	73771-73-0	CC1=C2CCC3=C2C(=C(C4=C3C=CC5=CC=CC=C54)F)C=C1	{16: 1, 1: 1, 11: 2, 14: 8}
Did not match all atoms present	73771-74-1	CC1=C2CCC3=C2C(=CC4=C3C=CC5=C4C=CC(=C5)F)C=C1	{16: 1, 1: 1, 11: 2, 14: 8}
Did not match all atoms present	73771-81-0	CC[N+]12CCC(C[C@@H]1[C@H](C3=C4C=C(C=CC4=NC=C3)OC)O)C(C2)C=C.[I-]	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 11: 4, 12: 3, 14: 5, 19: 1, 20: 1, 22: 1, 35: 1}
Did not match all atoms present	73772-31-3	CCNC1=CC2=C(C=C1C)N=C3C=CC(=[N+](CC)CC)C=C3O2.[Cl-].Cl[Zn]Cl	{1: 4, 2: 3, 35: 1, 33: 1, 14: 5, 17: 3, 23: 1, 31: 1}
Did not match all atoms present	73772-32-4	CN(C)CCCN(CC(CS(=O)(=O)[O-])O)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Na+]	{1: 2, 2: 5, 3: 1, 4: 6, 33: 2, 16: 13, 20: 1, 29: 5}
Did not match all atoms present	73772-33-5	CC(=O)O.CN(C)CCCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 3, 2: 3, 4: 6, 33: 1, 16: 13, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	73772-34-6	CN(C)CCCN(CCOCCOCCO)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 2, 2: 9, 4: 6, 33: 2, 16: 13, 20: 1, 22: 2, 29: 2}
Did not match all atoms present	73772-36-8	C[Si](Cl)Cl.C(CC(=O)O)C(=O)O.C(CO)O	{1: 1, 2: 4, 27: 2, 20: 2, 17: 2}
Did not match all atoms present	73772-43-7	CCCCCCCC(=O)[NH+](CCCN(C)C)[O-]	{24: 1, 1: 3, 2: 9, 29: 1, 33: 1}
Did not match all atoms present	73772-44-8	CCCCCCCCCC(=O)[NH+](CCCN(C)C)[O-]	{24: 1, 1: 3, 2: 11, 29: 1, 33: 1}
Did not match all atoms present	73772-45-9	CCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)O.[OH-]	{24: 1, 1: 3, 2: 12, 27: 1, 31: 1}
Did not match all atoms present	73772-46-0	CCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]	{24: 2, 1: 3, 2: 10, 31: 1}
Did not match all atoms present	73775-17-4	B(C)(N(C)N(B(C)F)C)F	{16: 2, 1: 4, 33: 2}
Did not match all atoms present	7378-50-9	CN(C)C1=CC=CC=C1/C=C/C2=CC=C(C=C2)Cl	{1: 2, 33: 1, 14: 8, 6: 2, 17: 1}
Did not match all atoms present	7378-54-3	CC1=CC=C(C=C1)C=CC2=CC=C(C=C2)N(C)C	{1: 3, 14: 8, 6: 2, 33: 1}
Did not match all atoms present	73781-91-6	COC(=O)C1=CN=C(C=C1)Cl	{1: 1, 35: 1, 28: 1, 14: 3, 17: 1}
Did not match all atoms present	73784-45-9	CC1(CC(C(N1O)(C)C)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])F)C	{1: 4, 38: 2, 33: 1, 11: 1, 12: 1, 13: 2, 14: 2, 16: 1, 20: 1, 31: 1}
Did not match all atoms present	73785-34-9	CC(=O)OC1=C(C2=C(C=C1)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3)OC(=O)C	{1: 2, 28: 2, 14: 10}
Did not match all atoms present	73785-40-7	CC1=C(N=CN1)CSCCN=C(NC#N)N(C)N=O	{32: 1, 1: 2, 2: 3, 35: 1, 33: 1, 7: 1, 40: 1, 34: 2, 14: 1, 37: 1, 29: 1, 31: 1}
Did not match all atoms present	7379-26-2	C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.N.N.N.N	{33: 2, 2: 6, 27: 4}
Did not match all atoms present	7379-35-3	C1=CN=CC=C1Cl.Cl	{17: 2, 35: 1, 14: 4}
Did not match all atoms present	7379-51-3	CC1=CC(=CC(=C1SC)C)O	{40: 1, 1: 3, 21: 1, 14: 2}
Did not match all atoms present	7379-79-5	C[Si](C)(C)N	{1: 3, 30: 1}
Did not match all atoms present	73790-27-9	C[N+]1(CCCCC1)CCC(=O)NC2=CC(=C(C=C2)C(=O)OC)O.[I-]	{1: 2, 2: 2, 11: 5, 14: 3, 19: 1, 21: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	73791-26-1	C1=CC=C(C(=C1)C(=O)O)NCN2C3=CC=CC=C3SC2=S	{33: 1, 2: 1, 41: 1, 14: 8, 27: 1, 31: 1}
Did not match all atoms present	73791-29-4	CC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)Br)S(=O)(=O)CCO	{1: 1, 2: 2, 14: 8, 18: 1, 20: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	73791-32-9	CC1=CC(=C(C(=C1)C)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C	{1: 3, 31: 1, 14: 9, 25: 2}
Did not match all atoms present	73791-39-6	C1=CC(=CC=C1N)[As]=O.O.O	{30: 1, 29: 1, 14: 4}
Did not match all atoms present	73791-40-9	CCCC[As](=O)(C(C)C)O	{1: 3, 2: 3, 3: 1, 20: 1, 29: 1}
Did not match all atoms present	73791-41-0	C1=CC=C(C(=C1)Cl)[As](=O)(CC(COC2=C(C=C(C=C2)Cl)Cl)O)O	{2: 2, 3: 1, 14: 7, 17: 3, 20: 2, 22: 1, 29: 1}
Did not match all atoms present	73791-42-1	C[As](=O)(C1=CC=C(C=C1)Cl)O	{1: 1, 20: 1, 29: 1, 14: 4, 17: 1}
Did not match all atoms present	73791-43-2	CC(C)C[As](=O)(C(C)C)O	{1: 4, 2: 1, 3: 2, 20: 1, 29: 1}
Did not match all atoms present	73791-44-3	C[As](=O)(CCC1=CC=CC=C1)O	{1: 1, 2: 2, 20: 1, 29: 1, 14: 5}
Did not match all atoms present	73791-45-4	CCC[As](=O)(C)O	{1: 2, 2: 2, 20: 1, 29: 1}
Did not match all atoms present	73791-62-5	CCCCCCCC/C=C/CCCCCCCC(=O)NCC[N+](C)(CCO)CC(CS(=O)(=O)[O-])O.COS(=O)(=O)[O-].[Na+]	{1: 3, 2: 20, 3: 1, 6: 2, 20: 2, 22: 1, 24: 1, 29: 6, 31: 1}
Did not match all atoms present	73791-64-7	C[N+](CCCN(CCCN(CC1=CC=CC=C1)CC2=CC=CC=C2)CC3=CC=CC=C3)(CCC[N+](C)(CC4=CC=CC=C4)CC5=CC=CC=C5)CC6=CC=CC=C6.COS(=O)(=O)[O-].COS(=O)(=O)[O-]	{1: 4, 2: 15, 33: 2, 14: 30, 22: 2, 29: 6}
Did not match all atoms present	73791-66-9	CC1=CC(=C(C=C1N)C)N.OS(=O)(=O)O	{1: 2, 30: 2, 20: 2, 29: 2, 14: 2}
Did not match all atoms present	738-70-5	COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N	{1: 3, 2: 1, 35: 2, 14: 3, 22: 3, 30: 2}
Did not match all atoms present	738-99-8	C1CN1P(=O)(N2CC2)N3CCN(CC3)P(=O)(N4CC4)N5CC5	{33: 6, 11: 12, 29: 2}
Did not match all atoms present	73803-48-2	C1CC2CC1C3C2CN(C3)NC(=O)C4=CC(=C(C=C4)Cl)S(=O)(=O)N	{33: 1, 11: 5, 12: 4, 14: 3, 17: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	73804-30-5	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])CC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)[O-].[Ca+2]	{2: 1, 29: 6, 14: 12}
Did not match all atoms present	73806-23-2	C1CSCCO1.Cl[Hg]Cl	{17: 2, 11: 4, 41: 1, 23: 1}
Did not match all atoms present	73806-49-2	CN(C)C[C@@H]1CCCC[C@@]1(C2=CC(=CC=C2)OC)O.Cl	{1: 3, 2: 1, 33: 1, 11: 4, 12: 1, 13: 1, 14: 4, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	7381-13-7	C1CCC(=O)N(CC1)C(=O)C2=CC(=CC=C2)C(=O)N3CCCCCC3=O	{24: 2, 25: 2, 11: 10, 14: 4, 33: 2}
Did not match all atoms present	7381-30-8	C[Si](C)(C)OCCO[Si](C)(C)C	{1: 6, 2: 2, 22: 2}
Did not match all atoms present	73815-11-9	COCC1CN(C(=O)O1)C2=CC=C(C=C2)OCC3=CC=CC(=C3)C#N	{1: 1, 2: 2, 37: 1, 33: 1, 11: 1, 12: 1, 14: 8, 22: 2, 28: 1}
Did not match all atoms present	73816-43-0	C1COCC[N+]1=CC2=CNC3=CC=CC=C32.C1COCC[N+]1=CC2=CNC3=CC=CC=C32.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sn+4]	{32: 2, 33: 2, 6: 2, 11: 8, 14: 10, 17: 6, 23: 2}
Did not match all atoms present	73816-58-7	C1CN(C2=C1C=CC(=C2)[N+](=O)[O-])C=O	{33: 1, 26: 1, 11: 2, 38: 1, 14: 3}
Did not match all atoms present	73816-74-7	CCN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(/C(=N/NC5=C(C=C(C=C5)C)S(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 2, 2: 1, 35: 3, 33: 1, 34: 1, 14: 11, 15: 2, 17: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	73816-75-8	C1=CC2=C(C=CC(=C2S(=O)(=O)O)N/N=C/3\C(=CC4=C(C3=O)C=CC(=C4)NCC5=NC(=NC(=N5)Cl)Cl)S(=O)(=O)O)C(=C1)S(=O)(=O)O	{2: 1, 35: 3, 34: 1, 14: 9, 15: 2, 17: 2, 20: 3, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	73816-77-0	C1=CC2=C(C=CC(=C2O)S(=O)(=O)O)C(=C1)NC3=CC4=C(C=C3)C(=C(C=C4)S(=O)(=O)O)O	{31: 1, 20: 2, 21: 2, 14: 10, 29: 4}
Did not match all atoms present	73825-17-9	B12SB(SB3SB(SB4SB(SB5SB(S1)SS5)SS4)SS3)SS2	{41: 16}
Did not match all atoms present	73825-85-1	C[Se]C.C[Se]C.O.[O-]S(=O)(=O)[O-].[Pt+2]	{1: 4, 29: 4}
Did not match all atoms present	73825-87-3	C1CCC(C(C1)N)N.O.O.[OH-].[OH-].[Pt+2]	{11: 4, 12: 2, 30: 2}
Did not match all atoms present	73826-58-1	C1=CC(=C(C=C1[N+](=O)[O-])N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)Cl)Cl)S(=O)(=O)O)S(=O)(=O)O)O	{34: 1, 35: 3, 38: 1, 14: 6, 15: 2, 17: 2, 20: 2, 21: 1, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	73829-94-4	CCC(CC)C#CC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 10: 2, 14: 5}
Did not match all atoms present	7383-70-2	C1=CC=C(C=C1)OC(=O)C2=CC(=CC(=C2)C(=O)OC3=CC=CC=C3)C(=O)OC4=CC=CC=C4	{28: 3, 14: 18}
Did not match all atoms present	7383-87-1	CC1=CC=C(C=C1)C2=CC(=CC(=C2)C)C	{1: 3, 14: 7}
Did not match all atoms present	7383-88-2	CC1=CC2=C(C=C1)C=C(C=C2)C(C)C	{1: 3, 3: 1, 14: 6}
Did not match all atoms present	7383-90-6	CC1=CC=C(C=C1)C2=CC(=CC=C2)C	{1: 2, 14: 8}
Did not match all atoms present	73834-77-2	C1=CC=C2C(=C1)C3=CC(=NC=C3N2)N	{32: 1, 35: 1, 30: 1, 14: 6}
Did not match all atoms present	73836-71-2	CC(=O)OC1=CC=CC=C1C(=O)O.C1=CC=C(C(=C1)C(=O)O)O	{1: 1, 27: 2, 28: 1, 21: 1, 14: 8}
Did not match all atoms present	73836-75-6	CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C4[N-]3)C5=NC(=CC6=NC(=C2)C(=C6C)C=C)C(C5CCC(=O)[O-])C)C(=O)[O-])[O-])C)C=O.[Na+].[Na+].[Cu+2]	{1: 4, 2: 3, 35: 4, 5: 1, 6: 1, 12: 3, 14: 3, 15: 12, 24: 2, 26: 1}
Did not match all atoms present	73838-84-3	CC(C)(C)C#C[Hg]C#CC(C)(C)C	{1: 6, 10: 4, 4: 2}
Did not match all atoms present	73839-65-3	CC(=O)C1=C(COC1=O)C2=CC(=C(C=C2)O)OC	{1: 2, 11: 1, 14: 3, 15: 2, 21: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	7384-22-7	[Li+].CCCCCCCC/C=C\CCCCCCCC(=O)[O-]	{24: 1, 1: 1, 2: 14, 6: 2}
Did not match all atoms present	73840-42-3	CN1CC=C(C=C1)SC2=CC=CC=C2.[I-]	{1: 1, 33: 1, 40: 1, 11: 1, 14: 8, 15: 1, 19: 1}
Did not match all atoms present	7385-67-3	CCN(CC)C1=CC2=C(C=C1)N=C3C4=CC=CC=C4C(=O)C=C3O2	{1: 2, 2: 2, 35: 1, 33: 1, 14: 8, 23: 1, 25: 1}
Did not match all atoms present	7385-99-1	C1=CC=C2C(=C1)C=CC(=N2)NN=CC3=CC=CC=N3	{34: 1, 35: 2, 14: 10, 6: 1, 31: 1}
Did not match all atoms present	73852-19-4	B(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(O)O	{16: 6, 20: 2, 4: 2, 14: 3}
Did not match all atoms present	73859-73-1	C1=CC(=CC=C1C(=O)NNC(=O)N)[N+](=O)[O-]	{24: 2, 38: 1, 30: 1, 14: 4, 31: 2}
Did not match all atoms present	73873-83-3	C1=CN(C=CC1=C[NH+]=O)COCN2C=CC(=C[NH+]=O)C=C2.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]	{33: 2, 2: 2, 6: 2, 14: 8, 15: 2, 22: 1, 29: 2, 31: 2}
Did not match all atoms present	7388-28-5	C(C[O-])O.[Na+]	{2: 2, 20: 1, 29: 1}
Did not match all atoms present	73892-04-3	CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)(C)C(=O)O.[Ti+4]	{27: 1, 1: 11, 3: 4, 4: 1, 29: 4}
Did not match all atoms present	739-71-9	CC(CN1C2=CC=CC=C2CCC3=CC=CC=C31)CN(C)C	{1: 3, 2: 2, 3: 1, 33: 2, 11: 2, 14: 8}
Did not match all atoms present	73908-23-3	C1=CC=C(C=C1)[C@@H](CBr)O	{2: 1, 3: 1, 20: 1, 18: 1, 14: 5}
Did not match all atoms present	73909-20-3	C1=CC=C(C(=C1)C=C2C(=O)NC(=S)NC2=O)C(=O)O	{32: 2, 6: 1, 14: 4, 15: 2, 25: 2, 27: 1}
Did not match all atoms present	7391-28-8	CC1=CC=C(C=C1)C(=O)CC#N	{24: 1, 1: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	73918-56-6	C1=CC(=CC=C1CCN)Br	{2: 2, 30: 1, 18: 1, 14: 4}
Did not match all atoms present	73926-79-1	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[K+].[Sn+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	73926-80-4	CCCC[S+](CC1=CC=CC=C1)CC2=CC=CC=C2.[I-].[I-].[I-].[Hg+2]	{1: 1, 2: 5, 19: 3, 14: 10}
Did not match all atoms present	73926-81-5	CC[S+](CC1=CC=CC=C1)CC2=CC=CC=C2.[I-].[I-].[I-].[Hg+2]	{1: 1, 2: 3, 19: 3, 14: 10}
Did not match all atoms present	73926-83-7	C1=CC=C(C=C1)C[S+](CC2=CC=CC=C2)CC3=CC=CC=C3.[I-].[I-].[I-].[Hg+2]	{2: 3, 19: 3, 14: 15}
Did not match all atoms present	73926-87-1	C1CCC(C(C1)NC(=O)CCBr)[Hg]Cl	{2: 2, 11: 4, 12: 2, 17: 1, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	73926-88-2	CCCCCC(=O)N[C@@H]1CCCC[C@H]1[Hg]Cl	{1: 1, 2: 4, 11: 4, 12: 2, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	73926-89-3	COCCC(=O)NC1CCCCC1[Hg]Cl	{1: 1, 2: 2, 11: 4, 12: 2, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	73926-90-6	CC[Sn](CC)(CC)Br.CC1CCCCN1	{32: 1, 1: 4, 2: 3, 11: 4, 12: 1, 18: 1}
Did not match all atoms present	73926-92-8	C1=CC(=C(C=C1/C=C/C2=CC(=C(C=C2)N)Cl)Cl)N	{17: 2, 30: 2, 14: 6, 6: 2}
Did not match all atoms present	73926-94-0	C1=CC2=C(C=CC3=NN(N=C23)C4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 1, 35: 2, 6: 2, 14: 11, 17: 1, 29: 9}
Did not match all atoms present	73927-56-7	C1=CC(=C(C(=C1)Cl)COCC2=C(C=CC=C2Cl)Cl)Cl	{17: 4, 2: 2, 22: 1, 14: 6}
Did not match all atoms present	73927-60-3	CCC1=CC=CC2=C1C3=NC4=C(C=C3C=C2)C5=CC=CC=C5C=C4	{1: 1, 2: 1, 35: 1, 14: 12}
Did not match all atoms present	73927-86-3	CCCC[Sn](CCCC)(OS(=O)(=O)C)OS(=O)(=O)C	{1: 4, 2: 6, 29: 4, 22: 2}
Did not match all atoms present	73927-87-4	CCC[Sn](CCC)(OS(=O)(=O)C)OS(=O)(=O)C	{1: 4, 2: 4, 29: 4, 22: 2}
Did not match all atoms present	73927-88-5	CCCCN(CCCC)C(=S)S[Sn](CCCC)(SC(=S)N(CCCC)CCCC)SC(=S)N(CCCC)CCCC	{40: 3, 1: 7, 2: 21, 33: 3, 7: 3}
Did not match all atoms present	73927-89-6	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)CC#N	{2: 1, 28: 1, 37: 1, 14: 15}
Did not match all atoms present	73927-90-9	C[Sn+2]C.C1=CC=C2C(=C1)N=C(C(=N2)[S-])[S-]	{1: 2, 35: 2, 14: 4}
Did not match all atoms present	73927-91-0	CCCC[Sn](CCCC)(CCCC)OC(=O)CI	{1: 3, 2: 10, 19: 1, 28: 1}
Did not match all atoms present	73927-92-1	CCC[Sn](CCC)(CCC)OC(=O)CI	{1: 3, 2: 7, 19: 1, 28: 1}
Did not match all atoms present	73927-93-2	CCCC[Sn](CCCC)(CCCC)OC(=O)C1=CC=CC=C1I	{1: 3, 2: 9, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	73927-94-3	CCC[Sn](CCC)(CCC)OC(=O)C1=CC=CC=C1I	{1: 3, 2: 6, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	73927-95-4	CCCC[Sn](CCCC)(CCCC)OC(=O)CCI	{1: 3, 2: 11, 19: 1, 28: 1}
Did not match all atoms present	73927-96-5	C1=CC=C(C=C1)[Sn]2(SC3=NC4=CC=CC=C4N=C3S2)C5=CC=CC=C5	{41: 2, 35: 2, 14: 14}
Did not match all atoms present	73927-97-6	CCCC[Sn](CCCC)(CCCC)OC(=O)CSCC(C)(C)C(C)(C)C	{40: 1, 1: 8, 2: 11, 4: 2, 28: 1}
Did not match all atoms present	73927-98-7	CCCC[Sn](CCCC)(CCCC)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 3, 2: 9, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	73927-99-8	CCC[Sn](CCC)(CCC)OC(=O)C(Cl)(Cl)Cl	{1: 3, 2: 6, 4: 1, 28: 1, 17: 3}
Did not match all atoms present	73928-00-4	CCCCCCCCCCC(=O)O[Sn](C(C)C)(C(C)C)C(C)C	{1: 7, 2: 9, 3: 3, 28: 1}
Did not match all atoms present	73928-01-5	C1=CC=C(C=C1)C=CC2=CC(=C(C=C2)N)Cl	{17: 1, 30: 1, 14: 8, 6: 2}
Did not match all atoms present	73928-02-6	COC1=C(C=CC(=C1)C=CC2=CC=CC=C2)N	{1: 1, 22: 1, 30: 1, 14: 8, 6: 2}
Did not match all atoms present	73928-03-7	CC1=C(C=CC(=C1)N)C=CC2=CC=CC=C2	{1: 1, 30: 1, 14: 8, 6: 2}
Did not match all atoms present	73928-04-8	CC1=C(C=CC(=C1)C=CC2=CC=CC=C2)N	{1: 1, 30: 1, 14: 8, 6: 2}
Did not match all atoms present	73928-11-7	C1=CC=C(C=C1)[NH-].C1=CC=C(C=C1)[NH-].[Hg+2]	{36: 2, 14: 10}
Did not match all atoms present	73928-12-8	CC[Hg+].CC[Hg]C1=NC(=NS1)[S-]	{1: 2, 2: 2, 35: 2, 41: 1}
Did not match all atoms present	73928-18-4	CC[Pb](CC)(CC)OC(=O)C1=CC=CO1	{1: 3, 2: 3, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	73928-21-9	CC[Pb](CC)(CC)OC(=O)CC1=CC=CC=C1	{1: 3, 2: 4, 28: 1, 14: 5}
Did not match all atoms present	7393-43-3	C=CC[Sn](CC=C)(CC=C)CC=C	{2: 4, 5: 4, 6: 4}
Did not match all atoms present	73931-44-9	COC1=CC(=CC(=C1Br)Br)Br	{1: 1, 18: 3, 22: 1, 14: 2}
Did not match all atoms present	73936-86-4	CC(C)(C)CC(C)(C)C1=C/C(=N\NC2=CC=CC=C2[N+](=O)[O-])/C(=O)C(=C1)C(C)(C)C3=CC=CC=C3	{1: 7, 2: 1, 4: 3, 38: 1, 34: 1, 14: 11, 15: 3, 25: 1, 31: 1}
Did not match all atoms present	73940-79-1	CC(=O)NC1=CC=CC=C1C(=O)O[Hg].[OH-].[Na+]	{24: 1, 1: 1, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	73940-85-9	CC[Sn](CC)(OS(=O)(=O)CC12CC[C@H](C1(C)C)CC2=O)OS(=O)(=O)CC34CC[C@H](C3(C)C)CC4=O	{1: 6, 2: 4, 11: 6, 12: 2, 13: 4, 22: 2, 25: 2, 29: 4}
Did not match all atoms present	73940-86-0	C[Sn](C)(C)OC#N	{1: 3, 37: 1, 22: 1}
Did not match all atoms present	73940-87-1	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)C#CC(=O)O[Sn](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{10: 2, 28: 2, 14: 30}
Did not match all atoms present	73940-88-2	CCCC[Sn](CCCC)(CCCC)OC(=O)C1=CC=C(C=C1)I	{1: 3, 2: 9, 19: 1, 28: 1, 14: 4}
Did not match all atoms present	73940-89-3	CCCC[Sn](CCCC)(CCCC)OC(=O)C(C)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 4, 2: 9, 3: 1, 14: 2, 17: 3, 22: 1, 28: 1}
Did not match all atoms present	73940-90-6	C1=CC=C(C=C1)N(C=O)[Hg]Cl	{17: 1, 26: 1, 14: 5, 33: 1}
Did not match all atoms present	73941-33-0	COC(=O)C1=CN=CN1CC2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 33: 1, 14: 7, 28: 1}
Did not match all atoms present	73941-35-2	C1(NC(=C([N-]1)Br)Br)Br.C1(NC(=C([N-]1)Br)Br)Br.[Cd+2]	{32: 2, 18: 6, 35: 2, 12: 2, 15: 4}
Did not match all atoms present	73943-41-6	COC1=C(C(=CC=C1)F)O	{16: 1, 1: 1, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	73944-13-5	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)N=NC5=CC(=C(C=C5N)N)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)N=NC6=CC(=C(C=C6N)N)S(=O)(=O)O	{34: 7, 14: 14, 15: 2, 20: 4, 25: 1, 29: 8, 30: 5, 31: 1}
Did not match all atoms present	73948-18-2	CCCCCC1=CC=C(C=C1)S(=O)(=O)Cl	{1: 1, 2: 4, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	73953-53-4	NN.F[Sn](F)F	{16: 3, 30: 2}
Did not match all atoms present	73953-80-7	CN(C)C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 2, 33: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	7396-38-5	CC1=CC(=C2C(=C1)C=CC3=CC(=CC(=C32)C)C)C	{1: 4, 14: 6}
Did not match all atoms present	7396-89-6	COC1=CC(=C(C=C1)C(=O)C2=CC(=CC=C2)C(F)(F)F)O	{1: 1, 4: 1, 14: 7, 16: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	7396-90-9	COC1=CC(=C(C=C1)C(=O)C2=CC=C(C=C2)C(F)(F)F)O	{1: 1, 4: 1, 14: 7, 16: 3, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	7396-92-1	C1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2O)Cl)Cl	{24: 1, 17: 2, 21: 1, 14: 7}
Did not match all atoms present	73960-07-3	C1=CC(=CC=C1C=O)OC(F)F	{16: 2, 26: 1, 3: 1, 22: 1, 14: 4}
Did not match all atoms present	73963-72-1	C1CCC(CC1)N2C(=NN=N2)CCCCOC3=CC4=C(C=C3)NC(=O)CC4	{32: 1, 33: 1, 2: 4, 35: 3, 11: 7, 12: 1, 14: 3, 22: 1, 25: 1}
Did not match all atoms present	73968-62-4	C1C=C(O[C@@H]1COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O	{2: 1, 4: 1, 11: 1, 12: 1, 14: 16, 15: 1, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	7397-06-0	CC1=C(C=C(C=C1)C(C)(C)C)C	{1: 5, 4: 1, 14: 3}
Did not match all atoms present	7397-43-5	B(OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C	{1: 9, 4: 3, 22: 3}
Did not match all atoms present	7397-44-6	B(NC)(NC)NC	{1: 3, 31: 3}
Did not match all atoms present	7397-46-8	B(CC)(CC)OC	{1: 3, 2: 2, 22: 1}
Did not match all atoms present	73972-54-0	C1=CC(=CC(=C1)F)CSC2=NC=NC3=C2NC=N3	{32: 1, 2: 1, 35: 3, 40: 1, 14: 6, 16: 1}
Did not match all atoms present	73972-56-2	C1=NC2=C(N1)C(=NC=N2)OCC(F)(F)F	{32: 1, 2: 1, 35: 3, 4: 1, 14: 2, 16: 3, 22: 1}
Did not match all atoms present	73973-02-1	CC(C)CCCCCOP(=S)(OCCCCCC(C)C)S[As]1C2=CC=CC=C2NC3=CC=CC=C31	{32: 1, 1: 4, 2: 10, 3: 2, 40: 1, 14: 8, 22: 2}
Did not match all atoms present	7398-69-8	C[N+](C)(CC=C)CC=C.[Cl-]	{1: 2, 2: 2, 5: 2, 6: 2, 17: 1}
Did not match all atoms present	73986-52-4	CCCCCCCCC1=CC(=C(C(=C1)Cl)O)Cl	{1: 1, 2: 7, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	73986-95-5	C1=CC(=C(C=C1Cl)Cl)OC(CO)O	{2: 1, 3: 1, 14: 3, 17: 2, 20: 2, 22: 1}
Did not match all atoms present	73987-52-7	CCOC(=O)OC12CC[C@@H]([C@]1([C@@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)O[C@@H]5C[C@@H]([C@@H]([C@H](O5)C)O[C@@H]6C[C@@H]([C@@H]([C@H](O6)C)O)O)O[C@@H]7C[C@@H]([C@@H]([C@H](O7)C)O)O)C)O)C)C8=CC(=O)OC8	{1: 6, 2: 1, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 5, 22: 3, 23: 3, 28: 1}
Did not match all atoms present	7399-00-0	CCCCCCCCCCCCCCCCCC[Si](OCC)(OCC)OCC	{1: 4, 2: 20, 22: 3}
Did not match all atoms present	7399-02-2	CCCCCCCCCOC(=O)CS[Sn](CCCC)(CCCC)SCC(=O)OCCCCCCCCC	{40: 2, 1: 4, 2: 24, 28: 2}
Did not match all atoms present	7399-50-0	CCC(CC)C1=CC=CC=N1	{1: 2, 2: 2, 3: 1, 14: 4, 35: 1}
Did not match all atoms present	74-11-3	C1=CC(=CC=C1C(=O)O)Cl	{17: 1, 27: 1, 14: 4}
Did not match all atoms present	74-31-7	C1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=CC=CC=C3	{14: 14, 31: 2}
Did not match all atoms present	74-39-5	C1=CC(=CC=C1NN=C2C=CC(=O)C=C2O)[N+](=O)[O-]	{34: 1, 38: 1, 14: 7, 15: 2, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	74-60-2	CC(C)OP(=S)(OC1=CC=C(C=C1)S(=O)C)OC(C)C	{1: 5, 3: 2, 22: 3, 14: 4, 29: 1}
Did not match all atoms present	74-81-7	C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC5=C(C4=C3)C=C(C=C5)O	{21: 1, 14: 13}
Did not match all atoms present	74-82-8	C	{}
Did not match all atoms present	7400-08-0	C1=CC(=CC=C1/C=C/C(=O)O)O	{27: 1, 14: 4, 6: 2, 21: 1}
Did not match all atoms present	74008-12-1	CC(=O)N(/C=C/C1=[N+](CCS1)C)C2=CC=CC=C2.[I-]	{1: 2, 6: 2, 33: 2, 41: 1, 11: 2, 14: 5, 15: 1, 19: 1, 24: 1}
Did not match all atoms present	74010-34-7	C#CC1=CC2=CC=CC=C2C1	{9: 1, 10: 1, 11: 1, 14: 5, 15: 1}
Did not match all atoms present	74011-58-8	CCN1C=C(C(=O)C2=CC(=C(N=C21)N3CCNCC3)F)C(=O)O	{32: 1, 1: 1, 2: 1, 35: 1, 33: 2, 11: 4, 14: 2, 16: 1, 25: 1, 27: 1}
Did not match all atoms present	7402-29-1	CCCC(=O)OCCCC1=CC=CC=C1	{1: 1, 2: 5, 28: 1, 14: 5}
Did not match all atoms present	7402-70-2	CC(=O)NC1=CC=CC=C1C(C)(C)C	{24: 1, 1: 4, 4: 1, 14: 4, 31: 1}
Did not match all atoms present	74035-70-4	CCCC[Sn](CCCC)(SP(=S)(CC)CC)SP(=S)(CC)CC	{40: 2, 1: 6, 2: 10}
Did not match all atoms present	74037-50-6	CCOC1=C(N=CC=C1)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 14: 3, 22: 1}
Did not match all atoms present	74037-60-8	CCCCOCN(COCCCC)C1=NC(=NC(=N1)N(CO)CO)N(COCCCC)COCCCC	{1: 4, 2: 18, 35: 3, 33: 3, 20: 2, 22: 4}
Did not match all atoms present	74038-45-2	CCOP(=O)(C(C1=CC=C(C=C1)OC)O[Sb](OCC(C)Cl)OCC(C)Cl)OCC	{1: 5, 2: 4, 3: 3, 14: 4, 17: 2, 22: 6, 29: 1}
Did not match all atoms present	74038-53-2	CCCCCCS(=O)(=O)NC1=CC=C(C=C1)[NH2+]C2=C3C=CC=CC3=NC4=CC=CC=C42.[Cl-]	{1: 1, 2: 5, 35: 1, 14: 12, 17: 1, 29: 2, 31: 1}
Did not match all atoms present	74039-01-3	C1=CC(=CC=C1C2=CC=C(C=C2)N3N=C4C=CC5=C(C=C(C=C5C4=N3)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[K+].[K+]	{33: 1, 30: 1, 35: 2, 29: 6, 14: 12}
Did not match all atoms present	74039-02-4	C1=CC(=CC=C1C2=CC(=C(C=C2)N)S(=O)(=O)[O-])N3N=C4C=CC5=C(C=C(C=C5C4=N3)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+].[K+]	{33: 1, 30: 1, 35: 2, 29: 9, 14: 11}
Did not match all atoms present	74039-78-4	C1=CC(=CC=C1P(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)Cl.C1=CC(=CC=C1P(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)Cl.[Cl-].[Cl-].[Hg+2]	{17: 8, 14: 24}
Did not match all atoms present	74039-79-5	CN(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C.CN(C)C1=CC=C(C=C1)P(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C.[Cl-].[Cl-].[Hg+2]	{1: 12, 33: 6, 14: 24, 17: 2}
Did not match all atoms present	74039-80-8	COC1=CC=C(C=C1)P(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC.COC1=CC=C(C=C1)P(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC.[Cl-].[Cl-].[Hg+2]	{1: 6, 22: 6, 14: 24, 17: 2}
Did not match all atoms present	74039-81-9	CSC1=CC=C(C=C1)P(C2=CC=C(C=C2)SC)C3=CC=C(C=C3)SC.CSC1=CC=C(C=C1)P(C2=CC=C(C=C2)SC)C3=CC=C(C=C3)SC.[Cl-].[Cl-].[Hg+2]	{40: 6, 1: 6, 14: 24, 17: 2}
Did not match all atoms present	74050-97-8	CCCCCCCCCC(=O)OC1(CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)Cl	{1: 1, 2: 11, 33: 1, 11: 4, 13: 1, 14: 8, 16: 1, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	74051-85-7	CCCCCCCC/C=C/CCCCCCCC1=NCCN1CCOCCC(=O)[O-].[K+]	{1: 1, 2: 18, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 22: 1, 24: 1}
Did not match all atoms present	74051-90-4	N.O=P(Cl)(Cl)Cl	{17: 3, 29: 1}
Did not match all atoms present	74058-71-2	CCCCCCCCCCCCCCCC(=O)NCC1=CC=CC=C1	{24: 1, 1: 1, 2: 15, 14: 5, 31: 1}
Did not match all atoms present	74070-00-1	C1=CSC2=C[Se]C=C21	{41: 1, 14: 4}
Did not match all atoms present	74070-46-5	C1=CC=C(C=C1)OC2=C(C(=C(C=C2)[N+](=O)[O-])N)Cl	{17: 1, 30: 1, 38: 1, 22: 1, 14: 7}
Did not match all atoms present	74077-58-0	CC[N+](CC)(CC)CC.CC#N.CC#N.Cl[Ru-](Cl)(Cl)Cl	{1: 6, 2: 4, 37: 2, 17: 4}
Did not match all atoms present	74082-17-0	C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)N3N(O3)C4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O	{33: 2, 34: 2, 38: 1, 6: 2, 14: 14, 20: 3, 23: 1, 29: 6}
Did not match all atoms present	74082-18-1	COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)OC)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6)NC(=O)C7=CC=C(C=C7)N)S(=O)(=O)O	{1: 2, 34: 5, 14: 18, 15: 2, 20: 4, 22: 2, 24: 1, 25: 1, 29: 8, 30: 1, 31: 2}
Did not match all atoms present	74082-19-2	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)O)N=NC3C=NN(C3=O)C4=CC(=C(C=C4Cl)S(=O)(=O)O)Cl	{33: 1, 34: 2, 35: 1, 12: 1, 14: 9, 17: 2, 20: 2, 25: 1, 29: 4}
Did not match all atoms present	74082-21-6	C1=CC=C(C=C1)C2=C/C(=N/NC3=CC=C(C=C3)CCOS(=O)(=O)O)/C(=O)C=C2	{2: 2, 34: 1, 14: 12, 15: 2, 20: 1, 22: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	74082-22-7	CN(C)C(=O)C1=CC2=C(C=C1)[C@@H]([C@@H](C2=O)C3=NC4=CC=CC=C4C=C3)O	{1: 2, 35: 1, 33: 1, 12: 2, 14: 9, 20: 1, 24: 1, 25: 1}
Did not match all atoms present	74082-23-8	COC1=C(C=CC(=C1)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O)NC(=O)NC4=C(C=C(C=C4)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)O)S(=O)(=O)O)OC	{1: 2, 34: 4, 14: 16, 20: 4, 22: 2, 24: 1, 29: 8, 31: 2}
Did not match all atoms present	74082-24-9	C1=CC(=CC=C1N2N=C3C=CC4=C(C=C(C=C4C3=N2)S(=O)(=O)O)S(=O)(=O)O)N5N(O5)C6=CC(=C(C=C6)/C=C/C7=C(C=C(C=C7)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O	{33: 3, 35: 2, 38: 1, 6: 2, 14: 14, 20: 4, 23: 1, 29: 8}
Did not match all atoms present	74098-41-2	C1=CC2=C(C=C1C3=C2C(=C4C(=C3/C=C/C5=C6C(=C(C7=C5C8=CC(=C7C=C8)S(=O)(=O)O)N9N=C1C=CC2=C(C=C(C=C2C1=N9)S(=O)(=O)O)S(=O)(=O)O)N1N6O1)N1N4O1)N1N=C2C=CC3=C(C=C(C=C3C2=N1)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{33: 6, 35: 4, 6: 2, 14: 14, 20: 6, 23: 2, 29: 12}
Did not match all atoms present	741-58-2	CC(C)OP(=S)(OC(C)C)SCCNS(=O)(=O)C1=CC=CC=C1	{1: 4, 2: 2, 3: 2, 40: 1, 14: 5, 22: 2, 29: 2, 31: 1}
Did not match all atoms present	7411-49-6	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N.Cl.Cl.Cl.Cl	{17: 4, 30: 4, 14: 6}
Did not match all atoms present	74111-27-6	CN(CC1C2CCC(C2)C1O)CC3=CC=CC=C3	{1: 1, 2: 2, 33: 1, 11: 3, 12: 4, 14: 5, 20: 1}
Did not match all atoms present	74115-12-1	C1=C(C=NC=C1Cl)O	{17: 1, 35: 1, 21: 1, 14: 3}
Did not match all atoms present	74115-24-5	C1=CC=C(C(=C1)C2=NN=C(N=N2)C3=CC=CC=C3Cl)Cl	{17: 2, 35: 4, 14: 8}
Did not match all atoms present	74124-79-1	C1CC(=O)N(C1=O)OC(=O)ON2C(=O)CCC2=O	{25: 4, 11: 4, 33: 2}
Did not match all atoms present	74129-20-7	C[Si](C)(CCC1=CC=CC=C1CC[Si](C)(C)Cl)Cl	{1: 4, 2: 4, 14: 4, 17: 2}
Did not match all atoms present	7413-34-5	CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-].[Na+].[Na+]	{1: 1, 2: 3, 3: 1, 33: 1, 14: 5, 35: 4, 24: 3, 30: 2, 31: 1}
Did not match all atoms present	7413-36-7	CC(C)NCC(C1=CC=C(C=C1)[N+](=O)[O-])O	{1: 2, 2: 1, 3: 2, 38: 1, 14: 4, 20: 1, 31: 1}
Did not match all atoms present	74137-64-7	CC(C)[C@@]1(C(=O)N2[C@@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C.CS(=O)(=O)O	{32: 1, 1: 4, 2: 1, 3: 1, 33: 3, 11: 5, 12: 4, 13: 2, 14: 10, 15: 1, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	74137-65-8	CC(C)[C@@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O.CS(=O)(=O)O	{32: 1, 1: 6, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	74137-66-9	CC(C)C[C@@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O.CS(=O)(=O)O	{32: 1, 1: 6, 2: 1, 3: 2, 33: 3, 11: 5, 12: 4, 13: 2, 14: 5, 15: 1, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	74137-68-1	C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C.CS(=O)(=O)O	{32: 1, 1: 3, 2: 1, 33: 3, 11: 5, 12: 4, 13: 2, 14: 10, 15: 1, 20: 2, 23: 1, 24: 1, 25: 2, 29: 2, 31: 1}
Did not match all atoms present	74139-77-8	CC(=CC1C(C1(C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C.CC(=CC1C(C1(C)C)C(=O)OCN2C(=O)C3=C(C2=O)CCCC3)C	{1: 8, 2: 2, 33: 1, 6: 2, 7: 2, 11: 4, 12: 4, 13: 2, 14: 9, 15: 2, 22: 1, 25: 2, 28: 2}
Did not match all atoms present	7414-83-7	CC(O)(P(=O)(O)[O-])P(=O)(O)[O-].[Na+].[Na+]	{1: 1, 4: 1, 29: 4, 20: 3}
Did not match all atoms present	74143-30-9	[Po+3]	{}
Did not match all atoms present	7415-86-3	C1=CC=C(C(=C1)C(=O)OCC(CBr)Br)C(=O)OCC(CBr)Br	{2: 4, 3: 2, 28: 2, 18: 4, 14: 4}
Did not match all atoms present	74150-27-9	CC1CC(=O)NN=C1C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)OC	{32: 2, 1: 2, 35: 2, 11: 1, 12: 1, 14: 7, 15: 1, 22: 1, 25: 1}
Did not match all atoms present	74153-51-8	C[N+](C)(CCOC(=O)C=C)CC1=CC=CC=C1.C=CC(=O)N.[Cl-]	{1: 2, 2: 3, 5: 2, 6: 2, 14: 5, 17: 1, 24: 1, 28: 1, 30: 1}
Did not match all atoms present	7416-34-4	CCC1=C(NC2=C1C(=O)C(CC2)CN3CCOCC3)C	{32: 1, 1: 2, 2: 2, 33: 1, 11: 6, 12: 1, 23: 1, 25: 1}
Did not match all atoms present	74163-81-8	C1[C@H](NCC2=CC=CC=C21)C(=O)O	{27: 1, 32: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	7417-18-7	COC1=CC=CC=C1CCO	{1: 1, 2: 2, 20: 1, 22: 1, 14: 4}
Did not match all atoms present	7417-19-8	COC1=CC(=C(C=C1)OC)CCO	{1: 2, 2: 2, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	7417-21-2	COC1=C(C=C(C=C1)CCO)OC	{1: 2, 2: 2, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	7417-99-4	C1CN1C(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)NC(=O)N4CC4	{33: 2, 2: 1, 11: 4, 14: 8, 24: 2, 31: 2}
Did not match all atoms present	7418-19-1	C[Si]1(CC[Si](N1)(C)C)C	{32: 1, 1: 4, 11: 2}
Did not match all atoms present	7418-20-4	C[Si]1(CC[Si](O1)(C)C)C	{1: 4, 11: 2, 23: 1}
Did not match all atoms present	7418-65-7	C1=CN=CC(=C1N)C(=O)O	{35: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	74186-12-2	CCC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=C(C=C(C=C4)Cl)C)/C2=O	{1: 2, 2: 1, 34: 1, 14: 12, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	74186-13-3	CCCCCCCCOCCN(CC)C1=CC=CC=C1	{1: 2, 2: 10, 22: 1, 14: 5, 33: 1}
Did not match all atoms present	74186-14-4	CCCCOCCN(CC)C1=CC=CC=C1	{1: 2, 2: 6, 22: 1, 14: 5, 33: 1}
Did not match all atoms present	74186-15-5	CCCNC1=C(C2=CC=CC=C2C=C1)N=NC3=CC=C(C=C3)N=NC4=CC=CC=C4	{1: 1, 2: 2, 34: 4, 14: 15, 31: 1}
Did not match all atoms present	74186-16-6	CCN(CCO)C1=CC=C(C=C1)N=NC2=[N+](C3=C(S2)C=C(C=C3)OC)C.[O-]S(=O)(=O)[O-]	{1: 3, 2: 3, 33: 2, 41: 1, 34: 2, 14: 7, 20: 1, 22: 1, 29: 4}
Did not match all atoms present	7419-60-5	[CH2]C1=CC=CC2=CC=CC=C12	{5: 1, 14: 7}
Did not match all atoms present	74195-73-6	C1CCC2=C(C1)C=CC=C2NC3=NCCN3.O.Cl	{32: 1, 35: 1, 11: 6, 14: 3, 15: 1, 17: 1, 31: 1}
Did not match all atoms present	74196-12-6	C1=CC(=CC2=C(C(=C(C=C21)S(=O)(=O)[O-])N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-])NC4=C(C(=NC(=N4)F)F)Cl.C1=CC(=CC2=C(C(=C(C=C21)S(=O)(=O)[O-])N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-])NC4=C(C(=NC(=N4)F)F)Cl.[Na+].[K+].[K+].[K+].[K+].[Co+3]	{34: 4, 35: 4, 38: 2, 14: 12, 16: 4, 17: 2, 29: 12, 31: 2}
Did not match all atoms present	742-20-1	C1CCC(C1)CC2NC3=CC(=C(C=C3S(=O)(=O)N2)S(=O)(=O)N)Cl	{32: 2, 2: 1, 11: 4, 12: 2, 14: 2, 17: 1, 29: 4, 30: 1}
Did not match all atoms present	74203-39-7	C1C2CC3CC1CC(C2)(C3)C#CC4=CC=CC=C4	{10: 2, 11: 6, 12: 3, 13: 1, 14: 5}
Did not match all atoms present	74203-45-5	CC(C)CCCCCCCOP(=O)([O-])[O-].[Ni+2]	{1: 2, 2: 7, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	74203-58-0	C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4CC(=O)N(C4)C5=CC=CC=C5.Cl	{33: 3, 2: 1, 11: 7, 12: 1, 14: 8, 17: 1, 23: 2, 24: 1, 25: 1}
Did not match all atoms present	74203-59-1	CN1CCN(CC1)C(=O)C2CC(=O)N(C2)C3=CC=CC=C3.Cl	{1: 1, 33: 3, 11: 6, 12: 1, 14: 5, 17: 1, 24: 1, 25: 1}
Did not match all atoms present	74203-61-5	CC(=O)COC1=CC=C(C=C1)[As](=O)(O)[O-].[Na+]	{1: 1, 2: 1, 14: 4, 20: 1, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	74204-00-5	CC1=CC(=CC(=C1)Br)O	{1: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	74205-51-9	CCOC1=CC=CC=C1CC#N	{1: 1, 2: 2, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	74209-34-0	C1=CC2=C(NN=C2C(=C1)[N+](=O)[O-])Br	{32: 1, 18: 1, 35: 1, 38: 1, 14: 3}
Did not match all atoms present	7421-40-1	C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC(=O)CCC(=O)[O-])C)(C)C(=O)[O-].[Na+].[Na+]	{1: 7, 2: 2, 11: 9, 12: 4, 13: 6, 14: 1, 15: 1, 24: 2, 25: 1, 28: 1}
Did not match all atoms present	74213-25-5	C(#[N+][O-])Br	{18: 1, 34: 1, 29: 1}
Did not match all atoms present	74219-20-8	C[C@@]12CC[C@@H](C1(C)C)C[C@@H]2OC=O	{1: 3, 26: 1, 11: 3, 12: 2, 13: 2}
Did not match all atoms present	7422-52-8	C[Si](C)(C)O[Si](C)(CCCOCC1CO1)O[Si](C)(C)C	{1: 7, 2: 4, 11: 1, 12: 1, 22: 3, 23: 1}
Did not match all atoms present	7422-73-3	CN(C)P(=[Se])(N(C)C)N(C)C	{1: 6, 33: 3}
Did not match all atoms present	74222-97-2	CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C	{1: 3, 35: 2, 14: 5, 24: 1, 28: 1, 29: 2, 31: 2}
Did not match all atoms present	74223-64-6	CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC	{1: 3, 35: 3, 14: 4, 22: 1, 24: 1, 28: 1, 29: 2, 31: 2}
Did not match all atoms present	74227-35-3	C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)SC4=CC=C(C=C4)[S+](C5=CC=CC=C5)C6=CC=CC=C6.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F	{16: 12, 40: 1, 14: 28}
Did not match all atoms present	74230-03-8	CCCCCCCCCC1=CC=C(C=C1)[O-].CCCCCCCCCC1=CC=C(C=C1)[O-].[Zn+2]	{1: 2, 2: 16, 14: 8}
Did not match all atoms present	7424-00-2	C1=CC(=CC=C1CC(C(=O)O)N)Cl	{2: 1, 3: 1, 14: 4, 17: 1, 27: 1, 30: 1}
Did not match all atoms present	74240-65-6	CCCCC1COC(OC1)C2=CC=C(C=C2)C#N	{1: 1, 2: 3, 37: 1, 11: 2, 12: 2, 14: 4, 23: 2}
Did not match all atoms present	74240-66-7	CCCCCC1COC(OC1)C2=CC=C(C=C2)C#N	{1: 1, 2: 4, 37: 1, 11: 2, 12: 2, 14: 4, 23: 2}
Did not match all atoms present	7425-80-1	CC(C)C[O-].CC(C)C[O-].CC(C)C[O-].CC(C)C[O-].[Ti+4]	{1: 8, 2: 4, 3: 4, 29: 4}
Did not match all atoms present	7425-81-2	COC1=C(C=C(C=C1)S(=O)(=O)CCO)N	{1: 1, 2: 2, 14: 3, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	74252-25-8	CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)[O-].O.O.O.[Na+]	{1: 2, 2: 1, 33: 1, 14: 7, 17: 1, 22: 1, 24: 2}
Did not match all atoms present	74257-00-4	CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C=NC(=N2)[N+](=O)[O-])C	{1: 3, 35: 2, 38: 1, 33: 1, 14: 3, 29: 2}
Did not match all atoms present	7426-75-7	C1COC(=N1)C2=CC=C(C=C2)C3=NCCO3	{23: 2, 35: 2, 11: 4, 14: 4, 15: 2}
Did not match all atoms present	74273-75-9	C1=C(N=C(C=N1)N=[N+]=[N-])N=[N+]=[N-]	{34: 4, 35: 2, 14: 2}
Did not match all atoms present	74278-22-1	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.CN(C)C(=O)SSC(=O)N(C)C.C(CCCCC(=O)[O-])CCCC(=O)[O-].[O-][Cr](=O)(=O)[O-].[Cl-].[K+].[K+].[Cd+2]	{1: 8, 2: 8, 33: 4, 7: 1, 40: 2, 14: 13, 15: 2, 17: 1, 24: 4, 29: 4}
Did not match all atoms present	74286-11-6	C[C@@H]([C-]1C=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3)OC.[CH-]1C=CC=C1.[Fe+2]	{1: 2, 3: 1, 22: 1, 14: 18}
Did not match all atoms present	7429-90-5	[Al]	{}
Did not match all atoms present	7429-91-6	[Dy]	{}
Did not match all atoms present	7429-92-7	[Es]	{}
Did not match all atoms present	74298-66-1	CC1=C(C=C(C=C1)C(=O)CCCCl)C	{24: 1, 1: 2, 2: 3, 14: 3, 17: 1}
Did not match all atoms present	743-45-3	C=CCC1C(=O)N(C(=O)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3	{33: 2, 2: 1, 5: 1, 6: 1, 12: 1, 14: 10, 25: 3}
Did not match all atoms present	74309-53-8	C=C(C1=CC=CC=C1F)C2=CC=CC=N2	{16: 1, 35: 1, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	74309-55-0	C=C(C1=CC=CC=C1Cl)C2=CC=CC=N2	{17: 1, 35: 1, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	74309-56-1	C=C(C1=CC=CC=C1Br)C2=CC=CC=N2	{18: 1, 35: 1, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	74309-57-2	C=C(C1=CC=CC=C1I)C2=CC=CC=N2	{35: 1, 19: 1, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	74309-58-3	C=C(C1=CC=CC=C1)C2=CN=CC=C2	{35: 1, 5: 1, 14: 9, 7: 1}
Did not match all atoms present	7431-35-8	C1=CC=C(C=C1)/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C#N	{37: 1, 38: 1, 14: 9, 6: 1, 7: 1}
Did not match all atoms present	74317-37-6	C1=CC=C(C=C1)C(=O)C2=CC(=C3C2=CC=CC=C3)C(=O)C4=CC=CC=C4	{24: 2, 14: 16}
Did not match all atoms present	74317-46-7	CC1=C2C3=CC=CC=C3NC2=CC(=N1)N=O	{32: 1, 1: 1, 34: 1, 35: 1, 14: 5, 29: 1}
Did not match all atoms present	7432-21-5	C1=CC=C(C=C1)COC(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O	{32: 1, 2: 2, 3: 1, 14: 10, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	7432-27-1	CCN(CC)CCOC1=C(C=C(C=C1)Cl)C(=O)NC2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 14: 8, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	7432-28-2	CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3CC1(C)O)OC)OC)OC)OC)OC)OC	{1: 8, 11: 2, 12: 1, 13: 1, 14: 2, 20: 1, 22: 6}
Did not match all atoms present	7433-79-6	CSC1=CC2=CC=CC=C2C=C1	{40: 1, 1: 1, 14: 7}
Did not match all atoms present	74340-04-8	C1=CC=C2C(=C1)C=C3C4=C(C=C5C3=C2C6=CC=CC=C65)[C@@H]([C@H](C=C4)O)O	{20: 2, 12: 2, 14: 12}
Did not match all atoms present	7435-50-9	CC1=CC(=C2C=C(C(=CC2=C1)C)C)C	{1: 4, 14: 4}
Did not match all atoms present	7435-83-8	CC1=CC(=C(C(=C1C)CCl)C)C	{1: 4, 2: 1, 14: 1, 17: 1}
Did not match all atoms present	74356-00-6	CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@](C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)[O-])S4)OC)SC2)C(=O)[O-].[Na+].[Na+]	{1: 2, 2: 1, 35: 3, 33: 2, 7: 1, 40: 1, 41: 3, 11: 1, 12: 2, 13: 1, 15: 3, 22: 1, 24: 4, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	74358-83-1	C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC(=CC(=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[Cr+3]	{34: 2, 38: 1, 29: 3, 14: 8}
Did not match all atoms present	7436-07-9	C1CC2=C(C1)C=C(C=C2)[N+](=O)[O-]	{11: 3, 38: 1, 14: 3}
Did not match all atoms present	7436-62-6	C1=CC=C(C=C1)CSC[C@@H](C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N	{2: 2, 3: 1, 38: 1, 40: 1, 14: 9, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	74367-22-9	CCCCCCCCCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 13, 28: 1}
Did not match all atoms present	74367-36-5	CCCCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 20, 28: 1}
Did not match all atoms present	74367-37-6	CCCCCCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C	{1: 4, 2: 22, 28: 1}
Did not match all atoms present	74367-78-5	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])CCl	{17: 1, 2: 1, 38: 2, 14: 3}
Did not match all atoms present	7437-53-8	CCN(CC)CC[NH2+]C(C1=CC=CC=C1)C(=O)OCCC(C)C.[Cl-]	{1: 4, 2: 6, 3: 2, 33: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	74370-93-7	CC(C)(C)C1=CSC(=N1)N	{1: 3, 35: 1, 4: 1, 41: 1, 14: 1, 30: 1}
Did not match all atoms present	74378-81-7	CC1=C(SS1)C	{1: 2, 41: 2}
Did not match all atoms present	7438-18-8	[B-](F)(F)(F)F.COC1=CC(=C(C=C1)[N+]#N)OC	{16: 4, 1: 2, 34: 1, 22: 2, 14: 3}
Did not match all atoms present	74381-53-6	CCNC(=O)C1CCCN1C(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CO)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C(CC5=CN=CN5)NC(=O)C6CCC(=O)N6.CC(=O)O	{32: 3, 1: 6, 2: 10, 3: 9, 33: 1, 7: 1, 11: 5, 12: 2, 34: 1, 14: 11, 35: 1, 20: 1, 21: 1, 24: 9, 25: 1, 27: 1, 30: 2, 31: 8}
Did not match all atoms present	7439-10-3	CC1=CC=C(C=C1)SC(C)(C)C	{40: 1, 1: 4, 4: 1, 14: 4}
Did not match all atoms present	7439-15-8	CCc1ccc(CCc2ccccc2)cc1	{1: 1, 2: 3, 14: 9}
Did not match all atoms present	7439-88-5	[Ir]	{}
Did not match all atoms present	7439-89-6	[Fe]	{}
Did not match all atoms present	7439-90-9	[Kr]	{}
Did not match all atoms present	7439-91-0	[La]	{}
Did not match all atoms present	7439-92-1	[Pb]	{}
Did not match all atoms present	7439-93-2	[Li]	{}
Did not match all atoms present	7439-94-3	[Lu]	{}
Did not match all atoms present	7439-95-4	[Mg]	{}
Did not match all atoms present	7439-96-5	[Mn]	{}
Did not match all atoms present	7439-97-6	[Hg]	{}
Did not match all atoms present	7439-98-7	[Mo]	{}
Did not match all atoms present	7439-99-8	[Np]	{}
Did not match all atoms present	74395-26-9	C1CN=C(N1)NC2=C(C(=C(C(=C2F)F)F)F)F	{32: 1, 35: 1, 11: 2, 15: 1, 16: 5, 31: 1}
Did not match all atoms present	74398-46-2	C1C(OC2=CC=CC=C2O1)CNCCCO	{2: 4, 11: 1, 12: 1, 14: 4, 20: 1, 23: 2, 31: 1}
Did not match all atoms present	74398-68-8	CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)NC3=CC(=C(C=C3)NC(=O)C4=CC=C(C=C4)N=NC5C(=NN(C5=O)C6=CC=C(C=C6)S(=O)(=O)[O-])C)S(=O)(=O)[O-])C7=CC=C(C=C7)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 35: 2, 33: 2, 12: 2, 14: 19, 15: 2, 24: 2, 25: 2, 29: 9, 31: 2}
Did not match all atoms present	74398-73-5	C1=CC2=C(C=C1Cl)C(=O)C3=C4C2=CC5=C6C4=C(C=C3)C=C7C6=C(C=C5)C(=O)C8=C7C=CC(=C8Br)Cl	{17: 2, 18: 1, 14: 11, 25: 2}
Did not match all atoms present	74398-74-6	CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2N/N=C\3/C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 33: 1, 34: 1, 14: 13, 15: 2, 25: 1, 29: 5, 30: 1, 31: 1}
Did not match all atoms present	74398-78-0	C1=CC(=C(C=C1N=NC2=C(C=CC3=C(C=C(C=C32)S(=O)(=O)[O-])S(=O)(=O)[O-])N)S(=O)(=O)[O-])/C=C/C4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{34: 2, 6: 2, 38: 1, 14: 10, 29: 12, 30: 1}
Did not match all atoms present	74398-79-1	C1=CC(=CC(=C1)Cl)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)[O-])NNC3=C4C(=CC(=CC4=O)S(=O)(=O)[O-])C=CC3=N.[Na+].[Na+]	{36: 1, 14: 11, 15: 5, 17: 1, 24: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	74398-80-4	C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)[N+]#N)S(=O)(=O)O.[Cl-]	{34: 1, 14: 8, 17: 1, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	744-45-6	C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)C(=O)OC3=CC=CC=C3	{28: 2, 14: 14}
Did not match all atoms present	744-80-9	CCC1(C(=O)NC(=O)N(C1=O)C(=O)C2=CC=CC=C2)C3=CC=CC=C3	{32: 1, 1: 1, 2: 1, 33: 1, 13: 1, 14: 10, 24: 1, 25: 3}
Did not match all atoms present	7440-00-8	[Nd]	{}
Did not match all atoms present	7440-01-9	[Ne]	{}
Did not match all atoms present	7440-02-0	[Ni]	{}
Did not match all atoms present	7440-03-1	[Nb]	{}
Did not match all atoms present	7440-04-2	[Os]	{}
Did not match all atoms present	7440-05-3	[Pd]	{}
Did not match all atoms present	7440-06-4	[Pt]	{}
Did not match all atoms present	7440-07-5	[Pu]	{}
Did not match all atoms present	7440-08-6	[Po]	{}
Did not match all atoms present	7440-09-7	[K]	{}
Did not match all atoms present	7440-10-0	[Pr]	{}
Did not match all atoms present	7440-11-1	[Md]	{}
Did not match all atoms present	7440-12-2	[Pm]	{}
Did not match all atoms present	7440-13-3	[Pa]	{}
Did not match all atoms present	7440-14-4	[Ra]	{}
Did not match all atoms present	7440-15-5	[Re]	{}
Did not match all atoms present	7440-16-6	[Rh]	{}
Did not match all atoms present	7440-17-7	[Rb]	{}
Did not match all atoms present	7440-18-8	[Ru]	{}
Did not match all atoms present	7440-19-9	[Sm]	{}
Did not match all atoms present	7440-20-2	[Sc]	{}
Did not match all atoms present	7440-21-3	[Si]	{}
Did not match all atoms present	7440-22-4	[Ag]	{}
Did not match all atoms present	7440-23-5	[Na]	{}
Did not match all atoms present	7440-24-6	[Sr]	{}
Did not match all atoms present	7440-25-7	[Ta]	{}
Did not match all atoms present	7440-26-8	[Tc]	{}
Did not match all atoms present	7440-27-9	[Tb]	{}
Did not match all atoms present	7440-28-0	[Tl]	{}
Did not match all atoms present	7440-29-1	[Th]	{}
Did not match all atoms present	7440-30-4	[Tm]	{}
Did not match all atoms present	7440-31-5	[Sn]	{}
Did not match all atoms present	7440-32-6	[Ti]	{}
Did not match all atoms present	7440-33-7	[W]	{}
Did not match all atoms present	7440-34-8	[Ac]	{}
Did not match all atoms present	7440-35-9	[Am]	{}
Did not match all atoms present	7440-36-0	[Sb]	{}
Did not match all atoms present	7440-37-1	[Ar]	{}
Did not match all atoms present	7440-38-2	[As]	{}
Did not match all atoms present	7440-39-3	[Ba]	{}
Did not match all atoms present	7440-40-6	[Bk]	{}
Did not match all atoms present	7440-41-7	[Be]	{}
Did not match all atoms present	7440-42-8	[B]	{}
Did not match all atoms present	7440-43-9	[Cd]	{}
Did not match all atoms present	7440-44-0	[C]	{}
Did not match all atoms present	7440-45-1	[Ce]	{}
Did not match all atoms present	7440-46-2	[Cs]	{}
Did not match all atoms present	7440-47-3	[Cr]	{}
Did not match all atoms present	7440-48-4	[Co]	{}
Did not match all atoms present	7440-50-8	[Cu]	{}
Did not match all atoms present	7440-51-9	[Cm]	{}
Did not match all atoms present	7440-52-0	[Er]	{}
Did not match all atoms present	7440-53-1	[Eu]	{}
Did not match all atoms present	7440-54-2	[Gd]	{}
Did not match all atoms present	7440-55-3	[Ga]	{}
Did not match all atoms present	7440-56-4	[Ge]	{}
Did not match all atoms present	7440-57-5	[Au]	{}
Did not match all atoms present	7440-58-6	[Hf]	{}
Did not match all atoms present	7440-59-7	[He]	{}
Did not match all atoms present	7440-60-0	[Ho]	{}
Did not match all atoms present	7440-61-1	[U]	{}
Did not match all atoms present	7440-62-2	[V]	{}
Did not match all atoms present	7440-63-3	[Xe]	{}
Did not match all atoms present	7440-64-4	[Yb]	{}
Did not match all atoms present	7440-65-5	[Y]	{}
Did not match all atoms present	7440-66-6	[Zn]	{}
Did not match all atoms present	7440-67-7	[Zr]	{}
Did not match all atoms present	7440-68-8	[At]	{}
Did not match all atoms present	7440-69-9	[Bi]	{}
Did not match all atoms present	7440-70-2	[Ca]	{}
Did not match all atoms present	7440-71-3	[Cf]	{}
Did not match all atoms present	7440-72-4	[Fm]	{}
Did not match all atoms present	7440-73-5	[Fr]	{}
Did not match all atoms present	7440-74-6	[In]	{}
Did not match all atoms present	7440-78-0	C(C(COP(=O)(O)O)(COP(=O)(O)O)COP(=O)(O)O)OP(=O)(O)O	{20: 8, 2: 4, 4: 1, 29: 4, 22: 4}
Did not match all atoms present	7440-84-8	CCC(=CC1=[N+](C2=C(S1)C=CC(=C2)Cl)CCC(=O)[O-])C=C3N(C4=C(S3)C=CC(=C4)Cl)CCC(=O)O	{1: 1, 2: 5, 33: 2, 6: 2, 7: 1, 41: 2, 14: 6, 15: 1, 17: 2, 24: 1, 27: 1}
Did not match all atoms present	74410-87-0	C1C2C13CC3C4=CC=CC=C24	{11: 2, 12: 2, 13: 1, 14: 4}
Did not match all atoms present	74411-34-0	C1=CC(=CC=C1C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)N)S(=O)(=O)[O-])N.[K+]	{24: 2, 30: 2, 29: 3, 14: 11, 31: 2}
Did not match all atoms present	74418-40-9	C(#N)C1=NNN=N1	{32: 1, 35: 3, 37: 1}
Did not match all atoms present	7442-07-1	C1=CC2=C(C=C1N)SC(=S)N2	{32: 1, 41: 1, 30: 1, 14: 3}
Did not match all atoms present	7443-25-6	COC1=CC=C(C=C1)C=C(C(=O)OC)C(=O)OC	{1: 3, 6: 1, 7: 1, 14: 4, 22: 1, 28: 2}
Did not match all atoms present	74431-25-7	C[C@@H]1CC[C@@H](C[C@H]1OC(=O)CC2=CC=CC=C2)C(=C)C	{1: 2, 2: 1, 5: 1, 7: 1, 11: 3, 12: 3, 14: 5, 28: 1}
Did not match all atoms present	74440-45-2	[2H]C([2H])([2H])C(C)C([2H])([2H])[2H]	{1: 3, 3: 1}
Did not match all atoms present	74444-58-9	C1CC2=C([C@H]([C@@H]1O)O)C3=CC=CC=C3C4=CC=CC=C24	{20: 2, 11: 2, 12: 2, 14: 8}
Did not match all atoms present	74444-59-0	C1CC2=C(C3C1O3)C4=CC=CC=C4C5=CC=CC=C25	{11: 2, 12: 2, 14: 8, 23: 1}
Did not match all atoms present	7445-60-5	C(=C(C(F)(F)F)C(F)(F)F)=S	{8: 1, 16: 6, 4: 2, 7: 1}
Did not match all atoms present	74457-86-6	CC(=O)C1=C(C=C(C=C1)OC)F	{16: 1, 1: 2, 22: 1, 14: 3, 24: 1}
Did not match all atoms present	7446-08-4	O=[Se]=O	{29: 2}
Did not match all atoms present	7446-11-9	O=S(=O)=O	{29: 3}
Did not match all atoms present	7446-14-2	[O-]S(=O)(=O)[O-].[Pb+2]	{29: 4}
Did not match all atoms present	7446-15-3	[O-][Se](=O)(=O)[O-].[Pb+2]	{29: 4}
Did not match all atoms present	7446-17-5	[O-][Se](=O)(=O)[O-].[Rb+].[Rb+]	{29: 4}
Did not match all atoms present	7446-18-6	[O-]S(=O)(=O)[O-].[Tl+].[Tl+]	{29: 4}
Did not match all atoms present	7446-19-7	O.[O-]S(=O)(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	7446-20-0	O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	7446-21-1	[O-][Se](=O)(=O)[O-].[Sr+2]	{29: 4}
Did not match all atoms present	7446-22-2	[O-][Se](=O)(=O)[O-].[Tl+].[Tl+]	{29: 4}
Did not match all atoms present	7446-26-6	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Zn+2].[Zn+2]	{29: 6, 22: 1}
Did not match all atoms present	7446-28-8	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Sr+2].[Sr+2].[Sr+2]	{29: 8}
Did not match all atoms present	7446-31-3	O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Zr+4]	{29: 8}
Did not match all atoms present	7446-32-4	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Sb+3].[Sb+3]	{29: 12}
Did not match all atoms present	7446-33-5	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Y+3].[Y+3]	{29: 12}
Did not match all atoms present	7446-34-6	S=[Se]	{}
Did not match all atoms present	7446-70-0	[Al+3].[Cl-].[Cl-].[Cl-]	{17: 3}
Did not match all atoms present	7446-81-3	C=CC(=O)[O-].[Na+]	{24: 1, 5: 1, 6: 1}
Did not match all atoms present	7446-94-8	CC[CH-]C.CC[CH-]C.[Zn+2]	{1: 4, 2: 2, 6: 2}
Did not match all atoms present	74465-36-4	C1=CC2=C3C(=C1)[C@@H]4[C@@H](O4)C5=C3C(=CC6=C5[C@@H]([C@H](C=C6)O)O)C=C2	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	74465-39-7	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2[C@H]([C@H]([C@H]5[C@H]4O5)O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	74469-00-4	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)C(=O)O)C.C1[C@@H]2N(C1=O)[C@H](/C(=C/CO)/O2)C(=O)[O-].[K+]	{1: 2, 2: 1, 3: 1, 6: 1, 33: 2, 41: 1, 11: 1, 12: 5, 13: 1, 14: 4, 15: 1, 20: 1, 21: 1, 23: 1, 24: 2, 25: 2, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	7447-39-4	Cl[Cu]Cl	{17: 2}
Did not match all atoms present	7447-40-7	[Cl-].[K+]	{17: 1}
Did not match all atoms present	7447-41-8	[Li+].[Cl-]	{17: 1}
Did not match all atoms present	7447-44-1	CC(C)(CSP(=O)(O)O)N	{1: 2, 2: 1, 4: 1, 40: 1, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	74472-37-0	C1=CC(=CC=C1C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 5, 14: 5}
Did not match all atoms present	74478-95-8	CCOC(=O)C1=C(N=CN1)[N+](=O)[O-]	{32: 1, 1: 1, 2: 1, 35: 1, 38: 1, 14: 1, 28: 1}
Did not match all atoms present	7448-86-4	COC1=CC=C(C=C1)C(=O)C=C	{1: 1, 5: 1, 6: 1, 14: 4, 22: 1, 24: 1}
Did not match all atoms present	74483-17-3	C[Si](C)(C)C(=PCl)C1=CC=CC=C1	{1: 3, 17: 1, 14: 5, 7: 1}
Did not match all atoms present	74486-33-2	CCCCCCCCCC1=CC=CC=C1O.CC1=CC=CC=C1O.C=O.C1=CC=C(C=C1)O	{1: 2, 2: 8, 5: 1, 14: 13, 21: 3}
Did not match all atoms present	7449-74-3	CC(=O)N(C)[Si](C)(C)C	{24: 1, 1: 5, 33: 1}
Did not match all atoms present	74499-35-7	C=CC1=CC(=C(C(=C1C=C)O)C=C)C=C	{14: 1, 5: 4, 6: 4, 21: 1}
Did not match all atoms present	74499-56-2	CC(=O)NC1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 1, 14: 7, 15: 2, 24: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	74499-63-1	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC)[O-])[O-])C3=CC=C(C=C3)Cl.CC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)NC)[O-].[Na+].[Co+3]	{1: 4, 34: 4, 35: 1, 33: 1, 14: 15, 17: 1, 24: 1, 29: 4, 31: 3}
Did not match all atoms present	74499-64-2	CC(=O)NC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)OC)N=NC3=CC(=CC=C3)S(=O)(=O)[O-].[Na+]	{1: 2, 34: 4, 14: 11, 22: 1, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	74499-65-3	CCN(CC[N+]1=CC=CC(=C1)C)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl.[Cl-]	{1: 2, 2: 3, 38: 1, 33: 2, 34: 2, 14: 10, 17: 3}
Did not match all atoms present	74499-67-5	C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC4=CC=C(C=C4)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6)N)S(=O)(=O)[O-].C(CO)NCCO.C(CO)N(CCO)CCO.[Na+].[Na+].[Na+]	{33: 1, 2: 10, 34: 4, 14: 15, 15: 4, 20: 5, 25: 2, 29: 9, 30: 2, 31: 3}
Did not match all atoms present	74499-74-4	CC(C)(CO)CO.C1=CC=C2C(=C1)C(=O)OC2=O.C(CCCO)CCO	{1: 2, 2: 8, 4: 1, 14: 4, 20: 4, 28: 2}
Did not match all atoms present	74499-75-5	C=O.C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O.C1(=NC(=NC(=N1)N)N)N	{2: 2, 35: 3, 5: 1, 3: 4, 20: 6, 30: 3}
Did not match all atoms present	745-23-3	C(F)(F)(F)P1P(P(P(P1C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 15, 4: 5}
Did not match all atoms present	7450-03-5	CC1=CC=CC=C1[Si](C)(C)C	{1: 4, 14: 4}
Did not match all atoms present	7450-69-3	C1=CC=C(C=C1)OP(=O)(N)N	{30: 2, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	7450-97-7	C1COC(OC1)CCN2CCN(CC2)CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)C(F)(F)F.C(CC(=O)O)C(=O)O.C(CC(=O)O)C(=O)O	{33: 3, 2: 9, 4: 1, 41: 1, 11: 7, 12: 1, 14: 7, 16: 3, 23: 2, 27: 4}
Did not match all atoms present	74507-60-1	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[V+2]	{1: 10}
Did not match all atoms present	74507-61-2	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Cr+2]	{1: 10, 13: 2, 15: 6}
Did not match all atoms present	74507-62-3	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Co+2]	{1: 10, 13: 2, 15: 6}
Did not match all atoms present	74507-63-4	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Ni+2]	{1: 10, 13: 2, 15: 6}
Did not match all atoms present	74507-64-5	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Mg+2]	{1: 10}
Did not match all atoms present	7451-76-5	C1=C(NC=N1)CC(C(=O)O)NC(=O)CNC(=O)CN	{32: 1, 2: 3, 3: 1, 14: 2, 35: 1, 24: 2, 27: 1, 30: 1, 31: 2}
Did not match all atoms present	74512-24-6	CCCCCCCCCCCCCCCCCCCC(C)(C)N.CCCCCCCCCCCCCCCCCCCC(C)(C)N.C(P(=O)(O)O)Cl	{1: 6, 2: 37, 4: 2, 17: 1, 20: 2, 29: 1, 30: 2}
Did not match all atoms present	74512-62-2	CC(C)C1=C(N(N(C1=O)C2=CC=CC=C2)C)CNC(=O)C3=CC=CC=C3CC(=O)O	{1: 3, 2: 2, 3: 1, 33: 2, 14: 9, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	74518-94-8	C1=CC(=CC=C1C=CC2=CC=C(C=C2)[N+](=O)[O-])C#N	{38: 1, 14: 8, 6: 2, 37: 1}
Did not match all atoms present	74518-95-9	CC(C)(C)C1(CC=C(C=C1)/C=C/C2=CC=CC=C2)[N+](=O)[O-]	{1: 3, 4: 1, 38: 1, 6: 2, 11: 1, 13: 1, 14: 8, 15: 1}
Did not match all atoms present	7452-51-9	CCN(CC)C1=CC=C(C=C1)C(=C2C=C(C(=O)C(=C2)C(=O)O)C)C3=CC(=C(C(=C3)C)O)C(=O)O	{1: 4, 2: 2, 33: 1, 7: 1, 14: 8, 15: 3, 21: 1, 25: 1, 27: 2}
Did not match all atoms present	7452-52-0	CCN(CC)C1=CC(=C(C=C1)C(=C2C=C(C(=O)C(=C2)C(=O)O)C)C3=CC(=C(C(=C3)C)O)C(=O)O)Cl	{1: 4, 2: 2, 33: 1, 7: 1, 14: 7, 15: 3, 17: 1, 21: 1, 25: 1, 27: 2}
Did not match all atoms present	7454-52-6	C1=CC(=CC=C1S(=O)(=O)NC2=CC(=C(C=C2)Cl)Cl)Cl	{17: 3, 29: 2, 14: 7, 31: 1}
Did not match all atoms present	74542-82-8	CC(=C=C)[Si](C)(C)C	{8: 1, 1: 4, 5: 1, 7: 1}
Did not match all atoms present	74548-80-4	CC(=O)OC(C(Cl)(Cl)Cl)P(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 3: 1, 4: 1, 14: 10, 17: 3, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	7456-24-8	CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)S(=O)(=O)N(C)C)N(C)C	{1: 5, 2: 1, 3: 1, 33: 3, 41: 1, 14: 7, 29: 2}
Did not match all atoms present	7456-87-3	COC(=O)O	{1: 1, 27: 1}
Did not match all atoms present	74568-07-3	C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=CC=CC(=C4O)CC5=CC=CC1=C5O)O)O	{11: 4, 21: 4, 14: 12}
Did not match all atoms present	74578-05-5	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N)S(=O)(=O)[O-].[Na+]	{1: 1, 35: 1, 41: 1, 14: 6, 29: 3, 30: 1}
Did not match all atoms present	74578-06-6	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N)S(=O)(=O)[O-].[K+]	{1: 1, 35: 1, 41: 1, 14: 6, 29: 3, 30: 1}
Did not match all atoms present	74578-07-7	[Li+].CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N)S(=O)(=O)[O-]	{1: 1, 35: 1, 41: 1, 14: 6, 29: 3, 30: 1}
Did not match all atoms present	74578-09-9	CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3O2.CS(=O)(=O)[O-]	{1: 5, 2: 4, 35: 1, 33: 2, 14: 6, 23: 1, 29: 3}
Did not match all atoms present	74578-10-2	CC1=CC(=CC(=C1C(=N)N)C)C(=C2C=C(C(=N)C(=C2)C)C)C3=C(C=CC=C3Cl)Cl.O[P+](=O)O	{1: 4, 36: 2, 7: 2, 14: 7, 15: 4, 17: 2, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	74578-12-4	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)S(=O)(=O)[O-])Cl)C3=CC=C(C=C3)Cl.CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)S(=O)(=O)[O-])Cl)C3=CC=C(C=C3)Cl.[K+].[K+]	{1: 2, 34: 4, 35: 2, 33: 2, 12: 2, 14: 14, 15: 2, 17: 4, 25: 2, 29: 6}
Did not match all atoms present	74578-13-5	CC[N+](CC)(CC=C)CC=C.CN(C)CNC(=O)C=C.C[N+](C)(CC=C)CC=C.[Cl-].[Cl-]	{1: 6, 2: 7, 5: 5, 6: 5, 33: 1, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	74578-38-4	C1CC(OC1)N2C=C(C(=O)NC2=O)F.C1=CNC(=O)NC1=O	{32: 3, 33: 1, 11: 3, 12: 1, 14: 3, 16: 1, 23: 1, 25: 4}
Did not match all atoms present	7458-65-3	CC(C[NH2+]C)CN1CCCCCC2=CC=CC=C21.[Cl-]	{1: 2, 2: 2, 3: 1, 33: 1, 11: 5, 14: 4, 17: 1}
Did not match all atoms present	7459-41-8	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Ce+4]	{24: 4, 1: 4, 2: 64}
Did not match all atoms present	7459-95-2	C1=CC=C(C(=C1)C(=O)O)N.Cl.Cl	{17: 2, 27: 1, 30: 1, 14: 4}
Did not match all atoms present	74592-97-5	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)S(=O)(=O)[O-])Cl)C3=CC=C(C=C3)Cl.[K+]	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 7, 15: 1, 17: 2, 25: 1, 29: 3}
Did not match all atoms present	746-47-4	C1=CC=C2C(=C1)C3=CC=CC=C3C2=C4C5=CC=CC=C5C6=CC=CC=C64	{14: 16, 15: 2}
Did not match all atoms present	746-53-2	C1=C(C=C2C(=C1[N+](=O)[O-])C3=C(C=C(C=C3C2=O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{25: 1, 38: 4, 14: 4}
Did not match all atoms present	7460-12-0	C[C@@H]([C@H](C1=CC=CC=C1)O)NC.OS(=O)(=O)O	{1: 2, 3: 2, 14: 5, 20: 3, 29: 2, 31: 1}
Did not match all atoms present	7460-19-7	CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)[O-])C4=N3)C(=O)[O-])C.[K+].[K+]	{32: 2, 1: 5, 2: 3, 35: 2, 5: 1, 6: 1, 12: 3, 14: 3, 24: 2, 25: 1}
Did not match all atoms present	7461-00-9	C1=CN=C(N=C1)NNC=O	{26: 1, 35: 2, 14: 3, 31: 2}
Did not match all atoms present	7461-26-9	CCCCCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 5, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	7461-60-1	COC1=CC=CC(=C1OC)/C=C/C(=O)O	{1: 2, 22: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	7461-79-2	C1=CC=C(C=C1)CN(C=O)C2=C(N=CN=C2SCC3=CC=CC=C3)N	{33: 1, 2: 2, 35: 2, 40: 1, 14: 11, 26: 1, 30: 1}
Did not match all atoms present	7461-80-5	CN(C)C1=NC(=O)C2=C(N1)N(C=N2)CC3=CC=CC=C3	{32: 1, 1: 2, 2: 1, 35: 2, 33: 2, 14: 6, 25: 1}
Did not match all atoms present	7461-93-0	CC(C)C(=O)NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 3: 1, 38: 2, 14: 3, 24: 1, 31: 2}
Did not match all atoms present	74612-30-9	C[Si](C)(CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cl	{16: 17, 1: 2, 2: 2, 4: 8, 17: 1}
Did not match all atoms present	74620-20-5	CC1=CC(=C(C=C1NC(=O)C(C(=O)C)N=NC2=C(C=C(C=C2)Cl)Cl)C)NC(=O)C(C(=O)C)N=NC3=C(C=C(C=C3)Cl)Cl	{1: 4, 34: 4, 3: 2, 14: 8, 17: 4, 24: 4, 31: 2}
Did not match all atoms present	74626-63-4	CCP(C#N)C1=CC=CC=C1	{1: 1, 2: 1, 37: 1, 14: 5}
Did not match all atoms present	74627-31-9	CN1CCN(CC1)C(=O)C(C[C@@H]2CC3[C@@H](CC4=CNC5=CC=CC3=C45)N(C2)C)C#N	{32: 1, 1: 2, 2: 1, 3: 1, 37: 1, 33: 3, 11: 7, 12: 3, 14: 4, 24: 1}
Did not match all atoms present	74627-37-5	C=CCN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CC(C#N)C(=O)N	{32: 1, 33: 1, 2: 2, 3: 1, 5: 1, 6: 1, 11: 3, 12: 3, 14: 4, 24: 1, 30: 1, 37: 1}
Did not match all atoms present	74627-38-6	CN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CC(C#N)C(=O)N5CCCC5	{32: 1, 1: 1, 2: 1, 3: 1, 37: 1, 33: 2, 11: 7, 12: 3, 14: 4, 24: 1}
Did not match all atoms present	74627-39-7	CN1C[C@@H](CC2[C@H]1CC3=CN(C4=CC=CC2=C34)C)CC(C#N)C(=O)N	{1: 2, 2: 1, 3: 1, 37: 1, 33: 2, 11: 3, 12: 3, 14: 4, 24: 1, 30: 1}
Did not match all atoms present	74627-56-8	CN1C[C@@H](CC2[C@H]1CC3=C(NC4=CC=CC2=C34)Cl)CC(C#N)C(=O)N	{32: 1, 1: 1, 2: 1, 3: 1, 37: 1, 33: 1, 11: 3, 12: 3, 14: 3, 17: 1, 24: 1, 30: 1}
Did not match all atoms present	7463-22-1	CN(C)S(=O)(=O)C1=CC=C(C=C1)Cl	{1: 2, 33: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	7463-31-2	CC(=O)C1=CC(=CC=C1)NC(=O)C	{24: 2, 1: 2, 14: 4, 31: 1}
Did not match all atoms present	7463-51-6	CC1=CC(=CC(=C1Br)C)O	{1: 2, 18: 1, 21: 1, 14: 2}
Did not match all atoms present	74630-99-2	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[V]	{24: 5, 1: 10, 2: 20, 3: 5}
Did not match all atoms present	74632-45-4	C1=CC=C(C=C1)N=NC2C(C(C(C(C2(F)F)(F)F)([N+](=O)[O-])[N+](=O)[O-])(F)F)(F)F	{34: 2, 38: 2, 12: 1, 13: 5, 14: 5, 16: 8}
Did not match all atoms present	7465-06-7	CCCN1C2=C(C(=O)N(C(=O)N2C)C)NC1=S	{32: 1, 1: 3, 2: 2, 33: 3, 25: 2}
Did not match all atoms present	7465-58-9	C1=CC2=C3C(=C1)C=CC(=O)C3=C(C=C2)O	{25: 1, 21: 1, 14: 7}
Did not match all atoms present	7465-89-6	COC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2Cl	{1: 1, 28: 1, 22: 1, 14: 8, 17: 1}
Did not match all atoms present	7466-38-8	CCOC1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 1, 2: 1, 34: 2, 22: 1, 14: 9}
Did not match all atoms present	7466-54-8	COC1=CC=CC=C1C(=O)NN	{1: 1, 14: 4, 22: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	74665-04-6	C1=CC(=CC=C1N)N=NC2=CC=C(C=C2)S(=O)(=O)[O-].C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)/C=C/C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O.C(=N)(N)N.[Na+]	{34: 2, 36: 1, 38: 2, 6: 2, 7: 1, 14: 14, 20: 2, 29: 7, 30: 3}
Did not match all atoms present	7467-29-0	CC1=CC=CC=C1N=NC2=C(C=C(C(=C2)C)N)N	{1: 2, 34: 2, 30: 2, 14: 6}
Did not match all atoms present	7468-67-9	C1=CC=C(C(=C1)C=O)C#N	{26: 1, 37: 1, 14: 4}
Did not match all atoms present	74681-68-8	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)S(=O)(=O)N.Cl.Cl.Cl	{32: 2, 1: 1, 35: 2, 33: 2, 11: 4, 14: 10, 17: 3, 29: 2, 30: 1}
Did not match all atoms present	74685-00-0	CC(=O)CO[Si](C)(C)C(C)(C)C	{24: 1, 1: 6, 2: 1, 4: 1, 22: 1}
Did not match all atoms present	74685-92-0	CC1=CC(=NNC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)C(=C1)NN=C4C(=CC5=C(C4=O)C=CC(=C5)NC6=CC7=C(C=C6)C(=O)C(=NN=C8C=C(C(=CC8=O)NNC9=CC(=C1C=CC=C(C1=C9)S(=O)(=O)[O-])S(=O)(=O)[O-])C)C(=C7)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{1: 2, 34: 4, 14: 22, 15: 10, 25: 4, 29: 18, 31: 5}
Did not match all atoms present	7469-40-1	C1CC2=CC=CC=C2C(=C1)C3=CC=CC=C3	{11: 2, 14: 10, 15: 1}
Did not match all atoms present	7469-83-2	COC1=CC=C(C=C1)C2(CCCCC2)C(=O)O	{1: 1, 11: 5, 13: 1, 14: 4, 22: 1, 27: 1}
Did not match all atoms present	74696-96-1	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C	{1: 3, 2: 2, 33: 1, 14: 4, 24: 1, 28: 1}
Did not match all atoms present	747-45-5	COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.OS(=O)(=O)O	{1: 1, 3: 1, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 5, 35: 1, 20: 3, 22: 1, 29: 2}
Did not match all atoms present	74701-47-6	CCC1=NC(=CC=C1)C(C)C	{1: 3, 2: 1, 3: 1, 14: 3, 35: 1}
Did not match all atoms present	7471-63-8	CC1=C(C2=C(C=CC=N2)C=C1)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	7472-43-7	C1=CC=C(C=C1)C(=O)CCCCCC(=O)O	{24: 1, 2: 5, 27: 1, 14: 5}
Did not match all atoms present	7472-54-0	COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9, 31: 1}
Did not match all atoms present	74720-33-5	C1=CC=C(C=C1)/C=C/2\NC(=O)/C(=C/C3=CC=CC=C3)/NC2=O	{32: 2, 25: 2, 14: 10, 6: 2}
Did not match all atoms present	7473-98-5	CC(C)(C(=O)C1=CC=CC=C1)O	{24: 1, 1: 2, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	7473-99-6	CC(C)(C(=O)C1=CC=CC=C1)Cl	{24: 1, 1: 2, 4: 1, 14: 5, 17: 1}
Did not match all atoms present	74732-00-6	C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CCCl	{17: 1, 2: 2, 33: 1, 14: 6, 25: 2}
Did not match all atoms present	747348-22-7	[Co+9].[Co+9].[NH-]CC[N-]CC[N-]CC[NH-].[NH-]CC[N-]CC[N-]CC[NH-].[NH-]CC[N-]CC[N-]CC[NH-]	{2: 18, 36: 6, 34: 6}
Did not match all atoms present	747350-06-7	[O].[O].[O].[O].[Ru-3]	{}
Did not match all atoms present	74738-17-3	C1=CC(=C(C(=C1)Cl)Cl)C2=CNC=C2C#N	{32: 1, 17: 2, 37: 1, 14: 5}
Did not match all atoms present	74738-52-6	C=C[C]=N	{36: 1, 5: 1, 6: 1}
Did not match all atoms present	7474-78-4	C1=CC(=C(C=C1S(=O)(=O)O)N)N	{30: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	7474-83-1	C1=CC=C2C(=C1)C=C(C(=O)C2=O)Br	{25: 2, 18: 1, 14: 5, 15: 1}
Did not match all atoms present	7475-39-0	CCOC(=O)C(=C1C=C(C(=O)C2=CC=CC=C21)O)C(=O)OCC	{1: 2, 2: 2, 7: 1, 14: 5, 15: 2, 20: 1, 25: 1, 28: 2}
Did not match all atoms present	7475-94-7	CC1=CC2=CC=CC=C2C=C1C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 3, 21: 1, 14: 8}
Did not match all atoms present	74758-13-7	CC(=O)N(CC[NH+](C)C)N1C=C(C2=CC=CC=C21)C3=CC=CC=C3.[Cl-]	{1: 3, 2: 2, 33: 2, 14: 10, 17: 1, 24: 1}
Did not match all atoms present	74758-19-3	C[NH+](C)CCN(CC[NH+](C)C)N1C=C(C2=CC=CC=C21)C3=CC=CC=C3.[Cl-].[Cl-]	{1: 4, 2: 4, 33: 2, 14: 10, 17: 2}
Did not match all atoms present	7476-02-0	CC1=C2C=CC=CC2=CC3=CC=CC=C13.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 3, 21: 1, 14: 11}
Did not match all atoms present	7476-08-6	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)C#N	{37: 1, 14: 11}
Did not match all atoms present	7476-66-6	COC(=O)C(C1=CC=CC=C1)Cl	{1: 1, 3: 1, 28: 1, 14: 5, 17: 1}
Did not match all atoms present	7476-80-4	CCCC(=O)OC1=CC=CC(=C1)C	{1: 2, 2: 2, 28: 1, 14: 4}
Did not match all atoms present	7476-91-7	C1=CC=C(C=C1)CCOC(=O)CCl	{17: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	74764-40-2	CC(C)COCC(CN(CC1=CC=CC=C1)C2=CC=CC=C2)N3CCCC3.Cl	{1: 2, 2: 4, 3: 2, 33: 2, 11: 4, 14: 10, 17: 1, 22: 1}
Did not match all atoms present	74764-93-5	CC1=CC2=C(C=C1)N(C=C2C3=CC=CC=C3)N(C)CC[NH+](C)C.[Cl-]	{1: 4, 2: 2, 33: 2, 14: 9, 17: 1}
Did not match all atoms present	7477-73-8	C1=CC=C(C=C1)C2=NN=NN2C3=CC=CC=C3	{33: 1, 35: 3, 14: 10}
Did not match all atoms present	74772-16-0	COC(=O)C1=C(C=CS1)N2C=CC=C2	{1: 1, 28: 1, 41: 1, 14: 6, 33: 1}
Did not match all atoms present	7478-69-5	CN(C)C1=CC=C(C=C1)C(=C)C2=CC=C(C=C2)N(C)C	{1: 4, 33: 2, 5: 1, 14: 8, 7: 1}
Did not match all atoms present	74785-85-6	CCCC[Sn](CCCC)(CCCC)OP(=O)(O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 2: 9, 29: 1, 22: 3}
Did not match all atoms present	74789-25-6	CCOC(=O)CSCSP(=O)(C)OCC	{1: 3, 2: 4, 40: 2, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	7479-05-2	CCOC(=O)[C@H](CC1=CNC2=CC=CC=C21)N	{32: 1, 1: 1, 2: 2, 3: 1, 14: 5, 28: 1, 30: 1}
Did not match all atoms present	748-30-1	C1=CC=C(C=C1)OC2=CC(=CC=C2)OC3=CC=CC(=C3)OC4=CC=CC=C4	{22: 3, 14: 18}
Did not match all atoms present	7480-35-5	C1C(C(C2=CC=CC=C21)N)O	{20: 1, 11: 1, 12: 2, 30: 1, 14: 4}
Did not match all atoms present	7481-49-4	CC1=CC(=C(C=C1)N/N=C\2/C3=C(C=C(C=C3)S(=O)(=O)O)C=C(C2=O)S(=O)(=O)O)C	{1: 2, 34: 1, 14: 7, 15: 2, 20: 2, 25: 1, 29: 4, 31: 1}
Did not match all atoms present	7481-89-2	C1C[C@@H](O[C@@H]1CO)N2C=CC(=NC2=O)N	{33: 1, 2: 1, 35: 1, 11: 2, 12: 2, 14: 2, 20: 1, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	74816-28-7	CC[NH+](CC)CC(=O)NC1=CC=C(C=C1)Cl.[Cl-]	{1: 2, 2: 3, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	74816-32-3	CC[NH+](CC)CC(=O)N(C)C1=CC=C(C=C1)Cl.[Cl-]	{1: 3, 2: 3, 33: 1, 14: 4, 17: 2, 24: 1}
Did not match all atoms present	7483-25-2	CCCCOC(=O)C1=CC=CC=C1C(=O)OCCOCCOC(=O)C2=CC=CC=C2C(=O)OCCCC	{1: 2, 2: 10, 28: 4, 22: 1, 14: 8}
Did not match all atoms present	74839-84-2	CCCC(P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4	{1: 1, 2: 2, 3: 1, 14: 20}
Did not match all atoms present	74847-35-1	COC1=CC=C2C(=C(C3=C(N2)C=C(C=C3)Cl)N=C4C=C(C(=O)C(=C4)CN5CCCC5)CN6CCCC6)N1	{32: 2, 1: 1, 2: 2, 33: 2, 11: 8, 34: 1, 14: 7, 15: 7, 17: 1, 22: 1, 25: 1}
Did not match all atoms present	74853-66-0	C1=CC(=CC=C1C(=O)C(F)(F)F)C(F)(F)F	{16: 6, 24: 1, 4: 2, 14: 4}
Did not match all atoms present	7486-26-2	[O-]Br=O.[Na+]	{18: 1, 29: 2}
Did not match all atoms present	7486-35-3	CCCC[Sn](CCCC)(CCCC)C=C	{1: 3, 2: 9, 5: 1, 6: 1}
Did not match all atoms present	74861-59-9	[B]C(=O)[O-].[NH4+]	{24: 1}
Did not match all atoms present	7487-15-2	COC(=O)C1=CC=C(C2=CC=CC=C21)C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	7487-88-9	[O-]S(=O)(=O)[O-].[Mg+2]	{29: 4}
Did not match all atoms present	7487-94-7	Cl[Hg]Cl	{17: 2}
Did not match all atoms present	7488-51-9	[O-][Se](=O)[O-].[Pb+2]	{29: 3}
Did not match all atoms present	7488-52-0	O.O.[O-]S(=O)[O-].[Zn+2]	{29: 3}
Did not match all atoms present	7488-54-2	[O-]S(=O)(=O)[O-].[Rb+].[Rb+]	{29: 4}
Did not match all atoms present	7488-55-3	[O-]S(=O)(=O)[O-].[Sn+2]	{29: 4}
Did not match all atoms present	7488-56-4	S=[Se]=S	{}
Did not match all atoms present	74886-24-1	CC/C(=C(/CC)\C1=CC=C(C=C1)OC)/CC2=CC=C(C=C2)OC	{1: 4, 2: 3, 22: 2, 14: 8, 7: 2}
Did not match all atoms present	749-02-0	C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CCCC(=O)C4=CC=C(C=C4)F	{32: 1, 33: 2, 2: 3, 11: 5, 13: 1, 14: 9, 16: 1, 24: 1, 25: 1}
Did not match all atoms present	749-13-3	C1CN(CCC1(C2=CC(=CC=C2)C(F)(F)F)O)CCCC(=O)C3=CC=C(C=C3)F	{33: 1, 2: 3, 4: 1, 11: 4, 13: 1, 14: 8, 16: 4, 20: 1, 24: 1}
Did not match all atoms present	7491-20-5	CCCCCCCCCCCC[NH3+].CC(C(=O)[O-])O	{24: 1, 1: 2, 2: 11, 3: 1, 20: 1}
Did not match all atoms present	74910-62-6	CCCCC.[Fe]	{1: 2, 2: 3}
Did not match all atoms present	74910-63-7	CCC(C)CC.[Fe]	{1: 3, 2: 2, 3: 1}
Did not match all atoms present	74910-64-8	CCC(C)C(C)[CH2-].CCC(C)C(C)[CH2-].[Fe+2]	{1: 6, 2: 2, 3: 4, 5: 2}
Did not match all atoms present	74912-20-2	[Si](I)(I)I	{19: 3}
Did not match all atoms present	74918-40-4	C1=CC2=C(C(=C1)Cl)OC3=C2C=CC(=C3)Cl	{17: 2, 14: 6, 23: 1}
Did not match all atoms present	7492-29-7	CN1C(=O)CN2CCC3=CC=CC=C3C2C4=C1C=CC(=C4)Cl	{1: 1, 33: 2, 11: 3, 12: 1, 14: 7, 17: 1, 25: 1}
Did not match all atoms present	7492-37-7	CCCC(=O)C(CC)CC1=CC=CC=C1	{24: 1, 1: 2, 2: 4, 3: 1, 14: 5}
Did not match all atoms present	7492-41-3	CC1(C2CCC1(C(C2)OC=O)C)C	{1: 3, 26: 1, 11: 3, 12: 2, 13: 2}
Did not match all atoms present	7492-44-6	CCCCC(=CC1=CC=CC=C1)C=O	{1: 1, 2: 3, 6: 1, 7: 1, 14: 5, 26: 1}
Did not match all atoms present	7492-55-9	C/C=C/C=C/C(=O)[O-].C/C=C/C=C/C(=O)[O-].[Ca+2]	{24: 2, 1: 2, 6: 8}
Did not match all atoms present	7492-65-1	C1=CC=C(C=C1)CC(=O)OC/C=C/C2=CC=CC=C2	{2: 2, 28: 1, 14: 10, 6: 2}
Did not match all atoms present	74920-98-2	CC([CH2-])CC(C)[CH2-].[Fe+2]	{1: 2, 2: 1, 3: 2, 5: 2}
Did not match all atoms present	74925-48-7	C1C(C(C2=CC=CC=C21)Cl)Cl	{17: 2, 11: 1, 12: 2, 14: 4}
Did not match all atoms present	74926-97-9	CCC(C)C1=CC=CC(=C1O)C(C)C	{1: 4, 2: 1, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	74926-98-0	CCCC(C)C1=CC=CC(=C1O)C(C)C	{1: 4, 2: 2, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	74927-02-9	CCCC(C)C1=C(C(=CC=C1)C(C)CCC)O	{1: 4, 2: 4, 3: 2, 21: 1, 14: 3}
Did not match all atoms present	74927-72-3	C1=CC=C(C=C1)[C@H](C(=O)O)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]	{3: 1, 38: 2, 14: 8, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	7493-57-4	CCCOC(C)OCCC1=CC=CC=C1	{1: 2, 2: 4, 3: 1, 22: 2, 14: 5}
Did not match all atoms present	7493-63-2	C=CCOC(=O)C1=CC=CC=C1N	{2: 1, 5: 1, 6: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	7493-74-5	C=CCOC(=O)COC1=CC=CC=C1	{2: 2, 5: 1, 6: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	74930-79-3	[B](Cl)Br	{17: 1, 18: 1}
Did not match all atoms present	74930-80-6	[B](F)Br	{16: 1, 18: 1}
Did not match all atoms present	74938-11-7	CCCN(CCC)C1CCC2=C(C1)C=C(C=C2)O	{1: 2, 2: 4, 33: 1, 11: 3, 12: 1, 14: 3, 21: 1}
Did not match all atoms present	7494-67-9	CC(=O)OC1=C(C2=CC=CC=C2C(=C1)C3=CC(=C(C4=CC=CC=C43)OC(=O)C)OC(=O)C)OC(=O)C	{1: 4, 28: 4, 14: 10}
Did not match all atoms present	74940-61-7	COP(=O)(C(C(Cl)(Cl)Cl)OC(=O)CCl)OC	{1: 2, 2: 1, 3: 1, 4: 1, 17: 4, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	7495-45-6	CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)O	{1: 1, 2: 1, 4: 1, 14: 10, 22: 1, 27: 1}
Did not match all atoms present	7495-77-4	CC(C)OC1=CC=C(C=C1)O	{1: 2, 22: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	7495-78-5	CC(C)OC1=CC=C(C=C1)OC(C)C	{1: 4, 3: 2, 22: 2, 14: 4}
Did not match all atoms present	7495-97-8	CCP(=O)(CC)OP(=O)(CC)CC	{1: 4, 2: 4, 29: 2, 22: 1}
Did not match all atoms present	7496-02-8	C1=CC=C2C(=C1)C=CC3=C2C=C(C4=CC=CC=C34)[N+](=O)[O-]	{38: 1, 14: 11}
Did not match all atoms present	7496-45-9	CCN1C=C2C(=NC=N2)N=C1	{1: 1, 2: 1, 35: 3, 14: 3, 33: 1}
Did not match all atoms present	74963-95-4	C[Ge]C	{1: 2}
Did not match all atoms present	74966-25-9	CCCCC(=O)C1=CC2=C(C=C1)OCCOCCOC3=C(C=CC(=C3)C(=O)CCCC)OCCOCCO2	{1: 2, 2: 6, 11: 8, 14: 6, 23: 6, 24: 2}
Did not match all atoms present	7497-08-7	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)OC(=O)OC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl	{17: 10}
Did not match all atoms present	7497-27-0	CC1=C(C(=CC=C1)C)NC(=O)C(F)(F)F	{1: 2, 4: 1, 14: 3, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	7497-89-4	COC(=O)CCOC1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	74974-60-0	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ga+3]	{16: 9, 4: 3, 29: 9}
Did not match all atoms present	74974-61-1	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Al+3]	{16: 9, 4: 3, 29: 9}
Did not match all atoms present	74976-84-4	CCOC(=O)C(=C)C[Si](C)(C)C	{1: 4, 2: 2, 28: 1, 5: 1, 7: 1}
Did not match all atoms present	74978-19-1	CCCCCCCCCCCCCCCCC(=O)OCC1=CC=CC=C1	{1: 1, 2: 16, 28: 1, 14: 5}
Did not match all atoms present	74978-20-4	[Al+3].[Cl-].[Cl-].[Cl-].[Cl-].[K+]	{17: 4}
Did not match all atoms present	7498-54-6	CC(C)(C)C1=CC=CC(=C1)C(=O)O	{1: 3, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	7498-57-9	C1=CC=C2C=C(C=CC2=C1)CC#N	{2: 1, 37: 1, 14: 7}
Did not match all atoms present	7498-66-0	C1=CC(=CC(=C1)Cl)C(=O)C2=CC=C(C=C2)Cl	{24: 1, 17: 2, 14: 8}
Did not match all atoms present	7499-32-3	CC1=CCCC2=C1C=C3C=CC4=C5C3=C2C=CC5=CC=C4	{1: 1, 11: 2, 14: 9, 15: 1}
Did not match all atoms present	7499-60-7	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)CCC(=O)O	{24: 1, 2: 2, 27: 1, 14: 9}
Did not match all atoms present	7499-65-2	C1=CC=C2C(=C1)C=C(C=C2Br)[N+](=O)[O-]	{18: 1, 38: 1, 14: 6}
Did not match all atoms present	74990-49-1	CC1=NC=CN=C1SCC2=CC=CC=C2	{40: 1, 1: 1, 2: 1, 35: 2, 14: 7}
Did not match all atoms present	74999-19-2	C1(=NNN=N1)NNC2=NNN=N2	{32: 2, 35: 6, 31: 2}
Did not match all atoms present	74999-25-0	CCN1N=C(N=N1)N=NC2=NN(N=N2)CC	{1: 2, 2: 2, 35: 6, 34: 2, 33: 2}
Did not match all atoms present	74999-36-3	CC1=CC(=C(N1)C(=O)OC)C	{32: 1, 1: 3, 28: 1, 14: 1}
Did not match all atoms present	75-15-0	C(=S)=S	{8: 1}
Did not match all atoms present	75-16-1	[CH3-].[Mg+2].[Br-]	{18: 1}
Did not match all atoms present	75-22-9	[B].CN(C)C	{1: 3, 33: 1}
Did not match all atoms present	75-23-0	B(F)(F)F.CCN	{16: 3, 1: 1, 2: 1, 30: 1}
Did not match all atoms present	75-24-1	C[Al](C)C	{1: 3}
Did not match all atoms present	75-39-8	CC=O.N	{1: 1, 26: 1}
Did not match all atoms present	75-54-7	C[Si](Cl)Cl	{1: 1, 17: 2}
Did not match all atoms present	75-57-0	C[N+](C)(C)C.[Cl-]	{1: 4, 17: 1}
Did not match all atoms present	75-58-1	C[N+](C)(C)C.[I-]	{1: 4, 19: 1}
Did not match all atoms present	75-59-2	C[N+](C)(C)C.[OH-]	{1: 4}
Did not match all atoms present	75-60-5	C[As](=O)(C)O	{1: 2, 20: 1, 29: 1}
Did not match all atoms present	75-74-1	C[Pb](C)(C)C	{1: 4}
Did not match all atoms present	75-75-2	CS(=O)(=O)O	{1: 1, 20: 1, 29: 2}
Did not match all atoms present	75-76-3	C[Si](C)(C)C	{1: 4}
Did not match all atoms present	75-77-4	C[Si](C)(C)Cl	{1: 3, 17: 1}
Did not match all atoms present	75-78-5	C[Si](C)(Cl)Cl	{1: 2, 17: 2}
Did not match all atoms present	75-79-6	C[Si](Cl)(Cl)Cl	{1: 1, 17: 3}
Did not match all atoms present	75-93-4	COS(=O)(=O)O	{1: 1, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	75-94-5	C=C[Si](Cl)(Cl)Cl	{17: 3, 5: 1, 6: 1}
Did not match all atoms present	750-90-3	COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.C1=CC=C(C(=C1)C(=O)O)O	{1: 1, 3: 1, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 9, 35: 1, 20: 1, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	7500-53-0	C1=CC=C(C(=C1)CC(=O)O)CC(=O)O	{2: 2, 27: 2, 14: 4}
Did not match all atoms present	7501-02-2	C1=CC=C(C=C1)C2=CC=CC=C2OCCO	{2: 2, 20: 1, 22: 1, 14: 9}
Did not match all atoms present	7501-18-0	CCCCNC(=O)C1=NSN=C1NC(=O)N	{1: 1, 2: 3, 35: 2, 41: 1, 24: 2, 30: 1, 31: 2}
Did not match all atoms present	7501-30-6	CCCCN=C(C1=NSN=C1N)N	{1: 1, 2: 3, 35: 2, 7: 1, 41: 1, 34: 1, 30: 2}
Did not match all atoms present	7501-32-8	C1=NC(=C(C(=N1)Cl)NC=O)N	{35: 2, 14: 1, 17: 1, 26: 1, 30: 1, 31: 1}
Did not match all atoms present	75016-34-1	[2H]C([2H])(CCC)N(C)N=O	{1: 2, 2: 3, 34: 1, 29: 1, 33: 1}
Did not match all atoms present	75018-23-4	CCN1C=NC2=C(C1=N)N=CN2C3C(C(C(O3)CO)O)O.I	{1: 1, 2: 2, 35: 2, 36: 1, 33: 2, 12: 4, 14: 2, 19: 1, 20: 3, 23: 1}
Did not match all atoms present	7502-06-9	CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)N	{1: 1, 2: 15, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	75024-32-7	C1CCCC(CC1)OC=O	{26: 1, 11: 6, 12: 1}
Did not match all atoms present	75032-76-7	CSC(=S)[C@H](CCO)N	{1: 1, 2: 2, 3: 1, 7: 1, 40: 1, 20: 1, 30: 1}
Did not match all atoms present	7504-66-7	CCC(=O)OC1=C(C=C(C=C1)CC=C)OC	{1: 2, 2: 2, 5: 1, 6: 1, 14: 3, 22: 1, 28: 1}
Did not match all atoms present	7504-73-6	CC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)OC	{1: 2, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	7504-86-1	CCCCCCCCCCOC(=O)NC1=CC=CC=C1	{1: 1, 2: 9, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	7505-62-6	C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)C=O	{26: 1, 14: 11}
Did not match all atoms present	7505-81-9	CNC1=CC=CC=C1C(=O)N	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	7505-92-2	C1=CC=C(C=C1)C(=O)C(=O)N	{24: 2, 30: 1, 14: 5}
Did not match all atoms present	75052-04-9	COC(CN=C=S)OC	{1: 2, 2: 1, 3: 1, 8: 1, 34: 1, 22: 2}
Did not match all atoms present	75055-73-1	CC(=O)CC(=O)C1=CC=NC=C1	{24: 2, 1: 1, 2: 1, 35: 1, 14: 4}
Did not match all atoms present	7506-76-5	C=CCOC(=O)C1=CC=CC=C1Cl	{2: 1, 5: 1, 6: 1, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	7506-77-6	CCOP(=S)(OCC)OP(=O)(CC)CC	{1: 4, 2: 4, 29: 1, 22: 3}
Did not match all atoms present	75067-09-3	C=C=C1C=C2C=CC=CC2=C1	{8: 1, 5: 1, 14: 6, 15: 1}
Did not match all atoms present	7507-01-9	CCC(C1=CC=C(C=C1)O)(C(CC)(C2=CC=C(C=C2)O)O)O	{1: 2, 2: 2, 4: 2, 14: 8, 20: 2, 21: 2}
Did not match all atoms present	7507-89-3	CC(=O)C1=C(C=C(C=C1O)OC)O	{24: 1, 1: 2, 22: 1, 21: 2, 14: 2}
Did not match all atoms present	7508-82-9	CC(CO)(C(=O)O)NC(=O)C1=CC=CC=C1	{1: 1, 2: 1, 4: 1, 14: 5, 20: 1, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	7509-11-7	CC1=CC(=C(C=C1[N+](=O)[O-])OC)OC	{1: 3, 38: 1, 22: 2, 14: 2}
Did not match all atoms present	7509-20-8	COC1=CC=C(C=C1)C2=CC(=CC(=C2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC	{1: 3, 22: 3, 14: 15}
Did not match all atoms present	7509-22-0	CC(=CC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC(=CC=C2)[N+](=O)[O-]	{1: 1, 6: 1, 38: 2, 7: 1, 14: 8, 24: 1}
Did not match all atoms present	7509-44-6	C1=CC=C2C(=C1)C3=CC=CC=C3C(=C2[N+]#N)[O-]	{34: 1, 14: 8}
Did not match all atoms present	7509-96-8	CCNC(=O)C1=C(N=CN1)[N+](=O)[O-]	{32: 1, 1: 1, 2: 1, 35: 1, 38: 1, 14: 1, 24: 1, 31: 1}
Did not match all atoms present	751-01-9	CN1CC[C@]23[C@@H]4C(=O)C=C[C@]2([C@H]1CC5=C3C(=C(C=C5)OC)O4)OC(=O)/C=C/C6=CC=CC=C6	{1: 2, 6: 2, 33: 1, 11: 3, 12: 2, 13: 2, 14: 9, 22: 1, 23: 1, 25: 1, 28: 1}
Did not match all atoms present	751-83-7	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/C.[O-]S(=O)(=O)[O-]	{1: 4, 2: 1, 6: 3, 7: 1, 11: 3, 13: 1, 14: 15, 15: 2, 29: 4}
Did not match all atoms present	751-84-8	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C.C1=CC=C(C=C1)CCNCC2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 41: 1, 12: 3, 13: 1, 14: 15, 24: 1, 25: 1, 27: 1, 31: 2}
Did not match all atoms present	751-94-0	C[C@H]1[C@@H]2CC[C@]3([C@H]([C@]2(CC[C@H]1O)C)[C@@H](C[C@@H]\4[C@@]3(C[C@@H](/C4=C(/CCC=C(C)C)\C(=O)[O-])OC(=O)C)C)O)C.[Na+]	{1: 7, 2: 2, 6: 1, 7: 2, 11: 6, 12: 7, 13: 3, 15: 1, 20: 2, 24: 1, 28: 1}
Did not match all atoms present	751-97-3	C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)NCN5CCCC5)N(C)C)O	{1: 3, 2: 1, 33: 2, 11: 5, 12: 3, 13: 2, 14: 3, 15: 4, 20: 4, 21: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	7510-57-8	CCC(C)OC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 2, 14: 3, 28: 1}
Did not match all atoms present	75102-19-1	COC1=C2C3CCC(C3)C2=C(C4=CC=CC=C41)OC	{1: 2, 11: 3, 12: 2, 22: 2, 14: 4}
Did not match all atoms present	75102-20-4	COC1=C2C3CCC(C2=C(C4=CC=CC=C41)OC)C=C3	{1: 2, 11: 2, 12: 2, 22: 2, 14: 6}
Did not match all atoms present	75102-21-5	CC1=CC2CCC1C3=C(C4=CC=CC=C4C(=C23)OC)OC	{1: 3, 11: 2, 12: 2, 14: 5, 15: 1, 22: 2}
Did not match all atoms present	7511-54-8	CCC1=C2CCC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1	{1: 1, 2: 1, 11: 2, 14: 9}
Did not match all atoms present	75113-53-0	CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC=C2)N=NC3=NC=C(S3)[N+](=O)[O-]	{1: 1, 34: 2, 35: 1, 38: 1, 41: 1, 14: 9, 29: 2, 31: 1}
Did not match all atoms present	75113-54-1	CCN(CC)C1=C(C=C(C(=C1)OC)N=NC2=CC=C(C=C2)[N+](=O)[O-])OC	{1: 4, 2: 2, 38: 1, 33: 1, 34: 2, 14: 6, 22: 2}
Did not match all atoms present	75113-57-4	CN(CCCCCC(=O)O)S(=O)(=O)C1=CC=CC=C1.C(CO)N	{1: 1, 2: 7, 33: 1, 14: 5, 20: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	75113-58-5	CC(CN)O.CN(CCCCCC(=O)O)S(=O)(=O)C1=CC=CC=C1	{1: 2, 2: 6, 3: 1, 33: 1, 14: 5, 20: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	75125-45-0	C1COCCN1C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3	{24: 1, 33: 2, 11: 4, 14: 10, 23: 1}
Did not match all atoms present	75125-54-1	C(CN(CCN(CCCN(CP(=O)(O)O)CP(=O)(O)O)CP(=O)(O)O)CP(=O)(O)O)CN(CP(=O)(O)O)CP(=O)(O)O	{33: 4, 2: 14, 20: 12, 29: 6}
Did not match all atoms present	75125-55-2	CC\1=C(C(=O)NC(=O)/C1=N/NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C#N	{32: 1, 1: 2, 34: 1, 37: 1, 38: 1, 14: 3, 15: 3, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	75135-40-9	CCCCN1C(=C(N(P1(=O)Cl)CCCC)C)C	{1: 4, 2: 6, 33: 2, 15: 2, 17: 1, 29: 1}
Did not match all atoms present	75148-49-1	CCOC(C1=CC(=CC=C1)Br)OCC	{1: 2, 2: 2, 3: 1, 14: 4, 18: 1, 22: 2}
Did not match all atoms present	75150-15-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=CC(=C4)CS(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N.[K+].[K+]	{2: 3, 14: 9, 22: 1, 25: 2, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	75150-16-2	CC1=CC(=C(C=C1)N/N=C\2/C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)S(=O)(=O)CCOS(=O)(=O)O)Cl)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 2: 2, 35: 3, 34: 1, 14: 10, 15: 2, 17: 1, 20: 4, 22: 1, 25: 1, 29: 10, 31: 3}
Did not match all atoms present	75150-17-3	CC(C)(CNC(=O)C=C)C[N+](C)(C)C.COS(=O)(=O)[O-].C=CC(=O)N	{1: 6, 2: 2, 4: 1, 5: 2, 6: 2, 22: 1, 24: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	75150-19-5	CC(C)(CNC(=O)C=C)CN(C)C.CC(C)(CNC(=O)C=C)CN(C)C.C=CC(=O)N.OS(=O)(=O)O	{1: 8, 2: 4, 4: 2, 5: 3, 6: 3, 33: 2, 20: 2, 24: 3, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	75150-22-0	CC(=C)C(=O)NCC(C)(C)C[N+](C)(C)C.COS(=O)(=O)[O-].C=CC(=O)N	{1: 7, 2: 2, 4: 1, 5: 2, 6: 1, 7: 1, 22: 1, 24: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	75150-25-3	CC(=C)C(=O)NCC(C)(C)CN(C)C.CC(=C)C(=O)NCC(C)(C)CN(C)C.C=CC(=O)N.OS(=O)(=O)O	{1: 10, 2: 4, 4: 2, 5: 3, 6: 1, 7: 2, 20: 2, 24: 3, 33: 2, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	75150-26-4	C[N+](C)(C)CCCNC(=O)C=C.COS(=O)(=O)[O-].C=CC(=O)N	{1: 4, 2: 3, 5: 2, 6: 2, 22: 1, 24: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	75150-28-6	CC(=C)C(=O)OCC[N+](C)(C)C.CC(C)(CNC(=O)C=C)C[N+](C)(C)C.C=CC(=O)N.[Cl-].[Cl-]	{1: 9, 2: 4, 4: 1, 5: 3, 6: 2, 7: 1, 17: 2, 24: 2, 28: 1, 30: 1, 31: 1}
Did not match all atoms present	75150-31-1	CN(C)CCCNC(=O)C=C.CN(C)CCCNC(=O)C=C.C=CC(=O)N.OS(=O)(=O)O	{1: 4, 2: 6, 5: 3, 6: 3, 33: 2, 20: 2, 24: 3, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	75156-21-7	CCCCCCCCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 7, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	75157-06-1	CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)N(CCC(C#N)(C1=CC=CC=C1)C2=CC=CC=N2)C(C)C	{1: 5, 2: 2, 3: 2, 4: 1, 37: 1, 33: 1, 14: 13, 35: 1, 20: 1, 29: 2}
Did not match all atoms present	75175-10-9	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=CC(=O)O	{27: 1, 28: 1, 14: 9, 6: 2}
Did not match all atoms present	7518-35-6	CS(=O)(=O)OCC(C(C(C(COS(=O)(=O)C)OS(=O)(=O)C)O)O)OS(=O)(=O)C	{1: 4, 2: 2, 3: 4, 20: 2, 22: 4, 29: 8}
Did not match all atoms present	75181-08-7	[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].C1C=CC=[C-]1.[Cl-].[Cl-].[Cl-].[Hf]	{17: 3, 11: 1, 14: 3}
Did not match all atoms present	75184-03-1	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C1=CC(=O)NNC1=O	{32: 2, 1: 2, 2: 1, 4: 1, 11: 1, 12: 1, 14: 10, 17: 1, 21: 2, 23: 1, 25: 2}
Did not match all atoms present	75184-71-3	CCCS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)NC(=O)OC	{32: 1, 1: 2, 2: 2, 35: 1, 14: 3, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	75192-38-0	C[Si](C)(C)C#P	{1: 3, 10: 1}
Did not match all atoms present	75198-31-1	C1=CC2=NC=C(N2C=C1)C3=CC=C(O3)[N+](=O)[O-]	{33: 1, 35: 1, 38: 1, 14: 7, 23: 1}
Did not match all atoms present	75198-32-2	C1=CC=C(C=C1)CC2=CC(=CC=C2)C(F)(F)F	{16: 3, 2: 1, 4: 1, 14: 9}
Did not match all atoms present	75198-79-7	[Li+].CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+]	{1: 2, 34: 2, 14: 7, 22: 1, 29: 6, 30: 1}
Did not match all atoms present	75198-80-0	[Li+].CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O)OC)N.[Na+]	{1: 2, 34: 2, 14: 7, 20: 2, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	75198-81-1	CC1=C/C(=N/NC2=CC=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)NS(=O)(=O)C)[N+](=O)[O-])/C(=O)C=C1.[Na]	{1: 2, 34: 1, 38: 1, 14: 10, 15: 2, 25: 1, 29: 4, 31: 3}
Did not match all atoms present	75198-86-6	CC1=C(C(=NC(=N1)F)NC2=CC3=C(C=C2)C(=O)/C(=N/NC4=C(C5=C(C=C4)C(=CC=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 1, 34: 1, 35: 2, 14: 9, 15: 2, 16: 1, 17: 1, 25: 1, 29: 9, 31: 2}
Did not match all atoms present	75198-91-3	CC1=C(C(=NC(=N1)F)NC2=CC=C(C=C2)N=NC3=C(C=C4C=C(/C(=N\NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=O)C4=C3N)S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+]	{1: 1, 34: 3, 35: 2, 14: 9, 15: 2, 16: 1, 17: 1, 25: 1, 29: 12, 30: 1, 31: 2}
Did not match all atoms present	75198-94-6	CC1=C(C=CC(=C1)OC)N=NC2=CC=C(C=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])OC.[Na+]	{1: 3, 34: 4, 22: 2, 14: 10, 29: 3}
Did not match all atoms present	75198-95-7	COC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])OC.[Na+]	{1: 2, 34: 4, 22: 2, 14: 11, 29: 3}
Did not match all atoms present	75198-97-9	[Li+].[Li+].CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	75198-98-0	[Li+].[Li+].CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	75198-99-1	[Li+].[Li+].CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	75199-02-9	CCOC1=CC=CC=C1NC2=C(C=C(C=C2)N)S(=O)(=O)[O-].[Na+]	{1: 1, 2: 1, 14: 7, 22: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	75199-14-3	CC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=CC(=C4)C)OC)/C2=O)C	{1: 4, 34: 1, 14: 11, 15: 2, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	75199-15-4	CC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC=C(C=C4)Cl)/C2=O)C	{1: 2, 34: 1, 14: 12, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	75199-16-5	CC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=CC=CC=C4Cl)/C2=O)C	{1: 2, 34: 1, 14: 12, 15: 2, 17: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	75199-17-6	C1=CC(=C(C=C1NC2=NC(=NC(=N2)Cl)NCC(CNC3=NC(=NC(=N3)NC4=CC(=C(C=C4)N=NC5=C(C=C6C=C(C=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)Cl)O)NC(=O)N)N=NC7=C(C=C8C=C(C=C(C8=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{2: 2, 3: 1, 34: 4, 14: 14, 17: 2, 35: 6, 20: 1, 24: 2, 29: 18, 30: 2, 31: 6}
Did not match all atoms present	75199-19-8	CCOC1=C(C=C(C(=C1)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C)N(CCO)CCOC(=O)C	{1: 3, 2: 5, 38: 2, 33: 1, 34: 2, 14: 4, 18: 1, 20: 1, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	75199-23-4	C1=CC(=CC(=C1)Cl)C(=O)NC2=CC(=C(C=C2)S(=O)(=O)[O-])N.[K+]	{14: 7, 17: 1, 24: 1, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	75199-24-5	CN(C)CCCNC1=C2C(=C(C=C1)O)C(=O)C3=CC=CC=C3C2=O.Cl	{1: 2, 2: 3, 33: 1, 14: 6, 17: 1, 21: 1, 25: 2, 31: 1}
Did not match all atoms present	75205-05-9	CC(=O)C(C(=O)NC1=CC=CC=C1OC)N=NC2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-]	{1: 2, 34: 2, 3: 1, 38: 1, 14: 7, 20: 1, 22: 1, 24: 2, 29: 2, 31: 1}
Did not match all atoms present	75207-77-1	C12=C(C(=C(C(=C1F)F)F)F)N=S=N2	{16: 4, 41: 1, 35: 2}
Did not match all atoms present	7521-80-4	CCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 3, 17: 3}
Did not match all atoms present	75214-66-3	C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C(=C4[O-])N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]	{34: 2, 35: 3, 14: 10, 17: 1, 29: 12, 31: 2}
Did not match all atoms present	75217-22-0	CC[Si]1([Si]([Si]([Si]([Si]1(CC)CC)(CC)CC)(CC)CC)(CC)CC)CC	{1: 10, 2: 10}
Did not match all atoms present	75219-46-4	CC12CCC3C(C1CC[C@@H]2OC(=O)COC(=O)CCCC4=CC=C(C=C4)N(CCCl)CCCl)CCC5=C3C=CC(=C5)OC(=O)C6=CC=CC=C6	{1: 1, 2: 8, 33: 1, 11: 6, 12: 4, 13: 1, 14: 12, 17: 2, 28: 3}
Did not match all atoms present	7522-43-2	CC(C)[C@](CO)(C(=O)[O-])[NH3+]	{1: 2, 2: 1, 3: 1, 4: 1, 20: 1, 24: 1}
Did not match all atoms present	7523-15-1	CCCCCCOC(=O)OCCCCCC	{1: 2, 2: 10}
Did not match all atoms present	75236-19-0	CCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N3CCCC3	{1: 1, 2: 1, 33: 1, 11: 4, 34: 2, 14: 8}
Did not match all atoms present	75238-15-2	CC(=O)N.[N+](=O)(O)[O-]	{24: 1, 1: 1, 20: 1, 30: 1}
Did not match all atoms present	7524-63-2	CC1CCC2=C(C1)C=CC(=C2)C	{1: 2, 11: 3, 12: 1, 14: 3}
Did not match all atoms present	75240-09-4	CCC1=C2C3=CC=CC=C3NC2=CC(=N1)N	{32: 1, 1: 1, 2: 1, 35: 1, 14: 5, 30: 1}
Did not match all atoms present	75240-12-9	CCCC1=C2C3=CC=CC=C3NC2=CC(=N1)N.CC(=O)O	{32: 1, 1: 2, 2: 2, 35: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	75240-14-1	CC(=O)O.C1=CC=C(C=C1)CC2=C3C4=CC=CC=C4NC3=CC(=N2)N	{32: 1, 1: 1, 2: 1, 35: 1, 14: 10, 27: 1, 30: 1}
Did not match all atoms present	75240-20-9	CCC1=C2C(=CN=C1N)C3=CC=CC=C3N2.CC(=O)O	{32: 1, 1: 2, 2: 1, 35: 1, 14: 5, 27: 1, 30: 1}
Did not match all atoms present	75240-22-1	CCC1=C(N=C(C2=C1NC3=CC=CC=C32)C)N.CC(=O)O	{32: 1, 1: 3, 2: 1, 35: 1, 14: 4, 27: 1, 30: 1}
Did not match all atoms present	75247-19-7	C1CCC(CC1)NC2=C3C(=C(C=C2)NC4CCCCC4CC5=C(C=CC=C5S(=O)(=O)[O-])CNC(=O)CCl)C(=O)C6=CC=CC=C6C3=O.[K+]	{2: 3, 11: 9, 12: 3, 14: 9, 17: 1, 24: 1, 25: 2, 29: 3, 31: 3}
Did not match all atoms present	7525-62-4	CCC1=CC=CC(=C1)C=C	{1: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	7526-26-3	CP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2	{1: 1, 22: 2, 14: 10, 29: 1}
Did not match all atoms present	75268-66-5	CCN1C(=O)C(=C(/C(=N\NC2=C(C=CC(=C2)NC3=NC(=NC(=N3)NC4=CC5=C(C=C4)C=C(C=C5)S(=O)(=O)[O-])F)S(=O)(=O)[O-])/C1=O)C)C(=O)N.[Na+].[Na+]	{1: 2, 2: 1, 35: 3, 33: 1, 34: 1, 14: 9, 15: 3, 16: 1, 24: 1, 25: 2, 29: 6, 30: 1, 31: 3}
Did not match all atoms present	75268-67-6	CCCCCC1=NC2=C(N1NC3=CC=CC=C3Cl)C4=C(C=C2)C=C(/C(=N/NC5=C(C=CC(=C5)NC(=O)C6=CC=CC=C6)S(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 2: 4, 35: 1, 33: 1, 34: 1, 14: 15, 15: 2, 17: 1, 24: 1, 25: 1, 29: 6, 31: 3}
Did not match all atoms present	75268-68-7	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)NC(=O)CCl)S(=O)(=O)[O-])N.[Na+]	{2: 1, 14: 9, 17: 1, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	75268-69-8	CC1=CC(=C(C=C1N=NC2=C3C=C(C(=CC3=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=C6C=C(C(=CC6=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 4, 14: 12, 22: 2, 24: 1, 29: 18, 31: 2}
Did not match all atoms present	75268-70-1	CC1=CC(=C(C(=C1)S(=O)(=O)[O-])N=NC2=CC(=C(C=C2C)N=NC3=C(C=C4C=C(C=CC4=C3)NC5=CC=CC=C5)S(=O)(=O)[O-])C)C.[Na+].[Na+]	{1: 4, 34: 4, 29: 6, 14: 14, 31: 1}
Did not match all atoms present	75268-71-2	CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C=C3[O-])S(=O)(=O)[O-])OC)N/N=C/4\C(=CC5=CC(=CC(=C5C4=O)NC6=NC(=NC(=N6)NC7=CC=C(C=C7)N/N=C\8/C=CC(=O)C(=C8)C(=O)O)N(C)C9=CC=CC=C9)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 3, 34: 4, 35: 3, 33: 1, 14: 21, 15: 4, 22: 1, 25: 2, 27: 1, 29: 12, 31: 4}
Did not match all atoms present	75268-73-4	CC1=CC(=C(C=C1N/N=C/2\C=C(C(=O)C(=C2)S(=O)(=O)[O-])C(=O)[O-])OC)NC(=O)C3=CC(=CC=C3)NC(=O)NC4=CC=C(C=C4)N/N=C/5\C=CC(=O)C(=C5)C(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 14: 15, 15: 5, 22: 1, 24: 4, 25: 2, 29: 3, 31: 5}
Did not match all atoms present	75268-74-5	C1=CC(=CC(=C1)S(=O)(=O)[O-])N=NC2=C(C=C3C(=C2[O-])C=CC(=C3N=NC4=C(C=C(C=C4)[N+](=O)[O-])[O-])N)S(=O)(=O)[O-].[Na+].[Cr+3]	{38: 1, 30: 1, 34: 4, 29: 6, 14: 10}
Did not match all atoms present	75268-76-7	C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC=CC=C3[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC=CC=C3[O-])[O-].[Na+].[Cr+3]	{34: 4, 14: 20}
Did not match all atoms present	75268-78-9	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)N=NC3=CC=CC=C3)[O-])[O-])C4=CC=CC=C4.CC1=NN(C(=O)C1=NN=C2C=C(C=C(C2=O)N([O-])[O-])S(=O)(=O)[O-])C3=CC=CC=C3.[Na+].[Na+].[Cr+3]	{1: 2, 34: 6, 35: 2, 33: 2, 14: 20, 15: 5, 25: 2, 29: 3}
Did not match all atoms present	75272-68-3	C[Si](C)(C)C1CCC(C2=C1C(CCC2[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	{1: 12, 11: 4, 12: 4, 15: 2}
Did not match all atoms present	75277-39-3	C1CN(CCN1CCO)CCS(=O)(=O)[O-].[Na+]	{33: 2, 2: 4, 11: 4, 20: 1, 29: 3}
Did not match all atoms present	75279-55-9	C1=CC(=C(C(=C1)Cl)CC#N)F	{16: 1, 17: 1, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	75279-56-0	C1=CC(=C(C=C1F)Cl)CC#N	{16: 1, 17: 1, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	75279-58-2	CC1=CC(=C(C=C1C)CC#N)C	{1: 3, 2: 1, 37: 1, 14: 2}
Did not match all atoms present	7529-21-7	CCCC[N+](CCCC)(CCCC)[O-]	{1: 3, 2: 9, 29: 1}
Did not match all atoms present	7529-22-8	C[N+]1(CCOCC1)[O-]	{1: 1, 11: 4, 29: 1, 23: 1}
Did not match all atoms present	7529-63-7	CC(C1=CC=CC=C1)N2CCCCC2	{11: 5, 1: 1, 3: 1, 14: 5, 33: 1}
Did not match all atoms present	7529-94-4	CCCCCCCCCCCCCCCCCCOP(=O)(O)[O-].[NH4+]	{1: 1, 2: 17, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	753-58-2	C1[C@H](N([C@H](S1)C2=CC=CC=C2O)C(=O)CCS)C(=O)O	{33: 1, 2: 2, 39: 1, 41: 1, 11: 1, 12: 2, 14: 4, 21: 1, 24: 1, 27: 1}
Did not match all atoms present	753-59-3	CP(C)(C)(F)F	{16: 2, 1: 3}
Did not match all atoms present	753-69-5	C[Ge](F)(F)F	{16: 3, 1: 1}
Did not match all atoms present	753-71-9	CP(=O)(F)Cl	{16: 1, 1: 1, 29: 1, 17: 1}
Did not match all atoms present	753-73-1	C[Sn](C)(Cl)Cl	{1: 2, 17: 2}
Did not match all atoms present	75300-76-4	CCN(CC)CCO.C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C([N-]4)N=C6C7=CC=CC=C7C(=N6)N=C8C9=CC=CC=C9C(=N8)N=C2[N-]3.[Cu+2]	{1: 2, 2: 4, 35: 8, 33: 1, 14: 16, 20: 1}
Did not match all atoms present	75300-78-6	CC1=CC=CC=C1OC2=CC=CC=C2C.C(CO)NCCO	{1: 2, 2: 4, 14: 8, 20: 2, 22: 1, 31: 1}
Did not match all atoms present	7531-39-7	CCP(=O)(CC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 14: 4, 22: 1, 29: 1}
Did not match all atoms present	75318-62-6	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN4C=CC5=CC=CC=C5C4=N3	{33: 1, 35: 2, 14: 15}
Did not match all atoms present	75318-64-8	C1CN2C(=NC(=N2)C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C51	{33: 1, 11: 2, 14: 13, 35: 2}
Did not match all atoms present	75318-65-9	C1C2=CC=CC=C2C3=NC(=NN31)C4=CC=C(C=C4)C5=CC=CC=C5	{33: 1, 11: 1, 14: 13, 35: 2}
Did not match all atoms present	75318-76-2	CC1=C(C=CC(=C1)Cl)C2=NC(=NN2)C3=CC(=CC=C3)OC	{32: 1, 1: 2, 35: 2, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	7532-52-7	C1=C(OC(=C1)[N+](=O)[O-])C2=NC(=NN2)N	{32: 1, 35: 2, 38: 1, 14: 2, 23: 1, 30: 1}
Did not match all atoms present	7532-60-7	CCCCNCC(CNC1=CC=C(C=C1)C)O	{1: 2, 2: 5, 3: 1, 14: 4, 20: 1, 31: 2}
Did not match all atoms present	7532-85-6	C=C[Sn](C=C)(Cl)Cl	{17: 2, 5: 2, 6: 2}
Did not match all atoms present	75321-19-6	C1=CC2=C3C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])C=CC4=C(C=CC1=C43)[N+](=O)[O-]	{38: 3, 14: 7}
Did not match all atoms present	75321-20-9	C1=CC2=C3C(=C1)C=CC4=C(C=C(C(=C43)C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8}
Did not match all atoms present	7534-64-7	C1=CC(=C(C(=C1)Cl)CSC#N)Cl	{40: 1, 17: 2, 2: 1, 37: 1, 14: 3}
Did not match all atoms present	75348-31-1	O[As]([O-])[O-].[Ca+2]	{20: 1, 29: 2}
Did not match all atoms present	75348-40-2	CCN(CC)CCOC1=NC=C(C=C1)C(=O)NC2=CC=CC=C2OC.Cl	{1: 3, 2: 4, 35: 1, 33: 1, 14: 7, 17: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	75348-49-1	COC1=C(C(=C(C=C1)/C=C/CC(=O)N2CC[NH+](CC2)CC(=O)N3CCCC3)OC)OC.C(=C\C(=O)[O-])\C(=O)O.N	{1: 3, 2: 2, 6: 4, 33: 2, 11: 8, 14: 2, 22: 3, 24: 3, 27: 1}
Did not match all atoms present	75356-86-4	CC(C)(C)P1[Si](P1C(C)(C)C)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 6, 4: 2, 14: 10}
Did not match all atoms present	7536-58-5	CC(C)(C)OC(=O)N[C@@H](CC(=O)OCC1=CC=CC=C1)C(=O)[O-]	{1: 3, 2: 2, 3: 1, 4: 1, 14: 5, 24: 1, 28: 2, 31: 1}
Did not match all atoms present	7538-44-5	CCO[Si](CCCN(CCO)CCO)(OCC)OCC	{1: 3, 2: 10, 20: 2, 22: 3, 33: 1}
Did not match all atoms present	7538-45-6	CO[Si](CCS)(OC)OC	{1: 3, 2: 2, 22: 3, 39: 1}
Did not match all atoms present	7539-58-4	B(OCCN(C1CCCCC1)C2CCCCC2)(OCCN(C3CCCCC3)C4CCCCC4)OCCN(C5CCCCC5)C6CCCCC6	{33: 3, 2: 6, 11: 30, 12: 6, 22: 3}
Did not match all atoms present	75391-57-0	CC1=C(C=CC(=C1)CC#N)OC	{1: 2, 2: 1, 22: 1, 14: 3, 37: 1}
Did not match all atoms present	754-05-2	C[Si](C)(C)C=C	{1: 3, 5: 1, 6: 1}
Did not match all atoms present	754-06-3	C[Sn](C)(C)C=C	{1: 3, 5: 1, 6: 1}
Did not match all atoms present	754-91-6	C(C(C(C(C(F)(F)S(=O)(=O)N)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 17, 4: 8, 29: 2, 30: 1}
Did not match all atoms present	75410-87-6	C1CN(CCN1CC2=CNC3=CC=CC=C32)C4=NC5=CC=CC=C5C=C4.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O	{32: 1, 33: 2, 2: 1, 35: 1, 6: 4, 11: 4, 14: 11, 27: 4}
Did not match all atoms present	75410-89-8	C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)[C@@H]([C@H]([C@H]5[C@@H]4O5)O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	754122-47-9	[Au+].[C-]#N.[C-]#N.[C-]#N.[C-]#N	{}
Did not match all atoms present	75428-45-4	C1=C(SC=C1C=O)[N+](=O)[O-]	{41: 1, 26: 1, 38: 1, 14: 2}
Did not match all atoms present	7543-51-3	O.O.O.O.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Zn+2].[Zn+2].[Zn+2]	{29: 8}
Did not match all atoms present	75431-62-8	C1=CC=C(C=C1)NC2=CC=C([C@@H]3[C@@H]2C(=O)C4=C(C3=O)C(=C(C=C4)[N+](=O)[O-])O)O	{38: 1, 12: 2, 14: 9, 15: 2, 20: 1, 21: 1, 25: 2, 31: 1}
Did not match all atoms present	75431-63-9	[Li+].CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-]	{1: 1, 14: 9, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	75431-67-3	[Li+].C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)[O-]	{34: 2, 29: 3, 14: 13, 31: 1}
Did not match all atoms present	75442-13-6	C1[C@@H](O[C@@]([C@@]1(N)O)(C(N)(N)ON)N)N2C=NC3=C2NC(=NC3=O)N.[Cl-].[Cl-].[Cl-].[Ru+3]	{32: 1, 33: 1, 35: 2, 4: 1, 11: 1, 12: 1, 13: 2, 14: 1, 17: 3, 20: 1, 22: 1, 23: 1, 25: 1, 30: 6}
Did not match all atoms present	75444-63-2	COC(=O)[C@H]1[C@@H](CC[C@@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O.Cl	{32: 1, 1: 1, 33: 1, 11: 6, 12: 5, 14: 4, 17: 1, 20: 1, 28: 1}
Did not match all atoms present	75454-89-6	C1=CC=C2C(=C1)C(=O)OC2=O.C(CCCO)CCO.C(C(CO)O)O	{28: 2, 2: 8, 3: 1, 20: 5, 14: 4}
Did not match all atoms present	7546-30-7	Cl[Hg]	{17: 1}
Did not match all atoms present	75460-28-5	C1COCCOCCOC2=C(C=CC(=C2)Br)OCCOCCO1	{18: 1, 11: 10, 14: 3, 23: 6}
Did not match all atoms present	75462-59-8	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CCl	{16: 6, 17: 1, 2: 1, 4: 2, 14: 3}
Did not match all atoms present	75462-61-2	CC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{16: 6, 1: 1, 4: 2, 14: 3}
Did not match all atoms present	75464-11-8	CCCC(=O)C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O	{1: 1, 2: 2, 12: 1, 14: 6, 21: 2, 24: 1, 25: 1}
Did not match all atoms present	75464-12-9	CCCCC(=O)C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O	{1: 1, 2: 3, 12: 1, 14: 6, 21: 2, 24: 1, 25: 1}
Did not match all atoms present	7547-15-1	C(F)(F)(F)[As]1[As]([As]([As]1C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 12, 4: 4}
Did not match all atoms present	75471-07-7	CN(C)C=PC1=CC=CC=C1	{1: 2, 14: 5, 6: 1, 33: 1}
Did not match all atoms present	75476-91-4	CC1=CC(=C(C=C1C(C)CC(C2=CC(=C(C=C2C)OP3OCC(CO3)(C)C)C(C)(C)C)C4=CC(=C(C=C4C)OP5OCC(CO5)(C)C)C(C)(C)C)C(C)(C)C)OP6OCC(CO6)(C)C	{1: 19, 2: 1, 3: 2, 4: 3, 11: 6, 13: 3, 14: 6, 22: 3, 23: 6}
Did not match all atoms present	75476-93-6	CC1=NN(C(=O)C1)C2=CC3=C(C=C(C=C3C=C2)O)S(=O)(=O)O	{1: 1, 35: 1, 33: 1, 11: 1, 14: 5, 15: 1, 20: 1, 21: 1, 25: 1, 29: 2}
Did not match all atoms present	75476-94-7	CCCCC(CC)CNC1=C2C(=C(C=C1)NC)C(=O)C3=CC=CC=C3C2=O	{1: 3, 2: 5, 3: 1, 14: 6, 25: 2, 31: 2}
Did not match all atoms present	75476-95-8	CCCCCNC1=C2C(=O)[C@@H]3C=CC=C[C@H]3C(=O)C2=C(C=C1)NC	{1: 2, 2: 4, 12: 2, 14: 6, 25: 2, 31: 2}
Did not match all atoms present	75476-97-0	CCCCCCCC/C=C\CCCCCCCC(=O)NCCOC(=O)CC(C(=O)[O-])S(=O)(=O)O.C(CO)N(CCO)CCO.[Na+]	{1: 1, 2: 23, 3: 1, 6: 2, 33: 1, 20: 4, 24: 2, 28: 1, 29: 2, 31: 1}
Did not match all atoms present	7548-44-9	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#CCl)OC)CCC4=C3C=CC(=C4)OC	{1: 3, 10: 2, 11: 6, 12: 3, 13: 2, 14: 3, 17: 1, 22: 2}
Did not match all atoms present	7548-46-1	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#CBr)OC)CCC4=C3C=CC(=C4)OC	{1: 3, 10: 2, 11: 6, 12: 3, 13: 2, 14: 3, 18: 1, 22: 2}
Did not match all atoms present	7549-33-9	CCC(=O)OCC1=CC=C(C=C1)OC	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	7549-83-9	CN(C)P(N(C)C)(N(C)C)(F)F	{16: 2, 1: 6, 33: 3}
Did not match all atoms present	75490-39-0	CC(CC(C)(C)C#N)C1=CC=CC=C1	{1: 3, 2: 1, 3: 1, 4: 1, 37: 1, 14: 5}
Did not match all atoms present	7550-35-8	[Li+].[Br-]	{18: 1}
Did not match all atoms present	7550-45-0	[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]	{17: 4}
Did not match all atoms present	75503-13-8	CC1(C2CC(C1=O)C(C2=S)(C)C)C	{1: 4, 11: 1, 12: 2, 13: 2, 15: 1, 25: 1}
Did not match all atoms present	75503-14-9	CC1(C2CC(C1=S)C(C2=S)(C)C)C	{1: 4, 11: 1, 12: 2, 13: 2, 15: 2}
Did not match all atoms present	75508-31-5	CC(=O)NC1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=C(C=C4)NC(=O)C)C(=O)C5=CC=CC=C5C3=O	{24: 2, 1: 2, 31: 4, 14: 14, 25: 2}
Did not match all atoms present	75508-32-6	C1=CC=[N+](C=C1)CC2=CC(=CC=C2)S(=O)(=O)[O-]	{33: 1, 2: 1, 29: 3, 14: 9}
Did not match all atoms present	7552-07-0	C1=NSC(=N1)N	{41: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	75520-89-7	CC(=O)N[C@@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC	{1: 5, 11: 2, 12: 1, 14: 4, 22: 4, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	75522-88-2	CN(CCC#N)C1=CC=C(C=C1)N=O.Cl	{1: 1, 2: 2, 37: 1, 33: 1, 34: 1, 14: 4, 17: 1, 29: 1}
Did not match all atoms present	75530-68-6	CC1=C(C(C(=C(N1)C#N)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C	{32: 1, 1: 4, 3: 1, 37: 1, 38: 1, 12: 1, 14: 4, 15: 4, 28: 2}
Did not match all atoms present	75534-73-5	C1CCN(CC1)C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3	{24: 1, 33: 2, 11: 5, 14: 10}
Did not match all atoms present	75535-12-5	CC1=C(C(=CC=C1)NC(=NC2=CC=CC(=C2C)C)N)C	{1: 4, 34: 1, 7: 1, 14: 6, 30: 1, 31: 1}
Did not match all atoms present	75535-23-8	CCN1CCCC2=C1C=CC(=C2)C=C3COC4=CC=CC=C4C3=O	{1: 1, 2: 1, 6: 1, 33: 1, 11: 4, 14: 7, 15: 1, 23: 1, 25: 1}
Did not match all atoms present	75535-31-8	[O-]P(=O)([O-])[O-].[F-].[Cl-].[Ca+2]	{16: 1, 17: 1, 29: 4}
Did not match all atoms present	7554-65-6	CC1=CNN=C1	{32: 1, 1: 1, 35: 1, 14: 2}
Did not match all atoms present	7555-67-1	C1CC1=CC2=CC=CC=C2	{11: 2, 14: 5, 6: 1, 15: 1}
Did not match all atoms present	75559-05-6	CN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)C(=O)/C(=N/NC5=C(C=C6C=C(C=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C(=C4)S(=O)(=O)[O-])Cl.[NH4+].[Na+].[Na+].[Na+]	{1: 1, 34: 1, 35: 3, 33: 1, 14: 13, 15: 2, 17: 1, 25: 1, 29: 12, 31: 2}
Did not match all atoms present	75567-58-7	CC1=C2C3=CC=CC=C3NC2=CC(=N1)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	75571-85-6	[Be+2].CC#[C-].[CH-]1C=CC=C1	{1: 1, 10: 1, 14: 5}
Did not match all atoms present	75574-98-0	C1C2=CC=CC3=C2C(=CC=C3)CSS1	{41: 2, 11: 2, 14: 6}
Did not match all atoms present	75574-99-1	C1C2=CC=CC3=C2C(=CC=C3)CSSS1	{41: 3, 11: 2, 14: 6}
Did not match all atoms present	75578-76-6	C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-].[Na+]	{24: 1, 38: 1, 14: 8}
Did not match all atoms present	75578-77-7	C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)O)OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)OS(=O)(=O)C5=CC=CC6=C5C=CC(=C6[O-])[N+]#N	{34: 2, 14: 17, 21: 1, 22: 2, 24: 1, 29: 4}
Did not match all atoms present	75578-78-8	C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)O)OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)O	{34: 1, 14: 12, 21: 2, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	75578-79-9	C1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)O)O)OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N	{34: 1, 14: 12, 21: 2, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	7558-79-4	OP(=O)([O-])[O-].[Na+].[Na+]	{20: 1, 29: 3}
Did not match all atoms present	7558-80-7	OP(=O)(O)[O-].[Na+]	{20: 2, 29: 2}
Did not match all atoms present	7558-85-2	C1=CC(=CN=C1)C(=O)N.I	{24: 1, 35: 1, 19: 1, 30: 1, 14: 4}
Did not match all atoms present	75587-96-1	CC(C)(C)CC1=CC=C(C(=O)N1)C(=O)O	{32: 1, 1: 3, 2: 1, 4: 1, 14: 2, 25: 1, 27: 1}
Did not match all atoms present	75589-83-2	CC(=PC1=CC=CC=C1)N(C)C	{1: 3, 33: 1, 14: 5, 7: 1}
Did not match all atoms present	7559-42-4	CC1=CC=C[Se]1	{1: 1, 14: 3}
Did not match all atoms present	7559-81-1	C1=C(OC=C(C1=O)O)CCl	{2: 1, 14: 2, 17: 1, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	756-79-6	COP(=O)(C)OC	{1: 3, 29: 1, 22: 2}
Did not match all atoms present	756-80-9	COP(=S)(OC)S	{1: 2, 22: 2, 39: 1}
Did not match all atoms present	756-81-0	CC[Si](C)(C)CC	{1: 4, 2: 2}
Did not match all atoms present	7560-59-0	CCCCS(=O)(=O)C	{1: 2, 2: 3, 29: 2}
Did not match all atoms present	7561-79-7	C1CC(=NC2=CC=CC=C2)N(C1)C3=CC=CC=C3	{33: 1, 34: 1, 11: 3, 14: 10, 15: 1}
Did not match all atoms present	7562-61-0	CC1=C(C(=C2C(=C1O)C3(C(=CC(=C(C3=O)C(=O)C)O)O2)C)C(=O)C)O	{1: 4, 13: 1, 14: 1, 15: 3, 20: 1, 21: 2, 23: 1, 24: 2, 25: 1}
Did not match all atoms present	75621-03-3	C[C@H](CCC(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C	{1: 5, 2: 8, 3: 1, 11: 7, 12: 8, 13: 2, 20: 3, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	75625-24-0	C1=C2C(=CC(=C1Br)Br)C(=C(C(=C2Br)Br)Br)Br	{18: 6, 14: 2}
Did not match all atoms present	75626-17-4	COC1=C(C=CC(=C1)F)F	{16: 2, 1: 1, 22: 1, 14: 3}
Did not match all atoms present	75627-13-3	[Li+].[Li+].COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])NC(=O)NC3=CC=C(C=C3)N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-]	{1: 1, 34: 3, 14: 14, 15: 2, 22: 1, 24: 2, 25: 1, 29: 3, 31: 3}
Did not match all atoms present	75627-14-4	CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])OC)OC.[Na+]	{1: 3, 34: 4, 22: 2, 14: 10, 29: 3}
Did not match all atoms present	75627-18-8	COC1=C(C=CC(=C1)N)N/N=C/2\C(=CC3=C(C2=O)C=C(C=C3)NC4=CC(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 1, 14: 11, 15: 2, 22: 1, 25: 1, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	75627-19-9	COC1=C(C=CC(=C1)N)N/N=C/2\C(=CC3=C(C2=O)C=C(C=C3)NC4=CC(=CC=C4)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 34: 1, 14: 11, 15: 2, 20: 2, 22: 1, 25: 1, 29: 4, 30: 1, 31: 2}
Did not match all atoms present	75627-21-3	C1=CC2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)N)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 14: 10, 15: 2, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	75627-22-4	C1=CC=C2C(=C1)C=CC=C2N=NC3=C4C=CC(=CC4=C(C=C3)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{34: 3, 14: 16, 15: 2, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	75627-23-5	C1=CC=C2C(=C1)C=CC=C2N=NC3=C4C=CC(=CC4=C(C=C3)N)S(=O)(=O)[O-].[Na+]	{30: 1, 34: 2, 29: 3, 14: 12}
Did not match all atoms present	75627-24-6	C1=CC=C2C(=C1)C=CC=C2N=NC3=C4C=CC=C(C4=C(C=C3)N)S(=O)(=O)O	{30: 1, 34: 2, 20: 1, 29: 2, 14: 12}
Did not match all atoms present	75627-25-7	C1=CC=C2C(=C1)C=CC=C2N=NC3=C4C=CC(=CC4=C(C=C3)N/N=C\5/C(=CC6=C(C5=O)C=CC(=C6)N)S(=O)(=O)O)S(=O)(=O)O	{34: 3, 14: 16, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	75627-26-8	C1=CC2=C(C=C(C=C2)S(=O)(=O)O)C(=C1)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)N)S(=O)(=O)O	{34: 1, 14: 10, 15: 2, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	75627-27-9	C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)[O-])N)N=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{30: 1, 34: 4, 29: 12, 14: 13}
Did not match all atoms present	75627-28-0	C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)N)N=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C(C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{30: 1, 34: 4, 20: 4, 29: 8, 14: 13}
Did not match all atoms present	75627-30-4	CCN(CC)C1=CC(=C(C=C1)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)NCCS(=O)(=O)O)Cl)C.C(CO)N(CCO)CCO	{1: 3, 2: 10, 33: 2, 34: 2, 14: 5, 17: 2, 20: 4, 29: 4, 31: 1}
Did not match all atoms present	7563-42-0	CCCC(C)C1(C(=O)NC(=O)NC1=O)CC.[Ca+2]	{32: 2, 1: 3, 2: 3, 3: 1, 13: 1, 25: 3}
Did not match all atoms present	7564-51-4	CC1=CCP(=O)(C1)C2=CC=CC=C2	{1: 1, 11: 2, 29: 1, 14: 6, 15: 1}
Did not match all atoms present	7564-63-8	CCC1=CC=CC=C1C=C	{1: 1, 2: 1, 14: 4, 5: 1, 6: 1}
Did not match all atoms present	75641-06-4	C1=CN(C=N1)C(=O)C2=C(C(=C(C(=C2F)F)F)F)F	{16: 5, 24: 1, 35: 1, 14: 3, 33: 1}
Did not match all atoms present	75659-69-7	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N\NC3=CC=CC=C3)/C2=O)S(=O)(=O)O.C(CO)NCCO.C(CO)NCCO	{1: 1, 2: 8, 34: 1, 14: 8, 15: 2, 20: 6, 24: 1, 25: 1, 29: 4, 31: 4}
Did not match all atoms present	75659-70-0	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N\NC3=CC=CC=C3)/C2=O)S(=O)(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 1, 2: 12, 33: 2, 34: 1, 14: 8, 15: 2, 20: 8, 24: 1, 25: 1, 29: 4, 31: 2}
Did not match all atoms present	7566-41-8	C1=CC(=CC=C1OC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)N	{30: 2, 22: 1, 14: 8, 29: 4}
Did not match all atoms present	7567-63-7	C#CC1=CC(=CC(=C1)C#C)C#C	{9: 3, 10: 3, 14: 3}
Did not match all atoms present	75673-17-5	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(/C(=N\NC3=CC=CC=C3)/C2=O)S(=O)(=O)O.C(CO)NCCO.C(CO)N(CCO)CCO	{1: 1, 2: 10, 33: 1, 34: 1, 14: 8, 15: 2, 20: 7, 24: 1, 25: 1, 29: 4, 31: 3}
Did not match all atoms present	75673-51-7	CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)N)C)C3=CC=CC=C3Cl)N	{1: 2, 3: 1, 30: 2, 14: 10, 17: 1}
Did not match all atoms present	756789-51-2	[Au+2].[C-]#N.[C-]#N.[C-]#N.[C-]#N	{}
Did not match all atoms present	75679-01-5	CC1=CC(=NC2=C1N=C3N2C=CC=C3)N	{1: 1, 35: 2, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	7568-92-5	C1=CC=C(C=C1)C(CO)N	{2: 1, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	7568-93-6	C1=CC=C(C=C1)C(CN)O	{2: 1, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	75694-46-1	C1=CC=C(C=C1)C2=C(OC3=CC=CC=C3O2)C4=CC=CC=C4	{23: 2, 14: 14, 15: 2}
Did not match all atoms present	757-44-8	CCO[Si](CCP(=O)(OCC)OCC)(OCC)OCC	{1: 5, 2: 7, 29: 1, 22: 5}
Did not match all atoms present	757-54-0	COP(=O)(CC=C)OC	{1: 2, 2: 1, 5: 1, 6: 1, 22: 2, 29: 1}
Did not match all atoms present	757-58-4	CCOP(=O)(OCC)OP(=O)(OCC)OP(=O)(OCC)OP(=O)(OCC)OCC	{1: 6, 2: 6, 29: 4, 22: 9}
Did not match all atoms present	757-88-0	CCC(C)(C)OC=O	{1: 3, 2: 1, 4: 1, 26: 1}
Did not match all atoms present	7570-25-4	C=CN=[N+]=[N-]	{34: 2, 5: 1, 6: 1}
Did not match all atoms present	7570-41-4	CCN1C2=CC=CC=C2SC1=C3C(=O)N(C(=S)S3)CC(=O)O	{1: 1, 2: 2, 33: 2, 41: 2, 14: 4, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	7570-45-8	CCN1C2=C(C=C(C=C2)C=O)C3=CC=CC=C31	{1: 1, 2: 1, 26: 1, 14: 7, 33: 1}
Did not match all atoms present	7570-47-0	CC1=CC2=C(N1)C=CC(=C2)[N+](=O)[O-]	{32: 1, 1: 1, 38: 1, 14: 4}
Did not match all atoms present	7570-49-2	CC1=CC2=C(N1)C=CC(=C2)N	{32: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	7570-96-9	C1=CC=C(C=C1)SC2=CC3=CC=CC=C3C=C2	{40: 1, 14: 12}
Did not match all atoms present	7570-98-1	C1=CC=C(C=C1)SC2=CC=CC3=CC=CC=C32	{40: 1, 14: 12}
Did not match all atoms present	75700-28-6	B(C1=C(C=CC=C1C)C)(C2=C(C=CC=C2C)C)C3=C(C=CC=C3C)C	{1: 6, 14: 9}
Did not match all atoms present	75701-35-8	[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].C1=CC(=C(C=C1N/N=C\2/C(=O)C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])N)S(=O)(=O)[O-])/C=C/C4=C(C=C(C=C4)N/N=C\5/C(=O)C6=C(C=C(C=C6C=C5S(=O)(=O)[O-])S(=O)(=O)[O-])N)S(=O)(=O)[O-]	{34: 2, 6: 2, 14: 12, 15: 4, 25: 2, 29: 18, 30: 2, 31: 2}
Did not match all atoms present	75701-37-0	[Li+].C1=CC(=O)C=CC1=NNC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NN=C4C=CC(=O)C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+]	{34: 2, 6: 2, 14: 14, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	75701-39-2	C1=CC=C(C(=C1)C(=O)O)C(=O)O.C(C(CO)(CO)N)O.C(C(CO)(CO)N)O	{2: 6, 4: 2, 14: 4, 20: 6, 27: 2, 30: 2}
Did not match all atoms present	75732-41-1	CC(C)(C)[Si](C)(C)O.C1=CC=C(C=C1)C(=O)O	{1: 5, 27: 1, 4: 1, 14: 5, 20: 1}
Did not match all atoms present	75742-13-1	C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)N=[N+]=[N-])N=[N+]=[N-]	{34: 4, 29: 2, 14: 8}
Did not match all atoms present	75746-71-3	CCC1=CC=CC(=C1N=C=O)C	{1: 2, 2: 1, 8: 1, 34: 1, 14: 3, 29: 1}
Did not match all atoms present	75751-20-1	CC1=CC2=C(C=C1C)N(C3(N2C)CCCC3)C	{1: 4, 11: 4, 13: 1, 14: 2, 33: 2}
Did not match all atoms present	75752-27-1	CCN(CC)C1=CC(=C(C=C1)N=O)OC.CS(=O)(=O)O	{1: 4, 2: 2, 33: 1, 34: 1, 14: 3, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	75752-30-6	C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC=CC=C3[O-])[O-].C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC=CC=C3[O-])[O-].[Na+].[Co+3]	{34: 4, 14: 20}
Did not match all atoms present	7576-36-5	COC(=O)C1C(=C1C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 12: 1, 28: 1, 14: 10, 15: 2}
Did not match all atoms present	7576-88-7	CC1=NC2=C(C=C(C=C2)N)N=C1C	{1: 2, 35: 2, 30: 1, 14: 3}
Did not match all atoms present	75764-11-3	CC1C(C(C(C1C)C)C)C.[Yb]	{1: 5, 12: 5}
Did not match all atoms present	75768-94-4	CC1=NN(C(=O)C1N=NC2=C(C3=CC=CC=C3C=C2)S(=O)(=O)O)C4=C(C=CC(=C4)S(=O)(=O)O)Cl.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 1, 2: 12, 35: 1, 33: 3, 12: 1, 34: 2, 14: 9, 15: 1, 17: 1, 20: 8, 25: 1, 29: 4}
Did not match all atoms present	75768-95-5	[Li+].CC1=NN(C(=O)C1N=NC2=C(C3=CC=CC=C3C=C2)S(=O)(=O)[O-])C4=C(C=CC(=C4)S(=O)(=O)O)Cl.C(CO)N(CCO)CCO	{1: 1, 2: 6, 35: 1, 33: 2, 12: 1, 34: 2, 14: 9, 15: 1, 17: 1, 20: 4, 25: 1, 29: 5}
Did not match all atoms present	75768-96-6	[Li+].[Li+].CC1=NN(C(=O)C1N=NC2=C(C3=CC=CC=C3C=C2)S(=O)(=O)[O-])C4=C(C=CC(=C4)S(=O)(=O)[O-])Cl	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 9, 15: 1, 17: 1, 25: 1, 29: 6}
Did not match all atoms present	75775-83-6	CS(=O)(=O)NC1=CC=C(C=C1)NC2=C(C=NC3=CC=CC=C32)C=C.Cl	{1: 1, 35: 1, 5: 1, 6: 1, 14: 9, 17: 1, 29: 2, 31: 2}
Did not match all atoms present	7578-36-1	B(F)(F)F.CC(=O)O	{16: 3, 1: 1, 27: 1}
Did not match all atoms present	7579-20-6	C1=CN=CC(=C1C(=O)O)N	{35: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	7579-36-4	C1=CC=C(C=C1)COC(=O)C(=O)OCC2=CC=CC=C2	{2: 2, 28: 2, 14: 10}
Did not match all atoms present	7579-40-0	C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2Cl	{17: 1, 2: 1, 28: 1, 14: 9}
Did not match all atoms present	7579-91-1	C1=CC=C(C=C1)S[Si](Cl)(Cl)Cl	{40: 1, 17: 3, 14: 5}
Did not match all atoms present	75790-75-9	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C(CCCO)CCO.C(=O)(Cl)Cl	{1: 2, 2: 6, 4: 1, 14: 8, 17: 2, 20: 2, 21: 2, 24: 1}
Did not match all atoms present	75790-77-1	CC1CO1.C(/C=C/CO)O.OS(=O)[O-].[Na+]	{1: 1, 2: 2, 6: 2, 11: 1, 12: 1, 20: 3, 23: 1, 29: 2}
Did not match all atoms present	75790-82-8	CC1=C(C=C(C=C1)CC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 38: 2, 14: 7}
Did not match all atoms present	75790-83-9	CC1=C(C=C(C=C1)CC2=CC=C(C=C2)N)N	{1: 1, 2: 1, 30: 2, 14: 7}
Did not match all atoms present	75790-84-0	CC1=C(C=C(C=C1)CC2=CC=C(C=C2)N=C=O)N=C=O	{1: 1, 2: 1, 8: 2, 34: 2, 14: 7, 29: 2}
Did not match all atoms present	75790-85-1	CC(C)C1=CC(=CC(=C1CC2=C(C=C(C=C2C(C)C)N)C(C)C)C(C)C)N	{1: 8, 2: 1, 3: 4, 30: 2, 14: 4}
Did not match all atoms present	75790-86-2	CCC1=CC(=CC(=C1CC2=C(C=C(C=C2CC)N)C(C)C)C(C)C)N	{1: 6, 2: 3, 3: 2, 30: 2, 14: 4}
Did not match all atoms present	75790-87-3	C1=CC=C(C(=C1)N=C=O)SC2=CC=C(C=C2)N=C=O	{8: 2, 40: 1, 34: 2, 29: 2, 14: 8}
Did not match all atoms present	75790-88-4	C1=CC=C2C(=C1)C=CC(=C2N/N=C\3/C4=C(C=C(C=C4)[N+](=O)[O-])C(=CC3=O)S(=O)(=O)[O-])O.[K+]	{34: 1, 38: 1, 14: 10, 15: 2, 21: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	758-16-7	CN(C)C=S	{1: 2, 6: 1, 33: 1}
Did not match all atoms present	758-21-4	CC[Si](C)C	{1: 3, 2: 1}
Did not match all atoms present	7580-37-2	CC(=O)[O-].C(O)[P+](CO)(CO)CO	{24: 1, 1: 1, 2: 4, 20: 4}
Did not match all atoms present	75805-17-3	CCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=CC=C(C=C5)N(CC)CC)C	{1: 4, 2: 3, 33: 2, 13: 1, 14: 12, 28: 1}
Did not match all atoms present	75832-82-5	C1COCCOC2=CC=CC=C2OCCOCCOC3=CC=CC=C3OCCOCCO1	{11: 12, 14: 8, 23: 8}
Did not match all atoms present	7584-72-7	C1=CC=C(C=C1)C(C(C2=CC=CC=C2)C(=O)O)C(=O)O	{27: 2, 3: 2, 14: 10}
Did not match all atoms present	75840-23-2	[2H]C1=C(C(=C2C(=C1[2H])C(C(C(C2([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])[2H])[2H]	{11: 4, 14: 4}
Did not match all atoms present	75847-80-2	CC1CO1.CC1=C(C=CC=C1N)N.CC(CO)O	{1: 3, 2: 1, 3: 1, 11: 1, 12: 1, 14: 3, 20: 2, 23: 1, 30: 2}
Did not match all atoms present	7585-41-3	CC1=CC(=C(C=C1Cl)N/N=C\2/C3=CC=CC=C3C=C(C2=O)C(=O)[O-])S(=O)(=O)[O-].[Ba+2]	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	75853-08-6	CC(C1=C(C(=C(C(=C1F)F)F)F)F)O	{16: 5, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	75853-18-8	C1=CC(=C(C(=C1)F)F)CO	{16: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	75853-20-2	C1=CC(=C(C=C1F)CO)F	{16: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	75864-24-3	CC1CO1.CC(CO)O.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N	{1: 2, 2: 2, 3: 1, 11: 1, 12: 1, 14: 8, 20: 2, 23: 1, 30: 2}
Did not match all atoms present	75866-72-7	CC1=N[C@H](CO1)CC2=CC=CC=C2	{1: 1, 2: 1, 35: 1, 11: 1, 12: 1, 14: 5, 15: 1, 23: 1}
Did not match all atoms present	75867-00-4	CC1([C@@H]([C@H]1C(=O)OCC2=C(C(=C(C(=C2F)F)F)F)F)C=C(Cl)Cl)C	{1: 2, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 16: 5, 17: 2, 28: 1}
Did not match all atoms present	75872-89-8	CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)OS(=O)(=O)OC2=CC=CC=C2)N3N=C4C=CC=CC4=N3	{1: 5, 2: 1, 35: 2, 4: 2, 33: 1, 14: 12, 22: 2, 29: 2}
Did not match all atoms present	75884-37-6	CC(=O)NC1=NC(=CS1)C2=CC=CO2	{1: 1, 35: 1, 41: 1, 14: 4, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	75888-03-8	C1CNC(=O)N(C1)/N=C/C2=CC=C(O2)[N+](=O)[O-]	{32: 1, 33: 1, 34: 1, 38: 1, 6: 1, 11: 3, 14: 2, 23: 1, 25: 1}
Did not match all atoms present	75889-62-2	CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2)OCC	{1: 2, 2: 3, 35: 1, 41: 1, 14: 8, 22: 2, 29: 1}
Did not match all atoms present	7589-27-7	C1=CC(=CC=C1CCO)F	{16: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	75896-37-6	CCCCCCCCCCCCC1=CC(=C(C(=C1)S(=O)(=O)[O-])OCC(CO)O)S(=O)(=O)[O-].[K+].[K+]	{1: 1, 2: 13, 3: 1, 14: 2, 20: 2, 22: 1, 29: 6}
Did not match all atoms present	75896-38-7	C[N+]1=CSC2=CC=CC=C21.OS(=O)(=O)[O-]	{1: 1, 33: 1, 41: 1, 14: 5, 20: 1, 29: 3}
Did not match all atoms present	75899-43-3	CC1=C(N=CN1)CSC	{32: 1, 1: 2, 2: 1, 35: 1, 40: 1, 14: 1}
Did not match all atoms present	759-23-9	CC(C)[SnH](C(C)C)C(C)C	{1: 6, 3: 3}
Did not match all atoms present	75905-10-1	CCOC(C1=CC=CO1)(OCC)OCC	{1: 3, 2: 3, 4: 1, 14: 3, 22: 3, 23: 1}
Did not match all atoms present	75908-84-8	CC1=C(C(=C(C(=C1NC2=NC(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)C)S(=O)(=O)[O-])C)NC4=CC(=C(C5=C4C(=O)C6=CC=CC=C6C5=O)N)S(=O)(=O)[O-].[K+].[K+].[K+]	{1: 3, 2: 2, 35: 3, 14: 9, 17: 1, 22: 1, 25: 2, 29: 11, 30: 1, 31: 3}
Did not match all atoms present	75908-85-9	CC(C)C(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]	{1: 2, 2: 4, 3: 1, 37: 1, 38: 1, 33: 1, 34: 2, 14: 8, 28: 1}
Did not match all atoms present	75915-27-4	CC(C[N+](C)(C)C)O.[OH-]	{1: 4, 2: 1, 3: 1, 20: 1}
Did not match all atoms present	75919-81-2	CSCC1=CC=C(C=C1)CSC	{40: 2, 1: 2, 2: 2, 14: 4}
Did not match all atoms present	75946-40-6	CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)N	{1: 2, 2: 1, 3: 3, 14: 5, 24: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	75949-79-0	CC1CO1.C(/C=C/O)O.OS(=O)[O-].[Na+]	{1: 1, 2: 1, 6: 2, 11: 1, 12: 1, 20: 3, 23: 1, 29: 2}
Did not match all atoms present	7595-53-1	CSC1=NC(=NC(=C1NC=O)N)SC	{1: 2, 35: 2, 40: 2, 26: 1, 30: 1, 31: 1}
Did not match all atoms present	75965-35-4	[Li+].[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.COCCOC.COCCOC.COCCOC	{1: 6, 2: 6, 22: 6, 14: 20}
Did not match all atoms present	75965-74-1	COC1=CC2=C(C=C1)C3=C(C=C2)OC(=C3)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 6, 23: 1}
Did not match all atoms present	75965-75-2	COC1=CC2=C(C=C1)C=CC3=C2C=C(O3)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 6, 23: 1}
Did not match all atoms present	7597-18-4	C1=CC2=C(C=C1[N+](=O)[O-])NN=C2	{32: 1, 35: 1, 38: 1, 14: 4}
Did not match all atoms present	7597-91-3	CC(=O)NNC1=C(C(=NC=N1)Cl)N	{1: 1, 35: 2, 14: 1, 17: 1, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	75975-87-0	CNC.COS(=O)(=O)OC.C=CC(=O)N.C=O	{1: 4, 5: 2, 6: 1, 22: 2, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	7598-61-0	CCOC(CP(=O)(OCC)OCC)OCC	{1: 4, 2: 5, 3: 1, 29: 1, 22: 4}
Did not match all atoms present	7598-91-6	CCOC(=O)C1=C(NC2=C1C=C(C=C2)O)C	{32: 1, 1: 2, 2: 1, 14: 3, 21: 1, 28: 1}
Did not match all atoms present	76-20-0	CCC(C)(S(=O)(=O)CC)S(=O)(=O)CC	{1: 4, 2: 3, 4: 1, 29: 4}
Did not match all atoms present	76-41-5	CN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)O)O4)O	{1: 1, 33: 1, 11: 5, 12: 2, 13: 2, 14: 2, 20: 1, 21: 1, 23: 1, 25: 1}
Did not match all atoms present	76-42-6	CN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)OC)O4)O	{1: 2, 33: 1, 11: 5, 12: 2, 13: 2, 14: 2, 20: 1, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	76-51-7	CCN1C2=CC=CC=C2[Si](C3=CC=CC=C31)(C4=CC=CC=C4)C5=CC=CC=C5	{1: 1, 2: 1, 14: 18, 33: 1}
Did not match all atoms present	76-54-0	C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C=C4OC5=CC(=C(C=C35)Cl)O)O)Cl	{13: 1, 14: 8, 17: 2, 21: 2, 23: 1, 28: 1}
Did not match all atoms present	76-57-3	CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(C=C4)O	{1: 2, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	76-58-4	CCOC1=C2C3=C(CC4C5C3(CCN4C)C(O2)C(C=C5)O)C=C1	{1: 2, 2: 1, 33: 1, 11: 3, 12: 4, 13: 1, 14: 4, 20: 1, 22: 1, 23: 1}
Did not match all atoms present	76-59-5	CC1=C(C(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4C)Br)O)C(C)C)C(C)C)O)Br	{1: 6, 3: 2, 13: 1, 14: 6, 18: 2, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	76-60-8	CC1=C(C(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4C)Br)O)Br)Br)O)Br	{1: 2, 13: 1, 14: 6, 18: 4, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	76-61-9	CC1=CC(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O	{1: 6, 3: 2, 13: 1, 14: 8, 21: 2, 23: 1, 29: 2}
Did not match all atoms present	76-62-0	C1=CC=C2C(=C1)C(=O)OC2(C3=CC(=C(C(=C3)Br)O)Br)C4=CC(=C(C(=C4)Br)O)Br	{18: 4, 28: 1, 13: 1, 14: 8, 21: 2}
Did not match all atoms present	76-63-1	C=CC[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{2: 1, 14: 15, 5: 1, 6: 1}
Did not match all atoms present	76-67-5	CCC(C1=CC=CC=C1)(C(=O)OCC)C(=O)OCC	{1: 3, 2: 3, 4: 1, 14: 5, 28: 2}
Did not match all atoms present	76-75-5	CCCC(C)C1(C(=O)NC(=S)NC1=O)CC	{32: 2, 1: 3, 2: 3, 3: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	76-80-2	CC1(C=CC2=C(O1)C=CC3=C2O[C@@H]4COC5=CC(=C(C=C5[C@@]4(C3=O)O)OC)OC)C	{1: 4, 11: 1, 12: 1, 13: 2, 14: 6, 20: 1, 22: 2, 23: 3, 25: 1}
Did not match all atoms present	76-83-5	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Cl	{17: 1, 4: 1, 14: 15}
Did not match all atoms present	76-84-6	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{20: 1, 4: 1, 14: 15}
Did not match all atoms present	76-86-8	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)Cl	{17: 1, 14: 15}
Did not match all atoms present	76-87-9	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)C3=CC=CC=C3.O	{14: 15}
Did not match all atoms present	76-89-1	COC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O	{1: 1, 4: 1, 28: 1, 14: 10, 20: 1}
Did not match all atoms present	76-90-4	C[N+]1(CCCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.[Br-]	{1: 2, 4: 1, 11: 4, 12: 1, 14: 10, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	76-93-7	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)O	{20: 1, 27: 1, 4: 1, 14: 10}
Did not match all atoms present	76-94-8	CC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2	{32: 2, 1: 1, 13: 1, 14: 5, 25: 3}
Did not match all atoms present	76-99-3	CCC(=O)C(CC(C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 4, 2: 2, 3: 1, 4: 1, 33: 1, 14: 10, 24: 1}
Did not match all atoms present	760-19-0	CC[Al](CC)Br	{1: 2, 2: 2, 18: 1}
Did not match all atoms present	760-32-7	CC[Si](C)CC	{1: 3, 2: 2}
Did not match all atoms present	7600-50-2	COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl	{1: 1, 14: 1, 17: 2, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	76000-08-3	C1CNCCC1CCCC2=CC=CC=C2.Cl	{32: 1, 2: 3, 11: 4, 12: 1, 14: 5, 17: 1}
Did not match all atoms present	76002-91-0	CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC(CO)O	{1: 2, 2: 3, 3: 1, 4: 1, 11: 1, 12: 1, 14: 8, 20: 2, 22: 2, 23: 1}
Did not match all atoms present	76008-29-2	CC(C)(C)C12C(C3=CC=CC=C31)C4=CC=CC=C24	{1: 3, 14: 8, 4: 1, 13: 1, 12: 1}
Did not match all atoms present	76008-73-6	CCOC(=O)C1=C(C=CC(=C1)Br)Cl	{1: 1, 2: 1, 14: 3, 17: 1, 18: 1, 28: 1}
Did not match all atoms present	7601-54-9	[O-]P(=O)([O-])[O-].[Na+].[Na+].[Na+]	{29: 4}
Did not match all atoms present	7601-55-0	C[N+]1(CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC(=C(C=C7)OC)O3)[N+](CCC6=CC(=C5OC)OC)(C)C)OC)C.[I-].[I-]	{1: 8, 11: 6, 12: 2, 14: 10, 19: 2, 22: 4, 23: 2}
Did not match all atoms present	7601-89-0	[O-]Cl(=O)(=O)=O.[Na+]	{17: 1, 29: 4}
Did not match all atoms present	76014-80-7	C1=CC(=CN=C1)C(=O)CCC=O	{24: 1, 2: 2, 35: 1, 26: 1, 14: 4}
Did not match all atoms present	76014-81-8	CN(CCCC(C1=CN=CC=C1)O)N=O	{1: 1, 2: 3, 3: 1, 33: 1, 34: 1, 14: 4, 35: 1, 20: 1, 29: 1}
Did not match all atoms present	76047-52-4	C1CC(=O)C(=C1)CSC2=CC=CC=C2	{2: 1, 40: 1, 11: 2, 14: 6, 15: 1, 25: 1}
Did not match all atoms present	7605-28-9	C1=CC=C(C=C1)S(=O)(=O)CC#N	{2: 1, 29: 2, 14: 5, 37: 1}
Did not match all atoms present	76058-33-8	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)O	{1: 2, 2: 2, 33: 1, 34: 2, 14: 8, 27: 1}
Did not match all atoms present	76059-11-5	CC1(C(=O)C2=CC=CC=C2C1=O)C3CCC(=O)NC3=O	{32: 1, 1: 1, 11: 2, 12: 1, 13: 1, 14: 4, 25: 4}
Did not match all atoms present	76059-13-7	C1CC(=O)NC(=O)C1C2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4	{32: 1, 11: 2, 12: 1, 13: 1, 14: 9, 25: 4}
Did not match all atoms present	76059-14-8	C1CC(=O)NC(=O)C1C2(C(=O)C3=C(C2=O)SCCS3)C4=CC=CC=C4	{32: 1, 41: 2, 11: 4, 12: 1, 13: 1, 14: 5, 15: 2, 25: 4}
Did not match all atoms present	7606-79-3	CN1C2=CC=CC=C2[N+](=C1C3=NC4=C(O3)C=C(C=C4)OC)C.COS(=O)(=O)[O-]	{1: 4, 35: 1, 33: 2, 14: 7, 22: 2, 23: 1, 29: 3}
Did not match all atoms present	7606-87-3	COC(=O)C1=CC(=CC(=C1O)Cl)Cl	{1: 1, 28: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	76069-32-4	CC1C(C(C(C(O1)OC(C(C2=NC(=CS2)C3=NC(=CS3)C(=O)NCCCCN)O)NC(=O)C(C(C)O)NC(=O)CC(C(C)NC(=O)C(C(C4=CN=CN4)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)OC(=O)N)O)NC(=O)C7=C(C(=NC(=N7)C(CC(=O)N)NCC(C(=O)N)N)N)C)O)O)O)N	{32: 1, 1: 4, 2: 9, 3: 10, 41: 2, 12: 15, 14: 4, 35: 5, 20: 11, 22: 3, 23: 3, 24: 7, 28: 1, 30: 7, 31: 6}
Did not match all atoms present	76089-77-5	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ce+3]	{16: 9, 4: 3, 29: 9}
Did not match all atoms present	76095-16-4	CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)O.C(=C\C(=O)O)\C(=O)O	{1: 2, 2: 3, 3: 2, 6: 2, 33: 1, 11: 3, 12: 1, 14: 5, 24: 1, 27: 3, 28: 1, 31: 1}
Did not match all atoms present	76095-53-9	C(CCl)P(=O)(O)O.NN	{17: 1, 2: 2, 20: 2, 29: 1, 30: 2}
Did not match all atoms present	761-02-4	CCN(CC)CC.NS(=O)(=O)O	{1: 3, 2: 3, 33: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	7612-96-6	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=C=S	{8: 1, 34: 3, 14: 9}
Did not match all atoms present	7612-98-8	CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=C=S	{8: 1, 1: 2, 34: 3, 14: 8, 33: 1}
Did not match all atoms present	76123-46-1	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Mg+2].[Ca+2]	{24: 4, 1: 4}
Did not match all atoms present	7613-16-3	C(CCCC[NH3+])CCC[NH3+].[Cl-].[Cl-]	{17: 2, 2: 8}
Did not match all atoms present	7614-64-4	CCCCCCCCCCNC(=S)NCCCCCCCCCC	{1: 2, 2: 18, 31: 2, 7: 1}
Did not match all atoms present	76145-76-1	CC(C)N1C2=C(C3=CC=CC=C3C=C2)N=C1C4=CC=C(C=C4)OC	{1: 3, 3: 1, 33: 1, 14: 10, 35: 1, 22: 1}
Did not match all atoms present	76149-14-9	C1=CC(=C(C=C1I)O)O	{19: 1, 21: 2, 14: 3}
Did not match all atoms present	7615-57-8	C(#N)C1=NC(=NC(=N1)C#N)C#N	{35: 3, 37: 3}
Did not match all atoms present	7616-22-0	CC1=C(C=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)O	{1: 7, 2: 9, 3: 3, 11: 2, 13: 1, 14: 1, 21: 1, 23: 1}
Did not match all atoms present	7616-83-3	[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Hg+2]	{17: 2, 29: 8}
Did not match all atoms present	76160-34-4	C1=CC=C(C(=C1)C(=O)C2=CC=CC=N2)Br	{24: 1, 18: 1, 35: 1, 14: 8}
Did not match all atoms present	76160-35-5	C1=CC=C(C(=C1)C(=O)C2=CC=CC=N2)I	{24: 1, 35: 1, 19: 1, 14: 8}
Did not match all atoms present	7617-57-4	C1=CC=C(C(=C1)N=O)N=O	{34: 2, 29: 2, 14: 4}
Did not match all atoms present	7617-67-6	C(CBr)S(=O)(=O)CCBr	{2: 4, 18: 2, 29: 2}
Did not match all atoms present	76175-45-6	C1COC(CN1)C2=CC=CS2.Cl	{32: 1, 41: 1, 11: 3, 12: 1, 14: 3, 17: 1, 23: 1}
Did not match all atoms present	76180-96-6	CN1C2=C(C3=C(C=C2)N=CC=C3)N=C1N	{1: 1, 35: 2, 30: 1, 14: 5, 33: 1}
Did not match all atoms present	76189-55-4	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8	{14: 32}
Did not match all atoms present	76193-89-0	CC1=CC=CC(=C1)C=NC2=C(C=C(C=C2)[N+](=O)[O-])C	{1: 2, 34: 1, 38: 1, 14: 7, 6: 1}
Did not match all atoms present	76193-90-3	CC1=CC=CC(=C1)C=NC2=C(C=C(C=C2C)[N+](=O)[O-])C	{1: 3, 34: 1, 38: 1, 14: 6, 6: 1}
Did not match all atoms present	762-04-9	CCO[P+](=O)OCC	{1: 2, 2: 2, 29: 1, 22: 2}
Did not match all atoms present	762-66-3	C[Ge](C)(C)CC=C	{1: 3, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	762-70-9	C(CCl)S(=O)(=O)F	{16: 1, 17: 1, 2: 2, 29: 2}
Did not match all atoms present	762-72-1	C[Si](C)(C)CC=C	{1: 3, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	762-73-2	C[Sn](C)(C)CC=C	{1: 3, 2: 1, 5: 1, 6: 1}
Did not match all atoms present	762-75-4	CC(C)(C)OC=O	{1: 3, 26: 1, 4: 1}
Did not match all atoms present	7620-46-4	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N=C=S	{8: 1, 34: 1, 35: 1, 14: 8}
Did not match all atoms present	7620-71-5	CC[N+](CC)(CC)C1=CC=CC=C1.[OH-]	{1: 3, 2: 3, 14: 5}
Did not match all atoms present	76204-55-2	CCCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 16, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-56-3	CCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 15, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-57-4	CCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 14, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-58-5	CCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 13, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-59-6	CCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 12, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-60-9	CCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 11, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-61-0	CCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 10, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-62-1	CCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 9, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-63-2	CCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 8, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-64-3	CCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 7, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-65-4	CCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 6, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-66-5	CCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 5, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76204-68-7	CCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 3, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76206-36-5	CCN(C(=O)OC1=CC=CC2=CC=CC=C21)N=O	{1: 1, 2: 1, 33: 1, 34: 1, 14: 7, 28: 1, 29: 1}
Did not match all atoms present	76206-37-6	CCCN(C(=O)OC1=CC=CC2=CC=CC=C21)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 14: 7, 28: 1, 29: 1}
Did not match all atoms present	76206-38-7	CCCCN(C(=O)OC1=CC=CC2=CC=CC=C21)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 14: 7, 28: 1, 29: 1}
Did not match all atoms present	7621-86-5	C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)N)N	{32: 1, 35: 1, 30: 2, 14: 7}
Did not match all atoms present	76212-79-8	CCCCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)CC	{1: 2, 2: 17, 34: 2, 14: 8, 24: 1, 28: 1}
Did not match all atoms present	76213-48-4	CCC(=CC1=[N+](C2=CC=CC=C2[Se]1)CCC(C)S(=O)(=O)[O-])C=C3N(C4=C(O3)C=CC(=C4)C5=CC=CC=C5)C	{1: 3, 2: 3, 3: 1, 33: 2, 6: 2, 7: 1, 14: 12, 15: 1, 23: 1, 29: 3}
Did not match all atoms present	7622-21-1	C1=CC=C(C=C1)C[C@@H](C(=O)OCC2=CC=CC=C2)O	{28: 1, 2: 2, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	7622-22-2	C1=CC=C(C=C1)C[C@H](C(=O)OCC2=CC=CC=C2)O	{28: 1, 2: 2, 3: 1, 20: 1, 14: 10}
Did not match all atoms present	7624-74-0	CC(CN(C)C)N1C2=CC=CC=C2SC3=C1C=C(C=C3)OC	{1: 4, 2: 1, 3: 1, 33: 2, 41: 1, 14: 7, 22: 1}
Did not match all atoms present	76246-37-2	C[Pb](C)(C)C1=CC=C(C=C1)[Pb](C)(C)C	{1: 6, 14: 4}
Did not match all atoms present	76246-38-3	C[Sn](C)(C)C1=CC=C(C2=CC=CC=C21)[Sn](C)(C)C	{1: 6, 14: 6}
Did not match all atoms present	76263-73-5	CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]3[C@H](N(N=C3C4=C2C=CC(=C4)OC)C(=O)C)C5=CC=CC=C5	{1: 3, 35: 1, 33: 2, 11: 1, 12: 2, 14: 12, 15: 1, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	76266-17-6	C1=CC=C2C=C3C(=CC2=C1)C3(F)F	{16: 2, 13: 1, 14: 6}
Did not match all atoms present	7627-80-7	C1(=C(C(=NN=C1F)F)F)F	{16: 4, 35: 2}
Did not match all atoms present	76274-62-9	C1=CC(=CC=C1N=C=S)S(=O)(=O)[O-].[Na+]	{8: 1, 34: 1, 29: 3, 14: 4}
Did not match all atoms present	76283-09-5	C1=CC(=C(C=C1Br)F)CBr	{16: 1, 2: 1, 18: 2, 14: 3}
Did not match all atoms present	76293-36-2	CC(=O)/C=C/C1=CC=CC=C1I	{24: 1, 1: 1, 19: 1, 14: 4, 6: 2}
Did not match all atoms present	76293-37-3	CC(=O)/C=C/C1=CC=CC=C1C(F)(F)F	{1: 1, 4: 1, 6: 2, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	76293-38-4	C1=CC=C(C(=C1)/C=C\C2=CC=CC=N2)F	{16: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	76293-40-8	C1=CC=C(C(=C1)/C=C\C2=CC=CC=N2)Br	{18: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	76298-68-5	CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]3[C@H](N(N=C3C4=CC=CC=C42)C(=O)C)C5=CC=CC=C5	{1: 2, 35: 1, 33: 2, 11: 1, 12: 2, 14: 13, 15: 1, 24: 1, 29: 2}
Did not match all atoms present	763-14-4	CCCOP(=O)(C)F	{16: 1, 1: 2, 2: 2, 29: 1, 22: 1}
Did not match all atoms present	7631-46-1	COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.I[I-]I.I[I-]I.I[I-]I.I[I-]I	{1: 3, 3: 3, 5: 3, 6: 3, 33: 3, 11: 12, 12: 9, 14: 15, 19: 12, 20: 15, 22: 3, 29: 12, 35: 3}
Did not match all atoms present	7631-86-9	O=[Si]=O	{29: 2}
Did not match all atoms present	7631-90-5	OS(=O)[O-].[Na+]	{20: 1, 29: 2}
Did not match all atoms present	7631-93-8	COC(=O)C1=CC=CC=C1[O-].[Na+]	{1: 1, 28: 1, 14: 4}
Did not match all atoms present	7631-94-9	[O-]S(=O)(=O)S(=O)(=O)[O-].[Na+].[Na+]	{29: 6}
Did not match all atoms present	7631-95-0	[O-][Mo](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	7631-98-3	CCCCCCCCCCCCN(C)CC(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 12, 33: 1}
Did not match all atoms present	7631-99-4	[N+](=O)([O-])[O-].[Na+]	{}
Did not match all atoms present	7632-00-0	N(=O)[O-].[Na+]	{34: 1, 29: 2}
Did not match all atoms present	7632-04-4	O=BO[O-].[Na+]	{29: 2, 22: 1}
Did not match all atoms present	7632-50-0	C(C(=O)O)C(CC(=O)[O-])(C(=O)O)O.[NH4+]	{24: 1, 20: 1, 2: 2, 27: 2, 4: 1}
Did not match all atoms present	7632-51-1	[Cl-].[Cl-].[Cl-].[Cl-].[V+4]	{17: 4}
Did not match all atoms present	76324-28-2	C1=CC=C(C=C1)OC2=CC=C(C=C2)C(Cl)(Cl)Cl	{17: 3, 4: 1, 22: 1, 14: 9}
Did not match all atoms present	76326-31-3	C(CC(C(=O)O)N)CP(=O)(O)O	{2: 3, 3: 1, 20: 2, 27: 1, 29: 1, 30: 1}
Did not match all atoms present	7633-57-0	C1CN(C2=CC=CC=C21)N=O	{33: 1, 34: 1, 11: 2, 29: 1, 14: 4}
Did not match all atoms present	7634-74-4	CCCCC1=CC2=C(C=C1)N=CC=C2	{1: 1, 2: 3, 35: 1, 14: 6}
Did not match all atoms present	7635-51-0	C[C@H]1[C@@H](OCCN1C)C2=CC=CC=C2.Cl	{1: 2, 33: 1, 11: 2, 12: 2, 14: 5, 17: 1, 23: 1}
Did not match all atoms present	76359-37-0	CC1=CC(=NN=C2C(=CC3=C(C2=O)C=CC(=C3)NC4=CC=CC=C4)S(=O)(=O)[O-])C(=O)C=C1NNC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Cu]	{1: 1, 34: 2, 14: 16, 15: 5, 25: 2, 29: 9, 31: 3}
Did not match all atoms present	7637-07-2	B(F)(F)F	{16: 3}
Did not match all atoms present	7637-13-0	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Sn+4]	{24: 4, 1: 4, 2: 64}
Did not match all atoms present	76374-09-9	C[C@H]([C-]1C=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3)N(C)C.[CH-]1C=CC=C1.Cl[Pd]Cl.[Fe+2]	{1: 3, 3: 1, 33: 1, 14: 18, 17: 2}
Did not match all atoms present	76393-16-3	CCOC(=O)C1=CC=CC=C1N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 28: 1, 29: 1}
Did not match all atoms present	764-65-8	C(CCC(=O)[O-])CC(=O)[O-]	{24: 2, 2: 4}
Did not match all atoms present	764-71-6	CCCCCCCC(=O)O.[K+]	{1: 1, 2: 6, 27: 1}
Did not match all atoms present	7640-33-7	C1=CC2=C(C(=C(C=C2Cl)Br)O)N=C1	{17: 1, 18: 1, 35: 1, 21: 1, 14: 4}
Did not match all atoms present	76412-62-9	CCCCOC1=NC(=NC2=C1NC=N2)N	{32: 1, 1: 1, 2: 3, 35: 3, 14: 1, 22: 1, 30: 1}
Did not match all atoms present	76419-97-1	CC1C2=CC(=C(C=C2CCN1)O)OC	{32: 1, 1: 2, 11: 2, 12: 1, 14: 2, 21: 1, 22: 1}
Did not match all atoms present	7643-08-5	CSC1=CC2=C(C=C1)SC3=CC=CC=C3N2	{32: 1, 1: 1, 41: 1, 14: 7, 40: 1}
Did not match all atoms present	7644-67-9	C(CC(=O)N[C@@H](CC/C(=C/[N+]#N)/[O-])C(=O)N[C@@H](CC/C(=C\[N+]#N)/[O-])C(=O)O)[C@@H](C(=O)[O-])N.[Na+]	{2: 6, 3: 3, 6: 2, 7: 2, 34: 2, 24: 3, 27: 1, 30: 1, 31: 2}
Did not match all atoms present	7646-69-7	[H-].[Na+]	{}
Did not match all atoms present	7646-78-8	Cl[Sn](Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	7646-79-9	Cl[Co]Cl	{17: 2}
Did not match all atoms present	7646-85-7	[Cl-].[Cl-].[Zn+2]	{17: 2}
Did not match all atoms present	7646-93-7	OS(=O)(=O)[O-].[K+]	{20: 1, 29: 3}
Did not match all atoms present	7647-10-1	Cl[Pd]Cl	{17: 2}
Did not match all atoms present	7647-14-5	[Na+].[Cl-]	{17: 1}
Did not match all atoms present	7647-15-6	[Na+].[Br-]	{18: 1}
Did not match all atoms present	7647-17-8	[Cl-].[Cs+]	{17: 1}
Did not match all atoms present	7647-18-9	[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sb+5]	{17: 5}
Did not match all atoms present	7647-19-0	FP(F)(F)(F)F	{16: 5}
Did not match all atoms present	7648-01-3	CCN1C(=O)CSC1=S	{1: 1, 2: 1, 33: 1, 41: 1, 11: 1, 15: 1, 25: 1}
Did not match all atoms present	76487-56-4	COC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCC=C	{1: 1, 2: 2, 5: 1, 6: 1, 14: 8, 22: 2, 28: 1}
Did not match all atoms present	76487-65-5	CC/C(=C(/C1=CC=CC=C1)\C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 5, 4: 1, 33: 1, 7: 2, 14: 14, 20: 1, 22: 1, 27: 3}
Did not match all atoms present	765-50-4	C1=CSC(=C1)CCl	{17: 1, 2: 1, 14: 3, 41: 1}
Did not match all atoms present	765-58-2	CC1=CC=C(S1)Br	{1: 1, 18: 1, 14: 2, 41: 1}
Did not match all atoms present	765-71-9	CC1=CC=C(N1N)C	{1: 2, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	7650-88-6	C1CCC(C1)P(C2CCCC2)C3CCCC3	{11: 12, 12: 3}
Did not match all atoms present	7650-89-7	C1=CC=C(C=C1)CP(CC2=CC=CC=C2)CC3=CC=CC=C3	{2: 3, 14: 15}
Did not match all atoms present	7650-91-1	C1=CC=C(C=C1)CP(C2=CC=CC=C2)C3=CC=CC=C3	{2: 1, 14: 15}
Did not match all atoms present	7651-40-3	CCC#CC(C)C1(C(=O)NC(=S)NC1=O)CC=C	{32: 2, 1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 10: 2, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	7651-60-7	C1=C[Se]C(=C1)C#N	{37: 1, 14: 3}
Did not match all atoms present	7651-83-4	C1=CC(=CC2=C1C=CN=C2)O	{35: 1, 21: 1, 14: 6}
Did not match all atoms present	7651-99-2	C(CN(CP(=O)(O)[O-])CP(=O)([O-])[O-])N(CP(=O)(O)[O-])CP(=O)(O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 6, 20: 3, 29: 9}
Did not match all atoms present	76513-69-4	C[Si](C)(C)CCOCCl	{1: 3, 2: 3, 22: 1, 17: 1}
Did not match all atoms present	7652-06-4	C[Si](C)(C)C#CCl	{1: 3, 10: 2, 17: 1}
Did not match all atoms present	7652-64-4	CC1CN1C(=O)C2=CC(=CC=C2)C(=O)N3CC3C	{1: 2, 33: 2, 11: 2, 12: 2, 14: 4, 24: 2}
Did not match all atoms present	76526-07-3	C1=CC=C(C=C1)/C(=C/C(=O)C2=CC=C(C=C2)Br)/S	{6: 1, 39: 1, 7: 1, 14: 9, 18: 1, 24: 1}
Did not match all atoms present	76526-09-5	COC1=CC=C(C=C1)C(=O)/C=C(/C2=CC=CC=C2)\S	{1: 1, 6: 1, 7: 1, 39: 1, 14: 9, 22: 1, 24: 1}
Did not match all atoms present	76530-22-8	CCN(CC)C1=CC=C(C=C1)C(=O)[C@@H](C2=CC=C(C=C2)O)O	{1: 2, 2: 2, 3: 1, 33: 1, 14: 8, 20: 1, 21: 1, 24: 1}
Did not match all atoms present	76530-23-9	[Li+].[Li+].COC1=C(C=CC(=C1)N=NC2=CC(=CC=C2)S(=O)(=O)[O-])NC(=O)NC3=C(C=C(C=C3)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])OC	{1: 2, 34: 4, 14: 14, 22: 2, 24: 1, 29: 6, 31: 2}
Did not match all atoms present	76530-24-0	[Li+].[Li+].C1=CC(=CC=C1NC(=O)NC2=CC=C(C=C2)N/N=C\3/C=CC(=O)C(=C3)C(=O)[O-])N/N=C/4\C=CC(=O)C(=C4)C(=O)[O-]	{34: 2, 14: 14, 15: 4, 24: 3, 25: 2, 31: 4}
Did not match all atoms present	7654-03-7	CC(C1=CC=CC=C1)NNC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 3: 1, 14: 10, 31: 2}
Did not match all atoms present	76541-59-8	COC1=NC(=NC=C1)SC	{40: 1, 1: 2, 35: 2, 22: 1, 14: 2}
Did not match all atoms present	76541-72-5	COP(=O)(C(C1=CC=C(C=C1)Cl)OP(=O)(OC)OC)OC	{1: 4, 3: 1, 14: 4, 17: 1, 22: 5, 29: 2}
Did not match all atoms present	7657-09-2	C1=CC(=C(C=C1Br)C(F)(F)F)Br	{16: 3, 18: 2, 4: 1, 14: 3}
Did not match all atoms present	76573-19-8	C[Se]C=C	{1: 1, 5: 1, 6: 1}
Did not match all atoms present	76578-14-8	CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl	{1: 2, 2: 1, 3: 1, 14: 8, 17: 1, 35: 2, 22: 2, 28: 1}
Did not match all atoms present	7658-80-2	CC1=CC=CC=C1C(=O)NN	{24: 1, 1: 1, 30: 1, 14: 4, 31: 1}
Did not match all atoms present	76584-98-0	CC=C.CC=C.CC=C.CC=C.CC1=C(C(=CC=C1)O)C.C=CC1=CC=CC=C1	{1: 6, 14: 8, 5: 5, 6: 5, 21: 1}
Did not match all atoms present	766-08-5	C[Si]C1=CC=CC=C1	{1: 1, 14: 5}
Did not match all atoms present	766-46-1	C#CC1=CC=CC=C1Br	{9: 1, 10: 1, 18: 1, 14: 4}
Did not match all atoms present	766-47-2	CC1=CC=CC=C1C#C	{1: 1, 10: 1, 14: 4, 9: 1}
Did not match all atoms present	766-49-4	C#CC1=CC=CC=C1F	{16: 1, 9: 1, 10: 1, 14: 4}
Did not match all atoms present	766-51-8	COC1=CC=CC=C1Cl	{1: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	766-55-2	C1=CC2=NC=CN2N=C1	{33: 1, 35: 2, 14: 5}
Did not match all atoms present	766-76-7	O=C([O-])c1ccccc1	{24: 1, 14: 5}
Did not match all atoms present	766-77-8	C[Si](C)C1=CC=CC=C1	{1: 2, 14: 5}
Did not match all atoms present	766-80-3	C1=CC(=CC(=C1)Cl)CBr	{17: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	766-81-4	C#CC1=CC(=CC=C1)Br	{9: 1, 10: 1, 18: 1, 14: 4}
Did not match all atoms present	766-82-5	CC1=CC=CC(=C1)C#C	{1: 1, 10: 1, 14: 4, 9: 1}
Did not match all atoms present	766-83-6	C#CC1=CC(=CC=C1)Cl	{9: 1, 10: 1, 14: 4, 17: 1}
Did not match all atoms present	766-84-7	C1=CC(=CC(=C1)Cl)C#N	{17: 1, 37: 1, 14: 4}
Did not match all atoms present	766-85-8	COC1=CC(=CC=C1)I	{1: 1, 19: 1, 22: 1, 14: 4}
Did not match all atoms present	766-90-5	C/C=C\C1=CC=CC=C1	{1: 1, 14: 5, 6: 2}
Did not match all atoms present	766-91-6	C1=CC=C(C=C1)C=[N+]=[N-]	{34: 1, 14: 5, 6: 1}
Did not match all atoms present	766-92-7	CSCC1=CC=CC=C1	{40: 1, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	766-94-9	C=COC1=CC=CC=C1	{14: 5, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	766-95-0	CCC1=CC=C(N1)CC	{32: 1, 1: 2, 2: 2, 14: 2}
Did not match all atoms present	766-96-1	C#CC1=CC=C(C=C1)Br	{9: 1, 10: 1, 18: 1, 14: 4}
Did not match all atoms present	766-97-2	CC1=CC=C(C=C1)C#C	{1: 1, 10: 1, 14: 4, 9: 1}
Did not match all atoms present	766-98-3	C#CC1=CC=C(C=C1)F	{16: 1, 9: 1, 10: 1, 14: 4}
Did not match all atoms present	7660-71-1	CC(C(C1=CC(=C(C=C1)O)NS(=O)(=O)C)O)NCCC2=CC=C(C=C2)OC	{1: 3, 2: 2, 3: 2, 14: 7, 20: 1, 21: 1, 22: 1, 29: 2, 31: 2}
Did not match all atoms present	7661-32-7	C1CC(=O)N(C1)C2=CC=C(C=C2)Br	{25: 1, 18: 1, 11: 3, 14: 4, 33: 1}
Did not match all atoms present	7661-33-8	C1CC(=O)N(C1)C2=CC=C(C=C2)Cl	{17: 1, 11: 3, 33: 1, 14: 4, 25: 1}
Did not match all atoms present	7661-39-4	CCCCC1=NC2=CC=CC=C2C=C1	{1: 1, 2: 3, 35: 1, 14: 6}
Did not match all atoms present	7661-55-4	CC1=C2C=CC=NC2=CC=C1	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	76615-66-2	C[N+](C)(C)CCC[Si](C)(C)CC[Si](C)(C)CCC[N+](C)(C)C.[I-].[I-]	{1: 10, 2: 8, 19: 2}
Did not match all atoms present	76619-89-1	CC1=CC(=CC(=C1)O)N	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	76619-91-5	COC(=S)C(=C(Cl)Cl)Cl	{1: 1, 17: 3, 22: 1, 7: 3}
Did not match all atoms present	7662-51-3	C1=CC(=CC=C1C[C@@H](C(=O)NN)N)O	{2: 1, 3: 1, 14: 4, 21: 1, 24: 1, 30: 2, 31: 1}
Did not match all atoms present	76620-00-3	CCC1=CC=C(C=C1)N2C(=O)C=CC2=O	{1: 1, 2: 1, 33: 1, 14: 6, 25: 2}
Did not match all atoms present	7664-38-2	OP(=O)(O)O	{20: 3, 29: 1}
Did not match all atoms present	7664-41-7	N	{}
Did not match all atoms present	7664-93-9	OS(=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	76648-01-6	CCN1CCN(C(=O)C1=O)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@]2([C@@H]3N(C2=O)C(=C(CS3)CSC4=NN=NN4C)C(=O)[O-])OC.[Na+]	{1: 4, 2: 2, 3: 2, 33: 4, 40: 1, 41: 1, 11: 3, 12: 1, 13: 1, 15: 2, 35: 3, 20: 1, 22: 1, 24: 3, 25: 3, 31: 2}
Did not match all atoms present	76674-14-1	C1=CC(=CC=C1C(CN2C=NC=N2)(C3=CC=C(C=C3)F)O)F	{33: 1, 2: 1, 35: 2, 4: 1, 14: 10, 16: 2, 20: 1}
Did not match all atoms present	76674-21-0	C1=CC=C(C(=C1)C(CN2C=NC=N2)(C3=CC=C(C=C3)F)O)F	{33: 1, 2: 1, 35: 2, 4: 1, 14: 10, 16: 2, 20: 1}
Did not match all atoms present	76684-21-4	C1=CC=C(C=C1)C#P	{10: 1, 14: 5}
Did not match all atoms present	7669-54-7	C1=CC=C(C(=C1)[N+](=O)[O-])SCl	{40: 1, 17: 1, 38: 1, 14: 4}
Did not match all atoms present	76698-72-1	CC1=CC=C(C=C1)C[Se]CC2=CC=C(C=C2)C	{1: 2, 2: 2, 14: 8}
Did not match all atoms present	76698-82-3	CC(=O)C1CCCCC1=S	{24: 1, 1: 1, 11: 4, 12: 1, 15: 1}
Did not match all atoms present	767-00-0	C1=CC(=CC=C1C#N)O	{21: 1, 14: 4, 37: 1}
Did not match all atoms present	767-15-7	CC1=CC(=NC(=N1)N)C	{1: 2, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	767-16-8	CC1=NC(=O)C=C(N1)N	{32: 1, 1: 1, 35: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	767-17-9	C1(=NC(=S)N=C(N1)N)N	{32: 1, 35: 2, 30: 2}
Did not match all atoms present	767-58-8	CC1CCC2=CC=CC=C12	{1: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	767-59-9	CC1C=CC2=CC=CC=C12	{1: 1, 12: 1, 14: 6}
Did not match all atoms present	767-60-2	CC1=CCC2=CC=CC=C12	{1: 1, 11: 1, 14: 5, 15: 1}
Did not match all atoms present	767-64-6	C1=CC2=NSN=C2C(=C1)N	{41: 1, 35: 2, 30: 1, 14: 3}
Did not match all atoms present	767-71-5	CC1=C(C(=CC=C1)C)NC	{1: 3, 14: 3, 31: 1}
Did not match all atoms present	767-79-3	C1(=C(N=C(N=C1F)F)F)F	{16: 4, 35: 2}
Did not match all atoms present	767-88-4	CN1C=CC=C(C1=O)C#N	{1: 1, 37: 1, 33: 1, 14: 3, 25: 1}
Did not match all atoms present	767-99-7	C/C=C(/C)c1ccccc1	{1: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	76706-59-7	C1=CC(=NC=C1C(=O)NO)N	{35: 1, 14: 3, 20: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	7671-49-0	C(CCI)CS(=O)(=O)[O-].[Na+]	{2: 4, 19: 1, 29: 3}
Did not match all atoms present	76710-52-6	CN(CCO[Si](C)(C)C)CCO[Si](C)(C)C	{1: 7, 2: 4, 22: 2, 33: 1}
Did not match all atoms present	7672-94-8	C1=CC2=C(C=C1Cl)C(=O)NC(=S)O2	{32: 1, 17: 1, 25: 1, 14: 3, 23: 1}
Did not match all atoms present	7673-07-6	C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3.[Cl-]	{17: 1, 2: 3, 14: 15}
Did not match all atoms present	7673-09-8	C1(=NC(=NC(=N1)NCl)NCl)NCl	{17: 3, 35: 3, 31: 3}
Did not match all atoms present	76734-92-4	C[Si](C)(C)OC(=O)C#CC(=O)O[Si](C)(C)C	{1: 6, 10: 2, 28: 2}
Did not match all atoms present	76738-28-8	C1[C@H](N=C(O1)C(Cl)Cl)[C@@H](C2=CC=C(C=C2)[N+](=O)[O-])O	{3: 2, 38: 1, 11: 1, 12: 1, 14: 4, 15: 1, 17: 2, 35: 1, 20: 1, 23: 1}
Did not match all atoms present	76738-62-0	CC(C)(C)[C@@H]([C@H](CC1=CC=C(C=C1)Cl)N2C=NC=N2)O	{1: 3, 2: 1, 3: 2, 4: 1, 33: 1, 14: 6, 17: 1, 35: 2, 20: 1}
Did not match all atoms present	7674-36-4	C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3N)N	{33: 1, 2: 1, 35: 3, 30: 2, 14: 6}
Did not match all atoms present	76748-63-5	C1=CC2=C3C(=C1)C4=C5C=CC6=C7C5=C8C9=C(C=CC1=C9C7=C(C=C1)C=C6)C1=C8C4=C4C3=C(C=C2)C=CC4=C1	{14: 16}
Did not match all atoms present	76749-37-6	CC(=O)ONC(=O)C1=CC2=CC=CC=C2C=C1	{24: 1, 1: 1, 28: 1, 14: 7, 31: 1}
Did not match all atoms present	7677-24-9	C[Si](C)(C)C#N	{1: 3, 37: 1}
Did not match all atoms present	76782-82-6	CC(C)(C)[Si](C)(C)OCC#C	{1: 5, 2: 1, 4: 1, 9: 1, 10: 1, 22: 1}
Did not match all atoms present	76783-59-0	CCOC(=O)C1=CC(=CC=C1)C(F)(F)F	{1: 1, 2: 1, 4: 1, 14: 4, 16: 3, 28: 1}
Did not match all atoms present	76790-18-6	CCC(=O)ONC(=O)C1=CC2=CC=CC=C2C=C1	{1: 1, 2: 1, 14: 7, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	76790-19-7	CCCCOC1=CC=C(C=C1)CC(=O)NOC=O	{1: 1, 2: 4, 14: 4, 22: 1, 24: 1, 26: 1, 31: 1}
Did not match all atoms present	76792-07-9	C=[Co]	{5: 1}
Did not match all atoms present	76795-95-4	C[Si](C)(C)O[Si]1(CC=CC1)O[Si](C)(C)C	{1: 6, 11: 2, 22: 2, 14: 2}
Did not match all atoms present	76797-74-5	[V].[Fe]	{}
Did not match all atoms present	768-00-3	C/C=C(\C)c1ccccc1	{1: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	768-03-6	C=CC(=O)C1=CC=CC=C1	{24: 1, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	768-22-9	C1C2C(O2)C3=CC=CC=C31	{11: 1, 12: 2, 14: 4, 23: 1}
Did not match all atoms present	768-29-6	C1(=NN=C(O1)N)C(F)(F)F	{16: 3, 35: 2, 4: 1, 30: 1, 23: 1}
Did not match all atoms present	768-32-1	C[Si](C)(C)C1=CC=CC=C1	{1: 3, 14: 5}
Did not match all atoms present	768-33-2	C[Si](C)(C1=CC=CC=C1)Cl	{1: 2, 14: 5, 17: 1}
Did not match all atoms present	768-35-4	B(C1=CC(=CC=C1)F)(O)O	{16: 1, 20: 2, 14: 4}
Did not match all atoms present	768-49-0	CC(=CC1=CC=CC=C1)C	{1: 2, 14: 5, 6: 1, 7: 1}
Did not match all atoms present	768-52-5	CC(C)NC1=CC=CC=C1	{1: 2, 3: 1, 14: 5, 31: 1}
Did not match all atoms present	768-56-9	C=CCCC1=CC=CC=C1	{2: 2, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	768-59-2	CCC1=CC=C(C=C1)CO	{1: 1, 2: 2, 20: 1, 14: 4}
Did not match all atoms present	768-60-5	COC1=CC=C(C=C1)C#C	{1: 1, 10: 1, 22: 1, 14: 4, 9: 1}
Did not match all atoms present	7681-11-0	[K+].[I-]	{19: 1}
Did not match all atoms present	7681-15-4	CCCOC(=O)C1=CN=CC=C1	{1: 1, 2: 2, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	7681-38-1	OS(=O)(=O)[O-].[Na+]	{20: 1, 29: 3}
Did not match all atoms present	7681-49-4	[F-].[Na+]	{16: 1}
Did not match all atoms present	7681-52-9	[Na+].[O-]Cl	{17: 1, 29: 1}
Did not match all atoms present	7681-53-0	[O-]P=O.[Na+]	{29: 2}
Did not match all atoms present	7681-55-2	[O-]I(=O)=O.[Na+]	{19: 1, 29: 3}
Did not match all atoms present	7681-57-4	[O-]S(=O)S(=O)(=O)[O-].[Na+].[Na+]	{29: 5}
Did not match all atoms present	7681-65-4	[Cu]I	{19: 1}
Did not match all atoms present	7681-76-7	CN1C(=CN=C1COC(=O)N)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 14: 1, 28: 1, 30: 1}
Did not match all atoms present	7681-82-5	[Na+].[I-]	{19: 1}
Did not match all atoms present	7681-85-8	C1=CC(=CC=C1C(=O)N)[As](SCC(=O)[O-])SCC(=O)[O-].[Na+].[Na+]	{24: 3, 40: 2, 2: 2, 30: 1, 14: 4}
Did not match all atoms present	7682-90-8	CCOP(=S)(OCC)OC1=NN2C(=CC(=NC2=C1Br)C)C	{1: 4, 2: 2, 35: 2, 33: 1, 14: 1, 18: 1, 22: 3}
Did not match all atoms present	76822-96-3	CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@@H]5CCCN5C(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)N	{1: 10, 2: 54, 3: 36, 36: 3, 33: 3, 7: 3, 11: 9, 12: 3, 14: 8, 20: 8, 21: 2, 24: 48, 39: 6, 27: 2, 30: 10, 31: 45}
Did not match all atoms present	76824-35-6	C1=C(N=C(S1)N=C(N)N)CSCCC(=NS(=O)(=O)N)N	{34: 2, 35: 1, 7: 2, 40: 1, 41: 1, 2: 3, 14: 1, 29: 2, 30: 4}
Did not match all atoms present	76826-48-7	B(C(C)(C)C)(C(C)(C)C)N(C)C	{1: 8, 4: 2, 33: 1}
Did not match all atoms present	7683-59-2	CC(C)NCC(C1=CC(=C(C=C1)O)O)O	{1: 2, 2: 1, 3: 2, 14: 3, 20: 1, 21: 2, 31: 1}
Did not match all atoms present	76835-20-6	CC1=C(C=C(C=C1)Cl)N2CCNCC2	{32: 1, 1: 1, 33: 1, 11: 4, 14: 3, 17: 1}
Did not match all atoms present	76836-02-7	C1CN(CCN1CCS(=O)(=O)[O-])CCS(=O)(=O)[O-].[Na+].[Na+]	{33: 2, 2: 4, 11: 4, 29: 6}
Did not match all atoms present	76841-70-8	CCCC=CCO.C1=CC=C(C=C1)C(=O)O	{1: 1, 2: 3, 6: 2, 14: 5, 20: 1, 27: 1}
Did not match all atoms present	76841-99-1	CC1(C[C@@H](C(N1O)(C)C)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C)C	{1: 6, 33: 2, 11: 1, 12: 1, 13: 2, 14: 6, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	76843-75-9	C1=CC=C(C=C1)C2=NS/N=C(/N=S=N2)\C3=CC=CC=C3	{41: 2, 35: 4, 14: 10, 15: 2}
Did not match all atoms present	76849-19-9	C#CCN(CC1=CC2=C(C=C1)NC(=NC2=O)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O	{32: 1, 33: 1, 2: 4, 3: 1, 9: 1, 10: 1, 14: 7, 35: 1, 24: 1, 25: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	76858-94-1	C(CP(C1=C(C(=C(C(=C1F)F)F)F)F)C2=C(C(=C(C(=C2F)F)F)F)F)P(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F	{16: 20, 2: 2}
Did not match all atoms present	7686-25-1	CCCCCCCCC1=CC=C(C=C1)C	{1: 2, 2: 7, 14: 4}
Did not match all atoms present	7687-09-4	CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=[N+]2[O-]	{1: 2, 34: 2, 29: 1, 14: 8, 33: 2}
Did not match all atoms present	7687-49-2	CC1(OCC2C(O1)C(C(O2)N3C=NC4=C3N=CN=C4N)O)C	{1: 2, 35: 3, 33: 1, 11: 1, 12: 4, 13: 1, 14: 2, 20: 1, 23: 3, 30: 1}
Did not match all atoms present	76871-75-5	C1CC(=C(C(=CC=C2C=C(SC3=CC=CC=C32)C4=CC=CC=C4)C1)Cl)C=CC5=CC(SC6=CC=CC=C65)C7=CC=CC=C7	{6: 4, 41: 2, 11: 3, 12: 1, 14: 20, 15: 6, 17: 1}
Did not match all atoms present	76876-70-5	C1CN(CCC1CCO)CC2=CC=CC=C2	{33: 1, 2: 3, 11: 4, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	7688-25-7	C1=CC=C(C=C1)P(CCCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{2: 4, 14: 20}
Did not match all atoms present	7689-03-4	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O	{1: 1, 2: 1, 35: 1, 33: 1, 11: 2, 13: 1, 14: 6, 20: 1, 25: 1, 28: 1}
Did not match all atoms present	769-06-2	CC1=C(C(=CC=C1)C)N(C)C	{1: 4, 14: 3, 33: 1}
Did not match all atoms present	769-10-8	CC1=C(C=CC=C1F)[N+](=O)[O-]	{16: 1, 1: 1, 38: 1, 14: 3}
Did not match all atoms present	769-25-5	CC1=CC(=C(C(=C1)C)C=C)C	{1: 3, 14: 2, 5: 1, 6: 1}
Did not match all atoms present	769-26-6	CC1=CC(=C(C(=C1)C)C#C)C	{1: 3, 10: 1, 14: 2, 9: 1}
Did not match all atoms present	769-28-8	CC1=CC(=C(C(=O)N1)C#N)C	{32: 1, 1: 2, 37: 1, 14: 1, 25: 1}
Did not match all atoms present	769-31-3	CC1=C2C=CC=CC=C2C=C1	{1: 1, 14: 7}
Did not match all atoms present	769-39-1	C1=C(C(=C(C(=C1F)F)O)F)F	{16: 4, 21: 1, 14: 1}
Did not match all atoms present	769-40-4	C1=C(C(=C(C(=C1F)F)S)F)F	{16: 4, 14: 1, 39: 1}
Did not match all atoms present	769-53-9	CC1=CC(=C(C=C1)N(C)C)C	{1: 4, 14: 3, 33: 1}
Did not match all atoms present	769-57-3	CC(=C(C)C1=CC=CC=C1)C	{1: 3, 14: 5, 7: 2}
Did not match all atoms present	769-68-6	CCC(C#N)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 37: 1, 14: 5}
Did not match all atoms present	769-78-8	C=COC(=O)C1=CC=CC=C1	{14: 5, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	769-92-6	CC(C)(C)C1=CC=C(C=C1)N	{1: 3, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	76903-88-3	C1=CC(=C(C=C1C(=O)Cl)F)F	{16: 2, 17: 1, 14: 3, 24: 1}
Did not match all atoms present	7691-02-3	C[Si](C)(C=C)N[Si](C)(C)C=C	{1: 4, 5: 2, 6: 2, 31: 1}
Did not match all atoms present	7693-26-7	[H-].[K+]	{}
Did not match all atoms present	7693-41-6	COC1=CC=C(C=C1)OC(=O)Cl	{1: 1, 28: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	7693-44-9	C1=CC(=CC=C1OC(=O)Cl)Br	{17: 1, 18: 1, 28: 1, 14: 4}
Did not match all atoms present	7693-45-0	C1=CC(=CC=C1OC(=O)Cl)Cl	{17: 2, 28: 1, 14: 4}
Did not match all atoms present	7693-46-1	C1=CC(=CC=C1[N+](=O)[O-])OC(=O)Cl	{17: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	7693-52-9	C1=CC(=C(C=C1Br)[N+](=O)[O-])O	{18: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	76932-48-4	CC(C)(C)OC(=O)N[C@H](CC1=CC=CC2=CC=CC=C21)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 7, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	76937-26-3	CCCCC1CC2=CC=CC=C2C1=O	{1: 1, 2: 3, 11: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	7695-91-2	CC1=C2C(=C(C(=C1C)OC(=O)C)C)CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C	{1: 9, 2: 9, 3: 3, 11: 2, 13: 1, 23: 1, 28: 1}
Did not match all atoms present	7697-37-2	[N+](=O)(O)[O-]	{20: 1}
Did not match all atoms present	7697-46-3	C1=CC=C(C=C1)C(=O)C2=CC=CN2	{24: 1, 32: 1, 14: 8}
Did not match all atoms present	7698-05-7	[2H]Cl	{17: 1}
Did not match all atoms present	7698-91-1	CNC(=O)C1=N[Se]N=C1N	{24: 1, 1: 1, 35: 2, 30: 1, 31: 1}
Did not match all atoms present	7698-97-7	CCC1C(C(CC=C1C2=CC=CC=C2)C(=O)O)C	{1: 2, 2: 1, 11: 1, 12: 3, 14: 6, 15: 1, 27: 1}
Did not match all atoms present	76985-09-6	C1=CC=C2C=C(C=CC2=C1)C[C@H](C(=O)O)N	{27: 1, 2: 1, 3: 1, 30: 1, 14: 7}
Did not match all atoms present	76985-10-9	CC(C)(C)OC(=O)N[C@H](CC1=CC2=CC=CC=C2C=C1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 7, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	7699-41-4	O[Si](=O)O	{20: 2, 29: 1}
Did not match all atoms present	7699-43-6	O=[Zr].Cl.Cl	{17: 2, 29: 1}
Did not match all atoms present	7699-45-8	[Zn+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	77-07-6	CN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O	{1: 1, 33: 1, 11: 7, 12: 2, 13: 1, 14: 3, 21: 1}
Did not match all atoms present	77-08-7	CC1(CC2(CC(C3=CC(=C(C=C32)O)O)(C)C)C4=CC(=C(C=C41)O)O)C	{1: 4, 11: 2, 13: 3, 14: 4, 21: 4}
Did not match all atoms present	77-09-8	C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O	{28: 1, 13: 1, 14: 12, 21: 2}
Did not match all atoms present	77-10-1	C1CCC(CC1)(C2=CC=CC=C2)N3CCCCC3	{33: 1, 11: 10, 13: 1, 14: 5}
Did not match all atoms present	77-14-5	CCC(=O)OC1(CCCN(CC1C)C)C2=CC=CC=C2	{1: 3, 2: 1, 33: 1, 11: 4, 12: 1, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	77-15-6	CCOC(=O)C1(CCCN(CC1)C)C2=CC=CC=C2	{1: 2, 2: 1, 33: 1, 11: 5, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	77-17-8	CCOC(=O)C1(CCNCC1)C2=CC=CC=C2	{32: 1, 1: 1, 2: 1, 11: 4, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	77-21-4	CCC1(CCC(=O)NC1=O)C2=CC=CC=C2	{32: 1, 1: 1, 2: 1, 11: 2, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	77-22-5	CCN(CC)CCOC(=O)C1(CCCC1)C2=CC=CC=C2	{1: 2, 2: 4, 33: 1, 11: 4, 13: 1, 14: 5, 28: 1}
Did not match all atoms present	77-23-6	CCN(CC)CCOCCOC(=O)C1(CCCC1)C2=CC=CC=C2	{1: 2, 2: 6, 33: 1, 11: 4, 13: 1, 14: 5, 22: 1, 28: 1}
Did not match all atoms present	77-27-0	CCCC(C)C1(C(=O)NC(=S)NC1=O)CC=C	{32: 2, 1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	77-36-1	C1=CC=C2C(=C1)C(=O)NC2(C3=CC(=C(C=C3)Cl)S(=O)(=O)N)O	{32: 1, 13: 1, 14: 7, 17: 1, 20: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	77-37-2	C1CCC(CC1)C(CCN2CCCC2)(C3=CC=CC=C3)O	{33: 1, 2: 2, 4: 1, 11: 9, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	77-38-3	CC(C1=CC=CC=C1)(C2=CC=C(C=C2)Cl)OCCN(C)C	{1: 3, 2: 2, 4: 1, 33: 1, 14: 9, 17: 1, 22: 1}
Did not match all atoms present	77-39-4	C1CCN(CC1)CCC(C2CCCC2)(C3=CC=CC=C3)O	{33: 1, 2: 2, 4: 1, 11: 9, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	77-40-7	CCC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 2, 2: 1, 4: 1, 21: 2, 14: 8}
Did not match all atoms present	77-41-8	CC1(CC(=O)N(C1=O)C)C2=CC=CC=C2	{1: 2, 33: 1, 11: 1, 13: 1, 14: 5, 25: 2}
Did not match all atoms present	77-46-3	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C	{24: 2, 1: 2, 29: 2, 14: 8, 31: 2}
Did not match all atoms present	77-50-9	CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C	{1: 4, 2: 3, 3: 1, 4: 1, 33: 1, 14: 10, 28: 1}
Did not match all atoms present	77-51-0	CC(C)C(CC(C)N(C)C)(C#N)C1=CC=CC=C1	{1: 5, 2: 1, 3: 2, 4: 1, 37: 1, 33: 1, 14: 5}
Did not match all atoms present	77-55-4	C1CCC(C1)(C2=CC=CC=C2)C(=O)O	{27: 1, 11: 4, 13: 1, 14: 5}
Did not match all atoms present	77-57-6	C1CCC(C1)(C#N)C2=CC=CC=C2	{11: 4, 13: 1, 14: 5, 37: 1}
Did not match all atoms present	77-62-3	CC1=CC(=C(C(=C1)C2(CCCCC2)C)O)CC3=C(C(=CC(=C3)C)C4(CCCCC4)C)O	{1: 4, 2: 1, 11: 10, 13: 2, 14: 4, 21: 2}
Did not match all atoms present	77-63-4	C[Si]1(O[Si](O[Si](O[Si](O1)(C)C2=CC=CC=C2)(C)C3=CC=CC=C3)(C)C4=CC=CC=C4)C5=CC=CC=C5	{1: 4, 14: 20, 23: 4}
Did not match all atoms present	77-77-0	C=CS(=O)(=O)C=C	{5: 2, 6: 2, 29: 2}
Did not match all atoms present	77-78-1	COS(=O)(=O)OC	{1: 2, 29: 2, 22: 2}
Did not match all atoms present	77-79-2	C1C=CCS1(=O)=O	{11: 2, 29: 2, 14: 2}
Did not match all atoms present	77-80-5	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)S[Sn](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6	{40: 1, 14: 30}
Did not match all atoms present	77-81-6	CCOP(=O)(C#N)N(C)C	{1: 3, 2: 1, 37: 1, 33: 1, 22: 1, 29: 1}
Did not match all atoms present	77-83-8	CCOC(=O)C1C(O1)(C)C2=CC=CC=C2	{1: 2, 2: 1, 12: 1, 13: 1, 14: 5, 23: 1, 28: 1}
Did not match all atoms present	77-98-5	CC[N+](CC)(CC)CC.[OH-]	{1: 4, 2: 4}
Did not match all atoms present	770-09-2	C[Si](C)(C)CC1=CC=CC=C1	{1: 3, 2: 1, 14: 5}
Did not match all atoms present	770-10-5	C1=CC=C(C=C1)C[Si](Cl)(Cl)Cl	{17: 3, 2: 1, 14: 5}
Did not match all atoms present	770-12-7	C1=CC=C(C=C1)OP(=O)(Cl)Cl	{17: 2, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	770-35-4	CC(COC1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	770-89-8	C[Si](C)(CCl)C1=CC=C(C=C1)Cl	{1: 2, 2: 1, 14: 4, 17: 2}
Did not match all atoms present	770-95-6	C1C(C(C1(F)F)(F)Cl)[Si](Cl)(Cl)Cl	{16: 3, 17: 4, 11: 1, 12: 1, 13: 2}
Did not match all atoms present	7700-17-6	CC(C1=CC=CC=C1)OC(=O)/C=C(\C)/OP(=O)(OC)OC	{1: 4, 3: 1, 6: 1, 7: 1, 14: 5, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	7700-27-8	C1=CC=C(C=C1)COC2=CC=C(C=C2)Cl	{17: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	77006-30-5	C(C1=C(C(=O)NO1)Br)C(C(=O)O)N	{32: 1, 2: 1, 3: 1, 18: 1, 23: 1, 25: 1, 27: 1, 30: 1}
Did not match all atoms present	77008-62-9	CC(C1=CC=C(C=C1)Cl)C2=CC=CC=C2Cl	{1: 1, 3: 1, 14: 8, 17: 2}
Did not match all atoms present	7701-62-4	C[N+]1(CC2=C(C1)C(=C(C(=C2Cl)Cl)Cl)Cl)CC[N+](C)(C)C.[Cl-].[Cl-]	{1: 4, 2: 2, 11: 2, 17: 6}
Did not match all atoms present	7702-67-2	CC1=CC=C(C=C1)SCCN2C=NC3=C(C2=O)NC=N3	{32: 1, 1: 1, 2: 2, 35: 2, 33: 1, 40: 1, 14: 6, 25: 1}
Did not match all atoms present	7704-34-9	[S]	{}
Did not match all atoms present	7704-71-4	C(=C/C(=O)[O-])\C(=O)[O-].[Mg+2]	{24: 2, 6: 2}
Did not match all atoms present	7704-98-5	[H-].[H-].[Ti+2]	{}
Did not match all atoms present	77046-80-1	CC1=CC(=C(C=C1)OC)N=NC2=CC=CC=C2	{1: 2, 34: 2, 22: 1, 14: 8}
Did not match all atoms present	7705-07-9	[Cl-].[Cl-].[Cl-].[Ti+3]	{17: 3}
Did not match all atoms present	7705-08-0	Cl[Fe](Cl)Cl	{17: 3}
Did not match all atoms present	77086-32-9	CN1C(=O)C2=CC=CC3=C2C(=C/C(=N\NC4=CC=C(C=C4)C5=NN=C(O5)C6=CC=C(C=C6)N/N=C\7/C=C8C9=C(C7=O)C=CC=C9C(=O)N(C8=O)C)/C3=O)C1=O	{1: 2, 34: 2, 35: 2, 33: 2, 14: 16, 23: 1, 25: 6, 31: 2}
Did not match all atoms present	77094-11-2	CC1=CC2=C(C=CC=N2)C3=C1N(C(=N3)N)C	{1: 2, 35: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	771-50-6	C1=CC=C2C(=C1)C(=CN2)C(=O)O	{32: 1, 27: 1, 14: 5}
Did not match all atoms present	771-51-7	C1=CC=C2C(=C1)C(=CN2)CC#N	{32: 1, 2: 1, 37: 1, 14: 5}
Did not match all atoms present	771-56-2	CC1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 1: 1}
Did not match all atoms present	771-60-8	C1(=C(C(=C(C(=C1F)F)F)F)F)N	{16: 5, 30: 1}
Did not match all atoms present	771-61-9	C1(=C(C(=C(C(=C1F)F)F)F)F)O	{16: 5, 21: 1}
Did not match all atoms present	771-62-0	C1(=C(C(=C(C(=C1F)F)S)F)F)F	{16: 5, 39: 1}
Did not match all atoms present	771-63-1	C1(=C(C(=C(C(=C1F)F)O)F)F)O	{16: 4, 21: 2}
Did not match all atoms present	771-69-7	C1=CC(=C(C(=C1[N+](=O)[O-])F)F)F	{16: 3, 38: 1, 14: 2}
Did not match all atoms present	771-97-1	C1=CC=C2C=C(C(=CC2=C1)N)N	{30: 2, 14: 6}
Did not match all atoms present	771-98-2	C1CCC(=CC1)C2=CC=CC=C2	{11: 4, 14: 6, 15: 1}
Did not match all atoms present	771-99-3	C1CNCCC1C2=CC=CC=C2	{32: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	7710-20-5	C1=C(C(=CC(=C1C(=O)Cl)C(=O)Cl)C(=O)Cl)C(=O)Cl	{24: 4, 17: 4, 14: 2}
Did not match all atoms present	77102-92-2	COC1=C(C=CC=C1Cl)O	{1: 1, 22: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	77102-93-3	COC1=C(C=CC(=C1O)Cl)Cl	{1: 1, 22: 1, 21: 1, 14: 2, 17: 2}
Did not match all atoms present	7714-72-9	C1CCC(=C(C2=CC=CC=C2)C3=CC=CC=C3)C1	{15: 1, 11: 4, 14: 10, 7: 1}
Did not match all atoms present	77159-76-3	CC1=CC(=CC(=C1N=C=O)C)Br	{1: 2, 34: 1, 8: 1, 14: 2, 18: 1, 29: 1}
Did not match all atoms present	7716-60-1	CCNC1=NSC2=CC=CC=C21	{1: 1, 2: 1, 35: 1, 41: 1, 14: 4, 31: 1}
Did not match all atoms present	77162-70-0	C1=CC=C2C(=C1)C(=C3C(=N2)C=CC=C3[N+](=O)[O-])[NH2+]CC[NH+](CCO)CCO.[Cl-].[Cl-]	{2: 6, 35: 1, 38: 1, 14: 7, 17: 2, 20: 2}
Did not match all atoms present	7717-76-2	C1=CC(=C(C=C1OC2=CC(=C(C=C2)C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 22: 1, 14: 6}
Did not match all atoms present	77174-66-4	C=C(C1=CC=CC=C1OCC2=CC(=CC=C2)Cl)N3C=CN=C3.Cl	{33: 1, 2: 1, 35: 1, 5: 1, 7: 1, 14: 11, 17: 2, 22: 1}
Did not match all atoms present	7718-54-9	Cl[Ni]Cl	{17: 2}
Did not match all atoms present	7718-98-1	Cl[V](Cl)Cl	{17: 3}
Did not match all atoms present	77182-82-2	CP(=O)(CCC(C(=O)[O-])N)O.[NH4+]	{1: 1, 2: 2, 3: 1, 20: 1, 24: 1, 29: 1, 30: 1}
Did not match all atoms present	7719-00-8	CO[Si](CCNCCN)(OC)OC	{1: 3, 2: 4, 30: 1, 22: 3, 31: 1}
Did not match all atoms present	7719-02-0	C=C[Si](C1=CC=CC=C1)(Cl)Cl	{17: 2, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	7719-03-1	C=CC[Si](C1=CC=CC=C1)(Cl)Cl	{17: 2, 2: 1, 14: 5, 5: 1, 6: 1}
Did not match all atoms present	7719-09-7	O=S(Cl)Cl	{17: 2, 29: 1}
Did not match all atoms present	7719-12-2	P(Cl)(Cl)Cl	{17: 3}
Did not match all atoms present	772-00-9	C1COCOC1C2=CC=CC=C2	{11: 3, 12: 1, 14: 5, 23: 2}
Did not match all atoms present	772-01-0	C1COC(OC1)C2=CC=CC=C2	{11: 3, 12: 1, 14: 5, 23: 2}
Did not match all atoms present	772-03-2	C=CC1=NC2=CC=CC=C2C=C1	{14: 6, 35: 1, 5: 1, 6: 1}
Did not match all atoms present	772-31-6	C1CC1C(=O)C2=CC=C(C=C2)F	{16: 1, 24: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	772-33-8	C1=CC(=C(C=C1[N+](=O)[O-])CBr)O	{2: 1, 38: 1, 18: 1, 14: 3, 21: 1}
Did not match all atoms present	772-43-0	C1=C(OC(=C1)[N+](=O)[O-])/C(=N/O)/N	{34: 1, 38: 1, 7: 1, 14: 2, 20: 1, 23: 1, 30: 1}
Did not match all atoms present	772-54-3	CCN(CC)CC1=CC=CC=C1	{1: 2, 2: 3, 14: 5, 33: 1}
Did not match all atoms present	772-55-4	CNC(=O)NC1=CC=C(C=C1)F	{16: 1, 1: 1, 31: 2, 14: 4, 24: 1}
Did not match all atoms present	772-59-8	COC1=C(C=C(C=C1)CC#N)Br	{1: 1, 2: 1, 37: 1, 14: 3, 18: 1, 22: 1}
Did not match all atoms present	772-79-2	C1=CC(=CC=C1OP(=O)(Cl)Cl)Cl	{17: 3, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	7720-19-6	C1=CC(=CC(=C1)O)C(=O)[O-].[Na+]	{24: 1, 21: 1, 14: 4}
Did not match all atoms present	7720-78-7	[O-]S(=O)(=O)[O-].[Fe+2]	{29: 4}
Did not match all atoms present	77202-08-5	CC1=NN=NC=C1	{1: 1, 35: 3, 14: 2}
Did not match all atoms present	77202-09-6	CC1=CC(=NN=N1)C	{1: 2, 35: 3, 14: 1}
Did not match all atoms present	77205-52-8	C[Si]1(CSC1)C	{1: 2, 11: 2, 41: 1}
Did not match all atoms present	7721-01-9	Cl[Ta](Cl)(Cl)(Cl)Cl	{17: 5}
Did not match all atoms present	7721-14-4	CCCCCC=CCC=CCCCCCCCC(=O)[O-].[NH4+]	{24: 1, 1: 1, 2: 12, 6: 4}
Did not match all atoms present	7721-15-5	CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Cu+2]	{24: 2, 1: 2, 2: 24, 6: 8}
Did not match all atoms present	77214-82-5	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].[Fe+3]	{1: 3, 29: 9, 14: 12}
Did not match all atoms present	7722-06-7	C1(=N[Se]N=C1N)C(=O)N	{24: 1, 35: 2, 30: 2}
Did not match all atoms present	7722-07-8	CCCCNC(=O)C1=N[Se]N=C1NC(=O)N	{1: 1, 2: 3, 35: 2, 24: 2, 30: 1, 31: 2}
Did not match all atoms present	7722-15-8	C1C(=NC2=C(C=C(C=C2)Cl)C(=[N+]1[O-])C3=CC=CC=C3)[NH3+].[Cl-]	{33: 1, 35: 1, 11: 1, 14: 8, 15: 2, 17: 2, 29: 1}
Did not match all atoms present	7722-64-7	[O-][Mn](=O)(=O)=O.[K+]	{29: 4}
Did not match all atoms present	7722-73-8	CCC1CN1C(=O)C2=CC(=CC(=C2)C(=O)N3CC3CC)C(=O)N4CC4CC	{1: 3, 2: 3, 33: 3, 11: 3, 12: 3, 14: 3, 24: 3}
Did not match all atoms present	7722-76-1	[NH4+].OP(=O)(O)[O-]	{20: 2, 29: 2}
Did not match all atoms present	7722-88-5	O=P([O-])([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]	{29: 6, 22: 1}
Did not match all atoms present	77227-69-1	CCS(=O)(=O)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)C(F)(F)F)F)[N+](=O)[O-]	{1: 1, 2: 1, 4: 1, 38: 1, 14: 5, 16: 4, 17: 1, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	77227-78-2	C1=CC(=C(C=C1C(F)(F)F)F)O	{16: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	77227-81-7	C1=C(C=C(C(=C1Cl)F)Cl)C(F)(F)F	{16: 4, 17: 2, 4: 1, 14: 2}
Did not match all atoms present	7723-14-0	[P]	{}
Did not match all atoms present	77234-90-3	C1=CC=C(C=C1)CCC2=CC=C(C=C2)C(CN3C=CN=C3)O.Cl	{33: 1, 2: 3, 3: 1, 14: 12, 17: 1, 35: 1, 20: 1}
Did not match all atoms present	77237-03-7	CC(C)C[O-].CC(C)C[O-].CC(C)C[O-].[Al+3]	{1: 6, 2: 3, 3: 3, 29: 3}
Did not match all atoms present	7724-48-3	C1CC2=NC3=CC=CC=C3N2C1	{33: 1, 11: 3, 14: 4, 35: 1}
Did not match all atoms present	77248-43-2	CCCCCCOS(=O)CNC(=O)OC1=CC=CC2=C1OC(C2)(C)C	{1: 3, 2: 6, 11: 1, 13: 1, 14: 3, 22: 1, 23: 1, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	77248-44-3	CC1=C(C(=CC=C1)C)S(=O)CNC(=O)OC2=CC=CC3=C2OC(C3)(C)C	{1: 4, 2: 1, 11: 1, 13: 1, 14: 6, 23: 1, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	77248-45-4	CCCCCCCCCCOS(=O)N(C)C(=O)O/N=C/C(C)(C)SC	{1: 5, 2: 9, 4: 1, 6: 1, 33: 1, 40: 1, 34: 1, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	7725-93-1	CC1=C(SC(=S)N1)C(=O)C	{24: 1, 1: 2, 41: 1, 32: 1}
Did not match all atoms present	77251-47-9	C1=CC(=CC=C1C(Cl)Cl)C(Cl)Cl	{17: 4, 3: 2, 14: 4}
Did not match all atoms present	77255-40-4	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3[C@H]([C@@H]([C@@H]5[C@H]4O5)O)O	{20: 2, 12: 4, 14: 8, 23: 1}
Did not match all atoms present	7726-20-7	CCCCCCCCS(=O)(=O)CCCCCCCC	{1: 2, 2: 14, 29: 2}
Did not match all atoms present	77267-47-1	CC1(C=CC=CC1OS(=O)N(CC2=C3C(=CC=CO3)CC2)C(=O)[O-])C	{1: 2, 2: 1, 33: 1, 11: 2, 12: 1, 13: 1, 14: 7, 15: 3, 22: 1, 23: 1, 24: 1, 29: 1}
Did not match all atoms present	77267-52-8	CCCCCCOS(=O)N(C)C(=O)OC1=CC=CC2=CC=CC=C21	{1: 2, 2: 5, 33: 1, 14: 7, 22: 1, 28: 1, 29: 1}
Did not match all atoms present	77267-60-8	CCC(C)(C)COS(=O)CN(C1=C2C(=CC=CO2)CC1)C(=O)[O-]	{1: 3, 2: 3, 4: 1, 33: 1, 11: 2, 14: 3, 15: 3, 22: 1, 23: 1, 24: 1, 29: 1}
Did not match all atoms present	7727-15-3	[Al](Br)(Br)Br	{18: 3}
Did not match all atoms present	7727-18-6	O=[V].Cl.Cl.Cl	{17: 3, 29: 1}
Did not match all atoms present	7727-21-1	[O-]S(=O)(=O)OOS(=O)(=O)[O-].[K+].[K+]	{29: 6, 22: 2}
Did not match all atoms present	7727-33-5	C1=CC(=CC=C1C(C2=CC=C(C=C2)O)C(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O)O	{3: 2, 21: 4, 14: 16}
Did not match all atoms present	7727-37-9	N#N	{}
Did not match all atoms present	7727-43-7	[O-]S(=O)(=O)[O-].[Ba+2]	{29: 4}
Did not match all atoms present	7727-54-0	[NH4+].[NH4+].[O-]S(=O)(=O)OOS(=O)(=O)[O-]	{29: 6, 22: 2}
Did not match all atoms present	7727-73-3	O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	77275-10-6	C1=CC=C(C(=C1)/C=C/C2=CC=CC=N2)F	{16: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	77275-11-7	CC1=CC=CC=C1/C=C/C2=CC=CC=N2	{1: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	77275-12-8	C1=CC=C(C(=C1)/C=C/C2=CC=CC=N2)Br	{18: 1, 35: 1, 14: 8, 6: 2}
Did not match all atoms present	77280-91-2	CCCCCCNCCCNC1=C2C(=NC3=CC=CC=C31)C=CC=C2[N+](=O)[O-].Cl.Cl	{1: 1, 2: 8, 35: 1, 38: 1, 14: 7, 17: 2, 31: 2}
Did not match all atoms present	77280-93-4	C1=CC=C2C(=C1)C(=C3C(=N2)C=CC=C3[N+](=O)[O-])NCCO.Cl	{2: 2, 35: 1, 38: 1, 14: 7, 17: 1, 20: 1, 31: 1}
Did not match all atoms present	77287-90-2	C[C@H]1CC(=C)CC23C1[C@@H](CC4=C2C=C(C=C4)O)N(CC3)CC5CCC5.CS(=O)(=O)O	{1: 2, 2: 1, 5: 1, 33: 1, 11: 8, 12: 4, 13: 1, 14: 3, 15: 1, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	773-01-3	[B-](F)(F)(F)F.CC1=CC(=[O+]C(=C1)C)C	{16: 4, 1: 3, 14: 2, 23: 1}
Did not match all atoms present	773-47-7	COP(=O)(CC1=CC=CC=C1)OC	{1: 2, 2: 1, 22: 2, 14: 5, 29: 1}
Did not match all atoms present	773-64-8	CC1=CC(=C(C(=C1)C)S(=O)(=O)Cl)C	{1: 3, 29: 2, 14: 2, 17: 1}
Did not match all atoms present	773-76-2	C1=CC2=C(C(=C(C=C2Cl)Cl)O)N=C1	{17: 2, 35: 1, 21: 1, 14: 4}
Did not match all atoms present	773-82-0	C(#N)C1=C(C(=C(C(=C1F)F)F)F)F	{16: 5, 37: 1}
Did not match all atoms present	773-99-9	C1=CC=C2C(=C1)C=CC=C2CCO	{2: 2, 20: 1, 14: 7}
Did not match all atoms present	7730-20-3	C1=CC2=C(C=C1F)NC=C2CC(C(=O)O)N	{32: 1, 2: 1, 3: 1, 14: 4, 16: 1, 27: 1, 30: 1}
Did not match all atoms present	77301-42-9	CC(C1=CC2=C(C=C1)C=C(C=C2)OC)O	{1: 2, 3: 1, 20: 1, 22: 1, 14: 6}
Did not match all atoms present	77304-63-3	CCCCCCOP(=O)(C)OCCCCCC	{1: 3, 2: 10, 29: 1, 22: 2}
Did not match all atoms present	7731-34-2	CC(C)(C)N1C(O1)C2=CC=CC=C2	{1: 3, 4: 1, 33: 1, 12: 1, 14: 5, 23: 1}
Did not match all atoms present	77314-23-9	CN1C2=C(C3=C(C=C2)N=CC=C3)N=C1NO	{1: 1, 35: 2, 33: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	7732-18-5	O	{}
Did not match all atoms present	77321-49-4	CCOC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3/C(=N/NC4=C(C=C(C=C4)Cl)C)/C2=O	{1: 2, 2: 1, 34: 1, 14: 12, 15: 2, 17: 1, 22: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	77326-36-4	C1=CC(=C(C(=C1)F)C#N)N	{16: 1, 30: 1, 14: 3, 37: 1}
Did not match all atoms present	77327-05-0	CC[C@H](C)[C@@H]1[C@H](CC(=O)O[C@H](C(=O)[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]3CCCN3C(=O)[C@H](C)O)C)CC4=CC=C(C=C4)OC)C)CC(C)C)C)C(C)C)O	{32: 2, 1: 14, 2: 4, 3: 6, 33: 4, 11: 7, 12: 10, 14: 4, 20: 2, 22: 1, 24: 3, 25: 5, 28: 2, 31: 1}
Did not match all atoms present	7733-02-0	[O-]S(=O)(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	7733-78-0	C[Si]1(OCCOCCO1)C	{1: 2, 11: 4, 23: 3}
Did not match all atoms present	77337-86-1	CC/C(=N/OC(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(=O)O/N=C(/C)\CC)/C	{1: 4, 2: 3, 7: 2, 34: 2, 14: 8, 28: 2, 31: 2}
Did not match all atoms present	77340-84-2	C1=CC=C(C=C1)/C(=C/C2=CC=CC=N2)/[N+](=O)[O-]	{38: 1, 35: 1, 14: 9, 6: 1, 7: 1}
Did not match all atoms present	7735-53-7	C1=CC=C2C(=C1)OC(=O)S2	{41: 1, 28: 1, 14: 4}
Did not match all atoms present	7735-56-0	C1=CC2=C(C=C1O)SC(=O)O2	{41: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	7735-65-1	CC1=CC2=C(C(=C1O)C)SC(=O)O2	{1: 2, 28: 1, 21: 1, 14: 1, 41: 1}
Did not match all atoms present	77355-29-4	CC1=CC=C(C=C1)/C=C/S(=O)(=O)C	{1: 2, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	77355-30-7	CS(=O)(=O)C=CC1=CC=C(C=C1)F	{16: 1, 1: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	77365-64-1	C1=CC(=CC(=C1)S(=O)(=O)CCOS(=O)(=O)[O-])NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(/C(=N\NC5=C(C6=C(C=C5)C(=CC=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 1, 14: 12, 15: 2, 17: 1, 22: 1, 25: 1, 29: 17, 31: 3}
Did not match all atoms present	77372-67-9	CCCCOC1=CC=C(C=C1)CC(=O)NOC(=O)C	{1: 2, 2: 4, 14: 4, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	77372-68-0	CCCCOC1=CC=C(C=C1)CC(=O)NOC(=O)CC	{1: 2, 2: 5, 14: 4, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	77376-07-9	CC(C)(C)C#CP	{1: 3, 10: 2, 4: 1}
Did not match all atoms present	77376-08-0	CC(C)(C)C#CP(Cl)Cl	{1: 3, 10: 2, 4: 1, 17: 2}
Did not match all atoms present	77376-09-1	CCN(CC)P(C#CC(C)(C)C)N(CC)CC	{1: 7, 2: 4, 4: 1, 10: 2, 33: 2}
Did not match all atoms present	77377-52-7	CC(C)(C)[Si](C)(C)N(C)C(=O)C(F)(F)F	{16: 3, 1: 6, 4: 2, 24: 1, 33: 1}
Did not match all atoms present	7738-94-5	O[Cr](=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	7739-33-5	B1(N(B(N(B(N1CC)C(C)C)CC)C(C)C)CC)C(C)C	{1: 9, 2: 3, 3: 3, 33: 3}
Did not match all atoms present	7739-63-1	CCCCCCCCCCOS(=O)(=O)[O-].[K+]	{1: 1, 2: 9, 29: 3, 22: 1}
Did not match all atoms present	774-44-7	CC1CCOC(O1)C2=CC=CC=C2	{1: 1, 11: 2, 12: 2, 14: 5, 23: 2}
Did not match all atoms present	774-48-1	CCOC(C1=CC=CC=C1)OCC	{1: 2, 2: 2, 3: 1, 22: 2, 14: 5}
Did not match all atoms present	774-55-0	CC(=O)C1=CC2=C(CCCC2)C=C1	{24: 1, 1: 1, 11: 4, 14: 3}
Did not match all atoms present	774-65-2	CC(C)(C)OC(=O)C1=CC=CC=C1	{1: 3, 4: 1, 14: 5, 28: 1}
Did not match all atoms present	774-81-2	COC1=C(C=C(C=C1)CC(=O)O)Br	{1: 1, 2: 1, 14: 3, 18: 1, 22: 1, 27: 1}
Did not match all atoms present	7740-33-2	CCOC(=O)CC(=S)C	{1: 2, 2: 2, 28: 1, 7: 1}
Did not match all atoms present	77405-29-9	CC[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)OC(=O)C	{1: 2, 2: 1, 28: 1, 14: 10}
Did not match all atoms present	77422-70-9	C1=CC=C(C=C1)SCN=[N+]=[N-]	{40: 1, 2: 1, 34: 2, 14: 5}
Did not match all atoms present	7743-39-7	CC(=O)NC1=CC(=CC(=C1)C(=O)O)NC(=O)C	{24: 2, 1: 2, 27: 1, 14: 3, 31: 2}
Did not match all atoms present	77430-23-0	CC(=S)N[Hg]C	{1: 2, 31: 1, 7: 1}
Did not match all atoms present	7745-89-3	CC1=C(C=C(C=C1)N)Cl.Cl	{1: 1, 30: 1, 14: 3, 17: 2}
Did not match all atoms present	7745-91-7	CC1=C(C=C(C=C1)N)Br	{1: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	7745-93-9	CC1=C(C=C(C=C1)[N+](=O)[O-])Br	{1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	77458-01-6	CCCSP(=O)(OCC)OC1=CN(N=C1)C2=CC=C(C=C2)Cl	{1: 2, 2: 3, 35: 1, 33: 1, 40: 1, 14: 6, 17: 1, 22: 2, 29: 1}
Did not match all atoms present	77473-07-5	CCC(C)(C)OOC(=O)C1=CC(=C(C=C1C(=O)OOC(C)(C)CC)C(=O)OOC(C)(C)CC)C(=O)OOC(C)(C)CC	{1: 12, 2: 4, 4: 4, 14: 2, 22: 4, 28: 4}
Did not match all atoms present	7749-47-5	CC1=CC(=NC(=N1)N)OC	{1: 2, 30: 1, 35: 2, 22: 1, 14: 1}
Did not match all atoms present	77491-30-6	CCNP(=S)(OC)O/C(=C/C(=O)OC(C)C)/C.COP(=O)(OC)OC=C(Cl)Cl	{1: 7, 2: 1, 3: 1, 6: 2, 7: 2, 17: 2, 22: 5, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	77494-58-7	CCC(C)(C)OOC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)OOC(C)(C)CC)C(=O)O	{1: 6, 2: 2, 4: 2, 14: 2, 22: 2, 27: 2, 28: 2}
Did not match all atoms present	775-01-9	C1=CC(=C(C=C1C(C(=O)O)O)O)O	{27: 1, 3: 1, 20: 1, 21: 2, 14: 3}
Did not match all atoms present	775-06-4	C1=CC(=CC(=C1)O)CC(C(=O)O)N	{2: 1, 3: 1, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	775-11-1	C1=CC=C(C=C1)CN(C(=O)N)N=O	{33: 1, 2: 1, 34: 1, 14: 5, 24: 1, 29: 1, 30: 1}
Did not match all atoms present	775-12-2	C1=CC=C(C=C1)[Si]C2=CC=CC=C2	{14: 10}
Did not match all atoms present	775-15-5	C1CN(CC1O)CC2=CC=CC=C2	{33: 1, 2: 1, 11: 3, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	775-16-6	C1CN(CC1=O)CC2=CC=CC=C2	{25: 1, 2: 1, 11: 3, 14: 5, 33: 1}
Did not match all atoms present	775-31-5	CC(=CC1=CC=C(C=C1)F)[N+](=O)[O-]	{1: 1, 6: 1, 38: 1, 7: 1, 14: 4, 16: 1}
Did not match all atoms present	775-56-4	CCO[Si](C)(C1=CC=CC=C1)OCC	{1: 3, 2: 2, 22: 2, 14: 5}
Did not match all atoms present	77500-04-0	CC1=CN=C2C=CC3=C(C2=N1)N=C(N3C)N	{1: 2, 35: 3, 30: 1, 14: 3, 33: 1}
Did not match all atoms present	77501-63-4	CCOC(=O)C(C)OC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 22: 1, 28: 2}
Did not match all atoms present	77501-90-7	CCOC(=O)COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]	{1: 1, 2: 2, 4: 1, 38: 1, 14: 6, 16: 3, 17: 1, 22: 1, 28: 2}
Did not match all atoms present	77503-17-4	C1=COC(=C1)C2=CSC(=N2)NC=O	{35: 1, 41: 1, 14: 4, 23: 1, 26: 1, 31: 1}
Did not match all atoms present	7751-31-7	C1=CC=C2C(=C1)N(C(=O)O2)CN(CCCl)CCCl	{17: 2, 2: 5, 28: 1, 14: 4, 33: 2}
Did not match all atoms present	77521-29-0	CC1=C(C(=O)NO1)CC(C(=O)O)N	{32: 1, 1: 1, 2: 1, 3: 1, 23: 1, 25: 1, 27: 1, 30: 1}
Did not match all atoms present	77523-56-9	CC(=O)C1=CC2=C(O1)C=C3C=CC(=CC3=C2)OC	{24: 1, 1: 2, 22: 1, 14: 6, 23: 1}
Did not match all atoms present	77532-79-7	CC1=C(C=C(C=C1)F)C#N	{16: 1, 1: 1, 37: 1, 14: 3}
Did not match all atoms present	77549-14-5	CC(=O)N[C@@H](CSCC1=CC=CC=C1)C(=O)OC	{1: 2, 2: 2, 3: 1, 40: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	7756-00-5	CC(=O)NC1=C(C(=C(C=C1)NC(=O)C)[N+](=O)[O-])[N+](=O)[O-]	{24: 2, 1: 2, 38: 2, 14: 2, 31: 2}
Did not match all atoms present	7756-87-8	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(O[Si](C3=CC=CC=C3)(C4=CC=CC=C4)Cl)Cl	{17: 2, 22: 1, 14: 20}
Did not match all atoms present	77565-50-5	CC1=CC(=C(C=C1S(=O)(=O)CCO)OC)NC(=O)C	{1: 3, 2: 2, 14: 2, 20: 1, 22: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	7757-79-1	O=[N+]([O-])[O-].[K+]	{}
Did not match all atoms present	7757-81-5	C/C=C/C=C/C(=O)[O-].[Na+]	{24: 1, 1: 1, 6: 4}
Did not match all atoms present	7757-82-6	[O-]S(=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	7757-83-7	[O-]S(=O)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	7757-86-0	OP(=O)([O-])[O-].[Mg+2]	{20: 1, 29: 3}
Did not match all atoms present	7757-87-1	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Mg+2].[Mg+2].[Mg+2]	{29: 8}
Did not match all atoms present	7757-88-2	[O-]S(=O)[O-].[Mg+2]	{29: 3}
Did not match all atoms present	7757-93-9	OP(=O)([O-])[O-].[Ca+2]	{20: 1, 29: 3}
Did not match all atoms present	7758-01-2	[O-]Br(=O)=O.[K+]	{18: 1, 29: 3}
Did not match all atoms present	7758-02-3	[K+].[Br-]	{18: 1}
Did not match all atoms present	7758-05-6	[O-]I(=O)=O.[K+]	{19: 1, 29: 3}
Did not match all atoms present	7758-09-0	N(=O)[O-].[K+]	{34: 1, 29: 2}
Did not match all atoms present	7758-11-4	OP(=O)([O-])[O-].[K+].[K+]	{20: 1, 29: 3}
Did not match all atoms present	7758-16-9	OP(=O)([O-])OP(=O)(O)[O-].[Na+].[Na+]	{20: 2, 29: 4, 22: 1}
Did not match all atoms present	7758-19-2	[O-]Cl=O.[Na+]	{17: 1, 29: 2}
Did not match all atoms present	7758-23-8	OP(=O)(O)[O-].OP(=O)(O)[O-].[Ca+2]	{20: 4, 29: 4}
Did not match all atoms present	7758-29-4	O=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+]	{29: 8, 22: 2}
Did not match all atoms present	7758-33-0	C1=C(NC=N1)C[C@@H](C(=O)NCC(=O)O)NC(=O)CN	{32: 1, 2: 3, 3: 1, 14: 2, 35: 1, 24: 2, 27: 1, 30: 1, 31: 2}
Did not match all atoms present	7758-87-4	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2]	{29: 8}
Did not match all atoms present	7758-88-5	[F-].[F-].[F-].[Ce+3]	{16: 3}
Did not match all atoms present	7758-89-6	Cl[Cu]	{17: 1}
Did not match all atoms present	7758-94-3	Cl[Fe]Cl	{17: 2}
Did not match all atoms present	7758-95-4	Cl[Pb]Cl	{17: 2}
Did not match all atoms present	7758-97-6	[O-][Cr](=O)(=O)[O-].[Pb+2]	{29: 4}
Did not match all atoms present	7758-98-7	[O-]S(=O)(=O)[O-].[Cu+2]	{29: 4}
Did not match all atoms present	7758-99-8	O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cu+2]	{29: 4}
Did not match all atoms present	7759-00-4	[O-][Si]([O-])([O-])[O-].[Mn]	{29: 4}
Did not match all atoms present	7759-01-5	[O-][W](=O)(=O)[O-].[Pb+2]	{29: 4}
Did not match all atoms present	7759-02-6	[O-]S(=O)(=O)[O-].[Sr+2]	{29: 4}
Did not match all atoms present	77599-01-0	C[Si]1(C2=CC=CC=C2SC3=CC=CC=C3[Si]1(C)C)C	{1: 4, 14: 8, 41: 1}
Did not match all atoms present	776-04-5	C1=CC=C(C(=C1)C(F)(F)F)S(=O)(=O)Cl	{16: 3, 17: 1, 4: 1, 29: 2, 14: 4}
Did not match all atoms present	776-34-1	C1=CC=C2C(=C1)C(=CC=C2[N+](=O)[O-])N	{38: 1, 30: 1, 14: 6}
Did not match all atoms present	776-35-2	C1CC2=CC=CC=C2C3=CC=CC=C31	{11: 2, 14: 8}
Did not match all atoms present	776-74-9	C1=CC=C(C=C1)C(C2=CC=CC=C2)Br	{18: 1, 3: 1, 14: 10}
Did not match all atoms present	776-75-0	C1CCN(CC1)C(=O)C2=CC=CC=C2	{24: 1, 33: 1, 11: 5, 14: 5}
Did not match all atoms present	776-76-1	C[Si](C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 14: 10}
Did not match all atoms present	776-88-5	CC1(COC(OC1)C2=CC=CC=C2)C	{1: 2, 11: 2, 12: 1, 13: 1, 14: 5, 23: 2}
Did not match all atoms present	776-99-8	CC(=O)CC1=CC(=C(C=C1)OC)OC	{24: 1, 1: 3, 2: 1, 22: 2, 14: 3}
Did not match all atoms present	7761-45-7	CC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)Cl	{1: 1, 35: 2, 30: 2, 14: 3, 17: 2}
Did not match all atoms present	7761-80-0	CC(=O)OC1=CC=C(C=C1)N=C2C=CC(=O)C=C2	{1: 1, 34: 1, 14: 8, 15: 1, 25: 1, 28: 1}
Did not match all atoms present	7761-88-8	[N+](=O)([O-])[O-].[Ag+]	{}
Did not match all atoms present	77614-70-1	CC1P(P1C(C)(C)C)C(C)(C)C	{1: 7, 4: 2, 12: 1}
Did not match all atoms present	77614-71-2	B1(P(P1C(C)(C)C)C(C)(C)C)N(C)C2CCCCC2	{1: 7, 11: 5, 4: 2, 12: 1, 33: 1}
Did not match all atoms present	77614-72-3	B1(P(P1C(C)(C)C)C(C)(C)C)N(C)C(C)(C)C	{1: 10, 4: 3, 33: 1}
Did not match all atoms present	77614-73-4	CC(C)(C)P1P([As]1C(C)(C)C)C(C)(C)C	{1: 9, 4: 3}
Did not match all atoms present	77650-95-4	CCCN1C[C@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)NC(=O)N(CC)CC	{32: 1, 1: 3, 2: 4, 33: 2, 11: 3, 12: 3, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	77659-29-1	CCCOP(=S)(CC=C)OCCC	{1: 2, 2: 5, 22: 2, 5: 1, 6: 1}
Did not match all atoms present	77659-30-4	CCOP(=[Se])(CC=C)OCC	{1: 2, 2: 3, 22: 2, 5: 1, 6: 1}
Did not match all atoms present	7766-23-6	CC1=C(C=CC=C1Br)O	{1: 1, 18: 1, 21: 1, 14: 3}
Did not match all atoms present	77669-79-5	C1=CC=C2C=C3C4C5C4C5C3=CC2=C1	{12: 4, 14: 6}
Did not match all atoms present	77671-19-3	CC1(N(N1CC2=CC=CC=C2)C)C	{1: 3, 2: 1, 13: 1, 14: 5, 33: 2}
Did not match all atoms present	7768-28-7	C1=CC=C(C(=C1)CCO)O	{2: 2, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	77680-87-6	C1CN1P2(=NP(=NS(=N2)(=O)N3CC3)(N4CC4)N5CC5)N6CC6	{33: 5, 11: 10, 29: 1, 35: 3}
Did not match all atoms present	77699-50-4	CCC(C)O[Si](O)(O)OC(C)C	{1: 4, 2: 1, 3: 2, 20: 2, 22: 2}
Did not match all atoms present	777-11-7	C1=C(C(=CC(=C1Cl)Cl)Cl)OCC#CI	{2: 1, 10: 2, 14: 2, 17: 3, 19: 1, 22: 1}
Did not match all atoms present	777-22-0	CCCCCCC(C)C1=CC=CC=C1	{1: 2, 2: 5, 3: 1, 14: 5}
Did not match all atoms present	777-37-7	C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)Cl	{16: 3, 17: 1, 4: 1, 38: 1, 14: 3}
Did not match all atoms present	777-44-6	C1=CC(=CC(=C1)S(=O)(=O)Cl)C(F)(F)F	{16: 3, 17: 1, 4: 1, 29: 2, 14: 4}
Did not match all atoms present	777-52-6	C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(Cl)Cl	{17: 2, 38: 1, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	777-59-3	CN(C(=O)NC1=CC=C(C=C1)F)N=O	{1: 1, 34: 1, 33: 1, 14: 4, 16: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	777-79-7	C1=CC=C(C=C1)CCN(C(=O)N)N=O	{33: 1, 2: 2, 34: 1, 14: 5, 24: 1, 29: 1, 30: 1}
Did not match all atoms present	777-84-4	C1=CC(=CC=C1[N+](=O)[O-])OC(=O)CCl	{17: 1, 2: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	7770-45-8	C1=CC=C2C(=C1)C(=CC=C2O)C=O	{26: 1, 21: 1, 14: 6}
Did not match all atoms present	7770-47-0	CN1C=C(C2=CC=CC=C21)CCC3=CC=NC=C3.Cl	{1: 1, 2: 2, 35: 1, 33: 1, 14: 9, 17: 1}
Did not match all atoms present	7772-37-4	C1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC=CS3	{32: 2, 25: 2, 13: 1, 14: 8, 41: 1}
Did not match all atoms present	7772-98-7	[O-]S(=O)(=S)[O-].[Na+].[Na+]	{29: 3}
Did not match all atoms present	7773-01-5	[Cl-].[Cl-].[Mn+2]	{17: 2}
Did not match all atoms present	7773-03-7	OS(=O)[O-].[K+]	{20: 1, 29: 2}
Did not match all atoms present	7773-06-0	[NH4+].NS(=O)(=O)[O-]	{29: 3, 30: 1}
Did not match all atoms present	7773-34-4	CCC(=C(CC)C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC	{1: 4, 2: 2, 22: 2, 14: 8, 7: 2}
Did not match all atoms present	77732-09-3	CC1=C(C(=CC=C1)C)N(C(=O)COC)N2CCOC2=O	{1: 3, 2: 1, 33: 2, 11: 2, 14: 3, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	7774-29-0	I[Hg]I	{19: 2}
Did not match all atoms present	7774-34-7	O.O.O.O.O.O.[Cl-].[Cl-].[Ca+2]	{17: 2}
Did not match all atoms present	7774-41-6	O.O[As](=O)(O)O.O[As](=O)(O)O	{20: 6, 29: 2}
Did not match all atoms present	7774-73-4	C1=CSC=C1S	{41: 1, 14: 3, 39: 1}
Did not match all atoms present	7774-74-5	C1=CSC(=C1)S	{41: 1, 14: 3, 39: 1}
Did not match all atoms present	7774-76-7	CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C\CCCCCCCC(=O)[O-].[Sn+4]	{24: 4, 1: 4, 2: 56, 6: 8}
Did not match all atoms present	77745-03-0	C1=CC=C(C=C1)CSCC(F)(F)F	{16: 3, 40: 1, 2: 2, 4: 1, 14: 5}
Did not match all atoms present	7775-05-5	CC(C)CC(CC(C)C)OC(=O)CC(C(=O)OC(CC(C)C)CC(C)C)S(=O)(=O)[O-].[Na+]	{1: 8, 2: 5, 3: 7, 28: 2, 29: 3}
Did not match all atoms present	7775-09-9	[O-]Cl(=O)=O.[Na+]	{17: 1, 29: 3}
Did not match all atoms present	7775-11-3	[O-][Cr](=O)(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	7775-14-6	[O-]S(=O)S(=O)[O-].[Na+].[Na+]	{29: 4}
Did not match all atoms present	7775-19-1	O=B[O-].[Na+]	{29: 2}
Did not match all atoms present	7775-27-1	[O-]S(=O)(=O)OOS(=O)(=O)[O-].[Na+].[Na+]	{29: 6, 22: 2}
Did not match all atoms present	7775-38-4	CC(C1=CC=CC=C1)OC=O	{1: 1, 26: 1, 3: 1, 14: 5}
Did not match all atoms present	7775-41-9	[F-].[Ag+]	{16: 1}
Did not match all atoms present	7776-33-2	C(C[Se][Se]CCC(C(=O)O)N)C(C(=O)O)N	{27: 2, 2: 4, 3: 2, 30: 2}
Did not match all atoms present	77771-02-9	C1=CC(=C(C=C1C=O)Br)F	{16: 1, 18: 1, 26: 1, 14: 3}
Did not match all atoms present	77771-04-1	C1COC(O1)C2=CC(=C(C=C2)F)Br	{11: 2, 12: 1, 14: 3, 16: 1, 18: 1, 23: 2}
Did not match all atoms present	77771-05-2	C1COC(O1)C2=CC(=C(C=C2)F)OC3=CC=CC=C3	{11: 2, 12: 1, 14: 8, 16: 1, 22: 1, 23: 2}
Did not match all atoms present	77774-39-1	CCOC(=O)NC1=CC=C(C=C1)I	{1: 1, 2: 1, 14: 4, 19: 1, 28: 1, 31: 1}
Did not match all atoms present	7778-06-5	CN1CCN(P1(=O)N(C)C)C	{1: 4, 11: 2, 29: 1, 33: 3}
Did not match all atoms present	7778-18-9	[O-]S(=O)(=O)[O-].[Ca+2]	{29: 4}
Did not match all atoms present	7778-39-4	O[As](=O)(O)O	{20: 3, 29: 1}
Did not match all atoms present	7778-41-8	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Cu+2].[Cu+2].[Cu+2]	{29: 8}
Did not match all atoms present	7778-43-0	O[As](=O)([O-])[O-].[Na+].[Na+]	{20: 1, 29: 3}
Did not match all atoms present	7778-44-1	[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2]	{29: 8}
Did not match all atoms present	7778-50-9	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[K+].[K+]	{29: 6, 22: 1}
Did not match all atoms present	7778-53-2	[O-]P(=O)([O-])[O-].[K+].[K+].[K+]	{29: 4}
Did not match all atoms present	7778-54-3	[O-]Cl.[O-]Cl.[Ca+2]	{17: 2, 29: 2}
Did not match all atoms present	7778-66-7	[O-]Cl.[K+]	{17: 1, 29: 1}
Did not match all atoms present	7778-73-6	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[O-].[K+]	{17: 5}
Did not match all atoms present	7778-74-7	[O-]Cl(=O)(=O)=O.[K+]	{17: 1, 29: 4}
Did not match all atoms present	7778-77-0	OP(=O)(O)[O-].[K+]	{20: 2, 29: 2}
Did not match all atoms present	7778-80-5	[O-]S(=O)(=O)[O-].[K+].[K+]	{29: 4}
Did not match all atoms present	7778-83-8	CCCOC(=O)/C=C/C1=CC=CC=C1	{1: 1, 2: 2, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	77787-77-0	CC1=CC(=C(C(=C1)C)C(C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3C)C)C)C	{24: 1, 1: 6, 3: 1, 14: 9}
Did not match all atoms present	77787-78-1	CC1=CC(=C(C(=C1)C)C(C2=C(C=C(C=C2C)C)C)C(=O)C3=CC=CC=C3)C	{24: 1, 1: 6, 3: 1, 14: 9}
Did not match all atoms present	77787-79-2	CC1=CC(=C(C(=C1)C)C(=C(C2=C(C=C(C=C2C)C)C)O)C3=CC=CC=C3)C	{1: 6, 20: 1, 14: 9, 7: 2}
Did not match all atoms present	77787-80-5	CC1=CC(=C(C(=C1)C)C(=C(C2=CC=CC=C2)O)C3=C(C=C(C=C3C)C)C)C	{1: 6, 20: 1, 14: 9, 7: 2}
Did not match all atoms present	7779-16-0	C1CCC(CC1)OC(=O)C2=CC=CC=C2N	{28: 1, 11: 5, 12: 1, 30: 1, 14: 4}
Did not match all atoms present	7779-17-1	C1CCC(CC1)OC(=O)/C=C/C2=CC=CC=C2	{28: 1, 11: 5, 12: 1, 14: 5, 6: 2}
Did not match all atoms present	7779-25-1	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)O)O.[Mg+2]	{24: 2, 20: 1, 2: 2, 27: 1, 4: 1}
Did not match all atoms present	7779-65-9	CC(C)CCOC(=O)C=CC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 6: 2, 14: 5, 28: 1}
Did not match all atoms present	7779-78-4	CC(C)CC(CC1=CC=CC=C1)O	{1: 2, 2: 2, 3: 2, 20: 1, 14: 5}
Did not match all atoms present	7779-88-6	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Zn+2]	{}
Did not match all atoms present	7779-90-0	[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Zn+2].[Zn+2].[Zn+2]	{29: 8}
Did not match all atoms present	7779-99-9	CCCCCCCCC=CCCCCCCCC(=O)OCC(C)C.OS(=O)(=O)O	{1: 3, 2: 15, 3: 1, 6: 2, 20: 2, 28: 1, 29: 2}
Did not match all atoms present	77791-20-9	CCN(CC)CC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 2, 2: 3, 33: 2, 14: 10, 17: 1, 24: 1}
Did not match all atoms present	77791-27-6	CCN(CC)CC(=O)NC1=NC=CC(=C1)C.Cl.Cl	{1: 3, 2: 3, 35: 1, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77791-37-8	CCN(C(C)COC1=C(C=C(C=C1)C)C)C(=O)C[NH+]2CCCCC2C.[Cl-]	{1: 5, 2: 3, 3: 1, 33: 1, 11: 4, 12: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	77791-38-9	CCN(C(C)COC1=C(C=C(C=C1)C)C)C(=O)C[NH+]2CCCCC2.[Cl-]	{1: 4, 2: 3, 3: 1, 33: 1, 11: 5, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	77791-40-3	CC1CCCC[NH+]1CC(=O)N(C)CCOC2=C(C=C(C=C2C)C)C.[Cl-]	{1: 5, 2: 3, 33: 1, 11: 4, 12: 1, 14: 2, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	77791-41-4	CC1=CC(=C(C(=C1)C)OCCN(C)C(=O)C[NH+]2CCOCC2)C.[Cl-]	{1: 4, 2: 3, 33: 1, 11: 4, 14: 2, 17: 1, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	77791-42-5	CC1CCCCN1CC(=O)N(C)CCOC2=CC=CC=C2.[Cl-]	{1: 2, 2: 3, 33: 2, 11: 4, 12: 1, 14: 5, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	77791-43-6	CC1CCCC[NH+]1CC(=O)N(C)CCOC2=CC=CC=C2C.[Cl-]	{1: 3, 2: 3, 33: 1, 11: 4, 12: 1, 14: 4, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	77791-53-8	CCCCOC1=CC=C(C=C1)NC(=O)CN2CCCCC2.[Cl-]	{1: 1, 2: 4, 33: 1, 11: 5, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	77791-55-0	CCCC[NH2+]CC(=O)NC1=CC=CC=C1Cl.[Cl-]	{1: 1, 2: 4, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77791-57-2	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=CC=C(C=C1)Cl.[Cl-].[Cl-]	{1: 3, 2: 5, 14: 4, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	77791-58-3	CC[NH+](CC)CC(=O)NC1=CC=CC=C1Cl.[Cl-]	{1: 2, 2: 3, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77791-63-0	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=C(C=CC=C1Cl)Cl.[Cl-].[Cl-]	{1: 3, 2: 5, 14: 3, 17: 4, 24: 1, 31: 1}
Did not match all atoms present	77791-64-1	CCC[NH+](CCC)CC(=O)NC1=C(C=CC=C1Cl)Cl.[Cl-]	{1: 2, 2: 5, 14: 3, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	77791-66-3	CC[NH+](CC)CC(=O)NC1=C(C=C(C=C1Cl)Cl)Cl.[Cl-]	{1: 2, 2: 3, 14: 2, 17: 4, 24: 1, 31: 1}
Did not match all atoms present	77791-67-4	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=CC=CC=C1OC.[Cl-].[Cl-]	{1: 4, 2: 5, 14: 4, 17: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	778-22-3	CC(C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 4: 1, 14: 10}
Did not match all atoms present	778-24-5	C[Si](C)(C1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 14: 10}
Did not match all atoms present	778-25-6	C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)O	{1: 1, 20: 1, 14: 10}
Did not match all atoms present	778-28-9	CCCCOS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 3, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	778-35-8	CC1=C(C(=C(C(=C1F)F)C(F)(F)F)F)F	{16: 7, 1: 1, 4: 1}
Did not match all atoms present	778-66-5	CC=C(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	778-82-5	CCOC(=O)CC1=CNC2=CC=CC=C21	{32: 1, 1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	778-94-9	C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])C#N	{16: 3, 38: 1, 4: 1, 37: 1, 14: 3}
Did not match all atoms present	778-97-2	CCOC(=O)C1=CN=C(N=C1N)SCC	{1: 2, 2: 2, 35: 2, 40: 1, 14: 1, 28: 1, 30: 1}
Did not match all atoms present	7780-06-5	CC(C)OC(=O)C=CC1=CC=CC=C1	{1: 2, 3: 1, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	7780-16-7	CCCCCC(=O)OC1=CC=CC=C1	{1: 1, 2: 4, 28: 1, 14: 5}
Did not match all atoms present	7781-98-8	CCOC(=O)C1=CC(=CC=C1)O	{1: 1, 2: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	77811-44-0	CC1=CC(=CC(=C1N)[N+](=O)[O-])Br	{1: 1, 18: 1, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	7782-24-3	C[C@@H](C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 3: 1, 14: 5}
Did not match all atoms present	7782-26-5	C[C@H](C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 3: 1, 14: 5}
Did not match all atoms present	7782-39-0	[2H][2H]	{}
Did not match all atoms present	7782-49-2	[Se]	{}
Did not match all atoms present	7782-61-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.O.O.O.[Fe+3]	{}
Did not match all atoms present	7782-63-0	O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Fe+2]	{29: 4}
Did not match all atoms present	7782-65-2	[GeH4]	{}
Did not match all atoms present	7782-75-4	O.O.O.OP(=O)([O-])[O-].[Mg+2]	{20: 1, 29: 3}
Did not match all atoms present	7782-78-7	N(=O)OS(=O)(=O)O	{34: 1, 20: 1, 29: 3, 22: 1}
Did not match all atoms present	7782-79-8	N=[N+]=[N-]	{34: 1, 36: 1}
Did not match all atoms present	7782-82-3	O[Se](=O)[O-].[Na+]	{20: 1, 29: 2}
Did not match all atoms present	7782-85-6	O.O.O.O.O.O.O.O=P(O)(O)O.[Na].[Na]	{20: 3, 29: 1}
Did not match all atoms present	7782-87-8	[O-]P=O.[K+]	{29: 2}
Did not match all atoms present	7782-89-0	[Li+].[NH2-]	{}
Did not match all atoms present	7782-91-4	O[Mo](=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	7782-92-5	[NH2-].[Na+]	{}
Did not match all atoms present	7782-99-2	OS(=O)O	{20: 2, 29: 1}
Did not match all atoms present	77820-11-2	CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CSC=C3	{1: 2, 2: 2, 33: 1, 41: 1, 14: 7, 24: 1, 28: 1}
Did not match all atoms present	77824-42-1	C1=C(C2=NC(=N1)O[Sb]OC3=NC=C(C(=N3)O[Sb]O2)CO)CO.O.O	{2: 2, 35: 4, 20: 2, 14: 2, 23: 4}
Did not match all atoms present	77824-43-2	C1=CC2=C(C=C(C(=C2N=C1)O[Sb]OC3=C4C(=C(C=C3C=O)S(=O)(=O)[O-])C=CC=N4)C=O)S(=O)(=O)O.[OH-].[Na+].[Na+]	{35: 2, 14: 8, 20: 1, 22: 2, 26: 2, 29: 5}
Did not match all atoms present	77824-44-3	C1=CN=C2N=C1O[Sb]OC3=NC(=NC=C3)O[Sb]O2.O.O	{35: 4, 14: 4, 23: 4}
Did not match all atoms present	77825-98-0	C1=CC=C2C(=C1)OS(=O)S2	{41: 1, 29: 1, 14: 4, 23: 1}
Did not match all atoms present	77825-99-1	C1=CC(=S)C=C1	{14: 4, 15: 1}
Did not match all atoms present	7783-00-8	O[Se](=O)O	{20: 2, 29: 1}
Did not match all atoms present	7783-03-1	O[W](=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	7783-05-3	OS(=O)(=O)OS(=O)(=O)O	{20: 2, 29: 4, 22: 1}
Did not match all atoms present	7783-06-4	S	{}
Did not match all atoms present	7783-07-5	[SeH2]	{}
Did not match all atoms present	7783-08-6	O[Se](=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	7783-09-7	[TeH2]	{}
Did not match all atoms present	7783-11-1	[NH4+].[NH4+].O.[O-]S(=O)[O-]	{29: 3}
Did not match all atoms present	7783-18-8	[NH4+].[NH4+].[O-]S(=O)(=S)[O-]	{29: 3}
Did not match all atoms present	7783-19-9	[NH4+].[NH4+].[O-][Se](=O)[O-]	{29: 3}
Did not match all atoms present	7783-20-2	[NH4+].[NH4+].[O-]S(=O)(=O)[O-]	{29: 4}
Did not match all atoms present	7783-21-3	[NH4+].[NH4+].[O-][Se](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	7783-22-4	[NH4+].[NH4+].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[U].[U]	{}
Did not match all atoms present	7783-26-8	[Si]=[Si]=[Si]	{}
Did not match all atoms present	7783-28-0	[NH4+].[NH4+].OP(=O)([O-])[O-]	{20: 1, 29: 3}
Did not match all atoms present	7783-29-1	[SiH3][SiH2][SiH2][SiH3]	{}
Did not match all atoms present	7783-30-4	I[Hg]	{19: 1}
Did not match all atoms present	7783-32-6	[O-]I(=O)=O.[O-]I(=O)=O.[Hg+2]	{19: 2, 29: 6}
Did not match all atoms present	7783-33-7	[K+].[K+].I[Hg-2](I)(I)I	{19: 4}
Did not match all atoms present	7783-34-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.[Hg+2]	{}
Did not match all atoms present	7783-35-9	[O-]S(=O)(=O)[O-].[Hg+2]	{29: 4}
Did not match all atoms present	7783-36-0	[O-]S(=O)(=O)[O-].[Hg+].[Hg+]	{29: 4}
Did not match all atoms present	7783-40-6	[F-].[F-].[Mg+2]	{16: 2}
Did not match all atoms present	7783-42-8	O=S(F)F	{16: 2, 29: 1}
Did not match all atoms present	7783-43-9	O(F)F.[Se]	{16: 2, 22: 1}
Did not match all atoms present	7783-46-2	F[Pb]F	{16: 2}
Did not match all atoms present	7783-47-3	[F-].[F-].[Sn+2]	{16: 2}
Did not match all atoms present	7783-48-4	[F-].[F-].[Sr+2]	{16: 2}
Did not match all atoms present	7783-49-5	[F-].[F-].[Zn+2]	{16: 2}
Did not match all atoms present	7783-50-8	F[Fe](F)F	{16: 3}
Did not match all atoms present	7783-51-9	[F-].[F-].[F-].[Ga+3]	{16: 3}
Did not match all atoms present	7783-52-0	[F-].[F-].[F-].[In+3]	{16: 3}
Did not match all atoms present	7783-55-3	FP(F)F	{16: 3}
Did not match all atoms present	7783-56-4	F[Sb](F)F	{16: 3}
Did not match all atoms present	7783-58-6	F[Ge](F)(F)F	{16: 4}
Did not match all atoms present	7783-60-0	FS(F)(F)F	{16: 4}
Did not match all atoms present	7783-61-1	F[Si](F)(F)F	{16: 4}
Did not match all atoms present	7783-62-2	[F-].[F-].[F-].[F-].[Sn+4]	{16: 4}
Did not match all atoms present	7783-64-4	[F-].[F-].[F-].[F-].[Zr+4]	{16: 4}
Did not match all atoms present	7783-68-8	[F-].[F-].[F-].[F-].[F-].[Nb+5]	{16: 5}
Did not match all atoms present	7783-70-2	F[Sb](F)(F)(F)F	{16: 5}
Did not match all atoms present	7783-72-4	[F-].[F-].[F-].[F-].[F-].[V]	{16: 5}
Did not match all atoms present	7783-77-9	F[Mo](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	7783-79-1	F[Se](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	7783-81-5	F[U](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	7783-82-6	F[W](F)(F)(F)(F)F	{16: 6}
Did not match all atoms present	7783-84-8	[O-]P=O.[O-]P=O.[O-]P=O.[Fe+3]	{29: 6}
Did not match all atoms present	7783-86-0	[Fe+2].[I-].[I-]	{19: 2}
Did not match all atoms present	7783-89-3	[O-]Br(=O)=O.[Ag+]	{18: 1, 29: 3}
Did not match all atoms present	7783-90-6	Cl[Ag]	{17: 1}
Did not match all atoms present	7783-92-8	[O-]Cl(=O)=O.[Ag+]	{17: 1, 29: 3}
Did not match all atoms present	7783-93-9	[O-]Cl(=O)(=O)=O.[Ag+]	{17: 1, 29: 4}
Did not match all atoms present	7783-96-2	[Ag]I	{19: 1}
Did not match all atoms present	7783-97-3	[O-]I(=O)=O.[Ag+]	{19: 1, 29: 3}
Did not match all atoms present	7783-98-4	[O-][Mn](=O)(=O)=O.[Ag+]	{29: 4}
Did not match all atoms present	7783-99-5	N(=O)[O-].[Ag+]	{34: 1, 29: 2}
Did not match all atoms present	7784-01-2	[O-][Cr](=O)(=O)[O-].[Ag+].[Ag+]	{29: 4}
Did not match all atoms present	7784-02-3	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Ag+].[Ag+]	{29: 6, 22: 1}
Did not match all atoms present	7784-05-6	[O-][Se](=O)[O-].[Ag+].[Ag+]	{29: 3}
Did not match all atoms present	7784-07-8	[O-][Se](=O)(=O)[O-].[Ag]	{29: 4}
Did not match all atoms present	7784-08-9	[O-][As]([O-])[O-].[Ag]	{29: 3}
Did not match all atoms present	7784-13-6	O.O.O.O.O.O.[Al+3].[Cl-].[Cl-].[Cl-]	{17: 3}
Did not match all atoms present	7784-15-8	O.O.O.O.O.O.O.O.O.[O-]Cl(=O)=O.[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Al+3]	{17: 3, 29: 9}
Did not match all atoms present	7784-16-9	[Na+].[Al-](Cl)(Cl)(Cl)Cl	{17: 4}
Did not match all atoms present	7784-22-7	[O-]P=O.[O-]P=O.[O-]P=O.[Al+3]	{29: 6}
Did not match all atoms present	7784-23-8	[Al](I)(I)I	{19: 3}
Did not match all atoms present	7784-25-0	[NH4+].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]	{29: 8}
Did not match all atoms present	7784-26-1	[NH4+].O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3]	{29: 8}
Did not match all atoms present	7784-30-7	O=P([O-])([O-])[O-].[Al+3]	{29: 4}
Did not match all atoms present	7784-33-0	[As](Br)(Br)Br	{18: 3}
Did not match all atoms present	7784-34-1	Cl[As](Cl)Cl	{17: 3}
Did not match all atoms present	7784-35-2	F[As](F)F	{16: 3}
Did not match all atoms present	7784-36-3	F[As](F)(F)(F)F	{16: 5}
Did not match all atoms present	7784-37-4	O[As](=O)(O)O.[Hg]	{20: 3, 29: 1}
Did not match all atoms present	7784-40-9	O[As](=O)([O-])[O-].[Pb+2]	{20: 1, 29: 3}
Did not match all atoms present	7784-41-0	O[As](=O)(O)[O-].[K+]	{20: 2, 29: 2}
Did not match all atoms present	7784-42-1	[AsH3]	{}
Did not match all atoms present	7784-44-3	[NH4+].[NH4+].O[As](=O)([O-])[O-]	{20: 1, 29: 3}
Did not match all atoms present	7784-45-4	[As](I)(I)I	{19: 3}
Did not match all atoms present	7784-46-5	[O-][As]=O.[Na+]	{29: 2}
Did not match all atoms present	7784-48-7	O.O.O.O.O.O.O.O.[O-][As](=O)([O-])[O-].[O-][As](=O)([O-])[O-].[Ni+2].[Ni+2].[Ni+2]	{29: 8}
Did not match all atoms present	77846-96-9	CC(CNCCNC1=C2C=C(C=CC2=NC3=CC=CC=C31)OC)Cl.CC(CNCCNC1=C2C=C(C=CC2=NC3=CC=CC=C31)OC)Cl.O.Cl.Cl.Cl.Cl	{1: 4, 2: 6, 3: 2, 14: 14, 17: 6, 35: 2, 22: 2, 31: 4}
Did not match all atoms present	77847-10-0	[Li+].[Li+].CC1=C/C(=N\NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)O)OC)/C=CC1=O	{1: 2, 34: 3, 14: 10, 15: 2, 20: 1, 22: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	77847-11-1	CC1=C/C(=N\NC2=C(C=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)O)OC)/C=CC1=O.[Na+].[Na+]	{1: 2, 34: 3, 14: 10, 15: 2, 20: 1, 22: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	77847-12-2	C1=CC(=C(C=C1N)S(=O)(=O)[O-])N.[K+]	{30: 2, 29: 3, 14: 3}
Did not match all atoms present	77847-13-3	CC1=CC=CC=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 6, 33: 1, 14: 9, 20: 4, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	77847-14-4	CC1=CC=CC=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[NH4+]	{1: 1, 14: 9, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	77847-15-5	CC1=NN(C(=O)C1N=NC2=C(C=CC(=C2)NC(=O)C3=CC=CC=C3)S(=O)(=O)[O-])C4=CC=CC=C4Cl.[Na+]	{1: 1, 34: 2, 35: 1, 33: 1, 12: 1, 14: 12, 15: 1, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	77847-16-6	C1=CC=C2C(=C1)N=C(S2)N=NC3=CC=CC(=C3)CCNCCCS(=O)(=O)O	{2: 5, 35: 1, 41: 1, 34: 2, 14: 8, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	77847-17-7	C1=CC(=CC=C1N2N=C3C=CC4=C(C=C(C=C4C3=N2)S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-].[Na+].[Na+]	{38: 1, 33: 1, 35: 2, 29: 6, 14: 8}
Did not match all atoms present	77847-18-8	CC1=C(C=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 14: 8, 25: 2, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	77847-19-9	CC1=C(C=C(C=C1)NC2=CC(=C(C3=C2C(=O)[C@@H]4C=CC=C[C@H]4C3=O)N)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 12: 2, 14: 8, 20: 2, 25: 2, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	77847-20-2	C1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[NH4+]	{11: 5, 12: 1, 14: 5, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	77847-22-4	CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C=C3OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)[O-])OC)N.[Na+].[Na+]	{1: 2, 34: 2, 14: 11, 22: 2, 29: 8, 30: 1}
Did not match all atoms present	77847-33-7	CC1CCCC1.Cl[Ta]Cl	{1: 1, 11: 4, 12: 1, 17: 2}
Did not match all atoms present	7785-19-5	[NH4+].[NH4+].O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Mn+2]	{29: 8}
Did not match all atoms present	7785-20-8	[NH4+].O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Ni]	{29: 4}
Did not match all atoms present	7785-21-9	[NH4+].[O-]P(=O)([O-])[O-].[Mg+2]	{29: 4}
Did not match all atoms present	7785-23-1	Br[Ag]	{18: 1}
Did not match all atoms present	7785-42-4	CC(C)(O)S(=O)(=O)O	{1: 2, 4: 1, 29: 2, 20: 2}
Did not match all atoms present	7785-84-4	[O-]P1(=O)OP(=O)(OP(=O)(O1)[O-])[O-].[Na+].[Na+].[Na+]	{29: 6, 23: 3}
Did not match all atoms present	7785-87-7	O=S(=O)(O)O.[Mn]	{20: 2, 29: 2}
Did not match all atoms present	7786-17-6	CCCCCCCCCC1=CC(=CC(=C1O)CC2=C(C(=CC(=C2)C)CCCCCCCCC)O)C	{1: 4, 2: 17, 21: 2, 14: 4}
Did not match all atoms present	7786-30-3	[Cl-].[Cl-].[Mg+2]	{17: 2}
Did not match all atoms present	7786-34-7	CC(=CC(=O)OC)OP(=O)(OC)OC	{1: 4, 6: 1, 7: 1, 22: 3, 28: 1, 29: 1}
Did not match all atoms present	7786-36-9	O[As](O)(O)(O)O	{20: 5}
Did not match all atoms present	7786-61-0	COC1=C(C=CC(=C1)C=C)O	{1: 1, 5: 1, 6: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	7786-81-4	[O-]S(=O)(=O)[O-].[Ni+2]	{29: 4}
Did not match all atoms present	778611-64-6	CC1=CC(=NC=C1Br)Cl	{1: 1, 18: 1, 35: 1, 14: 2, 17: 1}
Did not match all atoms present	7787-32-8	[F-].[F-].[Ba+2]	{16: 2}
Did not match all atoms present	7787-33-9	O.O.[I-].[I-].[Ba+2]	{19: 2}
Did not match all atoms present	7787-34-0	O.[O-]I(=O)=O.[O-]I(=O)=O.[Ba+2]	{19: 2, 29: 6}
Did not match all atoms present	7787-35-1	[O-][Mn](=O)(=O)[O-].[Ba+2]	{29: 4}
Did not match all atoms present	7787-36-2	[O-][Mn](=O)(=O)=O.[O-][Mn](=O)(=O)=O.[Ba+2]	{29: 8}
Did not match all atoms present	7787-38-4	N(=O)[O-].N(=O)[O-].O.[Ba+2]	{34: 2, 29: 4}
Did not match all atoms present	7787-39-5	[O-]S(=O)[O-].[Ba+2]	{29: 3}
Did not match all atoms present	7787-41-9	[O-][Se](=O)(=O)[O-].[Ba+2]	{29: 4}
Did not match all atoms present	7787-42-0	[O-][W](=O)(=O)[O-].[Ba+2]	{29: 4}
Did not match all atoms present	7787-46-4	[Be+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	7787-47-5	[Be+2].[Cl-].[Cl-]	{17: 2}
Did not match all atoms present	7787-48-6	[Be+2].O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O	{17: 2, 29: 8}
Did not match all atoms present	7787-50-0	[Be+2].[F-].[F-].[F-].[K+]	{16: 3}
Did not match all atoms present	7787-52-2	[H-].[H-].[Be+2]	{}
Did not match all atoms present	7787-53-3	[Be+2].[I-].[I-]	{19: 2}
Did not match all atoms present	7787-55-5	[Be+2].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O	{}
Did not match all atoms present	7787-57-7	O(Br)Br.[Bi]	{18: 2, 22: 1}
Did not match all atoms present	7787-58-8	Br[Bi](Br)Br	{18: 3}
Did not match all atoms present	7787-59-9	O=[Bi].Cl	{17: 1, 29: 1}
Did not match all atoms present	7787-60-2	Cl[Bi](Cl)Cl	{17: 3}
Did not match all atoms present	7787-61-3	F[Bi](F)F	{16: 3}
Did not match all atoms present	7787-63-5	O=[Bi].I	{19: 1, 29: 1}
Did not match all atoms present	7787-64-6	I[Bi](I)I	{19: 3}
Did not match all atoms present	7787-68-0	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Bi+3].[Bi+3]	{29: 12}
Did not match all atoms present	7787-69-1	[Br-].[Cs+]	{18: 1}
Did not match all atoms present	7787-70-4	[Cu]Br	{18: 1}
Did not match all atoms present	7787-82-8	CC([Si](Cl)(Cl)Cl)Cl	{1: 1, 3: 1, 17: 4}
Did not match all atoms present	7787-84-0	CC([Si](C)(Cl)Cl)Cl	{1: 2, 3: 1, 17: 3}
Did not match all atoms present	7787-85-1	C[Si](CCCl)(Cl)Cl	{1: 1, 2: 2, 17: 3}
Did not match all atoms present	7787-87-3	CC([Si](C)(C)C)Cl	{1: 4, 3: 1, 17: 1}
Did not match all atoms present	7787-93-1	C[Si](CCCCl)(Cl)Cl	{1: 1, 2: 3, 17: 3}
Did not match all atoms present	77876-39-2	C[C@@H](C[C@H](C)P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4	{1: 2, 2: 1, 3: 2, 14: 20}
Did not match all atoms present	7788-37-6	CC[Ge](CC)CC.C[Ge](C)C	{1: 6, 2: 3}
Did not match all atoms present	7788-96-7	O(F)F.[Cr]	{16: 2, 22: 1}
Did not match all atoms present	7788-97-8	[F-].[F-].[F-].[Cr+3]	{16: 3}
Did not match all atoms present	7788-98-9	[NH4+].[NH4+].[O-][Cr](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	7788-99-0	O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[K+].[Cr+3]	{29: 8}
Did not match all atoms present	7789-00-6	[O-][Cr](=O)(=O)[O-].[K+].[K+]	{29: 4}
Did not match all atoms present	7789-01-7	[Li+].[Li+].O.O.[O-][Cr](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	7789-02-8	[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.O.O.O.O.[Cr+3]	{}
Did not match all atoms present	7789-04-0	[O-]P(=O)([O-])[O-].[Cr+3]	{29: 4}
Did not match all atoms present	7789-06-2	[O-][Cr](=O)(=O)[O-].[Sr+2]	{29: 4}
Did not match all atoms present	7789-09-5	[NH4+].[NH4+].[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-]	{29: 6, 22: 1}
Did not match all atoms present	7789-10-8	[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Hg+2]	{29: 6, 22: 1}
Did not match all atoms present	7789-12-0	O.O.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Na+].[Na+]	{29: 6, 22: 1}
Did not match all atoms present	7789-17-5	[I-].[Cs+]	{19: 1}
Did not match all atoms present	7789-18-6	[N+](=O)([O-])[O-].[Cs+]	{}
Did not match all atoms present	7789-20-0	[2H]O[2H]	{}
Did not match all atoms present	7789-21-1	OS(=O)(=O)F	{16: 1, 20: 1, 29: 2}
Did not match all atoms present	7789-23-3	[F-].[K+]	{16: 1}
Did not match all atoms present	7789-24-4	[Li+].[F-]	{16: 1}
Did not match all atoms present	7789-26-6	[N+](=O)([O-])OF	{16: 1, 22: 1}
Did not match all atoms present	7789-27-7	[F-].[Tl+]	{16: 1}
Did not match all atoms present	7789-28-8	[F-].[F-].[Fe+2]	{16: 2}
Did not match all atoms present	7789-36-8	O.O.O.O.O.O.[O-]Br(=O)=O.[O-]Br(=O)=O.[Mg+2]	{18: 2, 29: 6}
Did not match all atoms present	7789-38-0	[O-]Br(=O)=O.[Na+]	{18: 1, 29: 3}
Did not match all atoms present	7789-39-1	[Br-].[Rb+]	{18: 1}
Did not match all atoms present	7789-40-4	[Br-].[Tl+]	{18: 1}
Did not match all atoms present	7789-41-5	[Ca+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	7789-42-6	[Br-].[Br-].[Cd+2]	{18: 2}
Did not match all atoms present	7789-43-7	[Co](Br)Br	{18: 2}
Did not match all atoms present	7789-45-9	[Br-].[Br-].[Cu+2]	{18: 2}
Did not match all atoms present	7789-46-0	[Fe+2].[Br-].[Br-]	{18: 2}
Did not match all atoms present	7789-47-1	Br[Hg]Br	{18: 2}
Did not match all atoms present	7789-48-2	[Br-].[Br-].[Mg+2]	{18: 2}
Did not match all atoms present	7789-51-7	O=[Se](Br)Br	{18: 2, 29: 1}
Did not match all atoms present	7789-53-9	O.O.O.O.O.O.[Br-].[Br-].[Sr+2]	{18: 2}
Did not match all atoms present	7789-54-0	Br[Te]Br	{18: 2}
Did not match all atoms present	7789-56-2	O.O.O.O.O.O.O.[Br-].[Br-].[Br-].[Ce+3]	{18: 3}
Did not match all atoms present	7789-57-3	[Si](Br)(Br)Br	{18: 3}
Did not match all atoms present	7789-59-5	O=P(Br)(Br)Br	{18: 3, 29: 1}
Did not match all atoms present	7789-60-8	P(Br)(Br)Br	{18: 3}
Did not match all atoms present	7789-61-9	Br[Sb](Br)Br	{18: 3}
Did not match all atoms present	7789-65-3	[Se](Br)(Br)(Br)Br	{18: 4}
Did not match all atoms present	7789-66-4	[Si](Br)(Br)(Br)Br	{18: 4}
Did not match all atoms present	7789-67-5	Br[Sn](Br)(Br)Br	{18: 4}
Did not match all atoms present	7789-69-7	P(Br)(Br)(Br)(Br)Br	{18: 5}
Did not match all atoms present	7789-74-4	[O-]P(=O)([O-])F.[Ca+2]	{16: 1, 29: 3}
Did not match all atoms present	7789-75-5	[Ca+2].[F-].[F-]	{16: 2}
Did not match all atoms present	7789-77-7	O.O.OP(=O)([O-])[O-].[Ca+2]	{20: 1, 29: 3}
Did not match all atoms present	7789-78-8	[Ca].[H].[H]	{}
Did not match all atoms present	7789-79-9	[O-]P=O.[O-]P=O.[Ca+2]	{29: 4}
Did not match all atoms present	7789-80-2	[O-]I(=O)=O.[O-]I(=O)=O.[Ca+2]	{19: 2, 29: 6}
Did not match all atoms present	7789-82-4	[O-][Mo](=O)(=O)[O-].[Ca+2]	{29: 4}
Did not match all atoms present	77897-14-4	CC1=C2CCC3=C(C(=C(CCC(=C1)C(=C2C)C)C=C3)C)C	{1: 5, 11: 4, 14: 3}
Did not match all atoms present	77897-17-7	CC1=C(C2=C(C(=C1CCC3=C(C(=C(CC2)C=C3)C)C)C)C)C	{1: 6, 11: 4, 14: 2}
Did not match all atoms present	77897-19-9	CC1=C2CCC3=C(C(=C(CCC(=C1)C(=C2C)C)C(=C3C)C)C)C	{1: 7, 11: 4, 14: 1}
Did not match all atoms present	77897-20-2	CC1=C(C2=C(C(=C1CCC3=C(C(=C(CC2)C(=C3C)C)C)C)C)C)C	{1: 8, 11: 4}
Did not match all atoms present	779-02-2	CC1=C2C=CC=CC2=CC3=CC=CC=C13	{1: 1, 14: 9}
Did not match all atoms present	779-03-3	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2N	{30: 1, 14: 9}
Did not match all atoms present	779-30-6	CC(=O)NC1=CC2=CC=CC=C2OC1=O	{24: 1, 1: 1, 28: 1, 14: 5, 31: 1}
Did not match all atoms present	779-47-5	CC(C)NC(=O)C1=CC=C(C=C1)C(=O)O	{1: 2, 3: 1, 14: 4, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	779-51-1	C/C(=C\C1=CC=CC=C1)/C2=CC=CC=C2	{1: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	779-84-0	C1=CC=C(C=C1)N/C=C\2/C=CC=CC2=O	{25: 1, 31: 1, 14: 9, 6: 1, 15: 1}
Did not match all atoms present	779-89-5	C1=CC(=CC(=C1)C(F)(F)F)/C=C/C(=O)O	{16: 3, 27: 1, 4: 1, 14: 4, 6: 2}
Did not match all atoms present	779-90-8	CC(=O)C1=CC(=CC(=C1)C(=O)C)C(=O)C	{24: 3, 1: 3, 14: 3}
Did not match all atoms present	7790-21-8	[O-]I(=O)(=O)=O.[K+]	{19: 1, 29: 4}
Did not match all atoms present	7790-22-9	[Li+].O.O.O.[I-]	{19: 1}
Did not match all atoms present	7790-28-5	[O-]I(=O)(=O)=O.[Na+]	{19: 1, 29: 4}
Did not match all atoms present	7790-29-6	[Rb+].[I-]	{19: 1}
Did not match all atoms present	7790-30-9	I[Tl]	{19: 1}
Did not match all atoms present	7790-31-0	O.O.O.O.O.O.O.O.[I-].[I-].[Mg+2]	{19: 2}
Did not match all atoms present	7790-32-1	[O-]I(=O)=O.[O-]I(=O)=O.[Mg+2]	{19: 2, 29: 6}
Did not match all atoms present	7790-33-2	[I-].[I-].[Mn+2]	{19: 2}
Did not match all atoms present	7790-37-6	[O-]I(=O)=O.[O-]I(=O)=O.[Zn+2]	{19: 2, 29: 6}
Did not match all atoms present	7790-38-7	[I-].[I-].[Pd+2]	{19: 2}
Did not match all atoms present	7790-41-2	I[Ir](I)I	{19: 3}
Did not match all atoms present	7790-44-5	[Sb](I)(I)I	{19: 3}
Did not match all atoms present	7790-45-6	I[Ir](I)(I)I	{19: 4}
Did not match all atoms present	7790-47-8	[Sn](I)(I)(I)I	{19: 4}
Did not match all atoms present	7790-53-6	[O-]P(=O)=O.[K+]	{29: 3}
Did not match all atoms present	7790-59-2	[O-][Se](=O)(=O)[O-].[K+].[K+]	{29: 4}
Did not match all atoms present	7790-60-5	[O-][W](=O)(=O)[O-].[K+].[K+]	{29: 4}
Did not match all atoms present	7790-62-7	[O-]S(=O)(=O)OS(=O)(=O)[O-].[K+].[K+]	{29: 6, 22: 1}
Did not match all atoms present	7790-69-4	[Li+].[N+](=O)([O-])[O-]	{}
Did not match all atoms present	7790-71-8	[Li+].[Li+].O.[O-][Se](=O)(=O)[O-]	{29: 4}
Did not match all atoms present	7790-76-3	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Ca+2].[Ca+2]	{29: 6, 22: 1}
Did not match all atoms present	7790-80-9	[Cd+2].[I-].[I-]	{19: 2}
Did not match all atoms present	7790-81-0	[O-]I(=O)=O.[O-]I(=O)=O.[Cd+2]	{19: 2, 29: 6}
Did not match all atoms present	7790-84-3	O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Cd+2]	{29: 4}
Did not match all atoms present	7790-86-5	[Cl-].[Cl-].[Cl-].[Ce+3]	{17: 3}
Did not match all atoms present	7790-87-6	[Ce+3].[I-].[I-].[I-]	{19: 3}
Did not match all atoms present	7790-94-5	OS(=O)(=O)Cl	{17: 1, 20: 1, 29: 2}
Did not match all atoms present	7790-98-9	[NH4+].[O-]Cl(=O)(=O)=O	{17: 1, 29: 4}
Did not match all atoms present	77902-86-4	C1=CC=C2C(=C1)C=CC(=O)O2.OS(=O)(=O)O	{28: 1, 20: 2, 29: 2, 14: 6}
Did not match all atoms present	7791-03-9	[Li+].[O-]Cl(=O)(=O)=O	{17: 1, 29: 4}
Did not match all atoms present	7791-07-3	O.[O-]Cl(=O)(=O)=O.[Na+]	{17: 1, 29: 4}
Did not match all atoms present	7791-08-4	O=[Sb].Cl	{17: 1, 29: 1}
Did not match all atoms present	7791-10-8	[O-]Cl(=O)=O.[O-]Cl(=O)=O.[Sr+2]	{17: 2, 29: 6}
Did not match all atoms present	7791-11-9	[Cl-].[Rb+]	{17: 1}
Did not match all atoms present	7791-12-0	[Cl-].[Tl+]	{17: 1}
Did not match all atoms present	7791-16-4	[F-].[F-].[F-].[Cl-].[Cl-].[Sb]	{16: 3, 17: 2}
Did not match all atoms present	7791-20-0	O.O.O.O.O.O.Cl[Ni]Cl	{17: 2}
Did not match all atoms present	7791-23-3	O=[Se](Cl)Cl	{17: 2, 29: 1}
Did not match all atoms present	7791-25-5	O=S(=O)(Cl)Cl	{17: 2, 29: 2}
Did not match all atoms present	7791-26-6	O=[U]=O.Cl.Cl	{17: 2, 29: 2}
Did not match all atoms present	7791-27-7	O=S(=O)(OS(=O)(=O)Cl)Cl	{17: 2, 29: 4, 22: 1}
Did not match all atoms present	7791-28-8	O.O.[Br-].[Br-].[Ba+2]	{18: 2}
Did not match all atoms present	7791-49-3	COC1=CC2=NO[N+](=C2C=C1)[O-]	{1: 1, 35: 1, 33: 1, 14: 3, 22: 1, 23: 1}
Did not match all atoms present	77933-52-9	CC#N.CC#N.[N+](=O)([O-])[O-].Cl[Pd+]	{1: 2, 37: 2, 17: 1}
Did not match all atoms present	77942-80-4	CCC(C)(C)C1=C(C=CC=C1S(=O)(=O)O)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N.C(CO)N(CCO)CCO	{1: 3, 2: 7, 4: 1, 33: 1, 14: 8, 20: 4, 21: 1, 22: 1, 25: 2, 29: 2, 30: 1}
Did not match all atoms present	77943-39-6	C[C@@H]1[C@@H](OC(=O)N1)C2=CC=CC=C2	{32: 1, 1: 1, 12: 2, 14: 5, 28: 1}
Did not match all atoms present	77944-89-9	CC1=C(C(=CC=C1)Cl)NC(=O)OCC[NH+]2CCCC2.[Cl-]	{1: 1, 2: 2, 11: 4, 14: 3, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	77945-03-0	CC[NH+](CC)CCN(C1=C(C=CC=C1C)C)C(=O)C2=CC(=NC3=CC=CC=C32)OCC.[Cl-]	{1: 5, 2: 5, 35: 1, 33: 1, 14: 8, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	77945-09-6	CC[NH+](CC)CCN(C1=C(C=CC=C1C)C)C(=O)/C=C/C.[Cl-]	{1: 5, 2: 4, 6: 2, 33: 1, 14: 3, 17: 1, 24: 1}
Did not match all atoms present	7795-87-1	CCCCCCCCCCOP(=O)(O)OCCCCCCCCCC	{1: 2, 2: 18, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	7795-95-1	CCCCCCCCS(=O)(=O)Cl	{1: 1, 2: 7, 29: 2, 17: 1}
Did not match all atoms present	77966-20-2	CCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)N(CC[NH+](CC)CC)C3=C(C=CC=C3C)C.[Cl-]	{1: 5, 2: 7, 35: 1, 33: 1, 14: 8, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	77966-25-7	CCCC[NH2+]CC(=O)NC1=CC=C(C=C1)OCC.[Cl-]	{1: 2, 2: 5, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-26-8	CC[NH+](CC)CC(=O)NC1=CC=CC=C1OCC.[Cl-]	{1: 3, 2: 4, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-27-9	CC[NH+](CC)CC(=O)NC1=CC=C(C=C1)OCC.[Cl-]	{1: 3, 2: 4, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-28-0	CCOC1=CC=C(C=C1)NC(=O)C[NH+]2CCCC2.[Cl-]	{1: 1, 2: 2, 11: 4, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-30-4	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]CC=C.[Cl-]	{1: 1, 2: 2, 5: 1, 6: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-31-5	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]CC2=CC=CC=C2.[Cl-]	{1: 1, 2: 2, 14: 8, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-32-6	CC[NH+](CC)CC(=O)N(CC1=CC=CC=C1)C2=C(C=CC=C2Cl)C.[Cl-]	{1: 3, 2: 4, 33: 1, 14: 8, 17: 2, 24: 1}
Did not match all atoms present	77966-34-8	CC[NH+](CC)CCC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2C.[Cl-].[Cl-]	{1: 3, 2: 7, 14: 9, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-38-2	CC[NH+](CC)CC[NH+](CC1=CC=C(C=C1)Cl)CC(=O)NC2=C(C=CC=C2Cl)C.[Cl-].[Cl-]	{1: 3, 2: 6, 14: 7, 17: 4, 24: 1, 31: 1}
Did not match all atoms present	77966-40-6	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]C2CCCCC2.[Cl-]	{1: 1, 2: 1, 11: 5, 12: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-41-7	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH+](C)C2CCCCC2.[Cl-]	{1: 2, 2: 1, 11: 5, 12: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-42-8	CCCC[NH+](CCCC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 3, 2: 7, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-43-9	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=C(C=C(C=C1)Cl)C.[Cl-].[Cl-]	{1: 4, 2: 5, 14: 3, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	77966-44-0	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=C(C=CC(=C1)Cl)C.[Cl-].[Cl-]	{1: 4, 2: 5, 14: 3, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	77966-45-1	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=C(C=CC(=C1)C)Cl.[Cl-].[Cl-]	{1: 4, 2: 5, 14: 3, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	77966-46-2	CC[NH+](CC)CC(=O)NC1=C(C(=CC=C1)Cl)C.[Cl-]	{1: 3, 2: 3, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-47-3	CC[NH+](CC)CC(=O)NC1=C(C=C(C=C1)Cl)C.[Cl-]	{1: 3, 2: 3, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-48-4	CCN(CC)CC(=O)NC1=C(C=CC(=C1)Cl)C	{1: 3, 2: 3, 33: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-49-5	CC[NH+](CC)CC(=O)NC1=C(C=CC(=C1)C)Cl.[Cl-]	{1: 3, 2: 3, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-51-9	CC[NH+](CC)CC(=O)N(C)C1=C(C=CC=C1Cl)C.[Cl-]	{1: 4, 2: 3, 33: 1, 14: 3, 17: 2, 24: 1}
Did not match all atoms present	77966-52-0	CC[NH+](CC)CC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F.[Cl-]	{1: 2, 2: 3, 4: 1, 14: 3, 16: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-53-1	CC[NH+](CC)CC(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl.[Cl-]	{1: 2, 2: 3, 4: 1, 14: 3, 16: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-54-2	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH+](C(C)C)C(C)C.[Cl-]	{1: 5, 2: 1, 3: 2, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-55-3	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH+](C)C.[Cl-]	{1: 3, 2: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-56-4	CC1=C(C(=CC=C1)Cl)N(C)C(=O)C[NH+](C)C.[Cl-]	{1: 4, 2: 1, 33: 1, 14: 3, 17: 2, 24: 1}
Did not match all atoms present	77966-58-6	CCC[NH+](CCC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 3, 2: 5, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-59-7	CC[NH2+]CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 2, 2: 2, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-61-1	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]C(C)C.[Cl-]	{1: 3, 2: 1, 3: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-62-2	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]C.[Cl-]	{1: 2, 2: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-63-3	CC1CCCCN1CC(=O)NC2=C(C=CC=C2Cl)C.[Cl-]	{1: 2, 2: 1, 33: 1, 11: 4, 12: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-67-7	CC1=C(C(=CC=C1)Cl)NC(=O)C[NH+]2CCCCC2.[Cl-]	{1: 1, 2: 1, 11: 5, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-68-8	CCC[NH2+]CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 2, 2: 3, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-70-2	CC[NH+](CC)CC(=O)NC1=C(C=C(C=C1Br)C)Br.[Cl-]	{1: 3, 2: 3, 14: 2, 17: 1, 18: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-71-3	CC[NH+](CC)CC(=O)N(CC)C1=CC=CC=C1C.[Cl-]	{1: 4, 2: 4, 33: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	77966-72-4	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=CC=CC=C1C.[Cl-].[Cl-]	{1: 4, 2: 5, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-73-5	CC[NH+](CC)CC(=O)N(C)C1=CC=CC=C1C.[Cl-]	{1: 4, 2: 3, 33: 1, 14: 4, 17: 1, 24: 1}
Did not match all atoms present	77966-75-7	CC[NH+](CC)CCC[NH+](CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.[Cl-].[Cl-]	{1: 4, 2: 7, 14: 8, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-77-9	CCCCN(C1=C(C=CC=C1C)C)C(=O)C[NH2+]CC.[Cl-]	{1: 4, 2: 5, 33: 1, 14: 3, 17: 1, 24: 1}
Did not match all atoms present	77966-79-1	CCCC[NH+](CCCC)CC(=O)NC1=C(C=CC=C1C)C.[Cl-]	{1: 4, 2: 7, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-80-4	CC[NH+](CC)CCN(C1=C(C=CC=C1C)C)C(=O)C.[Cl-]	{1: 5, 2: 4, 33: 1, 14: 3, 17: 1, 24: 1}
Did not match all atoms present	77966-81-5	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=C(C=CC=C1C)C.[Cl-].[Cl-]	{1: 5, 2: 5, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77966-82-6	CC[NH+](CC)CC(=O)NC1=CC(=CC(=C1)C)C.[Cl-]	{1: 4, 2: 3, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-83-7	CC[NH+](CC)CC(=O)N(C)C1=C(C=CC=C1C)C.[Cl-]	{1: 5, 2: 3, 33: 1, 14: 3, 17: 1, 24: 1}
Did not match all atoms present	77966-84-8	CC1=C(C(=CC=C1)C)NC(=O)C[NH+](C(C)C)C(C)C.[Cl-]	{1: 6, 2: 1, 3: 2, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-85-9	CC1CCCC([NH+]1CC(=O)NC2=C(C=CC=C2C)C)C.[Cl-]	{1: 4, 2: 1, 11: 3, 12: 2, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-90-6	CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCCCC2.[Cl-]	{1: 2, 2: 1, 11: 5, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	77966-93-9	CC1CCCC([NH+]1CC(=O)NC2=C(C=CC=C2Cl)C)C.[Cl-]	{1: 3, 2: 1, 11: 3, 12: 2, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77967-05-6	C[N+](C)(CCO)C(=O)CCC1=CC=C(C=C1)C2=CC=C(C=C2)CCC(=O)[N+](C)(C)CCO.[Br-].[Br-]	{1: 4, 2: 8, 14: 8, 18: 2, 20: 2, 24: 2}
Did not match all atoms present	77967-24-9	CCN(CC)CC(=O)NC1=CC=CC=C1C(=O)OCC.Cl	{1: 3, 2: 4, 33: 1, 14: 4, 17: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	77967-25-0	CCN(CC)CC(=O)NC1=CC=CC=C1C(=O)OC.Cl	{1: 3, 2: 3, 33: 1, 14: 4, 17: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	7797-81-1	C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)O	{25: 2, 20: 1, 14: 6, 33: 1}
Did not match all atoms present	7797-83-3	C1OC2=CC=CC(=C2O1)C=O	{26: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	77984-94-2	CC[NH+](CC)CC[NH+](C)CC(=O)NC1=C(C(=CC=C1)Cl)C.[Cl-].[Cl-]	{1: 4, 2: 5, 14: 3, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	77985-00-3	C[N+](C)(CCO)CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2.[Br-]	{1: 2, 2: 3, 14: 9, 18: 1, 20: 1, 24: 1}
Did not match all atoms present	77985-16-1	CC[NH+](CC)C(C)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 4, 2: 3, 3: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77985-17-2	CCC[NH2+]C(CC)C(=O)NC1=C(C=CC=C1Cl)C.[Cl-]	{1: 3, 2: 3, 3: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	77985-21-8	CC[NH+](CC)C(C)CC(=O)NC1=C(C=CC=C1C)C.[Cl-]	{1: 5, 2: 3, 3: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	77985-23-0	CC[NH+](CC)CCNC(=O)OC1=C(C=CC=C1Cl)C.[Cl-]	{1: 3, 2: 4, 14: 3, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	77985-24-1	CC[NH+](CC)CCNC(=O)OC1=C(C=C(C=C1C)C)C.[Cl-]	{1: 5, 2: 4, 14: 2, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	77985-25-2	CC[NH+](CC)CCNC(=O)OC1=C(C=CC=C1C)C.[Cl-]	{1: 4, 2: 4, 14: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	77985-27-4	CC1=C(C(=CC=C1)Cl)OC(=O)NCC[NH+]2CCCCC2.[Cl-]	{1: 1, 2: 2, 11: 5, 14: 3, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	77985-28-5	CC1=CC(=C(C(=C1)C)OC(=O)NCC[NH+]2CCCCC2)C.[Cl-]	{1: 3, 2: 2, 11: 5, 14: 2, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	77985-29-6	CC1=C(C(=CC=C1)C)OC(=O)NCC[NH+]2CCCCC2.[Cl-]	{1: 2, 2: 2, 11: 5, 14: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	77985-30-9	CC1=C(C(=CC=C1)Cl)OC(=O)NCC[NH+]2CCCC2.[Cl-]	{1: 1, 2: 2, 11: 4, 14: 3, 17: 2, 28: 1, 31: 1}
Did not match all atoms present	77985-31-0	CC1=CC(=C(C(=C1)C)OC(=O)NCC[NH+]2CCCC2)C.[Cl-]	{1: 3, 2: 2, 11: 4, 14: 2, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	77985-32-1	CC1=C(C(=CC=C1)C)OC(=O)NCC[NH+]2CCCC2.[Cl-]	{1: 2, 2: 2, 11: 4, 14: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	77986-14-2	CC(=C)C1=CC=CC=C1.CC(C)(C)CC(C)(C)C1=CC=CC=C1O.C=CC1=CC=CC=C1	{1: 6, 2: 1, 4: 2, 5: 2, 6: 1, 7: 1, 14: 14, 21: 1}
Did not match all atoms present	77987-49-6	C1=CC=C(C=C1)COC(=O)NCCO	{28: 1, 2: 3, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	78-00-2	CC[Pb](CC)(CC)CC	{1: 4, 2: 4}
Did not match all atoms present	78-06-8	CCCC[Sn]1(OC(=O)CCS1)CCCC	{1: 2, 2: 6, 11: 2, 28: 1, 41: 1}
Did not match all atoms present	78-07-9	CCO[Si](CC)(OCC)OCC	{1: 4, 2: 4, 22: 3}
Did not match all atoms present	78-10-4	CCO[Si](OCC)(OCC)OCC	{1: 4, 2: 4, 22: 4}
Did not match all atoms present	78-11-5	C(C(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-])O[N+](=O)[O-]	{2: 4, 4: 1, 22: 4}
Did not match all atoms present	78-13-7	CCC(CC)CO[Si](OCC(CC)CC)(OCC(CC)CC)OCC(CC)CC	{1: 8, 2: 12, 3: 4, 22: 4}
Did not match all atoms present	78-20-6	CCCC[Sn]1(OC(=O)CS1)CCCC	{1: 2, 2: 6, 11: 1, 28: 1, 41: 1}
Did not match all atoms present	78-21-7	CCCCCCCCCCCCCCCC[N+]1(CCOCC1)CC.CCOS(=O)(=O)[O-]	{1: 3, 2: 17, 11: 4, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	78-30-8	CC1=CC=CC=C1OP(=O)(OC2=CC=CC=C2C)OC3=CC=CC=C3C	{1: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	78-32-0	CC1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C)OC3=CC=C(C=C3)C	{1: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	78-33-1	CC(C)(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C(C)(C)C)OC3=CC=C(C=C3)C(C)(C)C	{1: 9, 4: 3, 22: 3, 14: 12, 29: 1}
Did not match all atoms present	78-34-2	CCOP(=S)(OCC)SC1C(OCCO1)SP(=S)(OCC)OCC	{1: 4, 2: 4, 40: 2, 11: 2, 12: 2, 22: 4, 23: 2}
Did not match all atoms present	78-37-5	CC(=CCCC(C)(C=C)OC(=O)C=CC1=CC=CC=C1)C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 4, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	78-38-6	CCOP(=O)(CC)OCC	{1: 3, 2: 3, 29: 1, 22: 2}
Did not match all atoms present	78-40-0	CCOP(=O)(OCC)OCC	{1: 3, 2: 3, 29: 1, 22: 3}
Did not match all atoms present	78-41-1	CCN(CC)CCOC1=CC=C(C=C1)C(CC2=CC=C(C=C2)Cl)(C3=CC=C(C=C3)C)O	{1: 3, 2: 5, 4: 1, 33: 1, 14: 12, 17: 1, 20: 1, 22: 1}
Did not match all atoms present	78-42-2	CCCCC(CC)COP(=O)(OCC(CC)CCCC)OCC(CC)CCCC	{1: 6, 2: 15, 3: 3, 29: 1, 22: 3}
Did not match all atoms present	78-43-3	C(C(CCl)Cl)OP(=O)(OCC(CCl)Cl)OCC(CCl)Cl	{17: 6, 2: 6, 3: 3, 29: 1, 22: 3}
Did not match all atoms present	78-46-6	CCCCOP(=O)(CCCC)OCCCC	{1: 3, 2: 9, 29: 1, 22: 2}
Did not match all atoms present	78-47-7	CCCCOP(=S)(OCCCC)OCCCC	{1: 3, 2: 9, 22: 3}
Did not match all atoms present	78-48-8	CCCCSP(=O)(SCCCC)SCCCC	{40: 3, 1: 3, 2: 9, 29: 1}
Did not match all atoms present	78-50-2	CCCCCCCCP(=O)(CCCCCCCC)CCCCCCCC	{1: 3, 2: 21, 29: 1}
Did not match all atoms present	78-51-3	CCCCOCCOP(=O)(OCCOCCCC)OCCOCCCC	{1: 3, 2: 15, 29: 1, 22: 6}
Did not match all atoms present	78-53-5	CCN(CC)CCSP(=O)(OCC)OCC	{1: 4, 2: 6, 33: 1, 40: 1, 22: 2, 29: 1}
Did not match all atoms present	78-57-9	COP(=S)(OC)SCC1=NC(=NC(=N1)N)N	{1: 2, 2: 1, 35: 3, 40: 1, 22: 2, 30: 2}
Did not match all atoms present	78-62-6	CCO[Si](C)(C)OCC	{1: 4, 2: 2, 22: 2}
Did not match all atoms present	78-73-9	C[N+](C)(C)CCO.C(=O)(O)[O-]	{1: 3, 2: 2, 27: 1, 20: 1}
Did not match all atoms present	780-11-0	CC(C)(C)C1=CC(=CC=C1)OC(=O)NC	{1: 4, 31: 1, 4: 1, 14: 4, 28: 1}
Did not match all atoms present	780-21-2	C1=CC=C(C=C1)C=NC2=CC=C(C=C2)Cl	{17: 1, 34: 1, 14: 9, 6: 1}
Did not match all atoms present	780-24-5	C1=CC=C(C=C1)C[Hg]CC2=CC=CC=C2	{2: 2, 14: 10}
Did not match all atoms present	780-25-6	C1=CC=C(C=C1)CN=CC2=CC=CC=C2	{2: 1, 34: 1, 14: 10, 6: 1}
Did not match all atoms present	780-68-7	C1C2CC3CC1CC(C2)(C3)C4=CC=CC=C4	{11: 6, 12: 3, 13: 1, 14: 5}
Did not match all atoms present	780-69-8	CCO[Si](C1=CC=CC=C1)(OCC)OCC	{1: 3, 2: 3, 22: 3, 14: 5}
Did not match all atoms present	78013-51-1	C1=C(C=C(N=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{35: 1, 38: 3, 14: 2}
Did not match all atoms present	7803-51-2	P	{}
Did not match all atoms present	7803-54-5	[NH2-].[NH2-].[Mg+2]	{}
Did not match all atoms present	7803-55-6	[NH4+].[O-][V](=O)=O	{29: 3}
Did not match all atoms present	7803-57-8	NN.O	{30: 2}
Did not match all atoms present	7803-58-9	NS(=O)(=O)N	{29: 2, 30: 2}
Did not match all atoms present	7803-60-3	OP(=O)(O)P(=O)(O)O	{20: 4, 29: 2}
Did not match all atoms present	7803-62-5	[SiH4]	{}
Did not match all atoms present	7803-63-6	[NH4+].OS(=O)(=O)[O-]	{20: 1, 29: 3}
Did not match all atoms present	7803-65-8	[NH4+].[O-]P=O	{29: 2}
Did not match all atoms present	78062-03-0	CN(C)C1=CC=C(C2=CC=CC=C21)C(=O)O	{1: 2, 27: 1, 14: 6, 33: 1}
Did not match all atoms present	78092-53-2	CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=CC(=CC(=C5O)CC6=C(C(=CC(=C6)C(C)(C)C)CC7=C(C(=CC(=C7)C(C)(C)C)C2)O)O)C(C)(C)C)C(C)(C)C)C(C)(C)C)O	{1: 18, 11: 6, 4: 6, 21: 6, 14: 12}
Did not match all atoms present	781-17-9	C1CC2=C3C(=CC=C2)CCC4=CC=CC1=C43	{11: 4, 14: 6}
Did not match all atoms present	781-35-1	CC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2	{24: 1, 1: 1, 3: 1, 14: 10}
Did not match all atoms present	781-43-1	CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C	{1: 2, 14: 8}
Did not match all atoms present	781-73-7	CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3C2	{24: 1, 1: 1, 11: 1, 14: 7}
Did not match all atoms present	78100-57-9	CC(C)NCC(COC1=C(C=C(C=C1)C(=O)OC)OC)O	{1: 4, 2: 2, 3: 2, 14: 3, 20: 1, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	78103-84-1	CC1(CCC(C2=CC=CC=C21)C#N)C	{1: 2, 37: 1, 11: 2, 12: 1, 13: 1, 14: 4}
Did not match all atoms present	78109-79-2	CCCCOC1=CC=CC=C1C(=O)NCCC[NH+](CCO)CCO.[Cl-]	{1: 1, 2: 10, 14: 4, 17: 1, 20: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	78109-80-5	CCCCOC1=CC=CC=C1C(=O)NC(C)CCC[NH+](CC)CC.[Cl-]	{1: 4, 2: 8, 3: 1, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	78109-81-6	CCCCOC1=CC=CC=C1C(=O)NCCC[NH+](CC)CC.[Cl-]	{1: 3, 2: 8, 14: 4, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	78109-87-2	CC[NH+](CC)CCNC(=O)C1=C(C=C(C=C1C)C)C.[Cl-]	{1: 5, 2: 4, 14: 2, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	78109-88-3	CCOC1=CC=CC=C1C(=O)NCCCN2CCOCC2	{1: 1, 2: 4, 33: 1, 11: 4, 14: 4, 22: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	78109-90-7	C1=CC=C(C=C1)C2=NN(C=C2)C3=CC=C(C=C3)S(=O)(=O)O	{33: 1, 35: 1, 20: 1, 29: 2, 14: 11}
Did not match all atoms present	78110-10-8	CC1=C(C(=CC=C1)Cl)N(C(=O)C)C(=O)CN2CCCC2.Cl	{1: 2, 2: 1, 33: 2, 11: 4, 14: 3, 17: 2, 24: 2}
Did not match all atoms present	78110-23-3	CC1=CC(=C(C(=C1)C)OCC(C)NC(C)C)C.Cl	{1: 6, 2: 1, 3: 2, 14: 2, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	78110-37-9	COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCNCCCl.COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCNCCCl.O.O.O.Cl.Cl.Cl.Cl	{1: 2, 2: 8, 35: 2, 14: 12, 17: 8, 22: 2, 31: 4}
Did not match all atoms present	78110-38-0	C[C@H]1[C@@H](C(=O)N1S(=O)(=O)O)NC(=O)/C(=N\OC(C)(C)C(=O)O)/C2=CSC(=N2)N	{1: 3, 34: 1, 35: 1, 4: 1, 33: 1, 7: 1, 41: 1, 12: 2, 14: 1, 20: 1, 22: 1, 24: 1, 25: 1, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	78128-69-5	CCCOC1=CC=CC=C1C(=O)NCCC[NH+](CCO)CCO.[Cl-]	{1: 1, 2: 9, 14: 4, 17: 1, 20: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	78128-83-3	CC1=C(COC1=O)N(CCN(C)C)C2=CC=CC=C2	{1: 3, 2: 2, 33: 2, 11: 1, 14: 5, 15: 2, 28: 1}
Did not match all atoms present	78128-85-5	C1C(=C(C(=O)O1)CCCC2=CC=CC=C2)O	{2: 3, 11: 1, 14: 5, 15: 2, 20: 1, 28: 1}
Did not match all atoms present	78129-68-7	CC(C)(C)C#P	{1: 3, 10: 1, 4: 1}
Did not match all atoms present	78134-03-9	CN1CCN(C(=S)C1=S)C	{1: 2, 11: 2, 33: 2, 15: 2}
Did not match all atoms present	78134-09-5	CC(C)N1CCCN(C(=S)C1=O)C(C)C	{1: 4, 3: 2, 33: 2, 11: 3, 15: 1, 25: 1}
Did not match all atoms present	78140-52-0	CC1(CC(C(N1O)(C)C)CN=C=S)C	{1: 4, 2: 1, 34: 1, 33: 1, 8: 1, 11: 1, 12: 1, 13: 2, 20: 1}
Did not match all atoms present	78156-03-3	CN(C)CCNC1=CC=CC=C1N	{1: 2, 2: 2, 33: 1, 14: 4, 30: 1, 31: 1}
Did not match all atoms present	78164-31-5	CC1=C(C=C(C=C1)C(F)(F)F)C	{16: 3, 1: 2, 4: 1, 14: 3}
Did not match all atoms present	78164-63-3	C1=CN(C=C1)P(F)F	{16: 2, 33: 1, 14: 4}
Did not match all atoms present	78168-93-1	CCSC1=NC(=O)N(C(=O)N1N)CC(C)(C)C	{1: 4, 2: 2, 35: 1, 4: 1, 33: 2, 40: 1, 25: 2, 30: 1}
Did not match all atoms present	78173-90-7	C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@]([C@@H](C3=C2C(=C4C(=C3)C(=O)C5=C(C4=O)C(=CC=C5)O)O)C(=O)OC)(CC(=O)C)O)N(C)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@H]7CCC(=O)[C@@H](O7)C)O	{1: 7, 2: 1, 33: 1, 11: 5, 12: 12, 13: 1, 14: 4, 20: 2, 21: 2, 22: 3, 23: 3, 24: 1, 25: 3, 28: 1}
Did not match all atoms present	78173-91-8	C[C@H]1[C@@H]2[C@H](C[C@@H](O1)O[C@@H]3[C@@H](O[C@H](C[C@@H]3N(C)C)O[C@H]4C[C@@]([C@@H](C5=C4C(=C6C(=C5)C(=O)C7=C(C6=O)C(=CC=C7)O)O)C(=O)OC)(C)O)C)O[C@H]8CC(=O)[C@@H](O[C@H]8O2)C	{1: 7, 33: 1, 11: 4, 12: 13, 13: 1, 14: 4, 20: 1, 21: 2, 22: 2, 23: 5, 25: 3, 28: 1}
Did not match all atoms present	78173-92-9	C[C@H]1[C@H]([C@H](C[C@H](O1)O[C@H]2C[C@@]([C@@H](C3=C2C(=C4C(=C3)C(=O)C5=C(C4=O)C(=CC=C5)O)O)C(=O)OC)(C)O)N(C)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@@H]7CCC(=O)[C@@H](O7)C)O	{1: 7, 33: 1, 11: 5, 12: 12, 13: 1, 14: 4, 20: 2, 21: 2, 22: 3, 23: 3, 25: 3, 28: 1}
Did not match all atoms present	78182-00-0	C[N+](C)(CCCO)CCO.[Cl-]	{1: 2, 2: 5, 20: 2, 17: 1}
Did not match all atoms present	78186-37-5	CC1=C(C(=CC=C1)C)NC(=O)C2CC[NH+](CC2)C.[Cl-]	{1: 3, 11: 4, 12: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	78186-39-7	C1=CC=C2C=[N+](C=CC2=C1)CCCN3C=CC(=C[NH+]=O)C=C3.[Br-].[Br-]	{33: 2, 2: 3, 6: 1, 14: 11, 15: 1, 18: 2, 29: 1, 31: 1}
Did not match all atoms present	78186-61-5	CC1(OC2=CC=CC=C2O1)[NH2+]C.[Cl-]	{1: 2, 23: 2, 13: 1, 14: 4, 17: 1}
Did not match all atoms present	78193-30-3	C[C@H]1[C@@H]2[C@H](C[C@@H](O1)O[C@@H]3[C@@H](O[C@H](C[C@@H]3N(C)C)O[C@H]4C[C@@]([C@@H](C5=C4C(=C6C(=C5)C(=O)C7=C(C6=O)C(=CC=C7)O)O)C(=O)OC)(CC(=O)C)O)C)O[C@H]8CC(=O)[C@@H](O[C@H]8O2)C	{1: 7, 2: 1, 33: 1, 11: 4, 12: 13, 13: 1, 14: 4, 20: 1, 21: 2, 22: 2, 23: 5, 24: 1, 25: 3, 28: 1}
Did not match all atoms present	78194-09-9	CC1=C(C(=C(C=C1)C)OC)N(COC(C)C)C(=O)CCl	{1: 5, 2: 2, 3: 1, 33: 1, 14: 2, 17: 1, 22: 2, 24: 1}
Did not match all atoms present	782-06-9	C/C(=C(/C)\C1=CC=CC=C1)/C2=CC=CC=C2	{1: 2, 14: 10, 7: 2}
Did not match all atoms present	782-17-2	C1=CC=C2C(=C1)C=C(N2)C3=CC=C(C=C3)F	{16: 1, 32: 1, 14: 9}
Did not match all atoms present	782-74-1	C1=CC=C(C(=C1)NNC2=CC=CC=C2Cl)Cl	{17: 2, 14: 8, 31: 2}
Did not match all atoms present	782-92-3	CC(=O)C1=CC=C(C=C1)CC2=CC=CC=C2	{24: 1, 1: 1, 2: 1, 14: 9}
Did not match all atoms present	78205-93-3	CCC1=[C-]CC=C1.CCC1=[C-]CC=C1.[Cl-].[Cl-].[Hf+4]	{1: 2, 2: 2, 11: 2, 14: 4, 15: 2, 17: 2}
Did not match all atoms present	78210-51-2	C1=CC=NC(=C1)CN2C=CC=C2	{33: 1, 2: 1, 35: 1, 14: 8}
Did not match all atoms present	78218-16-3	CCN(CCCNC1=C2C=CC=C(C2=NC3=CC=CC=C31)OC)CCCl.CCN(CCCNC1=C2C=CC=C(C2=NC3=CC=CC=C31)OC)CCCl.O.Cl.Cl.Cl.Cl	{1: 4, 2: 12, 35: 2, 33: 2, 14: 14, 17: 6, 22: 2, 31: 2}
Did not match all atoms present	78218-37-8	CC1=C(C(=CC=C1)Cl)NC(=O)CCN(C)C.Cl	{1: 3, 2: 2, 33: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	78218-38-9	CC1=C(C(=CC=C1)Cl)NC(=O)CCNC.Cl	{1: 2, 2: 2, 14: 3, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	78218-40-3	CC1=C(C(=CC=C1)Cl)NC(=O)CCN2CCCCC2.Cl	{1: 1, 2: 2, 33: 1, 11: 5, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	78218-42-5	CC1CCCCN1CCC(=O)NC2=C(C=CC=C2Cl)C.Cl	{1: 2, 2: 2, 33: 1, 11: 4, 12: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	78218-43-6	CCCCNC(C)C(=O)N(CCCC)C1=C(C=CC=C1C)C.Cl	{1: 5, 2: 6, 3: 1, 33: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	78218-49-2	C1=CC=C(C=C1)C2=C(N(N=C2C3=CC=CC=C3)C4=CC=CC=C4)CC(=O)[O-].[Na+]	{24: 1, 33: 1, 2: 1, 35: 1, 14: 15}
Did not match all atoms present	78219-00-8	C(C(CSP(=O)(O)O)N)N	{2: 2, 3: 1, 40: 1, 20: 2, 29: 1, 30: 2}
Did not match all atoms present	78219-33-7	CCN1CCCCC1CCOC(=O)C2=CC=CC=C2.Cl	{1: 1, 2: 3, 33: 1, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	78219-35-9	CC1CCN(CC1)CCOC(=O)C2=CC=CC=C2.Cl	{1: 1, 2: 2, 33: 1, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	78219-38-2	C1CCN(C(C1)CCC2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3.Cl	{33: 1, 2: 4, 11: 4, 12: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	78219-45-1	C1CCN(C(C1)CCC2=CC=CC=C2)CCCOC(=O)C3=CC=CC=C3.Cl	{33: 1, 2: 5, 11: 4, 12: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	78219-53-1	CCCN1CCC(CC1)OC(=O)C2=CC=CC=C2.Cl	{1: 1, 2: 2, 33: 1, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	78219-57-5	CCN1CCC(CC1)OC(=O)C2=CC=C(C=C2)N.Cl	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 14: 4, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	78219-58-6	CCN1CCC(CC1)OC(=O)C2=CC=CC=C2.Cl	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	78219-62-2	C1CN(CCC1OC(=O)C2=CC=C(C=C2)N)CCC3=CC=CC=C3.Cl	{33: 1, 2: 2, 11: 4, 12: 1, 14: 9, 17: 1, 28: 1, 30: 1}
Did not match all atoms present	78219-63-3	C1CN(CCC1OC(=O)C2=CC=CC=C2)CCC3=CC=CC=C3.Cl	{33: 1, 2: 2, 11: 4, 12: 1, 14: 10, 17: 1, 28: 1}
Did not match all atoms present	78225-78-2	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N=C=S	{8: 1, 24: 1, 34: 1, 38: 1, 14: 4}
Did not match all atoms present	78232-24-3	C1=CC(=C[N+](=C1)CCCCCC[N+]2=CC=CC(=C2)/C=N/O)/C=N/O.[Br-].[Br-]	{33: 2, 2: 6, 6: 2, 34: 2, 14: 8, 18: 2, 20: 2}
Did not match all atoms present	78235-07-1	CC(C)NC1=CC=CC=C1Cl	{31: 1, 1: 2, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	78239-34-6	C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C4(F)F	{16: 2, 13: 1, 14: 8}
Did not match all atoms present	782393-76-4	CC1=C(C(=NC=C1Br)N)C(=O)O	{1: 1, 35: 1, 14: 1, 18: 1, 27: 1, 30: 1}
Did not match all atoms present	78242-72-5	C[C@H]1CC(=O)C(=NNC2=CC=C(C=C2)Cl)C(=O)O1	{1: 1, 34: 1, 11: 1, 12: 1, 14: 4, 15: 1, 17: 1, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	78246-24-9	C1CC(N(C1)N=O)C2=C[N+](=CC=C2)[O-]	{33: 2, 34: 1, 11: 3, 12: 1, 14: 4, 29: 2}
Did not match all atoms present	78265-87-9	C1=CC(=C(C=C1N/N=C\2/C=C(C(=CC2=O)O)N=NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C=C4O)S(=O)(=O)O)N)[N+](=O)[O-]	{34: 3, 38: 1, 14: 9, 15: 3, 20: 3, 21: 1, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	78265-88-0	C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)N/N=C/3\C=CC(=O)/C(=N\NC4=CC=C(C=C4)NC5=C(C=C(C=C5)[N+](=O)[O-])S(=O)(=O)O)/C3=O	{34: 2, 38: 2, 14: 16, 20: 2, 25: 2, 29: 4, 31: 4}
Did not match all atoms present	78265-89-1	CCCCC(C(=O)NC1=C(C=CC=C1Cl)C)NCCCC.Cl	{1: 3, 2: 6, 3: 1, 14: 3, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	78265-90-4	CCCCC(C(=O)NC1=C(C=CC=C1Cl)C)NCC.Cl	{1: 3, 2: 4, 3: 1, 14: 3, 17: 2, 24: 1, 31: 2}
Did not match all atoms present	78265-91-5	CCCCC(C(=O)NC1=C(C=CC=C1Cl)C)N2CCCC2.Cl	{1: 2, 2: 3, 3: 1, 33: 1, 11: 4, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	78265-95-9	COC1=C(C=CC(=C1)NNC2=CC=CC=C2)N=O	{1: 1, 34: 1, 14: 8, 22: 1, 29: 1, 31: 2}
Did not match all atoms present	78265-97-1	CCCCCCCCCCOC(=O)C(C1=CC=CC=C1)[NH3+].[Cl-]	{1: 1, 2: 9, 3: 1, 14: 5, 17: 1, 28: 1}
Did not match all atoms present	78266-06-5	CC1=CC(=C(C(=C1NC(=O)CN(CC(=O)O)CC(=O)O)C)Br)C	{1: 3, 2: 3, 33: 1, 14: 1, 18: 1, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	78279-14-8	COC1=CC(=NC2=CC=C(C=C2)CN)C(=CC1=O)N	{1: 1, 2: 1, 34: 1, 14: 6, 15: 3, 22: 1, 25: 1, 30: 2}
Did not match all atoms present	78279-15-9	CC1=C(C=CC(=C1)N)N=C2C=C(C(=CC2=N)N)OC	{1: 2, 34: 1, 36: 1, 14: 5, 15: 4, 22: 1, 30: 2}
Did not match all atoms present	78279-90-0	C[Ge](C)(C)N1C=CN(C=C1)[Ge](C)(C)C	{1: 6, 14: 4, 33: 2}
Did not match all atoms present	78279-91-1	C[SiH](C)N1C=CN(C=C1)[SiH](C)C	{1: 4, 14: 4, 33: 2}
Did not match all atoms present	78279-92-2	CC1=C(N(C(=C(N1[Si](C)(C)C)C)C)[Si](C)(C)C)C	{1: 10, 33: 2, 15: 4}
Did not match all atoms present	78279-93-3	C[Si](C)(C)N1C=CN(C2=CC=CC=C21)[Si](C)(C)C	{1: 6, 14: 6, 33: 2}
Did not match all atoms present	78280-29-2	CCN(CC)CCNC1=C(C=CC=C1C)C.Cl.Cl	{1: 4, 2: 4, 33: 1, 14: 3, 17: 2, 31: 1}
Did not match all atoms present	78280-31-6	CN(C)C1CCCCC1OC(=O)C2=C(C=C(C=C2)N)O.Cl	{1: 2, 33: 1, 11: 4, 12: 2, 14: 3, 17: 1, 21: 1, 28: 1, 30: 1}
Did not match all atoms present	78281-06-8	C1=CC=C(C=C1)C2=CC=C(C=C2)N(C=O)O	{33: 1, 26: 1, 20: 1, 14: 9}
Did not match all atoms present	783-05-1	CC(=C)C(=O)NC1=CC=CC(=C1)C(F)(F)F	{1: 1, 4: 1, 5: 1, 7: 1, 14: 4, 16: 3, 24: 1, 31: 1}
Did not match all atoms present	783-08-4	COC1=CC=C(C=C1)N=CC2=CC=CC=C2	{1: 1, 22: 1, 34: 1, 14: 9, 6: 1}
Did not match all atoms present	783-33-5	C1=CC=CC=C1.C1(=C(C(=C(C(=C1F)F)F)F)F)F	{16: 6, 14: 6}
Did not match all atoms present	783-95-9	CC1=C(C(=C(C(=N1)Cl)C#N)C(F)(F)F)[N+](=O)[O-]	{1: 1, 35: 1, 4: 1, 37: 1, 38: 1, 16: 3, 17: 1}
Did not match all atoms present	78301-05-0	CC1=C(C(=CC=C1)C)N([N+](=O)C2=C(C=CC=C2C)C)[O-]	{1: 4, 29: 2, 14: 6, 33: 2}
Did not match all atoms present	78302-38-2	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=CC(=C3)Br	{1: 2, 18: 1, 14: 9}
Did not match all atoms present	78302-39-3	CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C=CC=C3Br	{1: 2, 18: 1, 14: 9}
Did not match all atoms present	78308-37-9	CCCCNC1=CC(=C(C=C1)C(=O)OC2CCN(CC2)CC)O.Cl	{1: 2, 2: 4, 33: 1, 11: 4, 12: 1, 14: 3, 17: 1, 21: 1, 28: 1, 31: 1}
Did not match all atoms present	78308-53-9	CC1=C(NCC1=O)[O-].[NH4+]	{32: 1, 1: 1, 11: 1, 25: 1, 15: 2}
Did not match all atoms present	78313-59-4	CC1=NC=C(C(=C1O)COC)CSSCC2=CN=C(C(=C2COC)O)C.Cl.Cl	{1: 4, 2: 4, 35: 2, 40: 2, 14: 2, 17: 2, 21: 2, 22: 2}
Did not match all atoms present	78329-75-6	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{32: 1, 1: 6, 3: 2, 33: 1, 11: 5, 12: 6, 14: 5, 20: 2, 22: 5, 27: 2, 28: 2}
Did not match all atoms present	78329-87-0	CCCC[NH2+]CC(=O)N(CCCC)C1=CC=C(C=C1)C(=O)OCCCC.[Cl-]	{1: 3, 2: 10, 33: 1, 14: 4, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	78329-88-1	CCCCN(C1=CC=C(C=C1)C(=O)OCCCC)C(=O)C[NH+]2CCCCC2.[Cl-]	{1: 2, 2: 7, 33: 1, 11: 5, 14: 4, 17: 1, 24: 1, 28: 1}
Did not match all atoms present	78329-97-2	CCN(CC)CC1=C(C=CC(=C1)C(=O)OCC)O	{1: 3, 2: 4, 33: 1, 14: 3, 21: 1, 28: 1}
Did not match all atoms present	78330-02-6	CCOC(=O)C1=CC(=C(C=C1)O)CN2CCOCC2	{1: 1, 2: 2, 33: 1, 11: 4, 14: 3, 21: 1, 23: 1, 28: 1}
Did not match all atoms present	78333-49-0	CCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)C(C2=O)C3=NC4=CC=CC=C4C=C3O	{1: 1, 2: 7, 35: 1, 12: 1, 14: 8, 21: 1, 25: 2, 28: 1}
Did not match all atoms present	78334-00-6	CCCN(CCC)C(=O)C1=CC2=C(C=C1)C(=O)C(C2=O)C3=NC4=CC=CC=C4C(=C3O)Br	{1: 2, 2: 4, 35: 1, 33: 1, 12: 1, 14: 7, 18: 1, 21: 1, 24: 1, 25: 2}
Did not match all atoms present	78350-78-4	CCC(C)OC(=O)OOC(=O)OC(C)C	{1: 4, 2: 1, 3: 2}
Did not match all atoms present	78354-52-6	CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)S(=O)(=O)[O-].C(CC(=O)N)[C@@H](C(=O)O)N.[Na+]	{1: 4, 2: 2, 3: 2, 14: 4, 24: 1, 27: 1, 29: 3, 30: 2}
Did not match all atoms present	78371-75-2	CCN(CC)CCOC1=C(C=CC=C1C)C.Cl	{1: 4, 2: 4, 33: 1, 14: 3, 17: 1, 22: 1}
Did not match all atoms present	78371-84-3	CCN(CC)CCN(C1=C(C=CC=C1Cl)C)C(=O)NC2=C(C=CC=C2Cl)C.Cl	{1: 4, 2: 4, 33: 2, 14: 6, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	78371-85-4	CC1=C(C(=CC=C1)Cl)NC(=O)N(CCN2CCCC2)C3=C(C=CC=C3Cl)C.Cl	{1: 2, 2: 2, 33: 2, 11: 4, 14: 6, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	78371-90-1	CCN(CC)CCN(C1CCCCC1)C(=O)NC2=C(C=CC=C2Cl)C.Cl	{1: 3, 2: 4, 33: 2, 11: 5, 12: 1, 14: 3, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	78371-95-6	CCN(CC)CCN(C1=C(C=CC=C1C)C)C(=O)NC2=C(C=CC=C2Cl)C.Cl	{1: 5, 2: 4, 33: 2, 14: 6, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	78372-00-6	CC1=C(C(=CC=C1)Cl)NC(=O)N(CCN2CCCCC2)CC3=CC=C(C=C3)OC	{1: 2, 2: 3, 33: 2, 11: 5, 14: 7, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	78372-01-7	CC1=CC=C(C=C1)CN(CCN2CCCC2)C(=O)NC3=C(C=C(C=C3)Cl)C.Cl	{1: 2, 2: 3, 33: 2, 11: 4, 14: 7, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	78372-03-9	CCN(CC)CCN(C)C(=O)NC1=C(C=C(C=C1C)C)C.Cl	{1: 6, 2: 4, 33: 2, 14: 2, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	78372-04-0	CCN(CC)CCNC(=O)NC1=C(C=CC=C1C)C.Cl	{1: 4, 2: 4, 33: 1, 14: 3, 17: 1, 24: 1, 31: 2}
Did not match all atoms present	78372-05-1	CCN(CCN(C)C)C(=O)NC1=C(C=C(C=C1C)C)C.Cl	{1: 6, 2: 3, 33: 2, 14: 2, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	78372-06-2	CC1=C(C(=CC=C1)C)NC(=O)N(CCN(C)C)C(C)C.Cl	{1: 6, 2: 2, 3: 1, 33: 2, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	78376-89-3	CC1=CC(=C(C=C1)N2CC2)C	{1: 2, 11: 2, 14: 3, 33: 1}
Did not match all atoms present	78376-90-6	CC1=C(C(=CC=C1)C)N2CC2	{1: 2, 11: 2, 14: 3, 33: 1}
Did not match all atoms present	78393-39-2	CC1=C(C(=CC=C1)Cl)NC(=O)N(CCN2CCCC2)CC3=CC=C(C=C3)OC.Cl	{1: 2, 2: 3, 33: 2, 11: 4, 14: 7, 17: 2, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	784-04-3	CC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31	{24: 1, 1: 1, 14: 9}
Did not match all atoms present	784-38-3	C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)F	{16: 1, 17: 1, 30: 1, 14: 7, 24: 1}
Did not match all atoms present	784-50-9	C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)C(=O)O	{25: 1, 27: 1, 14: 7}
Did not match all atoms present	784-57-6	C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)N	{33: 1, 4: 1, 11: 4, 14: 3, 16: 3, 23: 1, 30: 1}
Did not match all atoms present	784-62-3	C1=CC=C(C=C1)C2=CC(=O)C3=CC=CC=C3S2	{25: 1, 14: 10, 41: 1}
Did not match all atoms present	784-81-6	C1=CC=C(C=C1)S(=O)S(=O)(=O)C2=CC=CC=C2	{29: 3, 14: 10}
Did not match all atoms present	78415-72-2	CC1=C(C=C(C(=O)N1)C#N)C2=CC=NC=C2	{32: 1, 1: 1, 35: 1, 37: 1, 14: 5, 25: 1}
Did not match all atoms present	78431-47-7	CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]3[C@@H](N(N=C3C4=C2C=CC(=C4)OC)C(=O)C)C5=CC=NC=C5	{1: 3, 35: 2, 33: 2, 11: 1, 12: 2, 14: 11, 15: 1, 22: 1, 24: 1, 29: 2}
Did not match all atoms present	78432-19-6	C1=CC2=C3C(=C1)C=CC4=C3C(=CC(=C4[N+](=O)[O-])[N+](=O)[O-])C=C2	{38: 2, 14: 8}
Did not match all atoms present	78452-55-8	CC(C)(C)OC(=O)N[C@H](CC1=CC=CS1)C(=O)[O-]	{1: 3, 2: 1, 3: 1, 4: 1, 41: 1, 14: 3, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	78473-00-4	C1=C(C=C(C(=C1Cl)N)Cl)C#N	{17: 2, 30: 1, 14: 2, 37: 1}
Did not match all atoms present	78480-15-6	CCCCCCCCCC[N+](C)(C)C.CC(C)OS(=O)(=O)[O-]	{1: 6, 2: 9, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	78480-16-7	CCCCCCCCCCCC[N+](C)(C)C.CC(C)OS(=O)(=O)[O-]	{1: 6, 2: 11, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	78480-17-8	CCCCCCCCCCCCCCCC[N+](C)(C)C.CC(C)OS(=O)(=O)[O-]	{1: 6, 2: 15, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	78480-19-0	CCCCCCCC[N+](C)(C)C.CC(C)OS(=O)(=O)[O-]	{1: 6, 2: 7, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	78480-20-3	CCCCCCCCCCCCCC[N+](C)(C)C.CC(C)OS(=O)(=O)[O-]	{1: 6, 2: 13, 3: 1, 29: 3, 22: 1}
Did not match all atoms present	78480-22-5	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N=NC4C(=NNC4=O)C)S(=O)(=O)O.C(CO)NCCO	{32: 1, 1: 2, 2: 4, 35: 2, 41: 1, 12: 1, 34: 2, 14: 6, 15: 1, 20: 3, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	78480-24-7	C1=CC(=CC=C1C(=O)[O-])N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C(=O)/C(=N\NC6=CC=C(C=C6)C(=O)[O-])/C(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].C(CO)N(CCO)CCO.[Na+].[Na+].[Na+].[Na+]	{33: 1, 2: 6, 34: 2, 14: 16, 15: 4, 20: 3, 24: 3, 25: 2, 29: 6, 31: 4}
Did not match all atoms present	785-30-8	C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)N)N	{24: 1, 30: 2, 14: 8, 31: 1}
Did not match all atoms present	785-56-8	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)Cl	{16: 6, 17: 1, 4: 2, 14: 3, 24: 1}
Did not match all atoms present	785-78-4	CC(=O)C1=CC=C(C=C1)CCC2=CC=CC=C2	{24: 1, 1: 1, 2: 2, 14: 9}
Did not match all atoms present	785-80-8	C1=CC=C(C=C1)N=CC2=CC=C(C=C2)[N+](=O)[O-]	{34: 1, 38: 1, 14: 9, 6: 1}
Did not match all atoms present	785-81-9	C1=CC=C(C=C1)C=NC2=CC=C(C=C2)[N+](=O)[O-]	{34: 1, 38: 1, 14: 9, 6: 1}
Did not match all atoms present	78520-83-9	CC1=C(C=CC(=C1)CCNCCC#N)N=NC2=NC3=C(S2)C(=C(C=C3)Cl)Cl	{1: 1, 2: 4, 35: 1, 37: 1, 41: 1, 34: 2, 14: 5, 17: 2, 31: 1}
Did not match all atoms present	78550-67-1	C1=CC(=CC=C1P)P	{14: 4}
Did not match all atoms present	78560-44-8	C(C[Si](Cl)(Cl)Cl)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 17, 17: 3, 2: 2, 4: 8}
Did not match all atoms present	78560-45-9	C(C[Si](Cl)(Cl)Cl)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 17: 3, 2: 2, 4: 6}
Did not match all atoms present	78580-32-2	CC1=CC=C(C=C1)NC(=O)CCS	{1: 1, 2: 2, 39: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	78587-05-0	C[C@@H]1[C@H](SC(=O)N1C(=O)NC2CCCCC2)C3=CC=C(C=C3)Cl	{1: 1, 33: 1, 41: 1, 11: 5, 12: 3, 14: 4, 17: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	786-19-6	CCOP(=S)(OCC)SCSC1=CC=C(C=C1)Cl	{1: 2, 2: 3, 40: 2, 14: 4, 17: 1, 22: 2}
Did not match all atoms present	78600-25-6	CC[NH+]1CC2([C@H]3C(C4[C@@H]1C3([C@@H]5C[C@]6(C([C@@H]5[C@@]4(C(C6OC)O)OC(=O)C)OC(=O)C7=CC=CC=C7)O)C(CC2OC(=O)C)OC)OC)COC.[Br-]	{1: 7, 2: 2, 11: 3, 12: 11, 13: 4, 14: 5, 18: 1, 20: 2, 22: 4, 28: 3}
Did not match all atoms present	78631-72-8	C1CCC#CC2=CC=CC=C2C3=CC=CC=C3C#CCC1	{10: 4, 11: 5, 14: 8}
Did not match all atoms present	78649-41-9	CN(C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCC(CO)O)I)C(=O)CO	{1: 1, 2: 5, 3: 2, 33: 1, 19: 3, 20: 5, 24: 3, 31: 2}
Did not match all atoms present	78697-25-3	C[N+](C)(C)CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2.[Cl-]	{24: 1, 1: 3, 2: 1, 14: 9, 17: 1}
Did not match all atoms present	787-05-3	CCCCC(CC)COP([O-])OCC(CC)CCCC.CCCCC(CC)COP([O-])OCC(CC)CCCC.[Cd+2]	{1: 8, 2: 20, 3: 4, 29: 2, 22: 4}
Did not match all atoms present	787-69-9	CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C	{24: 2, 1: 2, 14: 8}
Did not match all atoms present	787-70-2	C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)O)C(=O)O	{27: 2, 14: 8}
Did not match all atoms present	787-77-9	COC1=CC=CC=C1NNC2=CC=CC=C2OC	{1: 2, 22: 2, 14: 8, 31: 2}
Did not match all atoms present	787-84-8	C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CC=C2	{24: 2, 14: 10, 31: 2}
Did not match all atoms present	78725-46-9	C1=CC(=CC(=C1)OC2=CC=CC(=C2)C(F)(F)F)C=O	{16: 3, 26: 1, 4: 1, 22: 1, 14: 8}
Did not match all atoms present	78787-80-1	CC1=CC2=C(C=C1)NC3=C2C=CC(=C3)C	{32: 1, 1: 2, 14: 6}
Did not match all atoms present	788-23-8	CC(=O)C1=CC=C(C=C1)N/C=C/2\C=CC=CC2=O	{1: 1, 6: 1, 14: 8, 15: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	78800-21-2	[C-]#[N+][N+]#[C-]	{34: 2}
Did not match all atoms present	78805-16-0	CC1=CC=CC=C1[Se]C(C)C	{1: 3, 3: 1, 14: 4}
Did not match all atoms present	78805-17-1	CC1=C(C(=CC=C1)C)[Se]C	{1: 3, 14: 3}
Did not match all atoms present	78805-18-2	CC[Se]C1=C(C=CC=C1C)C	{1: 3, 2: 1, 14: 3}
Did not match all atoms present	78812-93-8	CC1C(=CCC2=CC=CC=C12)OC	{1: 2, 11: 1, 12: 1, 14: 5, 15: 1, 22: 1}
Did not match all atoms present	78818-97-0	C(=[SiH2])(Cl)Cl	{17: 2, 7: 1}
Did not match all atoms present	78822-08-9	C[C@@H]1[C@H](C[C@@H]([C@H](O1)OC2[C@@H]([C@H](C([C@@H]([C@@H]2O)O)O)O)O)N)N=C(C(=O)O)N.C[C@@H]1[C@H](C[C@@H]([C@H](O1)OC2[C@@H]([C@H](C([C@@H]([C@@H]2O)O)O)O)O)N)N=C(C(=O)O)N.OS(=O)(=O)O	{1: 2, 34: 2, 7: 2, 11: 2, 12: 20, 20: 12, 22: 2, 23: 2, 27: 2, 29: 2, 30: 4}
Did not match all atoms present	78823-28-6	CC1=CC=CC=C1C(=O)C2=C(C=C(C=C2C(C)C)C(C)C)C(C)C	{24: 1, 1: 7, 3: 3, 14: 6}
Did not match all atoms present	78879-20-6	CC(C)(C)OC(=O)N1CC2=CC=CC=C2C[C@H]1C(=O)O	{1: 3, 4: 1, 33: 1, 11: 2, 12: 1, 14: 4, 27: 1, 28: 1}
Did not match all atoms present	789-02-6	C1=CC=C(C(=C1)C(C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl)Cl	{17: 5, 3: 1, 4: 1, 14: 8}
Did not match all atoms present	789-07-1	C1=CC2=C3C(=C1)C=CC4=C3C(=CC(=C4)[N+](=O)[O-])C=C2	{38: 1, 14: 9}
Did not match all atoms present	789-24-2	C1=CC=C(C=C1)C2C3=CC=CC=C3C4=CC=CC=C24	{12: 1, 14: 13}
Did not match all atoms present	789-25-3	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	789-47-9	C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC(=C4)N	{30: 1, 14: 11}
Did not match all atoms present	789-61-7	C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=S)N)CO)O	{32: 1, 33: 1, 2: 1, 35: 2, 11: 1, 12: 3, 14: 1, 20: 2, 23: 1, 30: 1}
Did not match all atoms present	78907-15-0	CC(C(=O)C1=CNC2=CC=CC=C21)NC(C)(C)C.O.Cl	{32: 1, 1: 4, 3: 1, 4: 1, 14: 5, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	78907-16-1	CC(C)(C)[NH2+]CC(=O)C1=CNC2=CC=CC=C21.[Cl-]	{32: 1, 1: 3, 2: 1, 4: 1, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	78941-77-2	C1C2C3C2(C4(C1C34)C(=O)O)C(=O)NC5=CC=CC=C5	{11: 1, 12: 4, 13: 2, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	78948-04-6	C=C(C[Si](Cl)(Cl)Cl)C[Si](Cl)(Cl)Cl	{17: 6, 2: 2, 5: 1, 7: 1}
Did not match all atoms present	78950-78-4	CCCN(CCC)C1CCC2=C(C1)C(=CC=C2)O	{1: 2, 2: 4, 33: 1, 11: 3, 12: 1, 14: 3, 21: 1}
Did not match all atoms present	78956-69-1	CCC(=O)C1=C(C(=C(N1)C)C(=O)OCC)C	{24: 1, 1: 4, 2: 2, 28: 1, 32: 1}
Did not match all atoms present	78958-61-9	CNC(=S)NNC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 35: 3, 7: 1, 14: 2, 31: 3}
Did not match all atoms present	78985-13-4	CC1=CC(=C(C(=C1C)CO)C)C	{1: 4, 2: 1, 20: 1, 14: 1}
Did not match all atoms present	79-19-6	C(=S)(N)NN	{31: 1, 30: 2, 7: 1}
Did not match all atoms present	79-40-3	C(=S)(C(=S)N)N	{30: 2, 7: 2}
Did not match all atoms present	79-57-2	C[C@@]1([C@H]2[C@@H]([C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O)O	{1: 3, 33: 1, 12: 4, 13: 2, 14: 3, 15: 4, 20: 5, 21: 1, 24: 1, 25: 2, 30: 1}
Did not match all atoms present	79-67-4	CC1=CC(=C(C=C1)S(=O)(=O)N(C)C)N	{1: 3, 30: 1, 29: 2, 14: 3, 33: 1}
Did not match all atoms present	79-72-1	CC1=C(C=C(C=C1)N)S(=O)(=O)NC2=CC=CC=C2	{1: 1, 30: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	79-74-3	CCC(C)(C)C1=CC(=C(C=C1O)C(C)(C)CC)O	{1: 6, 2: 2, 4: 2, 21: 2, 14: 2}
Did not match all atoms present	79-88-9	CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2	{1: 1, 38: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	79-90-3	CC1CCCC(C1CCC(C)[N+](C)(C)CCCCCC[N+](C)(C)C(C)CCC2C(CCCC2(C)C)C)(C)C.[Cl-].[Cl-]	{1: 12, 2: 10, 3: 2, 11: 6, 12: 4, 13: 2, 17: 2}
Did not match all atoms present	79-93-6	CC(C)(C(C)(C1=CC=C(C=C1)Cl)O)O	{1: 3, 4: 2, 20: 2, 14: 4, 17: 1}
Did not match all atoms present	79-94-7	CC(C)(C1=CC(=C(C(=C1)Br)O)Br)C2=CC(=C(C(=C2)Br)O)Br	{1: 2, 18: 4, 4: 1, 21: 2, 14: 4}
Did not match all atoms present	79-95-8	CC(C)(C1=CC(=C(C(=C1)Cl)O)Cl)C2=CC(=C(C(=C2)Cl)O)Cl	{1: 2, 4: 1, 21: 2, 14: 4, 17: 4}
Did not match all atoms present	79-96-9	CC(C)(C)C1=C(C=CC(=C1)C(C)(C)C2=CC(=C(C=C2)O)C(C)(C)C)O	{1: 8, 4: 3, 21: 2, 14: 6}
Did not match all atoms present	79-97-0	CC1=C(C=CC(=C1)C(C)(C)C2=CC(=C(C=C2)O)C)O	{1: 4, 4: 1, 21: 2, 14: 6}
Did not match all atoms present	79-98-1	CC(C)(C1=CC(=C(C=C1)O)Cl)C2=CC(=C(C=C2)O)Cl	{1: 2, 4: 1, 21: 2, 14: 6, 17: 2}
Did not match all atoms present	790-60-3	C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC=C4C5=C3O5	{14: 10, 23: 1}
Did not match all atoms present	790-69-2	C1=CC(=CC=C1NC(=S)NC2=CC(=CC(=C2)Cl)Cl)F	{16: 1, 17: 2, 31: 2, 14: 7, 7: 1}
Did not match all atoms present	790-82-9	CC(=O)C1=CC=C(C=C1)CC2=CC=C(C=C2)C(=O)C	{24: 2, 1: 2, 2: 1, 14: 8}
Did not match all atoms present	790-90-9	CC(=O)NC1=CC=C(C=C1)OC(=O)OCC(Cl)(Cl)Cl	{1: 1, 2: 1, 4: 1, 14: 4, 17: 3, 24: 1, 31: 1}
Did not match all atoms present	79004-98-1	CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C=CC(=O)OCCO.C1CO1	{1: 2, 2: 2, 5: 1, 6: 1, 8: 2, 11: 3, 12: 1, 34: 2, 14: 3, 20: 1, 23: 2, 28: 1, 29: 2}
Did not match all atoms present	79006-76-1	C/C(=N\OC(=O)N(SN(C(=O)OC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC(=O)N(SN(C(=O)O/N=C(/SC)\C)C)C)(C)C)C)C)/SC	{1: 10, 34: 2, 4: 1, 33: 4, 40: 4, 7: 2, 14: 8, 28: 4}
Did not match all atoms present	79013-23-3	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)[O-])O.[Na+]	{21: 1, 14: 6, 29: 3}
Did not match all atoms present	79014-73-6	B(C)(C)N(B(C)C)N(C)C	{1: 6, 33: 2}
Did not match all atoms present	79014-75-8	B(C)(C)N(N(C)C)[Si](C)(C)C	{1: 7, 33: 2}
Did not match all atoms present	79057-88-8	C1=CC(=CC=C1NC2=C(C=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N/N=C\5/C=CC(=CC5=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])N/N=C/6\C(=CC7=C(C6=O)C=C(C=C7)N/N=C/8\C=CC(=CC8=O)N)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 4, 14: 21, 15: 8, 25: 4, 29: 9, 30: 2, 31: 5}
Did not match all atoms present	79064-26-9	C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3Cl)Cl	{17: 2, 2: 1, 35: 3, 14: 6, 33: 1}
Did not match all atoms present	79069-96-8	C1=CC(=O)C=CC1=NNC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NN=C4C=CC(=O)C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[K+]	{34: 2, 6: 2, 14: 14, 15: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	79070-05-6	CC(C)(C)CCCCCC(=O)OCC1CO1.C=CC1=CC=CC=C1.C=CC(=O)O	{1: 3, 2: 6, 4: 1, 5: 2, 6: 2, 11: 1, 12: 1, 14: 5, 23: 1, 27: 1, 28: 1}
Did not match all atoms present	79070-07-8	CCCCOC(=O)C=C.CC(C)(C)CCCCCC(=O)OCC1CO1.C=CC1=CC=CC=C1.C=CC(=O)O	{1: 4, 2: 9, 4: 1, 5: 3, 6: 3, 11: 1, 12: 1, 14: 5, 23: 1, 27: 1, 28: 2}
Did not match all atoms present	79073-99-7	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)P=PC2=C(C=C(C=C2C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 18, 4: 6, 14: 4}
Did not match all atoms present	79098-13-8	CCCCCCCCCCCCCCCCC1=CC=C(C=C1)N	{1: 1, 2: 15, 30: 1, 14: 4}
Did not match all atoms present	791-28-6	C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3	{29: 1, 14: 15}
Did not match all atoms present	791-29-7	C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 14: 15}
Did not match all atoms present	791-31-1	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)O	{20: 1, 14: 15}
Did not match all atoms present	791-35-5	CN(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2Cl)O	{1: 2, 2: 2, 4: 1, 33: 1, 14: 9, 17: 1, 20: 1}
Did not match all atoms present	79118-38-0	CCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=C(C4=CC=CC=C43)N=NC5=CC=C(C=C5)N(CC)CC	{1: 3, 2: 5, 34: 6, 14: 18, 33: 1}
Did not match all atoms present	79124-75-7	CC1=CC=C(C=C1)OC2=CC=CC(=C2)C=O	{1: 1, 26: 1, 22: 1, 14: 8}
Did not match all atoms present	79124-76-8	C1=CC(=CC(=C1)OC2=CC(=C(C=C2)Cl)Cl)C=O	{17: 2, 26: 1, 22: 1, 14: 7}
Did not match all atoms present	79127-47-2	CCCCCCCCCCCCCC(=O)ON(C1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)I)C(=O)C	{1: 2, 2: 12, 33: 1, 11: 1, 14: 6, 19: 1, 24: 1, 28: 1}
Did not match all atoms present	79135-18-5	CC1=C(C(=O)N(C(=C1N=NC2=CC=C(C=C2)N3N=C(/C(=N/NC4=C(C=C(C=C4)[N+](=O)[O-])[O-])/C3=O)C)[O-])CCCN(C)C)[N+]5=CC=CC=C5.CC1=C(C(=O)N(C(=C1N=NC2=CC=C(C=C2)N3N=C(/C(=N/NC4=C(C=C(C=C4)[N+](=O)[O-])[O-])/C3=O)C)[O-])CCCN(C)C)[N+]5=CC=CC=C5.CC(O)C(=O)O.CC(O)C(=O)O.CC(O)C(=O)[O-].[Fe+3]	{1: 11, 2: 6, 3: 3, 38: 2, 33: 8, 34: 6, 14: 24, 15: 4, 35: 2, 20: 3, 24: 1, 25: 4, 27: 2, 31: 2}
Did not match all atoms present	79135-27-6	CC1=C(C(=O)N(C(=C1N=NC2=CC=C(C=C2)N3N=C(/C(=N/NC4=C(C=CC(=C4)[N+](=O)[O-])[O-])/C3=O)C)[O-])CCCN(C)C)[N+]5=CC=CC=C5.CC1=C(C(=O)N(C(=C1N=NC2=CC=C(C=C2)N3N=C(/C(=N/NC4=C(C=CC(=C4)[N+](=O)[O-])[O-])/C3=O)C)[O-])CCCN(C)C)[N+]5=CC=CC=C5.CC(O)C(=O)O.CC(O)C(=O)O.CC(O)C(=O)[O-].[Fe+3]	{1: 11, 2: 6, 3: 3, 38: 2, 33: 8, 34: 6, 14: 24, 15: 4, 35: 2, 20: 3, 24: 1, 25: 4, 27: 2, 31: 2}
Did not match all atoms present	79138-28-6	CN1C=CC=C(C1=O)C=O	{1: 1, 26: 1, 33: 1, 14: 3, 25: 1}
Did not match all atoms present	79155-44-5	C/C(=N/NC(=S)N)/C1=CC=C(S1)Cl	{1: 1, 34: 1, 7: 2, 41: 1, 14: 2, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	79172-99-9	[Li+].CCC(CC)(CC)O[Al-](OC(CC)(CC)CC)OC(CC)(CC)CC	{1: 9, 2: 9, 4: 3, 22: 3}
Did not match all atoms present	792-74-5	COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	79201-85-7	CCC[C@@]1(CCN(C[C@@H]1C)C)C2=CC(=CC=C2)O	{1: 3, 2: 2, 33: 1, 11: 3, 12: 1, 13: 1, 14: 4, 21: 1}
Did not match all atoms present	79208-64-3	CN1C=CC(=S)N1	{32: 1, 1: 1, 14: 2, 33: 1}
Did not match all atoms present	79230-10-7	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 9, 8: 2, 34: 2, 14: 8, 20: 2, 27: 2, 29: 2}
Did not match all atoms present	79241-46-6	CCCCOC(=O)[C@@H](C)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F	{1: 2, 2: 3, 3: 1, 4: 1, 14: 7, 16: 3, 35: 1, 22: 2, 28: 1}
Did not match all atoms present	79255-89-3	CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+].[K+]	{1: 2, 34: 2, 14: 7, 22: 1, 29: 6, 30: 1}
Did not match all atoms present	79255-90-6	CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+].[K+]	{1: 2, 34: 2, 14: 7, 22: 1, 29: 6, 30: 1}
Did not match all atoms present	79255-91-7	CC1=C(C=CC(=C1)N)N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[K+]	{1: 1, 30: 1, 34: 2, 29: 6, 14: 8}
Did not match all atoms present	79255-92-8	[Li+].CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+].[K+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	79255-93-9	[Li+].CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+]	{1: 2, 34: 4, 14: 16, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	79255-95-1	CC1=C(C=CC(=C1)S(=O)(=O)O)N/N=C/2\C(=O)C3=C(C=C2S(=O)(=O)O)C=C(C=C3)NC(=O)NC4=CC5=C(C(=O)/C(=N\NC6=C(C=C(C=C6)S(=O)(=O)O)C)/C(=C5)S(=O)(=O)O)C=C4	{1: 2, 34: 2, 14: 14, 15: 4, 20: 4, 24: 1, 25: 2, 29: 8, 31: 4}
Did not match all atoms present	79255-97-3	[Li+].CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\4/C(=CC5=C(C4=O)C=CC(=C5)N)S(=O)(=O)[O-].C(CO)N(CCO)CCO.[Na+].[K+]	{1: 2, 2: 6, 33: 1, 34: 3, 14: 11, 15: 2, 20: 3, 22: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	79255-98-4	[Li+].CC1=CC(=C(C=C1N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N/N=C\4/C(=CC5=C(C4=O)C=CC(=C5)N)S(=O)(=O)[O-].C(CO)N(CCO)CCO.[Na+].[K+]	{1: 2, 2: 6, 33: 1, 34: 3, 14: 11, 15: 2, 20: 3, 22: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	79261-58-8	C1[C@H](N(CC2=CC=CC=C21)C(=O)OCC3=CC=CC=C3)C(=O)O	{33: 1, 2: 1, 11: 2, 12: 1, 14: 9, 27: 1, 28: 1}
Did not match all atoms present	79265-30-8	C[Si](C)(C)C1=NC=CS1	{1: 3, 35: 1, 14: 2, 41: 1}
Did not match all atoms present	79271-56-0	CC[Si](CC)(CC)OS(=O)(=O)C(F)(F)F	{1: 3, 2: 3, 4: 1, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	793-06-6	CC(=O)C1=CC=C(C=C1)CCC2=CC=C(C=C2)C(=O)C	{24: 2, 1: 2, 2: 2, 14: 8}
Did not match all atoms present	793-23-7	C1=CC=C(C=C1)CC2=CC=C(C=C2)CC3=CC=CC=C3	{2: 2, 14: 14}
Did not match all atoms present	793-24-8	CC(C)CC(C)NC1=CC=C(C=C1)NC2=CC=CC=C2	{1: 3, 2: 1, 3: 2, 14: 9, 31: 2}
Did not match all atoms present	793-39-5	CC12C3=CC=CC=C3C(C4=CC=CC=C41)C5=CC=CC=C25	{1: 1, 12: 1, 13: 1, 14: 12}
Did not match all atoms present	79305-82-1	C1=CC(=CC(=C1)N)C=CC2=CC=C(C=C2)N	{30: 2, 14: 8, 6: 2}
Did not match all atoms present	79307-93-0	CN1CCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl.Cl	{1: 1, 2: 1, 35: 1, 33: 2, 11: 5, 12: 1, 14: 8, 17: 2, 25: 1}
Did not match all atoms present	79308-66-0	CC1=CC(=C2C=C([Se]C(=C2)C)C)C=C([Se]1)C	{1: 4, 14: 4, 15: 6}
Did not match all atoms present	79313-76-1	CC(=O)O.CC\1(C2=CC=CC=C2N(/C1=C/N=NC3=CC=CC=C3OC)C)C	{1: 5, 34: 2, 6: 1, 33: 1, 13: 1, 14: 8, 15: 1, 22: 1, 27: 1}
Did not match all atoms present	79313-77-2	CC(=O)O.CC\1(C2=CC=CC=C2N(/C1=C/N=NC3=CC=CC=C3)C)C	{1: 4, 34: 2, 6: 1, 33: 1, 13: 1, 14: 9, 15: 1, 27: 1}
Did not match all atoms present	79313-78-3	CC\1(C2=CC=CC=C2N(/C1=C/N=NC3=CC=CC=C3)C)C.C(C(=O)O)O	{1: 3, 2: 1, 34: 2, 6: 1, 33: 1, 13: 1, 14: 9, 15: 1, 20: 1, 27: 1}
Did not match all atoms present	79314-27-5	C[Si](C)(C)OC1=CC(=CC(=C1)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 28: 1, 22: 2, 14: 3}
Did not match all atoms present	79320-90-4	CCN(CC)C1=CC(=C(C=C1)[N+]#N)OCC.[Cl-].[Cl-].[Cl-].[Zn+2]	{1: 3, 2: 3, 33: 1, 34: 1, 14: 3, 17: 3, 22: 1}
Did not match all atoms present	79322-76-2	CC(C1=CC=C(C=C1)C(=O)OC)O	{1: 2, 3: 1, 20: 1, 14: 4, 28: 1}
Did not match all atoms present	79357-62-3	CC1=CC(=CC(=C1O[Pb](O[N+](=O)[O-])O[Pb])[N+](=O)[O-])[N+](=O)[O-].O	{1: 1, 38: 2, 22: 3, 14: 2}
Did not match all atoms present	79373-12-9	CC(CC(C)(C)C)CO[P+](=O)OCC(C)CC(C)(C)C	{1: 8, 2: 4, 3: 2, 4: 2, 22: 2, 29: 1}
Did not match all atoms present	79373-34-5	CC1=CC(=C(C(=C1NC2=C3C(=C(C=C2)NC4=C(C(=C(C=C4C)C)S(=O)(=O)[O-])C)C(=O)C5=CC=CC=C5C3=O)C)S(=O)(=O)[O-])C.[NH4+].[NH4+]	{1: 6, 31: 2, 29: 6, 14: 8, 25: 2}
Did not match all atoms present	79386-05-3	CC1([C@H]([C@@H](C2=C(O1)C=C(C=C2)OC)C3=CC=C(C=C3)OCCN4CCCC4)C5=CC=CC=C5)C.Cl	{1: 3, 2: 2, 33: 1, 11: 4, 12: 2, 13: 1, 14: 12, 17: 1, 22: 2, 23: 1}
Did not match all atoms present	794-00-3	CC1=C2C=C(C3=CC=CC=C3C2=C(C4=CC=CC=C14)C)F	{16: 1, 1: 2, 14: 9}
Did not match all atoms present	794-93-4	C1=C(OC(=C1)[N+](=O)[O-])/C=C/C2=CN=C(N=N2)N(CO)CO	{33: 1, 2: 2, 35: 3, 38: 1, 6: 2, 14: 3, 20: 2, 23: 1}
Did not match all atoms present	794-94-5	COC1=CC=C(C=C1)C(=O)OC(=O)C2=CC=C(C=C2)OC	{1: 2, 28: 2, 22: 2, 14: 8}
Did not match all atoms present	79415-41-1	C(C1=C(C(=C(C(=C1Br)Br)Br)Br)Br)O	{2: 1, 20: 1, 18: 5}
Did not match all atoms present	79440-50-9	CC1=CC(=C(C=C1OC)OC)CC(C)N	{1: 4, 2: 1, 3: 1, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	79440-51-0	CC(CC1=CC(=C(C=C1SC)OC)OC)N	{1: 4, 2: 1, 3: 1, 40: 1, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	79440-52-1	CC(CC1=CC(=C(C=C1OC)OC)SC)N	{1: 4, 2: 1, 3: 1, 40: 1, 14: 2, 22: 2, 30: 1}
Did not match all atoms present	79454-85-6	C[Si](C)(C)C(=PCl)[Si](C)(C)C	{1: 6, 17: 1, 7: 1}
Did not match all atoms present	79456-26-1	C1=C(C=NC(=C1Cl)N)C(F)(F)F	{35: 1, 4: 1, 14: 2, 16: 3, 17: 1, 30: 1}
Did not match all atoms present	79458-80-3	C1CC(C(=O)NC1)N2CC3=CC=CC=C3C2=O	{32: 1, 33: 1, 11: 4, 12: 1, 14: 4, 25: 2}
Did not match all atoms present	79463-77-7	C1=CC=C(C=C1)OC(=NC#N)OC2=CC=CC=C2	{34: 1, 37: 1, 22: 2, 14: 10, 7: 1}
Did not match all atoms present	79482-06-7	C1CC2=CC=C3C4=C(C=CC1=C24)C(=O)C(C3=O)(Cl)Cl	{17: 2, 11: 2, 13: 1, 14: 4, 25: 2}
Did not match all atoms present	79490-00-9	O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Cd+2]	{17: 2, 29: 8}
Did not match all atoms present	795-18-6	CCOC(=O)CCN(CC1=CC=CC=C1)CC(=O)OCC	{1: 2, 2: 6, 28: 2, 14: 5, 33: 1}
Did not match all atoms present	795-42-6	C1=CC=C2C(=C1)C3(C4=CC=CC=C4C2(C5=CC=CC=C53)Br)Br	{18: 2, 13: 2, 14: 12}
Did not match all atoms present	795-95-9	C1=CC=C2C(=C1)C=CC(=C2C3=C(C4=CC=CC=C4C=C3)N)N	{30: 2, 14: 12}
Did not match all atoms present	79517-01-4	CC(C1C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)N)C(=O)NC(CO)C(C)O)O.CC(=O)O	{32: 6, 1: 3, 2: 8, 3: 4, 41: 2, 11: 2, 12: 6, 14: 15, 20: 3, 24: 2, 25: 5, 27: 1, 30: 2, 31: 2}
Did not match all atoms present	79538-20-8	C1=C(C=C(C=C1F)F)CO	{16: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	79538-29-7	C1=C(C=C(C(=C1F)C(=O)Cl)F)F	{16: 3, 17: 1, 14: 2, 24: 1}
Did not match all atoms present	79538-32-2	CC1=C(C(=C(C(=C1F)F)COC(=O)C2C(C2(C)C)C=C(C(F)(F)F)Cl)F)F	{1: 3, 2: 1, 4: 1, 6: 1, 7: 1, 12: 2, 13: 1, 16: 7, 17: 1, 28: 1}
Did not match all atoms present	79543-29-6	CC1=C2C=CC3=CC=CC=C3C2=NC4=C1C5=CC=CC=C5C=C4	{1: 1, 35: 1, 14: 12}
Did not match all atoms present	79544-29-9	C1=CC(=C(C(=C1)I)C#N)F	{16: 1, 19: 1, 37: 1, 14: 3}
Did not match all atoms present	79547-78-7	C[C@@H]1CN(CC[C@@]1(C2=CC=CC=C2)C(=O)O)C3CCC(CC3)(C#N)C4=CC=C(C=C4)F.Cl	{1: 1, 37: 1, 33: 1, 11: 7, 12: 2, 13: 2, 14: 9, 16: 1, 17: 1, 27: 1}
Did not match all atoms present	79561-82-3	CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)Br)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	79568-42-6	C1N2CN3CN1CP(=[Se])(C2)C3	{33: 3, 11: 6}
Did not match all atoms present	79593-41-2	CC(C)(C)P1P(P2P(P2P1C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 4: 4}
Did not match all atoms present	796-13-4	C1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)Cl)Br)C3=CC=CC=C3	{17: 1, 18: 1, 14: 14, 7: 2}
Did not match all atoms present	796-97-4	CC(C)(C)C1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 4: 4, 14: 2}
Did not match all atoms present	79607-90-2	CC(C)N(C(C)C)P1N(C2=CC=CC=C2N1C)C	{1: 6, 3: 2, 14: 4, 33: 3}
Did not match all atoms present	79622-59-6	C1=C(C=NC(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])C(F)(F)F	{35: 1, 4: 2, 38: 2, 14: 3, 16: 6, 17: 2, 31: 1}
Did not match all atoms present	79630-23-2	C1=CC(=C(C=C1C#N)Br)F	{16: 1, 18: 1, 37: 1, 14: 3}
Did not match all atoms present	79636-94-5	CCOC1=C(C=C(C=C1)Br)C=O	{1: 1, 2: 1, 14: 3, 18: 1, 22: 1, 26: 1}
Did not match all atoms present	79647-25-9	CC1=C2CCC3=C2C(=CC4=C3C=CC5=C4C6C(O6)C(C5O)O)C=C1	{1: 1, 11: 2, 12: 4, 14: 5, 20: 2, 23: 1}
Did not match all atoms present	79663-49-3	CCC1C(C2(C(C(OC2O1)C=CC=CC=CC3=C(C(=CC(=O)O3)OC)C)O)C)(C)O	{1: 5, 2: 1, 6: 6, 12: 4, 13: 2, 14: 1, 20: 2, 22: 1, 23: 2, 28: 1}
Did not match all atoms present	79665-24-0	CC1=C(C=C(C=C1)Cl)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC(=C(C=C4C)NC(=O)C5=CC6=CC=CC=C6/C(=N/NC7=C(C=CC(=C7)Cl)C)/C5=O)C	{1: 4, 34: 2, 14: 18, 15: 4, 17: 2, 24: 2, 25: 2, 31: 4}
Did not match all atoms present	79665-35-3	CC1=C(C=C(C=C1)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)NC5=CC=CC6=C5C(=O)C7=CC=CC=C7C6=O	{1: 1, 31: 2, 14: 17, 25: 4}
Did not match all atoms present	797-77-3	C[Si](C)(C)O[Si](C1=CC=CC=C1)(C2=CC=CC=C2)O[Si](C)(C)C	{1: 6, 22: 2, 14: 10}
Did not match all atoms present	79723-02-7	C[N+](C)(C)C.C1=CC=C(C(=C1)C(=O)O)C(=O)[O-]	{24: 1, 1: 4, 27: 1, 14: 4}
Did not match all atoms present	79746-17-1	CC[Si](CC)(CC)OC=CC=C	{1: 3, 2: 3, 22: 1, 5: 1, 6: 3}
Did not match all atoms present	79747-04-9	C1CO[Si]2(OCCN1CCO2)CCCC#N	{33: 1, 2: 3, 11: 6, 37: 1, 23: 3}
Did not match all atoms present	79756-81-3	CC(C1=CC=CC=C1C(F)(F)F)O	{1: 1, 3: 1, 4: 1, 14: 4, 16: 3, 20: 1}
Did not match all atoms present	79767-72-9	C[C@@H]([C-]1C=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3)N(C)C.[CH-]1C=CC=C1.Cl[Pd]Cl.[Fe+2]	{1: 3, 3: 1, 33: 1, 14: 18, 17: 2}
Did not match all atoms present	79770-26-6	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)N=NC4=CC=C(C=C4)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 4, 14: 21, 24: 2, 29: 6, 31: 2}
Did not match all atoms present	79770-81-3	CCC(CO)(CO)CO.CC(C)CCCCCC(=O)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=O)OC1=O	{1: 3, 2: 9, 3: 1, 4: 1, 14: 6, 20: 3, 27: 1, 28: 4}
Did not match all atoms present	79771-14-5	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl.C(CCCCCCCCC(=O)O)CCCCCCCCO	{1: 2, 2: 18, 4: 1, 11: 1, 12: 1, 14: 8, 17: 1, 20: 1, 21: 2, 23: 1, 27: 1}
Did not match all atoms present	79771-17-8	C=O.C1C(O1)CCl.C1=CC=C(C=C1)O.C(CN)CNCCCN	{2: 7, 5: 1, 11: 1, 12: 1, 14: 5, 17: 1, 21: 1, 23: 1, 30: 2, 31: 1}
Did not match all atoms present	79771-28-1	C1=CC(=C[N+](=C1)C2=NC(=NC(=N2)NCCNC3=C(C4=C(C=C3)N=C5C(=C(C6=NC7=C(C(=C(C=C7)NCCNC8=NC(=NC(=N8)NC9=C(C=CC(=C9)S(=O)(=O)[O-])S(=O)(=O)[O-])[N+]1=CC=CC(=C1)C(=O)[O-])S(=O)(=O)[O-])OC6=C5Cl)Cl)O4)S(=O)(=O)[O-])NC1=C(C=CC(=C1)S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 2, 2: 4, 35: 8, 14: 18, 17: 2, 23: 2, 24: 2, 29: 18, 31: 6}
Did not match all atoms present	79771-30-5	C1=CC(=CC=C1C=CC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl)OCCO	{2: 2, 35: 3, 4: 2, 6: 2, 14: 4, 17: 6, 20: 1, 22: 1}
Did not match all atoms present	79771-31-6	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C(=C1)[N+](=O)[O-].[K+]	{38: 1, 29: 3, 14: 6}
Did not match all atoms present	79771-32-7	C1=CC2=C(C=C(C=C2)S(=O)(=O)[O-])C(=C1)[N+](=O)[O-].[K+]	{38: 1, 29: 3, 14: 6}
Did not match all atoms present	79771-33-8	CCCCCCCCCC[Si](C)(CCCCO)O[Si](C)(CCCCCCCCCC)CCCCO	{1: 4, 2: 26, 20: 2, 22: 1}
Did not match all atoms present	79792-98-6	C1=CC=C(C=C1)NC2=CC=C(C=C2)N=NC3=CC(=CC=C3)S(=O)(=O)O.C(CO)NCCO	{2: 4, 34: 2, 14: 13, 20: 3, 29: 2, 31: 2}
Did not match all atoms present	79793-03-6	CC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)N)N=NC3=CC=C(C=C3)N=NC4=CC5=C(C=C(C=C5C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 4, 14: 16, 24: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	79799-72-7	[Ni+2].[OH-].[OH-].[OH-]	{}
Did not match all atoms present	79801-89-1	CCC1=C(N=C2C(=C1)C3=CC=CC=C3N2)N	{32: 1, 1: 1, 2: 1, 35: 1, 14: 5, 30: 1}
Did not match all atoms present	79801-90-4	CCCC1=C(N=C2C(=C1)C3=CC=CC=C3N2)N	{32: 1, 1: 1, 2: 2, 35: 1, 14: 5, 30: 1}
Did not match all atoms present	79809-27-1	C1=CC2=C(C=CC(=C2S(=O)(=O)[O-])NN=C3C(=CC4=C(C3=O)C=CC(=C4)NC5=NC(=NC(=N5)NC6=CC=C(C=C6)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 1, 14: 13, 15: 2, 17: 1, 22: 1, 25: 1, 29: 14, 31: 3}
Did not match all atoms present	79815-20-6	C1[C@H](NC2=CC=CC=C21)C(=O)O	{27: 1, 32: 1, 11: 1, 12: 1, 14: 4}
Did not match all atoms present	79817-88-2	C1=CC(=C(C=C1[N+](=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=NC(=NC(=N4)N)Cl)[O-])[O-].C1=CC(=C(C=C1[N+](=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=NC(=NC(=N4)N)Cl)[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Co+3]	{34: 4, 35: 6, 38: 2, 14: 12, 17: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	79828-43-6	C1=CC(=C(C=C1[N+](=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=NC(=NC(=N4)N)Cl)[O-])[O-].C1=CC(=C(C=C1[N+](=O)[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=NC(=NC(=N4)N)Cl)[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Cr+3]	{34: 4, 35: 6, 38: 2, 14: 12, 17: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	79863-58-4	CCCCCCCCCCCC[N+]1(CCOCC1)CC.CCOS(=O)(=O)[O-]	{1: 3, 2: 13, 11: 4, 22: 1, 23: 1, 29: 3}
Did not match all atoms present	79866-98-1	CC(C)(C)[Si](C(C)(C)C)(OC)OC	{1: 8, 4: 2, 22: 2}
Did not match all atoms present	79867-78-0	CC1[C@@H]([C@H](C[C@@H](O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)N6CCOCC6)O	{1: 3, 33: 1, 11: 7, 12: 5, 13: 1, 14: 3, 20: 2, 21: 2, 22: 2, 23: 2, 24: 1, 25: 2}
Did not match all atoms present	79873-33-9	CC1=CC=C(C=C1)NC2=CC=CC3=C2C(=CC=C3)S(=O)(=O)[O-].[NH4+]	{1: 1, 29: 3, 14: 10, 31: 1}
Did not match all atoms present	79873-35-1	C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[K+].[K+]	{30: 1, 29: 6, 14: 5}
Did not match all atoms present	79887-10-8	CCCCCC1=CC=C(C=C1)C#C	{1: 1, 2: 4, 10: 1, 14: 4, 9: 1}
Did not match all atoms present	799-53-1	C[Si](C)(C)O[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 3, 22: 1, 14: 15}
Did not match all atoms present	79916-07-7	CCN(CC)C1=CC2=C(C=C1)N=C3C=CC(=[N+](CC)CC)C=C3O2.CC(=O)[O-]	{1: 5, 2: 4, 35: 1, 33: 2, 14: 6, 23: 1, 24: 1}
Did not match all atoms present	79933-17-8	CC(C)(C)N=P1(N(P1C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 34: 1, 4: 4, 33: 1}
Did not match all atoms present	79949-96-5	[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Sn+3]	{}
Did not match all atoms present	79967-32-1	CC1=NC=C(/C(=C\NC2=CC=C(C=C2)N(CCCl)CCCl)/C1=O)CO	{1: 1, 2: 5, 35: 1, 6: 1, 33: 1, 14: 5, 15: 3, 17: 2, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	79983-71-4	CCCCC(CN1C=NC=N1)(C2=C(C=C(C=C2)Cl)Cl)O	{1: 1, 2: 4, 35: 2, 4: 1, 33: 1, 14: 5, 17: 2, 20: 1}
Did not match all atoms present	79999-47-6	CC(C)(C)[Si](C)(C)OC[C@@H]1[C@H]([C@@H](C=CO1)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	{1: 15, 2: 1, 4: 3, 12: 3, 14: 2, 22: 3, 23: 1}
Did not match all atoms present	80-00-2	C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)Cl	{17: 1, 29: 2, 14: 9}
Did not match all atoms present	80-05-7	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O	{1: 2, 4: 1, 21: 2, 14: 8}
Did not match all atoms present	80-06-8	CC(C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)O	{1: 1, 4: 1, 20: 1, 14: 8, 17: 2}
Did not match all atoms present	80-07-9	C1=CC(=CC=C1S(=O)(=O)C2=CC=C(C=C2)Cl)Cl	{17: 2, 29: 2, 14: 8}
Did not match all atoms present	80-08-0	C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N	{30: 2, 29: 2, 14: 8}
Did not match all atoms present	80-09-1	C1=CC(=CC=C1O)S(=O)(=O)C2=CC=C(C=C2)O	{21: 2, 14: 8, 29: 2}
Did not match all atoms present	80-10-4	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(Cl)Cl	{17: 2, 14: 10}
Did not match all atoms present	80-11-5	CC1=CC=C(C=C1)S(=O)(=O)N(C)N=O	{1: 2, 34: 1, 29: 3, 14: 4, 33: 1}
Did not match all atoms present	80-12-6	C1N2CN3CN(S2(=O)=O)CN1S3(=O)=O	{33: 4, 11: 4, 29: 4}
Did not match all atoms present	80-13-7	C1=CC(=CC=C1C(=O)O)S(=O)(=O)N(Cl)Cl	{17: 2, 27: 1, 29: 2, 14: 4, 33: 1}
Did not match all atoms present	80-15-9	CC(C)(C1=CC=CC=C1)OO	{1: 2, 4: 1, 22: 1, 14: 5, 20: 1}
Did not match all atoms present	80-17-1	C1=CC=C(C=C1)S(=O)(=O)NN	{30: 1, 29: 2, 14: 5, 31: 1}
Did not match all atoms present	80-18-2	COS(=O)(=O)C1=CC=CC=C1	{1: 1, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	80-19-3	CC(C)NS(=O)(=O)C1=CC(=C(C=C1)O)N	{1: 2, 3: 1, 14: 3, 21: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	80-20-6	C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)N	{30: 1, 31: 1, 21: 1, 14: 8, 29: 2}
Did not match all atoms present	80-21-7	C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)N	{30: 1, 29: 2, 14: 9, 31: 1}
Did not match all atoms present	80-22-8	CCCCNS(=O)(=O)C1=CC(=C(C=C1)OC)N	{1: 2, 2: 3, 14: 3, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	80-23-9	CNS(=O)(=O)C1=CC(=C(C=C1)O)N	{1: 1, 14: 3, 21: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	80-30-8	CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2	{1: 1, 11: 5, 12: 1, 14: 4, 29: 2, 31: 1}
Did not match all atoms present	80-32-0	C1=CC(=CC=C1N)S(=O)(=O)NC2=NN=C(C=C2)Cl	{35: 2, 14: 6, 17: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	80-33-1	C1=CC(=CC=C1OS(=O)(=O)C2=CC=C(C=C2)Cl)Cl	{17: 2, 22: 1, 14: 8, 29: 2}
Did not match all atoms present	80-35-3	COC1=NN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 35: 2, 14: 6, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	80-38-6	C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)Cl	{17: 1, 22: 1, 14: 9, 29: 2}
Did not match all atoms present	80-39-7	CCNS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	80-40-0	CCOS(=O)(=O)C1=CC=C(C=C1)C	{1: 2, 2: 1, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	80-41-1	CC1=CC=C(C=C1)S(=O)(=O)OCCCl	{1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 29: 2}
Did not match all atoms present	80-42-2	CCCOS(=O)(=O)C1=CC=CC=C1	{1: 1, 2: 2, 22: 1, 14: 5, 29: 2}
Did not match all atoms present	80-43-3	CC(C)(C1=CC=CC=C1)OOC(C)(C)C2=CC=CC=C2	{1: 4, 4: 2, 22: 2, 14: 10}
Did not match all atoms present	80-46-6	CCC(C)(C)C1=CC=C(C=C1)O	{1: 3, 2: 1, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	80-48-8	CC1=CC=C(C=C1)S(=O)(=O)OC	{1: 2, 22: 1, 14: 4, 29: 2}
Did not match all atoms present	80-49-9	C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O)C.[Br-]	{1: 2, 3: 1, 11: 4, 12: 3, 14: 5, 18: 1, 20: 1, 28: 1}
Did not match all atoms present	80-50-2	CCCC(CCC)C(=O)OC1C[C@H]2CC[C@H](C1)[N+]2(C)C.[Br-]	{1: 4, 2: 4, 3: 1, 11: 4, 12: 3, 18: 1, 28: 1}
Did not match all atoms present	80-51-3	C1=CC(=CC=C1OC2=CC=C(C=C2)S(=O)(=O)NN)S(=O)(=O)NN	{30: 2, 31: 2, 22: 1, 14: 8, 29: 4}
Did not match all atoms present	80-54-6	CC(CC1=CC=C(C=C1)C(C)(C)C)C=O	{1: 4, 2: 1, 3: 1, 4: 1, 14: 4, 26: 1}
Did not match all atoms present	80-74-0	CC1=C(ON=C1C)N(C(=O)C)S(=O)(=O)C2=CC=C(C=C2)N	{1: 3, 35: 1, 33: 1, 14: 4, 23: 1, 24: 1, 29: 2, 30: 1}
Did not match all atoms present	80-77-3	CN1C(S(=O)(=O)CCC1=O)C2=CC=C(C=C2)Cl	{1: 1, 33: 1, 11: 2, 12: 1, 14: 4, 17: 1, 25: 1, 29: 2}
Did not match all atoms present	80-81-9	CCC1=CC2=C(C=C1)C(CCC2(C)C)(C)C	{1: 5, 2: 1, 11: 2, 13: 2, 14: 3}
Did not match all atoms present	800-22-6	CCN(CC)CCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl	{1: 2, 2: 4, 33: 2, 41: 1, 14: 7, 17: 1, 24: 1}
Did not match all atoms present	8000-03-1	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5	{1: 4, 11: 14, 12: 8, 13: 3, 14: 9, 15: 1, 20: 1, 24: 1, 25: 1, 28: 1}
Did not match all atoms present	8000-34-8	COC(=O)[C@@H](CC1=CN=CN1)N.Cl	{32: 1, 1: 1, 2: 1, 3: 1, 14: 2, 17: 1, 35: 1, 28: 1, 30: 1}
Did not match all atoms present	8000-95-1	CN1C=NC2=C1C(=O)N(C(=O)N2C)C.C1=CC=C(C=C1)C(=O)[O-].[Na+]	{1: 3, 35: 1, 33: 3, 14: 6, 24: 1, 25: 2}
Did not match all atoms present	80006-41-3	CCCCCCCCCCCCC(=O)[O-].[Tl+]	{24: 1, 1: 1, 2: 11}
Did not match all atoms present	80010-37-3	C(CS(=O)(=O)O)C(F)(F)F	{16: 3, 20: 1, 2: 2, 4: 1, 29: 2}
Did not match all atoms present	80010-52-2	CCN(CC(C[N+](C)(C)C)O)C1=CC(=C(C=C1)N=NC2=CC=C(C=C2)C(=O)C[N+](C)(C)C)C.[Cl-].[Cl-]	{1: 8, 2: 4, 3: 1, 33: 1, 34: 2, 14: 7, 17: 2, 20: 1, 24: 1}
Did not match all atoms present	80018-50-4	CCOC1=C(C=CC(=C1)CC(=O)O)O	{1: 1, 2: 2, 14: 3, 21: 1, 22: 1, 27: 1}
Did not match all atoms present	8002-33-3	CCCCCCC(OS(=O)(=O)[O-])C/C=C\CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C\CC(OS(=O)(=O)[O-])CCCCCC)COC(=O)CCCCCCC/C=C\CC(OS(=O)(=O)[O-])CCCCCC.[Na+].[Na+].[Na+]	{1: 3, 2: 41, 3: 4, 6: 6, 22: 3, 28: 3, 29: 9}
Did not match all atoms present	8002-89-9	CC(=O)[O-].CN1C(=C2C(=NC=N2)N(C1=O)C)[O-].[Na+].[Na+]	{1: 3, 35: 2, 33: 2, 14: 1, 24: 1, 25: 1}
Did not match all atoms present	80025-09-8	CCC(CC)(CC)C#CC1=CC=CC=C1	{1: 3, 2: 3, 4: 1, 10: 2, 14: 5}
Did not match all atoms present	8003-08-5	C[C@H]1C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)OC(=O)C)C)[C@@]4(C1=CC(=O)CC4)C.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 6, 9: 1, 10: 1, 11: 13, 12: 7, 13: 5, 14: 4, 15: 1, 20: 1, 21: 1, 24: 1, 25: 1, 28: 1}
Did not match all atoms present	8003-62-1	C1=CC(=CC=C1N/N=C/2\C(=CC3=C(C2=O)C=C(C=C3)N=NC4=C(C=C(C=C4)N)N)S(=O)(=O)[O-])N=NC5=C6C=CC(=CC6=C(C=C5)N)S(=O)(=O)[O-].[Na+].[Na+]	{34: 5, 14: 16, 15: 2, 25: 1, 29: 6, 30: 3, 31: 1}
Did not match all atoms present	8003-78-9	CC1=C(C=CC(=C1)NN=C2C=CC(=O)C(=NNC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)[O-])C2=O)N=NC5=CC(=CC(=C5C)Cl)S(=O)(=O)[O-].[Na+].[Na+]	{1: 2, 34: 4, 14: 13, 17: 1, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	80039-73-2	C1CN2C(=NC3=CC=CC=C3C2=O)C1O.Cl	{33: 1, 35: 1, 11: 2, 12: 1, 14: 4, 17: 1, 20: 1, 25: 1}
Did not match all atoms present	80039-76-5	C(#N)[Se]Cl	{17: 1, 37: 1}
Did not match all atoms present	80039-77-6	C(#N)[Se]Br	{18: 1, 37: 1}
Did not match all atoms present	8004-13-5	C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)OC2=CC=CC=C2	{22: 1, 14: 20}
Did not match all atoms present	8004-86-2	CCNC1=CC=C(C=C1)C(=C2C=CC(=NCC)C(=C2)C)C3=CC=C(C=C3)NCC.Cl	{1: 4, 2: 3, 7: 1, 34: 1, 14: 11, 15: 3, 17: 1, 31: 2}
Did not match all atoms present	8004-87-3	CNC1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]	{1: 5, 33: 2, 7: 1, 14: 12, 15: 2, 17: 1, 31: 1}
Did not match all atoms present	8004-98-6	C1=CC=C(C=C1)NC2=CC3=NC4=CC(=C(C=C4[N+](=C3C=C2NC5=CC=CC=C5)C6=CC=CC=C6)N)N.[Cl-]	{33: 1, 35: 1, 14: 19, 17: 1, 30: 2, 31: 2}
Did not match all atoms present	8005-78-5	CC1=C(C=C(C=C1)N=NC2=C(C=C(C(=C2)C)[NH3+])N)N=NC3=C(C=C(C(=C3)C)[NH3+])N.[Cl-].[Cl-]	{1: 3, 34: 4, 30: 2, 14: 7, 17: 2}
Did not match all atoms present	8006-25-5	CC(C)[C@@]1(C(=O)N2CC(=O)N3CCC[C@H]3[C@@]2(O1)O)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C	{32: 1, 1: 3, 3: 1, 33: 3, 11: 6, 12: 3, 13: 2, 14: 5, 15: 1, 20: 1, 23: 1, 24: 1, 25: 2, 31: 1}
Did not match all atoms present	8006-38-0	CCN1CC2([C@H]3C(C4[C@@H]1C3([C@@H]5C[C@]6(C([C@@H]5[C@@]4(C(C6OC)O)OC(=O)C)OC(=O)C7=CC=CC=C7)O)C(CC2O)OC)OC)COC	{1: 6, 2: 2, 33: 1, 11: 3, 12: 11, 13: 4, 14: 5, 20: 3, 22: 4, 28: 2}
Did not match all atoms present	80060-09-9	CC(C)C1=CC(=CC(=C1NC(=S)NC(C)(C)C)C(C)C)OC2=CC=CC=C2	{1: 7, 3: 2, 4: 1, 7: 1, 14: 7, 22: 1, 31: 2}
Did not match all atoms present	8007-56-5	[N+](=O)(O)[O-].Cl	{17: 1, 20: 1}
Did not match all atoms present	80077-72-1	CCOP(=O)(C(F)(F)[Si](C)(C)C)OCC	{1: 5, 2: 2, 4: 1, 16: 2, 22: 2, 29: 1}
Did not match all atoms present	80109-14-4	C1C(=CC=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3	{17: 1, 11: 1, 14: 11, 15: 2}
Did not match all atoms present	8011-76-5	OP(=O)(O)O.OP(=O)(O)O.[Ca+2]	{20: 6, 29: 2}
Did not match all atoms present	80112-41-0	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O.C1=CC=C(C=C1)C2=CC=C(C=C2)O	{1: 5, 2: 1, 4: 2, 5: 1, 14: 13, 21: 2}
Did not match all atoms present	80115-67-9	CCN1C=C(C(=O)N(C1=O)CC)F	{1: 2, 2: 2, 33: 2, 14: 1, 16: 1, 25: 2}
Did not match all atoms present	8012-54-2	[As](I)(I)I.I[Hg]	{19: 4}
Did not match all atoms present	8013-38-5	CCN(CC)CCOC(=O)C1=CC=C(C=C1)N.CN1C=NC2=C1C(=O)N(C(=O)N2C)C.Cl	{1: 5, 2: 4, 35: 1, 33: 4, 14: 5, 17: 1, 25: 2, 28: 1, 30: 1}
Did not match all atoms present	8014-95-7	OS(=O)(=O)O.O=S(=O)=O	{20: 2, 29: 5}
Did not match all atoms present	8015-12-1	CC(=O)O[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)C#C.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 3, 9: 2, 10: 2, 11: 14, 12: 7, 13: 4, 14: 4, 15: 1, 20: 1, 21: 1, 25: 1, 28: 1}
Did not match all atoms present	8015-18-7	CCC1(C(=O)NC(=O)NC1=O)CC.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C	{32: 2, 1: 6, 2: 2, 33: 3, 13: 1, 14: 5, 25: 4}
Did not match all atoms present	8015-19-8	CC#C[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H](C4=CC(=O)CC[C@]34C)C)C)O.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 5, 9: 1, 10: 3, 11: 13, 12: 7, 13: 5, 14: 4, 15: 1, 20: 2, 21: 1, 25: 1}
Did not match all atoms present	8015-29-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)CC[C@H]34.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)OC	{1: 3, 9: 2, 10: 2, 11: 14, 12: 7, 13: 4, 14: 4, 15: 1, 20: 2, 22: 1, 25: 1}
Did not match all atoms present	8015-35-8	C1=CC(=C(C=C1Cl)Cl)OCC(=O)O.C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)O	{17: 5, 2: 2, 27: 2, 22: 2, 14: 5}
Did not match all atoms present	8015-38-1	CC(C)OC(=O)NC1=CC=CC=C1.C1CC2C(C(C1O2)C(=O)O)C(=O)O	{1: 2, 3: 1, 11: 2, 12: 4, 14: 5, 23: 1, 27: 2, 28: 1, 31: 1}
Did not match all atoms present	8015-55-2	CC(C#C)OC(=O)NC1=CC(=CC=C1)Cl.CN(C)C(=O)NC1CCCCCCC1	{1: 3, 3: 1, 33: 1, 9: 1, 10: 1, 11: 7, 12: 1, 14: 4, 17: 1, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	80156-94-1	C1=CC(=CC(=C1)S(=O)(=O)CCOS(=O)(=O)[O-])NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N/N=C/4\C(=CC5=CC(=C(C(=C5C4=O)N)N=NC6=CC=C(C=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 3, 14: 13, 15: 2, 17: 1, 22: 1, 25: 1, 29: 17, 30: 1, 31: 3}
Did not match all atoms present	80156-96-3	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=C(C=C5)S(=O)(=O)CCOS(=O)(=O)[O-])Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 1, 14: 12, 15: 2, 17: 1, 22: 1, 25: 1, 29: 11, 31: 3}
Did not match all atoms present	80157-00-2	C1=CC(=CC(=C1)S(=O)(=O)CCOS(=O)(=O)[O-])NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)N=NC4=C(C=C5C=C(C=C(C5=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)N)Cl.[Na+].[Na+].[Na+].[Na+]	{2: 2, 35: 3, 34: 2, 14: 11, 17: 1, 22: 1, 24: 1, 29: 14, 30: 1, 31: 3}
Did not match all atoms present	8018-01-7	C(CNC(=S)[S-])NC(=S)[S-].C(CNC(=S)[S-])NC(=S)[S-].[Mn+2].[Zn+2]	{2: 4, 31: 4, 7: 4}
Did not match all atoms present	80182-35-0	C1=CC=C2C(=C1)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC5=C4C2=CC=C5	{38: 1, 14: 11}
Did not match all atoms present	802-93-7	C1=CC(=CC(=C1)C(C(F)(F)F)(C(F)(F)F)O)C(C(F)(F)F)(C(F)(F)F)O	{16: 12, 20: 2, 4: 6, 14: 4}
Did not match all atoms present	80214-35-3	CC1=CC=C(C=C1)S(=O)OC(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C	{1: 5, 3: 1, 33: 2, 14: 12, 22: 1, 29: 1}
Did not match all atoms present	8022-00-2	CCSCCOP(=S)(OC)OC.CCSCCSP(=O)(OC)OC	{40: 3, 1: 6, 2: 6, 29: 1, 22: 5}
Did not match all atoms present	80234-20-4	CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN)/C3=CC=CC=C3	{1: 1, 2: 3, 7: 2, 14: 14, 22: 1, 30: 1}
Did not match all atoms present	80266-48-4	CN(C)N=NC1=CC2=NC3=CC=CC=C3C(=C2C=C1)NC4=CC=C(C=C4)NS(=O)(=O)C	{1: 3, 34: 2, 35: 1, 33: 1, 14: 11, 29: 2, 31: 2}
Did not match all atoms present	80285-16-1	CCCC1COC(OC1)C2=CC=C(C=C2)C#N	{1: 1, 2: 2, 37: 1, 11: 2, 12: 2, 14: 4, 23: 2}
Did not match all atoms present	80289-21-0	CC(C)(C)C(=CC(=O)C(C(C(F)(F)F)(F)F)(F)F)[O-].CC(C)(C)C(=CC(=O)C(C(C(F)(F)F)(F)F)(F)F)[O-].[Cu+2]	{1: 6, 4: 8, 6: 2, 7: 2, 16: 14, 24: 2}
Did not match all atoms present	803-57-6	C1=CC=C2C(=C1)C3=NC4=C(C=C(C=C4)F)C5=NC6=CC=CC=C6C(=N2)N35	{16: 1, 33: 1, 35: 3, 14: 11}
Did not match all atoms present	8030-84-0	[H+].[H+].[H+].[H+].[H+].C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Mg+2].[K+].[K+]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	80301-65-1	C1=CC(=CC=C1N/N=C/2\C(=O)C=C/C(=N/NC3=CC4=C(C=C3)C=C(/C(=N\NC5=CC(=CC(=C5O)[N+](=O)[O-])S(=O)(=O)O)/C4=O)S(=O)(=O)O)/C2=O)[N+](=O)[O-]	{34: 3, 38: 2, 14: 12, 15: 2, 20: 2, 21: 1, 25: 3, 29: 4, 31: 3}
Did not match all atoms present	80301-66-2	CC1=C(C(=CC=C1)Cl)N2C(=O)C(C(=N2)C)N=NC3=C(C=CC(=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)NC6=CC(=C(C=C6)S(=O)(=O)[O-])N=NC7C(=NN(C7=O)C8=C(C=CC=C8Cl)C)C)S(=O)(=O)[O-].[Na+].[Na+]	{1: 4, 34: 4, 35: 5, 33: 2, 12: 2, 14: 17, 15: 2, 17: 2, 25: 2, 29: 6, 31: 3}
Did not match all atoms present	80336-72-7	COC1=CC=C(C=C1)C(=O)CI	{1: 1, 2: 1, 14: 4, 19: 1, 22: 1, 24: 1}
Did not match all atoms present	80376-66-5	CC(C)(C)N=CN(C)C[Si](C)(C)C	{1: 7, 2: 1, 4: 1, 6: 1, 33: 1, 34: 1}
Did not match all atoms present	80387-97-9	CCCCC(CC)COC(=O)CSCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C	{1: 8, 2: 7, 3: 1, 4: 2, 40: 1, 14: 2, 21: 1, 28: 1}
Did not match all atoms present	804-10-4	CCN(CC)CCC1=C(C2=C(C=C(C=C2)OCC(=O)OCC)OC1=O)C	{1: 4, 2: 6, 33: 1, 14: 3, 22: 1, 28: 2}
Did not match all atoms present	804-30-8	CC1=NC=C(C(=N1)N)CN(C=O)/C(=C(\CCO)/SSCC2CCCO2)/C	{1: 2, 2: 4, 35: 2, 33: 1, 7: 2, 40: 2, 11: 3, 12: 1, 14: 1, 20: 1, 23: 1, 26: 1, 30: 1}
Did not match all atoms present	804-36-4	C1=C(OC(=C1)[N+](=O)[O-])/C=C/C(=NN=C(N)N)/C=C/C2=CC=C(O2)[N+](=O)[O-]	{34: 2, 38: 2, 6: 4, 7: 2, 14: 4, 23: 2, 30: 2}
Did not match all atoms present	80400-38-0	[CH3-].[CH3-].[CH3-].[CH3-].C[C-]1C(=C(C(=C1C)C)C)C.[Ir]	{1: 5}
Did not match all atoms present	80430-60-0	CCCCOC(=O)C(=C)C.CC1=CC=CC=C1C=C.CC(=C)C(=O)OC	{1: 5, 2: 3, 5: 3, 6: 1, 7: 2, 14: 4, 28: 2}
Did not match all atoms present	80438-65-9	CC(C)(C)C1=CC(=C(C=C1)Cl)C(C)(C)C	{1: 6, 4: 2, 14: 3, 17: 1}
Did not match all atoms present	80438-67-1	CC(C)(C)C1=CC(=CC(=C1)Cl)C(C)(C)C	{1: 6, 4: 2, 14: 3, 17: 1}
Did not match all atoms present	80443-63-6	CC(C)(C)C1(CO1)CCC2=CC=C(C=C2)Cl	{1: 3, 2: 2, 4: 1, 11: 1, 13: 1, 14: 4, 17: 1, 23: 1}
Did not match all atoms present	80448-87-9	C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC4=C(C=C3)C(=O)C(=NNC5=C(C=CC(=C5)S(=O)(=O)[O-])O)C(=C4)S(=O)(=O)[O-])NC6=CC7=C(C=C6)C(=O)C(=NNC8=C(C=CC(=C8)S(=O)(=O)[O-])O)C(=C7)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu].[Cu]	{34: 2, 35: 3, 14: 19, 15: 4, 21: 2, 25: 2, 29: 12, 31: 5}
Did not match all atoms present	80448-88-0	C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC4=C(C=C3)C(=O)C(=NNC5=CC(=CC(=C5O)Cl)S(=O)(=O)[O-])C(=C4)S(=O)(=O)[O-])NC6=CC7=C(C=C6)C(=O)C(=NNC8=CC(=CC(=C8O)Cl)S(=O)(=O)[O-])C(=C7)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu].[Cu]	{34: 2, 35: 3, 14: 17, 15: 4, 17: 2, 21: 2, 25: 2, 29: 12, 31: 5}
Did not match all atoms present	80462-13-1	C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.C1=C[N-]N=C1.C1=C[N-]N=C1.[Ir].[Ir]	{35: 4, 11: 8, 14: 14}
Did not match all atoms present	8047-67-4	[C@H]([C@@H]([C@@H](C(=O)[O-])O)O)([C@H](C(=O)[O-])O)O.[C@H]([C@@H]([C@@H](C(=O)[O-])O)O)([C@H](C(=O)[O-])O)O.[C@H]([C@@H]([C@@H](C(=O)[O-])O)O)([C@H](C(=O)[O-])O)O.[Fe+3].[Fe+3]	{24: 6, 3: 12, 20: 12}
Did not match all atoms present	8047-99-2	CCNS(=O)(=O)C1=CC=CC(=C1)C	{1: 2, 2: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	80471-63-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@]45[C@@]3(CC(=C([C@]4(O5)C)O)[N+]#[C-])C	{1: 4, 34: 1, 11: 7, 12: 3, 13: 5, 15: 2, 20: 2, 23: 1}
Did not match all atoms present	80508-23-2	C1CC(N(C1)N=O)C2=CN=CC=C2	{33: 1, 34: 1, 35: 1, 11: 3, 12: 1, 14: 4, 29: 1}
Did not match all atoms present	80510-04-9	C1=CC=C(C(=C1)P)P	{14: 4}
Did not match all atoms present	8052-16-2	CC[C@H](C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N(CC(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)C3=C(C(=O)C(=C4C3=NC5=C(C=CC(=C5O4)C)C(=O)N[C@H]6[C@H](OC(=O)[C@@H](N(C(=O)CN(C(=O)[C@@H]7CCCN7C(=O)[C@@H](NC6=O)C(C)C)C)C)C(C)C)C)C)N)C)C(C)C)C)C	{32: 2, 1: 16, 2: 1, 3: 4, 33: 6, 11: 8, 12: 10, 14: 2, 35: 1, 23: 1, 24: 2, 25: 9, 28: 2, 30: 1, 31: 2}
Did not match all atoms present	80522-42-5	CC(C)[Si](C(C)C)(C(C)C)OS(=O)(=O)C(F)(F)F	{1: 6, 3: 3, 4: 1, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	80529-93-7	[H+].[H+].C(CN(CC(=O)[O-])CC(=O)[O-])N(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Gd+3]	{24: 5, 33: 3, 2: 9}
Did not match all atoms present	8053-21-2	CC(C(=O)O)OC1=C(C=C(C=C1)Cl)Cl.CC(C(=O)O)OC1=CC(=C(C=C1Cl)Cl)Cl.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O.C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)O	{1: 2, 2: 2, 3: 2, 14: 10, 17: 10, 22: 4, 27: 4}
Did not match all atoms present	80539-34-0	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(CC4=CC=C(C=C4)S(=O)(=O)[O-])CC5=CC=C(C=C5)S(=O)(=O)[O-].[Na+]	{1: 4, 2: 2, 33: 3, 7: 1, 14: 20, 15: 2, 29: 6}
Did not match all atoms present	80539-95-3	[H+].[H+].CN1C2=C(N=C1OCCCN(C)C)N(C(=O)N(C2=O)C)C.CN1C2=C(N=C1OCCCN(C)C)N(C(=O)N(C2=O)C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Pt+4]	{1: 10, 2: 6, 35: 2, 33: 8, 17: 6, 22: 2, 25: 4}
Did not match all atoms present	80548-31-8	C[C@H](C1=CC=CC=C1)NCCO	{1: 1, 2: 2, 3: 1, 14: 5, 20: 1, 31: 1}
Did not match all atoms present	80548-38-5	CC1=C2CCC3=C(C(=C(CCC(=C1)C=C2)C=C3)C)C	{1: 3, 11: 4, 14: 5}
Did not match all atoms present	8055-33-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CC[C@]34C	{1: 3, 11: 14, 12: 8, 13: 3, 14: 4, 15: 1, 20: 2, 21: 1, 25: 1}
Did not match all atoms present	8056-51-7	CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)CC[C@H]34.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 2, 2: 1, 9: 2, 10: 2, 11: 14, 12: 7, 13: 4, 14: 4, 15: 1, 20: 2, 21: 1, 25: 1}
Did not match all atoms present	80563-86-6	CC1=C(C=CC=C1Cl)S(=O)(=O)Cl	{1: 1, 29: 2, 14: 3, 17: 2}
Did not match all atoms present	8059-83-4	CCCC[N+]1([C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4)C.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)[O-].[Na+].[Br-]	{1: 5, 2: 5, 3: 1, 33: 3, 11: 2, 12: 5, 14: 10, 18: 1, 20: 1, 23: 1, 25: 1, 28: 1, 29: 3}
Did not match all atoms present	806-71-3	C1=CC=C(C=C1)C=C(C2=CC=CC=C2)C(=CC3=CC=CC=C3)C4=CC=CC=C4	{14: 20, 6: 2, 7: 2}
Did not match all atoms present	8061-51-6	COC1=CC=CC(=C1O)CC(CS(=O)(=O)[O-])OC2=C(C=C(C=C2)CCCS(=O)(=O)[O-])OC.[Na+].[Na+]	{1: 2, 2: 5, 3: 1, 14: 6, 21: 1, 22: 3, 29: 6}
Did not match all atoms present	80611-44-5	[H+].[H+].C1CCC(C(C1)N)N.C(C(C(C(=O)[O-])[O-])C(=O)[O-])C(=O)[O-].[Pt+2]	{2: 1, 3: 2, 11: 4, 12: 2, 24: 3, 29: 1, 30: 2}
Did not match all atoms present	8062-14-4	CC1=CC(=C(C=C1N)N)N=NC2=CC=C(C=C2)S(=O)(=O)[O-].C1=CC(=CC=C1N=NC2=CC(=C(C=C2N)N)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 30: 4, 34: 6, 29: 9, 14: 16}
Did not match all atoms present	8064-18-4	CCCCCOC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl.CCCCOC(=O)COC1=C(C=C(C=C1)Cl)C	{1: 3, 2: 9, 14: 5, 17: 4, 22: 2, 28: 2}
Did not match all atoms present	8064-38-8	[Li+].[Li+].[Li+].CC(=O)OC1=CC=CC=C1C(=O)O.COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.Cl.Cl	{1: 2, 2: 2, 3: 1, 4: 1, 5: 1, 6: 1, 33: 1, 11: 4, 12: 3, 14: 9, 17: 2, 35: 1, 20: 2, 22: 1, 24: 3, 27: 1, 28: 1}
Did not match all atoms present	8064-42-4	C/C=C\C(=O)OC1=C(C=C(C=C1[N+](=O)[O-])C(C)(C)CCC(C)C)[N+](=O)[O-].C(CNC(=S)[S-])NC(=S)[S-].C(CNC(=S)[S-])NC(=S)[S-].[Mn+2].[Zn+2]	{1: 5, 2: 6, 3: 1, 4: 1, 38: 2, 6: 2, 7: 4, 14: 2, 28: 1, 31: 4}
Did not match all atoms present	8064-60-6	CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(S4)C5=CC=C(C=C5)N)S(=O)(=O)[O-].[Na+]	{1: 1, 35: 2, 41: 2, 14: 9, 29: 3, 30: 1}
Did not match all atoms present	8064-66-2	CC1=C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)OC(=O)C)C)[C@@]4(C1=CC(=O)CC4)C.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 6, 9: 1, 10: 1, 11: 12, 12: 6, 13: 5, 14: 5, 15: 2, 20: 1, 21: 1, 24: 1, 25: 1, 28: 1}
Did not match all atoms present	8064-76-4	C[C@]12CCCC=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C#C)O)C.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 3, 9: 2, 10: 2, 11: 15, 12: 6, 13: 5, 14: 4, 15: 1, 20: 2, 21: 1}
Did not match all atoms present	8064-79-7	CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C	{1: 5, 2: 3, 33: 5, 12: 1, 14: 15, 25: 3}
Did not match all atoms present	8064-90-2	CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N.COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N	{1: 4, 2: 1, 35: 3, 14: 8, 22: 3, 23: 1, 29: 2, 30: 3, 31: 1}
Did not match all atoms present	80648-26-6	CC1=CC(=CC(=C1)C2CO2)C	{1: 2, 11: 1, 12: 1, 14: 3, 23: 1}
Did not match all atoms present	80648-58-4	CC1=CC(=C(C=C1NC(=O)C2=CC3=CC=CC=C3/C(=N\NC4=C(C=CC(=C4)C(=O)OC(C)C)C(=O)OC(C)C)/C2=O)C)NC(=O)C5=CC6=CC=CC=C6/C(=N/NC7=C(C=CC(=C7)C(=O)OC(C)C)C(=O)OC(C)C)/C5=O	{1: 10, 34: 2, 3: 4, 14: 18, 15: 4, 24: 2, 25: 2, 28: 4, 31: 4}
Did not match all atoms present	8065-48-3	CCOP(=O)(OCC)SCCSCC.CCOP(=S)(OCC)OCCSCC	{40: 3, 1: 6, 2: 10, 29: 1, 22: 5}
Did not match all atoms present	8065-83-6	Cl[Hg].Cl[Hg].Cl[Hg]Cl	{17: 4}
Did not match all atoms present	8066-33-9	CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C(C(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-])O[N+](=O)[O-]	{1: 1, 2: 4, 4: 1, 38: 3, 14: 2, 22: 4}
Did not match all atoms present	8067-69-4	C1=CC2=C(C(=C(C=C2)Cl)O)N=C1.C1=CC2=C(C=CC(=C2N=C1)O)Cl.C1=CC2=C(C(=C(C=C2Cl)Cl)O)N=C1	{17: 4, 35: 3, 21: 3, 14: 14}
Did not match all atoms present	8067-98-9	CCOC(=O)CC(C(=O)OCC)SP(=S)(OC)OC.CC1=C(C=CC(=C1)OP(=S)(OC)OC)[N+](=O)[O-]	{1: 7, 2: 3, 3: 1, 38: 1, 40: 1, 14: 3, 22: 5, 28: 2}
Did not match all atoms present	80676-35-3	C1=CC=C(C=C1)CCC2=CC=C(C=C2)CCl	{17: 1, 2: 3, 14: 9}
Did not match all atoms present	80677-48-1	CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4	{1: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 10, 22: 1}
Did not match all atoms present	8068-28-8	CCC(C)CCCCC(=O)NC(CCNCS(=O)(=O)[O-])C(=O)NC(C(C)O)C(=O)NC(CCNCS(=O)(=O)[O-])C(=O)NC1CCNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CCNCS(=O)(=O)[O-])CC(C)C)CC(C)C)CCNCS(=O)(=O)[O-])CCNCS(=O)(=O)[O-])C(C)O.[Na+].[Na+].[Na+].[Na+].[Na+]	{32: 7, 1: 8, 2: 22, 3: 8, 11: 2, 12: 7, 20: 2, 24: 4, 25: 7, 29: 15, 31: 9}
Did not match all atoms present	80684-62-4	C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)NO	{16: 5, 24: 1, 20: 1, 31: 1}
Did not match all atoms present	8069-76-9	CCCCCC(CC)C1=CC(=CC(=C1OC(=O)OC)[N+](=O)[O-])[N+](=O)[O-].CCCCC(CCC)C1=CC(=CC(=C1OC(=O)OC)[N+](=O)[O-])[N+](=O)[O-]	{1: 6, 2: 10, 3: 2, 38: 4, 14: 4}
Did not match all atoms present	80693-00-1	CC1=CC(=C(C(=C1)C(C)(C)C)OP2OCC3(CO2)COP(OC3)OC4=C(C=C(C=C4C(C)(C)C)C)C(C)(C)C)C(C)(C)C	{1: 14, 4: 4, 11: 4, 13: 1, 14: 4, 22: 2, 23: 4}
Did not match all atoms present	807-28-3	C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)O[Si](C)(C3=CC=CC=C3)C4=CC=CC=C4	{1: 2, 22: 1, 14: 20}
Did not match all atoms present	80722-69-6	C1CCN(C1)C(=O)CC2=NN=C3C=CC=NC3=C2	{33: 1, 2: 1, 35: 3, 11: 4, 14: 4, 24: 1}
Did not match all atoms present	80724-20-5	CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C=CC(=C4)N=C=S)C(=O)[O-]	{1: 4, 34: 1, 33: 2, 8: 1, 14: 9, 23: 1, 24: 1}
Did not match all atoms present	8073-61-8	CCNC1=NC(=NC(=N1)SC)NC(C)C.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O	{1: 4, 2: 2, 3: 1, 40: 1, 14: 3, 17: 2, 35: 3, 22: 1, 27: 1, 31: 2}
Did not match all atoms present	80734-02-7	CC1=C(OC(=O)O1)COC(=O)[C@H]2C(S[C@H]3N2C(=O)[C@H]3NC(=O)[C@@H](C4=CC=CC=C4)N)(C)C.Cl	{1: 3, 2: 1, 3: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 17: 1, 24: 1, 25: 1, 28: 3, 30: 1, 31: 1}
Did not match all atoms present	80741-39-5	CC(C)(C)OC(=O)N[C@@H](CC1=CC(=C(C=C1)Cl)Cl)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 3, 17: 2, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	8075-78-3	CC(=O)O[C@H]1CC[C@@H]2[C@H]3CC[C@]4([C@H]([C@@H]3CCC2=C1)CC[C@]4(C#C)OC(=O)C)C.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O	{1: 4, 9: 2, 10: 2, 11: 14, 12: 8, 13: 4, 14: 4, 15: 1, 20: 1, 21: 1, 28: 2}
Did not match all atoms present	80751-85-5	CC1=CC=CC(=C1)C2CN(CCC3=C(C(=C(C=C23)O)O)Cl)C.Br	{1: 2, 33: 1, 11: 3, 12: 1, 14: 5, 17: 1, 18: 1, 21: 2}
Did not match all atoms present	80756-85-0	CON=C(C1=CSC(=N1)N)C(=O)SC2=NC3=CC=CC=C3S2	{1: 1, 34: 1, 35: 2, 7: 1, 40: 1, 41: 2, 14: 5, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	8077-30-3	S.[S-2].[Ba+2]	{}
Did not match all atoms present	80789-69-1	C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)O	{27: 1, 17: 1, 11: 4, 13: 1, 14: 4}
Did not match all atoms present	80789-75-9	CC1=CC=C(C=C1)C2(CCCC2)C(=O)O	{27: 1, 1: 1, 11: 4, 13: 1, 14: 4}
Did not match all atoms present	808-24-2	CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](CC4)OC(=O)C6=CN=CC=C6	{1: 2, 35: 1, 33: 1, 11: 5, 12: 4, 13: 1, 14: 6, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	80811-66-1	C1=CC=C2C3C4C5=CC=CC=C5C(C(C2=C1)C6=C3C=NC=C6)C7=C4C=NC=C7	{35: 2, 12: 4, 14: 14}
Did not match all atoms present	80813-42-9	CC(C)(CO[Si](C)(C)C)CCl	{1: 5, 2: 2, 4: 1, 22: 1, 17: 1}
Did not match all atoms present	80822-73-7	CC1=CC(=C(C=C1Cl)N/N=C/2\C=C(C(=O)C3=CC=CC=C32)C(=O)[O-])S(=O)(=O)[O-].[Sr+2]	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	80830-39-3	COC1=C(C=CC(=C1)N)N=NC2=CC=CC=C2	{1: 1, 30: 1, 34: 2, 22: 1, 14: 8}
Did not match all atoms present	80832-54-8	CCOC1=CC(=C(C=C1)O)C=O	{1: 1, 2: 1, 14: 3, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	80836-96-0	CC1=C(C(=CC=C1)N2CCNCC2)C.Cl	{32: 1, 1: 2, 33: 1, 11: 4, 14: 3, 17: 1}
Did not match all atoms present	80841-48-1	CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)NC)N=C12)NC4=C(C=C(C=C4)NS(=O)(=O)C)OC.C(CS(=O)(=O)O)O	{1: 4, 2: 2, 35: 1, 14: 9, 20: 2, 22: 1, 24: 1, 29: 4, 31: 3}
Did not match all atoms present	80843-78-3	CC1=CC(=CC=C1)OC2=CC=CC(=C2)COCC(C)(C)C3=CC=C(C=C3)Cl	{1: 3, 2: 2, 4: 1, 14: 12, 17: 1, 22: 2}
Did not match all atoms present	80844-07-1	CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3	{1: 3, 2: 3, 4: 1, 22: 3, 14: 13}
Did not match all atoms present	80866-75-7	CC1=C(C=CC(=C1)CO)[N+](=O)[O-]	{1: 1, 2: 1, 20: 1, 38: 1, 14: 3}
Did not match all atoms present	80866-76-8	CC1=C(C(=CC=C1)CO)[N+](=O)[O-]	{1: 1, 2: 1, 20: 1, 38: 1, 14: 3}
Did not match all atoms present	80866-80-4	C1=CC(=C(C=C1[N+](=O)[O-])CO)Cl	{17: 1, 2: 1, 20: 1, 38: 1, 14: 3}
Did not match all atoms present	80866-81-5	C1CC1(CO)C2=CC=C(C=C2)Cl	{2: 1, 11: 2, 13: 1, 14: 4, 17: 1, 20: 1}
Did not match all atoms present	80866-82-6	COC1=C(C=C(C=C1)Br)CO	{1: 1, 2: 1, 14: 3, 18: 1, 20: 1, 22: 1}
Did not match all atoms present	80866-83-7	CCCC(=O)OCC(C)C1=CC=CC=C1	{1: 2, 2: 3, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	80866-87-1	COC(C#N)(C1=CC=CC=C1)C(F)(F)F	{1: 1, 4: 2, 37: 1, 14: 5, 16: 3, 22: 1}
Did not match all atoms present	80866-95-1	C1=CN(C=C1)CC2=CN=CC=C2	{33: 1, 2: 1, 35: 1, 14: 8}
Did not match all atoms present	80867-26-1	O.O.[O-]S(=O)(=O)[O-].[Zn+2]	{29: 4}
Did not match all atoms present	80879-80-7	C1=CC2=CC=C3C4=CC=C5C=CC6=C5C4=C(C=C6)C7=C3C2=C1C=C7	{14: 12}
Did not match all atoms present	80887-50-9	CCCCCCCCCCCCC1=CC=NC=C1.Br	{1: 1, 2: 11, 35: 1, 18: 1, 14: 4}
Did not match all atoms present	80890-42-2	CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N)S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 6, 35: 1, 33: 1, 41: 1, 14: 6, 20: 4, 29: 2, 30: 1}
Did not match all atoms present	80940-33-6	C=CC(=O)OCCCCCOC(=O)C=C.C1=CC=C2C(=C1)C(=O)OC2=O	{2: 5, 14: 4, 28: 4, 5: 2, 6: 2}
Did not match all atoms present	80958-26-5	C[Si](C)(C)C#CC#N	{1: 3, 10: 2, 37: 1}
Did not match all atoms present	80958-27-6	C[Ge](C)(C)C#CC#N	{1: 3, 10: 2, 37: 1}
Did not match all atoms present	80992-91-2	CC(=O)/C=C/C1=CC(=CC=C1)I	{24: 1, 1: 1, 19: 1, 14: 4, 6: 2}
Did not match all atoms present	80992-92-3	CC(=O)/C=C/C1=CC(=CC=C1)C(F)(F)F	{1: 1, 4: 1, 6: 2, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	81-03-8	CC1=CC2=C(C=C1)C(CC2(C)C)(C)C	{1: 5, 11: 1, 13: 2, 14: 3}
Did not match all atoms present	81-04-9	C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O	{20: 2, 29: 4, 14: 6}
Did not match all atoms present	81-06-1	C1=CC=C2C(=C1)C=CC(=C2N)S(=O)(=O)O	{30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	81-07-2	C1=CC=C2C(=C1)C(=O)NS2(=O)=O	{32: 1, 25: 1, 29: 2, 14: 4}
Did not match all atoms present	81-08-3	C1=CC=C2C(=C1)C(=O)OS2(=O)=O	{28: 1, 29: 2, 14: 4}
Did not match all atoms present	81-10-7	CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2N	{1: 1, 2: 1, 33: 1, 14: 9, 29: 2, 30: 1}
Did not match all atoms present	81-11-8	C1=CC(=C(C=C1N)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N)S(=O)(=O)O	{30: 2, 20: 2, 14: 6, 6: 2, 29: 4}
Did not match all atoms present	81-12-9	COC1=CC=C(C=C1)C(O)S(=O)(=O)O	{1: 1, 3: 1, 14: 4, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	81-14-1	CC1=C(C(=C(C(=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])C)C(=O)C	{24: 1, 1: 6, 4: 1, 38: 2}
Did not match all atoms present	81-15-2	CC1=C(C(=C(C(=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])C)[N+](=O)[O-]	{1: 5, 4: 1, 38: 3}
Did not match all atoms present	81-16-3	C1=CC=C2C(=C1)C=CC(=C2S(=O)(=O)O)N	{30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	81-19-6	C1=CC(=C(C(=C1)Cl)C(Cl)Cl)Cl	{17: 4, 3: 1, 14: 3}
Did not match all atoms present	81-20-9	CC1=C(C(=CC=C1)C)[N+](=O)[O-]	{1: 2, 38: 1, 14: 3}
Did not match all atoms present	81-24-3	C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C	{1: 3, 2: 4, 3: 1, 11: 7, 12: 8, 13: 2, 20: 4, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	81-26-5	CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)C4=C(C=CC5=C4C(=O)C6=CC=CC=C6C5=O)C	{1: 2, 14: 12, 25: 4}
Did not match all atoms present	81-30-1	C1=CC2=C3C(=CC=C4C3=C1C(=O)OC4=O)C(=O)OC2=O	{28: 4, 14: 4}
Did not match all atoms present	81-31-2	C1C2=CC=CC=C2C3=C4C1=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C9=CC=CC=C9C8	{11: 2, 14: 16}
Did not match all atoms present	81-32-3	C1=CC(=C2C(=CC=C3C2=C1C4=C5C3=CC=C(C5=C(C=C4)C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 14: 8}
Did not match all atoms present	81-37-8	CC1=CC2=C(C=C1)OC3=CC=C(C4=CC5=CC=CC=C5C2=C34)C	{1: 2, 14: 10, 23: 1}
Did not match all atoms present	81-41-4	C1=CC=C2C(=C1)C(=O)C3=C(C(=C(C(=C3C2=O)N)C#N)C#N)N	{25: 2, 30: 2, 14: 4, 37: 2}
Did not match all atoms present	81-44-7	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Br)C(=O)C4=CC=CC=C4C3=O	{24: 1, 25: 2, 18: 1, 14: 11, 31: 1}
Did not match all atoms present	81-45-8	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Cl)C(=O)C4=CC=CC=C4C3=O	{24: 1, 17: 1, 31: 1, 14: 11, 25: 2}
Did not match all atoms present	81-46-9	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O	{24: 1, 25: 2, 30: 1, 14: 11, 31: 1}
Did not match all atoms present	81-48-1	CC1=CC=C(C=C1)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O	{1: 1, 31: 1, 21: 1, 14: 10, 25: 2}
Did not match all atoms present	81-49-2	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3Br)Br)N	{25: 2, 18: 2, 30: 1, 14: 5}
Did not match all atoms present	81-50-5	CC1=CC(=C2C(=C1N)C(=O)C3=CC=CC=C3C2=O)Br	{1: 1, 18: 1, 30: 1, 14: 5, 25: 2}
Did not match all atoms present	81-51-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)O)N	{25: 2, 30: 1, 21: 2, 14: 5}
Did not match all atoms present	81-53-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)Cl)O	{17: 1, 21: 2, 14: 5, 25: 2}
Did not match all atoms present	81-54-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)O)O	{25: 2, 21: 3, 14: 5}
Did not match all atoms present	81-55-0	C1=CC(=C2C(=C1[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)O)[N+](=O)[O-])O	{25: 2, 38: 2, 21: 2, 14: 4}
Did not match all atoms present	81-58-3	C1=CC(=C2C(=C1Cl)C(=O)C3=C(C=CC(=C3C2=O)Cl)Cl)Cl	{17: 4, 14: 4, 25: 2}
Did not match all atoms present	81-59-4	C1CC(=O)C2=C(C3=C(C=CC(=C3C(=C2C1=O)O)O)O)O	{25: 2, 11: 2, 21: 4, 14: 2}
Did not match all atoms present	81-60-7	C1=CC(=C2C(=C1O)C(=O)C3=C(C=CC(=C3C2=O)O)O)O	{25: 2, 21: 4, 14: 4}
Did not match all atoms present	81-61-8	C1=CC(=C(C2=C1C(=O)C3=C(C=CC(=C3C2=O)O)O)O)O	{25: 2, 21: 4, 14: 4}
Did not match all atoms present	81-63-0	C1CC(=C2C(=C1N)C(=O)C3=CC=CC=C3C2=O)N	{25: 2, 11: 2, 30: 2, 14: 4, 15: 4}
Did not match all atoms present	81-64-1	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)O	{25: 2, 21: 2, 14: 6}
Did not match all atoms present	81-68-5	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OC	{1: 2, 14: 9, 22: 1, 25: 2, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	81-69-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)O)N	{14: 8, 20: 2, 25: 2, 29: 4, 30: 2, 31: 1}
Did not match all atoms present	81-71-0	CC1=CC(=C(C=C1C(C2=CC=CC=C2Cl)C3=CC(=C(C=C3C)N)C)C)N	{1: 4, 3: 1, 30: 2, 14: 8, 17: 1}
Did not match all atoms present	81-77-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3)NC5=C(N4)C=CC6=C5C(=O)C7=CC=CC=C7C6=O	{32: 2, 25: 4, 14: 12}
Did not match all atoms present	81-78-7	C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=CC=C5C(=O)O	{25: 2, 27: 2, 14: 14, 31: 2}
Did not match all atoms present	81-81-2	CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O	{1: 1, 2: 1, 3: 1, 14: 9, 21: 1, 24: 1, 28: 1}
Did not match all atoms present	81-82-3	CC(=O)CC(C1=CC=C(C=C1)Cl)C2=C(C3=CC=CC=C3OC2=O)O	{1: 1, 2: 1, 3: 1, 14: 8, 17: 1, 21: 1, 24: 1, 28: 1}
Did not match all atoms present	81-83-4	C1=CC2=C3C(=C1)C(=O)NC(=O)C3=CC=C2	{32: 1, 25: 2, 14: 6}
Did not match all atoms present	81-84-5	C1=CC2=C3C(=C1)C(=O)OC(=O)C3=CC=C2	{28: 2, 14: 6}
Did not match all atoms present	81-85-6	CN1C2=C3C(=CC1=O)C4=CC=CC=C4C(=O)C3=C(C=C2)Br	{1: 1, 18: 1, 33: 1, 14: 7, 25: 2}
Did not match all atoms present	81-88-9	CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)O.[Cl-]	{1: 4, 2: 4, 33: 2, 14: 10, 17: 1, 23: 1, 27: 1}
Did not match all atoms present	81-90-3	C1=CC=C(C(=C1)C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)C(=O)O	{27: 1, 3: 1, 21: 2, 14: 12}
Did not match all atoms present	81-92-5	C1=CC=C(C(=C1)CO)C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O	{2: 1, 3: 1, 20: 1, 21: 2, 14: 12}
Did not match all atoms present	81-93-6	C1=CC=C(C=C1)[N+]2=C3C=C(C=CC3=NC4=C2C=C(C=C4)N)N.[Cl-]	{17: 1, 35: 1, 30: 2, 14: 11, 33: 1}
Did not match all atoms present	81-95-8	C1=CC=C2C(=C1)C3=C4C(=C(C=C3)SC5=C6C=CC=C7C6=C(C=C5)C8=CC=CC=C8C7=O)C=CC=C4C2=O	{40: 1, 25: 2, 14: 18}
Did not match all atoms present	81-96-9	C1=CC=C2C(=C1)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O	{25: 1, 18: 1, 14: 9}
Did not match all atoms present	81-98-1	C1=CC2=C(C=CC3=C2C(=C1)C(=O)C4=C3C=CC(=C4)Br)Br	{25: 1, 18: 2, 14: 8}
Did not match all atoms present	81004-54-8	C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2N=CN4C3=NC=C4)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O	{33: 2, 2: 1, 35: 3, 11: 1, 12: 3, 14: 4, 20: 5, 22: 3, 23: 1, 29: 3}
Did not match all atoms present	81012-89-7	C1=CC=C2C(=C1)C=CC=C2OP(=O)(O)[O-].[Na+]	{20: 1, 22: 1, 14: 7, 29: 2}
Did not match all atoms present	81012-92-2	C1CC(=O)N(C1=O)OC(=O)COC2=CC3=CC=CC=C3C=C2	{33: 1, 2: 1, 11: 2, 14: 7, 22: 1, 25: 2, 28: 1}
Did not match all atoms present	81012-95-5	CC(=O)NC(C1=CC=C(C=C1)Cl)(C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl	{1: 1, 4: 2, 14: 8, 17: 5, 24: 1, 31: 1}
Did not match all atoms present	81025-03-8	C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]([C@@H](CO)O)[C@@H]([C@H](CO)O)O)O)O)O)O.O.O	{2: 3, 3: 4, 12: 5, 20: 9, 22: 1, 23: 1}
Did not match all atoms present	81025-04-9	C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]([C@@H](CO)O)[C@@H]([C@H](CO)O)O)O)O)O)O.O	{2: 3, 3: 4, 12: 5, 20: 9, 22: 1, 23: 1}
Did not match all atoms present	81028-03-7	C1=CC=C(C=C1)COCC=CCO	{2: 3, 22: 1, 20: 1, 14: 5, 6: 2}
Did not match all atoms present	81028-92-4	C1=CC(=CC(=C1)OC2=CC(=CC(=C2)Cl)Cl)C=O	{17: 2, 26: 1, 22: 1, 14: 7}
Did not match all atoms present	81029-03-0	CC1=C(C=CC(=C1C)OC)[N+](=O)[O-]	{1: 3, 38: 1, 22: 1, 14: 2}
Did not match all atoms present	81029-06-3	O.O.O.O.O.O.O.O.O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Al]	{17: 3, 29: 12}
Did not match all atoms present	81038-44-0	COC1=C(C(=CC(=C1)CC#N)Br)O	{1: 1, 2: 1, 37: 1, 14: 2, 18: 1, 21: 1, 22: 1}
Did not match all atoms present	81044-78-2	C1=CC=C2C(=C1)SS2	{41: 2, 14: 4}
Did not match all atoms present	81044-79-3	CC1=CC2=C(C=C1)SS2	{1: 1, 14: 3, 41: 2}
Did not match all atoms present	81098-60-4	COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCOC3=CC=C(C=C3)F	{1: 2, 2: 3, 33: 1, 11: 3, 12: 2, 14: 6, 16: 1, 17: 1, 22: 3, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	811-49-4	[Li+].C[CH2-]	{1: 1, 5: 1}
Did not match all atoms present	811-54-1	C(=O)[O-].C(=O)[O-].[Pb+2]	{26: 2}
Did not match all atoms present	811-59-6	B(F)(F)F.C[N]C	{16: 3, 1: 2, 34: 1}
Did not match all atoms present	811-62-1	CP(C)Cl	{1: 2, 17: 1}
Did not match all atoms present	811-70-1	C[Ge](C)(F)F	{16: 2, 1: 2}
Did not match all atoms present	811-73-4	C[Sn](C)(C)I	{1: 3, 19: 1}
Did not match all atoms present	811-92-7	C[N+](C)(C)C.COS(=O)(=O)[O-]	{1: 5, 29: 3, 22: 1}
Did not match all atoms present	811-98-3	[2H]C([2H])([2H])O[2H]	{1: 1, 20: 1}
Did not match all atoms present	81112-09-6	CC(C(=O)C1=CC=C(C=C1)F)Cl	{1: 1, 3: 1, 14: 4, 16: 1, 17: 1, 24: 1}
Did not match all atoms present	81131-70-6	CCC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)[O-])O)O)O.[Na+]	{1: 3, 2: 5, 3: 3, 11: 1, 12: 5, 14: 3, 15: 1, 20: 3, 24: 1, 28: 1}
Did not match all atoms present	81156-68-5	C1=CC(=C(C=C1Cl)Cl)CCO	{17: 2, 2: 2, 20: 1, 14: 3}
Did not match all atoms present	81172-89-6	CCOC(C1=CC=C(C=C1)C=O)OCC	{1: 2, 2: 2, 3: 1, 14: 4, 22: 2, 26: 1}
Did not match all atoms present	81177-91-5	COC(=C)[Sn](C(=C)OC)(C(=C)OC)C(=C)OC	{1: 4, 5: 4, 22: 4, 7: 4}
Did not match all atoms present	81189-61-9	CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)OC(=O)OCC2=CC=CC=C2Br)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 14: 8, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	81190-38-7	C[N+](C)(CCCN(CC(CS(=O)(=O)[O-])O)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCO.[OH-].[Na+]	{1: 2, 2: 7, 3: 1, 4: 6, 33: 1, 16: 13, 20: 2, 29: 5}
Did not match all atoms present	812-00-0	COP(=O)(O)O	{1: 1, 20: 2, 29: 1, 22: 1}
Did not match all atoms present	812-01-1	COS(=O)(=O)Cl	{1: 1, 29: 2, 22: 1, 17: 1}
Did not match all atoms present	812-14-6	CN(C)[Si](F)(F)F	{16: 3, 1: 2, 33: 1}
Did not match all atoms present	812-53-3	C[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)C	{1: 14}
Did not match all atoms present	812-94-2	CN(CCCCO)S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 4, 4: 4, 33: 1, 16: 9, 20: 1, 29: 2}
Did not match all atoms present	81200-77-3	C1C=C[SiH2]C=C1	{11: 1, 14: 4}
Did not match all atoms present	81226-60-0	C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CC3=CNC4=CC=CC=C43	{32: 1, 33: 1, 2: 1, 11: 4, 13: 1, 14: 9, 17: 1, 20: 1}
Did not match all atoms present	81228-09-3	C1=CC(=C(C=C1F)F)CC(=O)O	{16: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	81241-99-8	CC1(C2=CC=CC=C2N([C@]1(/C=N/N(C)C3=CC=C(C=C3)OC)O)C)C	{1: 5, 34: 1, 6: 1, 33: 2, 13: 2, 14: 8, 20: 1, 22: 1}
Did not match all atoms present	81265-54-5	CC(C1=CC=C(C=C1)N2C=C3C=CC=CC3=N2)C(=O)O	{1: 1, 3: 1, 33: 1, 14: 9, 35: 1, 27: 1}
Did not match all atoms present	81269-09-2	C1=CC=C(C=C1)CSC(C2=CC=C(C=C2)C(Cl)(Cl)Cl)SCC3=CC=CC=C3	{2: 2, 3: 1, 4: 1, 40: 2, 14: 14, 17: 3}
Did not match all atoms present	81276-56-4	CN(C)C(P(=O)(O)O)P(=O)(O)[O-].[NH4+]	{1: 2, 3: 1, 20: 3, 29: 3, 33: 1}
Did not match all atoms present	81290-20-2	C[Si](C)(C)C(F)(F)F	{16: 3, 1: 3, 4: 1}
Did not match all atoms present	813-19-4	CCCC[Sn](CCCC)CCCC.CCCC[Sn](CCCC)CCCC	{1: 6, 2: 18}
Did not match all atoms present	813-56-9	[2H]C([2H])(C(=O)O[2H])C(=O)O[2H]	{2: 1, 27: 2}
Did not match all atoms present	813-76-3	CCP(=O)(CC)O	{1: 2, 2: 2, 20: 1, 29: 1}
Did not match all atoms present	813-77-4	COP(=O)(OC)Cl	{1: 2, 29: 1, 22: 2, 17: 1}
Did not match all atoms present	813-78-5	COP(=O)(O)OC	{1: 2, 20: 1, 29: 1, 22: 2}
Did not match all atoms present	813-93-4	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Bi+3]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	813-94-5	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ca+2].[Ca+2].[Ca+2]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	81323-72-0	O[Si](Cl)(Cl)Cl	{17: 3, 20: 1}
Did not match all atoms present	81334-34-1	CC(C)C1(C(=O)NC(=N1)C2=C(C=CC=N2)C(=O)O)C	{32: 1, 1: 3, 3: 1, 13: 1, 14: 3, 15: 1, 35: 2, 25: 1, 27: 1}
Did not match all atoms present	81335-37-7	CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C	{32: 1, 1: 3, 3: 1, 13: 1, 14: 5, 15: 1, 35: 2, 25: 1, 27: 1}
Did not match all atoms present	81335-77-5	CCC1=CN=C(C(=C1)C(=O)O)C2=NC(C(=O)N2)(C)C(C)C	{32: 1, 1: 4, 2: 1, 3: 1, 13: 1, 14: 2, 15: 1, 35: 2, 25: 1, 27: 1}
Did not match all atoms present	81356-60-7	C1CC1NC(=O)NC2=C(C=CC(=C2)F)F	{11: 2, 12: 1, 14: 3, 16: 2, 24: 1, 31: 2}
Did not match all atoms present	81367-71-7	CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)[C@H](C)CCC	{1: 3, 2: 7, 3: 1, 14: 12, 22: 1, 28: 1}
Did not match all atoms present	81377-14-2	C1=C(C2=NON=C2C(=C1)Cl)S(=O)(=O)[O-].[NH4+]	{17: 1, 35: 2, 29: 3, 14: 2, 23: 1}
Did not match all atoms present	81382-20-9	C1CO[Si]2(OCCN1CC(=O)O2)CCl	{33: 1, 2: 1, 11: 5, 17: 1, 23: 2, 28: 1}
Did not match all atoms present	81382-22-1	B12OCCN(CCO1)CC(=O)O2	{33: 1, 11: 5, 28: 1, 23: 2}
Did not match all atoms present	81382-23-2	B12OCCN(CC(=O)O1)CC(=O)O2	{33: 1, 11: 4, 28: 2, 23: 1}
Did not match all atoms present	81398-94-9	CCN1C(=O)C2=CC=CC3=C2C(=CC(=NNC4=CC=C(C=C4)C=CC5=CC=C(C=C5)NN=C6C=C7C8=C(C6=O)C=CC=C8C(=O)N(C7=O)CC)C3=O)C1=O	{1: 2, 2: 2, 6: 2, 33: 2, 34: 2, 14: 16, 25: 6, 31: 2}
Did not match all atoms present	814-29-9	CCCCP(=O)(CCCC)CCCC	{1: 3, 2: 9, 29: 1}
Did not match all atoms present	814-40-4	CCOS(=O)(=O)OC	{1: 2, 2: 1, 29: 2, 22: 2}
Did not match all atoms present	814-49-3	CCOP(=O)(OCC)Cl	{1: 2, 2: 2, 29: 1, 22: 2, 17: 1}
Did not match all atoms present	814-71-1	C(C(=O)[O-])S.C(C(=O)[O-])S.[Ca+2]	{24: 2, 2: 2, 39: 2}
Did not match all atoms present	814-80-2	CC(C(=O)[O-])O.CC(C(=O)[O-])O.[Ca+2]	{24: 2, 1: 2, 3: 2, 20: 2}
Did not match all atoms present	814-87-9	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Al+3].[Al+3]	{24: 6}
Did not match all atoms present	814-88-0	C(=O)(C(=O)O)O.[Cd]	{27: 2}
Did not match all atoms present	814-90-4	C(=O)(C(=O)[O-])[O-].[Cr+2]	{24: 2}
Did not match all atoms present	814-91-5	C(=O)(C(=O)[O-])[O-].[Cu+2]	{24: 2}
Did not match all atoms present	814-93-7	C(=O)(C(=O)[O-])[O-].[Pb+2]	{24: 2}
Did not match all atoms present	814-94-8	C(=O)(C(=O)[O-])[O-].[Sn+2]	{24: 2}
Did not match all atoms present	814-95-9	C(=O)(C(=O)[O-])[O-].[Sr+2]	{24: 2}
Did not match all atoms present	814-97-1	CN(C)P(F)F	{16: 2, 1: 2, 33: 1}
Did not match all atoms present	814-98-2	C[Si](=[Si](C)C)C	{1: 4}
Did not match all atoms present	81403-80-7	CN(CCCNC(=O)C1CCCO1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC	{1: 3, 2: 3, 35: 2, 33: 1, 11: 3, 12: 1, 14: 2, 22: 2, 23: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	81422-13-1	C[Al](N1C2C3CCCCC3C1NC4C5CCCCC5C(N4)NC6C7CCCCC7C(N6)NC8C9CCCCC9C(N8)N2)O[Si](C1=CC=CC=C1)(C1=CC=CC=C1)O[Si](C1=CC=CC=C1)(C1=CC=CC=C1)O[Al](C)N1C2C3CCCCC3C1NC1C3CCCCC3C(N1)NC1C3CCCCC3C(N1)NC1C3CCCCC3C(N1)N2	{32: 14, 1: 2, 33: 2, 11: 32, 12: 32, 14: 20, 22: 3}
Did not match all atoms present	81431-98-3	C1=CC=C(C(=C1)C#N)N=C=S	{8: 1, 34: 1, 37: 1, 14: 4}
Did not match all atoms present	81453-98-7	CC(=O)C1=CN(C=C1)S(=O)(=O)C2=CC=CC=C2	{24: 1, 1: 1, 29: 2, 14: 8, 33: 1}
Did not match all atoms present	81475-22-1	CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)C(C)(C)C)CC6=C(C(=CC(=C6)C(C)(C)C)C2)O)O)C(C)(C)C)C(C)(C)C)O	{1: 15, 11: 5, 4: 5, 21: 5, 14: 10}
Did not match all atoms present	81486-22-8	CC(C)NCC(COC1=CC=CC2=C1OCC(C2)O[N+](=O)[O-])O	{1: 2, 2: 2, 3: 2, 11: 2, 12: 1, 14: 3, 20: 1, 22: 2, 23: 1, 31: 1}
Did not match all atoms present	815-78-1	C(C(C(=O)[O-])O)(C(=O)[O-])O.C(C(C(=O)[O-])O)(C(=O)[O-])O.C(C(C(=O)[O-])O)(C(=O)[O-])O.[Al+3].[Al+3]	{24: 6, 3: 6, 20: 6}
Did not match all atoms present	815-79-2	[C@@H]([C@@H](C(=O)[O-])O)(C(=O)[O-])O.[Ca+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	815-82-7	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Cu+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	815-84-9	C(C(C(=O)[O-])O)(C(=O)[O-])O.[Pb+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	815-85-0	C(C(C(=O)[O-])O)(C(=O)[O-])O.[Sn+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	81506-10-7	CC1=CC(=C(C=C1)N2CCC2)C	{1: 2, 11: 3, 14: 3, 33: 1}
Did not match all atoms present	81506-11-8	CCC1=C(C(=CC=C1)CC)N2CCC2	{1: 2, 2: 2, 11: 3, 14: 3, 33: 1}
Did not match all atoms present	81506-12-9	CC1=CC(=C(C=C1)N2CCCC2)C	{1: 2, 11: 4, 14: 3, 33: 1}
Did not match all atoms present	81506-13-0	CCC1=C(C(=CC=C1)CC)N2CCCC2	{1: 2, 2: 2, 11: 4, 14: 3, 33: 1}
Did not match all atoms present	81506-14-1	CC1=CC(=C(C=C1)N2CCCCC2)C	{1: 2, 11: 5, 14: 3, 33: 1}
Did not match all atoms present	81506-15-2	CC1=C(C(=CC=C1)C)N2CCCCC2	{1: 2, 11: 5, 14: 3, 33: 1}
Did not match all atoms present	81506-16-3	CCC1=C(C(=CC=C1)CC)N(CC)CC	{1: 4, 2: 4, 14: 3, 33: 1}
Did not match all atoms present	81506-50-5	CCNCC.CS(=O)(=O)O	{1: 3, 2: 2, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	81506-60-7	CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCCO)CCO	{1: 3, 2: 7, 34: 2, 8: 2, 11: 3, 12: 1, 13: 2, 14: 4, 20: 2, 27: 2, 29: 2}
Did not match all atoms present	81525-10-2	C1=CC(=CC=C1C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)N=C(N)N	{34: 1, 36: 1, 7: 2, 14: 10, 28: 1, 30: 3}
Did not match all atoms present	81541-12-0	CC1=CC=C(C=C1)[C@H]2OC[C@@H]3[C@@H](O2)[C@@H](O[C@@H](O3)C4=CC=C(C=C4)C)[C@@H](CO)O	{1: 2, 2: 1, 3: 1, 11: 1, 12: 5, 14: 8, 20: 2, 23: 4}
Did not match all atoms present	81547-13-9	CNC1=NC2=C(C=NC3=CC=CC=C32)N=N1	{1: 1, 35: 4, 14: 5, 31: 1}
Did not match all atoms present	81547-14-0	CN(C)C1=NC2=C(C=NC3=CC=CC=C32)N=N1	{1: 2, 35: 4, 14: 5, 33: 1}
Did not match all atoms present	81565-18-6	C1=CN=C(C=C1C(F)(F)F)Cl	{16: 3, 17: 1, 35: 1, 4: 1, 14: 3}
Did not match all atoms present	81568-85-6	C1=CC=C(C(=C1)C(=S)N)I	{19: 1, 30: 1, 14: 4, 7: 1}
Did not match all atoms present	816-43-3	[Li+].CC[N-]CC	{1: 2, 2: 2, 34: 1}
Did not match all atoms present	816-80-8	CSP(SC)SC	{40: 3, 1: 3}
Did not match all atoms present	81603-44-3	CC1=CC=CC2=C1C(=CC=C2)C(C)C	{1: 3, 3: 1, 14: 6}
Did not match all atoms present	81603-78-3	CC(C)CCCCCCCOC(=O)CCCCC(=O)O.CC(CCO)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O	{1: 3, 2: 13, 3: 2, 14: 4, 20: 2, 27: 3, 28: 1}
Did not match all atoms present	81606-31-7	C1=C(SC(=C1Br)Br)S(=O)(=O)Cl	{17: 1, 18: 2, 29: 2, 14: 1, 41: 1}
Did not match all atoms present	81611-37-2	CCCCCCCCCC1=CC(=C(C=C1)S(=O)(=O)[O-])CCCCCCCCC.[NH4+]	{1: 2, 2: 16, 29: 3, 14: 3}
Did not match all atoms present	81611-38-3	CCCCCCCCCCC1=CC(=C(C=C1)S(=O)(=O)[O-])CCCCCCCCCC.[NH4+]	{1: 2, 2: 18, 29: 3, 14: 3}
Did not match all atoms present	81611-39-4	CCCCCCCCCCCCCC1=CC(=C(C=C1)S(=O)(=O)[O-])CCCCCCCCCCCCC.[NH4+]	{1: 2, 2: 24, 29: 3, 14: 3}
Did not match all atoms present	81611-40-7	CCCCCCCCCCCC1=CC(=C(C=C1)S(=O)(=O)[O-])CCCCCCCCCCC.[NH4+]	{1: 2, 2: 20, 29: 3, 14: 3}
Did not match all atoms present	81613-60-7	CC(C)(C)C1CCN(CC1)CC#CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.Cl	{1: 3, 2: 1, 4: 3, 33: 1, 10: 2, 11: 4, 12: 1, 14: 3, 16: 6, 17: 1}
Did not match all atoms present	81645-87-6	C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 2: 1, 35: 3, 38: 2, 40: 1, 14: 8}
Did not match all atoms present	81675-81-2	CC(C)(C)N=P(N(C)C)(N(C)C)N(C)C	{1: 9, 34: 1, 4: 1, 33: 3}
Did not match all atoms present	81686-10-4	C1=CN=C(N=C1N=[N+]=[N-])N=[N+]=[N-]	{34: 4, 35: 2, 14: 2}
Did not match all atoms present	817-87-8	CCOC(=O)N=[N+]=[N-]	{1: 1, 2: 1, 28: 1, 34: 2}
Did not match all atoms present	817-99-2	C(C(=O)N)N/C(=C\[N+]#N)/[O-]	{2: 1, 6: 1, 7: 1, 34: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	81729-37-5	CC(CN(C)CC(C)O[Si](C)(C)C)O[Si](C)(C)C	{1: 9, 2: 2, 3: 2, 22: 2, 33: 1}
Did not match all atoms present	81732-65-2	CC(C)(C)NCC(C1=CC(=CC(=C1)OC(=O)N(C)C)OC(=O)N(C)C)O	{1: 7, 2: 1, 3: 1, 4: 1, 33: 2, 14: 3, 20: 1, 28: 2, 31: 1}
Did not match all atoms present	81736-04-1	[OH-].[OH-].[OH-].[OH-].[Zn+3]	{}
Did not match all atoms present	81777-89-1	CC1(CON(C1=O)CC2=CC=CC=C2Cl)C	{1: 2, 2: 1, 33: 1, 11: 1, 13: 1, 14: 4, 17: 1, 23: 1, 25: 1}
Did not match all atoms present	81781-28-4	CC1C(C(CC(O1)OC23C4C(C5=C(C=C6C(=C5O2)C(=C7C(=O)C(CC(C7=C6OC)OC8CC(C(OC8)(C)OC(=O)C)(C)O)O)O)C)OC(C39CO9)(O4)C(OC)OC)O)(C(C)O)O	{1: 9, 3: 2, 11: 5, 12: 8, 13: 6, 14: 1, 20: 5, 21: 1, 22: 5, 23: 6, 25: 1, 28: 1}
Did not match all atoms present	81790-10-5	C[Si](C)(C)CC(=C)Br	{1: 3, 2: 1, 18: 1, 5: 1, 7: 1}
Did not match all atoms present	818-08-6	CCCC[Sn](=O)CCCC	{1: 2, 2: 6, 29: 1}
Did not match all atoms present	81840-15-5	COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)NC(=O)CC4)OC	{32: 1, 1: 2, 33: 2, 11: 6, 14: 6, 22: 2, 24: 1, 25: 1}
Did not match all atoms present	81849-60-7	C(=C(\O)/C(F)(F)F)\C(=O)C(F)(F)F.C(=C(\O)/C(F)(F)F)\C(=O)C(F)(F)F.O.O.[Yb]	{4: 4, 6: 2, 7: 2, 16: 12, 20: 2, 24: 2}
Did not match all atoms present	81852-50-8	CCC=C(C(=O)[O-])N=[N+]=[N-]	{1: 1, 2: 1, 6: 1, 7: 1, 34: 2, 24: 1}
Did not match all atoms present	81859-24-7	CCCCCCCCCCCCOS(=O)(=O)O.C(CO)NCCO.C(CO)O	{1: 1, 2: 17, 20: 5, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	81866-63-9	CC1=CC=C(C=C1)OCCN[NH3+].[Cl-]	{1: 1, 2: 2, 14: 4, 17: 1, 22: 1, 31: 1}
Did not match all atoms present	819-17-0	C(S(=O)(=O)[O-])S(=O)(=O)[O-].[Ca+2]	{2: 1, 29: 6}
Did not match all atoms present	819-19-2	CC(C)(C)PC(C)(C)C	{1: 6, 4: 2}
Did not match all atoms present	819-52-3	CCCOS(=O)(=O)Cl	{1: 1, 2: 2, 29: 2, 22: 1, 17: 1}
Did not match all atoms present	819-73-8	CCCC(=O)[O-].CCCC(=O)[O-].[Pb+2]	{24: 2, 1: 2, 2: 4}
Did not match all atoms present	81926-79-6	C1=CC=C(C=C1)[Se]I	{19: 1, 14: 5}
Did not match all atoms present	81927-55-1	C1=CC=C(C=C1)COC(=N)C(Cl)(Cl)Cl	{2: 1, 4: 1, 7: 1, 14: 5, 17: 3, 22: 1, 36: 1}
Did not match all atoms present	81994-68-5	CCCCNC1=CC2=C(C=C1)C(=O)N(C2=O)CCN(CC)CC.Cl	{1: 3, 2: 7, 33: 2, 14: 3, 17: 1, 25: 2, 31: 1}
Did not match all atoms present	81995-11-1	C1=CC=C(C=C1)P(=CC(=O)C2=CC=CC=C2O)(C3=CC=CC=C3)C4=CC=CC=C4	{24: 1, 14: 19, 6: 1, 21: 1}
Did not match all atoms present	82-02-0	CC1=CC(=O)C2=C(C3=C(C(=C2O1)OC)OC=C3)OC	{1: 3, 25: 1, 22: 2, 14: 3, 23: 2}
Did not match all atoms present	82-05-3	C1=CC=C2C(=C1)C3=CC=CC4=C3C(=CC=C4)C2=O	{25: 1, 14: 10}
Did not match all atoms present	82-08-6	CC1=C(C(=C(C(=C1O)C(=O)C)O)CC2=C(C3=C(C(=C2O)C(=O)/C=C/C4=CC=CC=C4)OC(C=C3)(C)C)O)O	{1: 4, 2: 1, 6: 2, 13: 1, 14: 7, 21: 5, 23: 1, 24: 2}
Did not match all atoms present	82-12-2	C1=C2C(=C(C(=C1O)O)O)C(=O)C3=CC(=C(C(=C3C2=O)O)O)O	{25: 2, 21: 6, 14: 2}
Did not match all atoms present	82-17-7	C1=CC=C(C=C1)OC2=CC=CC3=C2C(=O)C4=C(C3=O)C=CC=C4OC5=CC=CC=C5	{25: 2, 22: 2, 14: 16}
Did not match all atoms present	82-18-8	C1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=CC=C5	{24: 2, 25: 2, 14: 16, 31: 2}
Did not match all atoms present	82-20-2	CC1=CC=C(C=C1)NC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)NC5=CC=C(C=C5)C	{1: 2, 31: 2, 14: 14, 25: 2}
Did not match all atoms present	82-21-3	C1=CC=C(C=C1)OC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)OC5=CC=CC=C5	{25: 2, 22: 2, 14: 16}
Did not match all atoms present	82-22-4	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O	{25: 4, 14: 14, 31: 1}
Did not match all atoms present	82-24-6	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)O)N	{25: 2, 27: 1, 30: 1, 14: 6}
Did not match all atoms present	82-27-9	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)N)Cl	{17: 1, 30: 1, 14: 6, 25: 2}
Did not match all atoms present	82-28-0	CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)N	{1: 1, 30: 1, 14: 6, 25: 2}
Did not match all atoms present	82-29-1	C1=CC2=C(C=C1O)C(=O)C3=C(C2=O)C(=C(C=C3)O)O	{25: 2, 21: 3, 14: 5}
Did not match all atoms present	82-31-5	C1=CC=C(C=C1)NC2=C3C(=C(C=C2)NC4=CC=C(C=C4)O)C=CC=C3S(=O)(=O)O	{31: 2, 20: 1, 21: 1, 14: 14, 29: 2}
Did not match all atoms present	82-33-7	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)N)N	{25: 2, 38: 1, 30: 2, 14: 5}
Did not match all atoms present	82-34-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]	{25: 2, 38: 1, 14: 7}
Did not match all atoms present	82-35-9	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]	{25: 2, 38: 2, 14: 6}
Did not match all atoms present	82-36-0	CC(=O)NC1=CC=CC2=C1C(=O)C3=C(C2=O)C=CC=C3NC(=O)C	{24: 2, 1: 2, 31: 2, 14: 6, 25: 2}
Did not match all atoms present	82-38-2	CNC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O	{1: 1, 31: 1, 14: 7, 25: 2}
Did not match all atoms present	82-39-3	COC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O	{1: 1, 22: 1, 14: 7, 25: 2}
Did not match all atoms present	82-40-6	CC(C)[C@H]1CC2=C(O1)N(C3=C(C2=O)C=CC=C3OC)C	{1: 4, 3: 1, 33: 1, 11: 1, 12: 1, 14: 3, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	82-42-8	C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)Cl)O	{17: 1, 21: 1, 14: 6, 25: 2}
Did not match all atoms present	82-43-9	C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C=CC=C3Cl	{17: 2, 14: 6, 25: 2}
Did not match all atoms present	82-44-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl	{17: 1, 14: 7, 25: 2}
Did not match all atoms present	82-45-1	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)N	{25: 2, 30: 1, 14: 7}
Did not match all atoms present	82-46-2	C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C(=CC=C3)Cl	{17: 2, 14: 6, 25: 2}
Did not match all atoms present	82-48-4	C1=CC2=C(C(=C1)S(=O)(=O)O)C(=O)C3=C(C2=O)C=CC=C3S(=O)(=O)O	{25: 2, 20: 2, 29: 4, 14: 6}
Did not match all atoms present	82-49-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)O	{25: 2, 20: 1, 29: 2, 14: 7}
Did not match all atoms present	82-50-8	C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)O	{25: 2, 38: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	82-57-5	CC1=CC(=O)C2=C(O1)C=C3C(=C2OC)C=CO3	{1: 2, 25: 1, 22: 1, 14: 4, 23: 2}
Did not match all atoms present	82-58-6	CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)O	{32: 1, 1: 1, 33: 1, 11: 2, 12: 2, 14: 5, 15: 1, 27: 1}
Did not match all atoms present	82-62-2	C1=C(C(=C(C(=C1Cl)Cl)[N+](=O)[O-])O)Cl	{17: 3, 38: 1, 21: 1, 14: 1}
Did not match all atoms present	82-65-5	C1=CC2=C3C(=C1)S(=O)(=O)NC3=C(C=C2S(=O)(=O)O)S(=O)(=O)O	{32: 1, 20: 2, 29: 6, 14: 4}
Did not match all atoms present	82-66-6	C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)C3C(=O)C4=CC=CC=C4C3=O	{24: 1, 25: 2, 3: 1, 12: 1, 14: 14}
Did not match all atoms present	82-68-8	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[N+](=O)[O-]	{17: 5, 38: 1}
Did not match all atoms present	82-71-3	C1=C(C(=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])O)[N+](=O)[O-]	{38: 3, 21: 2, 14: 1}
Did not match all atoms present	82-75-7	C1=CC2=C(C(=C1)N)C(=CC=C2)S(=O)(=O)O	{30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	82-77-9	CC1=CC(=C(C(=C1)C(C)(C)C)C(=O)C)C	{24: 1, 1: 6, 4: 1, 14: 2}
Did not match all atoms present	82-86-0	C1=CC2=C3C(=C1)C(=O)C(=O)C3=CC=C2	{25: 2, 14: 6}
Did not match all atoms present	82-87-1	CC1=C(C=CC(=C1)C(C2=CC=CC=C2)C3=CC(=C(C=C3)N)C)N	{1: 2, 3: 1, 30: 2, 14: 11}
Did not match all atoms present	82-88-2	CN1CCC2=C(C1)C(C3=CC=CC=C23)C4=CC=CC=C4	{1: 1, 33: 1, 11: 3, 12: 1, 14: 9, 15: 2}
Did not match all atoms present	82-92-8	CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3	{11: 4, 1: 1, 3: 1, 14: 10, 33: 2}
Did not match all atoms present	82-93-9	CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl	{1: 1, 3: 1, 33: 2, 11: 4, 14: 9, 17: 1}
Did not match all atoms present	82-94-0	CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)[N+](C)(C)C.[Cl-].[Cl-]	{1: 7, 33: 2, 7: 1, 14: 12, 15: 2, 17: 2}
Did not match all atoms present	82-95-1	CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl	{1: 3, 2: 1, 3: 1, 4: 1, 33: 2, 11: 4, 14: 13, 17: 1}
Did not match all atoms present	82-98-4	CCN1CCCC(C1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 12: 1, 14: 10, 28: 1}
Did not match all atoms present	820-10-0	CS(=O)(=O)CCC(C(=O)O)N	{1: 1, 2: 2, 3: 1, 27: 1, 29: 2, 30: 1}
Did not match all atoms present	820-66-6	CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(=O)[O-]	{24: 1, 1: 3, 2: 18}
Did not match all atoms present	820-75-7	C(C(=O)NN)N/C(=C/[N+]#N)/[O-]	{2: 1, 6: 1, 7: 1, 34: 1, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	82001-48-7	C1=CC=C(C=C1)OCC(CNCCNCCN)O	{2: 6, 3: 1, 14: 5, 20: 1, 22: 1, 30: 1, 31: 2}
Did not match all atoms present	82027-08-5	CN(C)C1=CC=C(C=C1)N2CC2	{1: 2, 11: 2, 14: 4, 33: 2}
Did not match all atoms present	82049-30-7	C1=CC=C(C=C1)[S+]2C3=CC=CC=C3SC4=CC=CC=C42.F[P-](F)(F)(F)(F)F	{16: 6, 41: 1, 14: 13}
Did not match all atoms present	82065-00-7	CC(=[SnH2])C	{1: 2, 7: 1}
Did not match all atoms present	82066-57-7	[CH-]1C=CC=C1.[N-]=S=N[S-].[Co]	{40: 1, 34: 1, 14: 5}
Did not match all atoms present	82086-46-2	CC(C)N(C(C)C)P1N(CCO1)C	{11: 2, 1: 5, 3: 2, 33: 2, 23: 1}
Did not match all atoms present	82097-50-5	CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2OCCCl	{1: 2, 2: 2, 35: 3, 14: 4, 17: 1, 22: 2, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	82105-88-2	CCOC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{1: 1, 2: 2, 22: 1, 18: 1, 14: 19}
Did not match all atoms present	82113-65-3	C(F)(F)(F)S(=O)(=O)NS(=O)(=O)C(F)(F)F	{16: 6, 4: 2, 29: 4, 31: 1}
Did not match all atoms present	82146-18-7	CC(C)C1=CC(=C(C=C1)Cl)C(C)C	{1: 4, 3: 2, 14: 3, 17: 1}
Did not match all atoms present	82158-27-8	C1=CC=C(C=C1)C2=CC=C(C=C2)C(C3=CC4=CC=CC=C4O3)O	{3: 1, 20: 1, 14: 14, 23: 1}
Did not match all atoms present	82168-33-0	CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-].[K+]	{1: 1, 14: 9, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	82168-34-1	C=CC(=O)OCCOCCOC(=O)C1=CC=CC=C1C(=O)C2=CC=C(C=C2)Cl	{2: 4, 5: 1, 6: 1, 14: 8, 17: 1, 22: 1, 24: 1, 28: 2}
Did not match all atoms present	82177-75-1	C1=C(C=C(C(=C1[N+](=O)[O-])N2N=C(N=N2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 35: 3, 38: 4, 14: 2}
Did not match all atoms present	82185-41-9	C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2N	{2: 1, 28: 1, 30: 1, 14: 9}
Did not match all atoms present	82199-06-2	CC(=O)NC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)CCO	{1: 1, 2: 2, 14: 6, 20: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	82199-09-5	C1=CC(=CC(=C1)S(=O)(=O)CCOS(=O)(=O)O)NC(=O)C2=CC=C(C=C2)[N+]#N.C1=CC(=CC(=C1)S(=O)(=O)CCOS(=O)(=O)O)NC(=O)C2=CC=C(C=C2)[N+]#N.[O-]S(=O)(=O)[O-]	{2: 4, 34: 2, 14: 16, 20: 2, 22: 2, 24: 2, 29: 12, 31: 2}
Did not match all atoms present	82199-10-8	C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)N.OS(=O)(=O)O	{35: 1, 38: 1, 41: 1, 14: 3, 20: 2, 29: 2, 30: 1}
Did not match all atoms present	82199-13-1	C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)S(=O)(=O)[O-])C=C(/C(=N\NC4=C(C5=C(C=C4)C=C(C=C5)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])/C3=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{2: 2, 34: 1, 14: 13, 15: 2, 22: 1, 24: 1, 25: 1, 29: 14, 31: 2}
Did not match all atoms present	82199-14-2	CC(C)(CS(=O)(=O)O)NC(=O)C=C.C=CC(=O)N.C=CNC=O	{1: 2, 2: 1, 4: 1, 5: 3, 6: 3, 20: 1, 24: 2, 26: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	822-12-8	CCCCCCCCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 12}
Did not match all atoms present	822-16-2	CCCCCCCCCCCCCCCCCC(=O)[O-].[Na+]	{24: 1, 1: 1, 2: 16}
Did not match all atoms present	822-36-6	CC1=CN=CN1	{32: 1, 1: 1, 35: 1, 14: 2}
Did not match all atoms present	822-38-8	C1CSC(=S)S1	{41: 2, 11: 2, 15: 1}
Did not match all atoms present	822-39-9	C1COP(O1)Cl	{17: 1, 11: 2, 23: 2}
Did not match all atoms present	822-68-4	C1CCC(CC1)P	{11: 5, 12: 1}
Did not match all atoms present	822-84-4	C1=CSC=C1[N+](=O)[O-]	{41: 1, 38: 1, 14: 3}
Did not match all atoms present	82205-86-5	CCCCC(CC)COP(OCC(CC)CCCC)OCC(CC)CCCC.Br[Hg]Br	{1: 6, 2: 15, 3: 3, 18: 2, 22: 3}
Did not match all atoms present	82211-24-3	C1=CC=C(C=C1)C(C2=C(C=CC(=C2)Cl)NC(=O)C3=CC=NC=C3)O	{3: 1, 14: 12, 17: 1, 35: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	82219-81-6	CO/N=C(\C1=CSC(=N1)N)/C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CSC4=CN=NS4)C(=O)[O-].[Na+]	{1: 1, 2: 1, 35: 3, 33: 1, 7: 1, 40: 1, 41: 3, 11: 1, 12: 2, 34: 1, 14: 2, 15: 2, 22: 1, 24: 2, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	82230-89-5	C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Cu+2]	{24: 2, 33: 2, 2: 6, 27: 2}
Did not match all atoms present	82242-04-4	C1=CC(=CC=C1C(=O)O)OCCCCCCCCCCCCOC2=CC=C(C=C2)C(=O)O	{2: 12, 27: 2, 22: 2, 14: 8}
Did not match all atoms present	82278-73-7	CC(C)(C)OC(=O)N[C@@H](CC1=CC(=CC=C1)Br)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 18: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	82294-78-8	CC1CO1.CC1=CCC2CC1C2(C)C.C=O.C1=CC=C(C=C1)O	{1: 4, 5: 1, 11: 3, 12: 3, 13: 1, 14: 6, 15: 1, 21: 1, 23: 1}
Did not match all atoms present	82294-79-9	CC1=CCC2CC1C2(C)C.C=O.C1CO1.C1=CC=C(C=C1)O	{1: 3, 5: 1, 11: 4, 12: 2, 13: 1, 14: 6, 15: 1, 21: 1, 23: 1}
Did not match all atoms present	82294-80-2	CC1CO1.CC1=CCC2CC1C2(C)C.C=O.C1CO1.C1=CC=C(C=C1)O	{1: 4, 5: 1, 11: 5, 12: 3, 13: 1, 14: 6, 15: 1, 21: 1, 23: 2}
Did not match all atoms present	823-09-6	CSC1=NC=CC=N1	{40: 1, 1: 1, 35: 2, 14: 3}
Did not match all atoms present	823-40-5	CC1=C(C=CC=C1N)N	{1: 1, 30: 2, 14: 3}
Did not match all atoms present	823-78-9	C1=CC(=CC(=C1)Br)CBr	{2: 1, 18: 2, 14: 4}
Did not match all atoms present	823-82-5	C1=C(OC(=C1)C=O)C=O	{26: 2, 14: 2, 23: 1}
Did not match all atoms present	823-86-9	C1=CC(=CC=C1NO)Cl	{17: 1, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	823-87-0	C1=CC(=CC=C1N=O)[O-].[Na+]	{34: 1, 29: 1, 14: 4}
Did not match all atoms present	823-96-1	B1(OB(OB(O1)C)C)C	{1: 3, 23: 3}
Did not match all atoms present	82317-95-1	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC2=C(C(=C(C(=C2F)F)F)F)F)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CC6=NC=NC6)NC(=O)[C@@H]7CCC(=O)N7.CC(=O)O	{32: 2, 1: 3, 2: 10, 3: 8, 33: 1, 7: 1, 11: 6, 12: 2, 34: 1, 14: 10, 15: 1, 16: 5, 35: 2, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 8}
Did not match all atoms present	82317-96-2	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC2=CC=CC3=CC=CC=C32)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CC7=NC=NC7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 2, 1: 3, 2: 10, 3: 8, 33: 1, 7: 1, 11: 6, 12: 2, 34: 1, 14: 17, 15: 1, 35: 2, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 8}
Did not match all atoms present	82317-97-3	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC2=CC(=CC=C2)C(F)(F)F)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CC6=NC=NC6)NC(=O)[C@@H]7CCC(=O)N7.CC(=O)O	{32: 2, 1: 3, 2: 10, 3: 8, 4: 1, 33: 1, 7: 1, 11: 6, 12: 2, 34: 1, 14: 14, 15: 1, 16: 3, 35: 2, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 8}
Did not match all atoms present	82317-98-4	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC2=CC=C(C=C2)C(F)(F)F)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CC6=NC=NC6)NC(=O)[C@@H]7CCC(=O)N7.CC(=O)O	{32: 2, 1: 3, 2: 10, 3: 8, 4: 1, 33: 1, 7: 1, 11: 6, 12: 2, 34: 1, 14: 14, 15: 1, 16: 3, 35: 2, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 8}
Did not match all atoms present	82317-99-5	CC1=CC(=C(C(=C1)C)C[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)NCC(=O)N)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CC6=NC=NC6)NC(=O)[C@@H]7CCC(=O)N7)C.CC(=O)O	{32: 2, 1: 6, 2: 10, 3: 8, 33: 1, 7: 1, 11: 6, 12: 2, 34: 1, 14: 12, 15: 1, 35: 2, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 8}
Did not match all atoms present	82318-00-1	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC2=C(C3=CC=CC=C3C=C2)Br)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CC7=NC=NC7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 2, 1: 3, 2: 10, 3: 8, 33: 1, 7: 1, 11: 6, 12: 2, 34: 1, 14: 16, 15: 1, 18: 1, 35: 2, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 8}
Did not match all atoms present	82318-04-5	CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC2=C3C=CC=CC3=CC4=CC=CC=C42)NC(=O)[C@H](CC5=CC=C(C=C5)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC6=CNC7=CC=CC=C76)NC(=O)[C@H](CC8=CNC=N8)NC(=O)C9CCC(=O)N9.CC(=O)O	{32: 3, 1: 3, 2: 10, 3: 8, 36: 1, 33: 1, 7: 1, 11: 5, 12: 2, 14: 20, 35: 1, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 2, 31: 9}
Did not match all atoms present	82318-05-6	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)NC(=O)[C@@H](CC(C2CCCCC2)C3CCCCC3)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CC7=NC=NC7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 2, 1: 3, 2: 10, 3: 9, 33: 1, 7: 1, 11: 16, 12: 4, 34: 1, 14: 10, 15: 1, 35: 2, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 8}
Did not match all atoms present	82318-07-8	CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC3=CC=CC=C3C=C2)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CC7=NC=NC7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 2, 1: 4, 2: 10, 3: 8, 33: 1, 7: 1, 11: 6, 12: 2, 34: 1, 14: 17, 15: 1, 35: 2, 20: 1, 21: 1, 24: 9, 25: 1, 27: 1, 30: 2, 31: 8}
Did not match all atoms present	82318-08-9	CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N)N(C)C(=O)[C@@H](CC2=CC3=CC=CC=C3C=C2)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CC7=NC=NC7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 2, 1: 4, 2: 10, 3: 8, 33: 2, 7: 1, 11: 6, 12: 2, 34: 1, 14: 17, 15: 1, 35: 2, 20: 1, 21: 1, 24: 10, 25: 1, 27: 1, 30: 3, 31: 7}
Did not match all atoms present	82318-10-3	CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CC7=CN=CN7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 3, 1: 4, 2: 10, 3: 9, 33: 1, 7: 1, 11: 5, 12: 2, 34: 1, 14: 21, 35: 1, 20: 1, 21: 1, 24: 9, 25: 1, 27: 1, 30: 2, 31: 8}
Did not match all atoms present	82318-11-4	CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC3=CC=CC=C3C=C2)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CC=CC6=CC=CC=C65)NC(=O)[C@H](CC7=CN=CN7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 2, 1: 4, 2: 10, 3: 8, 33: 1, 7: 1, 11: 5, 12: 2, 34: 1, 14: 20, 35: 1, 20: 1, 21: 1, 24: 9, 25: 1, 27: 1, 30: 2, 31: 8}
Did not match all atoms present	82339-03-5	CCCCCCCCCC1=CC=C(C=C1)O.C=O.C1CO1.OP(=O)(O)O	{1: 1, 2: 8, 5: 1, 11: 2, 14: 4, 20: 3, 21: 1, 23: 1, 29: 1}
Did not match all atoms present	82339-04-6	CC(=C)C(=O)OCCCCCCOC(=O)C(=C)C.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 6, 5: 2, 7: 2, 14: 4, 28: 4}
Did not match all atoms present	82339-06-8	CC(=C)C(=O)OCCCCCOC(=O)C(=C)C.C1=CC=C2C(=C1)C(=O)OC2=O	{1: 2, 2: 5, 5: 2, 7: 2, 14: 4, 28: 4}
Did not match all atoms present	82339-07-9	CC(C)(CO)COC(=O)C1=CC=CC=C1.C1=CC=C2C(=C1)C(=O)OC2=O.C(C(CO)(CO)CO)O	{1: 2, 2: 6, 4: 2, 14: 9, 20: 5, 28: 3}
Did not match all atoms present	82356-80-7	CCCC[Si](C)(C)N[Si](C)(C)CCCC	{1: 6, 2: 6, 31: 1}
Did not match all atoms present	82358-09-6	C1=CSC(=S)N1	{32: 1, 41: 1, 14: 2}
Did not match all atoms present	82365-22-8	CC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N	{1: 1, 2: 3, 37: 1, 33: 1, 11: 3, 12: 1, 14: 6, 15: 1, 24: 1}
Did not match all atoms present	82365-25-1	CC(=O)N(CC1=CC=CC=C1)C2=C(CCCC2)CCC#N	{1: 1, 2: 3, 37: 1, 33: 1, 11: 4, 14: 5, 15: 2, 24: 1}
Did not match all atoms present	82375-04-0	CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CC2=CC3=CC=CC=C3C=C2)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CC7=NC=NC7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 2, 1: 5, 2: 10, 3: 8, 33: 2, 7: 1, 11: 6, 12: 2, 34: 1, 14: 17, 15: 1, 35: 2, 20: 1, 21: 1, 24: 9, 25: 1, 27: 1, 30: 2, 31: 7}
Did not match all atoms present	82386-89-8	C1=CC(=C(C=C1C(F)(F)F)C=O)Cl	{16: 3, 17: 1, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	82391-15-9	CC1=CC(=C(C=C1S(=O)(=O)O)OC)NC(=O)C(C(=O)C)N=NC2=CC(=C(C=C2OC)S(=O)(=O)CCOS(=O)(=O)O)OC	{1: 5, 2: 2, 3: 1, 34: 2, 14: 4, 20: 2, 22: 4, 24: 2, 29: 6, 31: 1}
Did not match all atoms present	824-11-3	CCC12COP(OC1)OC2	{1: 1, 2: 1, 11: 3, 13: 1, 23: 3}
Did not match all atoms present	824-22-6	CC1=CC=CC2=C1CCC2	{1: 1, 11: 3, 14: 3}
Did not match all atoms present	824-35-1	C1=CC=C(C(=C1)C(=O)[O-])O.C1=CC=C(C(=C1)C(=O)[O-])O.[Ca+2]	{24: 2, 21: 2, 14: 8}
Did not match all atoms present	824-39-5	C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]	{38: 1, 14: 4}
Did not match all atoms present	824-40-8	C1=CC=[N+](C(=C1)C(=O)O)[O-]	{33: 1, 27: 1, 29: 1, 14: 4}
Did not match all atoms present	824-42-0	CC1=CC=CC(=C1O)C=O	{1: 1, 26: 1, 21: 1, 14: 3}
Did not match all atoms present	824-45-3	CC1=CC(=C(C=C1)C)CCl	{1: 2, 2: 1, 14: 3, 17: 1}
Did not match all atoms present	824-46-4	COC1=C(C=CC(=C1)O)O	{1: 1, 22: 1, 21: 2, 14: 3}
Did not match all atoms present	824-47-5	CC(CCl)C1=CC=CC=C1	{1: 1, 2: 1, 3: 1, 14: 5, 17: 1}
Did not match all atoms present	824-55-5	CC1=CC(=C(C=C1)CCl)C	{1: 2, 2: 1, 14: 3, 17: 1}
Did not match all atoms present	824-63-5	CC1CC2=CC=CC=C2C1	{1: 1, 11: 2, 12: 1, 14: 4}
Did not match all atoms present	824-69-1	C1=C(C(=CC(=C1Cl)O)Cl)O	{17: 2, 21: 2, 14: 2}
Did not match all atoms present	824-72-6	C1=CC=C(C=C1)P(=O)(Cl)Cl	{17: 2, 29: 1, 14: 5}
Did not match all atoms present	824-75-9	C1=CC(=CC=C1C(=O)N)F	{16: 1, 24: 1, 30: 1, 14: 4}
Did not match all atoms present	824-78-2	C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+]	{38: 1, 14: 4}
Did not match all atoms present	824-79-3	CC1=CC=C(C=C1)S(=O)[O-].[Na+]	{1: 1, 29: 2, 14: 4}
Did not match all atoms present	824-94-2	COC1=CC=C(C=C1)CCl	{1: 1, 2: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	824-98-6	COC1=CC=CC(=C1)CCl	{1: 1, 2: 1, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	82410-32-0	C1=NC2=C(N1COC(CO)CO)NC(=NC2=O)N	{32: 1, 33: 1, 2: 3, 3: 1, 14: 1, 35: 2, 20: 2, 22: 1, 25: 1, 30: 1}
Did not match all atoms present	82419-26-9	C1=CC(=C(C(=C1[N+](=O)[O-])O)F)F	{16: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	82419-36-1	CC1COC2=C3N1C=C(C(=O)C3=CC(=C2N4CCN(CC4)C)F)C(=O)O	{1: 2, 33: 3, 11: 5, 12: 1, 14: 2, 16: 1, 23: 1, 25: 1, 27: 1}
Did not match all atoms present	82452-93-5	C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=C(C(=CC=C5)CC6=CC=CC(=C6O)CC7=CC=CC(=C7O)CC8=CC=CC(=C8O)CC9=CC=CC1=C9O)O)O)O)O	{11: 8, 21: 8, 14: 24}
Did not match all atoms present	82457-17-8	C1=CC=C(C(=C1)CCO)NC2=C3C(=C(C=C2)O)C(=O)C4=C(C=CC(=C4C3=O)[N+](=O)[O-])O	{2: 2, 38: 1, 14: 8, 20: 1, 21: 2, 25: 2, 31: 1}
Did not match all atoms present	82458-41-1	CC(=C1C(C2=CC=CC=C2N1C)(C)C)C	{1: 5, 33: 1, 7: 1, 13: 1, 14: 4, 15: 1}
Did not match all atoms present	82464-70-8	CCOC1=CC=CC=C1C(=O)N.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C)C.CN1C=NC2=C1C(=O)N(C(=O)N2C)C	{1: 8, 2: 1, 3: 1, 33: 5, 14: 10, 35: 1, 22: 1, 24: 1, 25: 3, 30: 1}
Did not match all atoms present	82469-75-8	CC1=NN(C(=O)[C-]1N=NC2=C(C=C(C=C2)S(=O)(=O)[O-])C(=O)[O-])C3=CC(=C(C=C3)S(=O)(=O)[O-])/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)N6CCOCC6)NC7=C(C=C(C=C7)/C=C/C8=C(C=C(C=C8)N9C(=O)[C-](C(=N9)C)N=NC1=CC=CC=C1C(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Cu+2].[Cu+2]	{1: 2, 34: 4, 35: 5, 6: 4, 33: 3, 11: 4, 14: 19, 23: 1, 24: 2, 25: 2, 29: 15, 31: 2}
Did not match all atoms present	82473-24-3	C[C@H](CCC(=O)NCCC[N+](C)(C)CC(CS(=O)(=O)[O-])O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C	{1: 5, 2: 7, 3: 2, 11: 7, 12: 8, 13: 2, 20: 4, 24: 1, 29: 3, 31: 1}
Did not match all atoms present	82476-12-8	COC1=NN=C(O1)C2=CC=C(C=C2)Cl	{1: 1, 35: 2, 14: 4, 17: 1, 22: 1, 23: 1}
Did not match all atoms present	82486-82-6	CCCCN(CCO[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 5, 38: 1, 22: 1, 33: 1}
Did not match all atoms present	82499-00-1	CCC1=C2C3=CC(=C(C=C3NC2=CN=C1C(=O)OC)OC)OC	{32: 1, 1: 4, 2: 1, 35: 1, 14: 3, 22: 2, 28: 1}
Did not match all atoms present	82499-43-2	[B-](F)(F)(F)F.C1C2C=CC1C=C2.C1=CC=C(C=C1)P(CCCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Rh]	{16: 4, 2: 4, 11: 1, 12: 2, 14: 24}
Did not match all atoms present	825-44-5	C1=CC=C2C(=C1)C=CS2(=O)=O	{29: 2, 14: 6}
Did not match all atoms present	825-52-5	C1=CC=C(C=C1)C(=NO)C#N	{34: 1, 20: 1, 37: 1, 14: 5, 7: 1}
Did not match all atoms present	825-54-7	C1CC=C(C1)C2=CC=CC=C2	{11: 3, 14: 6, 15: 1}
Did not match all atoms present	825-55-8	C1=CC=C(C=C1)C2=CC=CS2	{41: 1, 14: 8}
Did not match all atoms present	825-83-2	C1=CC(=CC=C1C(F)(F)F)S	{16: 3, 4: 1, 14: 4, 39: 1}
Did not match all atoms present	825-92-3	C[Si](C)(C1=CC=C(C=C1)Cl)Cl	{1: 2, 14: 4, 17: 2}
Did not match all atoms present	825-94-5	C1=CC(=CC=C1[Si](Cl)(Cl)Cl)Cl	{17: 4, 14: 4}
Did not match all atoms present	82505-06-4	[2H]C([2H])([2H])SC(=O)C1=CC=C(C=C1)C(C)(C)C	{24: 1, 1: 4, 4: 1, 14: 4, 40: 1}
Did not match all atoms present	82517-12-2	CC1=CC(=CC2=C1C(=O)C(=CO2)C3=CC=CC=C3)OC	{1: 2, 25: 1, 22: 1, 14: 8, 23: 1}
Did not match all atoms present	82540-41-8	C1=C(C=C(C(=C1Cl)N)Cl)C(C(=O)O)O	{3: 1, 14: 2, 17: 2, 20: 1, 27: 1, 30: 1}
Did not match all atoms present	82547-81-7	CC1=NN(N=N1)CC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)OCOC(=O)C(C)(C)C	{1: 5, 2: 2, 35: 4, 4: 1, 33: 2, 7: 1, 41: 2, 11: 1, 12: 2, 34: 1, 14: 1, 15: 2, 22: 1, 24: 1, 25: 1, 28: 2, 30: 1, 31: 1}
Did not match all atoms present	82558-50-7	CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC	{1: 5, 2: 2, 35: 1, 4: 1, 14: 4, 22: 2, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	82560-12-1	CC(C)(C)C1=CC(=NN1)N	{32: 1, 1: 3, 35: 1, 4: 1, 14: 1, 30: 1}
Did not match all atoms present	82560-54-1	CCOC(=O)CCN(C(C)C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C	{1: 6, 2: 3, 3: 1, 33: 2, 40: 1, 11: 1, 13: 1, 14: 3, 23: 1, 28: 2}
Did not match all atoms present	82563-94-8	C(=O)C=S	{26: 1, 6: 1}
Did not match all atoms present	82586-52-5	CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3=CC(=C(C=C3C[C@H]2C(=O)O)OC)OC.Cl	{1: 4, 2: 3, 3: 2, 33: 1, 11: 2, 12: 1, 14: 7, 17: 1, 22: 2, 24: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	82599-58-4	CC1=NN(C(=O)C1N=NC2=C(C(=CC(=C2)N)N=NC3=CC=C(C=C3)NC4=C(C=C(C=C4)[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-])C5=CC=C(C=C5)S(=O)(=O)O	{1: 1, 34: 4, 35: 1, 38: 2, 33: 1, 12: 1, 14: 13, 15: 1, 20: 2, 25: 1, 29: 4, 30: 1, 31: 1}
Did not match all atoms present	82599-59-5	C1=CC(=CC=C1N/N=C/2\C(=CC3=C(C2=O)C=C(C=C3)N/N=C\4/C=CC(=O)/C(=N\NC5=CC(=CC(=C5O)[N+](=O)[O-])S(=O)(=O)O)/C4=O)S(=O)(=O)O)[N+](=O)[O-]	{34: 3, 38: 2, 14: 12, 15: 2, 20: 2, 21: 1, 25: 3, 29: 4, 31: 3}
Did not match all atoms present	826-73-3	C1CCC(=O)C2=CC=CC=C2C1	{25: 1, 11: 4, 14: 4}
Did not match all atoms present	826-74-4	C=CC1=CC=CC2=CC=CC=C21	{14: 7, 5: 1, 6: 1}
Did not match all atoms present	826-77-7	CC1=CC2=C(C=CN=C2C=C1)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	826-81-3	CC1=NC2=C(C=CC=C2O)C=C1	{1: 1, 35: 1, 21: 1, 14: 5}
Did not match all atoms present	82608-88-6	CC1=C(C=CC(=C1)Cl)N=S=O	{1: 1, 34: 1, 40: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	82608-90-0	CC1=C(C=CC=C1Cl)N=S=O	{1: 1, 34: 1, 40: 1, 14: 3, 17: 1, 29: 1}
Did not match all atoms present	82626-48-0	CC1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CC(=O)N(C)C	{1: 4, 2: 1, 35: 1, 33: 2, 14: 7, 24: 1}
Did not match all atoms present	82640-07-1	COC1=C(C=C(C=C1)S(=O)(=O)[O-])N.C1=CC(=CC(=C1)O)[O-].C1=CC(=C(C=C1N)N)[N+](=O)[O-].[Na+].[Na+].[Cu]	{1: 1, 38: 1, 14: 10, 21: 1, 22: 1, 29: 3, 30: 3}
Did not match all atoms present	82657-04-3	CC1=C(C=CC=C1COC(=O)C2C(C2(C)C)C=C(C(F)(F)F)Cl)C3=CC=CC=C3	{1: 3, 2: 1, 4: 1, 6: 1, 7: 1, 12: 2, 13: 1, 14: 8, 16: 3, 17: 1, 28: 1}
Did not match all atoms present	82671-02-1	C1=C(C(=NC(=C1F)Cl)Cl)C#N	{16: 1, 17: 2, 35: 1, 37: 1, 14: 1}
Did not match all atoms present	82671-06-5	C1=C(C(=NC(=C1F)Cl)Cl)C(=O)O	{16: 1, 17: 2, 27: 1, 14: 1, 35: 1}
Did not match all atoms present	82692-44-2	CC1=CC=C(C=C1)C(=O)COC2=C(C(=NN2C)C)C(=O)C3=C(C(=C(C=C3)Cl)C)Cl	{1: 4, 2: 1, 35: 1, 33: 1, 14: 6, 17: 2, 22: 1, 24: 2}
Did not match all atoms present	827-08-7	C1(=C(C(=C(C(=C1F)Br)Br)F)F)F	{16: 4, 18: 2}
Did not match all atoms present	827-15-6	C1(=C(C(=C(C(=C1F)F)I)F)F)F	{16: 5, 19: 1}
Did not match all atoms present	827-19-0	CC1=CC(=C(C=C1)C)S(=O)(=O)[O-].[Na+]	{1: 2, 29: 3, 14: 3}
Did not match all atoms present	827-21-4	CC1=CC(=C(C=C1)S(=O)(=O)[O-])C.[Na+]	{1: 2, 29: 3, 14: 3}
Did not match all atoms present	827-23-6	C1=C(C=C(C(=C1Br)N)[N+](=O)[O-])Br	{18: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	827-36-1	CN(C)C(C#N)C1=CC=CC=C1	{1: 2, 3: 1, 37: 1, 14: 5, 33: 1}
Did not match all atoms present	827-42-9	C1=CC=C(C=C1)C2=CC(=O)SS2	{25: 1, 14: 6, 41: 2}
Did not match all atoms present	827-43-0	CC1=CN=C(N1)C2=CC=CC=C2	{32: 1, 1: 1, 35: 1, 14: 6}
Did not match all atoms present	827-52-1	C1CCC(CC1)C2=CC=CC=C2	{11: 5, 12: 1, 14: 5}
Did not match all atoms present	827-54-3	C=CC1=CC2=CC=CC=C2C=C1	{14: 7, 5: 1, 6: 1}
Did not match all atoms present	827-60-1	CC1=CC=C(C=C1)N2C=CC=C2	{1: 1, 14: 8, 33: 1}
Did not match all atoms present	827-88-3	C1CC1C(C2=CC=C(C=C2)F)O	{3: 1, 11: 2, 12: 1, 14: 4, 16: 1, 20: 1}
Did not match all atoms present	827-94-1	C1=C(C=C(C(=C1Br)N)Br)[N+](=O)[O-]	{18: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	827-99-6	C1=CC(=CC(=C1)OC(F)(F)F)O	{16: 3, 22: 1, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	82717-96-2	CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)O	{1: 2, 2: 3, 3: 2, 14: 5, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	82760-43-8	CCOC(=O)C1=CC(=C(C(=C1)Br)N=NC2=C(C=C(C=C2)N(CCO)CCO)C)[N+](=O)[O-]	{1: 2, 2: 5, 38: 1, 33: 1, 34: 2, 14: 5, 18: 1, 20: 2, 28: 1}
Did not match all atoms present	82763-95-9	CC1=C[Si](C=C1C)(C)C	{1: 4, 14: 2, 15: 2}
Did not match all atoms present	82763-96-0	CC1=C[Ge](C=C1C)(C)C	{1: 4, 14: 2, 15: 2}
Did not match all atoms present	82769-76-4	C1=CC=C(C=C1)[C@H](CCO)N	{2: 2, 3: 1, 20: 1, 30: 1, 14: 5}
Did not match all atoms present	82783-88-8	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4.C(CNCCN)N	{1: 4, 2: 6, 4: 2, 11: 2, 12: 2, 14: 16, 21: 2, 22: 2, 23: 2, 30: 2, 31: 1}
Did not match all atoms present	82783-89-9	C1CN(CCN1)CCN.C1=CC=C(C(=C1)C(=O)O)O	{32: 1, 33: 1, 2: 2, 11: 4, 14: 4, 21: 1, 27: 1, 30: 1}
Did not match all atoms present	82795-51-5	C1=CC=C(C=C1)CC[C@H](C(=O)O)N	{27: 1, 2: 2, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	82799-44-8	CCC1=CC(=C2C(=C1)C(=O)C3=CC=CC=C3S2)CC	{1: 2, 2: 2, 41: 1, 14: 6, 25: 1}
Did not match all atoms present	828-01-3	C1=CC=C(C=C1)CC(C(=O)O)O	{27: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	828-27-3	C1=CC(=CC=C1O)OC(F)(F)F	{16: 3, 22: 1, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	828-73-9	C1(=C(C(=C(C(=C1F)F)F)F)F)NN	{16: 5, 30: 1, 31: 1}
Did not match all atoms present	828-86-4	CC[N+]1=CC=CC2=C1C=CC(=C2)C.[I-]	{1: 2, 2: 1, 19: 1, 14: 6, 33: 1}
Did not match all atoms present	828-97-7	CC1=CC2=C(CCC2C(C)C)C=C1	{11: 2, 1: 3, 3: 1, 12: 1, 14: 3}
Did not match all atoms present	82801-81-8	CCNC(C)CC1=CC2=C(C=C1)OCO2	{1: 2, 2: 2, 3: 1, 11: 1, 14: 3, 23: 2, 31: 1}
Did not match all atoms present	82823-46-9	C1=CC=C2C=C3C(=CC2=C1)OC4(O3)OC5=CC=CC=C5O4	{13: 1, 14: 10, 23: 4}
Did not match all atoms present	82830-49-7	COC1=CC(=C(C=C1)OC)F	{16: 1, 1: 2, 22: 2, 14: 3}
Did not match all atoms present	82842-52-2	CC1=CC(=C(C(=C1N)C)Br)C	{1: 3, 18: 1, 30: 1, 14: 1}
Did not match all atoms present	82859-72-1	CC1=CC=CC=C1C(=O)NN/C=C/2\C=CC=CC2=O	{1: 1, 6: 1, 14: 8, 15: 1, 24: 1, 25: 1, 31: 2}
Did not match all atoms present	82863-72-7	C[C@H]([C-]1C=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3)OC.[CH-]1C=CC=C1.[Fe+2]	{1: 2, 3: 1, 22: 1, 14: 18}
Did not match all atoms present	82867-98-9	O=P(=O)Br	{18: 1, 29: 2}
Did not match all atoms present	829-20-9	CC(=O)C1=C(C=C(C=C1)OC)OC	{24: 1, 1: 3, 22: 2, 14: 3}
Did not match all atoms present	829-26-5	CC1=CC2=CC(=C(C=C2C=C1)C)C	{1: 3, 14: 5}
Did not match all atoms present	829-65-2	CC1=CC=C(C=C1)NC(=O)N2CC2	{1: 1, 33: 1, 11: 2, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	829-83-4	C1=CC=C(C=C1)[As]C2=CC=CC=C2	{14: 10}
Did not match all atoms present	829-84-5	C1CCC(CC1)PC2CCCCC2	{11: 10, 12: 2}
Did not match all atoms present	829-85-6	C1=CC=C(C=C1)PC2=CC=CC=C2	{14: 10}
Did not match all atoms present	82911-32-8	C(CCS(=O)(=O)[O-])CSC1=NNC(=S)S1.[Na+]	{32: 1, 2: 4, 35: 1, 40: 1, 41: 1, 29: 3}
Did not match all atoms present	82911-69-1	C1CC(=O)N(C1=O)OC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{33: 1, 2: 1, 11: 2, 12: 1, 14: 8, 25: 2}
Did not match all atoms present	82938-50-9	CC(C)(C)[Si](C)(C)N1[C@@H](CC1=O)C(=O)O	{1: 5, 4: 1, 33: 1, 11: 1, 12: 1, 25: 1, 27: 1}
Did not match all atoms present	82964-91-8	CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)Cl	{1: 1, 29: 4, 14: 4, 17: 1}
Did not match all atoms present	82985-35-1	CO[Si](CCCNCCC[Si](OC)(OC)OC)(OC)OC	{1: 6, 2: 6, 22: 6, 31: 1}
Did not match all atoms present	82991-47-7	CCCC1CCC(CC1)C2=CC=C(C=C2)CC	{1: 2, 2: 3, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	82991-48-8	CCCCCC1CCC(CC1)C2=CC=C(C=C2)CCC	{1: 2, 2: 6, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	82996-64-3	CC1=C(C(=C(C=C1N=NC2=C3C=CC(=CC3=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4OC)C)N=NC5=C6C=CC(=CC6=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)OC.[Na+].[Na+].[Na+].[Na+]	{1: 6, 34: 4, 14: 12, 22: 4, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	82998-57-0	CC1=C(C=C(C=C1)C(=O)O)I	{27: 1, 1: 1, 19: 1, 14: 3}
Did not match all atoms present	83-01-2	C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)Cl	{24: 1, 17: 1, 14: 10, 33: 1}
Did not match all atoms present	83-05-6	C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C(=O)O)Cl	{27: 1, 17: 2, 3: 1, 14: 8}
Did not match all atoms present	83-07-8	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N	{1: 2, 33: 2, 30: 1, 14: 5, 25: 1}
Did not match all atoms present	83-08-9	C1=CC=C2C(=C1)C=CC(=N2)C3C(=O)C4=CC=CC=C4C3=O	{25: 2, 35: 1, 12: 1, 14: 10}
Did not match all atoms present	83-12-5	C1=CC=C(C=C1)C2C(=O)C3=CC=CC=C3C2=O	{25: 2, 12: 1, 14: 9}
Did not match all atoms present	83-13-6	CCOC(=O)C(C1=CC=CC=C1)C(=O)OCC	{1: 2, 2: 2, 3: 1, 28: 2, 14: 5}
Did not match all atoms present	83-14-7	CC1C2=C(C(=C(C=C2CCN1C)OC)OC)O	{1: 4, 33: 1, 11: 2, 12: 1, 14: 1, 21: 1, 22: 2}
Did not match all atoms present	83-15-8	CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C	{1: 3, 33: 2, 14: 5, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	83-18-1	CC1=CC(=C(N1C2=CC=CC=C2)C)C=O	{1: 2, 26: 1, 14: 6, 33: 1}
Did not match all atoms present	83-23-8	C1=CC=C(C=C1)S(=O)(=O)OC2=CC(=CC3=CC(=CC(=C32)N)S(=O)(=O)O)S(=O)(=O)O	{30: 1, 20: 2, 22: 1, 14: 9, 29: 6}
Did not match all atoms present	83-24-9	CC1=CC=C(N1C2=CC=CC=C2)C	{1: 2, 14: 7, 33: 1}
Did not match all atoms present	83-25-0	C1CC(=O)N(C1=O)C2=CC=CC=C2	{25: 2, 11: 2, 14: 5, 33: 1}
Did not match all atoms present	83-26-1	CC(C)(C)C(=O)C1C(=O)C2=CC=CC=C2C1=O	{1: 3, 4: 1, 12: 1, 14: 4, 24: 1, 25: 2}
Did not match all atoms present	83-28-3	CC(C)CC(=O)C1C(=O)C2=CC=CC=C2C1=O	{1: 2, 2: 1, 3: 1, 12: 1, 14: 4, 24: 1, 25: 2}
Did not match all atoms present	83-30-7	C1=C(C=C(C(=C1O)C(=O)O)O)O	{27: 1, 21: 3, 14: 2}
Did not match all atoms present	83-31-8	C1=CC2=C3C(=C1)OS(=O)(=O)C3=CC=C2	{29: 2, 14: 6, 23: 1}
Did not match all atoms present	83-32-9	C1CC2=CC=CC3=C2C1=CC=C3	{11: 2, 14: 6}
Did not match all atoms present	83-33-0	C1CC(=O)C2=CC=CC=C21	{25: 1, 11: 2, 14: 4}
Did not match all atoms present	83-34-1	CC1=CNC2=CC=CC=C12	{32: 1, 1: 1, 14: 5}
Did not match all atoms present	83-38-5	C1=CC(=C(C(=C1)Cl)C=O)Cl	{17: 2, 26: 1, 14: 3}
Did not match all atoms present	83-40-9	CC1=CC=CC(=C1O)C(=O)O	{1: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	83-41-0	CC1=C(C(=CC=C1)[N+](=O)[O-])C	{1: 2, 38: 1, 14: 3}
Did not match all atoms present	83-42-1	CC1=C(C=CC=C1Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	83-53-4	C1=CC=C2C(=C1)C(=CC=C2Br)Br	{18: 2, 14: 6}
Did not match all atoms present	83-54-5	CN1C=CC(=O)C2=CC=CC=C21	{1: 1, 33: 1, 14: 6, 25: 1}
Did not match all atoms present	83-55-6	C1=CC2=C(C=CC=C2O)C(=C1)N	{30: 1, 21: 1, 14: 6}
Did not match all atoms present	83-56-7	C1=CC2=C(C=CC=C2O)C(=C1)O	{21: 2, 14: 6}
Did not match all atoms present	83-59-0	CCCOC(=O)C1C(CC2=CC3=C(C=C2C1C(=O)OCCC)OCO3)C	{1: 3, 2: 4, 11: 2, 12: 3, 14: 2, 23: 2, 28: 2}
Did not match all atoms present	83-60-3	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)O)NC5=C4C=CC(=C5)OC)O	{32: 1, 1: 2, 33: 1, 11: 5, 12: 6, 14: 3, 20: 1, 22: 2, 27: 1}
Did not match all atoms present	83-62-5	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)S(=O)(=O)O)N	{25: 2, 30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	83-63-6	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N(C(=O)C)C(=O)C)C	{24: 2, 1: 4, 34: 2, 14: 7, 33: 1}
Did not match all atoms present	83-64-7	C1=CC2=C(C=CC(=C2C(=C1)O)N)S(=O)(=O)O	{30: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	83-65-8	C1=CC2=C(C=CC(=C2C(=C1)O)O)S(=O)(=O)O	{20: 1, 21: 2, 14: 5, 29: 2}
Did not match all atoms present	83-66-9	CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]	{1: 5, 38: 2, 4: 1, 22: 1, 14: 1}
Did not match all atoms present	83-67-0	CN1C=NC2=C1C(=O)NC(=O)N2C	{32: 1, 1: 2, 35: 1, 33: 2, 14: 1, 25: 2}
Did not match all atoms present	83-68-1	CC1=C(C2=CC=CC=C2C(=C1)N)N	{1: 1, 30: 2, 14: 5}
Did not match all atoms present	83-72-7	C1=CC=C2C(=C1)C(=CC(=O)C2=O)O	{25: 2, 20: 1, 14: 5, 15: 1}
Did not match all atoms present	83-73-8	C1=CC2=C(C(=C(C=C2I)I)O)N=C1	{35: 1, 19: 2, 21: 1, 14: 4}
Did not match all atoms present	83-74-9	CC[C@H]1C[C@@H]2C[C@@H]3[C@H]1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC	{32: 1, 1: 2, 2: 1, 33: 1, 11: 5, 12: 4, 14: 3, 22: 1}
Did not match all atoms present	83-79-4	CC(=C)[C@H]1CC2=C(O1)C=CC3=C2O[C@@H]4COC5=CC(=C(C=C5[C@@H]4C3=O)OC)OC	{1: 3, 5: 1, 7: 1, 11: 2, 12: 3, 14: 4, 22: 2, 23: 3, 25: 1}
Did not match all atoms present	83-80-7	C1=CC=C(C=C1)C(=O)C2=CC=CC3=C2C=CC=C3C(=O)C4=CC=CC=C4	{24: 2, 14: 16}
Did not match all atoms present	83-81-8	CCN(CC)C(=O)C1=CC=CC=C1C(=O)N(CC)CC	{24: 2, 1: 4, 2: 4, 14: 4, 33: 2}
Did not match all atoms present	83-83-0	CC1=C(C=C(C(=C1)C2=CC(=C(C=C2S(=O)(=O)O)N)C)S(=O)(=O)O)N	{1: 2, 30: 2, 20: 2, 29: 4, 14: 4}
Did not match all atoms present	83-86-3	C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O	{20: 12, 12: 6, 29: 6, 22: 6}
Did not match all atoms present	83-88-5	CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O	{32: 1, 1: 2, 2: 2, 3: 3, 33: 1, 14: 2, 35: 2, 20: 4, 25: 2}
Did not match all atoms present	83-89-6	CCN(CC)CCCC(C)NC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC	{1: 4, 2: 5, 3: 1, 33: 1, 14: 6, 17: 1, 35: 1, 22: 1, 31: 1}
Did not match all atoms present	83-93-2	C1CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C41)C(=O)O	{27: 1, 35: 1, 11: 2, 14: 8}
Did not match all atoms present	83-95-4	COC1=C(C2=C(C=C1)C(=C3C=COC3=N2)OC)OC	{1: 3, 35: 1, 22: 3, 14: 4, 23: 1}
Did not match all atoms present	83-98-7	CC1=CC=CC=C1C(C2=CC=CC=C2)OCCN(C)C	{1: 3, 2: 2, 3: 1, 33: 1, 14: 9, 22: 1}
Did not match all atoms present	830-03-5	CC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	830-09-1	COC1=CC=C(C=C1)/C=C/C(=O)O	{1: 1, 22: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	830-79-5	COC1=CC(=C(C(=C1)OC)C=O)OC	{1: 3, 26: 1, 22: 3, 14: 2}
Did not match all atoms present	830-81-9	CC(=O)OC1=CC=CC2=CC=CC=C21	{1: 1, 28: 1, 14: 7}
Did not match all atoms present	830-89-7	CC(C)CC1C(=O)N(C(=S)N1)CC=C	{32: 1, 1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 33: 1, 12: 1, 15: 1, 25: 1}
Did not match all atoms present	830-96-6	C1=CC=C2C(=C1)C(=CN2)CCC(=O)O	{32: 1, 2: 2, 27: 1, 14: 5}
Did not match all atoms present	83006-79-5	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C/3\C(=O)C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[K+].[K+]	{34: 1, 14: 10, 15: 1, 25: 1, 29: 9, 31: 1}
Did not match all atoms present	83011-43-2	COC1=CC(=CC(=C1OC)O)C(=O)OC	{1: 3, 22: 2, 28: 1, 21: 1, 14: 2}
Did not match all atoms present	83012-13-9	C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2Cl)C(F)(F)F	{16: 6, 17: 1, 35: 1, 4: 2, 14: 4}
Did not match all atoms present	83042-08-4	C1=CC=[NH+]C=C1.O=[Cr](=O)=O.F	{16: 1, 32: 1, 29: 3, 14: 5}
Did not match all atoms present	83044-89-7	CCCCCCCCOC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)Cl)O)C(C)(C)C	{1: 4, 2: 9, 35: 2, 4: 1, 33: 1, 14: 5, 17: 1, 21: 1, 28: 1}
Did not match all atoms present	83044-90-0	CCCCC(CC)COC(=O)CCC1=CC(=C(C(=C1)N2N=C3C=CC(=CC3=N2)Cl)O)C(C)(C)C	{1: 5, 2: 7, 3: 1, 4: 1, 33: 1, 14: 5, 17: 1, 35: 2, 21: 1, 28: 1}
Did not match all atoms present	83048-65-1	CO[Si](CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OC)OC	{16: 17, 1: 3, 2: 2, 4: 8, 22: 3}
Did not match all atoms present	83053-57-0	CCOC1=C2C(=C3CCC(=O)C3=C1)C=CC4=CC=CC=C42	{1: 1, 2: 1, 11: 2, 14: 7, 22: 1, 25: 1}
Did not match all atoms present	83053-59-2	CC(C)OC1=C2C(=C3CCC(=O)C3=C1)C=CC4=CC=CC=C42	{1: 2, 3: 1, 11: 2, 14: 7, 22: 1, 25: 1}
Did not match all atoms present	83053-60-5	CCCCOC1=C2C(=C3CCC(=O)C3=C1)C=CC4=CC=CC=C42	{1: 1, 2: 3, 11: 2, 14: 7, 22: 1, 25: 1}
Did not match all atoms present	83053-62-7	CC1=C2C(=C3C(CC(=O)C3=C1)OC)C=CC4=CC=CC=C42	{1: 2, 11: 1, 12: 1, 14: 7, 22: 1, 25: 1}
Did not match all atoms present	83053-63-8	C1CC(=O)C2=CC(=C3C(=C21)C=CC4=CC=CC=C43)O	{25: 1, 11: 2, 21: 1, 14: 7}
Did not match all atoms present	83055-99-6	COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2C(=O)OC)OC	{1: 3, 2: 1, 35: 2, 14: 5, 22: 2, 24: 1, 28: 1, 29: 2, 31: 2}
Did not match all atoms present	83067-20-3	CC(C)(C)[Si](C)(C)OCCCCCO	{1: 5, 2: 5, 4: 1, 22: 1, 20: 1}
Did not match all atoms present	831-00-5	CCC(=O)C1=C(C=C(C=C1)OC)OC	{24: 1, 1: 3, 2: 1, 22: 2, 14: 3}
Did not match all atoms present	831-29-8	CC(=O)CC1=C(C=C(C=C1)OC)OC	{24: 1, 1: 3, 2: 1, 22: 2, 14: 3}
Did not match all atoms present	831-52-7	C1=C(C=C(C(=C1[N+](=O)[O-])[O-])N)[N+](=O)[O-].[Na+]	{38: 2, 30: 1, 14: 2}
Did not match all atoms present	831-59-4	C1=CC(=CC(=C1)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{29: 6, 14: 4}
Did not match all atoms present	831-61-8	CCOC(=O)C1=CC(=C(C(=C1)O)O)O	{1: 1, 2: 1, 28: 1, 21: 3, 14: 2}
Did not match all atoms present	831-71-0	C1=C(OC(=C1)[N+](=O)[O-])/C=N/NC(=S)N	{34: 1, 38: 1, 6: 1, 7: 1, 14: 2, 23: 1, 30: 1, 31: 1}
Did not match all atoms present	831-75-4	C1=CC(=CC(=C1)OC(C(F)F)(F)F)N	{3: 1, 4: 1, 14: 4, 16: 4, 22: 1, 30: 1}
Did not match all atoms present	831-81-2	C1=CC=C(C=C1)CC2=CC=C(C=C2)Cl	{17: 1, 2: 1, 14: 9}
Did not match all atoms present	831-82-3	C1=CC=C(C=C1)OC2=CC=C(C=C2)O	{22: 1, 21: 1, 14: 9}
Did not match all atoms present	831-91-4	C1=CC=C(C=C1)CSC2=CC=CC=C2	{40: 1, 2: 1, 14: 10}
Did not match all atoms present	83115-11-1	C[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)P=PC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C	{1: 18, 4: 2}
Did not match all atoms present	83137-14-8	CCOCCOC1=NC(=NC(=N1)NC2=CC(=C(C=C2)S(=O)(=O)[O-])N/N=C/3\C(=CC4=CC(=C(C(=C4C3=O)N)N=NC5=C(C=CC(=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 1, 2: 3, 35: 3, 34: 3, 14: 8, 15: 2, 17: 1, 22: 2, 25: 1, 29: 15, 30: 1, 31: 2}
Did not match all atoms present	83137-18-2	C1=CC(=CC(=C1)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N=NC4=C(C5=C(C(=C(C=C5C=C4S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC6=CC=C(C=C6)S(=O)(=O)[O-])N)O)Cl)NC7=NC(=NC(=N7)NC8=CC(=C(C=C8)S(=O)(=O)[O-])N=NC9=C(C1=C(C(=C(C=C1C=C9S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC1=CC=C(C=C1)S(=O)(=O)[O-])N)O)Cl.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{34: 8, 35: 6, 14: 22, 17: 2, 21: 2, 29: 24, 30: 2, 31: 4}
Did not match all atoms present	83164-33-4	C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NC3=C(C=C(C=C3)F)F)C(F)(F)F	{35: 1, 4: 1, 14: 10, 16: 5, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	83175-08-0	CC(C)C(C(C)(C)CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C(CCCO)CCO	{1: 4, 2: 7, 3: 2, 4: 1, 14: 4, 20: 4, 28: 2}
Did not match all atoms present	83193-04-8	C(C(=O)[O-])(F)F	{16: 2, 24: 1, 3: 1}
Did not match all atoms present	832-01-9	COC1=CC=C(C=C1)C=CC(=O)OC	{1: 2, 22: 1, 28: 1, 14: 4, 6: 2}
Did not match all atoms present	832-53-1	C1(=C(C(=C(C(=C1F)F)S(=O)(=O)Cl)F)F)F	{16: 5, 17: 1, 29: 2}
Did not match all atoms present	832-58-6	CC(=O)C1=C(C=C(C=C1OC)OC)OC	{24: 1, 1: 4, 22: 3, 14: 2}
Did not match all atoms present	832-64-4	CC1=CC=CC2=C1C3=CC=CC=C3C=C2	{1: 1, 14: 9}
Did not match all atoms present	832-69-9	CC1=CC=CC2=C1C=CC3=CC=CC=C32	{1: 1, 14: 9}
Did not match all atoms present	832-71-3	CC1=CC2=C(C=C1)C=CC3=CC=CC=C32	{1: 1, 14: 9}
Did not match all atoms present	832-92-8	COC1=CC(=CC(=C1OC)OC)CCN.Cl	{1: 3, 2: 2, 14: 2, 17: 1, 22: 3, 30: 1}
Did not match all atoms present	83206-49-9	[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Na+].[K+].[K+].[K+]	{29: 8}
Did not match all atoms present	83207-21-0	CC(=O)NNC(=O)C1=CC=C(O1)[N+](=O)[O-]	{1: 1, 38: 1, 14: 2, 23: 1, 24: 2, 31: 2}
Did not match all atoms present	83242-95-9	CCCCCCCCP(=O)(CC(=O)N(CC(C)C)CC(C)C)C1=CC=CC=C1	{1: 5, 2: 10, 3: 2, 33: 1, 14: 5, 24: 1, 29: 1}
Did not match all atoms present	83270-34-2	CCN(CCO)C1=CC=C(C=C1)C2=[N+](C3=C4C2=CC=CC4=C(C=C3)Br)C.CC(=O)[O-]	{1: 3, 2: 3, 33: 2, 14: 9, 15: 1, 18: 1, 20: 1, 24: 1}
Did not match all atoms present	833-48-7	C1CC2=CC=CC=C2CC3=CC=CC=C31	{11: 3, 14: 8}
Did not match all atoms present	833-50-1	C1=CC=C(C=C1)C2=NC3=CC=CC=C3O2	{35: 1, 14: 9, 23: 1}
Did not match all atoms present	833-66-9	C1=CC2=C(C=CC(=C2)S(=O)(=O)[O-])C=C1O.[K+]	{21: 1, 14: 6, 29: 3}
Did not match all atoms present	833-82-9	C1=CC=C(C=C1)CS(=O)C2=CC=CC=C2	{2: 1, 29: 1, 14: 10}
Did not match all atoms present	83320-61-0	C1=CC(=CC=C1NC(C(Cl)(Cl)Cl)NC2=CC=C(C=C2)Br)Br	{3: 1, 4: 1, 14: 8, 17: 3, 18: 2, 31: 2}
Did not match all atoms present	834-12-8	CCNC1=NC(=NC(=N1)SC)NC(C)C	{1: 4, 2: 1, 3: 1, 40: 1, 35: 3, 31: 2}
Did not match all atoms present	834-14-0	COC1=CC=C(C=C1)CC2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	834-24-2	C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)N	{30: 1, 14: 9, 6: 2}
Did not match all atoms present	834-25-3	CC1=CC=C(C=C1)OCC2=CC=CC=C2	{1: 1, 2: 1, 22: 1, 14: 9}
Did not match all atoms present	834-28-6	C1=CC=C(C=C1)CCN=C(N)N=C(N)N.Cl	{2: 2, 7: 2, 34: 2, 14: 5, 17: 1, 30: 3}
Did not match all atoms present	83400-26-4	CC1=CC(=C(C=C1Cl)N/N=C/2\C=C(C(=O)C3=CC=CC=C32)C(=O)[O-])S(=O)(=O)[O-].[Ca+2]	{1: 1, 34: 1, 14: 7, 15: 2, 17: 1, 24: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	83435-67-0	CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CC(=O)O)C2CC3=CC=CC=C3C2	{1: 2, 2: 4, 3: 2, 33: 1, 11: 2, 12: 1, 14: 9, 24: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	83447-69-2	CCCCCCCC[Sn](CCCCCCCC)(Cl)Cl.CCCCCCCC[Sn](Cl)(Cl)Cl.C(C(=O)O)S	{1: 3, 2: 22, 27: 1, 39: 1, 17: 5}
Did not match all atoms present	83463-64-3	C(=[SiH2])Cl	{17: 1, 6: 1}
Did not match all atoms present	83470-64-8	C1=NC2=C(N1CCC(CO)O)NC(=NC2=O)N	{32: 1, 33: 1, 2: 3, 3: 1, 14: 1, 35: 2, 20: 2, 25: 1, 30: 1}
Did not match all atoms present	83483-14-1	CCC(=O)N[N+](C)(C)CC(C)(C(=C)C)[O-]	{1: 5, 2: 2, 4: 1, 5: 1, 7: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	835-11-0	C1=CC=C(C(=C1)C(=O)C2=CC=CC=C2O)O	{24: 1, 21: 2, 14: 8}
Did not match all atoms present	835-31-4	C1CN=C(N1)CC2=CC=CC3=CC=CC=C32	{32: 1, 2: 1, 35: 1, 11: 2, 14: 7, 15: 1}
Did not match all atoms present	835-64-3	C1=CC=C2C(=C1)N/C(=C\3/C=CC=CC3=O)/O2	{32: 1, 25: 1, 23: 1, 14: 8, 15: 2}
Did not match all atoms present	835-71-2	CC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2	{1: 1, 35: 1, 14: 8, 23: 1}
Did not match all atoms present	83527-54-2	O1[As]2O[As]3[As]1[As]3O2	{23: 3}
Did not match all atoms present	83527-55-3	O=[As]12O[As]3O[As](O1)[As]3O2	{29: 1, 23: 4}
Did not match all atoms present	83558-87-6	C1=CC(=C(C=C1C(C2=CC(=C(C=C2)O)N)(C(F)(F)F)C(F)(F)F)N)O	{16: 6, 30: 2, 4: 3, 21: 2, 14: 6}
Did not match all atoms present	83567-04-8	CCN(C1=CC(=CC=C1)S(=O)(=O)CCOS(=O)(=O)[O-])C2=NC(=NC(=N2)NC3=CC4=C(C=C3)C(=O)/C(=N\NC5=C(C=C(C=C5)OC)S(=O)(=O)[O-])/C(=C4)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]	{1: 2, 2: 3, 35: 3, 33: 1, 34: 1, 14: 11, 15: 2, 17: 1, 22: 2, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	83588-58-3	CCC(C)[O-].CCC(C)[O-].CCC(C)[O-].CCOP(=O)(OCC)OCC.[O-2].[O-2].[O-2].O=[Si]=O.[Al+3].[Cr+3]	{1: 9, 2: 6, 3: 3, 29: 6, 22: 3}
Did not match all atoms present	83588-59-4	CCOP(=O)(OCC)OCC.[O-2].[O-2].[O-2].O=[Si]=O.[Cr+3]	{1: 3, 2: 3, 29: 3, 22: 3}
Did not match all atoms present	83588-60-7	CCN\1C2=CC(=C(C=C2N(/C1=C\C=C/C3=[N+](C4=C(O3)C=C(C(=C4)C)C)CC)CCCOC(=O)C)Cl)Cl.[I-]	{1: 5, 2: 5, 6: 3, 33: 3, 14: 4, 15: 1, 17: 2, 19: 1, 23: 1, 28: 1}
Did not match all atoms present	83591-99-5	CCC1(CCC(=O)NC1=O)C2=CC=C(C=C2)NC=O	{32: 1, 1: 1, 2: 1, 11: 2, 13: 1, 14: 4, 25: 2, 26: 1, 31: 1}
Did not match all atoms present	83594-38-1	CON=C(C1=CSC(=N1)NC=O)C(=O)O	{1: 1, 34: 1, 35: 1, 7: 1, 41: 1, 14: 1, 22: 1, 26: 1, 27: 1, 31: 1}
Did not match all atoms present	836-30-6	C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+](=O)[O-]	{38: 1, 14: 9, 31: 1}
Did not match all atoms present	836-41-9	COC1=CC=C(C=C1)C=NC2=CC=CC=C2	{1: 1, 22: 1, 34: 1, 14: 9, 6: 1}
Did not match all atoms present	836-43-1	C1=CC=C(C=C1)COC2=CC=C(C=C2)CO	{2: 2, 20: 1, 22: 1, 14: 9}
Did not match all atoms present	836-44-2	C1=CC(=CC=C1C=CC2=CC=C(C=C2)O)N	{30: 1, 14: 8, 6: 2, 21: 1}
Did not match all atoms present	83656-84-2	CC1=CC2=C(C=C1)SC3=CC4=CC=CC=C4C=C32	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	83657-18-5	CC(C)(C)[C@H](/C(=C\C1=C(C=C(C=C1)Cl)Cl)/N2C=NC=N2)O	{1: 3, 3: 1, 4: 1, 33: 1, 6: 1, 7: 1, 14: 5, 17: 2, 35: 2, 20: 1}
Did not match all atoms present	83657-22-1	CC(C)(C)C(C(=CC1=CC=C(C=C1)Cl)N2C=NC=N2)O	{1: 3, 3: 1, 4: 1, 33: 1, 6: 1, 7: 1, 14: 6, 17: 1, 35: 2, 20: 1}
Did not match all atoms present	83657-24-3	CC(C)(C)C(/C(=C\C1=C(C=C(C=C1)Cl)Cl)/N2C=NC=N2)O	{1: 3, 3: 1, 4: 1, 33: 1, 6: 1, 7: 1, 14: 5, 17: 2, 35: 2, 20: 1}
Did not match all atoms present	83669-51-6	CC1=CC=CC2=CC3=C(C=C12)C4=CC=CC=C4S3	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	83688-84-0	CC(C)(C)NCC(COC1=CC=CC2=C1SCCC2)O	{1: 3, 2: 2, 3: 1, 4: 1, 41: 1, 11: 3, 14: 3, 20: 1, 22: 1, 31: 1}
Did not match all atoms present	837-01-4	C1=CC=C2C(=C1)SC3(S2)SC4=CC=CC=C4S3	{41: 4, 13: 1, 14: 8}
Did not match all atoms present	837-08-1	CC(C)(C1=CC=C(C=C1)O)C2=CC=CC=C2O	{1: 2, 4: 1, 21: 2, 14: 8}
Did not match all atoms present	837-45-6	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C(=O)O	{27: 1, 14: 9}
Did not match all atoms present	837-73-0	C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N	{1: 1, 30: 2, 14: 7, 33: 1}
Did not match all atoms present	83706-50-7	C1CCC(C1)(C#N)C2=CC=C(C=C2)F	{16: 1, 11: 4, 13: 1, 14: 4, 37: 1}
Did not match all atoms present	83724-41-8	COC1=CC=CC=C1[Bi](C2=CC=CC=C2OC)C3=CC=CC=C3OC	{1: 3, 22: 3, 14: 12}
Did not match all atoms present	83732-48-3	CC1=CC=CC=C1OCCCCCl	{1: 1, 2: 4, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	83732-95-0	CC1=NN(C(=C1N=NC2=CC=CC=C2[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=CC=C3.[Na+].[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 17, 29: 2, 30: 1}
Did not match all atoms present	83749-56-8	CCCCOC1=CC(=C(C=C1[N+]#N)OCCCC)N2CCOCC2.C1=C(C=C(C=C1C(=O)O)S(=O)(=O)[O-])C(=O)O	{1: 2, 2: 6, 33: 1, 11: 4, 34: 1, 14: 5, 22: 2, 23: 1, 27: 2, 29: 3}
Did not match all atoms present	83784-18-3	CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC5=CNC6=CC=CC=C65)NC(=O)[C@H](CC7=CN=CN7)NC(=O)[C@@H]8CCC(=O)N8.CC(=O)O	{32: 4, 1: 5, 2: 10, 3: 8, 33: 2, 7: 1, 11: 5, 12: 2, 34: 1, 14: 16, 35: 1, 20: 1, 21: 1, 24: 9, 25: 1, 27: 1, 30: 2, 31: 7}
Did not match all atoms present	838-41-5	C1=CC=C(C=C1)C2=COC(=N2)C3=CC=CC=C3	{35: 1, 14: 11, 23: 1}
Did not match all atoms present	838-57-3	CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 14: 4, 24: 1, 28: 1}
Did not match all atoms present	838-85-7	C1=CC=C(C=C1)OP(=O)(O)OC2=CC=CC=C2	{20: 1, 22: 2, 14: 10, 29: 1}
Did not match all atoms present	838-88-0	CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)C)N	{1: 2, 2: 1, 30: 2, 14: 6}
Did not match all atoms present	838-95-9	CN(C)C1=CC=C(C=C1)/C=C/C2=CC=CC=C2	{1: 2, 14: 9, 6: 2, 33: 1}
Did not match all atoms present	838-96-0	C1=CC=C(C=C1)COC2=CC=C(C=C2)CC#N	{2: 2, 22: 1, 14: 9, 37: 1}
Did not match all atoms present	83803-80-9	CCCCC1=CC=C(C=C1)C(OCC)OCC	{1: 3, 2: 5, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	83803-88-7	CC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2)OC	{24: 1, 1: 2, 22: 1, 21: 1, 14: 7}
Did not match all atoms present	83803-95-6	CC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=CC=CC=C3C=C2	{24: 2, 1: 1, 14: 11, 31: 2}
Did not match all atoms present	83809-88-5	CC1=NC2=NN=C(C(=O)N2N1)[N+](=O)[O-]	{32: 1, 1: 1, 35: 3, 38: 1, 33: 1, 25: 1}
Did not match all atoms present	83817-71-4	CC(C)(C#C)O[Si](C)(OC(C)(C)C#C)OC(C)(C)C#C	{1: 7, 10: 3, 4: 3, 22: 3, 9: 3}
Did not match all atoms present	83825-42-7	CC(C)(C)OC(=O)N[C@@H](CC1=CSC=C1)C(=O)O.C1CCC(CC1)NC2CCCCC2	{1: 3, 2: 1, 3: 1, 4: 1, 41: 1, 11: 10, 12: 2, 14: 3, 27: 1, 28: 1, 31: 2}
Did not match all atoms present	83833-21-0	CCCCCCCCCCCCCCOC(=O)CS[Sn](CCCC)(CCCC)SCC(=O)OCCCCCCCCCCCCCC	{40: 2, 1: 4, 2: 34, 28: 2}
Did not match all atoms present	83846-66-6	CC1=CC=C(C=C1)C2(CC2)C(=O)O	{27: 1, 1: 1, 11: 2, 13: 1, 14: 4}
Did not match all atoms present	83846-85-9	CC1=CC=C(C=C1)SC2=CC=C(C=C2)C(=O)C3=CC=CC=C3	{24: 1, 1: 1, 14: 13, 40: 1}
Did not match all atoms present	83863-33-6	CC1=C(C=C(C=C1)I)N	{1: 1, 19: 1, 30: 1, 14: 3}
Did not match all atoms present	83863-63-2	C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)S(=O)(=O)O	{20: 1, 29: 2, 14: 7, 23: 1}
Did not match all atoms present	83864-02-2	CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCC3=C(N4[C@@H]([C@@H](C4=O)NC(=O)CC5=CC=CS5)SC3)C(=O)[O-].[Na+]	{1: 2, 2: 2, 33: 2, 41: 2, 11: 1, 12: 2, 14: 9, 15: 2, 24: 2, 25: 1, 29: 2, 31: 2}
Did not match all atoms present	83864-25-9	CC(CO)O.C1C2C=CC1C3C2C(=O)OC3=O.C1=CC(=CC=C1O)O	{1: 1, 2: 1, 3: 1, 11: 1, 12: 4, 14: 6, 20: 2, 21: 2, 28: 2}
Did not match all atoms present	83876-50-0	CC1=C2C3=CC=CC=C3[C@H]([C@H](C2=NC4=CC=CC=C14)O)O	{1: 1, 35: 1, 12: 2, 14: 8, 20: 2}
Did not match all atoms present	83876-56-6	CC1=C2C=CC3=C(C2=NC4=CC=CC=C14)C=CC(=C3)OC	{1: 2, 35: 1, 22: 1, 14: 9}
Did not match all atoms present	83876-62-4	CC1=C2C=CC3=C(C2=NC4=CC=CC=C14)C=CC=C3OC(=O)C	{1: 2, 35: 1, 28: 1, 14: 9}
Did not match all atoms present	83877-91-2	CCOC(=O)/C=C(\[O-])/C.CCOC(=O)/C=C(\[O-])/C.CC(C[O-])C.CC(C[O-])C.[Ti+4]	{1: 8, 2: 4, 3: 2, 6: 2, 7: 2, 28: 2, 29: 2}
Did not match all atoms present	83890-22-6	C[Si]1(OCCOCCOCCOCCOCCO1)C	{1: 2, 11: 10, 23: 6}
Did not match all atoms present	839-78-1	C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)O)S(=O)(=O)F	{16: 1, 27: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	83915-83-7	C1C[C@H](N(C1)C(=O)[C@H](CCCCN)N[C@@H](CCC2=CC=CC=C2)C(=O)O)C(=O)O.O.O	{33: 1, 2: 6, 3: 2, 11: 3, 12: 1, 14: 5, 24: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	83917-77-5	C(=C=S)=S	{8: 2}
Did not match all atoms present	83933-03-3	C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=CC=CC(=C5O)CC6=CC=CC1=C6O)O)O)O	{11: 5, 21: 5, 14: 15}
Did not match all atoms present	83935-45-9	CC1=CC=C(N1C2=CC=C(C=C2)C(=O)C)C	{24: 1, 1: 3, 14: 6, 33: 1}
Did not match all atoms present	83935-62-0	C1COCCOC2=C(C=C(C=C2)N=C=O)OCCOCCO1	{34: 1, 8: 1, 11: 8, 14: 3, 23: 5, 29: 1}
Did not match all atoms present	83935-63-1	C1COCCOCCOC2=C(C=CC(=C2)N=C=O)OCCOCCO1	{34: 1, 8: 1, 11: 10, 14: 3, 23: 6, 29: 1}
Did not match all atoms present	83944-24-5	C1C2C1C3=CC=C(C=C3)C4CC4C5=CC=C2C=C5	{11: 2, 12: 4, 14: 8}
Did not match all atoms present	83947-07-3	C1CS(=O)(=O)C2C1C3CC2C=C3	{11: 3, 12: 4, 29: 2, 14: 2}
Did not match all atoms present	83949-71-7	CC1=CC=C(C=C1)N(C)/N=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.CC(=O)[O-]	{1: 6, 34: 1, 6: 1, 33: 2, 13: 1, 14: 8, 15: 1, 24: 1}
Did not match all atoms present	83950-11-2	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=NC(=NC(=N4)NC5=C6C(=C7C(=C5)C(=O)C8=C(N7)C=CC(=C8)Br)C(=O)C9=CC=CC=C9C6=O)NC1=CC=CC2=C1C(=O)C1=CC=CC=C1C2=O	{32: 1, 35: 3, 14: 22, 18: 1, 25: 7, 31: 3}
Did not match all atoms present	83950-33-8	CC1=C(C=CC(=C1)N(CCO)CCO)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]	{1: 5, 2: 4, 33: 3, 7: 1, 14: 11, 15: 2, 17: 1, 20: 2}
Did not match all atoms present	83984-91-2	CC1CO1.C1CO1.C1=CC=C(C=C1)C(=O)O	{1: 1, 11: 3, 12: 1, 14: 5, 23: 2, 27: 1}
Did not match all atoms present	83995-89-5	B(=S)F	{16: 1}
Did not match all atoms present	83997-16-4	C1C[C@H](N(C1)[C@@H](CCCN=C(N)N)C=O)C(=O)NC(=O)[C@@H](CC2=CC=CC=C2)N.OS(=O)(=O)O	{33: 1, 2: 4, 3: 2, 7: 1, 11: 3, 12: 1, 34: 1, 14: 5, 20: 2, 24: 2, 26: 1, 29: 2, 30: 3, 31: 1}
Did not match all atoms present	84-01-5	CCN(CC)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl	{1: 2, 2: 5, 33: 2, 41: 1, 14: 7, 17: 1}
Did not match all atoms present	84-04-8	C1CN(CCC1C(=O)N)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl	{33: 2, 2: 3, 41: 1, 11: 4, 12: 1, 14: 7, 17: 1, 24: 1, 30: 1}
Did not match all atoms present	84-06-0	CC(=O)OCCN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl	{1: 1, 2: 5, 33: 3, 41: 1, 11: 4, 14: 7, 17: 1, 28: 1}
Did not match all atoms present	84-08-2	C1CCN(C1)CCN2C3=CC=CC=C3SC4=CC=CC=C42	{33: 2, 2: 2, 11: 4, 14: 8, 41: 1}
Did not match all atoms present	84-11-7	C1=CC=C2C(=C1)C3=CC=CC=C3C(=O)C2=O	{25: 2, 14: 8}
Did not match all atoms present	84-12-8	C1=CC2=C(C(=O)C(=O)C3=C2C=CC=N3)N=C1	{25: 2, 35: 2, 14: 6}
Did not match all atoms present	84-15-1	C1=CC=C(C=C1)C2=CC=CC=C2C3=CC=CC=C3	{14: 14}
Did not match all atoms present	84-17-3	C/C=C(/C(=C/C)/C1=CC=C(C=C1)O)\C2=CC=C(C=C2)O	{1: 2, 21: 2, 14: 8, 6: 2, 7: 2}
Did not match all atoms present	84-19-5	CC=C(C1=CC=C(C=C1)OC(=O)C)C(=CC)C2=CC=C(C=C2)OC(=O)C	{1: 4, 28: 2, 14: 8, 6: 2, 7: 2}
Did not match all atoms present	84-21-9	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)OP(=O)(O)O)O	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 4, 22: 1, 23: 1, 29: 1, 30: 1}
Did not match all atoms present	84-22-0	C1CC(C2=CC=CC=C2C1)C3=NCCN3	{32: 1, 35: 1, 11: 5, 12: 1, 14: 4, 15: 1}
Did not match all atoms present	84-23-1	C1=CC=C2C(=C1)C(=CC3=C2N=NO3)S(=O)(=O)O	{35: 2, 20: 1, 29: 2, 14: 5, 23: 1}
Did not match all atoms present	84-26-4	C1CN2C(=NC3=CC=CC=C3C2=O)C4=C1C5=CC=CC=C5N4	{32: 1, 33: 1, 35: 1, 11: 2, 14: 8, 25: 1}
Did not match all atoms present	84-36-6	CCOC(=O)OC1=C(C=C(C=C1OC)C(=O)O[C@@H]2C[C@@H]3CN4CCC5=C([C@H]4C[C@@H]3[C@@H]([C@H]2OC)C(=O)OC)NC6=C5C=CC(=C6)OC)OC	{32: 1, 1: 6, 2: 1, 33: 1, 11: 5, 12: 6, 14: 5, 22: 4, 28: 2}
Did not match all atoms present	84-40-2	C1=CC2=C(C=C1Br)C(=O)/C(=C\3/C(=O)C4=C(N3)C=CC(=C4)Br)/N2	{32: 2, 25: 2, 18: 2, 14: 6, 15: 2}
Did not match all atoms present	84-44-6	CC1=C(C=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)Br	{1: 1, 18: 1, 14: 6, 25: 2}
Did not match all atoms present	84-46-8	C1=CC=C2C(=C1)C(=O)C3=CC(=C(C=C3C2=O)Cl)N	{17: 1, 30: 1, 14: 6, 25: 2}
Did not match all atoms present	84-47-9	CC(C)(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O	{1: 3, 4: 1, 14: 7, 25: 2}
Did not match all atoms present	84-48-0	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)O	{25: 2, 20: 1, 29: 2, 14: 7}
Did not match all atoms present	84-49-1	C1=CC2=C(C=C1S(=O)(=O)O)C(=O)C3=C(C2=O)C=CC(=C3)S(=O)(=O)O	{25: 2, 20: 2, 29: 4, 14: 6}
Did not match all atoms present	84-50-4	C1=CC2=C(C=C1S(=O)(=O)O)C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)O	{25: 2, 20: 2, 29: 4, 14: 6}
Did not match all atoms present	84-51-5	CCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O	{1: 1, 2: 1, 14: 7, 25: 2}
Did not match all atoms present	84-52-6	C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)OP(=O)(O)O)O	{33: 1, 2: 1, 35: 1, 12: 4, 14: 2, 20: 4, 22: 1, 23: 1, 25: 1, 29: 1, 30: 1}
Did not match all atoms present	84-54-8	CC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O	{1: 1, 14: 7, 25: 2}
Did not match all atoms present	84-56-0	C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3N=CC=C4	{35: 1, 14: 11}
Did not match all atoms present	84-57-1	CC1=NN(C(=O)C1)C2=CC(=C(C=C2Cl)S(=O)(=O)O)Cl	{1: 1, 35: 1, 33: 1, 11: 1, 14: 2, 15: 1, 17: 2, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	84-60-6	C1=CC2=C(C=C1O)C(=O)C3=C(C2=O)C=C(C=C3)O	{25: 2, 21: 2, 14: 6}
Did not match all atoms present	84-61-7	C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3	{28: 2, 11: 10, 12: 2, 14: 4}
Did not match all atoms present	84-62-8	C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2C(=O)OC3=CC=CC=C3	{28: 2, 14: 14}
Did not match all atoms present	84-64-0	CCCCOC(=O)C1=CC=CC=C1C(=O)OC2CCCCC2	{1: 1, 2: 3, 11: 5, 12: 1, 14: 4, 28: 2}
Did not match all atoms present	84-65-1	C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O	{25: 2, 14: 8}
Did not match all atoms present	84-66-2	CCOC(=O)C1=CC=CC=C1C(=O)OCC	{1: 2, 2: 2, 28: 2, 14: 4}
Did not match all atoms present	84-68-4	C1=CC(=C(C=C1N)Cl)C2=C(C=C(C=C2)N)Cl	{17: 2, 30: 2, 14: 6}
Did not match all atoms present	84-69-5	CC(C)COC(=O)C1=CC=CC=C1C(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	84-72-0	CCOC(=O)COC(=O)C1=CC=CC=C1C(=O)OCC	{1: 2, 2: 3, 28: 3, 14: 4}
Did not match all atoms present	84-73-1	C1=CC=C(C(=C1)C(=O)OCCO)C(=O)OCCO	{28: 2, 2: 4, 20: 2, 14: 4}
Did not match all atoms present	84-74-2	CCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC	{1: 2, 2: 6, 28: 2, 14: 4}
Did not match all atoms present	84-75-3	CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC	{1: 2, 2: 10, 28: 2, 14: 4}
Did not match all atoms present	84-76-4	CCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCC	{1: 2, 2: 16, 28: 2, 14: 4}
Did not match all atoms present	84-77-5	CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCC	{1: 2, 2: 18, 28: 2, 14: 4}
Did not match all atoms present	84-78-6	CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC	{1: 2, 2: 10, 28: 2, 14: 4}
Did not match all atoms present	84-79-7	CC(=CCC1=C(C2=CC=CC=C2C(=O)C1=O)O)C	{1: 2, 2: 1, 6: 1, 7: 1, 14: 4, 15: 2, 20: 1, 25: 2}
Did not match all atoms present	84-80-0	CC1=C(C(=O)C2=CC=CC=C2C1=O)CC=C(C)CCCC(C)CCCC(C)CCCC(C)C	{1: 6, 2: 10, 3: 3, 6: 1, 7: 1, 14: 4, 15: 2, 25: 2}
Did not match all atoms present	84-83-3	CC1(C2=CC=CC=C2N(C1=CC=O)C)C	{1: 3, 6: 1, 33: 1, 13: 1, 14: 4, 15: 1, 26: 1}
Did not match all atoms present	84-85-5	COC1=CC=C(C2=CC=CC=C21)O	{1: 1, 22: 1, 21: 1, 14: 6}
Did not match all atoms present	84-86-6	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)N	{30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	84-87-7	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	84-88-8	C1=CC2=C(C=CC(=C2N=C1)O)S(=O)(=O)O	{35: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	84-89-9	C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)N	{30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	84-92-4	C1=CC2=C(C=CC(=C2N)N)C(=C1)S(=O)(=O)O	{30: 2, 20: 1, 29: 2, 14: 5}
Did not match all atoms present	84-94-6	CC1=C(C=CC(=C1)N)N=NC2=CC(=C3C=CC=C(C3=C2)S(=O)(=O)O)S(=O)(=O)O	{1: 1, 34: 2, 14: 8, 20: 2, 29: 4, 30: 1}
Did not match all atoms present	84-95-7	CCN(CC)C1=CC=CC2=CC=CC=C21	{1: 2, 2: 2, 14: 7, 33: 1}
Did not match all atoms present	84-96-8	CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C	{1: 3, 2: 2, 3: 1, 33: 2, 41: 1, 14: 8}
Did not match all atoms present	84-97-9	CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=CC=CC=C42	{1: 1, 2: 3, 33: 3, 41: 1, 11: 4, 14: 8}
Did not match all atoms present	84-99-1	CC1(C=CC2=C(O1)C=C3C(=C2OC)C=CC(=O)O3)C	{1: 3, 13: 1, 14: 5, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	840-58-4	C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]	{35: 1, 38: 1, 14: 8, 23: 1}
Did not match all atoms present	840-65-3	COC(=O)C1=CC2=C(C=C1)C=C(C=C2)C(=O)OC	{1: 2, 28: 2, 14: 6}
Did not match all atoms present	840-97-1	CCOC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C	{1: 2, 2: 2, 3: 1, 14: 4, 21: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	84000-75-9	CC(C)(C1=CC=C(C=C1)OC(=O)OCC=C)C2=CC=C(C=C2)OC(=O)OCC=C	{1: 2, 2: 2, 4: 1, 5: 2, 6: 2, 14: 8}
Did not match all atoms present	84002-64-2	CC(C(CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{1: 1, 2: 1, 3: 2, 22: 3}
Did not match all atoms present	84008-89-9	[Na+].[Na+].[Cl-]	{17: 1}
Did not match all atoms present	84028-88-6	CCOC(=O)[C@H](C)OS(=O)(=O)C(F)(F)F	{1: 2, 2: 1, 3: 1, 4: 1, 16: 3, 22: 1, 28: 1, 29: 2}
Did not match all atoms present	84030-79-5	C1=CC=C2C=C3C(=CC2=C1)C4=CC=CC5=CC6=CC=CC=C6C3=C54	{14: 14}
Did not match all atoms present	84031-17-4	CN1C(CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=C3Cl)COC	{1: 2, 2: 1, 35: 1, 33: 1, 11: 1, 12: 1, 14: 7, 15: 1, 17: 1, 18: 1, 22: 1}
Did not match all atoms present	84057-80-7	CCC(=O)[O-].[Zr+4]	{24: 1, 1: 1, 2: 1}
Did not match all atoms present	84082-95-1	CC1=CC(=C(C=C1S(=O)(=O)CCOS(=O)(=O)[O-])[O-])N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C)[O-].[Na+].[Na+].[Na+].[Cu+2]	{1: 2, 2: 2, 34: 2, 14: 5, 22: 1, 24: 1, 29: 11, 31: 1}
Did not match all atoms present	84083-16-9	C1=CC=C(C=C1)NC2=CC=C(C=C2)NN=C3C=CC(=O)C=C3	{25: 1, 34: 1, 31: 2, 14: 13, 15: 1}
Did not match all atoms present	84087-01-4	C1=CC(=C(C2=NC=C(C=C21)Cl)C(=O)O)Cl	{17: 2, 27: 1, 14: 4, 35: 1}
Did not match all atoms present	841-06-5	CC(C)NC1=NC(=NC(=N1)NCCCOC)SC	{1: 4, 2: 3, 3: 1, 40: 1, 35: 3, 22: 1, 31: 2}
Did not match all atoms present	841-07-6	CCCCC1=CC(=CC(=C1)CCCC)CCCC	{1: 3, 2: 9, 14: 3}
Did not match all atoms present	841-12-3	C1=C/C(=C/NC2=CC=CC(=C2)C(=O)O)/C(=O)C=C1	{6: 1, 14: 8, 15: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	841-32-7	CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)O	{1: 1, 2: 2, 27: 1, 4: 1, 14: 10}
Did not match all atoms present	841-71-4	CC1=CC(=C2C(=CC(=C2C(=C1)C)C(=O)C)C(=O)C)C	{24: 2, 1: 5, 14: 3}
Did not match all atoms present	841-76-9	C1=CC=C(C=C1)[Al](C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	841-77-0	C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=CC=C3	{11: 4, 32: 1, 3: 1, 14: 10, 33: 1}
Did not match all atoms present	84100-59-4	CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)Cl	{1: 1, 35: 1, 33: 1, 14: 8, 17: 1}
Did not match all atoms present	84110-40-7	B(CC(C)C)(O)O	{1: 2, 2: 1, 3: 1, 20: 2}
Did not match all atoms present	84194-36-5	C1=CC(=C(C=C1F)Cl)C=O	{16: 1, 17: 1, 26: 1, 14: 3}
Did not match all atoms present	84196-28-1	CC1=NN(C(=C1N=NC2=CC=CC=C2O)O)C3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)NC7=CC(=C(C=C7)/C=C/C8=C(C=C(C=C8)N9C(=C(C(=N9)C)N=NC1=C(C=CC(=C1)S(=O)(=O)[O-])O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Cu].[Cu]	{1: 2, 34: 4, 35: 5, 6: 4, 33: 2, 14: 24, 21: 4, 29: 15, 31: 3}
Did not match all atoms present	842-00-2	CCS(=O)(=O)C1=CC=C(C2=CC=CC=C21)S(=O)(=O)N	{1: 1, 2: 1, 30: 1, 29: 4, 14: 6}
Did not match all atoms present	842-07-9	C1=CC=C(C=C1)NN=C2C(=O)C=CC3=CC=CC=C32	{25: 1, 34: 1, 31: 1, 14: 11, 15: 1}
Did not match all atoms present	842-18-2	C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[K+].[K+]	{21: 1, 14: 5, 29: 6}
Did not match all atoms present	842-19-3	C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+]	{21: 1, 14: 5, 29: 6}
Did not match all atoms present	84215-62-3	CC1=C(C=CC(=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)[O-])NC4=CC(=C(C=C4)N=NC5=CC(=C6C=CC=C(C6=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC7=C(C8=CC(=CC(=C8C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 35: 3, 14: 19, 29: 18, 31: 3}
Did not match all atoms present	84228-44-4	COC(=O)C1=CC(=C(C=C1)N)Cl	{1: 1, 28: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	84246-29-7	C1(C(S(=O)(=O)NS(=O)(=O)C1(F)F)(F)F)(F)F	{16: 6, 32: 1, 13: 3, 29: 4}
Did not match all atoms present	84254-97-7	C1CCN(CC1)C2(CCN(CC2)CC3=CC=CC=C3)C#N	{33: 2, 2: 1, 37: 1, 11: 9, 13: 1, 14: 5}
Did not match all atoms present	84258-49-1	CCN1C2=CC=CC=C2C(C1=O)C	{1: 2, 2: 1, 33: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	84258-62-8	CC1=CC=CC2=C1C3=C(C=C2)SC4=CC=CC=C43	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	84258-63-9	CC1=CC2=C(C=C1)C3=C(C=C2)SC4=CC=CC=C43	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	84258-70-8	CC1=CC2=CC=CC=C2C3=C1SC4=CC=CC=C43	{1: 1, 14: 9, 41: 1}
Did not match all atoms present	84284-91-3	[B]OCC	{1: 1, 2: 1, 22: 1}
Did not match all atoms present	843-34-5	CC(=O)NC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)O	{1: 1, 6: 2, 14: 8, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	843-55-0	C1CCC(CC1)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O	{11: 5, 13: 1, 14: 8, 21: 2}
Did not match all atoms present	84303-47-9	C1=CC(=C(C(=C1C2=CC(=C(C(=C2)Br)Br)Br)Br)Br)Br	{18: 6, 14: 4}
Did not match all atoms present	84315-23-1	C1=C(C=C(C=C1F)F)/C=C/C(=O)O	{16: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	84348-86-7	C1=C(C(=C(C(=C1F)F)F)N=C=S)F	{8: 1, 16: 4, 34: 1, 14: 1}
Did not match all atoms present	84355-05-5	C1=CC(=CC=C1CS(=O)(=O)CC2=CC=C(C=C2)Cl)Cl	{17: 2, 2: 2, 29: 2, 14: 8}
Did not match all atoms present	84359-31-9	O.[O-]P(=O)([O-])[O-].[Cr+3]	{29: 4}
Did not match all atoms present	84370-87-6	COC1=CC(=C(C=C1)N=C=O)OC	{1: 2, 34: 1, 8: 1, 14: 3, 22: 2, 29: 1}
Did not match all atoms present	84371-65-3	CC#C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CC[C@@H]23)C5=CC=C(C=C5)N(C)C)C)O	{1: 4, 33: 1, 10: 2, 11: 7, 12: 3, 13: 2, 14: 5, 15: 3, 20: 1, 25: 1}
Did not match all atoms present	84381-54-4	CCN(CC)C1=CC=C(C=C1)N=C=S	{1: 2, 2: 2, 33: 1, 8: 1, 34: 1, 14: 4}
Did not match all atoms present	84387-89-3	C1=CC2=C(C=C1[N+](=O)[O-])C(=NS2)N	{38: 1, 41: 1, 35: 1, 30: 1, 14: 3}
Did not match all atoms present	84396-62-3	C1C2CC3CC1CC(C2)(C3)C4=CNN=C4	{32: 1, 35: 1, 11: 6, 12: 3, 13: 1, 14: 2}
Did not match all atoms present	844-51-9	C1=CC=C(C=C1)C2=CC(=O)C(=CC2=O)C3=CC=CC=C3	{25: 2, 14: 12, 15: 2}
Did not match all atoms present	84434-11-7	CCOP(=O)(C1=CC=CC=C1)C(=O)C2=C(C=C(C=C2C)C)C	{1: 4, 2: 1, 14: 7, 22: 1, 24: 1, 29: 1}
Did not match all atoms present	84434-42-4	CC1=C(C=CC(=C1N)N=NC2=CC=CC=C2)N	{1: 1, 34: 2, 30: 2, 14: 7}
Did not match all atoms present	84434-45-7	CC1=CC=CC=C1N=NC2=C(C(=C(C=C2)N)C)N	{1: 2, 34: 2, 30: 2, 14: 6}
Did not match all atoms present	84434-48-0	CC1=C(C(=O)N(N1)C2=CC=C(C=C2)S(=O)(=O)[O-])/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C.[Na+].[Na+]	{32: 1, 1: 2, 35: 1, 6: 1, 33: 2, 14: 8, 15: 2, 25: 2, 29: 6}
Did not match all atoms present	84449-09-2	CC(C)(C)C1=C(SS1)C(C)(C)C	{1: 6, 4: 2, 41: 2}
Did not match all atoms present	84451-42-3	C1C2C=CC2CS1(=O)=O	{11: 2, 12: 2, 29: 2, 14: 2}
Did not match all atoms present	84455-53-8	CC1(C2=CC=CC=C2[N+](=C1/C=C/C3=CC=C(C=C3)N(C)C)C)C.OS(=O)(=O)O	{1: 5, 6: 2, 33: 2, 13: 1, 14: 8, 15: 1, 20: 2, 29: 2}
Did not match all atoms present	84473-83-6	C1=CC(=C(C(=C1)Cl)C(Cl)(Cl)Cl)F	{16: 1, 17: 4, 4: 1, 14: 3}
Did not match all atoms present	84483-22-7	CC1=CC(=C(C(=C1Cl)Br)N)Br	{1: 1, 18: 2, 30: 1, 14: 1, 17: 1}
Did not match all atoms present	84501-54-2	[Li+].CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)C(=O)[O-]	{24: 2, 1: 1, 2: 17, 14: 4, 31: 1}
Did not match all atoms present	84501-71-3	CC(C)CCCCCC(=O)[O-].[K+]	{24: 1, 1: 2, 2: 5, 3: 1}
Did not match all atoms present	84501-72-4	CC(C)CCCCCC(=O)[O-].[Na+]	{24: 1, 1: 2, 2: 5, 3: 1}
Did not match all atoms present	84504-69-8	C1=CC(=C(C=C1Cl)C2=NC(=NC(=N2)N)N)Cl.C(=C\C(=O)O)\C(=O)O	{35: 3, 6: 2, 14: 3, 17: 2, 27: 2, 30: 2}
Did not match all atoms present	84540-59-0	CC1=C(C=C(C=C1)CCl)[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	84540-76-1	CCCCC[C@@H](C)C1=CC=C(C=C1)OP(=S)(OC2=CC=CC(=C2)[C@H](C)CCCCC)S	{1: 4, 2: 8, 3: 2, 39: 1, 14: 8, 22: 2}
Did not match all atoms present	84545-30-2	C1=CN(N=C1NC(=NCC(F)(F)F)N)CCCCC(=O)N	{33: 1, 2: 5, 35: 1, 4: 1, 7: 1, 34: 1, 14: 2, 16: 3, 24: 1, 30: 2, 31: 1}
Did not match all atoms present	84562-48-1	CN(C)C1=CC(=C(C=C1)C=O)OC	{1: 3, 26: 1, 22: 1, 14: 3, 33: 1}
Did not match all atoms present	84563-49-5	C=COCCOC1=CC=C(C=C1)OCCOC=C	{22: 4, 2: 4, 14: 4, 5: 2, 6: 2}
Did not match all atoms present	84573-73-9	CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Eu+3]	{24: 3, 1: 6, 2: 12, 3: 3}
Did not match all atoms present	84583-53-9	CC1=CC2=CC=CNC2=CC1=O	{32: 1, 1: 1, 14: 5, 25: 1}
Did not match all atoms present	846-35-5	C1=CC=C2C(=C1)C=CC3=C2C4=CSC5=CC=CC=C5C4=N3	{41: 1, 35: 1, 14: 11}
Did not match all atoms present	846-49-1	C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)O)Cl	{32: 1, 35: 1, 12: 1, 14: 7, 15: 1, 17: 2, 20: 1, 25: 1}
Did not match all atoms present	846-50-4	CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)O)C3=CC=CC=C3	{1: 1, 35: 1, 33: 1, 12: 1, 14: 8, 15: 1, 17: 1, 20: 1, 25: 1}
Did not match all atoms present	846-63-9	C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC4=CC=CC=C43	{35: 1, 14: 13, 23: 1}
Did not match all atoms present	84604-20-6	COC1=C(C=CC(=C1)[C@@H]2[C@@H](OC3=C(O2)C=C(C=C3)[C@H]4C(C(=O)C5=C(C=C(C=C5O4)O)O)O)CO)O	{1: 1, 2: 1, 12: 4, 14: 8, 20: 2, 21: 3, 22: 1, 23: 3, 25: 1}
Did not match all atoms present	84604-70-6	C1CC1(C2=C(C=C(C=C2)Cl)Cl)C(=O)O	{27: 1, 17: 2, 11: 2, 13: 1, 14: 3}
Did not match all atoms present	84605-25-4	CCCCCC(C)C1=CC=CC=C1O	{1: 2, 2: 4, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	84615-33-8	C1=CC(=S)C=CC1=S	{14: 4, 15: 2}
Did not match all atoms present	84620-34-8	CC1CC2=C(CC(S1)C)C(=CC=C2)[O-].CC1CC2=C(CC(S1)C)C(=CC=C2)[O-].[Ca+2]	{1: 4, 11: 4, 12: 4, 14: 6, 41: 2}
Did not match all atoms present	84625-60-5	CC(C)CCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC2=CC=CC=C2.[Cl-]	{1: 2, 2: 17, 3: 1, 11: 2, 14: 5, 15: 1, 17: 1, 35: 1, 20: 1}
Did not match all atoms present	84665-66-7	C1=CC=C(C(=C1)C(=O)[O-])C(=O)O[O-].O.O.O.O.O.O.[Mg+2]	{24: 1, 28: 1, 29: 1, 14: 4}
Did not match all atoms present	84678-75-1	C[Si](C)(C)OC(=O)C1CCCC1	{1: 3, 11: 4, 12: 1, 28: 1}
Did not match all atoms present	84682-27-9	CC1=CC=C(C=C1)C2(CCCCC2)C(=O)O	{27: 1, 1: 1, 11: 5, 13: 1, 14: 4}
Did not match all atoms present	84698-58-8	C1=CC=C(C(=C1)C(=O)O)C(=O)O[O-].C1=CC=C(C(=C1)C(=O)O)C(=O)O[O-].O.O.O.O.O.O.[Mg+2]	{27: 2, 28: 2, 29: 2, 14: 8}
Did not match all atoms present	847-25-6	CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O	{1: 1, 2: 1, 3: 3, 14: 4, 17: 2, 20: 2, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	847-51-8	C1=CC(=C(C=C1N)O)NC(=O)C(C(C(F)(F)F)(F)F)(F)F	{4: 3, 14: 3, 16: 7, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	84732-26-3	C1=CC2=C(C=C(C=C2C(=C1)S(=O)(=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-].[NH4+].[NH4+]	{38: 1, 29: 6, 14: 5}
Did not match all atoms present	84732-27-4	C=CC(=O)OCCOC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O	{2: 2, 5: 1, 6: 1, 14: 3, 27: 2, 28: 2}
Did not match all atoms present	84732-28-5	CC1=C(C=C(C=C1)NC(=O)OCCOC(=O)C=C)NC(=O)N2CCCCCC2=O	{1: 1, 2: 2, 5: 1, 6: 1, 33: 1, 11: 5, 14: 3, 24: 1, 25: 1, 28: 2, 31: 2}
Did not match all atoms present	84732-30-9	CCN(CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)O.C(CO)N(CCO)CCO	{1: 2, 2: 8, 33: 2, 34: 4, 14: 12, 20: 4, 29: 2}
Did not match all atoms present	84732-31-0	[Li+].[Li+].CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(/C(=N\NC3=CC=CC=C3)/C2=O)S(=O)(=O)[O-]	{1: 1, 34: 1, 14: 8, 15: 2, 24: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	84732-32-1	[Li+].CCN(CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)S(=O)(=O)[O-]	{1: 2, 2: 2, 33: 1, 34: 4, 14: 12, 29: 3}
Did not match all atoms present	84732-33-2	CC1=CC(=CC=C1)N=NC2=C3C=C(C=CC3=C(C=C2)NN=C4C=CC(=O)C=C4)S(=O)(=O)[O-].[Na+]	{1: 1, 34: 3, 14: 13, 15: 1, 25: 1, 29: 3, 31: 1}
Did not match all atoms present	84732-34-3	C1=CC(=CC=C1N=O)[O-].C1=CC(=CC=C1N=O)[O-].[Mg+2]	{34: 2, 29: 2, 14: 8}
Did not match all atoms present	84732-35-4	CCCCCCCCCC1=CC=C(C=C1)O.CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O.C=O	{1: 6, 2: 9, 4: 2, 5: 1, 14: 8, 21: 2}
Did not match all atoms present	84732-37-6	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=CC(=O)OCCOC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O.C1C(O1)CCl	{1: 2, 2: 3, 4: 1, 5: 1, 6: 1, 11: 1, 12: 1, 14: 11, 17: 1, 21: 2, 23: 1, 27: 2, 28: 2}
Did not match all atoms present	84753-04-8	CCCCCCCCC(C(CCCCCCCC(=O)[O-])O)O.[NH4+]	{24: 1, 1: 1, 2: 14, 3: 2, 20: 2}
Did not match all atoms present	84756-01-4	[CH-]1[CH-][CH-][C-]([CH-]1)SCCS[C-]2C=CC=C2.[Fe]	{40: 2, 2: 2, 14: 8}
Did not match all atoms present	84779-61-3	CCN(CC)CC#C.OS(=O)(=O)O	{1: 2, 2: 3, 33: 1, 9: 1, 10: 1, 20: 2, 29: 2}
Did not match all atoms present	84787-99-5	CN1C=C[N+](=C1N=NC2=CC(=C(C=C2OC)N(C)C)OC)C.COS(=O)(=O)[O-]	{1: 7, 34: 2, 33: 3, 14: 4, 22: 3, 29: 3}
Did not match all atoms present	84788-00-1	CCN(CC)C1=CC=C(C=C1)N=NC2=[N+](N(C3=CC=CC=C32)C)C.COS(=O)(=O)[O-]	{1: 5, 2: 2, 33: 3, 34: 2, 14: 8, 22: 1, 29: 3}
Did not match all atoms present	84788-01-2	CN1C=NN(C1N/N=C/2\C3=CC=CC=C3N=C2C4=CC=CC=C4)C.[Cl-]	{1: 2, 34: 1, 35: 2, 33: 2, 12: 1, 14: 10, 15: 2, 17: 1, 31: 1}
Did not match all atoms present	84788-21-6	C1=CC=[N+](C=C1)CC2=CC=CC=C2S(=O)(=O)[O-]	{33: 1, 2: 1, 29: 3, 14: 9}
Did not match all atoms present	848-53-3	CN1CCCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl	{1: 1, 3: 1, 33: 2, 11: 5, 14: 9, 17: 1}
Did not match all atoms present	848-75-9	CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)O)C3=CC=CC=C3Cl	{1: 1, 35: 1, 33: 1, 12: 1, 14: 7, 15: 1, 17: 2, 20: 1, 25: 1}
Did not match all atoms present	84814-06-2	CC(C)(C)N(/C=C/N(C(C)(C)C)[Si](C)(C)C)[Si](C)(C)C	{1: 12, 4: 2, 6: 2, 33: 2}
Did not match all atoms present	84814-07-3	CC(C)(C)N/C=C\N(C(C)(C)C)[Si](C)(C)C	{1: 9, 4: 2, 33: 1, 6: 2, 31: 1}
Did not match all atoms present	84814-09-5	CC(C)(C)N1C=CN([Si]1(C)C)C(C)(C)C	{1: 8, 4: 2, 14: 2, 33: 2}
Did not match all atoms present	84819-41-0	B1(OCC(O1)CCCCCCCCCCCCCC)O	{1: 1, 2: 13, 11: 1, 12: 1, 20: 1, 23: 2}
Did not match all atoms present	84821-53-4	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Ru+2]	{1: 10, 13: 2, 15: 6}
Did not match all atoms present	84823-11-0	C1CCC2C(C1)C3NC4C5CCC(CC5C(N4)NC6C7CC(CCC7C([N-]6)NC8C9CCC(CC9C(N8)NC2[N-]3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].C(CO)[NH+](CCO)CCO.C(CO)[NH+](CCO)CCO.C(CO)[NH+](CCO)CCO.[Cu+2]	{32: 6, 2: 18, 35: 2, 11: 13, 12: 19, 20: 9, 29: 9}
Did not match all atoms present	84827-78-1	CN1C(=NC(=N1)N)SC	{40: 1, 1: 2, 35: 2, 30: 1, 33: 1}
Did not match all atoms present	84850-16-8	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC=C5C6=C4O6	{14: 12, 23: 1}
Did not match all atoms present	84852-23-3	C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)O)N)S(=O)(=O)[O-])S(=O)(=O)[O-].[K+].[K+]	{30: 1, 20: 1, 29: 8, 14: 4}
Did not match all atoms present	84852-37-9	CC(C)CCCCCC(=O)[O-].CC(C)CCCCCC(=O)[O-].[Ni+2]	{24: 2, 1: 4, 2: 10, 3: 2}
Did not match all atoms present	849-01-4	C1=CC=C(C=C1)C(=CC(=O)C2=CC=CC=C2)C3=CC=CC=C3	{24: 1, 14: 15, 6: 1, 7: 1}
Did not match all atoms present	849-55-8	CC(CCC1=CC=CC=C1)[NH2+]C(C)C(C2=CC=C(C=C2)O)O.[Cl-]	{1: 2, 2: 2, 3: 3, 14: 9, 17: 1, 20: 1, 21: 1}
Did not match all atoms present	84928-99-4	C(CN(CCN=[N+]=[N-])CCN=[N+]=[N-])N=[N+]=[N-]	{33: 1, 2: 6, 34: 6}
Did not match all atoms present	84954-89-2	C1/C/2=C\3/C=C\C\4=C(/C=C2)\CCC5=C(C=C(C(=C5)C1)CC3)CC4	{11: 8, 14: 6, 15: 4}
Did not match all atoms present	85-00-7	C1C[N+]2=CC=CC=C2C3=CC=CC=[N+]31.[Br-].[Br-]	{33: 2, 18: 2, 11: 2, 14: 8}
Did not match all atoms present	85-01-8	C1=CC=C2C(=C1)C=CC3=CC=CC=C32	{14: 10}
Did not match all atoms present	85-02-9	C1=CC=C2C(=C1)C=CC3=C2C=CC=N3	{35: 1, 14: 9}
Did not match all atoms present	85-04-1	CC(=O)NC1=C(C=CC2=CC=CC=C21)OC	{24: 1, 1: 2, 22: 1, 14: 6, 31: 1}
Did not match all atoms present	85-06-3	CC1=NC2=C(C=C1)C3=CC=CC=C3C=C2	{1: 1, 35: 1, 14: 8}
Did not match all atoms present	85-07-4	CC1=C(C2=CC=CC=C2C=C1)CC(=O)N	{24: 1, 1: 1, 2: 1, 30: 1, 14: 6}
Did not match all atoms present	85-08-5	CC1=C(C2=CC=CC=C2C=C1)CC(=O)O	{1: 1, 2: 1, 27: 1, 14: 6}
Did not match all atoms present	85-09-6	C1=CC=C2C(=C1)C=CC(=C2CS(=O)(=O)O)N	{2: 1, 30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	85-11-0	C1=CC=C(C=C1)NNC2=C3C=CC(=O)C=C3C(=N)C=C2	{25: 1, 31: 2, 36: 1, 14: 10, 15: 4}
Did not match all atoms present	85-15-4	CC1=NC2=C(O1)C=CC3=CC=CC=C32	{1: 1, 35: 1, 14: 6, 23: 1}
Did not match all atoms present	85-18-7	CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl	{32: 1, 1: 2, 35: 1, 33: 2, 17: 1, 25: 2}
Did not match all atoms present	85-19-8	C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)O	{24: 1, 17: 1, 21: 1, 14: 8}
Did not match all atoms present	85-22-3	CCC1=C(C(=C(C(=C1Br)Br)Br)Br)Br	{1: 1, 2: 1, 18: 5}
Did not match all atoms present	85-28-9	COC1=CC(=C(C=C1)C(=O)C2=CC=C(C=C2)Cl)O	{1: 1, 14: 7, 17: 1, 21: 1, 22: 1, 24: 1}
Did not match all atoms present	85-29-0	C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)Cl)Cl	{24: 1, 17: 2, 14: 8}
Did not match all atoms present	85-31-4	C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)NC(=NC2=S)N	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 1, 20: 3, 23: 1, 30: 1}
Did not match all atoms present	85-32-5	C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)NC(=NC2=O)N	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 1, 20: 4, 22: 1, 23: 1, 25: 1, 29: 1, 30: 1}
Did not match all atoms present	85-34-7	C1=CC(=C(C(=C1Cl)CC(=O)O)Cl)Cl	{17: 3, 2: 1, 27: 1, 14: 2}
Did not match all atoms present	85-36-9	CC(=O)NC1=C(C=C(C(=C1I)C(=O)O)I)I	{1: 1, 14: 1, 19: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	85-38-1	C1=CC(=C(C(=C1)[N+](=O)[O-])O)C(=O)O	{38: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	85-41-6	C1=CC=C2C(=C1)C(=O)NC2=O	{32: 1, 25: 2, 14: 4}
Did not match all atoms present	85-44-9	C1=CC=C2C(=C1)C(=O)OC2=O	{28: 2, 14: 4}
Did not match all atoms present	85-45-0	COC1=C(C=CC=C1[N+](=O)[O-])N	{1: 1, 30: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	85-46-1	C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)Cl	{17: 1, 29: 2, 14: 7}
Did not match all atoms present	85-47-2	C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)O	{20: 1, 29: 2, 14: 7}
Did not match all atoms present	85-48-3	C1=CC2=C(C(=C1)S(=O)(=O)O)N=CC=C2	{35: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	85-52-9	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O	{24: 1, 27: 1, 14: 9}
Did not match all atoms present	85-54-1	C1=CC=C(C(=C1)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)O	{24: 1, 17: 1, 27: 1, 38: 1, 14: 7}
Did not match all atoms present	85-55-2	CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O	{24: 1, 1: 1, 27: 1, 14: 8}
Did not match all atoms present	85-60-9	CCCC(C1=CC(=C(C=C1C)O)C(C)(C)C)C2=CC(=C(C=C2C)O)C(C)(C)C	{1: 9, 2: 2, 3: 1, 4: 2, 14: 4, 21: 2}
Did not match all atoms present	85-61-0	CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCS)O	{1: 2, 2: 6, 3: 1, 4: 1, 33: 1, 39: 1, 12: 4, 14: 2, 35: 3, 20: 6, 22: 4, 23: 1, 24: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	85-64-3	CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)O)OC)OC	{1: 4, 2: 1, 33: 1, 11: 2, 12: 1, 14: 5, 21: 1, 22: 3}
Did not match all atoms present	85-66-5	CN1C2=CC=CC=C2N=C3C1=CC=CC3=O	{1: 1, 35: 1, 33: 1, 14: 7, 25: 1}
Did not match all atoms present	85-67-6	C1=CC(=CC=C1N)N=NC2=C3C=CC(=CC3=C(C=C2)N)S(=O)(=O)O	{30: 2, 34: 2, 20: 1, 29: 2, 14: 9}
Did not match all atoms present	85-68-7	CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2	{1: 1, 2: 4, 28: 2, 14: 9}
Did not match all atoms present	85-69-8	CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCCCC	{1: 3, 2: 8, 3: 1, 28: 2, 14: 4}
Did not match all atoms present	85-70-1	CCCCOC(=O)COC(=O)C1=CC=CC=C1C(=O)OCCCC	{1: 2, 2: 7, 28: 3, 14: 4}
Did not match all atoms present	85-72-3	CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2C(=O)O	{24: 1, 1: 1, 27: 1, 14: 8, 31: 1}
Did not match all atoms present	85-73-4	C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)C(=O)O	{35: 1, 41: 1, 14: 10, 24: 1, 27: 1, 29: 2, 31: 2}
Did not match all atoms present	85-74-5	C1=CC2=C(C=CC(=C2C=C1S(=O)(=O)O)S(=O)(=O)O)N	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	85-75-6	C1=CC2=C(C=CC(=C2C=C1S(=O)(=O)O)N)S(=O)(=O)O	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	85-77-8	C1=CC(=CC=C1N)N=NC2=C3C=C(C=CC3=C(C=C2)N)S(=O)(=O)O	{30: 2, 34: 2, 20: 1, 29: 2, 14: 9}
Did not match all atoms present	85-79-0	CCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)NCCN(CC)CC	{1: 3, 2: 7, 35: 1, 33: 1, 14: 5, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	85-81-4	COC1=CC(=C2C(=C1)C=CC=N2)[N+](=O)[O-]	{38: 1, 1: 1, 35: 1, 22: 1, 14: 5}
Did not match all atoms present	85-82-5	CC1=CC(=C(C=C1)C)N/N=C\2/C(=O)C=CC3=CC=CC=C32	{1: 2, 34: 1, 14: 9, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	85-83-6	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N/N=C\3/C(=O)C=CC4=CC=CC=C43)C	{1: 2, 34: 3, 14: 13, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	85-84-7	C1=CC=C(C=C1)N=NC2=C(C=CC3=CC=CC=C32)N	{34: 2, 30: 1, 14: 11}
Did not match all atoms present	85-85-8	C1=CC=C2C(=C1)C=CC(=O)C2=NNC3=CC=CC=N3	{34: 1, 35: 1, 14: 10, 15: 1, 25: 1, 31: 1}
Did not match all atoms present	85-86-9	C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N/N=C\3/C(=O)C=CC4=CC=CC=C43	{25: 1, 34: 3, 31: 1, 14: 15, 15: 1}
Did not match all atoms present	85-90-5	CC1=COC2=CC=CC=C2C1=O	{1: 1, 25: 1, 14: 5, 23: 1}
Did not match all atoms present	85-91-6	CNC1=CC=CC=C1C(=O)OC	{1: 2, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	85-95-0	CCC(C1=CC=C(C=C1)O)C(CC)C(C)C2=CC=C(C=C2)O	{1: 3, 2: 2, 3: 3, 21: 2, 14: 8}
Did not match all atoms present	85-97-2	C1=CC=C(C=C1)C2=C(C(=CC=C2)Cl)O	{17: 1, 21: 1, 14: 8}
Did not match all atoms present	85-98-3	CCN(C1=CC=CC=C1)C(=O)N(CC)C2=CC=CC=C2	{24: 1, 1: 2, 2: 2, 14: 10, 33: 2}
Did not match all atoms present	85-99-4	CC(=O)NC1=CC=CC=C1C(=O)C2=CC=CC=C2	{24: 2, 1: 1, 14: 9, 31: 1}
Did not match all atoms present	850-57-7	CN1CC[C@]23[C@@H]4C(=CC=C2[C@H]1CC5=C3C(=C(C=C5)OC)O4)OC.Cl	{1: 3, 33: 1, 11: 3, 12: 2, 13: 1, 14: 4, 15: 2, 17: 1, 22: 2, 23: 1}
Did not match all atoms present	85006-31-1	CC1=CSC(=C1N)C(=O)OC	{1: 2, 28: 1, 30: 1, 14: 1, 41: 1}
Did not match all atoms present	85011-89-8	CC(C)NC1=C2C(=O)[C@@H]3C=CC=C([C@H]3C(=O)C2=C(C=C1)NC4=CC=C(C=C4)C(C)(C)C)O	{1: 5, 3: 1, 4: 1, 12: 2, 14: 9, 15: 1, 20: 1, 25: 2, 31: 2}
Did not match all atoms present	85013-98-5	CC(=O)C1=CC=C(C=C1)OC(F)(F)F	{1: 1, 4: 1, 14: 4, 16: 3, 22: 1, 24: 1}
Did not match all atoms present	85017-80-7	[Li+].O.[I-]	{19: 1}
Did not match all atoms present	85019-62-1	CCC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N	{1: 1, 2: 4, 37: 1, 33: 1, 11: 3, 12: 1, 14: 6, 15: 1, 24: 1}
Did not match all atoms present	85019-63-2	CCCC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N	{1: 1, 2: 5, 37: 1, 33: 1, 11: 3, 12: 1, 14: 6, 15: 1, 24: 1}
Did not match all atoms present	85019-64-3	CC(C)CC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N	{1: 2, 2: 4, 3: 1, 37: 1, 33: 1, 11: 3, 12: 1, 14: 6, 15: 1, 24: 1}
Did not match all atoms present	85019-65-4	CC(C)C(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N	{1: 2, 2: 3, 3: 1, 37: 1, 33: 1, 11: 3, 12: 1, 14: 6, 15: 1, 24: 1}
Did not match all atoms present	85019-67-6	CCC(=O)N(CC1=CC=CC=C1)C2=C(CCCC2)CCC#N	{1: 1, 2: 4, 37: 1, 33: 1, 11: 4, 14: 5, 15: 2, 24: 1}
Did not match all atoms present	85019-68-7	CCCC(=O)N(CC1=CC=CC=C1)C2=C(CCCC2)CCC#N	{1: 1, 2: 5, 37: 1, 33: 1, 11: 4, 14: 5, 15: 2, 24: 1}
Did not match all atoms present	85019-69-8	CCCCC(=O)N(CC1=CC=CC=C1)C2=C(CCCC2)CCC#N	{1: 1, 2: 6, 37: 1, 33: 1, 11: 4, 14: 5, 15: 2, 24: 1}
Did not match all atoms present	85028-86-0	CC1=CC(=C(C(=C1)C)P=PC2=C(C=C(C=C2C(C)(C)C)C(C)(C)C)C(C)(C)C)C	{1: 12, 4: 3, 14: 4}
Did not match all atoms present	85030-22-4	CC1=C(C=CC(=C1)N)N=NC2=[N+](C3=CC=CC=C3S2)C.COS(=O)(=O)[O-]	{1: 3, 34: 2, 33: 1, 41: 1, 14: 7, 22: 1, 29: 3, 30: 1}
Did not match all atoms present	85031-41-0	CCCCC(=O)N(CC1=CC=CC=C1)C2=CCCCC2CCC#N	{1: 1, 2: 6, 37: 1, 33: 1, 11: 3, 12: 1, 14: 6, 15: 1, 24: 1}
Did not match all atoms present	85057-68-7	C1=CC=C2C(=C1)C=C3C4=C(C=C5C3=C2C6=CC=CC=C65)C7C(O7)C(C4O)O	{20: 2, 12: 4, 14: 10, 23: 1}
Did not match all atoms present	85068-27-5	C1=CC(=C(C=C1F)CC(=O)O)F	{16: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	85068-28-6	C1=CC(=C(C(=C1)F)CC(=O)O)F	{16: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	85068-29-7	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CN	{16: 6, 2: 1, 4: 2, 30: 1, 14: 3}
Did not match all atoms present	85068-30-0	CCC(=O)C1=C(C=C(C=C1)F)F	{16: 2, 1: 1, 2: 1, 14: 3, 24: 1}
Did not match all atoms present	85068-31-1	CCC(=O)C1=C(C=CC=C1F)F	{16: 2, 1: 1, 2: 1, 14: 3, 24: 1}
Did not match all atoms present	85068-32-2	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CC#N	{16: 6, 2: 1, 4: 2, 37: 1, 14: 3}
Did not match all atoms present	85068-33-3	C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CC(=O)O	{16: 6, 2: 1, 27: 1, 4: 2, 14: 3}
Did not match all atoms present	85068-34-4	CCC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{1: 1, 2: 1, 4: 2, 14: 3, 16: 6, 24: 1}
Did not match all atoms present	85068-35-5	C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)F)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	85068-36-6	C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)F)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	85068-73-1	CCN(CCO[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 22: 1, 33: 1}
Did not match all atoms present	85070-47-9	C1=CC(=C(C(=C1)Cl)F)CBr	{16: 1, 17: 1, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	85070-48-0	C1=CC(=C(C(=C1)Cl)F)C=O	{16: 1, 17: 1, 26: 1, 14: 3}
Did not match all atoms present	85089-31-2	CC1=C(C(=CC=C1)Cl)F	{16: 1, 1: 1, 14: 3, 17: 1}
Did not match all atoms present	85117-97-1	CCCCN(CCCC)C1=NC(=C2C(=N1)OC3=C(C24C5=CC=CC=C5C(=O)O4)C=CC(=C3)N(CC)CC)C	{1: 5, 2: 8, 35: 2, 33: 2, 13: 1, 14: 7, 23: 1, 28: 1}
Did not match all atoms present	85117-99-3	C1=CC(=C(C=C1F)CBr)F	{16: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	85118-00-9	C1=CC(=C(C(=C1)F)CBr)F	{16: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	85118-01-0	C1=CC(=C(C=C1CBr)F)F	{16: 2, 2: 1, 18: 1, 14: 3}
Did not match all atoms present	85118-02-1	C1=CC(=C(C=C1F)F)C(=O)N	{16: 2, 24: 1, 30: 1, 14: 3}
Did not match all atoms present	85118-03-2	C1=CC(=C(C=C1F)C(=O)N)F	{16: 2, 24: 1, 30: 1, 14: 3}
Did not match all atoms present	85118-04-3	C1=CC(=C(C=C1C(=O)N)F)F	{16: 2, 24: 1, 30: 1, 14: 3}
Did not match all atoms present	85118-05-4	C1=CC(=C(C=C1CO)F)F	{16: 2, 2: 1, 20: 1, 14: 3}
Did not match all atoms present	85118-06-5	C1=CC(=C(C=C1F)CN)F	{16: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	85118-07-6	C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)F)F	{16: 2, 24: 1, 14: 8}
Did not match all atoms present	85137-09-3	CCOC1=CC(=C(C=C1)N)N.OS(=O)(=O)O	{1: 1, 2: 1, 14: 3, 20: 2, 22: 1, 29: 2, 30: 2}
Did not match all atoms present	85153-20-4	CC\1=CC(=O)C(=C/C1=N/NC2=C(C=C(C=C2)C3=CC(=C(C=C3)N/N=C\4/C(=CC5=C(C4=O)C=CC(=C5N=NC6=CC=CC7=NNN=C76)N)S(=O)(=O)[O-])OC)OC)C(=O)[O-].[Na+].[Na+]	{32: 1, 1: 3, 34: 4, 35: 2, 14: 14, 15: 5, 22: 2, 24: 1, 25: 2, 29: 3, 30: 1, 31: 2}
Did not match all atoms present	85153-34-0	CCCCCCCC[N+](C)(C)C.COP(=O)([O-])OC	{1: 6, 2: 7, 29: 2, 22: 2}
Did not match all atoms present	85187-33-3	CC1=C(C=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C(=C)Br)N=NC3=C(C=CC4=C3C=CC(=C4)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[Na+].[Na+]	{1: 1, 34: 2, 5: 1, 7: 1, 14: 11, 18: 1, 24: 1, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	85187-44-6	C1=CC(=C(C2=CC(=CC(=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])N)N.C1=CC(=C(C2=CC(=CC(=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])N)N.C1=CC(=C(C2=CC(=CC(=C21)S(=O)(=O)[O-])S(=O)(=O)[O-])N)N.[K+].[K+].[K+].[Fe+3]	{30: 6, 29: 18, 14: 12}
Did not match all atoms present	85187-58-2	CC1=NN(C(=C1N=NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.CC1=NN(C(=O)C1=NN=C2C=C(C=CC2=O)N([O-])[O-])C3=CC=C(C=C3)S(=O)(=O)N.[Na+].[Co+3]	{1: 2, 34: 4, 35: 2, 38: 1, 33: 2, 14: 14, 15: 4, 25: 2, 29: 4, 30: 2}
Did not match all atoms present	85188-11-0	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)[O-])NNC3=C(C=C(C=C3)Cl)S(=O)(=O)[O-].[Na+].[Na+]	{36: 1, 14: 7, 15: 5, 17: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	85191-11-3	C[Si]1(O[Si](O[Si](O[Si](O1)(C)CCCN)(C)CCCN)(C)CCCN)CCCN	{1: 4, 2: 12, 30: 4, 23: 4}
Did not match all atoms present	852-38-0	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN=C(O3)C4=CC=CC=C4	{35: 2, 14: 14, 23: 1}
Did not match all atoms present	852-42-6	COC1=CC=CC=C1OCCOCCOCCN2CCCCC2	{1: 1, 2: 6, 33: 1, 11: 5, 14: 4, 22: 4}
Did not match all atoms present	85202-43-3	C[C-]1[C-]([C-]([C-]([C-]1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[N]=O.[N]=O.[Co].[Co]	{1: 10, 29: 2}
Did not match all atoms present	85222-99-7	C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-].C1=CC(=C(C=C1C(F)(F)F)[N+]#N)Cl	{34: 1, 4: 1, 14: 9, 16: 3, 17: 1, 29: 6}
Did not match all atoms present	85223-01-4	C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)[N+]#N)Cl.C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)[N+]#N)Cl.C(=O)(C(=O)[O-])[O-]	{24: 2, 17: 4, 34: 2, 22: 2, 14: 14}
Did not match all atoms present	85223-09-2	CC\1=NN2C(=NC3=C(C2=O)C=C(C=C3)Cl)/C1=N/NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O	{1: 1, 34: 1, 35: 2, 33: 1, 14: 10, 15: 2, 17: 1, 25: 3, 31: 1}
Did not match all atoms present	85233-19-8	C1=CC=C(C(=C1)N(CC(=O)O)CC(=O)O)OCCOC2=CC=CC=C2N(CC(=O)O)CC(=O)O	{33: 2, 2: 6, 27: 4, 22: 2, 14: 8}
Did not match all atoms present	85237-43-0	C1=CC(=C(C=C1C(F)(F)F)[N+]#N)Cl.C1=CC(=C(C=C1C(F)(F)F)[N+]#N)Cl.[Cl-].[Cl-].[Cl-].[Cl-].[Zn+2]	{16: 6, 17: 6, 34: 2, 4: 2, 14: 6}
Did not match all atoms present	85264-33-1	CC1=CC(=NN1CO)C	{1: 2, 2: 1, 35: 1, 33: 1, 14: 1, 20: 1}
Did not match all atoms present	85272-31-7	CC(C)(C)[Si](C(C)(C)C)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F	{16: 6, 1: 6, 4: 4, 29: 4, 22: 2}
Did not match all atoms present	85280-21-3	CC1=CC(=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)N.[Na+]	{1: 1, 14: 8, 25: 2, 29: 5, 30: 2, 31: 1}
Did not match all atoms present	85283-75-6	CCN(CC[N+](C)(C)C)C1=CC(=C(C=C1)N=NC2=NC(=NS2)C3=CC=CC=C3)C.CC(=O)[O-]	{1: 6, 2: 3, 35: 2, 33: 1, 41: 1, 34: 2, 14: 8, 24: 1}
Did not match all atoms present	85283-95-0	CCN(CC)C1=CC=C(C=C1)/C=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.[O-]S(=O)(=O)[O-]	{1: 5, 2: 2, 6: 2, 33: 2, 13: 1, 14: 8, 15: 1, 29: 4}
Did not match all atoms present	85287-61-2	C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@H](C3=CC=CC=C3)NC(=O)C4=C(NC=N4)C(=O)O)C(=O)[O-])C[N+]5=CC=C(C=C5)CCS(=O)(=O)[O-].[Na+]	{32: 1, 33: 2, 2: 3, 3: 1, 41: 1, 11: 1, 12: 2, 14: 10, 15: 2, 35: 1, 24: 3, 25: 1, 27: 1, 29: 3, 31: 2}
Did not match all atoms present	85294-31-1	[Li+].[Li+].C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]	{34: 3, 38: 1, 14: 11, 15: 2, 25: 1, 29: 6, 30: 1, 31: 1}
Did not match all atoms present	85294-32-2	C1=CC(=C2C=C(C=C(C2=C1N)O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]	{30: 1, 21: 1, 14: 4, 29: 6}
Did not match all atoms present	85294-35-5	CC1CO1.C=O.C1=COC(=C1)CO	{1: 1, 2: 1, 5: 1, 11: 1, 12: 1, 14: 3, 20: 1, 23: 2}
Did not match all atoms present	85298-07-3	COC1=C(C(=C(C=C1Cl)Cl)Cl)OC	{1: 2, 22: 2, 14: 1, 17: 3}
Did not match all atoms present	853-34-9	CC(=O)CCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 2: 2, 33: 2, 12: 1, 14: 10, 24: 1, 25: 2}
Did not match all atoms present	853-35-0	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+]	{25: 2, 29: 6, 14: 6}
Did not match all atoms present	853-39-4	C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)C2=C(C(=C(C(=C2F)F)F)F)F	{16: 10, 24: 1}
Did not match all atoms present	853-68-9	C1=CC2=C(C=C1S(=O)(=O)[O-])C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)[O-].[Na+].[Na+]	{25: 2, 29: 6, 14: 6}
Did not match all atoms present	85303-87-3	CCC1=CC=CC=C1C2=NC(=NN2)C3=CC4=C(C=C3)OCO4	{32: 1, 1: 1, 2: 1, 35: 2, 11: 1, 14: 7, 23: 2}
Did not match all atoms present	85303-89-5	CCCCC1=CC=CC=C1C2=NC(=NN2)C3=CC(=CC=C3)OC	{32: 1, 1: 2, 2: 3, 35: 2, 14: 8, 22: 1}
Did not match all atoms present	85303-91-9	CC1=CC(=C(C=C1)C2=NC(=NN2)C3=CC(=CC=C3)OC)C	{32: 1, 1: 3, 35: 2, 22: 1, 14: 7}
Did not match all atoms present	85303-98-6	CCC1=CC=CC=C1C2=NC(=NN2)C3=CC(=CC=C3)OCC	{32: 1, 1: 2, 2: 2, 35: 2, 14: 8, 22: 1}
Did not match all atoms present	85327-13-5	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)N(CC6=CC=CC=C6)C7CCCCC7	{1: 2, 2: 3, 33: 2, 11: 5, 12: 1, 13: 1, 14: 15, 23: 1, 28: 1}
Did not match all atoms present	85371-59-1	[B-](F)(F)(F)F.CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NN(CN3C)C	{1: 3, 2: 2, 35: 1, 33: 3, 11: 1, 34: 2, 14: 9, 15: 1, 16: 4}
Did not match all atoms present	85371-64-8	CC(C(C)(C)C)N=C(NC#N)NC1=CC=NC=C1	{1: 4, 34: 1, 3: 1, 4: 1, 37: 1, 7: 1, 14: 4, 35: 1, 31: 2}
Did not match all atoms present	85394-19-0	CC1=CN(C(=O)NC1=O)/C=C/C=O	{32: 1, 1: 1, 6: 2, 33: 1, 14: 1, 25: 2, 26: 1}
Did not match all atoms present	854-04-6	C/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C2=CC=C(C=C2)OC	{1: 2, 34: 1, 38: 2, 7: 1, 14: 7, 22: 1, 31: 1}
Did not match all atoms present	85417-41-0	COC1=C(C(=CC=C1)OC)P(C2=C(C=CC=C2OC)OC)C3=C(C=CC=C3OC)OC	{1: 6, 22: 6, 14: 9}
Did not match all atoms present	85419-40-5	CCOC(=O)NC1=CC(=C(C=C1)C)Cl	{1: 2, 2: 1, 14: 3, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	85455-35-2	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(/C(=N\NC3=C(C=CC(=C3)S(=O)(=O)CCOS(=O)(=O)[O-])OC)/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 2: 2, 34: 1, 14: 6, 15: 2, 22: 2, 24: 1, 25: 1, 29: 11, 31: 2}
Did not match all atoms present	85455-74-9	CS(=O)(=O)NCCC1=CC=C(C=C1)NN.Cl	{1: 1, 2: 2, 14: 4, 17: 1, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	85473-32-1	CC1CCCCC1OP(=O)(C)F	{1: 2, 11: 4, 12: 2, 16: 1, 22: 1, 29: 1}
Did not match all atoms present	855-38-9	COC1=CC=C(C=C1)P(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC	{1: 3, 22: 3, 14: 12}
Did not match all atoms present	85509-19-9	C[Si](CN1C=NC=N1)(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F	{1: 1, 2: 1, 35: 2, 33: 1, 14: 10, 16: 2}
Did not match all atoms present	85529-65-3	C[C-]1[C-]([C-]([C-]([C-]1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[CH-]=O.[N-]=O.[Co].[Co]	{1: 10, 29: 2}
Did not match all atoms present	85536-88-5	COC1=CC(=C(C=C1N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C(=O)[O-])OC)S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 2: 2, 35: 1, 33: 1, 12: 1, 34: 2, 14: 6, 15: 1, 22: 3, 24: 1, 25: 1, 29: 8}
Did not match all atoms present	85559-57-5	C[C@]12CC[C@@](C[C@@H]1C3=CCC4[C@]5(CC[C@@H](C(C5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC(=O)/C=C/C(=O)[O-])C)(C)C(=O)[O-].[Na+].[Na+]	{1: 7, 6: 2, 11: 10, 12: 4, 13: 6, 14: 1, 15: 1, 24: 2, 28: 1}
Did not match all atoms present	85567-10-8	C1=CC(=CC=C1N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 1, 2: 2, 35: 1, 12: 1, 34: 2, 14: 8, 15: 1, 22: 1, 24: 1, 25: 1, 29: 8}
Did not match all atoms present	85567-17-5	CN(C1=CC2=C(C=C1)C=C(/C(=N\NC3=C(C=C(C=C3)OC)S(=O)(=O)[O-])/C2=O)S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[K+]	{1: 2, 2: 2, 33: 1, 34: 1, 14: 7, 15: 2, 22: 2, 25: 1, 29: 11, 31: 1}
Did not match all atoms present	85587-35-5	C1=CC(=CC(=C1)N=NC2=C(C=C(C(=C2)N=NC3=CC=C(C=C3)S(=O)(=O)[O-])N)N)N=NC4=C(C=C(C(=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])N)N.[NH4+].[NH4+]	{30: 4, 34: 8, 29: 6, 14: 16}
Did not match all atoms present	85601-30-5	C.OS(=O)(=O)O	{20: 2, 29: 2}
Did not match all atoms present	85603-41-4	C1CC[C@H]([C@H](C1)C(=O)C2=CC=C(C=C2)Br)C(=O)[O-]	{24: 2, 18: 1, 11: 4, 12: 2, 14: 4}
Did not match all atoms present	85616-56-4	CC1=CC2=CC=CC=C2C3=C(C=C4C(=C13)CCC4=O)C	{1: 2, 11: 2, 14: 6, 25: 1}
Did not match all atoms present	85622-95-3	C1=NC(=C2N1C(=O)N(N=N2)CCCl)C(=O)N	{33: 2, 2: 2, 35: 3, 14: 1, 17: 1, 24: 1, 25: 1, 30: 1}
Did not match all atoms present	85625-90-7	CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.C(CC(=O)[O-])CN.[Mn+2]	{1: 2, 2: 6, 3: 1, 4: 1, 20: 2, 24: 3, 30: 1, 31: 1}
Did not match all atoms present	85631-88-5	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC(=C(C=C4)NC5=CC=C(C=C5)N/N=C\6/C=CC(=O)C=C6N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 4, 14: 17, 15: 4, 25: 2, 29: 9, 30: 2, 31: 3}
Did not match all atoms present	85650-44-8	C1=CC=C(C=C1)C2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(/C(=N\NC5=CC=CC=C5)/C4=O)S(=O)(=O)[O-].[Na+].[Na+]	{34: 1, 35: 3, 14: 13, 15: 2, 17: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	85650-52-8	CN1CCN2C(C1)C3=CC=CC=C3CC4=C2N=CC=C4	{1: 1, 35: 1, 33: 2, 11: 4, 12: 1, 14: 7}
Did not match all atoms present	85665-88-9	CC1=CC(=NC=C1)CC(C)C	{1: 3, 2: 1, 3: 1, 14: 3, 35: 1}
Did not match all atoms present	85666-02-0	C1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OCCCS(=O)(=O)[O-].[Na+]	{2: 3, 14: 10, 22: 1, 25: 2, 29: 3, 30: 1, 31: 1}
Did not match all atoms present	85668-72-0	CCCC(CCC)(C1=CC=C(C=C1)C(C)(C)C)C(CCC)(CCC)C2=CC=C(C=C2)C(C)(C)C	{1: 10, 2: 8, 4: 4, 14: 8}
Did not match all atoms present	85668-73-1	CCCC(CC)(C1=CC=C(C=C1)C(C)(C)C)C(CC)(CCC)C2=CC=C(C=C2)C(C)(C)C	{1: 10, 2: 6, 4: 4, 14: 8}
Did not match all atoms present	85668-74-2	CCC(C)C(C1=CC=C(C=C1)C(C)(C)C)C(CC)(CC)C2=CC=C(C=C2)C(C)(C)C	{1: 10, 2: 3, 3: 2, 4: 3, 14: 8}
Did not match all atoms present	85668-75-3	CC(C)CC(C)(C1=CC=C(C=C1)C(C)(C)C)C(C)(CC(C)C)C2=CC=C(C=C2)C(C)(C)C	{1: 12, 2: 2, 3: 2, 4: 4, 14: 8}
Did not match all atoms present	85668-76-4	CCCCC(CCCC)(C1=CC=C(C=C1)C(C)(C)C)C(CCCC)(CCCC)C2=CC=C(C=C2)C(C)(C)C	{1: 10, 2: 12, 4: 4, 14: 8}
Did not match all atoms present	85681-49-8	CC1=CC=CC=C1C2=NC(=NN2)C3=CC=CC=C3C	{32: 1, 1: 2, 35: 2, 14: 8}
Did not match all atoms present	85698-56-2	CN(C)C1=CC(=NC=C1)C2=NC=CC(=C2)N(C)C	{1: 4, 35: 2, 14: 6, 33: 2}
Did not match all atoms present	857-62-5	COC1=CC=CC=C1N2CCN(CC2)CCCC(C3=CC=C(C=C3)F)O	{1: 1, 2: 3, 3: 1, 33: 2, 11: 4, 14: 8, 16: 1, 20: 1, 22: 1}
Did not match all atoms present	857-95-4	C1=CC(=CC=C1CC(C(=O)O)N)OC2=CC=C(C=C2)N(CCCl)CCCl	{33: 1, 2: 5, 3: 1, 14: 8, 17: 2, 22: 1, 27: 1, 30: 1}
Did not match all atoms present	85720-47-4	CCC(C1=C(C=C(C=C1)O)O)C(CC)C2=C(C=C(C=C2)O)O	{1: 2, 2: 2, 3: 2, 21: 4, 14: 6}
Did not match all atoms present	85721-13-7	C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)N/N=C/3\C(=CC4=CC(=CC(=C4C3=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])NNC5=C6C(=CC(=CC6=O)S(=O)(=O)[O-])C=CC5=N.[Na+].[Na+].[Na+]	{34: 1, 36: 1, 14: 15, 15: 7, 24: 1, 25: 2, 29: 9, 30: 1, 31: 4}
Did not match all atoms present	85721-24-0	C1=CC=C(C=C1)C2=NC(=C(S2)CC(=O)[O-])C3=CC=C(C=C3)Cl.C1=CC=C(C=C1)C2=NC(=C(S2)CC(=O)[O-])C3=CC=C(C=C3)Cl.[Ca+2]	{2: 2, 35: 2, 41: 2, 14: 18, 17: 2, 24: 2}
Did not match all atoms present	85723-21-3	CC1N(CCCC1)CCCNCC(=O)NC2=C(C(=NN2C)C)C(=O)C3=CC=CC=C3F.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O	{1: 3, 2: 4, 35: 1, 6: 4, 33: 2, 11: 4, 12: 1, 14: 4, 16: 1, 24: 2, 27: 4, 31: 2}
Did not match all atoms present	857237-25-3	CC(CO)OC(C)c1ccccc1	{1: 2, 2: 1, 3: 2, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	85763-67-3	CCC1CCC(C1)CCC(=O)[O-].CCC1CCC(C1)CCC(=O)[O-].[Ca+2]	{24: 2, 1: 2, 2: 6, 11: 6, 12: 4}
Did not match all atoms present	85763-75-3	CCCCC(CC)C(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Zn+2]	{24: 2, 1: 5, 2: 9, 3: 1, 4: 1}
Did not match all atoms present	85765-41-9	CC(=O)NC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)CCOS(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]	{1: 1, 2: 2, 34: 2, 14: 6, 22: 1, 24: 1, 29: 8, 30: 1, 31: 1}
Did not match all atoms present	85776-14-3	CN(C)S(=O)(=O)C1=C(C=C(C(=C1)Cl)N/N=C/2\C3=CC=CC=C3C=C(C2=O)C(=O)NC4=CC=C(C=C4)Cl)Cl	{1: 2, 34: 1, 33: 1, 14: 11, 15: 2, 17: 3, 24: 1, 25: 1, 29: 2, 31: 2}
Did not match all atoms present	85785-20-2	CCN(C(C)C(C)C)C(=O)SCC1=CC=CC=C1	{1: 4, 2: 2, 3: 2, 33: 1, 40: 1, 14: 5, 24: 1}
Did not match all atoms present	85796-96-9	[Li+].C(=C\C(=O)[O-])\C(=O)O	{24: 1, 27: 1, 6: 2}
Did not match all atoms present	858-46-8	C1(=NC(=NC(=N1)C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F	{16: 15, 35: 3, 4: 6}
Did not match all atoms present	85850-93-7	CCC1=C(C2=C(C=C(C=C2)OCC(CO)O)OC3=CC=CC=C31)C4=CC=C(C=C4)O	{1: 1, 2: 3, 3: 1, 14: 11, 15: 2, 20: 2, 21: 1, 22: 1, 23: 1}
Did not match all atoms present	85864-33-1	CC(C)(C)C(=O)NC1=CC=CC=C1CC2=CC=CC=C2	{1: 3, 2: 1, 4: 1, 14: 9, 24: 1, 31: 1}
Did not match all atoms present	85878-62-2	C1=CN=CC2=C1C3=C(C=C4C(=C3)C=CO4)OC2=O	{35: 1, 28: 1, 14: 7, 23: 1}
Did not match all atoms present	85878-63-3	CC1=C2C(=CC3=C1OC(=O)C4=C3C=CN=C4)C=CO2	{1: 1, 35: 1, 28: 1, 14: 6, 23: 1}
Did not match all atoms present	858830-96-3	CC(CCC1=CC2=C(C=C1)OCO2)NN	{1: 1, 2: 2, 3: 1, 11: 1, 14: 3, 23: 2, 30: 1, 31: 1}
Did not match all atoms present	85886-25-5	CCN(CC)CCOC(=O)C1=CC=C(C=C1)N.CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)[O-].CN1C=NC2=C1C(=O)N(C(=O)N2C)C.C=CCC1(C(=O)NC(=O)NC1=O)CC=C.C1=CC=C(C(=C1)C(=O)O)[O-].[Na+].[Na+].Cl	{32: 2, 1: 8, 2: 7, 35: 1, 5: 2, 6: 2, 33: 7, 13: 1, 14: 14, 17: 1, 25: 6, 27: 1, 28: 1, 29: 3, 30: 1}
Did not match all atoms present	85906-84-9	C(F)(F)(F)[GeH3]	{16: 3, 4: 1}
Did not match all atoms present	85908-78-7	CC(=CC(=[CH-])C)C.CC(=CC(=[CH-])C)C.[Ru+2]	{1: 6, 6: 2, 7: 4}
Did not match all atoms present	85923-37-1	CC1=C2CCC3=C2C(=C(C4=C3C=CC5=CC=CC=C54)C)C=C1	{1: 2, 11: 2, 14: 8}
Did not match all atoms present	85929-96-0	CC(C)(C)C1=NC=C(C=N1)O	{1: 3, 35: 2, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	85940-65-4	C1=CC(=CC=C1N/N=C\2/C(=CC3=C(C2=O)C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[K+]	{2: 2, 34: 1, 14: 8, 15: 2, 22: 1, 25: 1, 29: 11, 31: 1}
Did not match all atoms present	85941-57-7	[N-]=[N+]=N[Pb]N=[N+]=[N-]	{34: 4}
Did not match all atoms present	85952-93-8	C1CO[Si]2(OCCN1CCO2)CCCNC3=CC=CC=C3	{33: 1, 2: 3, 11: 6, 14: 5, 23: 3, 31: 1}
Did not match all atoms present	85958-57-2	C1=CC(=C(C=C1F)Cl)S(=O)(=O)Cl	{16: 1, 17: 2, 29: 2, 14: 3}
Did not match all atoms present	85958-80-1	CN=C(/C(=C\1/C2=CC=CC=C2C(=N1)NNC(=O)C3=CC=CC=C3[O-])/C#N)[O-].[Ni+2]	{1: 1, 34: 1, 35: 1, 37: 1, 7: 2, 14: 8, 15: 2, 24: 1, 31: 2}
Did not match all atoms present	85959-47-3	C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)N/N=C/3\C(=CC4=C(C3=O)C=C(C=C4)N)S(=O)(=O)[O-])N/N=C\5/C=CC(=O)C(=C5)C(=O)[O-].[Na+].[Na+]	{34: 2, 14: 15, 15: 4, 24: 2, 25: 2, 29: 3, 30: 1, 31: 3}
Did not match all atoms present	85959-71-3	C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)N=NC3=C(C=C(C=C3)[O-])N)N/N=C/4\C(=O)C=C/C(=N/NC5=C(C=CC(=C5)S(=O)(=O)[O-])[O-])/C4=O.[Na+].[Cu+2]	{34: 4, 14: 16, 24: 1, 25: 2, 29: 3, 30: 1, 31: 3}
Did not match all atoms present	85959-83-7	CC1=[C-]C(C(=C1C)C)(C)C.CC1=[C-]C(C(=C1C)C)(C)C.[Cl-].[Cl-].[Hf+4]	{1: 10, 17: 2, 13: 2, 15: 6}
Did not match all atoms present	86-00-0	C1=CC=C(C=C1)C2=CC=CC=C2[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	86-12-4	CN1CCC(CC1)N(CC2=CC=CS2)C3=CC=CC=C3	{1: 1, 2: 1, 33: 2, 41: 1, 11: 4, 12: 1, 14: 8}
Did not match all atoms present	86-14-6	CCN(CC)C(C)C=C(C1=CC=CS1)C2=CC=CS2	{1: 3, 2: 2, 3: 1, 33: 1, 6: 1, 7: 1, 41: 2, 14: 6}
Did not match all atoms present	86-15-7	CCCCOC1=CC(=C(C=C1N2CCOCC2)OCCCC)[N+](=O)[O-]	{1: 2, 2: 6, 38: 1, 33: 1, 11: 4, 14: 2, 22: 2, 23: 1}
Did not match all atoms present	86-16-8	CCOC1=CC(=C(C=C1N2CCOCC2)OCC)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 33: 1, 11: 4, 14: 2, 22: 2, 23: 1}
Did not match all atoms present	86-19-1	COC1=CC=C(C=C1)NC(=O)C2=C(C=C3C(=C2)C=CC4=C3NC5=CC=CC=C45)O	{32: 1, 1: 1, 14: 12, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	86-20-4	CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C31	{1: 1, 2: 1, 38: 1, 14: 7, 33: 1}
Did not match all atoms present	86-21-5	CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2	{1: 2, 2: 2, 3: 1, 33: 1, 14: 9, 35: 1}
Did not match all atoms present	86-22-6	CN(C)CCC(C1=CC=C(C=C1)Br)C2=CC=CC=N2	{1: 2, 2: 2, 3: 1, 33: 1, 14: 8, 18: 1, 35: 1}
Did not match all atoms present	86-26-0	COC1=CC=CC=C1C2=CC=CC=C2	{1: 1, 22: 1, 14: 9}
Did not match all atoms present	86-28-2	CCN1C2=CC=CC=C2C3=CC=CC=C31	{1: 1, 2: 1, 14: 8, 33: 1}
Did not match all atoms present	86-29-3	C1=CC=C(C=C1)C(C#N)C2=CC=CC=C2	{3: 1, 37: 1, 14: 10}
Did not match all atoms present	86-30-6	C1=CC=C(C=C1)N(C2=CC=CC=C2)N=O	{33: 1, 34: 1, 29: 1, 14: 10}
Did not match all atoms present	86-31-7	C1=CC2=C(C=CC(=C2C=C1N)N/N=C\3/C=CC(=CC3=O)[N+](=O)[O-])S(=O)(=O)O	{34: 1, 38: 1, 14: 8, 15: 2, 20: 1, 25: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	86-34-0	CN1C(=O)CC(C1=O)C2=CC=CC=C2	{1: 1, 33: 1, 11: 1, 12: 1, 14: 5, 25: 2}
Did not match all atoms present	86-35-1	CCN1C(=O)C(NC1=O)C2=CC=CC=C2	{32: 1, 1: 1, 2: 1, 33: 1, 12: 1, 14: 5, 25: 2}
Did not match all atoms present	86-42-0	CCN(CC)CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O	{1: 2, 2: 3, 35: 1, 33: 1, 14: 8, 17: 1, 21: 1, 31: 1}
Did not match all atoms present	86-43-1	CCCOC1=C(C=CC(=C1)N)C(=O)OCCN(CC)CC	{1: 3, 2: 6, 33: 1, 14: 3, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	86-45-3	COC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)O)N	{1: 1, 14: 5, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	86-48-6	C1=CC=C2C(=C1)C=CC(=C2O)C(=O)O	{27: 1, 21: 1, 14: 6}
Did not match all atoms present	86-49-7	CCN(CC)C1=C(C=C(C=C1)[N+](=O)[O-])Cl	{1: 2, 2: 2, 38: 1, 33: 1, 14: 3, 17: 1}
Did not match all atoms present	86-50-0	COP(=S)(OC)SCN1C(=O)C2=CC=CC=C2N=N1	{1: 2, 2: 1, 35: 2, 33: 1, 40: 1, 14: 4, 22: 2, 25: 1}
Did not match all atoms present	86-51-1	COC1=CC=CC(=C1OC)C=O	{1: 2, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	86-52-2	C1=CC=C2C(=C1)C=CC=C2CCl	{17: 1, 2: 1, 14: 7}
Did not match all atoms present	86-53-3	C1=CC=C2C(=C1)C=CC=C2C#N	{37: 1, 14: 7}
Did not match all atoms present	86-54-4	C1=CC=C2C(=C1)C=NN=C2NN	{35: 2, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	86-55-5	C1=CC=C2C(=C1)C=CC=C2C(=O)O	{27: 1, 14: 7}
Did not match all atoms present	86-56-6	CN(C)C1=CC=CC2=CC=CC=C21	{1: 2, 14: 7, 33: 1}
Did not match all atoms present	86-57-7	C1=CC=C2C(=C1)C=CC=C2[N+](=O)[O-]	{38: 1, 14: 7}
Did not match all atoms present	86-58-8	B(C1=C2C(=CC=C1)C=CC=N2)(O)O	{35: 1, 20: 2, 14: 6}
Did not match all atoms present	86-59-9	C1=CC2=C(C(=C1)C(=O)O)N=CC=C2	{35: 1, 27: 1, 14: 6}
Did not match all atoms present	86-60-2	C1=CC2=C(C=C(C=C2)N)C(=C1)S(=O)(=O)O	{30: 1, 20: 1, 29: 2, 14: 6}
Did not match all atoms present	86-61-3	C1=CC(=CC2=C(C=C(C=C21)O)S(=O)(=O)O)N	{30: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	86-63-5	CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)S(=O)(=O)O)OC)N	{1: 2, 34: 2, 14: 7, 20: 2, 22: 1, 29: 4, 30: 1}
Did not match all atoms present	86-65-7	C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)N	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	86-66-8	C1=CC2=C(C=C(C=C2C=C1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	{20: 3, 29: 6, 14: 5}
Did not match all atoms present	86-67-9	C1=CC(=C2C(=C1)SC3=CC=CC(=C3S2)C(=O)O)C(=O)O	{41: 2, 27: 2, 14: 6}
Did not match all atoms present	86-68-0	COC1=CC2=C(C=CN=C2C=C1)C(=O)O	{1: 1, 27: 1, 22: 1, 14: 5, 35: 1}
Did not match all atoms present	86-72-6	C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)NC4=CC=C(C=C4)O	{32: 1, 21: 1, 14: 11, 31: 1}
Did not match all atoms present	86-73-7	C1C2=CC=CC=C2C3=CC=CC=C31	{11: 1, 14: 8}
Did not match all atoms present	86-74-8	C1=CC=C2C(=C1)C3=CC=CC=C3N2	{32: 1, 14: 8}
Did not match all atoms present	86-75-9	C1=CC=C(C=C1)C(=O)OC2=CC=CC3=C2N=CC=C3	{35: 1, 28: 1, 14: 11}
Did not match all atoms present	86-76-0	C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)Br	{18: 1, 14: 7, 23: 1}
Did not match all atoms present	86-77-1	C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)O	{21: 1, 14: 7, 23: 1}
Did not match all atoms present	86-78-2	CC(C)NCCCCCNC1=C2C(=CC(=C1)OC)C=CC=N2	{1: 3, 2: 5, 3: 1, 14: 5, 35: 1, 22: 1, 31: 2}
Did not match all atoms present	86-79-3	C1=CC=C2C(=C1)C3=C(N2)C=C(C=C3)O	{32: 1, 21: 1, 14: 7}
Did not match all atoms present	86-80-6	CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)C	{1: 3, 2: 5, 35: 1, 33: 1, 14: 5, 22: 1}
Did not match all atoms present	86-81-7	COC1=CC(=CC(=C1OC)OC)C=O	{1: 3, 26: 1, 22: 3, 14: 2}
Did not match all atoms present	86-83-9	CC(=O)CC(=O)NC1=CC=CC2=CC=CC=C21	{24: 2, 1: 1, 2: 1, 14: 7, 31: 1}
Did not match all atoms present	86-84-0	C1=CC=C2C(=C1)C=CC=C2N=C=O	{8: 1, 34: 1, 29: 1, 14: 7}
Did not match all atoms present	86-86-2	C1=CC=C2C(=C1)C=CC=C2CC(=O)N	{24: 1, 2: 1, 30: 1, 14: 7}
Did not match all atoms present	86-87-3	C1=CC=C2C(=C1)C=CC=C2CC(=O)O	{2: 1, 27: 1, 14: 7}
Did not match all atoms present	86-88-4	C1=CC=C2C(=C1)C=CC=C2NC(=S)N	{31: 1, 30: 1, 14: 7, 7: 1}
Did not match all atoms present	86-89-5	CCCCCc1cccc2ccccc12	{1: 1, 2: 4, 14: 7}
Did not match all atoms present	86-92-0	CC1=NN(C(=O)C1)C2=CC=C(C=C2)C	{1: 2, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 25: 1}
Did not match all atoms present	86-93-1	C1=CC=C(C=C1)N2C(=S)N=NN2	{32: 1, 33: 1, 35: 2, 14: 5}
Did not match all atoms present	86-95-3	C1=CC=C2C(=C1)C(=CC(=O)N2)O	{32: 1, 25: 1, 21: 1, 14: 5}
Did not match all atoms present	86-96-4	C1=CC=C2C(=C1)C(=O)NC(=O)N2	{32: 2, 25: 2, 14: 4}
Did not match all atoms present	86-97-5	C1=CC2=C(C=CC(=C2)O)C(=C1)N	{30: 1, 21: 1, 14: 6}
Did not match all atoms present	86-98-6	C1=CC2=C(C=CN=C2C=C1Cl)Cl	{17: 2, 35: 1, 14: 5}
Did not match all atoms present	860-22-0	C1=CC2=C(C=C1S(=O)(=O)[O-])C(=O)/C(=C\3/C(=O)C4=C(N3)C=CC(=C4)S(=O)(=O)[O-])/N2.[Na+].[Na+]	{32: 2, 25: 2, 29: 6, 14: 6, 15: 2}
Did not match all atoms present	860-39-9	C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])SSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]	{16: 6, 40: 2, 4: 2, 38: 2, 14: 6}
Did not match all atoms present	86005-69-8	O.O.[Am]	{}
Did not match all atoms present	86060-85-7	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCC(=O)OC4=C(C(=C(C(=C4F)F)F)F)F	{2: 2, 12: 1, 14: 8, 16: 5, 28: 2, 31: 1}
Did not match all atoms present	86060-87-9	CC(C)[C@@H](C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24	{1: 2, 2: 1, 3: 2, 12: 1, 14: 8, 16: 5, 28: 2, 31: 1}
Did not match all atoms present	86073-23-6	CCC(C)SP(=O)(OCC)SC(C)(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 40: 2, 22: 1, 29: 1}
Did not match all atoms present	86098-92-2	CC(C)SN(C1=NC(=NC(=N1)N(SC(C)C)SC(C)C)N(SC(C)C)SC(C)C)SC(C)C	{40: 6, 1: 12, 3: 6, 35: 3, 33: 3}
Did not match all atoms present	86209-51-0	COC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC(F)F)OC(F)F	{1: 1, 3: 2, 14: 5, 16: 4, 35: 2, 22: 2, 24: 1, 28: 1, 29: 2, 31: 2}
Did not match all atoms present	86220-53-3	CC1=C(C2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)N=NC4=C(C=C5C=C(C=CC5=C4[O-])NC(=O)NC6=CC=C(C=C6)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 2, 35: 1, 41: 1, 14: 13, 24: 2, 29: 9, 31: 3}
Did not match all atoms present	86242-89-9	COC1=C(C=C(C(=C1)N/N=C\2/C3=C(C=CC2=O)C=CC=C3NS(=O)(=O)C)O)Cl.COC1=C(C=C(C(=C1)N/N=C\2/C3=C(C=CC2=O)C=CC=C3NS(=O)(=O)C)O)Cl.[Na+].[Cr]	{1: 4, 34: 2, 14: 14, 15: 2, 17: 2, 21: 2, 22: 2, 25: 2, 29: 4, 31: 4}
Did not match all atoms present	86242-90-2	CC1=CC=CC=C1NC(=O)C(C(C)O)N=NC2=C(C=CC(=C2)S(=O)(=O)N)C(=O)O.CC1=CC=CC=C1NC(=O)C(C(C)O)N=NC2=C(C=CC(=C2)S(=O)(=O)N)C(=O)O.[Na+].[Cr]	{1: 4, 34: 4, 3: 4, 14: 14, 20: 2, 24: 2, 27: 2, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	86270-03-3	C1=CC(=CC(=C1)OC(F)(F)F)C(=O)Cl	{4: 1, 14: 4, 16: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	86271-35-4	COC1=NC(=NC(=N1)NCCS(=O)(=O)[O-])NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)OC)N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 2, 2: 6, 35: 6, 6: 2, 33: 1, 14: 6, 20: 2, 22: 2, 29: 9, 31: 3}
Did not match all atoms present	86299-47-0	CC(C)(C)OC(=O)C(C)(C)ON=C(C1=CSC(=N1)N)C(=O)O	{1: 5, 34: 1, 35: 1, 4: 2, 7: 1, 41: 1, 14: 1, 22: 1, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	863-61-6	CC1=C(C(=O)C2=CC=CC=C2C1=O)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C	{1: 6, 2: 7, 6: 4, 7: 4, 14: 4, 15: 2, 25: 2}
Did not match all atoms present	86318-61-8	CC(C)(C)C#C[Si](C)C	{1: 5, 10: 2, 4: 1}
Did not match all atoms present	86329-79-5	CC1=C(SC(=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)[O-])CC(=O)[O-].[Na+].[Na+]	{1: 2, 2: 2, 35: 2, 33: 1, 7: 1, 40: 1, 41: 3, 11: 1, 12: 2, 34: 1, 14: 1, 15: 2, 22: 1, 24: 3, 25: 1, 30: 1, 31: 1}
Did not match all atoms present	86374-48-3	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[C]1=[C][C]=[C][C]=[C]1.[V].[V]	{14: 10}
Did not match all atoms present	86393-34-2	C1=C(C(=CC(=C1F)Cl)Cl)C(=O)Cl	{16: 1, 17: 3, 14: 2, 24: 1}
Did not match all atoms present	864-56-2	CCC(C)(C)C1=CC=C(C=C1)OP(OC2=CC=C(C=C2)C(C)(C)CC)OC3=CC=C(C=C3)C(C)(C)CC	{1: 9, 2: 3, 4: 3, 22: 3, 14: 12}
Did not match all atoms present	86402-30-4	CC1=CN=NN=C1	{1: 1, 35: 3, 14: 2}
Did not match all atoms present	86402-31-5	CC1=CN=NN=C1C	{1: 2, 35: 3, 14: 1}
Did not match all atoms present	86408-72-2	CC(C)C1=C(C=C2C(=C1)CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)O)C)S(=O)(=O)[O-].[Na+]	{1: 4, 3: 1, 11: 5, 12: 1, 13: 2, 14: 2, 27: 1, 29: 3}
Did not match all atoms present	86422-60-8	C1=CC=C(C(=C1)N=NC2=C(C3=C(C=C(C=C3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])NC4=NC(=NC(=N4)NC5=CC=C(C=C5)NC6=NC(=NC(=N6)[N+]7=CC=CC(=C7)C(=O)O)NC8=C9C(=CC(=C8)S(=O)(=O)[O-])C=C(C(=C9O)N=NC1=CC=CC=C1S(=O)(=O)[O-])S(=O)(=O)[O-])[N+]1=CC=CC(=C1)C(=O)O)O)S(=O)(=O)[O-].[OH-].[OH-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{33: 2, 34: 4, 35: 6, 14: 26, 21: 2, 27: 2, 29: 18, 31: 4}
Did not match all atoms present	86422-61-9	CC(=O)NC1=C(C=CC(=C1)NC2=NC(=NC(=N2)[N+]3=CC=CC(=C3)C(=O)O)NC4=CC(=C(C=C4)/C=C/C5=C(C=C(C=C5)NC6=NC(=NC(=N6)NC7=CC(=C(C=C7)N=NC8=CC(=C9C=CC=C(C9=C8)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C)[N+]1=CC=CC(=C1)C(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])N=NC1=CC(=C2C=CC=C(C2=C1)S(=O)(=O)[O-])S(=O)(=O)[O-].[OH-].[OH-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]	{1: 2, 34: 4, 35: 6, 6: 2, 33: 2, 14: 30, 24: 2, 27: 2, 29: 18, 31: 6}
Did not match all atoms present	86432-23-7	CCCCCCCCCCCCCCCCCCNC(=O)C1=CC=CC=C1C(=O)[O-].[Na+]	{24: 2, 1: 1, 2: 17, 14: 4, 31: 1}
Did not match all atoms present	86436-19-3	C1=CC=C(C=C1)C(C#CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3Cl)O)(C4=CC=CC=C4Cl)O	{17: 2, 10: 4, 4: 2, 14: 18, 20: 2}
Did not match all atoms present	86453-13-6	CCS(=O)(=O)CC(=O)C	{24: 1, 1: 2, 2: 2, 29: 2}
Did not match all atoms present	86456-97-5	CCOC1=C(C=CC(=C1)CCN)OC	{1: 2, 2: 3, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	86470-99-7	CC(C1=CC2=C3C(=C1)C=CC4=C3C(=CC=C4)C=C2)O	{1: 1, 3: 1, 20: 1, 14: 9}
Did not match all atoms present	86475-37-8	CC(=O)N1C(=O)C(CN1C2=CC=CC=C2)(C)C	{1: 3, 33: 2, 11: 1, 13: 1, 14: 5, 24: 1, 25: 1}
Did not match all atoms present	86479-06-3	C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=CC(=C(C(=C2)Cl)OC(C(F)F)(F)F)Cl)F	{3: 1, 4: 1, 14: 5, 16: 6, 17: 2, 22: 1, 24: 2, 31: 2}
Did not match all atoms present	865-04-3	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=C(C=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC	{32: 1, 1: 6, 33: 1, 11: 5, 12: 6, 14: 5, 22: 5, 28: 2}
Did not match all atoms present	865-21-4	CC[C@@]1(C[C@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O	{32: 1, 1: 7, 2: 2, 33: 3, 11: 9, 12: 4, 13: 5, 14: 8, 20: 2, 22: 1, 28: 3}
Did not match all atoms present	865-28-1	CC(C)C[C@H]1C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCN)C(C)C)CC3=CC=C(C=C3)O)CCC(=O)N)CC(=O)N)CC4=CC=CC=C4)CC5=CNC6=CC=CC=C65)CC7=CC=CC=C7	{32: 10, 1: 4, 2: 11, 3: 2, 33: 1, 11: 3, 12: 10, 14: 19, 21: 1, 24: 2, 25: 10, 30: 3}
Did not match all atoms present	865-33-8	C[O-].[K+]	{1: 1, 29: 1}
Did not match all atoms present	865-34-9	[Li+].C[O-]	{1: 1, 29: 1}
Did not match all atoms present	865-35-0	C[O-].C[O-].C[O-].C[O-].C[O-].[Ta+5]	{1: 5, 29: 5}
Did not match all atoms present	865-38-3	C(#N)[S-].C(#N)[S-].[Cd+2]	{37: 2}
Did not match all atoms present	865-47-4	CC(C)(C)[O-].[K+]	{1: 3, 4: 1, 29: 1}
Did not match all atoms present	865-48-5	CC(C)(C)[O-].[Na+]	{1: 3, 4: 1, 29: 1}
Did not match all atoms present	865-49-6	[2H]C(Cl)(Cl)Cl	{17: 3, 3: 1}
Did not match all atoms present	865-52-1	C[Ge](C)(C)C	{1: 4}
Did not match all atoms present	865-76-9	C[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)C	{1: 10}
Did not match all atoms present	86521-05-3	C[Si](C)(C)C#CC1=CC=CC=N1	{1: 3, 10: 2, 35: 1, 14: 4}
Did not match all atoms present	86522-89-6	C1=C(C(=CC(=C1F)Cl)Cl)C(=O)O	{16: 1, 17: 2, 27: 1, 14: 2}
Did not match all atoms present	86539-71-1	CC1=C(OC2=C1C3=C(C=C2)C=C(C=C3)OC)[N+](=O)[O-]	{1: 2, 38: 1, 22: 1, 14: 5, 23: 1}
Did not match all atoms present	86548-40-5	COC1=CC(=C2C=C(C(=O)OC2=C1)C(=O)C3=CC=CC4=CC=CC=C43)OC	{24: 1, 1: 2, 28: 1, 22: 2, 14: 10}
Did not match all atoms present	86560-61-4	CC(C)(C)P1C2(P1C(C)(C)C)P(P2C(C)(C)C)C(C)(C)C	{1: 12, 4: 4, 13: 1}
Did not match all atoms present	86571-25-7	C1=CC=C(C=C1)C=CC(=O)C(F)(F)F	{16: 3, 24: 1, 4: 1, 14: 5, 6: 2}
Did not match all atoms present	86595-27-9	B(C)(OC(C)C)OC(C)C	{1: 5, 3: 2, 22: 2}
Did not match all atoms present	86595-32-6	B(CCCC)(OC(C)C)OC(C)C	{1: 5, 2: 3, 3: 2, 22: 2}
Did not match all atoms present	86596-78-3	CC1(CCCC(C2=C1SS2)(C)C)C	{1: 4, 11: 3, 13: 2, 41: 2}
Did not match all atoms present	86596-79-4	CC1(CS(=O)(=O)CC(C=C1)(C)C)C	{1: 4, 11: 2, 13: 2, 14: 2, 29: 2}
Did not match all atoms present	866-17-1	C(=O)(C(C(C(=O)[O-])(O)O)(O)O)[O-].[Na+].[Na+]	{24: 2, 20: 4, 4: 2}
Did not match all atoms present	866-23-9	CCOP(=O)(C(Cl)(Cl)Cl)OCC	{1: 2, 2: 2, 4: 1, 17: 3, 22: 2, 29: 1}
Did not match all atoms present	866-55-7	CC[Sn](CC)(Cl)Cl	{1: 2, 2: 2, 17: 2}
Did not match all atoms present	866-81-9	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Co+2].[Co+2].[Co+2]	{24: 6, 20: 2, 2: 4, 4: 2}
Did not match all atoms present	866-82-0	C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Cu+2].[Cu+2]	{20: 1, 2: 2, 27: 3, 4: 1}
Did not match all atoms present	866-84-2	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[K+].[K+].[K+]	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	866-97-7	CCCCC[N+](CCCCC)(CCCCC)CCCCC.[Br-]	{1: 4, 2: 16, 18: 1}
Did not match all atoms present	86608-70-0	C1COC(O1)CC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]	{2: 2, 11: 2, 12: 1, 14: 15, 18: 1, 23: 2}
Did not match all atoms present	86641-76-1	C1C[N+]2(CCN1C(=O)CCBr)CC[N+]3(CCN(CC3)C(=O)CCBr)CC2.[Cl-].[Cl-]	{33: 2, 2: 4, 11: 12, 17: 2, 18: 2, 24: 2}
Did not match all atoms present	86674-51-3	C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)N=O	{34: 1, 29: 1, 14: 9}
Did not match all atoms present	867-13-0	CCOC(=O)CP(=O)(OCC)OCC	{1: 3, 2: 4, 28: 1, 29: 1, 22: 2}
Did not match all atoms present	867-27-6	CCSCCOP(=S)(OC)OC	{40: 1, 1: 3, 2: 3, 22: 3}
Did not match all atoms present	867-36-7	CCC[Sn](CCC)(Cl)Cl	{1: 2, 2: 4, 17: 2}
Did not match all atoms present	867-46-9	B(OC)(Cl)Cl	{1: 1, 22: 1, 17: 2}
Did not match all atoms present	867-47-0	C=CC(=O)[O-].C=CC(=O)[O-].[Pb+2]	{24: 2, 5: 2, 6: 2}
Did not match all atoms present	867-55-0	[Li+].CC(C(=O)[O-])O	{24: 1, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	867-56-1	C[C@@H](C(=O)[O-])O.[Na+]	{24: 1, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	867-62-9	C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2O)Br)CCC4=C3C=CC(=C4)O)OC	{1: 2, 11: 4, 12: 6, 13: 1, 14: 3, 18: 1, 20: 1, 21: 1, 22: 1}
Did not match all atoms present	867-63-0	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Er+3].[Er+3]	{24: 6}
Did not match all atoms present	867-64-1	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Gd+3].[Gd+3]	{24: 6}
Did not match all atoms present	867-68-5	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Y+3].[Y+3]	{24: 6}
Did not match all atoms present	867-81-2	CC(C)(CO)[C@H](C(=O)NCCC(=O)[O-])O.[Na+]	{1: 2, 2: 3, 3: 1, 4: 1, 20: 2, 24: 2, 31: 1}
Did not match all atoms present	86702-46-7	CCCCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 8, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	86781-16-0	CCCCN(CCCC)C(=O)NC1=CC=CC(=C1)C	{1: 3, 2: 6, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	86784-80-7	CC[C@H](C)[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CN=CN2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC3=CN=CN3)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)O)NC(=O)[C@@H]4CCCN4C(=O)[C@@H]5CCCN5C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)N	{32: 2, 1: 29, 2: 53, 3: 51, 36: 3, 33: 2, 7: 3, 40: 2, 11: 6, 12: 2, 14: 9, 35: 2, 20: 4, 24: 44, 27: 8, 30: 9, 31: 41}
Did not match all atoms present	868-18-8	C(C(C(=O)[O-])O)(C(=O)[O-])O.[Na+].[Na+]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	868-19-9	[C@@H]([C@H](C(=O)[O-])O)(C(=O)[O-])O.[Sr+2]	{24: 2, 3: 2, 20: 2}
Did not match all atoms present	868-59-7	CCOC(=O)[C@H](CS)[NH3+].[Cl-]	{1: 1, 2: 2, 3: 1, 39: 1, 17: 1, 28: 1}
Did not match all atoms present	868-85-9	CO[P+](=O)OC	{1: 2, 29: 1, 22: 2}
Did not match all atoms present	86811-46-3	CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OC4=CC=CC=C4C(=O)OC5=CC=CC=C5C(=O)O	{1: 2, 2: 1, 33: 1, 14: 15, 17: 1, 22: 1, 24: 1, 27: 1, 28: 2}
Did not match all atoms present	86831-20-1	CCCC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C#N)F	{1: 1, 2: 2, 37: 1, 14: 7, 16: 1, 28: 1}
Did not match all atoms present	86831-22-3	CCCCCC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C#N)F	{1: 1, 2: 4, 37: 1, 14: 7, 16: 1, 28: 1}
Did not match all atoms present	86831-65-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CCC34OC=O	{1: 1, 11: 8, 12: 3, 13: 2, 14: 1, 15: 1, 25: 2, 26: 1}
Did not match all atoms present	86845-35-4	C1=CC(=CC(=C1)C(F)(F)F)CC2=CC(=CC=C2)C(F)(F)F	{16: 6, 2: 1, 4: 2, 14: 8}
Did not match all atoms present	86864-60-0	CC(C)(C)[Si](C)(C)OCCBr	{1: 5, 2: 2, 4: 1, 18: 1, 22: 1}
Did not match all atoms present	86864-87-1	CC1=CC(=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)C	{1: 2, 22: 3, 14: 13, 29: 1}
Did not match all atoms present	86864-88-2	CC1=CC(=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=C(C=C(C=C3)C)C)C	{1: 4, 22: 3, 14: 11, 29: 1}
Did not match all atoms present	86864-89-3	CC1=CC(=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=C(C=CC=C3C)C)C	{1: 4, 22: 3, 14: 11, 29: 1}
Did not match all atoms present	86864-90-6	CC1=CC(=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=C(C=C(C=C3C)C)C)C	{1: 5, 22: 3, 14: 10, 29: 1}
Did not match all atoms present	86864-91-7	CC1=CC(=C(C=C1)OP(=O)(OC2=C(C=C(C=C2)C)C)OC3=C(C=CC=C3C)C)C	{1: 6, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	86864-92-8	CC1=CC(=C(C=C1)OP(=O)(OC2=C(C=CC=C2C)C)OC3=C(C=CC=C3C)C)C	{1: 6, 22: 3, 14: 9, 29: 1}
Did not match all atoms present	86864-93-9	CC1=CC(=C(C=C1)OP(=O)(OC2=C(C=C(C=C2)C)C)OC3=C(C=C(C=C3C)C)C)C	{1: 7, 22: 3, 14: 8, 29: 1}
Did not match all atoms present	86864-94-0	CC1=CC(=C(C=C1)OP(=O)(OC2=C(C=CC=C2C)C)OC3=C(C=C(C=C3C)C)C)C	{1: 7, 22: 3, 14: 8, 29: 1}
Did not match all atoms present	86864-95-1	CC1=CC(=C(C=C1)OP(=O)(OC2=C(C=C(C=C2C)C)C)OC3=C(C=C(C=C3C)C)C)C	{1: 8, 22: 3, 14: 7, 29: 1}
Did not match all atoms present	86881-29-0	COCC1C(C(C(O1)N2C=CC(=NC2=O)N)OC)OC	{1: 3, 2: 1, 35: 1, 33: 1, 12: 4, 14: 2, 22: 3, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	869-56-7	CCCSP(SCCC)SCCC	{40: 3, 1: 3, 2: 6}
Did not match all atoms present	86943-85-3	CN(C)C1=CC=CC2=C1C3=C(C2)C=CC=C3N(C)C	{1: 4, 11: 1, 14: 6, 33: 2}
Did not match all atoms present	869495-24-9	C1CCN(CC1)[C@@H](C2=CC=CC=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O	{33: 1, 3: 1, 4: 1, 11: 5, 14: 15, 20: 1}
Did not match all atoms present	87-00-3	CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(C3=CC=CC=C3)O	{1: 1, 3: 1, 33: 1, 11: 4, 12: 3, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	87-01-4	CC1=CC(=O)OC2=C1C=CC(=C2)N(C)C	{1: 3, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	87-02-5	C1=CC2=C(C=C(C=C2C=C1N)S(=O)(=O)O)O	{30: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	87-03-6	C1=CC2=C(C=C(C=C2C=C1NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)O)S(=O)(=O)O)O	{31: 1, 20: 2, 21: 2, 14: 10, 29: 4}
Did not match all atoms present	87-05-8	CCOC1=CC2=C(C=C1)C(=CC(=O)O2)C	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	87-08-1	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)C	{1: 2, 2: 1, 33: 1, 41: 1, 12: 3, 13: 1, 14: 5, 22: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	87-10-5	C1=CC(=CC=C1NC(=O)C2=CC(=CC(=C2O)Br)Br)Br	{24: 1, 18: 3, 21: 1, 14: 6, 31: 1}
Did not match all atoms present	87-11-6	CC(=O)NC1=C2C(=CSS2)N(C1=O)C	{1: 2, 33: 1, 41: 2, 14: 1, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	87-12-7	C1=CC(=CC=C1NC(=O)C2=C(C=CC(=C2)Br)O)Br	{24: 1, 18: 2, 21: 1, 14: 7, 31: 1}
Did not match all atoms present	87-17-2	C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2O	{24: 1, 21: 1, 14: 9, 31: 1}
Did not match all atoms present	87-18-3	CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O	{1: 3, 4: 1, 21: 1, 14: 8, 28: 1}
Did not match all atoms present	87-19-4	CC(C)COC(=O)C1=CC=CC=C1O	{1: 2, 2: 1, 3: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	87-20-7	CC(C)CCOC(=O)C1=CC=CC=C1O	{1: 2, 2: 2, 3: 1, 14: 4, 21: 1, 28: 1}
Did not match all atoms present	87-22-9	C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2O	{2: 2, 28: 1, 21: 1, 14: 9}
Did not match all atoms present	87-24-1	CCOC(=O)C1=CC=CC=C1C	{1: 2, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	87-25-2	CCOC(=O)C1=CC=CC=C1N	{1: 1, 2: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	87-26-3	CCCC(C)C1=CC=CC=C1O	{1: 2, 2: 2, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	87-28-5	C1=CC=C(C(=C1)C(=O)OCCO)O	{28: 1, 2: 2, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	87-29-6	C1=CC=C(C=C1)C=CCOC(=O)C2=CC=CC=C2N	{2: 1, 30: 1, 28: 1, 14: 9, 6: 2}
Did not match all atoms present	87-31-0	C1=C(C=C2C(=C1[N+](=O)[O-])ON=N2)[N+](=O)[O-]	{35: 2, 38: 2, 14: 2, 23: 1}
Did not match all atoms present	87-32-1	CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O	{32: 1, 1: 1, 2: 1, 3: 1, 14: 5, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	87-33-2	C1[C@H]([C@@H]2[C@H](O1)[C@H](CO2)O[N+](=O)[O-])O[N+](=O)[O-]	{11: 2, 12: 4, 22: 2, 23: 2}
Did not match all atoms present	87-40-1	COC1=C(C=C(C=C1Cl)Cl)Cl	{1: 1, 22: 1, 14: 2, 17: 3}
Did not match all atoms present	87-41-2	C1C2=CC=CC=C2C(=O)O1	{11: 1, 28: 1, 14: 4}
Did not match all atoms present	87-42-3	C1=NC2=C(N1)C(=NC=N2)Cl	{32: 1, 17: 1, 35: 3, 14: 2}
Did not match all atoms present	87-47-8	CC1=NN(C(=C1)OC(=O)N(C)C)C2=CC=CC=C2	{1: 3, 35: 1, 28: 1, 14: 6, 33: 2}
Did not match all atoms present	87-48-9	C1=CC2=C(C=C1Br)C(=O)C(=O)N2	{32: 1, 25: 2, 18: 1, 14: 3}
Did not match all atoms present	87-51-4	C1=CC=C2C(=C1)C(=CN2)CC(=O)O	{32: 1, 2: 1, 27: 1, 14: 5}
Did not match all atoms present	87-52-5	CN(C)CC1=CNC2=CC=CC=C21	{32: 1, 1: 2, 2: 1, 14: 5, 33: 1}
Did not match all atoms present	87-58-1	C1(=C(NC(=C1I)I)I)I	{32: 1, 19: 4}
Did not match all atoms present	87-59-2	CC1=C(C(=CC=C1)N)C	{1: 2, 30: 1, 14: 3}
Did not match all atoms present	87-60-5	CC1=C(C=CC=C1Cl)N	{1: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	87-61-6	C1=CC(=C(C(=C1)Cl)Cl)Cl	{17: 3, 14: 3}
Did not match all atoms present	87-62-7	CC1=C(C(=CC=C1)C)N	{1: 2, 30: 1, 14: 3}
Did not match all atoms present	87-63-8	CC1=C(C(=CC=C1)Cl)N	{1: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	87-64-9	CC1=C(C(=CC=C1)Cl)O	{1: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	87-65-0	C1=CC(=C(C(=C1)Cl)O)Cl	{17: 2, 21: 1, 14: 3}
Did not match all atoms present	87-66-1	C1=CC(=C(C(=C1)O)O)O	{21: 3, 14: 3}
Did not match all atoms present	87-76-3	CCCCCCCCCCCCCCCC[N+](C)(C)C.C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[O-]	{1: 4, 2: 15, 17: 5}
Did not match all atoms present	87-82-1	C1(=C(C(=C(C(=C1Br)Br)Br)Br)Br)Br	{18: 6}
Did not match all atoms present	87-83-2	CC1=C(C(=C(C(=C1Br)Br)Br)Br)Br	{1: 1, 18: 5}
Did not match all atoms present	87-85-4	CC1=C(C(=C(C(=C1C)C)C)C)C	{1: 6}
Did not match all atoms present	87-86-5	C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)O	{17: 5, 21: 1}
Did not match all atoms present	87-87-6	C1(=C(C(=C(C(=C1Cl)Cl)O)Cl)Cl)O	{17: 4, 21: 2}
Did not match all atoms present	87-97-8	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)COC	{1: 7, 2: 1, 4: 2, 14: 2, 21: 1, 22: 1}
Did not match all atoms present	870-08-6	CCCCCCCC[Sn](=O)CCCCCCCC	{1: 2, 2: 14, 29: 1}
Did not match all atoms present	870-26-8	C[SiH2][SiH2]C	{1: 2}
Did not match all atoms present	870-52-0	CCCCOP(=O)(N)OCCCC	{1: 2, 2: 6, 30: 1, 29: 1, 22: 2}
Did not match all atoms present	870-62-2	C[N+](C)(C)CCCCCC[N+](C)(C)C.[I-].[I-]	{1: 6, 2: 6, 19: 2}
Did not match all atoms present	870-72-4	C(O)S(=O)(=O)O	{2: 1, 20: 2, 29: 2}
Did not match all atoms present	870-73-5	CCSC(=S)C	{40: 1, 1: 2, 2: 1, 7: 1}
Did not match all atoms present	87016-67-9	C1COC2=C(C=C(C=C2)Br)OCCOCCOC3=CC=CC=C3OCCO1	{18: 1, 11: 8, 14: 7, 23: 6}
Did not match all atoms present	87027-12-1	C1=COC(=C1)[SiH2]C2=CC=CO2	{14: 6, 23: 2}
Did not match all atoms present	87051-43-2	CC1=C(C(=O)N2C=CSC2=N1)CCN3CCC(=C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)CC3	{1: 1, 2: 2, 35: 1, 33: 2, 7: 1, 41: 1, 11: 4, 14: 10, 15: 1, 16: 2, 25: 1}
Did not match all atoms present	87056-78-8	CCCN1CC(CC2C1CC3=C(C2)C(=CC=C3)O)NS(=O)(=O)N(CC)CC	{1: 3, 2: 4, 33: 2, 11: 4, 12: 3, 14: 3, 21: 1, 29: 2, 31: 1}
Did not match all atoms present	871-27-2	CC[Al]CC	{1: 2, 2: 2}
Did not match all atoms present	871-31-8	CCN=[N+]=[N-]	{1: 1, 2: 1, 34: 2}
Did not match all atoms present	871-41-0	CCCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 6, 17: 3}
Did not match all atoms present	871-58-9	CCCCOC(=S)[S-].[K+]	{1: 1, 2: 3, 22: 1, 7: 1}
Did not match all atoms present	871-67-0	C(CCCNC(=S)[S-])CCNC(=S)[S-].[Na+].[Na+]	{2: 6, 31: 2, 7: 2}
Did not match all atoms present	871-92-1	CCCCCCCC[Si]	{1: 1, 2: 7}
Did not match all atoms present	87110-35-8	CN1C=CC(=N1)SC	{40: 1, 1: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	87110-36-9	CN1C(=CC=N1)SC	{40: 1, 1: 2, 35: 1, 14: 2, 33: 1}
Did not match all atoms present	87110-37-0	CN1C(=S)C=CN1	{32: 1, 1: 1, 14: 2, 33: 1}
Did not match all atoms present	87121-06-0	C[Si](C)(C)OC(=CC=C)O[Si](C)(C)C	{1: 6, 22: 2, 5: 1, 6: 2, 7: 1}
Did not match all atoms present	87123-46-4	CC1=NC(=NN1)N/N=C/C2=CC=CC=C2	{32: 1, 1: 1, 34: 1, 35: 2, 6: 1, 14: 5, 31: 1}
Did not match all atoms present	87130-20-9	CCOC1=C(C=C(C=C1)NC(=O)OC(C)C)OCC	{1: 4, 2: 2, 3: 1, 14: 3, 22: 2, 28: 1, 31: 1}
Did not match all atoms present	871518-84-2	CC(O)COC(C)c1ccccc1	{1: 2, 2: 1, 3: 2, 14: 5, 20: 1, 22: 1}
Did not match all atoms present	87171-21-9	CCC(CC)C1(C(=O)NC(=S)NC1=O)CC	{32: 2, 1: 3, 2: 3, 3: 1, 13: 1, 15: 1, 25: 2}
Did not match all atoms present	87185-24-8	C1=CC2=CC(=C(C=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 5}
Did not match all atoms present	87186-92-3	CCC(=O)NC1=CC=CC(=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O	{1: 1, 2: 1, 14: 9, 20: 1, 24: 1, 25: 2, 29: 2, 30: 1, 31: 2}
Did not match all atoms present	87193-95-1	[Ar].[Hg]	{}
Did not match all atoms present	87198-15-0	F[As](Cl)(Cl)(Cl)Cl	{16: 1, 17: 4}
Did not match all atoms present	87199-16-4	B(C1=CC(=CC=C1)C=O)(O)O	{26: 1, 20: 2, 14: 4}
Did not match all atoms present	87199-18-6	B(C1=CC(=CC=C1)O)(O)O	{20: 2, 21: 1, 14: 4}
Did not match all atoms present	872-31-1	C1=CSC=C1Br	{41: 1, 18: 1, 14: 3}
Did not match all atoms present	872-35-5	C1=CNC(=S)N1	{32: 2, 14: 2}
Did not match all atoms present	872-46-8	C1C=CC[Si]1(Cl)Cl	{17: 2, 11: 2, 14: 2}
Did not match all atoms present	872-49-1	CN1C=NC=C1Cl	{1: 1, 35: 1, 33: 1, 14: 2, 17: 1}
Did not match all atoms present	872-55-9	CCC1=CC=CS1	{1: 1, 2: 1, 14: 3, 41: 1}
Did not match all atoms present	872-73-1	CC1=CC=CC=[N+]1C.[I-]	{1: 2, 19: 1, 14: 4, 33: 1}
Did not match all atoms present	872-85-5	C1=CN=CC=C1C=O	{26: 1, 35: 1, 14: 4}
Did not match all atoms present	872-89-9	C[Te]C1=CC=CC=C1	{1: 1, 14: 5}
Did not match all atoms present	872-93-5	CC1CCS(=O)(=O)C1	{1: 1, 11: 3, 12: 1, 29: 2}
Did not match all atoms present	872-94-6	CC1=CS(=O)(=O)CC1	{1: 1, 11: 2, 29: 2, 14: 1, 15: 1}
Did not match all atoms present	87205-48-9	CC(C)(C)P1[Si]2(P1C(C)(C)C)P(P2C(C)(C)C)C(C)(C)C	{1: 12, 4: 4}
Did not match all atoms present	87233-62-3	CCOCCN1C(=NC2=CC=CC=C12)N3CCN(CCC3)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 3, 35: 1, 6: 4, 33: 3, 11: 5, 14: 4, 22: 1, 27: 4}
Did not match all atoms present	87237-48-7	CCOCCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl	{1: 2, 2: 3, 3: 1, 4: 1, 14: 6, 16: 3, 17: 1, 35: 1, 22: 3, 28: 1}
Did not match all atoms present	87290-97-9	C[Si](C)C#CC1=CC=CC=C1	{1: 2, 10: 2, 14: 5}
Did not match all atoms present	873-31-4	C#CC1=CC=CC=C1Cl	{9: 1, 10: 1, 14: 4, 17: 1}
Did not match all atoms present	873-32-5	C1=CC=C(C(=C1)C#N)Cl	{17: 1, 37: 1, 14: 4}
Did not match all atoms present	873-38-1	C1=CC(=C(C=C1Cl)Br)N	{17: 1, 18: 1, 30: 1, 14: 3}
Did not match all atoms present	873-49-4	C1CC1C2=CC=CC=C2	{11: 2, 12: 1, 14: 5}
Did not match all atoms present	873-50-7	CC1=NN(C=C1)C(=O)N	{1: 1, 35: 1, 33: 1, 14: 2, 24: 1, 30: 1}
Did not match all atoms present	873-51-8	B(C1=CC=CC=C1)(Cl)Cl	{17: 2, 14: 5}
Did not match all atoms present	873-55-2	C1=CC=C(C=C1)S(=O)[O-].[Na+]	{29: 2, 14: 5}
Did not match all atoms present	873-62-1	C1=CC(=CC(=C1)O)C#N	{21: 1, 14: 4, 37: 1}
Did not match all atoms present	873-63-2	C1=CC(=CC(=C1)Cl)CO	{17: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	873-64-3	CCC1=NC(=C(S1)C)C	{1: 3, 2: 1, 35: 1, 41: 1}
Did not match all atoms present	873-66-5	CC=CC1=CC=CC=C1	{1: 1, 14: 5, 6: 2}
Did not match all atoms present	873-67-6	C1=CC=C(C=C1)C#[N+][O-]	{34: 1, 29: 1, 14: 5}
Did not match all atoms present	873-73-4	C#CC1=CC=C(C=C1)Cl	{9: 1, 10: 1, 14: 4, 17: 1}
Did not match all atoms present	873-74-5	C1=CC(=CC=C1C#N)N	{30: 1, 14: 4, 37: 1}
Did not match all atoms present	873-75-6	C1=CC(=CC=C1CO)Br	{2: 1, 20: 1, 18: 1, 14: 4}
Did not match all atoms present	873-76-7	C1=CC(=CC=C1CO)Cl	{17: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	873-83-6	C1=C(NC(=O)NC1=O)N	{32: 2, 25: 2, 30: 1, 14: 1}
Did not match all atoms present	873-97-2	CC1(COP(=O)(OC1)C)C	{1: 3, 11: 2, 29: 1, 13: 1, 23: 2}
Did not match all atoms present	873-99-4	CC1(COP(=O)(OC1)O)C	{1: 2, 11: 2, 13: 1, 20: 1, 23: 2, 29: 1}
Did not match all atoms present	87327-65-9	CC(C1=C(C=CC=C1F)F)O	{16: 2, 1: 1, 3: 1, 20: 1, 14: 3}
Did not match all atoms present	87331-12-2	[OH-].[Na].[Na+].[Na+]	{}
Did not match all atoms present	87331-13-3	[F-].[Na+].[Na+]	{16: 1}
Did not match all atoms present	87331-16-6	[Cl-].[Cs+].[Cs+]	{17: 1}
Did not match all atoms present	87373-48-6	C1CC2(CCC1N=N2)C3=CC=CC=C3	{35: 2, 11: 4, 12: 1, 13: 1, 14: 5}
Did not match all atoms present	87392-12-9	CCC1=CC=CC(=C1N([C@@H](C)COC)C(=O)CCl)C	{1: 4, 2: 3, 3: 1, 33: 1, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	874-05-5	C1=CC=C2C(=C1)C(=NN2)N	{32: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	874-24-8	C1=CC(=C(N=C1)C(=O)O)O	{35: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	874-35-1	CC1=CC2=C(CCC2)C=C1	{1: 1, 11: 3, 14: 3}
Did not match all atoms present	874-39-5	CC1=CC2=NC=CN2C=C1	{1: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	874-41-9	CCC1=C(C=C(C=C1)C)C	{1: 3, 2: 1, 14: 3}
Did not match all atoms present	874-42-0	C1=CC(=C(C=C1Cl)Cl)C=O	{17: 2, 26: 1, 14: 3}
Did not match all atoms present	874-60-2	CC1=CC=C(C=C1)C(=O)Cl	{24: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	874-63-5	CC1=CC(=CC(=C1)OC)C	{1: 3, 22: 1, 14: 3}
Did not match all atoms present	874-66-8	CC(=CC1=CC=CO1)C=O	{1: 1, 6: 1, 7: 1, 14: 3, 23: 1, 26: 1}
Did not match all atoms present	874-79-3	CCCSC1=CC=CC=C1	{40: 1, 1: 1, 2: 2, 14: 5}
Did not match all atoms present	874-83-9	CC(=O)C=CC1=CC=CS1	{24: 1, 1: 1, 14: 3, 6: 2, 41: 1}
Did not match all atoms present	874-86-2	C1=CC(=CC=C1CCl)C#N	{17: 1, 2: 1, 37: 1, 14: 4}
Did not match all atoms present	874-90-8	COC1=CC=C(C=C1)C#N	{1: 1, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	874-98-6	COC1=CC=CC(=C1)CBr	{1: 1, 2: 1, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	87413-09-0	CC(=O)OI1(C2=CC=CC=C2C(=O)O1)(OC(=O)C)OC(=O)C	{1: 3, 19: 1, 28: 4, 14: 4}
Did not match all atoms present	87414-49-1	CC(=CCC1=C(C=CC(=C1)COC(=O)[C@]2(C(=C(C(=O)O2)O)C3=CC=C(C=C3)O)C)O)C	{1: 3, 2: 2, 6: 1, 7: 1, 13: 1, 14: 7, 15: 2, 20: 1, 21: 2, 28: 2}
Did not match all atoms present	87454-84-0	CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC(=C5)NC6=CC=CC=C6F	{1: 2, 2: 2, 33: 1, 13: 1, 14: 14, 16: 1, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	87457-99-6	CCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	87458-01-3	CCCCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 5, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	87473-92-5	CC1(SC2=CC=CC=C2S1)C	{1: 2, 13: 1, 14: 4, 41: 2}
Did not match all atoms present	87478-71-5	CC(C)[NH3+].[N+](=O)([O-])[O-]	{1: 2, 3: 1}
Did not match all atoms present	875-06-9	CC1(C2CCC(C2)(C1=S)C)C	{1: 3, 11: 3, 12: 1, 13: 2, 15: 1}
Did not match all atoms present	875-30-9	CC1=CN(C2=CC=CC=C12)C	{1: 2, 14: 5, 33: 1}
Did not match all atoms present	875-31-0	CN1C=NC2=C1NC=NC2=O	{32: 1, 1: 1, 35: 2, 33: 1, 14: 2, 25: 1}
Did not match all atoms present	875-51-4	C1=CC(=C(C=C1Br)[N+](=O)[O-])N	{18: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	875-59-2	CC1=C(C=CC(=C1)O)C(=O)C	{24: 1, 1: 2, 21: 1, 14: 3}
Did not match all atoms present	875-74-1	C1=CC=C(C=C1)[C@H](C(=O)O)N	{27: 1, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	875-79-6	CC1=CC2=CC=CC=C2N1C	{1: 2, 14: 5, 33: 1}
Did not match all atoms present	875-80-9	CC1=C(N2C=CC=CC2=N1)C	{1: 2, 35: 1, 14: 4, 33: 1}
Did not match all atoms present	875-85-4	CCC1=C(C=C(C=C1)O)CC	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	87515-67-1	CC[N+]1=C(SC2=CC=CC=C21)SCC.[I-]	{1: 2, 2: 2, 33: 1, 40: 1, 41: 1, 14: 4, 19: 1}
Did not match all atoms present	87534-11-0	C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[NH4+].[NH4+].[NH4+].[OH-].[Zr+4]	{24: 3}
Did not match all atoms present	87591-03-5	CC(C)C1=CC(=C(C=C1)C(C)C)F	{16: 1, 1: 4, 3: 2, 14: 3}
Did not match all atoms present	87591-05-7	CC(C)C1=C(C(=CC=C1)C(C)C)F	{16: 1, 1: 4, 3: 2, 14: 3}
Did not match all atoms present	87598-22-9	C(=S)C#N	{37: 1, 6: 1}
Did not match all atoms present	876-02-8	CC1=C(C=CC(=C1)C(=O)C)O	{24: 1, 1: 2, 21: 1, 14: 3}
Did not match all atoms present	876-08-4	C1=CC(=CC=C1CCl)C(=O)Cl	{24: 1, 17: 2, 2: 1, 14: 4}
Did not match all atoms present	876-20-0	[2H]C([2H])(C1=CC=CC=C1)C([2H])([2H])N	{2: 2, 30: 1, 14: 5}
Did not match all atoms present	876-27-7	CC(=O)OC1=CC=C(C=C1)Cl	{1: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	876-31-3	C1=CC(=CC=C1CC#N)C#N	{2: 1, 37: 2, 14: 4}
Did not match all atoms present	876-83-5	CC1C(=O)C2=CC=CC=C2C1=O	{1: 1, 12: 1, 14: 4, 25: 2}
Did not match all atoms present	876-98-2	CC1=C(C(=CC=C1)C)OC(=O)C	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	87630-35-1	CC(C)[Si](C(C)C)(C(C)C)N1C=CC=C1	{1: 6, 3: 3, 14: 4, 33: 1}
Did not match all atoms present	87674-68-8	CC1=CSC(=C1N(C(C)COC)C(=O)CCl)C	{1: 4, 2: 2, 3: 1, 33: 1, 41: 1, 14: 1, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	87676-07-1	CC1=CSC(=C1NC(C)COC)C	{1: 4, 2: 1, 3: 1, 41: 1, 14: 1, 22: 1, 31: 1}
Did not match all atoms present	87687-70-5	C[C@H]1/C=C/C=C/C=C/C=C/C=C/C=C/C=C/[C@@H](C[C@H]2[C@@H]([C@H](C[C@](O2)(C[C@H](C[C@H]([C@@H](CC[C@H](C[C@H](CC(=O)O[C@H]([C@@H]([C@@H]1O)C)C)O)O)O)O)O)O)O)C(=O)O)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O)N)O.C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C.[Na+]	{1: 7, 2: 2, 3: 1, 11: 16, 12: 25, 13: 3, 14: 14, 20: 12, 22: 1, 23: 2, 24: 1, 27: 1, 28: 1, 30: 1}
Did not match all atoms present	877-07-6	B1(N(B(N(B(N1C)C)C)C)C)C	{1: 6, 33: 3}
Did not match all atoms present	877-08-7	CC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)C	{1: 2, 17: 4}
Did not match all atoms present	877-09-8	CC1=C(C(=C(C(=C1Cl)Cl)Cl)C)Cl	{1: 2, 17: 4}
Did not match all atoms present	877-10-1	CC1=C(C(=C(C(=C1Cl)Cl)C)Cl)Cl	{1: 2, 17: 4}
Did not match all atoms present	877-11-2	CC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 1, 17: 5}
Did not match all atoms present	877-22-5	COC1=CC=CC(=C1O)C(=O)O	{1: 1, 22: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	877-24-7	C1=CC=C(C(=C1)C(=O)O)C(=O)[O-].[K+]	{24: 1, 27: 1, 14: 4}
Did not match all atoms present	877-42-9	CC1=NC2=C(C=C1)C=C(C=C2)Br	{1: 1, 18: 1, 35: 1, 14: 5}
Did not match all atoms present	877-43-0	CC1=CC2=C(C=C1)N=C(C=C2)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	877-44-1	CCC1=CC(=C(C=C1)CC)CC	{1: 3, 2: 3, 14: 3}
Did not match all atoms present	877-48-5	CC1=CC(=C(C=C1)C)OC(=O)C	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	877-53-2	CC1=CC(=C(C=C1)OC(=O)C)C	{1: 3, 28: 1, 14: 3}
Did not match all atoms present	877-65-6	CC(C)(C)C1=CC=C(C=C1)CO	{1: 3, 2: 1, 4: 1, 14: 4, 20: 1}
Did not match all atoms present	877-66-7	CS(=O)(=O)C1=CC=C(C=C1)NN	{1: 1, 30: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	877-68-9	COC1=CC=C(C=C1)[Si](C)(C)C	{1: 4, 22: 1, 14: 4}
Did not match all atoms present	877-89-4	COC1=NC(=NC(=N1)OC)OC	{1: 3, 35: 3, 22: 3}
Did not match all atoms present	877-95-2	CC(=O)NCCC1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	87719-24-2	CC1=C(C=CC(=C1)[N+]#N)N2CCCC2.C1=C(C=C(C=C1C(=O)O)S(=O)(=O)[O-])C(=O)O	{1: 1, 34: 1, 33: 1, 11: 4, 14: 6, 27: 2, 29: 3}
Did not match all atoms present	87730-60-7	CC1=C(C=CC(=C1)Cl)N=NC2=CC(=C(C=C2)OCC3=CC=CC=C3)C=O	{1: 1, 2: 1, 34: 2, 14: 11, 17: 1, 22: 1, 26: 1}
Did not match all atoms present	87730-61-8	CCOC1=CC=C(C=C1)N=NC2=CC(=C(C=C2)OCC3=CC=CC=C3)C=O	{1: 1, 34: 2, 2: 2, 14: 12, 22: 2, 26: 1}
Did not match all atoms present	87767-48-4	CC(C1=CC=C(C=C1)OC(=O)N(SN(C(=O)O/N=C/2\SCCSC2)C)C)(C3=CC=C(C=C3)OC(=O)N(SN(C(=O)O/N=C/4\SCCSC4)C)C)C	{1: 6, 34: 2, 4: 1, 33: 4, 40: 2, 41: 4, 11: 6, 14: 8, 15: 2, 28: 4}
Did not match all atoms present	87778-95-8	CC1=C(C(C(=C1C)C)(C)[Si](C)(C)C)C	{1: 8, 13: 1, 15: 4}
Did not match all atoms present	878-00-2	CC(=O)OC1=CC=C(C=C1)C=O	{1: 1, 26: 1, 28: 1, 14: 4}
Did not match all atoms present	878-28-4	C1CNCCN1.C1=CC(=CC=C1O)O	{32: 2, 11: 4, 21: 2, 14: 4}
Did not match all atoms present	87820-88-0	CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)C)C)NOCC	{1: 5, 2: 2, 7: 1, 11: 2, 12: 1, 14: 2, 15: 1, 22: 1, 25: 2, 31: 1}
Did not match all atoms present	87842-94-2	C1CCC#CC2=C3C(=CC=C2)C=CC=C3C#CCC1	{10: 4, 11: 5, 14: 6}
Did not match all atoms present	87855-94-5	CCCC(C)COP(=S)(OCC(C)CCC)[S-].CCCC(C)COP(=S)(OCC(C)CCC)[S-].[Zn+2]	{1: 8, 2: 12, 3: 4, 22: 4}
Did not match all atoms present	879-08-3	CCN1C=NC2=C1NC(=NC2=O)N	{32: 1, 1: 1, 2: 1, 35: 2, 33: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	879-12-9	CC1=CC2=CC=CC=C2C(=C1C)C	{1: 3, 14: 5}
Did not match all atoms present	879-18-5	C1=CC=C2C(=C1)C=CC=C2C(=O)Cl	{24: 1, 17: 1, 14: 7}
Did not match all atoms present	879-37-8	C1=CC=C2C(=C1)C(=CN2)CC(=O)N	{24: 1, 32: 1, 2: 1, 30: 1, 14: 5}
Did not match all atoms present	879-39-0	C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)[N+](=O)[O-]	{17: 4, 38: 1, 14: 1}
Did not match all atoms present	879-60-7	CN1C(=O)OC(=N1)C2=CC=CC=C2	{1: 1, 35: 1, 28: 1, 14: 5, 33: 1}
Did not match all atoms present	879-72-1	CN(C)CCC(=O)C1=CC=CC=C1.Cl	{1: 2, 2: 2, 33: 1, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	879-97-0	CC1=CC(=CC(=C1O)C)C(C)(C)C	{1: 5, 4: 1, 21: 1, 14: 2}
Did not match all atoms present	87903-39-7	C1=CC=C(C(=C1)C(=O)O)O[O-].[Pb+2]	{27: 1, 22: 1, 14: 4, 29: 1}
Did not match all atoms present	87945-06-0	CC(C)C1=CC(=CC(=C1)Cl)C(C)C	{1: 4, 3: 2, 14: 3, 17: 1}
Did not match all atoms present	87961-59-9	C[C-]1C(=C(C(=C1C)C)C)C.C[PH+](C)CC[PH+](C)C.[Co]	{1: 9, 2: 2}
Did not match all atoms present	87963-93-7	O[SiH2][SiH3]	{20: 1}
Did not match all atoms present	87965-36-4	O=[PH]([O-])O	{20: 1, 29: 2}
Did not match all atoms present	88-02-8	CC1=C(C=C(C=C1N)N)N	{1: 1, 30: 3, 14: 2}
Did not match all atoms present	88-03-9	CC1=C(C=C(C=C1O)O)O	{1: 1, 21: 3, 14: 2}
Did not match all atoms present	88-04-0	CC1=CC(=CC(=C1Cl)C)O	{1: 2, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	88-05-1	CC1=CC(=C(C(=C1)C)N)C	{1: 3, 30: 1, 14: 2}
Did not match all atoms present	88-06-2	C1=C(C=C(C(=C1Cl)O)Cl)Cl	{17: 3, 21: 1, 14: 2}
Did not match all atoms present	88-11-9	CCN(CC)C(=S)Cl	{1: 2, 2: 2, 17: 1, 33: 1, 7: 1}
Did not match all atoms present	88-13-1	C1=CSC=C1C(=O)O	{41: 1, 27: 1, 14: 3}
Did not match all atoms present	88-14-2	C1=COC(=C1)C(=O)O	{27: 1, 14: 3, 23: 1}
Did not match all atoms present	88-15-3	CC(=O)C1=CC=CS1	{24: 1, 1: 1, 14: 3, 41: 1}
Did not match all atoms present	88-16-4	C1=CC=C(C(=C1)C(F)(F)F)Cl	{16: 3, 17: 1, 4: 1, 14: 4}
Did not match all atoms present	88-17-5	C1=CC=C(C(=C1)C(F)(F)F)N	{16: 3, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	88-18-6	CC(C)(C)C1=CC=CC=C1O	{1: 3, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	88-19-7	CC1=CC=CC=C1S(=O)(=O)N	{1: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	88-20-0	CC1=CC=CC=C1S(=O)(=O)O	{1: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	88-21-1	C1=CC=C(C(=C1)N)S(=O)(=O)O	{30: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	88-22-2	CC1=CC(=C(C(=C1)S(=O)(=O)O)N)C	{1: 2, 30: 1, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	88-23-3	C1=C(C=C(C(=C1S(=O)(=O)O)O)N)Cl	{14: 2, 17: 1, 20: 1, 21: 1, 29: 2, 30: 1}
Did not match all atoms present	88-24-4	CCC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)CC)C(C)(C)C)O	{1: 8, 2: 3, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	88-26-6	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CO	{1: 6, 2: 1, 4: 2, 14: 2, 20: 1, 21: 1}
Did not match all atoms present	88-27-7	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN(C)C	{1: 8, 2: 1, 4: 2, 33: 1, 14: 2, 21: 1}
Did not match all atoms present	88-29-9	CCC1=CC2=C(C=C1C(=O)C)C(CCC2(C)C)(C)C	{1: 6, 2: 1, 11: 2, 13: 2, 14: 2, 24: 1}
Did not match all atoms present	88-30-2	C1=CC(=C(C=C1O)C(F)(F)F)[N+](=O)[O-]	{16: 3, 38: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	88-32-4	CC(C)(C)C1=C(C=CC(=C1)O)OC	{1: 4, 22: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	88-34-6	CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)Cl)C(C)(C)CC	{1: 6, 2: 3, 4: 2, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	88-35-7	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O	{38: 1, 20: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	88-38-0	C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)NC7=CC=CC=C7)S(=O)(=O)O)S(=O)(=O)O)NC8=CC=CC=C8	{35: 6, 6: 2, 14: 26, 20: 2, 29: 4, 31: 6}
Did not match all atoms present	88-39-1	C1=CC(=C(C=C1S(=O)(=O)O)S(=O)(=O)O)C=O	{26: 1, 20: 2, 29: 4, 14: 3}
Did not match all atoms present	88-40-4	CC1=CC(=C(C=C1)C(C)(C)C)OC	{1: 5, 4: 1, 22: 1, 14: 3}
Did not match all atoms present	88-42-6	C1=CC(=C(C=C1Cl)S(=O)(=O)O)Cl	{17: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	88-44-8	CC1=CC(=C(C=C1)N)S(=O)(=O)O	{1: 1, 30: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	88-45-9	C1=CC(=C(C=C1N)S(=O)(=O)O)N	{30: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	88-50-6	C1=C(C(=CC(=C1Cl)S(=O)(=O)O)Cl)N	{17: 2, 30: 1, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	88-51-7	CC1=CC(=C(C=C1Cl)N)S(=O)(=O)O	{1: 1, 14: 2, 17: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	88-52-8	CC1=CC(=C(C=C1N)N)S(=O)(=O)O	{1: 1, 30: 2, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	88-56-2	CCC1=CC(=C(C=C1Cl)S(=O)(=O)O)N	{1: 1, 2: 1, 14: 2, 17: 1, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	88-58-4	CC(C)(C)C1=CC(=C(C=C1O)C(C)(C)C)O	{1: 6, 4: 2, 21: 2, 14: 2}
Did not match all atoms present	88-60-8	CC1=CC(=C(C=C1)C(C)(C)C)O	{1: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	88-61-9	CC1=CC(=C(C=C1)S(=O)(=O)O)C	{1: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	88-62-0	CC1=CC(=C(C=C1)S(=O)(=O)O)N	{1: 1, 30: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	88-63-1	C1=CC(=C(C=C1N)N)S(=O)(=O)O	{30: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	88-64-2	CC(=O)NC1=CC(=C(C=C1)S(=O)(=O)O)N	{1: 1, 14: 3, 20: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	88-65-3	C1=CC=C(C(=C1)C(=O)O)Br	{18: 1, 27: 1, 14: 4}
Did not match all atoms present	88-66-4	C1=CC=C(C(=C1)C(Cl)Cl)Cl	{17: 3, 3: 1, 14: 4}
Did not match all atoms present	88-67-5	C1=CC=C(C(=C1)C(=O)O)I	{27: 1, 19: 1, 14: 4}
Did not match all atoms present	88-68-6	C1=CC=C(C(=C1)C(=O)N)N	{24: 1, 30: 2, 14: 4}
Did not match all atoms present	88-69-7	CC(C)C1=CC=CC=C1O	{1: 2, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	88-72-2	CC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 38: 1, 14: 4}
Did not match all atoms present	88-73-3	C1=CC=C(C(=C1)[N+](=O)[O-])Cl	{17: 1, 38: 1, 14: 4}
Did not match all atoms present	88-74-4	C1=CC=C(C(=C1)N)[N+](=O)[O-]	{38: 1, 30: 1, 14: 4}
Did not match all atoms present	88-75-5	C1=CC=C(C(=C1)[N+](=O)[O-])O	{38: 1, 21: 1, 14: 4}
Did not match all atoms present	88-76-6	CC1=NN(C(=O)C1)C2=C(C=CC(=C2)S(=O)(=O)O)Cl	{1: 1, 35: 1, 33: 1, 11: 1, 14: 3, 15: 1, 17: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	88-82-4	C1=C(C=C(C(=C1I)I)C(=O)O)I	{27: 1, 19: 3, 14: 2}
Did not match all atoms present	88-85-7	CCC(C)C1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 2, 14: 2, 21: 1}
Did not match all atoms present	88-87-9	C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])Cl	{17: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	88-88-0	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])[N+](=O)[O-]	{17: 1, 38: 3, 14: 2}
Did not match all atoms present	88-89-1	C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 21: 1, 14: 2}
Did not match all atoms present	88-90-4	CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-]	{1: 1, 38: 2, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	88-95-9	C1=CC=C(C(=C1)C(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 14: 4}
Did not match all atoms present	88-96-0	C1=CC=C(C(=C1)C(=O)N)C(=O)N	{24: 2, 30: 2, 14: 4}
Did not match all atoms present	88-97-1	C1=CC=C(C(=C1)C(=O)N)C(=O)O	{24: 1, 27: 1, 30: 1, 14: 4}
Did not match all atoms present	88-99-3	C1=CC=C(C(=C1)C(=O)O)C(=O)O	{27: 2, 14: 4}
Did not match all atoms present	880-78-4	C1(=C(C(=C(C(=C1F)F)F)F)F)[N+](=O)[O-]	{16: 5, 38: 1}
Did not match all atoms present	880-93-3	CC1=CC=C(C2=CC=CC=C12)[N+](=O)[O-]	{1: 1, 38: 1, 14: 6}
Did not match all atoms present	88010-92-8	C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)N3C=NC4=C3NC(=NC4=S)N)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6	{32: 1, 33: 1, 2: 1, 35: 2, 12: 4, 14: 16, 23: 1, 28: 3, 30: 1}
Did not match all atoms present	88038-94-2	CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O	{1: 1, 2: 2, 27: 1, 14: 8}
Did not match all atoms present	88040-86-2	CC1=CC(=C(C=C1)OC)S(=O)(=O)Cl	{1: 2, 29: 2, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	88054-22-2	CC1=NC=C(N1)[N+](=O)[O-]	{32: 1, 1: 1, 35: 1, 38: 1, 14: 1}
Did not match all atoms present	88056-92-2	C1C[C@H](N2[C@@H](C1)OC[C@H]2C3=CC=CC=C3)C#N	{33: 1, 37: 1, 11: 4, 12: 3, 14: 5, 23: 1}
Did not match all atoms present	88069-49-2	CC1=C(C(=CC=C1)C)NC(=O)CC23CCCN2CCC3.Cl	{1: 2, 2: 1, 33: 1, 11: 6, 13: 1, 14: 3, 17: 1, 24: 1, 31: 1}
Did not match all atoms present	881-03-8	CC1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 14: 6}
Did not match all atoms present	881-07-2	CC1=NC2=C(C=CC=C2[N+](=O)[O-])C=C1	{1: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	881-50-5	CC(=O)NC1=C(C=C(C=C1)Br)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	881-67-4	COC(C1=CC=C(C=C1)[N+](=O)[O-])OC	{38: 1, 1: 2, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	881-68-5	CC(=O)OC1=C(C=C(C=C1)C=O)OC	{1: 2, 26: 1, 28: 1, 22: 1, 14: 3}
Did not match all atoms present	881-90-3	CC1=NC(=CC2=CC=CC=C2)C(=O)O1	{1: 1, 35: 1, 6: 1, 14: 5, 15: 2, 28: 1}
Did not match all atoms present	881-99-2	C1=CC(=CC(=C1)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{17: 6, 4: 2, 14: 4}
Did not match all atoms present	88108-42-3	CCOC1=CC=C(C=C1)N=NC2=CC(=C(C(=C2)C)OCC3=CC=CC=C3)C	{1: 3, 2: 2, 34: 2, 22: 2, 14: 11}
Did not match all atoms present	88108-44-5	CCC(C)C1=C(C=CC(=C1)N=NC2=CC=C(C=C2)OCC)OCC3=CC=CC=C3	{1: 3, 34: 2, 3: 1, 2: 3, 14: 12, 22: 2}
Did not match all atoms present	88112-75-8	C1=CC(=C(C=C1Br)F)N=C=O	{34: 1, 8: 1, 14: 3, 16: 1, 18: 1, 29: 1}
Did not match all atoms present	88127-54-2	C[Si](C)(CCl)OC1=CC=CC=C1Cl	{1: 2, 2: 1, 22: 1, 14: 4, 17: 2}
Did not match all atoms present	88150-42-9	CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCN	{32: 1, 1: 3, 2: 4, 12: 1, 14: 4, 15: 4, 17: 1, 22: 1, 28: 2, 30: 1}
Did not match all atoms present	88159-08-4	C1=CC(=C(C=C1NC2=NC(=NC(=N2)N)F)NC(=O)N)N=NC3=C(C=C4C=C(C=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 35: 3, 14: 7, 16: 1, 24: 1, 29: 9, 30: 2, 31: 2}
Did not match all atoms present	88166-55-6	CCCCCCCCCCCCNC1=NC=NC2=C1NC=N2	{32: 1, 1: 1, 2: 11, 35: 3, 14: 2, 31: 1}
Did not match all atoms present	88170-17-6	[CH2]C1=CC=C(C=C1)O	{5: 1, 14: 4, 21: 1}
Did not match all atoms present	88193-04-8	CC1=CC2=C(C3=CC=CC=C13)C4=C(N2)C=C(C5=CC=CC=C54)C	{32: 1, 1: 2, 14: 10}
Did not match all atoms present	882-00-8	CC(CC1=CC=C(C=C1)C(F)(F)F)N.Cl	{1: 1, 2: 1, 3: 1, 4: 1, 14: 4, 16: 3, 17: 1, 30: 1}
Did not match all atoms present	882-09-7	CC(C)(C(=O)O)OC1=CC=C(C=C1)Cl	{1: 2, 4: 1, 14: 4, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	882-26-8	C1=CC(=CC(=C1)[N+](=O)[O-])C=C[N+](=O)[O-]	{38: 2, 14: 4, 6: 2}
Did not match all atoms present	882-33-7	C1=CC=C(C=C1)SSC2=CC=CC=C2	{40: 2, 14: 10}
Did not match all atoms present	882-36-0	CC(=O)CC(=O)NCC1=CC=CC=C1	{24: 2, 1: 1, 2: 2, 14: 5, 31: 1}
Did not match all atoms present	882-69-9	CC1(COP(=O)(OC1)C2=CC=CC=C2)C	{1: 2, 11: 2, 13: 1, 14: 5, 23: 2, 29: 1}
Did not match all atoms present	88246-66-6	CC(C)C=C(O[Si](C)(C)C)O[Si](C)(C)C	{1: 8, 3: 1, 22: 2, 6: 1, 7: 1}
Did not match all atoms present	88254-07-3	CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N6CCOCC6C#N)O	{1: 2, 2: 1, 37: 1, 33: 1, 11: 6, 12: 6, 13: 1, 14: 3, 20: 3, 21: 2, 22: 2, 23: 2, 24: 1, 25: 2}
Did not match all atoms present	88255-01-0	CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=NCCS(=O)(=O)O)NC(=O)OC	{1: 2, 2: 4, 38: 1, 7: 1, 40: 1, 34: 1, 14: 3, 20: 1, 28: 1, 29: 2, 31: 2}
Did not match all atoms present	88266-67-5	CC1=C(N=C(N=C1N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)C(=O)N[C@@H]([C@H](C2=CN=CN2)O[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)CO)O)O)O[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)OC(=O)N)O)C(=O)N[C@H](C)[C@H]([C@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCN(C)CCCN(CC7=CC(=C(C=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)CC1=CC(=C(C=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)O	{32: 1, 1: 5, 2: 18, 3: 9, 33: 2, 41: 2, 12: 10, 14: 30, 35: 5, 20: 8, 22: 6, 23: 2, 24: 7, 28: 1, 30: 5, 31: 6}
Did not match all atoms present	88283-41-4	CO/N=C(/CC1=CN=CC=C1)\C2=C(C=C(C=C2)Cl)Cl	{1: 1, 2: 1, 35: 1, 7: 1, 34: 1, 14: 7, 17: 2, 22: 1}
Did not match all atoms present	88284-48-4	C[Si](C)(C)C1=CC=CC=C1OS(=O)(=O)C(F)(F)F	{1: 3, 4: 1, 14: 4, 16: 3, 22: 1, 29: 2}
Did not match all atoms present	883-20-5	CC1=CC2=CC=CC=C2C3=CC=CC=C13	{1: 1, 14: 9}
Did not match all atoms present	883-39-6	C1=CC=C(C=C1)N2C3=CC=CC=C3N=N2	{33: 1, 35: 2, 14: 9}
Did not match all atoms present	883-40-9	C1=CC=C(C=C1)C(=[N+]=[N-])C2=CC=CC=C2	{34: 1, 14: 10, 7: 1}
Did not match all atoms present	883-62-5	COC1=CC2=CC=CC=C2C=C1C(=O)O	{1: 1, 27: 1, 22: 1, 14: 6}
Did not match all atoms present	883-93-2	C1=CC=C(C=C1)C2=NC3=CC=CC=C3S2	{41: 1, 35: 1, 14: 9}
Did not match all atoms present	883-99-8	COC(=O)C1=CC2=CC=CC=C2C=C1O	{1: 1, 28: 1, 21: 1, 14: 6}
Did not match all atoms present	88303-12-2	CC1=CC=C(C=C1)S(=O)(=O)N(C)F	{16: 1, 1: 2, 29: 2, 14: 4, 33: 1}
Did not match all atoms present	88303-17-7	CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)(C)C)F	{1: 4, 2: 1, 4: 1, 33: 1, 14: 4, 16: 1, 29: 2}
Did not match all atoms present	88338-63-0	CC1=NC(=NO1)CN2C=NC3=C2C(=O)N(C(=O)N3C)C	{1: 3, 2: 1, 35: 3, 33: 3, 14: 1, 23: 1, 25: 2}
Did not match all atoms present	88374-55-4	CCCCCCCCOC1=CC=C(C=C1)C#N	{1: 1, 2: 7, 22: 1, 14: 4, 37: 1}
Did not match all atoms present	88377-29-1	COC1=CC=CC(=C1Br)C(=O)O	{1: 1, 18: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	88394-54-1	CC(O)(P(=O)(O)O)P(=O)(O)[O-].C(CO)[NH+](CCO)CCO	{1: 1, 2: 6, 4: 1, 29: 3, 20: 7}
Did not match all atoms present	88394-55-2	CC(O)(P(=O)(O)O)P(=O)(O)[O-].C(CO)[NH2+]CCO	{1: 1, 2: 4, 4: 1, 29: 3, 20: 6}
Did not match all atoms present	884-33-3	C1=CC=C(C=C1)CC(CC(=O)O)C(=O)O	{27: 2, 2: 2, 3: 1, 14: 5}
Did not match all atoms present	884-35-5	COC1=CC(=CC(=C1O)OC)C(=O)OC	{1: 3, 22: 2, 28: 1, 21: 1, 14: 2}
Did not match all atoms present	884-43-5	CCOC1=NC(=NC(=N1)OCC)OCC	{1: 3, 2: 3, 35: 3, 22: 3}
Did not match all atoms present	884-89-9	CC1(COP(=O)(OC1)OC2=CC=CC=C2)C	{1: 2, 11: 2, 13: 1, 14: 5, 22: 1, 23: 2, 29: 1}
Did not match all atoms present	88404-25-5	COC1=C(C=C2C(=C1)C(=CC(=O)O2)CBr)OC	{1: 2, 2: 1, 14: 3, 18: 1, 22: 2, 28: 1}
Did not match all atoms present	88419-56-1	C1=C(C(=CC(=C1F)F)F)C(=O)Cl	{16: 3, 17: 1, 14: 2, 24: 1}
Did not match all atoms present	88449-52-9	[O-]P(=O)([O-])OP(=O)([O-])[O-].[Ag+].[Ag+].[Ag+].[Ag+]	{29: 6, 22: 1}
Did not match all atoms present	88475-55-2	CN1CCC2=CC=CC=C21	{1: 1, 11: 2, 14: 4, 33: 1}
Did not match all atoms present	88476-02-2	C(=S(F)(F)(F)F)C(F)(F)F	{16: 7, 4: 1, 6: 1}
Did not match all atoms present	88485-37-4	C1COC(O1)CON=C(C2=CC=C(C=C2)Cl)C(F)(F)F	{2: 1, 4: 1, 7: 1, 11: 2, 12: 1, 34: 1, 14: 4, 16: 3, 17: 1, 22: 1, 23: 2}
Did not match all atoms present	885-81-4	CCOC1=CC(=C(C=C1)NC(=O)C)[N+](=O)[O-]	{1: 2, 2: 1, 38: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	88542-70-5	CC(C)C=C1C2=CC=CC=C2C(=O)O1	{1: 2, 3: 1, 6: 1, 14: 4, 15: 1, 28: 1}
Did not match all atoms present	88552-03-8	C1=CC=C(C=C1)/C(=C/C(=O)C(C(F)F)(F)F)/S	{3: 1, 4: 1, 6: 1, 7: 1, 39: 1, 14: 5, 16: 4, 24: 1}
Did not match all atoms present	88578-22-7	CC1=CC(=C(C=C1)C)N=NC2=CC=C(C=C2)OC	{1: 3, 34: 2, 22: 1, 14: 7}
Did not match all atoms present	88578-24-9	CC1=C(C=CC(=C1)Cl)N=NC2=CC=C(C=C2)OC	{1: 2, 34: 2, 22: 1, 14: 7, 17: 1}
Did not match all atoms present	88578-27-2	CC1=CC(=C(C=C1)C)N=NC2=CC(=C(C=C2)OCC3=CC=CC=C3)Cl	{1: 2, 2: 1, 34: 2, 14: 11, 17: 1, 22: 1}
Did not match all atoms present	88578-28-3	CC1=C(C=CC(=C1)Cl)N=NC2=CC=C(C=C2)OCC3=CC=CC=C3	{1: 1, 2: 1, 34: 2, 14: 12, 17: 1, 22: 1}
Did not match all atoms present	88578-29-4	CC1=C(C=CC(=C1)Cl)N=NC2=CC(=C(C=C2)OCC3=CC=CC=C3)Cl	{1: 1, 2: 1, 34: 2, 14: 11, 17: 2, 22: 1}
Did not match all atoms present	88578-90-9	C1=CC(=C(C=C1F)Cl)C(=O)N	{16: 1, 17: 1, 30: 1, 14: 3, 24: 1}
Did not match all atoms present	88598-54-3	C1=C(N=C(S1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN=C5N)O)O)O)O)C(=O)N	{33: 1, 2: 2, 35: 4, 41: 1, 12: 8, 14: 3, 20: 6, 22: 3, 23: 2, 24: 1, 29: 2, 30: 2}
Did not match all atoms present	886-06-6	C1CCN(CC1)CCC(=O)C2=CC=CC=C2.Cl	{33: 1, 2: 2, 11: 5, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	886-34-0	C1=C/C(=C\NC2=CC=C(C=C2)Br)/C(=O)C=C1	{6: 1, 14: 8, 15: 1, 18: 1, 25: 1, 31: 1}
Did not match all atoms present	886-35-1	C1=C(C=C(C=C1C(F)(F)F)NN)C(F)(F)F	{16: 6, 4: 2, 30: 1, 14: 3, 31: 1}
Did not match all atoms present	886-38-4	C1=CC=C(C=C1)C2=C(C2=O)C3=CC=CC=C3	{25: 1, 14: 10}
Did not match all atoms present	886-50-0	CCNC1=NC(=NC(=N1)SC)NC(C)(C)C	{1: 5, 2: 1, 35: 3, 4: 1, 40: 1, 31: 2}
Did not match all atoms present	886-58-8	CC(C)C1=CC=C(C=C1)CC2=CC=CC=C2	{1: 2, 2: 1, 3: 1, 14: 9}
Did not match all atoms present	886-65-7	C1=CC=C(C=C1)C=CC=CC2=CC=CC=C2	{14: 10, 6: 4}
Did not match all atoms present	886-66-8	C1=CC=C(C=C1)C#CC#CC2=CC=CC=C2	{10: 4, 14: 10}
Did not match all atoms present	886-74-8	C1=CC(=CC=C1OCC(COC(=O)N)O)Cl	{2: 2, 3: 1, 14: 4, 17: 1, 20: 1, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	886-86-2	CCOC(=O)C1=CC(=CC=C1)N.CS(=O)(=O)O	{1: 2, 2: 1, 14: 4, 20: 1, 28: 1, 29: 2, 30: 1}
Did not match all atoms present	88635-78-3	C1=CC=C2C(=CC=CC(=C1)C2(F)F)S(=O)(=O)Cl	{13: 1, 14: 7, 15: 3, 16: 2, 17: 1, 29: 2}
Did not match all atoms present	88635-83-0	[2H]C([2H])([2H])C1(C(OO1)(C([2H])([2H])[2H])C([2H])([2H])[2H])C([2H])([2H])[2H]	{1: 4, 13: 2, 23: 2}
Did not match all atoms present	88653-55-8	CC(=O)C1=CC=C(S1)C#N	{24: 1, 1: 1, 37: 1, 14: 2, 41: 1}
Did not match all atoms present	88671-89-0	CCCCC(CN1C=NC=N1)(C#N)C2=CC=C(C=C2)Cl	{1: 1, 2: 4, 35: 2, 4: 1, 37: 1, 33: 1, 14: 6, 17: 1}
Did not match all atoms present	88678-67-5	CC(C)(C)C1=CC(=CC=C1)OC(=S)N(C)C2=NC(=CC=C2)OC	{1: 5, 35: 1, 4: 1, 33: 1, 7: 1, 14: 7, 22: 2}
Did not match all atoms present	887-15-0	C1CC(OC1)(C2=CC=CC=C2)C3=CC=CC=C3	{11: 3, 13: 1, 14: 10, 23: 1}
Did not match all atoms present	887-54-7	COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)O)Cl)Cl	{1: 1, 27: 1, 28: 1, 17: 4}
Did not match all atoms present	88718-32-5	C1COCCOCCCOC2=CC=CC=C2OC1	{11: 8, 14: 4, 23: 4}
Did not match all atoms present	88718-33-6	C1CNCCNCCCNC2=CC=CC=C2NC1	{32: 4, 11: 8, 14: 4}
Did not match all atoms present	88744-04-1	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)OC4=C(C(=C(C(=C4F)F)F)F)F	{16: 5, 2: 1, 12: 1, 14: 8}
Did not match all atoms present	88746-71-8	CC(=O)N1C(NC(=O)CO1)C2=CC=CC=C2	{32: 1, 1: 1, 33: 1, 11: 1, 12: 1, 14: 5, 23: 1, 24: 1, 25: 1}
Did not match all atoms present	88768-45-0	C1=CN=C(N=C1)SCC(=O)O	{40: 1, 35: 2, 2: 1, 27: 1, 14: 3}
Did not match all atoms present	88780-84-1	C12=NNN=C1N=C(N=C2Cl)N	{32: 1, 17: 1, 35: 4, 30: 1}
Did not match all atoms present	88784-09-2	CCC1=CC(=C(C2=C1N=C(C=C2)Cl)NC(=O)C3=CC=CC=C3)Br	{1: 1, 2: 1, 35: 1, 14: 8, 17: 1, 18: 1, 24: 1, 31: 1}
Did not match all atoms present	888-54-0	C=CC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{34: 1, 5: 1, 38: 2, 14: 3, 6: 2, 31: 1}
Did not match all atoms present	888-71-1	C1=CC=C(C=C1)C2=NOC(=N2)C3=CC=CC=C3	{35: 2, 14: 10, 23: 1}
Did not match all atoms present	88814-72-6	CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].CCC(=O)[O-].[Cr+3].[Cr+3]	{24: 4, 1: 4, 2: 4}
Did not match all atoms present	88847-89-6	C1[C@@H]([C@H](O[C@H]1N2C3=C(C(=O)N=C(N3)N)NC2=O)CO)O	{32: 2, 33: 1, 2: 1, 35: 1, 11: 1, 12: 3, 20: 2, 23: 1, 25: 2, 30: 1}
Did not match all atoms present	88863-33-6	CC(C)[O-].CC(C)[O-].[Sr+2]	{1: 4, 3: 2, 29: 2}
Did not match all atoms present	88878-49-3	CC(C)(C)C1=CC(=CC2=C(/C(=C/C3=CC(=[S+]C(=C3)C(C)(C)C)C(C)(C)C)/C2=O)[O-])C=C(S1)C(C)(C)C	{1: 12, 4: 4, 6: 2, 41: 2, 14: 4, 15: 6, 25: 1}
Did not match all atoms present	88938-37-8	CC\1=C(C(=O)N(C(=O)/C1=N/NC2=CC=C(C=C2)C(=O)OCCOC3=CC=CC=C3)C)C#N	{1: 2, 2: 2, 37: 1, 33: 1, 34: 1, 14: 9, 15: 3, 22: 1, 25: 2, 28: 1, 31: 1}
Did not match all atoms present	88949-37-5	C1=CC=C(C=C1)C2=C3C(=C(NC3=O)C4=CC=C(C=C4)Cl)C(=O)N2	{32: 2, 17: 1, 25: 2, 14: 9, 15: 4}
Did not match all atoms present	88969-31-7	CCN1C(=C(C(=C(C1=O)C#N)C)C=CC=C2C(=C(C(=O)N(C2=O)CC)C#N)C)O.CCN(CC)CC	{1: 7, 2: 5, 37: 2, 6: 3, 33: 3, 15: 3, 21: 1, 25: 3}
Did not match all atoms present	88996-23-0	[B].CCN(C(C)C)C(C)C	{1: 5, 2: 1, 3: 2, 33: 1}
Did not match all atoms present	89-00-9	C1=CC(=C(N=C1)C(=O)O)C(=O)O	{35: 1, 27: 2, 14: 3}
Did not match all atoms present	89-01-0	C1=CN=C(C(=N1)C(=O)O)C(=O)O	{35: 2, 27: 2, 14: 2}
Did not match all atoms present	89-02-1	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)O	{38: 2, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	89-04-3	CCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCC)C(=O)OCCCCCCCC	{1: 3, 2: 21, 28: 3, 14: 3}
Did not match all atoms present	89-05-4	C1=C(C(=CC(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 14: 2}
Did not match all atoms present	89-07-6	CC(C)C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 3: 1, 38: 2, 14: 3}
Did not match all atoms present	89-13-4	CCCCCC(C)COC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C	{1: 4, 2: 12, 3: 2, 28: 2, 14: 4}
Did not match all atoms present	89-19-0	CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC	{1: 2, 2: 12, 28: 2, 14: 4}
Did not match all atoms present	89-20-3	C1=CC(=C(C=C1Cl)C(=O)O)C(=O)O	{17: 1, 27: 2, 14: 3}
Did not match all atoms present	89-21-4	COC1=C(C=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	89-24-7	C1=CC=C(C=C1)C2C(=O)NC(=O)N2	{32: 2, 25: 2, 12: 1, 14: 5}
Did not match all atoms present	89-25-8	CC1=NN(C(=O)C1)C2=CC=CC=C2	{1: 1, 35: 1, 33: 1, 11: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	89-26-9	C1C(=NN(C1=O)C2=CC(=CC=C2)N)C(=O)O	{33: 1, 35: 1, 11: 1, 14: 4, 15: 1, 25: 1, 27: 1, 30: 1}
Did not match all atoms present	89-27-0	C1C(=NN(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O	{33: 1, 35: 1, 38: 1, 11: 1, 14: 4, 15: 1, 25: 1, 27: 1}
Did not match all atoms present	89-28-1	CCCCCCCCCCCCC1=CC2=C(C=C1)NC(C=C2C)(C)C	{32: 1, 1: 4, 2: 11, 13: 1, 14: 4, 15: 1}
Did not match all atoms present	89-29-2	CC1=NN(C(=O)C1)C2=CC(=CC=C2)S(=O)(=O)N	{1: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 25: 1, 29: 2, 30: 1}
Did not match all atoms present	89-30-5	CCCCOC1=CC(=C(C=C1[N+](=O)[O-])OCCCC)Cl	{1: 2, 2: 6, 38: 1, 14: 2, 17: 1, 22: 2}
Did not match all atoms present	89-32-7	C1=C2C(=CC3=C1C(=O)OC3=O)C(=O)OC2=O	{28: 4, 14: 2}
Did not match all atoms present	89-36-1	CC1=NN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)O	{1: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 20: 1, 25: 1, 29: 2}
Did not match all atoms present	89-37-2	CN(C)C(=S)SC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 2, 33: 1, 40: 1, 7: 1, 14: 3}
Did not match all atoms present	89-39-4	COC1=CC(=C(C=C1)OC)[N+](=O)[O-]	{1: 2, 38: 1, 22: 2, 14: 3}
Did not match all atoms present	89-40-7	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)NC2=O	{32: 1, 25: 2, 38: 1, 14: 3}
Did not match all atoms present	89-41-8	COC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]	{38: 1, 1: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	89-50-9	CCNC1=CC=CC=C1C(=O)O	{1: 1, 2: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	89-51-0	C1=CC=C(C(=C1)CC(=O)O)C(=O)O	{2: 1, 27: 2, 14: 4}
Did not match all atoms present	89-52-1	CC(=O)NC1=CC=CC=C1C(=O)O	{24: 1, 1: 1, 27: 1, 14: 4, 31: 1}
Did not match all atoms present	89-54-3	C1=CC(=C(C=C1N)C(=O)O)Cl	{17: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	89-55-4	C1=CC(=C(C=C1Br)C(=O)O)O	{18: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	89-56-5	CC1=CC(=C(C=C1)O)C(=O)O	{1: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	89-57-6	C1=CC(=C(C=C1N)C(=O)O)O	{30: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	89-58-7	CC1=CC(=C(C=C1)C)[N+](=O)[O-]	{1: 2, 38: 1, 14: 3}
Did not match all atoms present	89-59-8	CC1=C(C=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	89-60-1	CC1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 14: 3, 17: 1}
Did not match all atoms present	89-61-2	C1=CC(=C(C=C1Cl)[N+](=O)[O-])Cl	{17: 2, 38: 1, 14: 3}
Did not match all atoms present	89-62-3	CC1=CC(=C(C=C1)N)[N+](=O)[O-]	{1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	89-63-4	C1=CC(=C(C=C1Cl)[N+](=O)[O-])N	{17: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	89-64-5	C1=CC(=C(C=C1Cl)[N+](=O)[O-])O	{17: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	89-68-9	CC1=CC(=C(C=C1Cl)C(C)C)O	{1: 3, 3: 1, 21: 1, 14: 2, 17: 1}
Did not match all atoms present	89-69-0	C1=C(C(=CC(=C1Cl)Cl)Cl)[N+](=O)[O-]	{17: 3, 38: 1, 14: 2}
Did not match all atoms present	89-71-4	CC1=CC=CC=C1C(=O)OC	{1: 2, 28: 1, 14: 4}
Did not match all atoms present	89-72-5	CCC(C)C1=CC=CC=C1O	{1: 2, 2: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	89-73-6	C1=CC=C(C(=C1)C(=O)NO)O	{24: 1, 20: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	89-74-7	CC1=CC(=C(C=C1)C(=O)C)C	{24: 1, 1: 3, 14: 3}
Did not match all atoms present	89-75-8	C1=CC(=C(C=C1Cl)Cl)C(=O)Cl	{24: 1, 17: 3, 14: 3}
Did not match all atoms present	89-77-0	C1=CC(=C(C=C1Cl)N)C(=O)O	{17: 1, 27: 1, 30: 1, 14: 3}
Did not match all atoms present	89-83-8	CC1=CC(=C(C=C1)C(C)C)O	{1: 3, 3: 1, 21: 1, 14: 3}
Did not match all atoms present	89-84-9	CC(=O)C1=C(C=C(C=C1)O)O	{24: 1, 1: 1, 21: 2, 14: 3}
Did not match all atoms present	89-86-1	C1=CC(=C(C=C1O)O)C(=O)O	{27: 1, 21: 2, 14: 3}
Did not match all atoms present	89-87-2	CC1=CC(=C(C=C1)[N+](=O)[O-])C	{1: 2, 38: 1, 14: 3}
Did not match all atoms present	89-92-9	CC1=CC=CC=C1CBr	{1: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	89-93-0	CC1=CC=CC=C1CN	{1: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	89-95-2	CC1=CC=CC=C1CO	{1: 1, 2: 1, 20: 1, 14: 4}
Did not match all atoms present	89-96-3	CCC1=CC=CC=C1Cl	{1: 1, 2: 1, 14: 4, 17: 1}
Did not match all atoms present	89-97-4	C1=CC=C(C(=C1)CN)Cl	{17: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	89-98-5	C1=CC=C(C(=C1)C=O)Cl	{17: 1, 26: 1, 14: 4}
Did not match all atoms present	89-99-6	C1=CC=C(C(=C1)CN)F	{16: 1, 2: 1, 30: 1, 14: 4}
Did not match all atoms present	890-38-0	C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC=NC3=O)CO)O	{32: 1, 33: 1, 2: 1, 35: 2, 11: 1, 12: 3, 14: 2, 20: 2, 23: 1, 25: 1}
Did not match all atoms present	890-51-7	C1=CC=C(C=C1)C=NC2=CC=CC3=CC=CC=C32	{34: 1, 14: 12, 6: 1}
Did not match all atoms present	89007-45-4	CC(C)C1=CC=C(C=C1)N=C=S	{8: 1, 1: 2, 34: 1, 3: 1, 14: 4}
Did not match all atoms present	89022-11-7	COC(=O)C1=CC=CC=C1OC(=O)C2=CC=C(C=C2)N=C(N)N	{1: 1, 34: 1, 7: 1, 14: 8, 28: 2, 30: 2}
Did not match all atoms present	89031-83-4	CC(C)(C)[Si](C)(C)OCCCCCl	{1: 5, 2: 4, 4: 1, 22: 1, 17: 1}
Did not match all atoms present	89031-84-5	CC(C)(C)[Si](C)(C)OCCCBr	{1: 5, 2: 3, 4: 1, 18: 1, 22: 1}
Did not match all atoms present	89047-29-0	C1=CC=[N+](C=C1)CC2=CC=C(C=C2)Br	{33: 1, 2: 1, 18: 1, 14: 9}
Did not match all atoms present	89074-92-0	CCN(CC)C1=CC=CC(=C1)C.Cl	{1: 3, 2: 2, 33: 1, 14: 4, 17: 1}
Did not match all atoms present	89091-89-4	[OH-].[K].[K+].[K+]	{}
Did not match all atoms present	89091-90-7	[OH-].[Na+].[Na+].[Na+].[Na+]	{}
Did not match all atoms present	89130-65-4	C(CN(CCN=[N+]=[N-])[N+](=O)[O-])N=[N+]=[N-]	{33: 1, 2: 4, 34: 4, 38: 1}
Did not match all atoms present	89145-01-7	C1=COC(=C1)C(=O)C=CC2=CC=CS2	{24: 1, 41: 1, 14: 6, 6: 2, 23: 1}
Did not match all atoms present	89148-95-8	CPP(C)C	{1: 3}
Did not match all atoms present	89149-01-9	CP=C	{1: 1, 5: 1}
Did not match all atoms present	89154-51-8	CCOC(=O)C1=CC=C(C=C1)N/N=C\2/C=CC(=O)C3=CC=CC=C2C3	{1: 1, 2: 1, 11: 1, 34: 1, 14: 10, 15: 3, 25: 1, 28: 1, 31: 1}
Did not match all atoms present	89194-77-4	CCN1C[C@H]2CN(C[C@@H](C1)C2OC(=O)C3=CC=C(C=C3)Cl)C	{1: 2, 2: 1, 33: 2, 11: 4, 12: 3, 14: 4, 17: 1, 28: 1}
Did not match all atoms present	892-17-1	CC1=C2C(=C3CCC(=O)C3=C1)C=CC4=CC=CC=C42	{1: 1, 11: 2, 14: 7, 25: 1}
Did not match all atoms present	892-21-7	C1=CC=C2C(=C1)C3=C4C2=CC=CC4=C(C=C3)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	892-75-1	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN(C)C.Cl	{1: 8, 2: 1, 4: 2, 33: 1, 14: 2, 17: 1, 21: 1}
Did not match all atoms present	89213-87-6	CC[C@H](C)[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCNC(=N)N)CC(=O)O)CCSC)CCCNC(=N)N)CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)O)CC(C)C)CO)CCC(=O)N)C	{32: 16, 1: 8, 2: 32, 3: 14, 36: 5, 7: 5, 40: 1, 41: 2, 11: 7, 12: 12, 14: 14, 20: 5, 21: 1, 24: 13, 25: 16, 27: 2, 30: 8, 31: 16}
Did not match all atoms present	89265-35-0	CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)Cl	{1: 1, 29: 4, 14: 4, 17: 1}
Did not match all atoms present	89267-67-4	CC1=CC(=CC(=C1)O[Si](C)(C)C)O[Si](C)(C)C	{1: 7, 22: 2, 14: 3}
Did not match all atoms present	89284-45-7	C(=O)NC1=C(N=C(N=C1Cl)Cl)N	{17: 2, 26: 1, 35: 2, 30: 1, 31: 1}
Did not match all atoms present	893-33-4	C1=CC=C2C=C(C=CC2=C1)C(=O)CC(=O)C(F)(F)F	{16: 3, 24: 2, 2: 1, 4: 1, 14: 7}
Did not match all atoms present	89303-65-1	CC1=CC(=C(C(=C1NC2=C3C(=C(C=C2)NC4=C(C(=C(C=C4C)C)S(=O)(=O)[O-])C)C(=O)C5=CC(=C(C=C5C3=O)Cl)Cl)C)S(=O)(=O)[O-])C.[Na+].[Na+]	{1: 6, 14: 6, 17: 2, 25: 2, 29: 6, 31: 2}
Did not match all atoms present	89323-10-4	C1=CC(=NC(=C1N=O)N)N	{35: 1, 30: 2, 34: 1, 29: 1, 14: 2}
Did not match all atoms present	89343-06-6	CC(C)[Si](C#C)(C(C)C)C(C)C	{1: 6, 10: 1, 3: 3, 9: 1}
Did not match all atoms present	89359-21-7	CC1=CC(=[C-]C(=C1)C)C.[Au+]	{1: 3, 14: 2}
Did not match all atoms present	89365-50-4	C1=CC=C(C=C1)CCCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O	{2: 12, 3: 1, 14: 8, 20: 2, 21: 1, 22: 1, 31: 1}
Did not match all atoms present	89367-92-0	CC1=C2C(=NC(=O)N(C2=O)NC=C3C=CC(=O)C=C3)SN1	{32: 1, 1: 1, 35: 1, 6: 1, 33: 1, 41: 1, 14: 4, 15: 1, 25: 3, 31: 1}
Did not match all atoms present	89389-51-5	CC(C)[C-]1[CH-][CH-][CH-][CH-]1.CC(C)[C-]1C=CC=C1.CC(C)[C-]1C=CC=C1.CC(C)[C-]1C=CC=C1.[SH-].[SH-].[SH-].[SH-].[Mo].[Mo].[Mo].[Mo]	{1: 8, 3: 4, 14: 16}
Did not match all atoms present	89398-07-2	C1C2CN(CC1CSC2)CC3=CC=CC=C3.OCl(=O)(=O)=O	{33: 1, 2: 1, 41: 1, 11: 5, 12: 2, 14: 5, 17: 1, 20: 1, 29: 3}
Did not match all atoms present	894-06-4	C1=CC=C(C=C1)[Pb](C2=CC=CC=C2)(C3=CC=CC=C3)Br	{18: 1, 14: 15}
Did not match all atoms present	894-09-7	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)I	{19: 1, 14: 15}
Did not match all atoms present	894-52-0	CC1=C(C2=C(C=CC3=CC=CC=C32)C4=C1C(=O)CC4)C	{1: 2, 11: 2, 14: 6, 25: 1}
Did not match all atoms present	894-86-0	C1=CC=C2C(=C1)C(=C(N2)C3=C(C4=CC=CC=C4N3)[O-])[O-].[Na+].[Na+]	{32: 2, 14: 8}
Did not match all atoms present	89411-46-1	C1C(=CC=C(C1=[N+]=[N-])O)CCN	{2: 2, 11: 1, 34: 1, 14: 2, 15: 3, 20: 1, 30: 1}
Did not match all atoms present	89465-63-4	CCNC(=O)NC1=NSN=C1C(=O)N	{1: 1, 2: 1, 35: 2, 41: 1, 24: 2, 30: 1, 31: 2}
Did not match all atoms present	89482-81-5	[Li+].[Na+].[Na+].[Na+]	{}
Did not match all atoms present	89488-30-2	CC1=CC(=CNC1=O)Br	{32: 1, 1: 1, 18: 1, 14: 2, 25: 1}
Did not match all atoms present	895-85-2	CC1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=C(C=C2)C	{1: 2, 28: 2, 14: 8}
Did not match all atoms present	89505-08-8	COC1=CC=C(C=C1)C(=CC=NN(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=C(C=C4)OC	{1: 2, 34: 1, 6: 2, 33: 1, 7: 1, 14: 18, 22: 2}
Did not match all atoms present	89557-35-7	CCCC1=CC=C(C=C1)C(OCC)OCC	{1: 3, 2: 4, 3: 1, 22: 2, 14: 4}
Did not match all atoms present	89565-68-4	CN1C2CCC1CC(C2)OC(=O)C3=CNC4=CC=CC=C43	{32: 1, 1: 1, 33: 1, 11: 4, 12: 3, 14: 5, 28: 1}
Did not match all atoms present	89579-33-9	CC[PH+](CC)CC.CC[PH+](CC)CC.[C-]#N.Cl[Pd+]	{1: 6, 2: 6, 17: 1}
Did not match all atoms present	89591-51-5	CC[NH+](CC)CCNC(=O)C1=CC(=C(C=C1OC)N(C)C)[N+](=O)[O-].[Cl-]	{1: 5, 2: 4, 38: 1, 33: 1, 14: 2, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	89598-96-9	B(C1=CC(=CC=C1)Br)(O)O	{18: 1, 20: 2, 14: 4}
Did not match all atoms present	896-33-3	CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]	{1: 1, 2: 1, 14: 15, 17: 1}
Did not match all atoms present	89695-36-3	CCN1C=CC(=CC=C2C(=O)N(C(=S)S2)CCCCCC(=O)O)C3=CC=CC=C31	{1: 1, 2: 6, 6: 2, 33: 2, 41: 1, 14: 6, 15: 3, 25: 1, 27: 1}
Did not match all atoms present	897-15-4	C[NH+](C)CC/C=C\1/C2=CC=CC=C2CSC3=CC=CC=C31.[Cl-]	{1: 2, 2: 2, 6: 1, 41: 1, 11: 1, 14: 8, 15: 1, 17: 1}
Did not match all atoms present	897-18-7	C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CC4=CC=CC=C43	{35: 2, 14: 12, 23: 1}
Did not match all atoms present	897-55-2	CN(C)C1=CC=C(C=C1)C=CC2=CC=NC3=CC=CC=C23	{1: 2, 35: 1, 14: 10, 6: 2, 33: 1}
Did not match all atoms present	897-78-9	C1CC(=CC2=CC=CC=C2)C(=O)C(=CC3=CC=CC=C3)C1	{25: 1, 11: 3, 14: 10, 6: 2, 15: 2}
Did not match all atoms present	89703-05-9	CC/C(=C\C1=[N+](C2=C([Se]1)C=CC(=C2)C)CCC(=O)O)/C=C\3/N(C4=C([Se]3)C=CC(=C4)C)CCC(=O)O.[Br-]	{1: 3, 2: 5, 33: 2, 6: 2, 7: 1, 14: 6, 15: 1, 18: 1, 27: 2}
Did not match all atoms present	89763-93-9	C1=CC(=C(C=C1C(F)(F)F)F)C=O	{16: 4, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	89794-02-5	CC1=C(C=C(C=C1)Br)Cl	{1: 1, 18: 1, 14: 3, 17: 1}
Did not match all atoms present	89797-01-3	C1=CC=C(C=C1)C(=NNC2=CC(=CC(=NC3=NC(=NC(=N3)NC4=C(C=CC(=C4)S(=O)(=O)[O-])Cl)[N+]5=CC=CC(=C5)C(=O)[O-])C2=O)S(=O)(=O)[O-])NNC6=C(C=CC(=C6)S(=O)(=O)[O-])C(=O)O.[OH-].[Na+].[Na+].[Na+].[Cu+2]	{33: 1, 34: 2, 35: 3, 7: 1, 14: 17, 15: 3, 17: 1, 24: 1, 25: 1, 27: 1, 29: 9, 31: 4}
Did not match all atoms present	89813-56-9	C1=C2C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)NC(=O)N2	{32: 2, 14: 2, 17: 1, 25: 1, 29: 4, 30: 1}
Did not match all atoms present	89827-45-2	C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)Br	{18: 1, 14: 7, 23: 1}
Did not match all atoms present	89853-87-2	CCSC1=NC=C(C(=N1)N)C(=O)O	{1: 1, 2: 1, 35: 2, 40: 1, 14: 1, 27: 1, 30: 1}
Did not match all atoms present	89854-23-9	CC1=NN2C=NN=C2C(=C1)NC	{1: 2, 35: 3, 33: 1, 14: 2, 31: 1}
Did not match all atoms present	89854-43-3	C1=C(C(=O)NC(=O)N1)NC(=O)N(CCO)N=O	{32: 2, 33: 1, 2: 2, 34: 1, 14: 1, 20: 1, 24: 1, 25: 2, 29: 1, 31: 1}
Did not match all atoms present	89856-44-0	CC1=CC(=NC(=C1Br)C)N	{1: 2, 18: 1, 35: 1, 30: 1, 14: 1}
Did not match all atoms present	89897-57-4	C1=C(C(=O)NC(=O)N1)NC(=O)NCCO	{32: 2, 2: 2, 14: 1, 20: 1, 24: 1, 25: 2, 31: 2}
Did not match all atoms present	89909-07-9	CN(C)C1=NS2=NC(=NS2=N1)N(C)C	{1: 4, 35: 4, 33: 2, 15: 2}
Did not match all atoms present	89921-55-1	CC(C)CCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCC(C)C)S(=O)(=O)O.C1COCCN1	{32: 1, 1: 4, 2: 12, 3: 2, 11: 4, 14: 5, 20: 1, 23: 1, 29: 2}
Did not match all atoms present	89923-55-7	CC1=C/C(=N\N=C/2\C(=[N+](C3=CC=CC=C32)C)C)/N(N1C)C4=CC=CC=C4.[Cl-]	{1: 4, 34: 2, 33: 3, 14: 10, 15: 2, 17: 1}
Did not match all atoms present	89930-55-2	CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)NC(CC3=CC=CC=C3)C(=O)[O-])Cl.[Na+]	{1: 1, 2: 1, 3: 1, 11: 1, 12: 1, 14: 6, 17: 1, 21: 1, 24: 2, 28: 1, 31: 1}
Did not match all atoms present	89942-59-6	CC(=O)C1=C(C=CC=N1)C(=O)O	{24: 1, 1: 1, 27: 1, 14: 3, 35: 1}
Did not match all atoms present	89943-20-4	CCO/C(=C(\C#N)/C(=S)N)/C	{1: 2, 2: 1, 37: 1, 7: 3, 22: 1, 30: 1}
Did not match all atoms present	89947-76-2	C1C2=CC=CC=C2C3=C1C=C(C=C3)N([C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O	{33: 1, 11: 1, 12: 5, 14: 7, 20: 4, 23: 1, 27: 1}
Did not match all atoms present	89952-87-4	C1=CC=NC=C1.C1=CC=NC=C1.C1=CC=NC=C1.C1=CC=NC=C1.[O-][Cr](=O)(=O)O[Cr](=O)(=O)[O-].[Ag+].[Ag+]	{35: 4, 22: 1, 14: 20, 29: 6}
Did not match all atoms present	89959-15-9	CC1=CC(=C(C(=C1)C)C(=C(C)O)C2=C(C=C(C=C2C)C)C)C	{1: 7, 20: 1, 14: 4, 7: 2}
Did not match all atoms present	89970-80-9	C[N+]1=CC=CC=C1C(=O)NO.[I-]	{1: 1, 33: 1, 14: 4, 19: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	89970-81-0	C[N+]1=CC=C(C=C1)C(=O)NO.[I-]	{1: 1, 33: 1, 14: 4, 19: 1, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	89970-82-1	CN(C(=O)C1=CC=CC=N1)O	{1: 1, 35: 1, 33: 1, 14: 4, 20: 1, 24: 1}
Did not match all atoms present	89970-83-2	CC(=O)ONC(=O)C1=CC=CC=N1	{1: 1, 35: 1, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	89970-84-3	CC(=O)ONC(=O)C1=CN=CC=C1	{1: 1, 35: 1, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	89970-85-4	CC(=O)ONC(=O)C1=CC=NC=C1	{1: 1, 35: 1, 14: 4, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	89977-78-6	CCOC(=O)C1=CN=C2N=CNN2C1=O	{32: 1, 1: 1, 2: 1, 35: 2, 33: 1, 14: 2, 25: 1, 28: 1}
Did not match all atoms present	89985-01-3	C[C@H]([C@H]1C(=O)NCCCCCCC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)OCC5=CC=CC=C5	{32: 6, 1: 1, 2: 7, 3: 1, 11: 6, 12: 4, 14: 15, 22: 1, 25: 5, 30: 1}
Did not match all atoms present	90-00-6	CCC1=CC=CC=C1O	{1: 1, 2: 1, 21: 1, 14: 4}
Did not match all atoms present	90-01-7	C1=CC=C(C(=C1)CO)O	{2: 1, 20: 1, 21: 1, 14: 4}
Did not match all atoms present	90-02-8	C1=CC=C(C(=C1)C=O)O	{26: 1, 21: 1, 14: 4}
Did not match all atoms present	90-04-0	COC1=CC=CC=C1N	{1: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	90-05-1	COC1=CC=CC=C1O	{1: 1, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	90-10-8	CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2	{1: 1, 29: 2, 14: 10, 33: 1}
Did not match all atoms present	90-11-9	C1=CC=C2C(=C1)C=CC=C2Br	{18: 1, 14: 7}
Did not match all atoms present	90-12-0	CC1=CC=CC2=CC=CC=C12	{1: 1, 14: 7}
Did not match all atoms present	90-13-1	C1=CC=C2C(=C1)C=CC=C2Cl	{17: 1, 14: 7}
Did not match all atoms present	90-14-2	C1=CC=C2C(=C1)C=CC=C2I	{19: 1, 14: 7}
Did not match all atoms present	90-15-3	C1=CC=C2C(=C1)C=CC=C2O	{21: 1, 14: 7}
Did not match all atoms present	90-16-4	C1=CC=C2C(=C1)C(=O)N=NN2	{32: 1, 25: 1, 35: 2, 14: 4}
Did not match all atoms present	90-17-5	CC(=O)OC(C1=CC=CC=C1)C(Cl)(Cl)Cl	{1: 1, 3: 1, 4: 1, 14: 5, 17: 3, 28: 1}
Did not match all atoms present	90-19-7	COC1=CC(=C2C(=C1)OC(=C(C2=O)O)C3=CC(=C(C=C3)O)O)O	{1: 1, 14: 5, 21: 4, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	90-20-0	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)O)S(=O)(=O)O	{30: 1, 20: 2, 21: 1, 14: 4, 29: 4}
Did not match all atoms present	90-22-2	CCC(C)C(C1=CC=CC=C1)C(=O)OCC[N+](C)(CC)CC.[Br-]	{1: 5, 2: 5, 3: 2, 14: 5, 18: 1, 28: 1}
Did not match all atoms present	90-24-4	CC(=O)C1=C(C=C(C=C1OC)OC)O	{24: 1, 1: 3, 22: 2, 21: 1, 14: 2}
Did not match all atoms present	90-26-6	CCC(C1=CC=CC=C1)C(=O)N	{1: 1, 2: 1, 3: 1, 14: 5, 24: 1, 30: 1}
Did not match all atoms present	90-27-7	CCC(C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	90-30-2	C1=CC=C(C=C1)NC2=CC=CC3=CC=CC=C32	{14: 12, 31: 1}
Did not match all atoms present	90-31-3	CC1=NN(C(=O)C1)C2=CC(=CC=C2)Cl	{1: 1, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 17: 1, 25: 1}
Did not match all atoms present	90-33-5	CC1=CC(=O)OC2=C1C=CC(=C2)O	{1: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	90-34-6	CC(CCCN)NC1=C2C(=CC(=C1)OC)C=CC=N2	{1: 2, 2: 3, 3: 1, 14: 5, 35: 1, 22: 1, 30: 1, 31: 1}
Did not match all atoms present	90-40-4	C1=C2C=C(C=C(C2=CC(=C1S(=O)(=O)O)N)O)S(=O)(=O)O	{30: 1, 20: 2, 21: 1, 14: 4, 29: 4}
Did not match all atoms present	90-41-5	C1=CC=C(C=C1)C2=CC=CC=C2N	{30: 1, 14: 9}
Did not match all atoms present	90-43-7	C1=CC=C(C=C1)C2=CC=CC=C2O	{21: 1, 14: 9}
Did not match all atoms present	90-44-8	C1C2=CC=CC=C2C(=O)C3=CC=CC=C31	{25: 1, 11: 1, 14: 8}
Did not match all atoms present	90-45-9	C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N	{35: 1, 30: 1, 14: 8}
Did not match all atoms present	90-46-0	C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)O	{20: 1, 12: 1, 14: 8, 23: 1}
Did not match all atoms present	90-47-1	C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3O2	{25: 1, 14: 8, 23: 1}
Did not match all atoms present	90-49-3	CCC(C1=CC=CC=C1)C(=O)NC(=O)N	{1: 1, 2: 1, 3: 1, 14: 5, 24: 2, 30: 1, 31: 1}
Did not match all atoms present	90-50-6	COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)O	{1: 3, 22: 3, 27: 1, 14: 2, 6: 2}
Did not match all atoms present	90-51-7	C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)O)N	{30: 1, 20: 1, 21: 1, 14: 5, 29: 2}
Did not match all atoms present	90-53-9	COC1=CC=CC(=C1OC)CC(=O)O	{1: 2, 2: 1, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	90-54-0	CCN(CC)CCOC1=CC=CC=C1C(=O)CCC2=CC=CC=C2	{1: 2, 2: 6, 33: 1, 14: 9, 22: 1, 24: 1}
Did not match all atoms present	90-59-5	C1=C(C=C(C(=C1Br)O)C=O)Br	{18: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	90-60-8	C1=C(C=C(C(=C1Cl)O)C=O)Cl	{17: 2, 26: 1, 21: 1, 14: 2}
Did not match all atoms present	90-64-2	C1=CC=C(C=C1)C(C(=O)O)O	{27: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	90-66-4	CC1=CC(=C(C(=C1)SC2=CC(=CC(=C2O)C(C)(C)C)C)O)C(C)(C)C	{40: 1, 1: 8, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	90-68-6	CC1=CC(=C(C(=C1)CC2=C(C(=CC(=C2)C)C(C)(C)C)O)O)CC3=C(C(=CC(=C3)C)C(C)(C)C)O	{1: 9, 2: 2, 4: 2, 21: 3, 14: 6}
Did not match all atoms present	90-69-7	CN1[C@@H](CCC[C@@H]1CC(=O)C2=CC=CC=C2)C[C@@H](C3=CC=CC=C3)O	{1: 1, 2: 2, 3: 1, 33: 1, 11: 3, 12: 2, 14: 10, 20: 1, 24: 1}
Did not match all atoms present	90-72-2	CN(C)CC1=CC(=C(C(=C1)CN(C)C)O)CN(C)C	{1: 6, 2: 3, 21: 1, 14: 2, 33: 3}
Did not match all atoms present	90-82-4	C[C@@H]([C@H](C1=CC=CC=C1)O)NC	{1: 2, 3: 2, 20: 1, 14: 5, 31: 1}
Did not match all atoms present	90-84-6	CCN(CC)C(C)C(=O)C1=CC=CC=C1	{1: 3, 2: 2, 3: 1, 33: 1, 14: 5, 24: 1}
Did not match all atoms present	90-86-8	CC(C(C1=CC=CC=C1)O)N(C)C/C=C/C2=CC=CC=C2	{1: 2, 2: 1, 3: 2, 6: 2, 33: 1, 14: 10, 20: 1}
Did not match all atoms present	90-87-9	CC(C1=CC=CC=C1)C(OC)OC	{1: 3, 3: 2, 22: 2, 14: 5}
Did not match all atoms present	90-90-4	C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Br	{24: 1, 18: 1, 14: 9}
Did not match all atoms present	90-94-8	CN(C)C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N(C)C	{24: 1, 1: 4, 14: 8, 33: 2}
Did not match all atoms present	90-96-0	COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC	{24: 1, 1: 2, 22: 2, 14: 8}
Did not match all atoms present	90-97-1	C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)O)Cl	{17: 2, 3: 1, 20: 1, 14: 8}
Did not match all atoms present	90-98-2	C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)Cl	{24: 1, 17: 2, 14: 8}
Did not match all atoms present	90-99-3	C1=CC=C(C=C1)C(C2=CC=CC=C2)Cl	{17: 1, 3: 1, 14: 10}
Did not match all atoms present	900-91-4	C1=CC=C(C=C1)C(CC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3	{2: 1, 27: 1, 4: 1, 14: 15}
Did not match all atoms present	900-95-8	CC(=O)O[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{1: 1, 28: 1, 14: 15}
Did not match all atoms present	9000-55-9	COC1=CC(=CC(=C1OC)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O.COC1=CC(=CC(=C1OC)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O.COC1=CC(=CC(=C1OC)OC)C2C(C(C(C3=CC4=C(C=C23)OCO4)O)CO)C(=O)O.COC1=CC(=CC(=C1OC)OC)C2C(C(C(C3=CC4=C(C=C23)OCO4)O)CO)C(=O)O	{1: 12, 2: 2, 11: 6, 12: 16, 14: 16, 20: 6, 22: 12, 23: 8, 27: 2, 28: 2}
Did not match all atoms present	90004-93-6	CC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Br	{24: 1, 1: 1, 18: 1, 38: 1, 14: 3}
Did not match all atoms present	90015-77-3	CC1=CC2=NC3=C(N2C=C1)N=C(C=C3NC(=O)C)C	{1: 3, 35: 2, 33: 1, 14: 4, 24: 1, 31: 1}
Did not match all atoms present	9002-84-0	[H]	{}
Did not match all atoms present	9002-93-1	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCO	{1: 5, 2: 3, 4: 2, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	90029-73-5	C1=NC2=C(C(=N1)N)N=CN2C=CC=O	{33: 1, 35: 3, 6: 2, 14: 2, 26: 1, 30: 1}
Did not match all atoms present	9003-36-5	C=O.C1C(O1)CCl.C1=CC=C(C=C1)O	{2: 1, 5: 1, 11: 1, 12: 1, 14: 5, 17: 1, 21: 1, 23: 1}
Did not match all atoms present	9003-54-7	C=CC#N.C=CC1=CC=CC=C1	{14: 5, 5: 2, 6: 2, 37: 1}
Did not match all atoms present	9003-55-8	C=CC=C.C=CC1=CC=CC=C1	{14: 5, 5: 3, 6: 3}
Did not match all atoms present	9003-56-9	C=CC=C.C=CC#N.C=CC1=CC=CC=C1	{14: 5, 5: 4, 6: 4, 37: 1}
Did not match all atoms present	90034-99-4	C1C(CC2=CC=CC=C2C1C3=C(C4=CC=CC=C4OC3=O)O)C5=CC=C(C=C5)C(F)(F)F	{4: 1, 11: 2, 12: 2, 14: 12, 16: 3, 21: 1, 28: 1}
Did not match all atoms present	9004-12-0	CC[C@H](C)[C@H]1C(=O)N[C@H]2CSSC[C@@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CO)CC(C)C)CC3=CC=C(C=C3)O)CCC(=O)N)CC(C)C)CCC(=O)O)CC(=O)N)CC4=CC=C(C=C4)O)C(=O)N[C@@H](CC(=O)N)C(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CC6=CC=CC=C6)C(=O)N[C@@H](CC7=CC=C(C=C7)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N8CCC[C@H]8C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)CC(C)C)CC9=CC=C(C=C9)O)CC(C)C)C)CCC(=O)O)C(C)C)CC(C)C)CC2=CN=CN2)CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2=CN=CN2)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC2=CC=CC=C2)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CO)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)CN	{32: 28, 1: 27, 2: 47, 3: 32, 36: 1, 33: 1, 7: 1, 41: 6, 11: 10, 12: 28, 14: 35, 35: 2, 20: 5, 21: 4, 24: 28, 25: 26, 27: 6, 30: 10, 31: 22}
Did not match all atoms present	9004-24-4	CCCCCCCCCCOCCOP(=O)(O)O	{1: 1, 2: 11, 20: 2, 29: 1, 22: 2}
Did not match all atoms present	9004-38-0	CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C.CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C.C1=CC=C(C(=C1)C(=O)O)C(=O)OCC2C(C(C(C(O2)OC(=O)C3=CC=CC=C3C(=O)O)OC(=O)C4=CC=CC=C4C(=O)O)OC(=O)C5=CC=CC=C5C(=O)O)OC6C(C(C(C(O6)COC(=O)C7=CC=CC=C7C(=O)O)OC(=O)C8=CC=CC=C8C(=O)O)OC(=O)C9=CC=CC=C9C(=O)O)OC(=O)C1=CC=CC=C1C(=O)O.C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O.C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O	{1: 16, 2: 10, 12: 50, 14: 32, 20: 16, 22: 5, 23: 10, 27: 8, 28: 24}
Did not match all atoms present	9004-64-2	CCC(C1=C(C=C(C=C1)N(C)C)C)N	{1: 4, 2: 1, 3: 1, 33: 1, 14: 3, 30: 1}
Did not match all atoms present	9004-66-4	OS(=O)(=O)O.[Fe]	{20: 2, 29: 2}
Did not match all atoms present	9004-70-0	C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O.C(C1C(C(C(C(O1)O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])OC2C(C(C(C(O2)CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]	{20: 8, 2: 4, 12: 20, 22: 10, 23: 4}
Did not match all atoms present	9004-86-8	C1=CC=C(C=C1)C(=O)OCCOC(=O)C2=CC=CC=C2	{2: 2, 28: 2, 14: 10}
Did not match all atoms present	9005-10-1	CC(=C)C(=O)[O-].CC(=C)C(=O)OC.[Na+]	{24: 1, 1: 3, 28: 1, 5: 2, 7: 2}
Did not match all atoms present	9005-35-0	[C@@H]1([C@@H]([C@H](O[C@H]([C@H]1O)O[C@H]2[C@@H]([C@@H]([C@@H](O[C@H]2C(=O)O)O[C@H]3[C@@H]([C@@H]([C@@H](O[C@H]3C(=O)[O-])O)O)O)O)O)C(=O)[O-])O)O.[Ca+2]	{12: 15, 20: 8, 22: 2, 23: 3, 24: 2, 27: 1}
Did not match all atoms present	9005-53-2	COc1cc(C(Oc2c(O)cc(C(Oc3ccc(C(O)C(CO)Oc4ccc(C=CCO)cc4OC)cc3OC)C(CO)Oc3ccc(C4OC(c5cc(OC)c(O)c(OC)c5)C5COCC45)cc3OC)cc2OC)C(CO)Oc2ccc(C3Oc4c(OC)cc(C(O)C(C)O)cc4C3CO)cc2OC)ccc1O	{1: 10, 2: 5, 3: 8, 6: 2, 11: 2, 12: 6, 14: 21, 20: 8, 21: 3, 22: 14, 23: 3}
Did not match all atoms present	90066-12-9	CCN(CC)CC.C1=CC(=CC=C1N2C(=O)C(=C(N2)C(=O)[O-])/C=C/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]	{32: 1, 1: 3, 2: 3, 35: 1, 6: 3, 33: 3, 14: 8, 15: 2, 24: 2, 25: 2, 29: 6}
Did not match all atoms present	9007-28-7	CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1O)OS(=O)(=O)O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O	{1: 1, 12: 10, 20: 6, 22: 2, 23: 2, 24: 1, 27: 1, 29: 2, 31: 1}
Did not match all atoms present	9007-49-2	C1C(C(OC1N)COP(=O)(O)OC2CC(OC2COP(=O)(O)OC3CC(OC3CO)N)N)O	{2: 3, 11: 3, 12: 9, 20: 4, 22: 4, 23: 3, 29: 2, 30: 3}
Did not match all atoms present	9007-92-5	C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC5=CNC6=CC=CC=C65)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)O)NC(=O)CNC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC7=CN=CN7)N)O	{32: 2, 1: 11, 2: 35, 3: 34, 36: 2, 7: 2, 40: 1, 14: 25, 35: 1, 20: 7, 21: 2, 24: 32, 27: 4, 30: 8, 31: 30}
Did not match all atoms present	9008-26-8	CC(C)C1=CC2=CCC3[C@@]([C@H]2CC1)(CCC[C@]3(C)C(=O)[O-])C.CC(C)C1=CC2=CCC3[C@@]([C@H]2CC1)(CCC[C@]3(C)C(=O)[O-])C.[Pb+2]	{1: 8, 3: 2, 11: 12, 12: 4, 13: 4, 14: 4, 15: 4, 24: 2}
Did not match all atoms present	90097-08-8	CN(CC1=CC=CC=C1)C2=CC=CC=C2.Cl	{1: 1, 2: 1, 33: 1, 14: 10, 17: 1}
Did not match all atoms present	901-44-0	CC(C)(C1=CC=C(C=C1)OCCO)C2=CC=C(C=C2)OCCO	{1: 2, 2: 4, 4: 1, 14: 8, 20: 2, 22: 2}
Did not match all atoms present	901-79-1	C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)[O-])N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{30: 1, 29: 9, 14: 4}
Did not match all atoms present	901-93-9	CC(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4=O)C	{1: 2, 11: 6, 12: 3, 13: 1, 14: 3, 25: 1, 28: 1}
Did not match all atoms present	9010-69-9	CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)[O-])C.CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)[O-])C.[Zn+2]	{1: 8, 3: 2, 11: 12, 12: 4, 13: 4, 14: 4, 15: 4, 24: 2}
Did not match all atoms present	9011-05-6	C=O.C(=O)(N)N	{24: 1, 5: 1, 30: 2}
Did not match all atoms present	9011-12-5	CC(=C)C.C=CC1=CC=CC=C1	{1: 2, 14: 5, 5: 2, 6: 1, 7: 1}
Did not match all atoms present	9011-13-6	C=CC1=CC=CC=C1.C1=CC(=O)OC1=O	{14: 7, 28: 2, 5: 1, 6: 1}
Did not match all atoms present	90134-10-4	CCCCN(CCCC)C1=CC=C(C=C1)C=O	{1: 2, 2: 6, 26: 1, 14: 4, 33: 1}
Did not match all atoms present	9014-02-2	C[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[C@H]2[C@@H](C=C3C2CC#C[C@@H]4[C@@](O4)(C#C3)[C@H]5COC(=O)O5)OC(=O)C6=C(C=CC7=C(C=C(C=C76)OC)C)O)NC)O)O	{1: 4, 10: 4, 11: 2, 12: 10, 13: 1, 14: 5, 15: 1, 20: 2, 21: 1, 22: 2, 23: 2, 28: 1, 31: 1}
Did not match all atoms present	9016-01-7	[Cu+2].[Cu+2].[Cu+2].[Cu+2].[Zn+2].[Zn+2].[Zn+2].[Zn+2]	{}
Did not match all atoms present	9017-04-3	CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C(C(CO)O)O	{1: 2, 2: 2, 3: 1, 8: 2, 11: 1, 12: 1, 34: 2, 14: 3, 20: 3, 23: 1, 29: 2}
Did not match all atoms present	9017-43-0	CC(=C)C(=O)OC.C=CC1=CC=CC=C1.C=CC1=CC=CC=C1C=C	{1: 2, 5: 4, 6: 3, 7: 1, 14: 9, 28: 1}
Did not match all atoms present	90176-80-0	C1=CC(=C(C=C1F)C(F)(F)F)C=O	{16: 4, 26: 1, 4: 1, 14: 3}
Did not match all atoms present	902-47-6	C1=CC(=CC=C1C(=O)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{28: 2, 38: 2, 14: 8}
Did not match all atoms present	90210-56-3	C1=CC=C(C=C1)CC2=CC3=CC=CC=C3C=N2	{2: 1, 35: 1, 14: 11}
Did not match all atoms present	90219-00-4	C=O.C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N.C1=CC=C(C(=C1)C(=O)O)O	{35: 3, 5: 1, 14: 9, 21: 1, 27: 1, 30: 2}
Did not match all atoms present	90238-10-1	CN(C)C(=O)C1=CC(=CC=C1)C(F)(F)F	{1: 2, 4: 1, 33: 1, 14: 4, 16: 3, 24: 1}
Did not match all atoms present	90247-37-3	C(CCCCCCOP(=O)(O)O)CCCCCOP(=O)(O)O	{2: 12, 20: 4, 29: 2, 22: 2}
Did not match all atoms present	90274-16-1	B(C(C)(C)C)(N(C)C)N(C)C	{1: 7, 4: 1, 33: 2}
Did not match all atoms present	90282-99-8	COC1=C(C(=CC=C1)Cl)OC	{1: 2, 22: 2, 14: 3, 17: 1}
Did not match all atoms present	90283-01-5	COC1=CC(=CC(=C1OC)Cl)Cl	{1: 2, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	90283-02-6	COC1=C(C=CC(=C1OC)Cl)Cl	{1: 2, 22: 2, 14: 2, 17: 2}
Did not match all atoms present	90293-48-4	CC(=NOC)C(=NOC(=O)N(C)SC1=CC=C(C=C1)C(C)(C)C)C(=O)N(C)C	{1: 8, 34: 2, 4: 1, 33: 2, 7: 2, 40: 1, 14: 4, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	90293-53-1	C/C(=N\OC)/C(=N/OC(=O)N(C)SN(C)C(=O)OC1=CC=CC2=CC=CC=C21)/C(=O)N(C)C	{1: 6, 34: 2, 33: 3, 7: 2, 40: 1, 14: 7, 22: 1, 24: 1, 28: 2}
Did not match all atoms present	90293-54-2	C/C(=N\OC)/C(=N/OC(=O)N(C)SN(C)C(=O)OC1=CC=CC2=C1OC(C2)(C)C)/C(=O)N(C)C	{1: 8, 34: 2, 33: 3, 7: 2, 40: 1, 11: 1, 13: 1, 14: 3, 22: 1, 23: 1, 24: 1, 28: 2}
Did not match all atoms present	90293-55-3	CCCCCCCCCC1=CC=C(C=C1)OC(=O)N(C)SN(C)C(=O)O/N=C(/C(=N/OC)/C)\C(=O)N(C)C	{1: 7, 2: 8, 33: 3, 7: 2, 40: 1, 34: 2, 14: 4, 22: 1, 24: 1, 28: 2}
Did not match all atoms present	903-46-8	C1=CC2=C(C(=C1)S(=O)(=O)[O-])C(=O)C3=C(C2=O)C=CC=C3S(=O)(=O)[O-].[Na+].[Na+]	{25: 2, 29: 6, 14: 6}
Did not match all atoms present	90315-82-5	CCOC(=O)[C@@H](CCC1=CC=CC=C1)O	{1: 1, 2: 3, 3: 1, 14: 5, 20: 1, 28: 1}
Did not match all atoms present	90319-52-1	C1[C@H](NC(=O)O1)C2=CC=CC=C2	{32: 1, 28: 1, 11: 1, 12: 1, 14: 5}
Did not match all atoms present	90349-65-8	CN(C(=O)NC1=CC=C(C=C1)C(=O)O)N=O	{1: 1, 34: 1, 33: 1, 14: 4, 24: 1, 27: 1, 29: 1, 31: 1}
Did not match all atoms present	90350-40-6	C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)COC(=O)CCCCCCC(=O)N(C)CCS(=O)(=O)[O-])O.[Na+]	{1: 4, 2: 9, 33: 1, 11: 4, 12: 5, 13: 3, 14: 3, 15: 1, 20: 2, 24: 2, 25: 1, 28: 1, 29: 3}
Did not match all atoms present	90365-74-5	C1[C@@H]([C@H](CN1CC2=CC=CC=C2)O)O	{33: 1, 2: 1, 11: 2, 12: 2, 14: 5, 20: 2}
Did not match all atoms present	90370-29-9	CC1=CC(=O)OC2=C3C(=COC3=C(C=C12)C)C	{1: 3, 28: 1, 14: 3, 23: 1}
Did not match all atoms present	90390-27-5	C1=C(C=C(C=C1F)F)CN	{16: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	9041-08-1	C([C@@H]1C([C@@H](C(C(O1)O)NS(=O)(=O)[O-])O)O[C@H]2C([C@H](C(C(O2)C(=O)[O-])O)O)OS(=O)(=O)[O-])OS(=O)(=O)[O-]	{2: 1, 12: 10, 20: 4, 22: 3, 23: 2, 24: 1, 29: 9, 31: 1}
Did not match all atoms present	9041-93-4	CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)O[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)CO)O)O)O[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCC[S+](C)C)O.OS(=O)(=O)[O-]	{32: 1, 1: 6, 2: 9, 3: 9, 41: 2, 12: 10, 14: 4, 35: 5, 20: 9, 22: 2, 23: 2, 24: 7, 28: 1, 29: 3, 30: 5, 31: 6}
Did not match all atoms present	90429-36-0	CCCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 4, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	9045-22-1	C1=CC=C(C=C1)C=CC(=O)O	{27: 1, 14: 5, 6: 2}
Did not match all atoms present	90466-79-8	CCOC(C[Se][Se]CC(OCC)OCC)OCC	{1: 4, 2: 6, 3: 2, 22: 4}
Did not match all atoms present	90467-12-2	CC(C)(C)[Si](C)(C)C1=CC=CC=C1	{1: 5, 4: 1, 14: 5}
Did not match all atoms present	90481-46-2	COC1=CC(=O)/C(=C\2/NC3=CC=CC=C3S2)/C=C1	{32: 1, 1: 1, 41: 1, 14: 7, 15: 3, 22: 1, 25: 1}
Did not match all atoms present	90498-90-1	CC1=C(C(=CC(=C1)CCC(=O)OCC(C)(C)C2OCC3(CO2)COC(OC3)C(C)(C)COC(=O)CCC4=CC(=C(C(=C4)C(C)(C)C)O)C)C(C)(C)C)O	{1: 12, 2: 6, 4: 4, 11: 4, 12: 2, 13: 1, 14: 4, 21: 2, 23: 4, 28: 2}
Did not match all atoms present	905-95-3	C1=CC=C2C=C3C=C4C(=CC3=CC2=C1)C5=CC6=CC=CC=C6C=C5N4	{32: 1, 14: 14}
Did not match all atoms present	905-96-4	CCN1C2=CC=CC=C2OC1=CC=CC3=[N+](C4=CC=CC=C4O3)CC.[I-]	{1: 2, 2: 2, 6: 3, 33: 2, 14: 8, 15: 1, 19: 1, 23: 2}
Did not match all atoms present	9052-50-0	CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C1CO1	{1: 2, 34: 2, 8: 2, 11: 3, 12: 1, 14: 3, 23: 2, 29: 2}
Did not match all atoms present	90536-66-6	CS(=O)(=O)C1=CC=C(C=C1)CC(=O)O	{1: 1, 2: 1, 27: 1, 29: 2, 14: 4}
Did not match all atoms present	90580-64-6	B(C1=CC=C(C=C1)CC(C(=O)O)N)(O)O	{2: 1, 3: 1, 14: 4, 20: 2, 27: 1, 30: 1}
Did not match all atoms present	90583-38-3	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.OS(=O)O.[Na+].[Na+].[Na+]	{1: 2, 4: 1, 5: 1, 14: 8, 20: 2, 21: 2, 29: 1}
Did not match all atoms present	90590-96-8	[CH-]1[CH-][CH-][CH-][CH-]1.[CH-]1C=CC=C1.[N]=O.[N]=O.[Ru+5].[Ru+5]	{29: 2, 14: 10}
Did not match all atoms present	906-65-0	C1C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC1=O	{11: 1, 28: 2, 14: 15, 15: 1}
Did not match all atoms present	9060-10-0	CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCCN=C(N)N)O	{32: 1, 1: 4, 2: 10, 3: 9, 7: 1, 41: 2, 12: 10, 34: 1, 14: 4, 35: 5, 20: 8, 22: 2, 23: 2, 24: 7, 28: 1, 30: 7, 31: 6}
Did not match all atoms present	90642-35-6	CN(C(=O)NCCSC1=NC=NC2=C1NC=N2)N=O	{32: 1, 1: 1, 2: 2, 35: 3, 33: 1, 40: 1, 34: 1, 14: 2, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	90653-55-7	CS(=O)(=O)/C=C/C1=CC=C(C=C1)Br	{1: 1, 18: 1, 14: 4, 6: 2, 29: 2}
Did not match all atoms present	9067-32-7	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)NC(=O)C)O)O.[Na+]	{1: 2, 2: 2, 12: 20, 20: 10, 22: 3, 23: 4, 24: 2, 27: 2, 31: 2}
Did not match all atoms present	90677-64-8	CCN(CC)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)OC4=CC=C(C=C4)C(C)(C)C5=CC=C(C=C5)OC6=NC(=NC7=CC=CC=C76)C8=CC=C(C=C8)N(CC)CC	{1: 6, 2: 4, 35: 4, 4: 1, 33: 2, 14: 24, 22: 2}
Did not match all atoms present	9070-36-4	C=O.C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N.OS(=O)(=O)O	{34: 1, 5: 1, 14: 9, 20: 2, 29: 2, 31: 1}
Did not match all atoms present	9071-85-6	CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOP(=O)(O)OCCOCCOCCOC2=CC=C(C=C2)CCCCCCCCC	{1: 2, 2: 28, 14: 8, 20: 1, 22: 8, 29: 1}
Did not match all atoms present	90719-30-5	C/C=C/C(=O)N1[C@H](COC1=O)CC2=CC=CC=C2	{1: 1, 2: 1, 6: 2, 33: 1, 11: 1, 12: 1, 14: 5, 24: 1, 28: 1}
Did not match all atoms present	90719-32-7	C1[C@@H](NC(=O)O1)CC2=CC=CC=C2	{32: 1, 2: 1, 11: 1, 12: 1, 14: 5, 28: 1}
Did not match all atoms present	9072-93-9	CC1=C(C=CC=C1N=C=O)N=C=O.C(CO)COCCCO	{1: 1, 2: 6, 8: 2, 34: 2, 14: 3, 20: 2, 22: 1, 29: 2}
Did not match all atoms present	90721-40-7	COC(=O)C1=CC(=CC=C1)SC	{40: 1, 1: 2, 28: 1, 14: 4}
Did not match all atoms present	90742-91-9	CC(C)NCC(COC1=C(C=CC(=C1C(=C)N2C=CN=C2)Cl)Cl)O.Cl	{1: 2, 2: 2, 3: 2, 5: 1, 7: 1, 14: 5, 17: 3, 35: 1, 20: 1, 22: 1, 33: 1, 31: 1}
Did not match all atoms present	90759-83-4	[OH-].[Pb+3]	{}
Did not match all atoms present	90773-36-7	C12=NSNC1=NC(=S)N=C2N	{32: 1, 41: 1, 35: 3, 30: 1}
Did not match all atoms present	9078-84-6	CCC1=CC=CC=C1C=C.C=CC#N.C=CC1=CC=CC=C1C=C	{1: 1, 2: 1, 5: 4, 6: 4, 14: 8, 37: 1}
Did not match all atoms present	9079-94-1	C=CC(=O)O.C=CC(=O)[O-].[NH4+]	{24: 1, 27: 1, 5: 2, 6: 2}
Did not match all atoms present	90793-41-2	C1C(C1NC(=O)N)C2=CC(=C(C=C2)Cl)Cl	{11: 1, 12: 2, 14: 3, 17: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	9082-27-3	C=CC#N.C=CC1=CC=CC=C1CCl.C=CC1=CC=CC=C1C=C	{2: 1, 5: 4, 6: 4, 14: 8, 17: 1, 37: 1}
Did not match all atoms present	90823-38-4	CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-]	{1: 4, 2: 4, 35: 1, 14: 12, 15: 1, 24: 1, 29: 2, 31: 1}
Did not match all atoms present	90826-31-6	CC(C)(C1=CC(=CC=C1)C(C)(C)NC(=O)OC)NC(=O)OC	{1: 6, 31: 2, 4: 2, 14: 4, 28: 2}
Did not match all atoms present	90826-33-8	CC(C)(C1=CC(=CC=C1)C(C)(C)NC(=O)OC)N=C=O	{1: 5, 34: 1, 4: 2, 8: 1, 14: 4, 28: 1, 29: 1, 31: 1}
Did not match all atoms present	90826-83-8	C1=CC=C(C=C1)NC2=NC(=NC(=N2)N(CCO)CCO)NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)NC6=CC=CC=C6)N(CCO)CCO)S(=O)(=O)[O-])S(=O)(=O)[O-].[NH4+].[NH4+]	{33: 2, 2: 8, 35: 6, 6: 2, 14: 16, 20: 4, 29: 6, 31: 4}
Did not match all atoms present	90842-58-3	CCCCOC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{1: 1, 2: 3, 22: 1, 17: 5}
Did not match all atoms present	90843-31-5	CC(=O)C1=CC2=C(C=C1)OCC2	{24: 1, 1: 1, 11: 2, 14: 3, 23: 1}
Did not match all atoms present	90866-66-3	C[C-]1C(=C(C(=C1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Sm]	{1: 10}
Did not match all atoms present	9087-70-1	CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H]2CSSC[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N4CCC[C@H]4C(=O)N5CCC[C@H]5C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N6CCC[C@H]6C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3)CC(=O)O)CCC(=O)O)C)CO)CCCCN)CC7=CC=CC=C7)CC(=O)N)CC(=O)N)CCCNC(=N)N)CCCCN)C)CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CCC(=O)N)[C@@H](C)O)CC8=CC=CC=C8)C(C)C)CC9=CC=C(C=C9)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCNC(=N)N)C)CCCCN)[C@@H](C)O)CC1=CC=C(C=C1)O)CCC(=O)O)CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)CCCNC(=N)N)CCSC)CC(C)C)C)CCCCN)C)CC(=O)N)CC1=CC=C(C=C1)O)CC1=CC=CC=C1)CC1=CC=C(C=C1)O)CCCNC(=N)N)[C@@H](C)CC	{32: 47, 1: 20, 2: 62, 3: 12, 36: 6, 33: 4, 7: 6, 40: 1, 41: 6, 11: 22, 12: 48, 14: 36, 20: 4, 21: 4, 24: 11, 25: 50, 27: 5, 30: 15, 31: 12}
Did not match all atoms present	90875-14-2	CCOC(C)OC1=CC=C(C=C1)Br	{1: 2, 2: 1, 3: 1, 14: 4, 18: 1, 22: 2}
Did not match all atoms present	9088-15-7	CC(=C)C(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1C(O1)CCl	{1: 3, 2: 1, 4: 1, 5: 1, 7: 1, 11: 1, 12: 1, 14: 8, 17: 1, 21: 2, 23: 1, 27: 1}
Did not match all atoms present	909-39-7	C1CN(CCN1CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42)CCO.Cl.Cl	{33: 3, 2: 5, 11: 4, 14: 10, 17: 2, 20: 1}
Did not match all atoms present	90924-88-2	CNC(=O)NCCN1C=NC2=C1N=CN=C2SC	{1: 2, 2: 2, 35: 3, 33: 1, 40: 1, 14: 2, 24: 1, 31: 2}
Did not match all atoms present	90953-43-8	C1=NC2=C(N1)C(=NC=N2)SCCNC(=O)N	{32: 1, 2: 2, 35: 3, 40: 1, 14: 2, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	90982-32-4	CCOC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)Cl)OC	{1: 2, 2: 1, 35: 2, 14: 5, 17: 1, 22: 1, 24: 1, 28: 1, 29: 2, 31: 2}
Did not match all atoms present	91-00-9	C1=CC=C(C=C1)C(C2=CC=CC=C2)N	{3: 1, 30: 1, 14: 10}
Did not match all atoms present	91-01-0	C1=CC=C(C=C1)C(C2=CC=CC=C2)O	{3: 1, 20: 1, 14: 10}
Did not match all atoms present	91-02-1	C1=CC=C(C=C1)C(=O)C2=CC=CC=N2	{24: 1, 35: 1, 14: 9}
Did not match all atoms present	91-04-3	CC1=CC(=C(C(=C1)CO)O)CO	{1: 1, 2: 2, 20: 2, 21: 1, 14: 2}
Did not match all atoms present	91-06-5	CCC1=CC(=C(C(=C1)CC)Br)CC	{1: 3, 2: 3, 18: 1, 14: 2}
Did not match all atoms present	91-08-7	CC1=C(C=CC=C1N=C=O)N=C=O	{8: 2, 1: 1, 34: 2, 29: 2, 14: 3}
Did not match all atoms present	91-10-1	COC1=C(C(=CC=C1)OC)O	{1: 2, 22: 2, 21: 1, 14: 3}
Did not match all atoms present	91-13-4	C1=CC=C(C(=C1)CBr)CBr	{2: 2, 18: 2, 14: 4}
Did not match all atoms present	91-15-6	C1=CC=C(C(=C1)C#N)C#N	{37: 2, 14: 4}
Did not match all atoms present	91-16-7	COC1=CC=CC=C1OC	{1: 2, 22: 2, 14: 4}
Did not match all atoms present	91-18-9	C1=CN=C2C(=N1)C=NC=N2	{35: 4, 14: 4}
Did not match all atoms present	91-19-0	C1=CC=C2C(=C1)N=CC=N2	{35: 2, 14: 6}
Did not match all atoms present	91-20-3	C1=CC=C2C=CC=CC2=C1	{14: 8}
Did not match all atoms present	91-21-4	C1CNCC2=CC=CC=C21	{32: 1, 11: 3, 14: 4}
Did not match all atoms present	91-22-5	C1=CC=C2C(=C1)C=CC=N2	{35: 1, 14: 7}
Did not match all atoms present	91-23-6	COC1=CC=CC=C1[N+](=O)[O-]	{1: 1, 38: 1, 22: 1, 14: 4}
Did not match all atoms present	91-25-8	C1=CC=C(C(=C1)C=O)S(=O)(=O)O	{26: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	91-29-2	C1=CC(=CC=C1N)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O	{38: 1, 14: 7, 20: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	91-30-5	C1=CC=C(C=C1)NC2=C(C=C(C=C2)N)S(=O)(=O)O	{30: 1, 20: 1, 29: 2, 14: 8, 31: 1}
Did not match all atoms present	91-33-8	C1=CC=C(C=C1)CSCC2=NS(=O)(=O)C3=CC(=C(C=C3N2)Cl)S(=O)(=O)N	{32: 1, 2: 2, 35: 1, 40: 1, 14: 7, 15: 1, 17: 1, 29: 4, 30: 1}
Did not match all atoms present	91-34-9	C1=CC(=O)C=CC1=NNC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NN=C4C=CC(=O)C=C4)S(=O)(=O)O)S(=O)(=O)O	{34: 2, 6: 2, 14: 14, 15: 2, 20: 2, 25: 2, 29: 4, 31: 2}
Did not match all atoms present	91-35-0	C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)O)N	{14: 7, 21: 1, 27: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	91-36-1	C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O	{17: 1, 27: 2, 29: 2, 14: 7, 31: 1}
Did not match all atoms present	91-38-3	COC1=CC=C(C=C1)NC2=C(C=CC(=C2)Cl)C(=O)O	{1: 1, 14: 7, 17: 1, 22: 1, 27: 1, 31: 1}
Did not match all atoms present	91-40-7	C1=CC=C(C=C1)NC2=CC=CC=C2C(=O)O	{27: 1, 14: 9, 31: 1}
Did not match all atoms present	91-43-0	CCOC1=CC(=C(C=C1[N+](=O)[O-])OCC)Cl	{1: 2, 2: 2, 38: 1, 14: 2, 17: 1, 22: 2}
Did not match all atoms present	91-44-1	CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C	{1: 3, 2: 2, 28: 1, 14: 4, 33: 1}
Did not match all atoms present	91-48-5	C1=CC=C(C=C1)C=C(C2=CC=CC=C2)C(=O)O	{27: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	91-49-6	CCCCN(C1=CC=CC=C1)C(=O)C	{24: 1, 1: 2, 2: 3, 14: 5, 33: 1}
Did not match all atoms present	91-51-0	CC(CC1=CC=C(C=C1)C(C)(C)C)C=NC2=CC=CC=C2C(=O)OC	{1: 5, 2: 1, 3: 1, 4: 1, 6: 1, 34: 1, 14: 8, 28: 1}
Did not match all atoms present	91-52-1	COC1=CC(=C(C=C1)C(=O)O)OC	{1: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	91-53-2	CCOC1=CC2=C(C=C1)NC(C=C2C)(C)C	{32: 1, 1: 4, 2: 1, 13: 1, 14: 4, 15: 1, 22: 1}
Did not match all atoms present	91-55-4	CC1=C(NC2=CC=CC=C12)C	{32: 1, 1: 2, 14: 4}
Did not match all atoms present	91-56-5	C1=CC=C2C(=C1)C(=O)C(=O)N2	{32: 1, 25: 2, 14: 4}
Did not match all atoms present	91-57-6	CC1=CC2=CC=CC=C2C=C1	{1: 1, 14: 7}
Did not match all atoms present	91-58-7	C1=CC=C2C=C(C=CC2=C1)Cl	{17: 1, 14: 7}
Did not match all atoms present	91-59-8	C1=CC=C2C=C(C=CC2=C1)N	{30: 1, 14: 7}
Did not match all atoms present	91-60-1	C1=CC=C2C=C(C=CC2=C1)S	{14: 7, 39: 1}
Did not match all atoms present	91-61-2	CC1=CC2=C(C=C1)NCCC2	{32: 1, 1: 1, 11: 3, 14: 3}
Did not match all atoms present	91-62-3	CC1=CC2=C(C=C1)N=CC=C2	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	91-63-4	CC1=NC2=CC=CC=C2C=C1	{1: 1, 35: 1, 14: 6}
Did not match all atoms present	91-64-5	C1=CC=C2C(=C1)C=CC(=O)O2	{28: 1, 14: 6}
Did not match all atoms present	91-66-7	CCN(CC)C1=CC=CC=C1	{1: 2, 2: 2, 14: 5, 33: 1}
Did not match all atoms present	91-67-8	CCN(CC)C1=CC=CC(=C1)C	{1: 3, 2: 2, 14: 4, 33: 1}
Did not match all atoms present	91-68-9	CCN(CC)C1=CC(=CC=C1)O	{1: 2, 2: 2, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	91-71-4	C1=CC=C(C(=C1)C(=O)O)S[As](C2=CC=C(C=C2)NC(=O)N)SC3=CC=CC=C3C(=O)O	{40: 2, 14: 12, 24: 1, 27: 2, 30: 1, 31: 1}
Did not match all atoms present	91-72-5	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)O	{33: 1, 2: 2, 20: 1, 29: 2, 14: 14}
Did not match all atoms present	91-73-6	C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC=CC=C3	{33: 1, 2: 2, 14: 15}
Did not match all atoms present	91-75-8	C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3	{32: 1, 33: 1, 2: 2, 35: 1, 11: 2, 14: 10, 15: 1}
Did not match all atoms present	91-76-9	C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N	{35: 3, 30: 2, 14: 5}
Did not match all atoms present	91-77-0	C=CCN(CC=C)C1=NC(=NC(=N1)N)N	{33: 1, 2: 2, 35: 3, 5: 2, 6: 2, 30: 2}
Did not match all atoms present	91-78-1	C1N(CN(CN1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{33: 3, 11: 3, 14: 15}
Did not match all atoms present	91-79-2	CN(C)CCN(CC1=CSC=C1)C2=CC=CC=N2	{1: 2, 2: 3, 35: 1, 33: 2, 41: 1, 14: 7}
Did not match all atoms present	91-80-5	CN(C)CCN(CC1=CC=CS1)C2=CC=CC=N2	{1: 2, 2: 3, 35: 1, 33: 2, 41: 1, 14: 7}
Did not match all atoms present	91-81-6	CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=N2	{1: 2, 2: 3, 35: 1, 14: 9, 33: 2}
Did not match all atoms present	91-82-7	C1CCN(C1)CC=C(CC2=CC=C(C=C2)Cl)C3=CC=CC=C3	{33: 1, 2: 2, 6: 1, 7: 1, 11: 4, 14: 9, 17: 1}
Did not match all atoms present	91-84-9	CN(C)CCN(CC1=CC=C(C=C1)OC)C2=CC=CC=N2	{1: 3, 2: 3, 35: 1, 33: 2, 14: 8, 22: 1}
Did not match all atoms present	91-85-0	CN(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CC=N2	{1: 3, 2: 3, 35: 2, 33: 2, 14: 7, 22: 1}
Did not match all atoms present	91-88-3	CCN(CCO)C1=CC=CC(=C1)C	{1: 2, 2: 3, 20: 1, 14: 4, 33: 1}
Did not match all atoms present	91-91-8	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]#N)OC)[N+]#N.[Cl-].[Cl-]	{1: 2, 34: 2, 22: 2, 14: 6, 17: 2}
Did not match all atoms present	91-93-0	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=C=O)OC)N=C=O	{1: 2, 34: 2, 8: 2, 14: 6, 22: 2, 29: 2}
Did not match all atoms present	91-94-1	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)Cl)Cl)N	{17: 2, 30: 2, 14: 6}
Did not match all atoms present	91-95-2	C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N	{30: 4, 14: 6}
Did not match all atoms present	91-96-3	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)CC(=O)C)C)NC(=O)CC(=O)C	{24: 4, 1: 4, 2: 2, 14: 6, 31: 2}
Did not match all atoms present	91-97-4	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=C=O)C)N=C=O	{8: 2, 1: 2, 34: 2, 29: 2, 14: 6}
Did not match all atoms present	91-98-5	CCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC=CC(=C2)C	{1: 2, 2: 2, 33: 1, 14: 8, 20: 1, 29: 2}
Did not match all atoms present	91-99-6	CC1=CC(=CC=C1)N(CCO)CCO	{1: 1, 2: 4, 20: 2, 14: 4, 33: 1}
Did not match all atoms present	910-06-5	C1=CC=C(C=C1)C(=O)O[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4	{28: 1, 14: 20}
Did not match all atoms present	910-86-1	CC(C)CCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)OCCC(C)C	{1: 4, 2: 4, 3: 2, 7: 1, 14: 8, 22: 2, 31: 2}
Did not match all atoms present	91000-69-0	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCCN=C(N)N)C(=O)O	{2: 4, 3: 1, 7: 1, 12: 1, 34: 1, 14: 8, 27: 1, 28: 1, 30: 2, 31: 1}
Did not match all atoms present	91026-74-3	CC(=O)NC1=C(NC=N1)C(=O)N	{32: 1, 1: 1, 35: 1, 14: 1, 24: 2, 30: 1, 31: 1}
Did not match all atoms present	91054-33-0	CC(=O)C1=CC=CC=C1C#N	{24: 1, 1: 1, 37: 1, 14: 4}
Did not match all atoms present	91062-74-7	CCC1=CC(=C(C2=C1N=CC=C2)[N+](=O)[O-])Br	{1: 1, 2: 1, 35: 1, 38: 1, 14: 4, 18: 1}
Did not match all atoms present	91076-68-5	C[Si](C)(C)OP([O-])[O-]	{1: 3, 29: 2, 22: 1}
Did not match all atoms present	91083-54-4	CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC3=CC4=C(C=C3)C5=NC6=C7C=CC(=CC7=C8N6[Pb]N9C(=NC1=NC(=N8)C2=C1C=CC(=C2)OC1=CC=C(C=C1)C(C)(C)C1=CC=CC=C1)C1=C(C9=NC4=N5)C=C(C=C1)OC1=CC=C(C=C1)C(C)(C)C1=CC=CC=C1)OC1=CC=C(C=C1)C(C)(C)C1=CC=CC=C1	{1: 8, 35: 6, 4: 4, 33: 2, 14: 48, 15: 4, 22: 4}
Did not match all atoms present	91091-02-0	CC1=NC=CN=C1SC2=CC=CC=C2	{40: 1, 1: 1, 35: 2, 14: 7}
Did not match all atoms present	911-45-5	CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3	{1: 2, 2: 4, 33: 1, 7: 2, 14: 14, 17: 1, 22: 1}
Did not match all atoms present	911-77-3	C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-].Cl	{2: 3, 3: 1, 38: 1, 7: 1, 34: 1, 14: 9, 17: 1, 24: 2, 30: 2, 31: 2}
Did not match all atoms present	91100-28-6	C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]	{24: 1, 41: 1, 38: 1, 14: 11}
Did not match all atoms present	91112-47-9	CC(CO)O.C(CCC(=O)O)CC(=O)O.C12=C(C(=C(C(=C1Br)Br)Br)Br)C(=O)OC2=O	{1: 1, 2: 5, 3: 1, 18: 4, 20: 2, 27: 2, 28: 2}
Did not match all atoms present	91137-78-9	CC1=NC=CN=C1OC2=CC=CC=C2	{1: 1, 35: 2, 22: 1, 14: 7}
Did not match all atoms present	91138-00-0	CC1=C(C=NN1C2=CC=CC=C2)C(=O)O	{1: 1, 27: 1, 35: 1, 14: 6, 33: 1}
Did not match all atoms present	91144-26-2	C1=CC2=C(C(=C(C=C2C=C1NC3=NC(=NC(=N3)N)Cl)S(=O)(=O)[O-])N=NC4=C5C=CC(=CC5=C(C=C4[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].C1=CC2=C(C(=C(C=C2C=C1NC3=NC(=NC(=N3)N)Cl)S(=O)(=O)[O-])N=NC4=C5C=CC(=CC5=C(C=C4[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Co+3]	{34: 4, 35: 6, 38: 2, 14: 16, 17: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	91166-50-6	CN(C)[Si](C)(C)CC[Si](C)(C)N(C)C	{1: 8, 2: 2, 33: 2}
Did not match all atoms present	91170-93-3	C1=CC(=C(C=C1S(=O)(=O)Cl)Cl)F	{16: 1, 17: 2, 29: 2, 14: 3}
Did not match all atoms present	912-60-7	C[NH+]1CCC2=CC3=C(C(=C2[C@H]1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OC)OCO3.[Cl-]	{1: 4, 11: 3, 12: 2, 14: 3, 17: 1, 22: 3, 23: 2, 28: 1}
Did not match all atoms present	91203-10-0	CC(C)CCCCCOC(=O)C=C.C=CC1=CC=CC=C1	{1: 2, 2: 5, 3: 1, 5: 2, 6: 2, 14: 5, 28: 1}
Did not match all atoms present	91219-87-3	CC(C)(C)C1=CC=CC(=C1O)C(C2=NC=C(N2C)[N+](=O)[O-])O	{1: 4, 3: 1, 4: 1, 38: 1, 33: 1, 14: 4, 35: 1, 20: 1, 21: 1}
Did not match all atoms present	91241-12-2	CN(C)P(=NP(=O)(N(C)C)N(C)C)(N(C)C)N(C)C	{1: 10, 34: 1, 29: 1, 33: 5}
Did not match all atoms present	91247-38-0	C1=CC=C(C=C1)CCC(CC(=O)O)N	{27: 1, 2: 3, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	91254-96-5	C1=CC2=C3C(=C1)C=C(C4=C3C(=C(C=C4)[N+](=O)[O-])C=C2)O	{38: 1, 21: 1, 14: 8}
Did not match all atoms present	91259-16-4	C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C(C=C4)C=CC(=C25)[N+](=O)[O-]	{38: 1, 14: 11}
Did not match all atoms present	91269-98-6	C1=CC=C(C=C1)C=CC2=CC(=O)OC2O	{6: 2, 12: 1, 14: 6, 15: 1, 20: 1, 28: 1}
Did not match all atoms present	91297-11-9	C=CC[Se]CC=C	{2: 2, 5: 2, 6: 2}
Did not match all atoms present	913-86-0	CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)(C(C3=CC=C(C=C3)C)(C4=CC=C(C=C4)C)O)O	{1: 4, 4: 2, 14: 16, 20: 2}
Did not match all atoms present	91314-05-5	CCOC1=NC(=NC2=NNN=C21)N	{32: 1, 1: 1, 2: 1, 35: 4, 22: 1, 30: 1}
Did not match all atoms present	91323-12-5	CCCCCCCCCCCCCCC1=CC=C(C=C1)N	{1: 1, 2: 13, 30: 1, 14: 4}
Did not match all atoms present	91367-05-4	CC1=C(C=CC(=C1)C(=O)OC)Cl	{1: 2, 28: 1, 14: 3, 17: 1}
Did not match all atoms present	91391-83-2	C1=CC=C(C=C1)CCC2=NC=CN=C2	{2: 2, 35: 2, 14: 8}
Did not match all atoms present	91395-18-5	C1=CC=C(C=C1)CN2C3=C(C(=NC=N3)Cl)N=C2Cl	{17: 2, 2: 1, 35: 3, 14: 6, 33: 1}
Did not match all atoms present	91398-41-3	C1=CC=C(C=C1)CN(C=O)C2=C(N=CN=C2Cl)N	{33: 1, 2: 1, 35: 2, 14: 6, 17: 1, 26: 1, 30: 1}
Did not match all atoms present	91419-78-2	O[Si](F)(F)F	{16: 3, 20: 1}
Did not match all atoms present	91441-48-4	CNCCNC1=C2C3=C(C=C1)N(NC3=C4C(=O)C=CC(=O)C4=C2O)CCNCCO	{32: 1, 1: 1, 2: 6, 33: 1, 14: 4, 20: 1, 21: 1, 25: 2, 31: 3}
Did not match all atoms present	91454-65-8	CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)Cl	{1: 1, 2: 1, 14: 4, 17: 1, 22: 1, 24: 1, 28: 1}
Did not match all atoms present	91458-42-3	CCN(CCC(C)C)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)O	{1: 3, 2: 3, 3: 1, 33: 1, 14: 7, 21: 1, 24: 1, 27: 1}
Did not match all atoms present	91460-60-5	CC1=CC(=CC=C1)CC(=C)OC	{1: 2, 2: 1, 5: 1, 7: 1, 14: 4, 22: 1}
Did not match all atoms present	91480-86-3	CC1=C(C(=C(N1)C2=CC(=CC=C2)OC)N)C(=O)C	{32: 1, 1: 3, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	91480-88-5	CC1=C(C=CC(=C1)C2=C(C(=C(N2)C)C(=O)C)N)OC	{32: 1, 1: 4, 14: 3, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	91480-89-6	CC1=C(C(=C(N1)C2=CC(=CC=C2)F)N)C(=O)C	{32: 1, 1: 2, 14: 4, 16: 1, 24: 1, 30: 1}
Did not match all atoms present	91480-90-9	CC1=C(C(=C(N1)C2=CC(=C(C=C2)OC)OC)N)C(=O)C	{32: 1, 1: 4, 14: 3, 22: 2, 24: 1, 30: 1}
Did not match all atoms present	91480-92-1	CC1=C(C(=C(N1)C2=CC(=C(C=C2)Cl)Cl)N)C(=O)C	{32: 1, 1: 2, 14: 3, 17: 2, 24: 1, 30: 1}
Did not match all atoms present	91480-97-6	CC1=C(C(=C(N1)C2=CC=CC=C2)O)C(=O)C	{24: 1, 1: 2, 21: 1, 14: 5, 32: 1}
Did not match all atoms present	91480-98-7	CC1=C(C(=C(N1)C2=CC=CC=C2)OC)C(=O)C	{24: 1, 1: 3, 22: 1, 14: 5, 32: 1}
Did not match all atoms present	91481-02-6	CC1=C(C(=C(N1)C2=CC=CC=C2Cl)N)C(=O)C	{32: 1, 1: 2, 14: 4, 17: 1, 24: 1, 30: 1}
Did not match all atoms present	91481-03-7	CC1=C(C(=C(N1)C2=CC=CC=C2OC)N)C(=O)C	{32: 1, 1: 3, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	91481-04-8	CC1=C(NC(=C1C(=O)C)C)C2=CC=CC=C2	{24: 1, 1: 3, 14: 5, 32: 1}
Did not match all atoms present	915-30-0	CCOC(=O)C1(CCN(CC1)CCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{1: 1, 2: 3, 4: 1, 37: 1, 33: 1, 11: 4, 13: 1, 14: 15, 28: 1}
Did not match all atoms present	915-67-3	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N/N=C\3/C4=C(C=C(C=C4)S(=O)(=O)[O-])C=C(C3=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 1, 14: 10, 15: 2, 25: 1, 29: 9, 31: 1}
Did not match all atoms present	915-76-4	C1(=NC(=NC(=N1)C(C(C(F)(F)F)(F)F)(F)F)C(C(C(F)(F)F)(F)F)(F)F)C(C(C(F)(F)F)(F)F)(F)F	{16: 21, 35: 3, 4: 9}
Did not match all atoms present	91503-79-6	CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)OC(C)OC(=O)C	{16: 1, 1: 3, 3: 2, 28: 2, 14: 8}
Did not match all atoms present	91513-55-2	CC(C1=CC=CC=C1)N.CC(C1=CC=CC=C1)N.Cl[Pt]Cl	{1: 2, 3: 2, 30: 2, 14: 10, 17: 2}
Did not match all atoms present	91513-56-3	CS(=O)CCl.C(CN)N.[Cl-].[Cl-].[Cl-].[Cl-].[Pt+4]	{1: 1, 2: 3, 29: 1, 30: 2, 17: 5}
Did not match all atoms present	91524-15-1	CCN1C=C(C(=O)C2=CC(=C(C=C21)N3C=CC=C3)F)C(=O)O	{1: 1, 2: 1, 33: 2, 14: 7, 16: 1, 25: 1, 27: 1}
Did not match all atoms present	91532-29-5	C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N=NN2	{32: 1, 25: 1, 35: 2, 38: 1, 14: 3}
Did not match all atoms present	91553-11-6	CCCCOC1=CC=C(C=C1)C(C)N	{1: 2, 2: 3, 3: 1, 14: 4, 22: 1, 30: 1}
Did not match all atoms present	91558-02-0	CCOC(=O)CNC(=O)NCC1=CC=CC=C1	{1: 1, 2: 3, 14: 5, 24: 1, 28: 1, 31: 2}
Did not match all atoms present	91560-22-4	C1=CC=C(C=C1)CSC2=NC=NC(=C2NC=O)N	{2: 1, 35: 2, 40: 1, 14: 6, 26: 1, 30: 1, 31: 1}
Did not match all atoms present	91598-91-3	CC(=O)NC1=C2C=CC3=C4C2=C(C=CC4=C(C=C3)O)C=C1	{24: 1, 1: 1, 21: 1, 14: 8, 31: 1}
Did not match all atoms present	91599-74-5	CC1=C([C@H](C(=C(N1)C)C(=O)O[C@@H]2CCCN(C2)CC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC.Cl	{32: 1, 1: 3, 2: 1, 38: 1, 33: 1, 11: 4, 12: 2, 14: 9, 15: 4, 17: 1, 28: 2}
Did not match all atoms present	91599-81-4	C1C[C@H](CN(C1)CC2=CC=CC=C2)O	{33: 1, 2: 1, 11: 4, 12: 1, 14: 5, 20: 1}
Did not match all atoms present	91608-15-0	COC1=CC(=C(C(=C1)OC)P(C2=C(C=C(C=C2OC)OC)OC)C3=C(C=C(C=C3OC)OC)OC)OC	{1: 9, 22: 9, 14: 6}
Did not match all atoms present	91639-45-1	CC1=CC(=C2C(=C1)C(=C(N2)C)C)C	{32: 1, 1: 4, 14: 2}
Did not match all atoms present	91646-87-6	CNC(=O)NCCC1=CC=C(C=C1)OC(=O)NC	{1: 2, 2: 2, 14: 4, 24: 1, 28: 1, 31: 3}
Did not match all atoms present	91672-41-2	CCCC[C@H](CCC)CC1=CC=CC=C1O	{1: 2, 2: 6, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	91674-71-4	CCOP(=O)(OCC)OC(=O)C(Cl)Cl	{1: 2, 2: 2, 3: 1, 17: 2, 22: 2, 28: 1, 29: 1}
Did not match all atoms present	91682-96-1	C/C=C(\C)/C=C/C=C/[C@@H]([C@@H](C)[C@H]([C@@H](C)CCC1=C(C(=O)C2=C(O1)C(=C(C=C2OC)OC)O)C)OC)OC	{1: 9, 2: 2, 3: 4, 6: 5, 7: 1, 14: 1, 21: 1, 22: 4, 23: 1, 25: 1}
Did not match all atoms present	917-23-7	C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9)N3	{32: 2, 35: 2, 14: 28}
Did not match all atoms present	917-54-4	[Li+].[CH3-]	{}
Did not match all atoms present	917-57-7	[Li+].C=[CH-]	{5: 1}
Did not match all atoms present	917-58-8	CC[O-].[K+]	{1: 1, 2: 1, 29: 1}
Did not match all atoms present	917-61-3	C(#N)[O-].[Na+]	{29: 1, 37: 1}
Did not match all atoms present	917-64-6	[CH3-].[Mg+2].[I-]	{19: 1}
Did not match all atoms present	917-65-7	C[Al](Cl)Cl	{1: 1, 17: 2}
Did not match all atoms present	917-69-1	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[Co+3]	{24: 3, 1: 3}
Did not match all atoms present	917-70-4	CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].[La+3]	{24: 3, 1: 3}
Did not match all atoms present	917-71-5	[2H]C(=O)O	{26: 1, 27: 1}
Did not match all atoms present	917-96-4	[2H]C([2H])([2H])N=C	{1: 1, 34: 1, 5: 1}
Did not match all atoms present	91724-16-2	[O-][As]([O-])[O-].[O-][As]([O-])[O-].[Sr+2].[Sr+2].[Sr+2]	{29: 6}
Did not match all atoms present	91763-74-5	CCCC(CC)C1=CC=CC=C1O	{1: 2, 2: 3, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	91776-68-0	CCCCCCCCCCCCOP(=O)(OCC)OCC	{1: 3, 2: 13, 29: 1, 22: 3}
Did not match all atoms present	91794-28-4	C[C@@H]1[C@@H](OC(=S)N1)C2=CC=CC=C2	{32: 1, 1: 1, 12: 2, 14: 5, 15: 1, 23: 1}
Did not match all atoms present	918-04-7	CC(O)S(=O)(=O)[O-].[Na+]	{1: 1, 3: 1, 20: 1, 29: 3}
Did not match all atoms present	918-05-8	CN(C)S(=O)(=O)C	{1: 3, 29: 2, 33: 1}
Did not match all atoms present	91832-40-5	C=CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)/C(=N\O)/C3=CSC(=N3)N)SC1)C(=O)O	{33: 1, 34: 1, 35: 1, 5: 1, 6: 1, 7: 1, 41: 2, 11: 1, 12: 2, 14: 1, 15: 2, 20: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	918440-44-5	[O].[O].[Sb+]	{}
Did not match all atoms present	91872-10-5	CC1=NC(=C(C=C1Br)Br)N	{1: 1, 18: 2, 35: 1, 30: 1, 14: 1}
Did not match all atoms present	91899-22-8	C(=[As]C(F)(F)F)(F)F	{16: 5, 4: 1, 7: 1}
Did not match all atoms present	919-16-4	[Li+].[Li+].[Li+].C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O	{24: 3, 20: 1, 2: 2, 4: 1}
Did not match all atoms present	919-19-7	CCOP(=O)(C(=O)C)OCC	{24: 1, 1: 3, 2: 2, 29: 1, 22: 2}
Did not match all atoms present	919-28-8	CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)OC(=O)C	{1: 4, 2: 21, 28: 1}
Did not match all atoms present	919-30-2	CCO[Si](CCCN)(OCC)OCC	{1: 3, 2: 6, 30: 1, 22: 3}
Did not match all atoms present	919-31-3	CCO[Si](CCC#N)(OCC)OCC	{1: 3, 2: 5, 37: 1, 22: 3}
Did not match all atoms present	919-54-0	CCOC(=O)CSP(=S)(OCC)OCC	{40: 1, 1: 3, 2: 4, 28: 1, 22: 2}
Did not match all atoms present	919-62-0	CC(C)CCOP(=O)(OCCC(C)C)OCCC(C)C	{1: 6, 2: 6, 3: 3, 29: 1, 22: 3}
Did not match all atoms present	919-76-6	COCCNC(=O)CSP(=S)(OC)OC	{1: 3, 2: 3, 40: 1, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	919-86-8	CCSCCSP(=O)(OC)OC	{40: 2, 1: 3, 2: 3, 29: 1, 22: 2}
Did not match all atoms present	91962-06-0	C1=CC=C(C=C1)CN(C=O)C2=C(N=C(N=C2Cl)Cl)N	{33: 1, 2: 1, 35: 2, 14: 5, 17: 2, 26: 1, 30: 1}
Did not match all atoms present	91978-56-2	CCN(CCOC)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl	{1: 2, 2: 3, 38: 1, 33: 1, 34: 2, 14: 7, 17: 1, 22: 1}
Did not match all atoms present	91978-58-4	C1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)N/N=C\6/C=CC7=C(C=CC(=C7C6=O)N)S(=O)(=O)O)S(=O)(=O)[O-])S(=O)(=O)O.[Na+]	{34: 4, 14: 19, 15: 3, 20: 2, 24: 1, 25: 2, 29: 7, 30: 2, 31: 3}
Did not match all atoms present	91978-59-5	C1=CC(=O)C=CC1=NNC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NNC4=C5C(=CC(=CC5=O)S(=O)(=O)[O-])C=CC4=N.[Na+]	{34: 1, 36: 1, 14: 16, 15: 6, 24: 1, 25: 2, 29: 3, 31: 4}
Did not match all atoms present	91996-52-0	C1=CC=C(C(=C1)NC(=O)C2=CC=C(C=C2)N/N=C\3/C=CC(=O)C(=C3)C(=O)[O-])N/N=C/4\C(=CC5=C(C4=O)C=C(C=C5)N)S(=O)(=O)[O-].[Na+].[Na+]	{34: 2, 14: 15, 15: 4, 24: 2, 25: 2, 29: 3, 30: 1, 31: 3}
Did not match all atoms present	91998-68-4	B1(SB(S1)F)F	{16: 2, 41: 2}
Did not match all atoms present	91999-14-3	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5I	{1: 1, 11: 6, 12: 3, 13: 1, 14: 7, 19: 1, 25: 1, 28: 1}
Did not match all atoms present	92-00-2	C1=CC(=CC(=C1)Cl)N(CCO)CCO	{17: 1, 2: 4, 20: 2, 14: 4, 33: 1}
Did not match all atoms present	92-01-3	CC1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)N)S(=O)(=O)O	{1: 1, 35: 1, 41: 1, 14: 6, 20: 1, 29: 2, 30: 1}
Did not match all atoms present	92-02-4	CC(=O)NC1=CC(=CC=C1)N(CCO)CCO	{1: 1, 2: 4, 33: 1, 14: 4, 20: 2, 24: 1, 31: 1}
Did not match all atoms present	92-03-5	C1=CC=C(C=C1)C2=CC(=C(C=C2)O)Br	{18: 1, 21: 1, 14: 8}
Did not match all atoms present	92-04-6	C1=CC=C(C=C1)C2=CC(=C(C=C2)O)Cl	{17: 1, 21: 1, 14: 8}
Did not match all atoms present	92-05-7	C1=CC=C(C=C1)C2=CC(=C(C=C2)O)O	{21: 2, 14: 8}
Did not match all atoms present	92-06-8	C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC=CC=C3	{14: 14}
Did not match all atoms present	92-07-9	C1=CC=C(C=C1)C2=CC(=CN=C2)C3=CC=CC=C3	{35: 1, 14: 13}
Did not match all atoms present	92-09-1	CCN(CCNS(=O)(=O)C)C1=CC(=C(C=C1)N)C	{1: 3, 2: 3, 33: 1, 14: 3, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	92-10-4	CCN(CCCl)C1=CC(=C(C=C1)C=O)C	{1: 2, 2: 3, 33: 1, 14: 3, 17: 1, 26: 1}
Did not match all atoms present	92-11-5	CCN(CC(CO)O)C1=CC=CC(=C1)C	{1: 2, 2: 3, 3: 1, 33: 1, 14: 4, 20: 2}
Did not match all atoms present	92-12-6	CN(C)CCOC1=CC=CC=C1CC2=CC=CC=C2	{1: 2, 2: 3, 22: 1, 14: 9, 33: 1}
Did not match all atoms present	92-13-7	CC[C@H]1[C@H](COC1=O)CC2=CN=CN2C	{1: 2, 2: 2, 35: 1, 33: 1, 11: 1, 12: 2, 14: 2, 28: 1}
Did not match all atoms present	92-14-8	CCN(CC)C1=CC(=C(C=C1)C=O)C	{1: 3, 2: 2, 26: 1, 14: 3, 33: 1}
Did not match all atoms present	92-15-9	CC(=O)CC(=O)NC1=CC=CC=C1OC	{1: 2, 2: 1, 14: 4, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	92-16-0	COC1=CC=CC=C1NC(=O)CC(=O)C2=CC=CC=C2	{1: 1, 2: 1, 14: 9, 22: 1, 24: 2, 31: 1}
Did not match all atoms present	92-18-2	CCN(CC)C1=CC(=CC=C1)OC	{1: 3, 2: 2, 22: 1, 14: 4, 33: 1}
Did not match all atoms present	92-21-7	COC1=CC(=C(C=C1NC(=O)CC(=O)C2=CC=C(C=C2)C(=O)CC(=O)NC3=CC(=C(C=C3OC)OC)Cl)Cl)OC	{1: 4, 2: 2, 14: 8, 17: 2, 22: 4, 24: 4, 31: 2}
Did not match all atoms present	92-24-0	C1=CC=C2C=C3C=C4C=CC=CC4=CC3=CC2=C1	{14: 12}
Did not match all atoms present	92-26-2	CC1=CC2=CC3=CC(=C(C=C3N=C2C=C1N)N)C	{1: 2, 35: 1, 30: 2, 14: 5}
Did not match all atoms present	92-27-3	C1=CC(=CC2=CC(=C(C=C21)O)O)S(=O)(=O)O	{20: 1, 21: 2, 14: 5, 29: 2}
Did not match all atoms present	92-28-4	C1=CC(=CC2=CC(=C(C=C21)N)S(=O)(=O)O)S(=O)(=O)O	{30: 1, 20: 2, 29: 4, 14: 5}
Did not match all atoms present	92-29-5	C1=CC=C(C=C1)/C=N/C(/N=C/C2=CC=CC=C2)C3=CC=CC=C3	{34: 2, 3: 1, 14: 15, 6: 2}
Did not match all atoms present	92-30-8	C1=CC=C2C(=C1)NC3=C(S2)C=CC(=C3)C(F)(F)F	{16: 3, 32: 1, 4: 1, 14: 7, 41: 1}
Did not match all atoms present	92-31-9	CC1=CC2=C(C=C1N)SC3=CC(=[N+](C)C)C=CC3=N2.[Cl-]	{1: 3, 35: 1, 33: 1, 41: 1, 14: 5, 17: 1, 30: 1}
Did not match all atoms present	92-32-0	CN(C)C1=CC2=C(C=C1)C=C3C=CC(=[N+](C)C)C=C3O2.[Cl-]	{1: 4, 23: 1, 33: 2, 14: 7, 17: 1}
Did not match all atoms present	92-35-3	CC1=C(SC2=NC3=NC(=NC=C3CN12)C)CCO	{1: 2, 2: 2, 35: 3, 33: 1, 41: 1, 11: 1, 14: 1, 15: 3, 20: 1}
Did not match all atoms present	92-36-4	CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N	{1: 1, 35: 1, 30: 1, 14: 7, 41: 1}
Did not match all atoms present	92-39-7	C1=CC=C2C(=C1)NC3=C(S2)C=CC(=C3)Cl	{32: 1, 17: 1, 14: 7, 41: 1}
Did not match all atoms present	92-40-0	C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)O)O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	92-41-1	C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)O)S(=O)(=O)O	{20: 2, 29: 4, 14: 6}
Did not match all atoms present	92-43-3	C1CN(NC1=O)C2=CC=CC=C2	{32: 1, 25: 1, 11: 2, 14: 5, 33: 1}
Did not match all atoms present	92-44-4	C1=CC=C2C=C(C(=CC2=C1)O)O	{21: 2, 14: 6}
Did not match all atoms present	92-46-6	CC1=NC2=C(C=C1)C=C(C=C2)Cl	{1: 1, 35: 1, 14: 5, 17: 1}
Did not match all atoms present	92-47-7	CC1=CC2=C(C=C1)OC(=O)CC2	{1: 1, 11: 2, 28: 1, 14: 3}
Did not match all atoms present	92-48-8	CC1=CC2=C(C=C1)OC(=O)C=C2	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	92-49-9	CCN(CCCl)C1=CC=CC=C1	{1: 1, 2: 3, 33: 1, 14: 5, 17: 1}
Did not match all atoms present	92-50-2	CCN(CCO)C1=CC=CC=C1	{1: 1, 2: 3, 20: 1, 14: 5, 33: 1}
Did not match all atoms present	92-52-4	C1=CC=C(C=C1)C2=CC=CC=C2	{14: 10}
Did not match all atoms present	92-53-5	C1COCCN1C2=CC=CC=C2	{33: 1, 11: 4, 14: 5, 23: 1}
Did not match all atoms present	92-54-6	C1CN(CCN1)C2=CC=CC=C2	{32: 1, 33: 1, 11: 4, 14: 5}
Did not match all atoms present	92-56-8	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)S(=O)(=O)O	{1: 1, 2: 2, 33: 1, 14: 9, 20: 1, 29: 2}
Did not match all atoms present	92-57-9	CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)[N+]#N.[Cl-]	{1: 1, 2: 2, 33: 1, 34: 1, 14: 9, 17: 1}
Did not match all atoms present	92-59-1	CCN(CC1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 2, 14: 10, 33: 1}
Did not match all atoms present	92-60-4	CCN(CC1=CC=C(C=C1)S(=O)(=O)O)C2=CC=CC=C2	{1: 1, 2: 2, 33: 1, 14: 9, 20: 1, 29: 2}
Did not match all atoms present	92-61-5	COC1=C(C=C2C(=C1)C=CC(=O)O2)O	{1: 1, 22: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	92-62-6	C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N	{35: 1, 30: 2, 14: 7}
Did not match all atoms present	92-64-8	C1=CC=C(C=C1)N(CCC#N)CCO	{33: 1, 2: 4, 20: 1, 37: 1, 14: 5}
Did not match all atoms present	92-65-9	CCN(CCO)C1=CC=C(C=C1)N	{1: 1, 2: 3, 33: 1, 14: 4, 20: 1, 30: 1}
Did not match all atoms present	92-66-0	C1=CC=C(C=C1)C2=CC=C(C=C2)Br	{18: 1, 14: 9}
Did not match all atoms present	92-67-1	C1=CC=C(C=C1)C2=CC=C(C=C2)N	{30: 1, 14: 9}
Did not match all atoms present	92-69-3	C1=CC=C(C=C1)C2=CC=C(C=C2)O	{21: 1, 14: 9}
Did not match all atoms present	92-70-6	C1=CC=C2C=C(C(=CC2=C1)C(=O)O)O	{27: 1, 21: 1, 14: 6}
Did not match all atoms present	92-71-7	C1=CC=C(C=C1)C2=CN=C(O2)C3=CC=CC=C3	{35: 1, 14: 11, 23: 1}
Did not match all atoms present	92-72-8	COC1=CC(=C(C=C1NC(=O)C2=CC3=CC=CC=C3C=C2O)Cl)OC	{1: 2, 14: 8, 17: 1, 21: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	92-73-9	COC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=CC=CC=C3C=C2O	{1: 2, 14: 9, 21: 1, 22: 2, 24: 1, 31: 1}
Did not match all atoms present	92-75-1	CC1=CC(=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O)C	{24: 1, 1: 2, 21: 1, 14: 9, 31: 1}
Did not match all atoms present	92-77-3	C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O	{24: 1, 21: 1, 14: 11, 31: 1}
Did not match all atoms present	92-79-5	COC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2O	{1: 1, 14: 10, 21: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	92-80-8	C1=CC=C2C=C(C(=CC2=C1)C(=O)NCCO)O	{2: 2, 14: 6, 20: 1, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	92-81-9	C1C2=CC=CC=C2NC3=CC=CC=C31	{32: 1, 11: 1, 14: 8}
Did not match all atoms present	92-82-0	C1=CC=C2C(=C1)N=C3C=CC=CC3=N2	{35: 2, 14: 8}
Did not match all atoms present	92-83-1	C1C2=CC=CC=C2OC3=CC=CC=C31	{11: 1, 14: 8, 23: 1}
Did not match all atoms present	92-84-2	C1=CC=C2C(=C1)NC3=CC=CC=C3S2	{32: 1, 41: 1, 14: 8}
Did not match all atoms present	92-85-3	C1=CC=C2C(=C1)SC3=CC=CC=C3S2	{41: 2, 14: 8}
Did not match all atoms present	92-86-4	C1=CC(=CC=C1C2=CC=C(C=C2)Br)Br	{18: 2, 14: 8}
Did not match all atoms present	92-87-5	C1=CC(=CC=C1C2=CC=C(C=C2)N)N	{30: 2, 14: 8}
Did not match all atoms present	92-88-6	C1=CC(=CC=C1C2=CC=C(C=C2)O)O	{21: 2, 14: 8}
Did not match all atoms present	92-89-7	C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O	{27: 1, 38: 1, 14: 8}
Did not match all atoms present	92-91-1	CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2	{24: 1, 1: 1, 14: 9}
Did not match all atoms present	92-92-2	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O	{27: 1, 14: 9}
Did not match all atoms present	92-93-3	C1=CC=C(C=C1)C2=CC=C(C=C2)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	92-94-4	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3	{14: 14}
Did not match all atoms present	92-95-5	C1=CC=C(C=C1)C2=CC=C(C=C2)N=C=O	{8: 1, 34: 1, 29: 1, 14: 9}
Did not match all atoms present	92-99-9	CC1=NC2=C(C=C1)C=C(C=C2)N(C)C	{1: 3, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	920-39-8	C[CH-]C.[Mg+2].[Br-]	{1: 2, 18: 1, 6: 1}
Did not match all atoms present	920-42-3	[2H]C(=O)O[2H]	{26: 1, 27: 1}
Did not match all atoms present	920-52-5	O=C([O-])C(=O)O	{24: 1, 27: 1}
Did not match all atoms present	920-68-3	CN([Si](C)(C)C)[Si](C)(C)C	{1: 7, 33: 1}
Did not match all atoms present	92001-52-0	CC1=NC2=C(N1)C(=NC=N2)Cl	{32: 1, 1: 1, 35: 3, 14: 1, 17: 1}
Did not match all atoms present	92003-62-8	CCOC(=O)COC1=C2CC3=CC(=CC(=C3OCC(=O)OCC)CC4=CC(=CC(=C4OCC(=O)OCC)CC5=C(C(=CC(=C5)C(C)(C)C)CC6=C(C(=CC(=C6)C(C)(C)C)CC7=C(C(=CC(=C7)C(C)(C)C)CC1=CC(=C2)C(C)(C)C)OCC(=O)OCC)OCC(=O)OCC)OCC(=O)OCC)C(C)(C)C)C(C)(C)C	{1: 24, 2: 12, 4: 6, 11: 6, 14: 12, 22: 6, 28: 6}
Did not match all atoms present	92013-10-0	CCCC1CC2=CC=CC=C2C1=O	{1: 1, 2: 2, 11: 1, 12: 1, 14: 4, 25: 1}
Did not match all atoms present	92013-11-1	CCCC1=CC2=CC=CC=C2C1	{1: 1, 2: 2, 11: 1, 14: 5, 15: 1}
Did not match all atoms present	92013-89-3	CN(C)C1=CC=CC2=C1C3=CC=CC=C3C2	{1: 2, 11: 1, 14: 7, 33: 1}
Did not match all atoms present	92042-04-1	COC1=CC(=CC(=C1OC)OC)C(=O)NC2CC2	{1: 3, 11: 2, 12: 1, 14: 2, 22: 3, 24: 1, 31: 1}
Did not match all atoms present	92077-78-6	CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@H]2CCCN3CCC[C@H](N3C2=O)C(=O)O.O	{1: 1, 2: 3, 3: 1, 33: 2, 11: 6, 12: 2, 14: 5, 25: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	92141-86-1	B(=O)[O-].[Cs+]	{29: 2}
Did not match all atoms present	92145-26-1	CC1=C2C=CC3=C(C2=NC4=CC=CC=C14)C=C[C@H]([C@@H]3O)O	{1: 1, 35: 1, 12: 2, 14: 8, 20: 2}
Did not match all atoms present	92153-14-5	CC1=CC(=C(C=C1)O)C(=O)C2=C(C=C(C=C2)Cl)Cl	{24: 1, 1: 1, 21: 1, 14: 6, 17: 2}
Did not match all atoms present	92153-17-8	CC1=CC(=C(C=C1)O)C(=O)C2=CC(=C(C=C2)Cl)Cl	{24: 1, 1: 1, 21: 1, 14: 6, 17: 2}
Did not match all atoms present	92163-15-0	C1=CC=C(C=C1)OC2=CC=C(C=C2)CC#N	{2: 1, 22: 1, 14: 9, 37: 1}
Did not match all atoms present	92166-81-9	C1=CC=C(C(=C1)NN=C2C=C(C=CC2=O)CCO)[N+](=O)[O-]	{2: 2, 38: 1, 34: 1, 14: 7, 15: 2, 20: 1, 25: 1, 31: 1}
Did not match all atoms present	92180-79-5	CC1=NC2=C(C3=C(C=C2)N(C(=N3)N)C)N=C1C	{1: 3, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	92193-48-1	C1CN1C2=NC=NC3=C2N=CN3CC4=CC=CC=C4	{33: 2, 2: 1, 11: 2, 14: 7, 35: 3}
Did not match all atoms present	92207-24-4	C1=CC=C(C=C1)C=CS(=O)(=O)CC(=O)[O-]	{24: 1, 2: 1, 14: 5, 6: 2, 29: 2}
Did not match all atoms present	92233-82-4	CCCC1=NC(=C(N=C1C)C)C	{1: 4, 2: 2, 35: 2}
Did not match all atoms present	92265-07-1	CC(C)C(CO)NC(=O)C1=CC=CC=C1	{1: 2, 2: 1, 3: 2, 14: 5, 20: 1, 24: 1, 31: 1}
Did not match all atoms present	92272-66-7	B12OCCN(CCC(=O)O1)CCO2	{33: 1, 11: 6, 28: 1, 23: 2}
Did not match all atoms present	92296-30-5	CCN(C=O)C1=C(N=CN=C1SCC2=CC=CC=C2)N	{1: 1, 2: 2, 35: 2, 33: 1, 40: 1, 14: 6, 26: 1, 30: 1}
Did not match all atoms present	923-34-2	CC[In](CC)CC	{1: 3, 2: 3}
Did not match all atoms present	923-99-9	CCCOP(OCCC)OCCC	{1: 3, 2: 6, 22: 3}
Did not match all atoms present	92333-25-0	C1=CN=CC=C1CC#N.Cl	{17: 1, 2: 1, 35: 1, 37: 1, 14: 4}
Did not match all atoms present	92341-23-6	CC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)C	{1: 2, 10: 4, 28: 2, 14: 8}
Did not match all atoms present	92341-24-7	CCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CC	{1: 2, 2: 2, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	92341-25-8	CCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCC	{1: 2, 2: 4, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	92341-26-9	CCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCC	{1: 2, 2: 8, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	92341-27-0	CCCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCCC	{1: 2, 2: 10, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	92341-28-1	CCCCCCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCCCCCC	{1: 2, 2: 16, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	92341-29-2	CCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)OC(=O)CCCCCCCCCCC	{1: 2, 2: 20, 28: 2, 10: 4, 14: 8}
Did not match all atoms present	92352-41-5	CCCCN1C2=NC(=NC(=S)C2=NN1)N	{32: 1, 1: 1, 2: 3, 35: 3, 33: 1, 30: 1}
Did not match all atoms present	92374-99-7	CCCCCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 6, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	92379-51-6	CCCCCC(C)COP(=S)(OCC(C)CCCCC)[S-].CCCCCC(C)COP(=S)(OCC(C)CCCCC)[S-].[Zn+2]	{1: 8, 2: 20, 3: 4, 22: 4}
Did not match all atoms present	92379-52-7	CCC[C@@H](C)CO[P+](=O)OC[C@H](C)CCC	{1: 4, 2: 6, 3: 2, 29: 1, 22: 2}
Did not match all atoms present	924-52-7	CCC(C)O[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 22: 1}
Did not match all atoms present	92409-09-1	CCCN(C)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)C)NC6=CC=CC=C6	{1: 3, 2: 2, 33: 1, 13: 1, 14: 14, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	92466-70-1	C(C(F)(F)F)OP(O)OCC(F)(F)F	{16: 6, 20: 1, 2: 2, 4: 2, 22: 2}
Did not match all atoms present	92468-04-7	COC(=O)C1CCCC1.C1CCCCCCC1.[Co]	{1: 1, 11: 12, 12: 1, 28: 1}
Did not match all atoms present	92469-33-5	CN(C)CCO.CN(C)CCO.CN(C)CCO.CN(C)CCO.[Ti]	{1: 8, 2: 8, 20: 4, 33: 4}
Did not match all atoms present	92473-80-8	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Eu+3].[Eu+3]	{24: 6}
Did not match all atoms present	925-90-6	C[CH2-].[Mg+2].[Br-]	{1: 1, 18: 1, 5: 1}
Did not match all atoms present	925-93-9	[2H]OCC	{1: 1, 2: 1, 20: 1}
Did not match all atoms present	92550-15-7	C1=CC(=CC=C1CNC(=O)NCC2=CC=C(C=C2)Cl)Cl	{24: 1, 17: 2, 2: 2, 14: 8, 31: 2}
Did not match all atoms present	926-06-7	CC(C)OS(=O)(=O)C	{1: 3, 3: 1, 29: 2, 22: 1}
Did not match all atoms present	926-25-0	CC(CN)OS(=O)(=O)O	{1: 1, 2: 1, 3: 1, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	926-39-6	C(COS(=O)(=O)O)N	{2: 2, 30: 1, 20: 1, 29: 2, 22: 1}
Did not match all atoms present	926-53-4	CCC[As](Cl)Cl	{1: 1, 2: 2, 17: 2}
Did not match all atoms present	926-67-0	CCOC(=S)C	{1: 2, 2: 1, 22: 1, 7: 1}
Did not match all atoms present	926-93-2	CC(C=C)NC(=S)NNC(=S)NC	{1: 2, 3: 1, 5: 1, 6: 1, 7: 2, 31: 4}
Did not match all atoms present	92610-88-3	CC1=CC(=O)N=C(N1)NN=C(C)C(=O)O	{32: 1, 1: 2, 34: 1, 35: 1, 7: 1, 14: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	92611-10-4	CC(C)N(C(C)C)P(N(C(C)C)C(C)C)OC	{1: 9, 3: 4, 22: 1, 33: 2}
Did not match all atoms present	92630-42-7	COC1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=CC=C3	{1: 1, 34: 1, 7: 1, 14: 14, 22: 1, 24: 2}
Did not match all atoms present	92630-44-9	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C(=NC3=CC=CC=C3)C(=O)C4=CC=CC=C4	{24: 2, 34: 1, 14: 19, 7: 1}
Did not match all atoms present	92630-45-0	C1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Cl	{24: 2, 17: 1, 34: 1, 14: 14, 7: 1}
Did not match all atoms present	92630-46-1	C1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)Br	{24: 2, 18: 1, 34: 1, 14: 14, 7: 1}
Did not match all atoms present	92630-47-2	C1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Cl	{24: 2, 17: 1, 34: 1, 14: 14, 7: 1}
Did not match all atoms present	92630-50-7	CC1=CC=C(C=C1)C(=O)C(=NC2=CC=CC=C2)C(=O)C3=CC=CC=C3	{24: 2, 1: 1, 34: 1, 14: 14, 7: 1}
Did not match all atoms present	92636-36-7	C1=CN(C=C1)C2=CC=C(C=C2)I	{33: 1, 19: 1, 14: 8}
Did not match all atoms present	92662-79-8	CCC(=O)O/N=C(/C1=CC=C(O1)[N+](=O)[O-])\N	{1: 1, 2: 1, 38: 1, 7: 1, 34: 1, 14: 2, 23: 1, 28: 1, 30: 1}
Did not match all atoms present	92665-29-7	C/C=C/C1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)SC1)C(=O)O	{1: 1, 3: 1, 6: 2, 33: 1, 41: 1, 11: 1, 12: 2, 14: 4, 15: 2, 21: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
Did not match all atoms present	92688-77-2	C1C2C(CS1(=O)=O)C3C=CC2O3	{11: 2, 12: 4, 29: 2, 14: 2, 23: 1}
Did not match all atoms present	92688-78-3	C1CC2C=CC1C3C2S(=O)(=O)CC3	{11: 4, 12: 4, 29: 2, 14: 2}
Did not match all atoms present	92688-79-4	C1C=CCC2C1CS(=O)(=O)C2	{11: 4, 12: 2, 29: 2, 14: 2}
Did not match all atoms present	92688-80-7	C1C2C=CC1C3C2CS(=O)(=O)C3	{11: 3, 12: 4, 29: 2, 14: 2}
Did not match all atoms present	92688-81-8	C1CC2C=CC1C3C2CS(=O)(=O)C3	{11: 4, 12: 4, 29: 2, 14: 2}
Did not match all atoms present	927-67-3	CCCNC(=S)N	{1: 1, 2: 2, 31: 1, 30: 1, 7: 1}
Did not match all atoms present	927-86-6	CC(=O)OCC[N+](C)(C)C.[O-]Cl(=O)(=O)=O	{1: 4, 2: 2, 28: 1, 29: 4, 17: 1}
Did not match all atoms present	92700-71-5	CCCCCCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 7, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	92723-90-5	C1=CC=C(C=C1)CN2C=NC3=C2NC(=NC3=S)N	{32: 1, 33: 1, 2: 1, 35: 2, 14: 6, 30: 1}
Did not match all atoms present	92758-75-3	CC=CC(=O)OCC1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 14: 5, 6: 2}
Did not match all atoms present	92771-38-5	CC/C(=C/C1=[N+](C2=C(O1)C=CC(=C2)Cl)CCCCS(=O)(=O)[O-])/C=C\3/N(C4=C(O3)C=CC(=C4)Cl)CCCCS(=O)(=O)O.CCN(CC)CC	{1: 4, 2: 12, 33: 3, 6: 2, 7: 1, 14: 6, 15: 1, 17: 2, 20: 1, 23: 2, 29: 5}
Did not match all atoms present	92785-64-3	[Fe].[Fe](I)I	{19: 2}
Did not match all atoms present	928-04-1	C(#CC(=O)[O-])C(=O)O.[K+]	{24: 1, 10: 2, 27: 1}
Did not match all atoms present	928-45-0	CCCCO[N+](=O)[O-]	{1: 1, 2: 3, 22: 1}
Did not match all atoms present	928-64-3	CCCCCCP(=O)(Cl)Cl	{1: 1, 2: 5, 29: 1, 17: 2}
Did not match all atoms present	928-65-4	CCCCCC[Si](Cl)(Cl)Cl	{1: 1, 2: 5, 17: 3}
Did not match all atoms present	928-70-1	CC(C)CCOC(=S)[S-].[K+]	{1: 2, 2: 2, 3: 1, 22: 1, 7: 1}
Did not match all atoms present	928-72-3	C(C(=O)[O-])NCC(=O)[O-].[Na+].[Na+]	{24: 2, 2: 2, 31: 1}
Did not match all atoms present	92818-48-9	CN(CCCC1=CC=CC=C1)C2=CC=C(C=C2)N=NC3=NC4=CC(=C(C=C4S3)Cl)Cl	{1: 1, 2: 3, 35: 1, 33: 1, 41: 1, 34: 2, 14: 11, 17: 2}
Did not match all atoms present	92823-03-5	CO[C@@]1([C@@H]2N(C1=O)C(=C(CO2)CSC3=NN=NN3CCO)C(=O)O)NC(=O)CSC(F)F.[Na]	{1: 1, 2: 4, 3: 1, 33: 2, 40: 2, 11: 1, 12: 1, 13: 1, 15: 2, 16: 2, 35: 3, 20: 1, 22: 1, 23: 1, 24: 1, 25: 1, 27: 1, 31: 1}
Did not match all atoms present	929-57-7	[C-]#[N+]CCCCCC[N+]#[C-]	{2: 6, 34: 2}
Did not match all atoms present	92908-53-7	CC1=CC=C(C=C1)N(C)/N=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 6, 34: 1, 6: 1, 33: 2, 13: 1, 14: 12, 15: 1, 29: 3}
Did not match all atoms present	92908-54-8	CC1=CC=C(C=C1)N(C)/N=C/C2=[N+](C3=CC=CC=C3C2(C)C)C.C(=O)[O-]	{1: 5, 34: 1, 6: 1, 33: 2, 13: 1, 14: 8, 15: 1, 26: 1}
Did not match all atoms present	92908-55-9	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1(C2=CC=CC=C2[N+](=C1/C=N/N(C)C3=CC=C(C=C3)OC)C)C	{1: 6, 34: 1, 6: 1, 33: 2, 13: 1, 14: 12, 15: 1, 22: 1, 29: 3}
Did not match all atoms present	92908-56-0	CCCCC(CC)CNCC(CC)CCCC.C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=CC=C(C=C3)S(=O)(=O)O	{1: 4, 2: 10, 3: 2, 34: 1, 14: 10, 15: 1, 20: 1, 25: 1, 29: 2, 31: 2}
Did not match all atoms present	92952-73-3	CCN(CCO)C1=CC=C(C=C1)C2=[N+](C3=C4C2=CC=CC4=C(C=C3)Cl)C.CC(=O)[O-]	{1: 3, 2: 3, 33: 2, 14: 9, 15: 1, 17: 1, 20: 1, 24: 1}
Did not match all atoms present	929976-32-9	CC1=C(C(=NC=C1[N+](=O)[O-])N)Br	{1: 1, 35: 1, 38: 1, 14: 1, 18: 1, 30: 1}
Did not match all atoms present	92999-29-6	C1=NC2=C(C(=N1)N)N=CN2C[C@@H](CO)OCP(=O)(O)O	{33: 1, 2: 3, 3: 1, 14: 2, 35: 3, 20: 3, 22: 1, 29: 1, 30: 1}
Did not match all atoms present	93-01-6	C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C=C1O	{20: 1, 21: 1, 14: 6, 29: 2}
Did not match all atoms present	93-02-7	COC1=CC(=C(C=C1)OC)C=O	{1: 2, 26: 1, 22: 2, 14: 3}
Did not match all atoms present	93-03-8	COC1=C(C=C(C=C1)CO)OC	{1: 2, 2: 1, 20: 1, 22: 2, 14: 3}
Did not match all atoms present	93-04-9	COC1=CC2=CC=CC=C2C=C1	{1: 1, 22: 1, 14: 7}
Did not match all atoms present	93-05-0	CCN(CC)C1=CC=C(C=C1)N	{1: 2, 2: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	93-07-2	COC1=C(C=C(C=C1)C(=O)O)OC	{1: 2, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	93-08-3	CC(=O)C1=CC2=CC=CC=C2C=C1	{24: 1, 1: 1, 14: 7}
Did not match all atoms present	93-09-4	C1=CC=C2C=C(C=CC2=C1)C(=O)O	{27: 1, 14: 7}
Did not match all atoms present	93-10-7	C1=CC=C2C(=C1)C=CC(=N2)C(=O)O	{35: 1, 27: 1, 14: 6}
Did not match all atoms present	93-11-8	C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)Cl	{17: 1, 29: 2, 14: 7}
Did not match all atoms present	93-13-0	COC1=CC=CC=C1NCS(=O)(=O)O	{1: 1, 2: 1, 14: 4, 20: 1, 22: 1, 29: 2, 31: 1}
Did not match all atoms present	93-14-1	COC1=CC=CC=C1OCC(CO)O	{1: 1, 2: 2, 3: 1, 14: 4, 20: 2, 22: 2}
Did not match all atoms present	93-15-2	COC1=C(C=C(C=C1)CC=C)OC	{1: 2, 2: 1, 5: 1, 6: 1, 14: 3, 22: 2}
Did not match all atoms present	93-16-3	CC=CC1=CC(=C(C=C1)OC)OC	{1: 3, 22: 2, 14: 3, 6: 2}
Did not match all atoms present	93-17-4	COC1=C(C=C(C=C1)CC#N)OC	{1: 2, 2: 1, 22: 2, 14: 3, 37: 1}
Did not match all atoms present	93-18-5	CCOC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 1, 22: 1, 14: 7}
Did not match all atoms present	93-19-6	CC(C)CC1=NC2=CC=CC=C2C=C1	{1: 2, 2: 1, 3: 1, 14: 6, 35: 1}
Did not match all atoms present	93-20-9	C1=CC=C2C=C(C=CC2=C1)OCCO	{2: 2, 20: 1, 22: 1, 14: 7}
Did not match all atoms present	93-21-0	C1=CC=C2C=C(C=CC2=C1)SCC(=O)O	{40: 1, 2: 1, 27: 1, 14: 7}
Did not match all atoms present	93-23-2	CCCCCCCCCCCC[N+]1=CC2=CC=CC=C2C=C1.[Br-]	{1: 1, 2: 11, 18: 1, 14: 7, 33: 1}
Did not match all atoms present	93-25-4	COC1=CC=CC=C1CC(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	93-26-5	CC(=O)NC1=CC=CC=C1OC	{24: 1, 1: 2, 22: 1, 14: 4, 31: 1}
Did not match all atoms present	93-27-6	CC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC	{1: 2, 38: 1, 14: 3, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	93-28-7	CC(=O)OC1=C(C=C(C=C1)CC=C)OC	{1: 2, 2: 1, 5: 1, 6: 1, 14: 3, 22: 1, 28: 1}
Did not match all atoms present	93-29-8	CC=CC1=CC(=C(C=C1)OC(=O)C)OC	{1: 3, 22: 1, 28: 1, 14: 3, 6: 2}
Did not match all atoms present	93-34-5	COC1=C(C=C(C=C1)Cl)[N+]#N.[Cl-]	{1: 1, 34: 1, 22: 1, 14: 3, 17: 2}
Did not match all atoms present	93-35-6	C1=CC(=CC2=C1C=CC(=O)O2)O	{28: 1, 21: 1, 14: 5}
Did not match all atoms present	93-37-8	CC1=CC2=C(C=C1)C=CC(=N2)C	{1: 2, 35: 1, 14: 5}
Did not match all atoms present	93-40-3	COC1=C(C=C(C=C1)CC(=O)O)OC	{1: 2, 2: 1, 27: 1, 22: 2, 14: 3}
Did not match all atoms present	93-42-5	C1=CC=C2C=C(C=CC2=C1)NC(=O)CS	{24: 1, 2: 1, 39: 1, 14: 7, 31: 1}
Did not match all atoms present	93-44-7	C1=CC=C(C=C1)C(=O)OC2=CC3=CC=CC=C3C=C2	{28: 1, 14: 12}
Did not match all atoms present	93-45-8	C1=CC=C2C=C(C=CC2=C1)NC3=CC=C(C=C3)O	{21: 1, 14: 11, 31: 1}
Did not match all atoms present	93-46-9	C1=CC=C2C=C(C=CC2=C1)NC3=CC=C(C=C3)NC4=CC5=CC=CC=C5C=C4	{14: 18, 31: 2}
Did not match all atoms present	93-48-1	CC1=CC(=C(C=C1)C)CN	{1: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	93-50-5	COC1=C(C=CC(=C1)Cl)N	{1: 1, 30: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	93-51-6	CC1=CC(=C(C=C1)O)OC	{1: 2, 22: 1, 21: 1, 14: 3}
Did not match all atoms present	93-52-7	C1=CC=C(C=C1)C(CBr)Br	{2: 1, 3: 1, 18: 2, 14: 5}
Did not match all atoms present	93-53-8	CC(C=O)C1=CC=CC=C1	{1: 1, 26: 1, 3: 1, 14: 5}
Did not match all atoms present	93-54-9	CCC(C1=CC=CC=C1)O	{1: 1, 2: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	93-55-0	CCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	93-56-1	C1=CC=C(C=C1)C(CO)O	{2: 1, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	93-58-3	COC(=O)C1=CC=CC=C1	{1: 1, 28: 1, 14: 5}
Did not match all atoms present	93-59-4	C1=CC=C(C=C1)C(=O)OO	{28: 1, 20: 1, 14: 5}
Did not match all atoms present	93-60-7	COC(=O)C1=CN=CC=C1	{1: 1, 35: 1, 28: 1, 14: 4}
Did not match all atoms present	93-61-8	CN(C=O)C1=CC=CC=C1	{1: 1, 26: 1, 14: 5, 33: 1}
Did not match all atoms present	93-65-2	CC1=C(C=CC(=C1)Cl)OC(C)C(=O)O	{1: 2, 3: 1, 14: 3, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	93-68-5	CC1=CC=CC=C1NC(=O)CC(=O)C	{24: 2, 1: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	93-69-6	CC1=CC=CC=C1N=C(N)N=C(N)N	{1: 1, 34: 2, 30: 3, 14: 4, 7: 2}
Did not match all atoms present	93-70-9	CC(=O)CC(=O)NC1=CC=CC=C1Cl	{1: 1, 2: 1, 14: 4, 17: 1, 24: 2, 31: 1}
Did not match all atoms present	93-72-1	CC(C(=O)O)OC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 3: 1, 14: 2, 17: 3, 22: 1, 27: 1}
Did not match all atoms present	93-76-5	C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)O	{17: 3, 2: 1, 27: 1, 22: 1, 14: 2}
Did not match all atoms present	93-77-6	CC1=CC(=C(C=C1Cl)C)SCC(=O)O	{1: 2, 2: 1, 40: 1, 14: 2, 17: 1, 27: 1}
Did not match all atoms present	93-79-8	CCCCOC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl	{1: 1, 2: 4, 14: 2, 17: 3, 22: 1, 28: 1}
Did not match all atoms present	93-80-1	C1=C(C(=CC(=C1Cl)Cl)Cl)OCCCC(=O)O	{17: 3, 2: 3, 27: 1, 22: 1, 14: 2}
Did not match all atoms present	93-84-5	C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)N2	{32: 2, 25: 1, 38: 1, 14: 3}
Did not match all atoms present	93-85-6	C1=CC2=C(C=C1C(=O)O)SC(=N2)N	{35: 1, 27: 1, 30: 1, 14: 3, 41: 1}
Did not match all atoms present	93-89-0	CCOC(=O)C1=CC=CC=C1	{1: 1, 2: 1, 28: 1, 14: 5}
Did not match all atoms present	93-90-3	CN(CCO)C1=CC=CC=C1	{1: 1, 2: 2, 20: 1, 14: 5, 33: 1}
Did not match all atoms present	93-91-4	CC(=O)CC(=O)C1=CC=CC=C1	{24: 2, 1: 1, 2: 1, 14: 5}
Did not match all atoms present	93-92-5	CC(C1=CC=CC=C1)OC(=O)C	{1: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	93-94-7	CCOC(=O)CC(=O)C1=CC=C(C=C1)C(=O)CC(=O)OCC	{24: 2, 1: 2, 2: 4, 28: 2, 14: 4}
Did not match all atoms present	93-96-9	CC(C1=CC=CC=C1)OC(C)C2=CC=CC=C2	{1: 2, 3: 2, 22: 1, 14: 10}
Did not match all atoms present	93-97-0	C1=CC=C(C=C1)C(=O)OC(=O)C2=CC=CC=C2	{28: 2, 14: 10}
Did not match all atoms present	93-98-1	C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2	{24: 1, 14: 10, 31: 1}
Did not match all atoms present	93-99-2	C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2	{28: 1, 14: 10}
Did not match all atoms present	930-27-8	CC1=COC=C1	{1: 1, 14: 3, 23: 1}
Did not match all atoms present	930-35-8	C1=CSC(=S)S1	{41: 2, 14: 2}
Did not match all atoms present	930-62-1	CC1=CN=C(N1)C	{32: 1, 1: 2, 35: 1, 14: 1}
Did not match all atoms present	930-63-2	CC1=NC(=O)NN1	{32: 2, 1: 1, 35: 1, 25: 1}
Did not match all atoms present	930-69-8	C1=CC=C(C=C1)[S-].[Na+]	{14: 5}
Did not match all atoms present	930-81-4	[Li+].C1C[C-]2CCC1C2	{11: 5, 12: 1, 15: 1}
Did not match all atoms present	930-87-0	CC1=CC=C(N1C)C	{1: 3, 14: 2, 33: 1}
Did not match all atoms present	93014-31-4	C1=CC=C(C=C1)/C=C/COC(=O)NC2=CC=CC=C2[N+](=O)[O-]	{2: 1, 6: 2, 38: 1, 14: 9, 28: 1, 31: 1}
Did not match all atoms present	93023-34-8	CCC1=CC=CC=C1N=NC2=CC=C(C=C2)N(C)C	{1: 3, 2: 1, 34: 2, 14: 8, 33: 1}
Did not match all atoms present	93071-75-1	C1=CC(=CC(=C1)OC(F)(F)F)CN	{2: 1, 4: 1, 14: 4, 16: 3, 22: 1, 30: 1}
Did not match all atoms present	93088-18-7	COC1=C(C=C(C=C1)CN2CCNCC2)OC.Cl.Cl	{32: 1, 1: 2, 2: 1, 33: 1, 11: 4, 14: 3, 17: 2, 22: 2}
Did not match all atoms present	931-07-7	C1=C(C=NS1)[N+](=O)[O-]	{41: 1, 35: 1, 38: 1, 14: 2}
Did not match all atoms present	931-19-1	CC1=CC=CC=[N+]1[O-]	{1: 1, 29: 1, 14: 4, 33: 1}
Did not match all atoms present	931-36-2	CCC1=NC=C(N1)C	{32: 1, 1: 2, 2: 1, 35: 1, 14: 1}
Did not match all atoms present	931-40-8	C1C(OC(=O)O1)CO	{20: 1, 2: 1, 11: 1, 12: 1}
Did not match all atoms present	931-51-1	C1CC[CH-]CC1.[Mg+2].[Cl-]	{17: 1, 11: 5, 14: 1}
Did not match all atoms present	931-53-3	[C-]#[N+]C1CCCCC1	{34: 1, 11: 5, 12: 1}
Did not match all atoms present	931-54-4	[C-]#[N+]C1=CC=CC=C1	{34: 1, 14: 5}
Did not match all atoms present	931-63-5	COC1=NC=CC=N1	{1: 1, 35: 2, 22: 1, 14: 3}
Did not match all atoms present	931-86-2	C1=NC(=O)NC(=N1)N	{32: 1, 25: 1, 35: 2, 30: 1, 14: 1}
Did not match all atoms present	93102-05-7	COCN(CC1=CC=CC=C1)C[Si](C)(C)C	{1: 4, 2: 3, 22: 1, 14: 5, 33: 1}
Did not match all atoms present	93113-98-5	CN(C)C(=S)SCCN.Br	{1: 2, 2: 2, 33: 1, 40: 1, 7: 1, 18: 1, 30: 1}
Did not match all atoms present	93168-42-4	C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Lu+3].[Lu+3]	{24: 6}
Did not match all atoms present	932-16-1	CC(=O)C1=CC=CN1C	{24: 1, 1: 2, 14: 3, 33: 1}
Did not match all atoms present	932-32-1	CNC1=CC=CC=C1Cl	{1: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	932-49-0	C1CN(C(=S)N1)CCO	{32: 1, 33: 1, 2: 2, 11: 2, 15: 1, 20: 1}
Did not match all atoms present	932-52-5	C1=C(C(=O)NC(=O)N1)N	{32: 2, 25: 2, 30: 1, 14: 1}
Did not match all atoms present	932-53-6	CC1=NNC(=O)NC1=O	{32: 2, 1: 1, 35: 1, 25: 2}
Did not match all atoms present	932-62-7	CC(=O)C1=CN(C=C1)C	{24: 1, 1: 2, 14: 3, 33: 1}
Did not match all atoms present	932-64-9	C1(=NC(=O)NN1)[N+](=O)[O-]	{32: 2, 25: 1, 35: 1, 38: 1}
Did not match all atoms present	932-69-4	C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Co+2]	{24: 2, 14: 10}
Did not match all atoms present	932-77-4	C1=CC(=CC(=C1)Br)CCl	{17: 1, 2: 1, 18: 1, 14: 4}
Did not match all atoms present	932-87-6	C1=CC=C(C=C1)C#CBr	{10: 2, 18: 1, 14: 5}
Did not match all atoms present	932-88-7	C1=CC=C(C=C1)C#CI	{10: 2, 19: 1, 14: 5}
Did not match all atoms present	932-90-1	C1=CC=C(C=C1)C=NO	{34: 1, 20: 1, 14: 5, 6: 1}
Did not match all atoms present	932-95-6	C1=C(SC(=C1)C=O)C=O	{41: 1, 26: 2, 14: 2}
Did not match all atoms present	932-96-7	CNC1=CC=C(C=C1)Cl	{1: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	932-98-9	C1=CC(=CC=C1N=O)Cl	{17: 1, 34: 1, 29: 1, 14: 4}
Did not match all atoms present	93204-36-5	COC(=O)[C@@H](CO)NC(=O)OCC1=CC=CC=C1	{1: 1, 2: 2, 3: 1, 14: 5, 20: 1, 28: 2, 31: 1}
Did not match all atoms present	93215-63-5	[2H]C([2H])([2H])C#CC#N	{1: 1, 10: 2, 37: 1}
Did not match all atoms present	93247-79-1	CN(C)C=CC1=C(C(=CC=C1)C(=O)OC)[N+](=O)[O-]	{1: 3, 6: 2, 38: 1, 33: 1, 14: 3, 28: 1}
Did not match all atoms present	93249-62-8	C1=CC(=C(C=C1OC(F)(F)F)C=O)O	{4: 1, 14: 3, 16: 3, 21: 1, 22: 1, 26: 1}
Did not match all atoms present	93251-89-9	C1CC2=C3C(=CC=C2)CCCN3C1.Cl[Pt]Cl	{17: 2, 11: 6, 14: 3, 33: 1}
Did not match all atoms present	93286-22-7	C1=CC(=C(C=C1F)Cl)CCl	{16: 1, 17: 2, 2: 1, 14: 3}
Did not match all atoms present	933-18-6	B1(NB(NB(N1)Cl)Cl)Cl	{32: 3, 17: 3}
Did not match all atoms present	933-67-5	CC1=CC=CC2=C1NC=C2	{32: 1, 1: 1, 14: 5}
Did not match all atoms present	933-69-7	CC1=CC=CC2=NC=CN12	{1: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	933-75-5	C1=CC(=C(C(=C1Cl)O)Cl)Cl	{17: 3, 21: 1, 14: 2}
Did not match all atoms present	933-76-6	CN1C(=O)C(=C(C=N1)Cl)Cl	{1: 1, 35: 1, 33: 1, 14: 1, 17: 2, 25: 1}
Did not match all atoms present	933-78-8	C1=C(C=C(C(=C1Cl)Cl)O)Cl	{17: 3, 21: 1, 14: 2}
Did not match all atoms present	933-88-0	CC1=CC=CC=C1C(=O)Cl	{24: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	933-98-2	CCC1=CC=CC(=C1C)C	{1: 3, 2: 1, 14: 3}
Did not match all atoms present	93343-10-3	COC1=CC(=CC(=C1)F)F	{16: 2, 1: 1, 22: 1, 14: 3}
Did not match all atoms present	93343-11-4	CC1=C(C=C(C=C1F)F)F	{16: 3, 1: 1, 14: 2}
Did not match all atoms present	93379-36-3	CC(=C)C(=O)O.C=C.C1CCC(=O)[N-]CC1.[Na+]	{1: 1, 35: 1, 5: 3, 7: 1, 11: 5, 25: 1, 27: 1}
Did not match all atoms present	93379-48-7	CC1(O[C@H]([C@@H](O1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C	{1: 2, 4: 2, 12: 2, 13: 1, 14: 20, 20: 2, 23: 2}
Did not match all atoms present	934-00-9	COC1=CC=CC(=C1O)O	{1: 1, 22: 1, 21: 2, 14: 3}
Did not match all atoms present	934-31-6	C(#N)C1=C(SC(=O)S1)C#N	{25: 1, 37: 2, 41: 2}
Did not match all atoms present	934-32-7	C1=CC=C2C(=C1)NC(=N2)N	{32: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	934-34-9	C1=CC=C2C(=C1)NC(=O)S2	{32: 1, 25: 1, 14: 4, 41: 1}
Did not match all atoms present	934-37-2	CC1=CN2C=CC=CC2=N1	{1: 1, 35: 1, 14: 5, 33: 1}
Did not match all atoms present	934-48-5	CC1=CC(=NN1C(=O)N)C	{1: 2, 35: 1, 33: 1, 14: 1, 24: 1, 30: 1}
Did not match all atoms present	934-53-2	CC(C)(C1=CC=CC=C1)Cl	{1: 2, 4: 1, 14: 5, 17: 1}
Did not match all atoms present	934-56-5	C[Sn](C)(C)C1=CC=CC=C1	{1: 3, 14: 5}
Did not match all atoms present	934-60-1	CC1=CC=CC(=N1)C(=O)O	{1: 1, 27: 1, 14: 3, 35: 1}
Did not match all atoms present	934-72-5	CC1=CC=C(C=C1)S(=O)C	{1: 2, 29: 1, 14: 4}
Did not match all atoms present	934-73-6	CS(=O)C1=CC=C(C=C1)Cl	{1: 1, 29: 1, 14: 4, 17: 1}
Did not match all atoms present	934-74-7	CCC1=CC(=CC(=C1)C)C	{1: 3, 2: 1, 14: 3}
Did not match all atoms present	934-80-5	CCC1=CC(=C(C=C1)C)C	{1: 3, 2: 1, 14: 3}
Did not match all atoms present	934-87-2	CC(=O)SC1=CC=CC=C1	{24: 1, 1: 1, 14: 5, 40: 1}
Did not match all atoms present	93401-23-1	[OH-].[K+].[K+]	{}
Did not match all atoms present	93405-68-6	CC[NH+](CC)CC(CN1C2=CC(=C(C=C2N=C3C1=NC(=O)NC3=O)Cl)Cl)O.OS(=O)(=O)[O-]	{32: 1, 1: 2, 2: 4, 3: 1, 33: 1, 14: 2, 17: 2, 35: 2, 20: 2, 25: 2, 29: 3}
Did not match all atoms present	93407-11-5	CN(C)CC(C(=O)C1=CC=CC=C1)OC2=CC=CC=C2.Cl	{1: 2, 2: 1, 3: 1, 33: 1, 14: 10, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	93440-84-7	FSSS(F)(F)F	{16: 4, 40: 2}
Did not match all atoms present	93457-06-8	CC(=O)CC1=C(C=CC=C1Cl)Cl	{24: 1, 1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	93457-07-9	CC(=O)CC1=C(C=C(C=C1)Cl)Cl	{24: 1, 1: 1, 2: 1, 14: 3, 17: 2}
Did not match all atoms present	93480-02-5	C1=CC(=C(C=C1/C(=C/2\C=C(C(=O)C=C2)C(=O)O)/C3=CC(=C(C=C3)[O-])C(=O)[O-])C(=O)O)[O-].C1=CC(=C(C=C1/C(=C/2\C=C(C(=O)C=C2)C(=O)O)/C3=CC(=C(C=C3)[O-])C(=O)[O-])C(=O)O)[O-].[Ca+2].[Ca+2].[Ca+2]	{7: 2, 14: 18, 15: 4, 24: 2, 25: 2, 27: 4}
Did not match all atoms present	93480-03-6	CCCC1=CC=C(C=C1)C=NN	{1: 1, 34: 1, 6: 1, 2: 2, 14: 4, 30: 1}
Did not match all atoms present	93480-04-7	CCCCC1=CC=C(C=C1)C=NN	{1: 1, 34: 1, 6: 1, 2: 3, 14: 4, 30: 1}
Did not match all atoms present	93480-05-8	CC(=NN)C1=CC=C(C=C1)C#N	{1: 1, 34: 1, 37: 1, 7: 1, 14: 4, 30: 1}
Did not match all atoms present	93480-06-9	CC(=NN)C1=CC=C(C=C1)F	{1: 1, 34: 1, 7: 1, 14: 4, 16: 1, 30: 1}
Did not match all atoms present	935-02-4	C1=CC=C(C=C1)C#CC#N	{10: 2, 37: 1, 14: 5}
Did not match all atoms present	935-05-7	C1=CC=C(C=C1)CON=O	{2: 1, 34: 1, 22: 1, 14: 5, 29: 1}
Did not match all atoms present	935-07-9	C/C=N/NC1=CC=CC=C1	{1: 1, 34: 1, 14: 5, 6: 1, 31: 1}
Did not match all atoms present	935-13-7	C1=COC(=C1)CCC(=O)O	{2: 2, 27: 1, 14: 3, 23: 1}
Did not match all atoms present	935-14-8	C#CC1=CC=C(C=C1)C#C	{9: 2, 10: 2, 14: 4}
Did not match all atoms present	935-28-4	CCC1=NC(=CC=C1)CC	{1: 2, 2: 2, 35: 1, 14: 3}
Did not match all atoms present	935-44-4	C1CC1(C#N)C2=CC=CC=C2	{11: 2, 13: 1, 14: 5, 37: 1}
Did not match all atoms present	935-64-8	C1CC(C1)(C2=CC=CC=C2)O	{11: 3, 20: 1, 13: 1, 14: 5}
Did not match all atoms present	935-67-1	CC(C)(C1=CC=CC=C1)OC	{1: 3, 4: 1, 22: 1, 14: 5}
Did not match all atoms present	935-69-3	CN1C=NC2=C1C(=NC=N2)N	{1: 1, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	935-95-5	C1=C(C(=C(C(=C1Cl)Cl)O)Cl)Cl	{17: 4, 21: 1, 14: 1}
Did not match all atoms present	93514-82-0	CCOC(=O)C1=CNC2=CC(=CC(=C2C1=O)Cl)Cl	{32: 1, 1: 1, 2: 1, 14: 3, 17: 2, 25: 1, 28: 1}
Did not match all atoms present	93517-71-6	CC1=NC=C(C(=S)N1C=C)O	{1: 1, 35: 1, 5: 1, 6: 1, 33: 1, 14: 1, 21: 1}
Did not match all atoms present	93556-88-8	[B-](F)(F)(F)F.CC#N.CC#N.CC#N.CC#N.[Ag+]	{16: 4, 1: 4, 37: 4}
Did not match all atoms present	93573-36-5	CCCCCCCCCCCCCOP(=O)(OCCCCCCCCCC)OCCCCCCCCCC	{1: 3, 2: 30, 29: 1, 22: 3}
Did not match all atoms present	936-02-7	C1=CC=C(C(=C1)C(=O)NN)O	{24: 1, 30: 1, 21: 1, 14: 4, 31: 1}
Did not match all atoms present	936-05-0	CN1C(=CN=C1CO)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 14: 1, 20: 1}
Did not match all atoms present	936-12-9	CCOC(=O)C1=C(NC=C1)C	{32: 1, 1: 2, 2: 1, 28: 1, 14: 2}
Did not match all atoms present	936-46-9	C1=CC=C(C=C1)C2=CSN=C2	{41: 1, 35: 1, 14: 7}
Did not match all atoms present	936-49-2	C1CN=C(N1)C2=CC=CC=C2	{32: 1, 35: 1, 11: 2, 14: 5, 15: 1}
Did not match all atoms present	936-51-6	C1COC(O1)C2=CC=CC=C2	{11: 2, 12: 1, 14: 5, 23: 2}
Did not match all atoms present	936-53-8	C1CN(N=C1)C2=CC=CC=C2	{33: 1, 11: 2, 14: 6, 35: 1}
Did not match all atoms present	936-58-3	C=CCC(C1=CC=CC=C1)O	{2: 1, 3: 1, 5: 1, 6: 1, 14: 5, 20: 1}
Did not match all atoms present	936-59-4	C1=CC=C(C=C1)C(=O)CCCl	{24: 1, 17: 1, 2: 2, 14: 5}
Did not match all atoms present	936-72-1	CC1=CC=CC=C1OCC=C	{1: 1, 2: 1, 5: 1, 6: 1, 14: 4, 22: 1}
Did not match all atoms present	936-89-0	CCC1=CC(=C(C=C1)O)CC	{1: 2, 2: 2, 21: 1, 14: 3}
Did not match all atoms present	93638-55-2	C1CS(=O)(=O)C2C1CC=CC2	{11: 4, 12: 2, 29: 2, 14: 2}
Did not match all atoms present	93654-97-8	C1=CC=C2C(=C1)C=CC=C2C3=CC=CC=C3CC(=O)O	{2: 1, 27: 1, 14: 11}
Did not match all atoms present	93673-39-3	C1=CC2=CC3=C(C=CC4=C3C=CC=C4O)C5=C2C(=C1)C=C5	{21: 1, 14: 11}
Did not match all atoms present	93680-80-9	CC(=O)OC1=COC2=CC=CC=C21	{1: 1, 28: 1, 14: 5, 23: 1}
Did not match all atoms present	93689-94-2	CC(=O)NC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)[O-].[Na+]	{24: 1, 1: 1, 29: 3, 14: 6, 31: 1}
Did not match all atoms present	93690-11-0	C1=CC(=CC(=C1)[N+](=O)[O-])C=C(C#N)C(=S)N	{37: 1, 38: 1, 7: 2, 14: 4, 6: 1, 30: 1}
Did not match all atoms present	937-00-8	C1=CC(=CC(=C1)S)C(F)(F)F	{16: 3, 4: 1, 14: 4, 39: 1}
Did not match all atoms present	937-14-4	C1=CC(=CC(=C1)Cl)C(=O)OO	{17: 1, 20: 1, 14: 4, 28: 1}
Did not match all atoms present	937-20-2	C1=CC(=CC=C1C(=O)CCl)Cl	{24: 1, 17: 2, 2: 1, 14: 4}
Did not match all atoms present	937-25-7	CN(C1=CC=C(C=C1)F)N=O	{1: 1, 34: 1, 33: 1, 14: 4, 16: 1, 29: 1}
Did not match all atoms present	937-30-4	CCC1=CC=C(C=C1)C(=O)C	{24: 1, 1: 2, 2: 1, 14: 4}
Did not match all atoms present	937-31-5	C#CC1=CC=C(C=C1)[N+](=O)[O-]	{9: 1, 10: 1, 38: 1, 14: 4}
Did not match all atoms present	937-32-6	C1=CC(=CC=C1[N+](=O)[O-])SCl	{40: 1, 17: 1, 38: 1, 14: 4}
Did not match all atoms present	937-33-7	CC(C)(C)NC1=CC=CC=C1	{1: 3, 4: 1, 14: 5, 31: 1}
Did not match all atoms present	937-39-3	C1=CC=C(C=C1)CC(=O)NN	{24: 1, 2: 1, 30: 1, 14: 5, 31: 1}
Did not match all atoms present	937-40-6	CN(CC1=CC=CC=C1)N=O	{1: 1, 2: 1, 33: 1, 34: 1, 14: 5, 29: 1}
Did not match all atoms present	937-41-7	C=CC(=O)OC1=CC=CC=C1	{14: 5, 28: 1, 5: 1, 6: 1}
Did not match all atoms present	937-52-0	C[C@H](CCC1=CC=CC=C1)N	{1: 1, 2: 2, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	937-54-2	CC(C)OCC1=CC=CC=C1	{1: 2, 2: 1, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	937-62-2	CC1=CC=C(C=C1)OC(=O)Cl	{1: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	937-63-3	CC1=CC=C(C=C1)OC(=S)Cl	{1: 1, 17: 1, 22: 1, 14: 4, 7: 1}
Did not match all atoms present	937-64-4	C1=CC(=CC=C1OC(=S)Cl)Cl	{17: 2, 22: 1, 14: 4, 7: 1}
Did not match all atoms present	93777-17-4	CCCCCCCC(=O)OC1=CC=C(C=C1)C#N	{1: 1, 2: 6, 28: 1, 37: 1, 14: 4}
Did not match all atoms present	93777-26-5	C1=CC(=C(C=C1Br)C=O)F	{16: 1, 18: 1, 26: 1, 14: 3}
Did not match all atoms present	93780-95-1	C1=CC=C2C(=C1)C=CC3=CC4=C(C5=C(C=C4)[C@H]([C@@H]([C@H]6[C@@H]5O6)O)O)N=C32	{20: 2, 35: 1, 12: 4, 14: 9, 23: 1}
Did not match all atoms present	93780-98-4	C1=CC=C2C(=C1)C=CC3=CC4=C(C5=C(C=C4)[C@H]([C@@H]([C@@H]6[C@H]5O6)O)O)N=C32	{20: 2, 35: 1, 12: 4, 14: 9, 23: 1}
Did not match all atoms present	93793-83-0	CC(=O)OCC(=O)NCCCOC1=CC=CC(=C1)CN2CCCCC2.Cl	{1: 1, 2: 5, 33: 1, 11: 5, 14: 4, 17: 1, 22: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	93798-26-6	CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C[C@H](C)CC	{1: 3, 2: 9, 3: 1, 28: 1, 14: 12}
Did not match all atoms present	938-09-0	C1=CC=C(C=C1)S(=O)(=O)CCCl	{17: 1, 2: 2, 29: 2, 14: 5}
Did not match all atoms present	938-10-3	C1=CC=C(C=C1)S(=O)(=O)N=[N+]=[N-]	{34: 2, 29: 2, 14: 5}
Did not match all atoms present	938-16-9	CC(C)(C)C(=O)C1=CC=CC=C1	{24: 1, 1: 3, 4: 1, 14: 5}
Did not match all atoms present	938-18-1	CC1=CC(=C(C(=C1)C)C(=O)Cl)C	{24: 1, 1: 3, 14: 2, 17: 1}
Did not match all atoms present	938-22-7	COC1=C(C(=C(C=C1Cl)Cl)Cl)Cl	{1: 1, 22: 1, 14: 1, 17: 4}
Did not match all atoms present	938-24-9	C1=CC=C2C(=C1)C(=O)C(=O)C2=O	{25: 3, 14: 4}
Did not match all atoms present	938-25-0	C1=CC=C2C(=C1)C=CC(=C2N)N	{30: 2, 14: 6}
Did not match all atoms present	938-33-0	COC1=CC=CC2=C1N=CC=C2	{1: 1, 35: 1, 22: 1, 14: 6}
Did not match all atoms present	938-39-6	C1=CC=C2C(=C1)C(=CC(=O)N2)Br	{32: 1, 25: 1, 18: 1, 14: 5}
Did not match all atoms present	938-45-4	CCC(=O)C1=C(C=CC(=C1)C)O	{24: 1, 1: 2, 2: 1, 21: 1, 14: 3}
Did not match all atoms present	938-46-5	CCC(=O)C1=C(C=CC(=C1)O)O	{24: 1, 1: 1, 2: 1, 21: 2, 14: 3}
Did not match all atoms present	938-55-6	CN(C)C1=NC=NC2=C1NC=N2	{32: 1, 1: 2, 35: 3, 14: 2, 33: 1}
Did not match all atoms present	938-71-6	C1=CC(=C(C=C1Cl)[N+](=O)[O-])CCl	{17: 2, 2: 1, 38: 1, 14: 3}
Did not match all atoms present	938-73-8	CCOC1=CC=CC=C1C(=O)N	{1: 1, 2: 1, 14: 4, 22: 1, 24: 1, 30: 1}
Did not match all atoms present	938-79-4	CC[C@H](C1=CC=CC=C1)C(=O)O	{27: 1, 1: 1, 2: 1, 3: 1, 14: 5}
Did not match all atoms present	938-81-8	CC(=O)N(C1=CC=CC=C1)N=O	{1: 1, 34: 1, 33: 1, 14: 5, 24: 1, 29: 1}
Did not match all atoms present	938-86-3	COC1=CC(=C(C(=C1Cl)Cl)Cl)Cl	{1: 1, 22: 1, 14: 1, 17: 4}
Did not match all atoms present	938-91-0	CNC(=O)N(C)C1=CC=CC=C1	{24: 1, 1: 2, 33: 1, 14: 5, 31: 1}
Did not match all atoms present	938-94-3	CC1=CC=C(C=C1)C(C)C(=O)O	{27: 1, 1: 2, 3: 1, 14: 4}
Did not match all atoms present	938-95-4	CC(C1=CC=C(C=C1)Cl)C(=O)O	{27: 1, 1: 1, 3: 1, 14: 4, 17: 1}
Did not match all atoms present	938-96-5	CC(C1=CC=C(C=C1)O)C(=O)O	{27: 1, 1: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	93804-29-6	CCCCCCCC[Si](C)(C)OC	{1: 4, 2: 7, 22: 1}
Did not match all atoms present	93814-57-4	CCCCCCCCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 9, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	93822-01-6	CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].CCO[Si](C)(C)OCC.[Ti+4]	{1: 8, 2: 14, 29: 4, 22: 2}
Did not match all atoms present	93839-16-8	CC(=O)CC1=C(C=CC=C1Cl)F	{1: 1, 2: 1, 14: 3, 16: 1, 17: 1, 24: 1}
Did not match all atoms present	93858-50-5	CCCCC(CC)COC(=O)C[S-].CCCCC(CC)COC(=O)C[S-].[Cd+2]	{1: 4, 2: 12, 3: 2, 28: 2}
Did not match all atoms present	93858-64-1	CC1=CC=CC=C1CO[C@@H]2C[C@]3(CC[C@@]2(O3)C)C(C)C	{1: 4, 2: 1, 3: 1, 11: 3, 12: 1, 13: 2, 14: 4, 22: 1, 23: 1}
Did not match all atoms present	93870-58-7	CC1=C(C2=CC=CC=C2C=C1)C3=CC=CC=C3C	{1: 2, 14: 10}
Did not match all atoms present	93893-03-9	C1=CC=C(C=C1)S(=O)(=O)O.C(CO)N	{2: 2, 30: 1, 20: 2, 29: 2, 14: 5}
Did not match all atoms present	93894-08-7	CCCCCCCCCC1=CC=C(C=C1)[O-].CCCCCCCCCC1=CC=C(C=C1)[O-].[Cd+2]	{1: 2, 2: 16, 14: 8}
Did not match all atoms present	939-06-0	CC1CN=C(N1)C2=CC=CC=C2	{32: 1, 1: 1, 35: 1, 11: 1, 12: 1, 14: 5, 15: 1}
Did not match all atoms present	939-23-1	C1=CC=C(C=C1)C2=CC=NC=C2	{35: 1, 14: 9}
Did not match all atoms present	939-26-4	C1=CC=C2C=C(C=CC2=C1)CBr	{2: 1, 18: 1, 14: 7}
Did not match all atoms present	939-27-5	CCC1=CC2=CC=CC=C2C=C1	{1: 1, 2: 1, 14: 7}
Did not match all atoms present	939-48-0	CC(C)OC(=O)C1=CC=CC=C1	{1: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	939-52-6	C1=CC=C(C=C1)C(=O)CCCCl	{24: 1, 17: 1, 2: 3, 14: 5}
Did not match all atoms present	939-54-8	C1=CC=C(C=C1)C(=O)OCCBr	{2: 2, 28: 1, 18: 1, 14: 5}
Did not match all atoms present	939-55-9	C1=CC=C(C=C1)C(=O)OCCCl	{17: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	939-57-1	CC1=CC=CC=C1C=CC(=O)O	{1: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	939-80-0	C1=CC(=C(C=C1C#N)[N+](=O)[O-])Cl	{17: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	939-83-3	CC1=C(C=C(C=C1)[N+](=O)[O-])C#N	{1: 1, 38: 1, 37: 1, 14: 3}
Did not match all atoms present	939-87-7	C1[C@H]([C@@H]1C(=O)Cl)C2=CC=CC=C2	{24: 1, 17: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	939-90-2	C1[C@H]([C@@H]1C(=O)O)C2=CC=CC=C2	{27: 1, 11: 1, 12: 2, 14: 5}
Did not match all atoms present	939-97-9	CC(C)(C)C1=CC=C(C=C1)C=O	{1: 3, 26: 1, 4: 1, 14: 4}
Did not match all atoms present	939-98-0	[2H]C([2H])([2H])C1=CC=C(C=C1)CC	{1: 2, 2: 1, 14: 4}
Did not match all atoms present	939-99-1	C1=CC(=CC=C1CCl)C(F)(F)F	{16: 3, 17: 1, 2: 1, 4: 1, 14: 4}
Did not match all atoms present	93905-46-5	C1=CC=C(C=C1)C(=O)OCCOCCO.C1=CC(=O)OC1=O	{28: 3, 2: 4, 20: 1, 22: 1, 14: 7}
Did not match all atoms present	93905-75-0	CCCCN1C=NC2=C1NC(=NC2=O)N	{32: 1, 1: 1, 2: 3, 35: 2, 33: 1, 14: 1, 25: 1, 30: 1}
Did not match all atoms present	93917-68-1	CCOC(=O)COC1=CC=CC=C1C	{1: 2, 2: 2, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	93919-56-3	C1=CC(=CC=C1CN)OC(F)(F)F	{2: 1, 4: 1, 14: 4, 16: 3, 22: 1, 30: 1}
Did not match all atoms present	93939-74-3	C1=CC(=CC=C1[C@H](C(=O)O)N)F	{16: 1, 27: 1, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	93940-13-7	C1=CC=C\2C(=C1)C=CC(=O)/C2=N\NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(/C(=N\NC5=CC(=CC(=C5O)[N+](=O)[O-])S(=O)(=O)[O-])/C4=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{34: 2, 38: 1, 14: 11, 15: 3, 21: 1, 25: 2, 29: 9, 31: 2}
Did not match all atoms present	93952-57-9	CC1=C(C(=O)N(N1)C2=CC=C(C=C2)S(=O)(=O)O)/C=C\3/C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)O)C.[K+].[K+].[K+]	{32: 1, 1: 2, 35: 1, 6: 1, 33: 2, 14: 8, 15: 2, 20: 2, 25: 2, 29: 4}
Did not match all atoms present	93964-23-9	CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC3=CC=CC=C3C=C2[O-].[Na+]	{1: 2, 14: 8, 17: 1, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	93964-25-1	CC1=C(C=CC(=C1)OC)NC(=O)C2=C(C=C3C(=C2)C=CC4=C3NC5=CC=CC=C45)[O-].[Na+]	{32: 1, 1: 2, 14: 11, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	93966-92-8	C1=CC(=C(C=C1C2=CC(=C(C=C2)N/N=C/3\C(=O)C4=C(C=C3S(=O)(=O)O)C=C(C=C4)S(=O)(=O)O)O)O)N/N=C/5\C(=O)C6=C(C=C5S(=O)(=O)O)C=C(C=C6)S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+].[Cu].[Cu]	{34: 2, 14: 14, 15: 4, 20: 4, 21: 2, 25: 2, 29: 8, 31: 2}
Did not match all atoms present	93982-25-3	COC1=CC=CC=C1[NH3+].[N+](=O)([O-])[O-]	{1: 1, 22: 1, 14: 4}
Did not match all atoms present	93999-89-4	CCCCCCCCCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 10, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	94-01-9	C1=CC=C(C=C1)C(=O)OC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3	{28: 2, 14: 14}
Did not match all atoms present	94-02-0	CCOC(=O)CC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 2, 28: 1, 14: 5}
Did not match all atoms present	94-06-4	CCCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 2, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	94-07-5	CNCC(C1=CC=C(C=C1)O)O	{1: 1, 2: 1, 3: 1, 14: 4, 20: 1, 21: 1, 31: 1}
Did not match all atoms present	94-08-6	CCOC(=O)C1=CC=C(C=C1)C	{1: 2, 2: 1, 28: 1, 14: 4}
Did not match all atoms present	94-09-7	CCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 1, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	94-10-0	CCOC1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N	{1: 1, 34: 2, 2: 1, 14: 7, 22: 1, 30: 2}
Did not match all atoms present	94-11-1	CC(C)OC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 1, 3: 1, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	94-12-2	CCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 2, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	94-13-3	CCCOC(=O)C1=CC=C(C=C1)O	{1: 1, 2: 2, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	94-14-4	CC(C)COC(=O)C1=CC=C(C=C1)N	{1: 2, 2: 1, 3: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	94-15-5	CCN(CC)CC(C)(C)COC(=O)C1=CC=C(C=C1)N	{1: 4, 2: 4, 4: 1, 33: 1, 14: 4, 28: 1, 30: 1}
Did not match all atoms present	94-17-7	C1=CC(=CC=C1C(=O)OOC(=O)C2=CC=C(C=C2)Cl)Cl	{17: 2, 28: 2, 14: 8}
Did not match all atoms present	94-18-8	C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)O	{2: 1, 28: 1, 21: 1, 14: 9}
Did not match all atoms present	94-20-2	CCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)Cl	{1: 1, 2: 2, 14: 4, 17: 1, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	94-21-3	CN(CCC#N)C1=CC=C(C=C1)C=O	{1: 1, 2: 2, 37: 1, 33: 1, 14: 4, 26: 1}
Did not match all atoms present	94-24-6	CCCCNC1=CC=C(C=C1)C(=O)OCCN(C)C	{1: 3, 2: 5, 33: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	94-25-7	CCCCOC(=O)C1=CC=C(C=C1)N	{1: 1, 2: 3, 28: 1, 30: 1, 14: 4}
Did not match all atoms present	94-26-8	CCCCOC(=O)C1=CC=C(C=C1)O	{1: 1, 2: 3, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	94-30-4	CCOC(=O)C1=CC=C(C=C1)OC	{1: 2, 2: 1, 28: 1, 22: 1, 14: 4}
Did not match all atoms present	94-31-5	CN(CCCl)C1=CC=C(C=C1)C=O	{1: 1, 2: 2, 33: 1, 14: 4, 17: 1, 26: 1}
Did not match all atoms present	94-32-6	CCCCNC1=CC=C(C=C1)C(=O)OCC	{1: 2, 2: 4, 28: 1, 14: 4, 31: 1}
Did not match all atoms present	94-33-7	C1=CC=C(C=C1)C(=O)OCCO	{28: 1, 2: 2, 20: 1, 14: 5}
Did not match all atoms present	94-34-8	CN(CCC#N)C1=CC=CC=C1	{1: 1, 2: 2, 37: 1, 14: 5, 33: 1}
Did not match all atoms present	94-35-9	C1=CC=C(C=C1)C(COC(=O)N)O	{2: 1, 3: 1, 14: 5, 20: 1, 28: 1, 30: 1}
Did not match all atoms present	94-36-0	C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2	{28: 2, 14: 10}
Did not match all atoms present	94-37-1	C1CCN(CC1)C(=S)SSC(=S)N2CCCCC2	{40: 2, 33: 2, 11: 10, 7: 2}
Did not match all atoms present	94-41-7	C1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC=C2	{24: 1, 14: 10, 6: 2}
Did not match all atoms present	94-44-0	C1=CC=C(C=C1)COC(=O)C2=CN=CC=C2	{2: 1, 35: 1, 28: 1, 14: 9}
Did not match all atoms present	94-45-1	CCOC1=CC2=C(C=C1)N=C(S2)N	{1: 1, 2: 1, 35: 1, 41: 1, 14: 3, 22: 1, 30: 1}
Did not match all atoms present	94-46-2	CC(C)CCOC(=O)C1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 28: 1, 14: 5}
Did not match all atoms present	94-47-3	C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2	{2: 2, 28: 1, 14: 10}
Did not match all atoms present	94-48-4	CC(=CCCC(=CCOC(=O)C1=CC=CC=C1)C)C	{1: 3, 2: 3, 6: 2, 7: 2, 14: 5, 28: 1}
Did not match all atoms present	94-50-8	CCCCCCCCOC(=O)C1=CC=CC=C1	{1: 1, 2: 7, 28: 1, 14: 5}
Did not match all atoms present	94-52-0	C1=CC2=C(C=C1[N+](=O)[O-])NC=N2	{32: 1, 35: 1, 38: 1, 14: 4}
Did not match all atoms present	94-53-1	C1OC2=C(O1)C=C(C=C2)C(=O)O	{27: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	94-57-5	CC1=CC=CC=C1NCS(=O)(=O)O	{1: 1, 2: 1, 14: 4, 20: 1, 29: 2, 31: 1}
Did not match all atoms present	94-58-6	CCCC1=CC2=C(C=C1)OCO2	{1: 1, 2: 2, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	94-59-7	C=CCC1=CC2=C(C=C1)OCO2	{2: 1, 5: 1, 6: 1, 11: 1, 14: 3, 23: 2}
Did not match all atoms present	94-62-2	C1CCN(CC1)C(=O)/C=C/C=C/C2=CC3=C(C=C2)OCO3	{33: 1, 6: 4, 11: 6, 14: 3, 23: 2, 24: 1}
Did not match all atoms present	94-64-4	CNCC1=CC=CC=C1Cl	{1: 1, 2: 1, 31: 1, 14: 4, 17: 1}
Did not match all atoms present	94-68-8	CCNC1=CC=CC=C1C	{1: 2, 2: 1, 14: 4, 31: 1}
Did not match all atoms present	94-69-9	CC1=CC=CC=C1NC=O	{1: 1, 26: 1, 14: 4, 31: 1}
Did not match all atoms present	94-70-2	CCOC1=CC=CC=C1N	{1: 1, 2: 1, 30: 1, 22: 1, 14: 4}
Did not match all atoms present	94-71-3	CCOC1=CC=CC=C1O	{1: 1, 2: 1, 22: 1, 21: 1, 14: 4}
Did not match all atoms present	94-74-6	CC1=C(C=CC(=C1)Cl)OCC(=O)O	{1: 1, 2: 1, 14: 3, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	94-75-7	C1=CC(=C(C=C1Cl)Cl)OCC(=O)O	{17: 2, 2: 1, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	94-76-8	CC1=C(C=CC(=C1)Cl)SCC(=O)O	{1: 1, 2: 1, 40: 1, 14: 3, 17: 1, 27: 1}
Did not match all atoms present	94-78-0	C1=CC=C(C=C1)N=NC2=C(N=C(C=C2)N)N	{34: 2, 35: 1, 30: 2, 14: 7}
Did not match all atoms present	94-80-4	CCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl	{1: 1, 2: 4, 14: 3, 17: 2, 22: 1, 28: 1}
Did not match all atoms present	94-81-5	CC1=C(C=CC(=C1)Cl)OCCCC(=O)O	{1: 1, 2: 3, 14: 3, 17: 1, 22: 1, 27: 1}
Did not match all atoms present	94-82-6	C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)O	{17: 2, 2: 3, 27: 1, 22: 1, 14: 3}
Did not match all atoms present	94-83-7	C1=CC=C(C=C1)C(=O)OCCOC2=C(C=C(C=C2)Cl)Cl	{17: 2, 2: 2, 28: 1, 22: 1, 14: 8}
Did not match all atoms present	94-85-9	CCOC1=CC(=C(C=C1)OCC)N	{1: 2, 2: 2, 30: 1, 22: 2, 14: 3}
Did not match all atoms present	94-86-0	CCOC1=C(C=C(C=C1)C=CC)O	{1: 2, 2: 1, 6: 2, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	94-87-1	C1=CC=C(C(=C1)NCCO)Cl	{17: 1, 2: 2, 20: 1, 14: 4, 31: 1}
Did not match all atoms present	94-89-3	C1=CC=C(C(=C1)NCCC#N)Cl	{17: 1, 2: 2, 37: 1, 14: 4, 31: 1}
Did not match all atoms present	94-92-8	CC1=CC=CC=C1NCCNC2=CC=CC=C2C	{1: 2, 2: 2, 14: 8, 31: 2}
Did not match all atoms present	94-97-3	C1=CC2=NNN=C2C=C1Cl	{32: 1, 17: 1, 35: 2, 14: 3}
Did not match all atoms present	94-98-4	CC1=CC(=C(C=C1)CN)C	{1: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	94-99-5	C1=CC(=C(C=C1Cl)Cl)CCl	{17: 3, 2: 1, 14: 3}
Did not match all atoms present	940-14-7	C=COC1=CC=C(C=C1)[N+](=O)[O-]	{38: 1, 14: 4, 22: 1, 5: 1, 6: 1}
Did not match all atoms present	940-31-8	CC(C(=O)O)OC1=CC=CC=C1	{27: 1, 1: 1, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	940-36-3	COC(=O)NC1=CC=C(C=C1)Cl	{1: 1, 31: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	940-41-0	C1=CC=C(C=C1)CC[Si](Cl)(Cl)Cl	{17: 3, 2: 2, 14: 5}
Did not match all atoms present	940-49-8	CC(C)COCC1=CC=CC=C1	{1: 2, 2: 2, 3: 1, 22: 1, 14: 5}
Did not match all atoms present	940-50-1	C#C/C=C/C=C/C1=CC=CC=C1	{9: 1, 10: 1, 14: 5, 6: 4}
Did not match all atoms present	940-54-5	CCCC=NNC1=CC=CC=C1	{1: 1, 2: 2, 6: 1, 34: 1, 14: 5, 31: 1}
Did not match all atoms present	940-64-7	CC1=CC=C(C=C1)OCC(=O)O	{1: 1, 2: 1, 27: 1, 22: 1, 14: 4}
Did not match all atoms present	940-71-6	N1=P(N=P(N=P1(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 6, 35: 3}
Did not match all atoms present	940-73-8	[2H]C([2H])([2H])CC1=CC=C(C=C1)C	{1: 2, 2: 1, 14: 4}
Did not match all atoms present	940-76-1	C1=CC(=CC=C1F)SC(F)(F)F	{16: 4, 40: 1, 4: 1, 14: 4}
Did not match all atoms present	940-93-2	CC1=CC(=[O+]C(=C1)C)C.[O-]Cl(=O)(=O)=O	{1: 3, 23: 1, 29: 4, 14: 2, 17: 1}
Did not match all atoms present	94021-06-4	CC1=C(C(=C(C(=C1NC(=O)C2=CC(=NN=C2Cl)Cl)C)S(=O)(=O)[O-])C)NC3=CC(=C(C4=C3C(=O)C5=CC=CC=C5C4=O)N)S(=O)(=O)[O-].[Na+].[Na+]	{1: 3, 35: 2, 14: 6, 17: 2, 24: 1, 25: 2, 29: 6, 30: 1, 31: 2}
Did not match all atoms present	94021-08-6	C1=CC=C(C(=C1)N=NC2C(=NN(C2=O)C3=C(C=C(C=C3)NC4=NC(=NC(=N4)Cl)N(CCS(=O)(=O)CCCl)CCS(=O)(=O)CCCl)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{33: 2, 2: 8, 35: 4, 12: 1, 34: 2, 14: 7, 15: 1, 17: 3, 24: 1, 25: 1, 29: 10, 31: 1}
Did not match all atoms present	94021-09-7	CC1=C(C=C(C=C1N2C(=O)C(C(=N2)C(=O)[O-])N=NC3=CC=CC=C3S(=O)(=O)[O-])NC(=O)C4=CC(=NN=C4Cl)Cl)S(=O)(=O)[O-].[Na+].[Na+].[Na+]	{1: 1, 34: 2, 35: 3, 33: 1, 12: 1, 14: 7, 15: 1, 17: 2, 24: 2, 25: 1, 29: 6, 31: 1}
Did not match all atoms present	94022-57-8	CCCCCCCCC=CCCCCCCCCNCCC(=O)NCC1=CC=CC(=C1)CN	{1: 1, 2: 19, 6: 2, 14: 4, 24: 1, 30: 1, 31: 2}
Did not match all atoms present	94022-96-5	C1=CC=C(C(=C1)CCO)C(F)(F)F	{16: 3, 20: 1, 2: 2, 4: 1, 14: 4}
Did not match all atoms present	94031-30-8	CC(=C)C(=O)OCCN(C)C.CC(=C)C(=O)OCC[N+](C)(C)C.COS(=O)(=O)O	{1: 8, 2: 4, 5: 2, 7: 2, 20: 1, 22: 1, 33: 1, 28: 2, 29: 2}
Did not match all atoms present	94071-27-9	CCN(CCO)C1=CC(=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=C(C=C3)N(CC)CCO)C)C.[Cl-]	{1: 6, 2: 8, 33: 3, 7: 1, 14: 10, 15: 2, 17: 1, 20: 2}
Did not match all atoms present	94071-28-0	C1C(C2=CC=C1C=C2)N=C(C(C3=CC=CC=C3)C(=NC4CC5=CC=C4C=C5)OS(=O)(=O)C6=CC=CC=C6)OS(=O)(=O)C7=CC=CC=C7	{34: 2, 3: 1, 7: 2, 11: 2, 12: 2, 14: 23, 22: 2, 29: 4}
Did not match all atoms present	94079-71-7	C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].O.O.O.[Eu+3]	{16: 9, 24: 3, 4: 3}
Did not match all atoms present	94087-40-8	C1=CC(=C(C(=C1)Cl)F)C#N	{16: 1, 17: 1, 37: 1, 14: 3}
Did not match all atoms present	94088-46-7	COC1=C(C(=CC=C1)F)C#N	{16: 1, 1: 1, 22: 1, 14: 3, 37: 1}
Did not match all atoms present	94088-92-3	CC1(C(C12C=CC3=CC=CC=C23)C(=O)[O-])C.[Na+]	{24: 1, 1: 2, 12: 1, 13: 2, 14: 6}
Did not match all atoms present	94089-02-8	CC(C1=CC=CS1)S	{1: 1, 3: 1, 41: 1, 14: 3, 39: 1}
Did not match all atoms present	941-55-9	CC1=CC=C(C=C1)S(=O)(=O)[N-][N+]#N	{1: 1, 34: 2, 29: 2, 14: 4}
Did not match all atoms present	941-69-5	C1=CC=C(C=C1)N2C(=O)C=CC2=O	{25: 2, 14: 7, 33: 1}
Did not match all atoms present	941-81-1	CC1=CC(=C2C=CC=C2C(=C1)C)C	{1: 3, 14: 5}
Did not match all atoms present	941-98-0	CC(=O)C1=CC=CC2=CC=CC=C21	{24: 1, 1: 1, 14: 7}
Did not match all atoms present	94108-56-2	C1=CC(=CC=C1OC(F)(F)F)S(=O)(=O)Cl	{4: 1, 14: 4, 16: 3, 17: 1, 22: 1, 29: 2}
Did not match all atoms present	94110-08-4	C[NH+](C)CCOC(=O)C1=CC(=C(C=C1)Cl)N.[Cl-]	{1: 2, 2: 2, 14: 3, 17: 2, 28: 1, 30: 1}
Did not match all atoms present	94116-55-9	[Pb].[Bi]	{}
Did not match all atoms present	94133-90-1	CN(C)CCCN(CC(CS(=O)(=O)[O-])O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[Na+]	{1: 2, 2: 5, 3: 1, 4: 8, 33: 2, 16: 17, 20: 1, 29: 5}
Did not match all atoms present	94134-86-8	CCCCC1=CC(=C(C=C1)C)O	{1: 2, 2: 3, 21: 1, 14: 3}
Did not match all atoms present	94135-41-8	CCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)C	{1: 2, 2: 17, 14: 4}
Did not match all atoms present	94168-98-6	CCN(CC)/C(=N/N/C=C/1\C2=C(C3=C(C(=C4C(=C3C1=O)C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](/C=C/C=C(\C(=O)N2)/C)C)O)C)O)C)OC(=O)C)C)OC)C)C)O)O)/C	{32: 1, 1: 12, 2: 2, 34: 1, 33: 1, 6: 1, 7: 1, 12: 8, 13: 1, 14: 5, 15: 4, 20: 3, 21: 1, 22: 1, 23: 2, 25: 3, 28: 1, 31: 1}
Did not match all atoms present	94190-03-1	CC1=NC2=NNNC(=O)C2=N1	{32: 2, 1: 1, 35: 3, 25: 1}
Did not match all atoms present	942-01-8	C1CCC2=C(C1)C3=CC=CC=C3N2	{32: 1, 11: 4, 14: 4}
Did not match all atoms present	942-06-3	C1=C2C(=CC(=C1Cl)Cl)C(=O)OC2=O	{17: 2, 28: 2, 14: 2}
Did not match all atoms present	942-14-3	CC(C)OC(=O)C1=CC=CC=C1Cl	{1: 2, 3: 1, 28: 1, 14: 4, 17: 1}
Did not match all atoms present	942-24-5	COC(=O)C1=CNC2=CC=CC=C21	{32: 1, 1: 1, 28: 1, 14: 5}
Did not match all atoms present	942-31-4	C1=CC=C(C=C1)C2=C(N=C(S2)N)N.Cl	{17: 1, 35: 1, 30: 2, 14: 5, 41: 1}
Did not match all atoms present	942-92-7	CCCCCC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 2: 4, 14: 5}
Did not match all atoms present	94201-73-7	CC1CCOC(C1)C2=CC=CC=C2	{1: 1, 11: 3, 12: 2, 14: 5, 23: 1}
Did not match all atoms present	94213-53-3	CC1=CC(=C(C(=C1)S(=O)(=O)[O-])N=NC2=CC(=C(C=C2C)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC5=CC=CC=C5)S(=O)(=O)[O-])OC)C.C(CO)N(CCO)CCO.[Na+].[Na+]	{1: 4, 2: 6, 33: 1, 34: 3, 14: 13, 15: 2, 20: 3, 22: 1, 25: 1, 29: 6, 31: 2}
Did not match all atoms present	94213-68-0	C1OC2=C(O1)C3=C(C(=C2)C(=O)[O-])C(=CC4=CC=CC=C43)[N+](=O)[O-].[Na+]	{24: 1, 11: 1, 38: 1, 14: 6, 23: 2}
Did not match all atoms present	94214-52-5	CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)O[C@@H](CCCO)O	{1: 1, 2: 15, 3: 1, 14: 4, 20: 2, 28: 2}
Did not match all atoms present	94214-54-7	CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCOC2=CC=CC=C2	{1: 1, 2: 14, 28: 2, 22: 1, 14: 9}
Did not match all atoms present	94219-58-6	CCCCCCCC(N)P(=O)(O)O	{1: 1, 2: 6, 3: 1, 20: 2, 29: 1, 30: 1}
Did not match all atoms present	94230-83-8	CC1=C(C(=NN1CO)C)Br	{1: 2, 2: 1, 35: 1, 33: 1, 18: 1, 20: 1}
Did not match all atoms present	94236-80-3	CCCCC(CC)CNCC(CC)CCCC.CC1=NN(C(=O)C1N=NC2=CC=CC=C2)C3=C(C=CC(=C3)S(=O)(=O)O)Cl	{1: 5, 2: 10, 3: 2, 33: 1, 12: 1, 34: 2, 14: 8, 15: 1, 17: 1, 35: 1, 20: 1, 25: 1, 29: 2, 31: 1}
Did not match all atoms present	94237-49-7	CCNC1=CC=C(C=C1)NS(=O)(=O)C	{1: 2, 2: 1, 29: 2, 14: 4, 31: 2}
Did not match all atoms present	94247-63-9	CCCCCCCCCCCCCCC(C)C1=CC=CC2=CC=CC=C21	{1: 2, 2: 13, 3: 1, 14: 7}
Did not match all atoms present	94258-53-4	COC1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)/N=C\C3=CC=C(C=C3)OC	{1: 2, 34: 1, 6: 2, 33: 1, 41: 1, 14: 8, 15: 2, 22: 2, 25: 1}
Did not match all atoms present	94266-82-7	CCCCCCCCCCCCCCCCCCNC.C1CO1.C(C(=O)N)Cl.NS(=O)(=O)O	{1: 2, 2: 18, 11: 2, 17: 1, 20: 1, 23: 1, 24: 1, 29: 2, 30: 2, 31: 1}
Did not match all atoms present	94278-12-3	CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCC(=O)[O-]	{24: 1, 1: 1, 2: 24, 28: 1}
Did not match all atoms present	943-03-3	COC1=CC2=C(C=C1)N=C(S2)C#N	{1: 1, 35: 1, 37: 1, 41: 1, 14: 3, 22: 1}
Did not match all atoms present	943-14-6	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Br	{18: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	943-15-7	CC1=C(C=C(C=C1)C(C)C)[N+](=O)[O-]	{1: 3, 3: 1, 38: 1, 14: 3}
Did not match all atoms present	943-17-9	CCNCC(C1=CC(=CC=C1)O)O.Cl	{1: 1, 2: 2, 3: 1, 14: 4, 17: 1, 20: 1, 21: 1, 31: 1}
Did not match all atoms present	943-27-1	CC(=O)C1=CC=C(C=C1)C(C)(C)C	{24: 1, 1: 4, 4: 1, 14: 4}
Did not match all atoms present	943-39-5	C1=CC(=CC=C1C(=O)OO)[N+](=O)[O-]	{28: 1, 20: 1, 38: 1, 14: 4}
Did not match all atoms present	943-59-9	C1=CC=C(C=C1)CC(=O)OCCCl	{17: 1, 2: 3, 28: 1, 14: 5}
Did not match all atoms present	943-73-7	C1=CC=C(C=C1)CC[C@@H](C(=O)O)N	{27: 1, 2: 2, 3: 1, 30: 1, 14: 5}
Did not match all atoms present	943-88-4	CC(=O)C=CC1=CC=C(C=C1)OC	{24: 1, 1: 2, 22: 1, 14: 4, 6: 2}
Did not match all atoms present	943-89-5	COC1=CC=C(C=C1)C=CC(=O)O	{1: 1, 22: 1, 27: 1, 14: 4, 6: 2}
Did not match all atoms present	94334-59-5	C1=CC=C(C=C1)[N+]#N.C1=CC(=CC=C1C(=O)O)[N+]#N.C1=CC2=C(C=C(C=C2C=C1NC(=O)NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[NH4+]	{34: 2, 14: 19, 21: 2, 24: 1, 27: 1, 29: 6, 31: 2}
Did not match all atoms present	94350-17-1	N.N.N(=O)[O-].N(=O)[O-].[N+](=O)(O)[O-].[Pt+2]	{34: 2, 20: 1, 29: 4}
Did not match all atoms present	94350-18-2	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C(#N)Cl	{1: 2, 4: 1, 37: 1, 14: 8, 17: 1, 21: 2}
Did not match all atoms present	94361-06-5	CC(C1CC1)C(CN2C=NC=N2)(C3=CC=C(C=C3)Cl)O	{1: 1, 2: 1, 3: 1, 4: 1, 33: 1, 11: 2, 12: 1, 14: 6, 17: 1, 35: 2, 20: 1}
Did not match all atoms present	94373-85-0	CCCCCCCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 8, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	94383-67-2	C1CC2(CCC2(C1)C3=CC=CC=C3)C4=CC=CC=C4	{11: 5, 13: 2, 14: 10}
Did not match all atoms present	94397-44-1	C[Si](C)C1=CC=CC=C1.C[Sn](C)C	{1: 5, 14: 5}
Did not match all atoms present	94397-45-2	CC(C)(C)[Ge](C)(C)C1=CC=CC=C1	{1: 5, 4: 1, 14: 5}
Did not match all atoms present	94397-46-3	C[Ge](C)C1=CC=CC=C1.C[Sn](C)C	{1: 5, 14: 5}
Did not match all atoms present	94397-80-5	CC1=CC=C(C=C1)C(=C)[Si](C)(C)C	{1: 4, 5: 1, 14: 4, 7: 1}
Did not match all atoms present	944-22-9	CCOP(=S)(CC)SC1=CC=CC=C1	{40: 1, 1: 2, 2: 2, 22: 1, 14: 5}
Did not match all atoms present	944-61-6	COC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)OC	{1: 2, 22: 2, 17: 4}
Did not match all atoms present	944-73-0	CN1C2=C(C(=O)N(C1=O)C)NC(=O)N2	{32: 2, 1: 2, 33: 2, 25: 3}
Did not match all atoms present	944-78-5	COC1=C(C(=C(C(=C1Cl)Cl)OC)Cl)Cl	{1: 2, 22: 2, 17: 4}
Did not match all atoms present	944-85-4	C[Sn](C)(C)C1=CC=CC2=CC=CC=C21	{1: 3, 14: 7}
Did not match all atoms present	94432-01-6	CCCCCCCCCCCCOC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 11, 38: 1, 14: 4, 28: 1, 31: 1}
Did not match all atoms present	94441-92-6	CCCCC(CC)CN(CCC(=O)[O-])CCC(=O)[O-].[Na+].[Na+]	{24: 2, 1: 2, 2: 9, 3: 1, 33: 1}
Did not match all atoms present	94442-22-5	[CH3-].[CH3-].[CH3-].CC1=[C-]CC=C1.[Pt+4]	{1: 1, 11: 1, 14: 2, 15: 1}
Did not match all atoms present	94492-00-9	[Po-]	{}
Did not match all atoms present	945-49-3	C1CCC(CC1)C(C2=CC=CC=C2)O	{11: 5, 20: 1, 3: 1, 12: 1, 14: 5}
Did not match all atoms present	945-51-7	C1=CC=C(C=C1)S(=O)C2=CC=CC=C2	{29: 1, 14: 10}
Did not match all atoms present	945-65-3	C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3.Cl	{32: 1, 17: 1, 35: 2, 14: 6, 41: 1}
Did not match all atoms present	945-93-7	CCOC(=O)C=C(C)C1=CC=CC=C1	{1: 2, 2: 1, 6: 1, 7: 1, 14: 5, 28: 1}
Did not match all atoms present	94508-09-5	CCOC(CNCCC1=CC=CC=C1)OCC	{1: 2, 2: 5, 3: 1, 14: 5, 22: 2, 31: 1}
Did not match all atoms present	94552-14-4	CC1=CC(=C(C=C1)N)C.C1=CC(=CC(=C1)O)O.C1=CC(=CC=C1N)S(=O)(=O)O	{1: 2, 14: 11, 20: 1, 21: 2, 29: 2, 30: 2}
Did not match all atoms present	94593-79-0	C1COC(O1)CON=C(C#N)C2=CC=CC=C2	{2: 1, 37: 1, 7: 1, 11: 2, 12: 1, 34: 1, 14: 5, 22: 1, 23: 2}
Did not match all atoms present	94593-91-6	COCCOC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=NC(=N2)OC)OC	{1: 3, 2: 2, 35: 3, 14: 4, 22: 4, 24: 1, 29: 2, 31: 2}
Did not match all atoms present	946-02-1	C1=CC=C(C=C1)C(=O)OCCCCCl	{17: 1, 2: 4, 28: 1, 14: 5}
Did not match all atoms present	946-30-5	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)[O-])Cl.[Na+]	{17: 1, 38: 1, 29: 3, 14: 3}
Did not match all atoms present	946-33-8	C1CCC(=O)C(C1)CC2=CC=CC=C2	{25: 1, 2: 1, 11: 4, 12: 1, 14: 5}
Did not match all atoms present	946-39-4	CCOC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2	{1: 1, 2: 1, 11: 1, 12: 2, 14: 5, 28: 1}
Did not match all atoms present	946-80-5	C1=CC=C(C=C1)COC2=CC=CC=C2	{2: 1, 22: 1, 14: 10}
Did not match all atoms present	946-88-3	C1=CC=C(C=C1)OCC(=O)OCCCl	{17: 1, 2: 3, 28: 1, 22: 1, 14: 5}
Did not match all atoms present	94602-15-0	CN(C(=O)NC1=CC=C(C=C1)NC(=O)N(C)N=O)N=O	{1: 2, 34: 2, 33: 2, 14: 4, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	94628-91-8	CNC(=O)NC1=CC=C(C=C1)NC(=O)NC	{24: 2, 1: 2, 14: 4, 31: 4}
Did not match all atoms present	94651-33-9	C1=CC=C(C(=C1)C=O)OC(F)(F)F	{16: 3, 26: 1, 4: 1, 22: 1, 14: 4}
Did not match all atoms present	94695-48-4	C1=C(C(=C(C(=C1F)F)F)F)C(=O)Cl	{16: 4, 17: 1, 14: 1, 24: 1}
Did not match all atoms present	947-02-4	CCOP(=O)(N=C1SCCS1)OCC	{1: 2, 2: 2, 41: 2, 11: 2, 34: 1, 15: 1, 22: 2, 29: 1}
Did not match all atoms present	947-19-3	C1CCC(CC1)(C(=O)C2=CC=CC=C2)O	{24: 1, 11: 5, 20: 1, 13: 1, 14: 5}
Did not match all atoms present	947-42-2	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(O)O	{20: 2, 14: 10}
Did not match all atoms present	947-58-0	COC1=C2C3CC(C2=C(C=C1)OC)C=C3	{1: 2, 11: 1, 12: 2, 22: 2, 14: 4}
Did not match all atoms present	947-72-8	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)Cl	{17: 1, 14: 9}
Did not match all atoms present	947-73-9	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)N	{30: 1, 14: 9}
Did not match all atoms present	947-82-0	CC1=NN(C(=O)C1(C)C)C2=CC=CC=C2	{1: 3, 35: 1, 33: 1, 13: 1, 14: 5, 15: 1, 25: 1}
Did not match all atoms present	947-84-2	C1=CC=C(C=C1)C2=CC=CC=C2C(=O)O	{27: 1, 14: 9}
Did not match all atoms present	947-91-1	C1=CC=C(C=C1)C(C=O)C2=CC=CC=C2	{26: 1, 3: 1, 14: 10}
Did not match all atoms present	947-95-5	CC1=NN(C(=C1C=O)Cl)C2=CC=CC=C2	{1: 1, 35: 1, 33: 1, 14: 5, 17: 1, 26: 1}
Did not match all atoms present	94718-60-2	C[Te]C=C	{1: 1, 5: 1, 6: 1}
Did not match all atoms present	94755-93-8	CC1=C(ON=C1C)NC(=O)C2=CC=C(C=C2)NC(=O)C(C)N3CCCCC3	{1: 3, 3: 1, 33: 1, 11: 5, 14: 4, 35: 1, 23: 1, 24: 2, 31: 2}
Did not match all atoms present	94764-55-3	C1=CC=C2C(=C1)C3=C(S2)C=C(C=C3)[N+](=O)[O-]	{41: 1, 38: 1, 14: 7}
Did not match all atoms present	94782-52-2	CCN(CC)C1=C(C=C(C(=C1)OC)N=NC2=CC(=C(C=C2Cl)S(=O)(=O)[O-])Cl)OC.[Na+]	{1: 4, 2: 2, 33: 1, 34: 2, 14: 4, 17: 2, 22: 2, 29: 3}
Did not match all atoms present	94782-53-3	C1=CC(=C(C=C1N/N=C\2/C(=O)C3=C(C(=CC(=C3N)S(=O)(=O)O)S(=O)(=O)O)C=C2)S(=O)(=O)O)/C=C/C4=C(C=C(C=C4)N/N=C\5/C(=O)C6=C(C(=CC(=C6N)S(=O)(=O)O)S(=O)(=O)O)C=C5)S(=O)(=O)O.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO	{33: 6, 2: 36, 6: 2, 34: 2, 14: 12, 15: 2, 20: 24, 25: 2, 29: 12, 30: 2, 31: 2}
Did not match all atoms present	94782-54-4	CC1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)N=NC4C(=O)NC(=O)NC4=O)S(=O)(=O)[O-].[Na+]	{32: 2, 1: 1, 34: 2, 35: 1, 41: 1, 12: 1, 14: 6, 25: 3, 29: 3}
Did not match all atoms present	948-03-8	COC(=O)C1=C(C2=CC=CC=C2C=C1)O	{1: 1, 28: 1, 21: 1, 14: 6}
Did not match all atoms present	948-32-3	CC(C)C1=CC(=C(C=C1)C(C)C)C(C)C	{1: 6, 3: 3, 14: 3}
Did not match all atoms present	948-65-2	C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2	{32: 1, 14: 10}
Did not match all atoms present	948-99-2	C1=CC=C(C=C1)/C=C(/C2=CC=CC=C2)\Cl	{17: 1, 14: 10, 6: 1, 7: 1}
Did not match all atoms present	94820-31-2	C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=NOC4=CC=CC=C43	{35: 1, 29: 1, 22: 3, 14: 14, 23: 1}
Did not match all atoms present	94825-62-4	C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)[O-])NNC3=CC(=C(C=C3S(=O)(=O)[O-])Cl)NNC4=C5C(=CC(=CC5=O)S(=O)(=O)[O-])C=CC4=N.[K+].[K+].[K+]	{36: 2, 14: 10, 15: 10, 17: 1, 25: 2, 29: 9, 31: 4}
Did not match all atoms present	94854-03-2	C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC(=C(C(=C4)Br)O)Br)C5=CC(=C(C(=C5)Br)O)Br	{18: 4, 13: 1, 14: 12, 21: 2}
Did not match all atoms present	94855-74-0	CN1C(=CN=C1C=C(C(=O)OC)C(=O)OC)[N+](=O)[O-]	{1: 3, 35: 1, 38: 1, 6: 1, 33: 1, 7: 1, 14: 1, 28: 2}
Did not match all atoms present	94857-19-9	CCC(CO)(CO)CO.CC(C)(C1=CC(=CC=C1)C(C)(C)N=C=O)N=C=O	{1: 5, 2: 4, 4: 3, 8: 2, 34: 2, 14: 4, 20: 3, 29: 2}
Did not match all atoms present	94878-29-2	C1=CC=C(C=C1)C2=CC3=C(C=C2)N=C(C=C3)C4=CC=CC=C4	{35: 1, 14: 15}
Did not match all atoms present	949-03-1	C1=CC(=CC=C1C(=O)OCCCl)[N+](=O)[O-]	{17: 1, 2: 2, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	949-42-8	CC1=NC(=NC(=N1)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{1: 1, 35: 3, 4: 2, 17: 6}
Did not match all atoms present	949-87-1	CC1=CC=C(C=C1)N=NC2=CC=CC=C2	{1: 1, 34: 2, 14: 9}
Did not match all atoms present	94933-08-1	CCCCC(CC)CNCCCN.C1C(O1)COC2=CC=C(C=C2)CC3=CC=C(C=C3)OCC4CO4	{1: 2, 2: 11, 3: 1, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2, 30: 1, 31: 1}
Did not match all atoms present	94977-52-3	C1=CC(=C(C=C1F)F)C=CC(=O)O	{16: 2, 27: 1, 14: 3, 6: 2}
Did not match all atoms present	95-00-1	C1=CC(=C(C=C1Cl)Cl)CN	{17: 2, 2: 1, 30: 1, 14: 3}
Did not match all atoms present	95-01-2	C1=CC(=C(C=C1O)O)C=O	{26: 1, 21: 2, 14: 3}
Did not match all atoms present	95-03-4	COC1=C(C=C(C=C1)Cl)N	{1: 1, 30: 1, 22: 1, 14: 3, 17: 1}
Did not match all atoms present	95-05-6	CCN(CC)C(=S)SC(=S)N(CC)CC	{40: 1, 1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	95-06-7	CCN(CC)C(=S)SCC(=C)Cl	{1: 2, 2: 3, 5: 1, 33: 1, 40: 1, 7: 2, 17: 1}
Did not match all atoms present	95-13-6	C1C=CC2=CC=CC=C21	{11: 1, 14: 6}
Did not match all atoms present	95-14-7	C1=CC2=NNN=C2C=C1	{32: 1, 35: 2, 14: 4}
Did not match all atoms present	95-15-8	C1=CC=C2C(=C1)C=CS2	{41: 1, 14: 6}
Did not match all atoms present	95-16-9	C1=CC=C2C(=C1)N=CS2	{41: 1, 35: 1, 14: 5}
Did not match all atoms present	95-20-5	CC1=CC2=CC=CC=C2N1	{32: 1, 1: 1, 14: 5}
Did not match all atoms present	95-21-6	CC1=NC2=CC=CC=C2O1	{1: 1, 35: 1, 14: 4, 23: 1}
Did not match all atoms present	95-22-7	CC1=CC2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(S4)C5=CC=C(C=C5)N	{1: 1, 35: 2, 30: 1, 14: 10, 41: 2}
Did not match all atoms present	95-23-8	C1=CC2=C(C=C1N)NC(=O)N2	{32: 2, 25: 1, 30: 1, 14: 3}
Did not match all atoms present	95-24-9	C1=CC2=C(C=C1Cl)SC(=N2)N	{17: 1, 35: 1, 30: 1, 14: 3, 41: 1}
Did not match all atoms present	95-25-0	C1=CC2=C(C=C1Cl)NC(=O)O2	{32: 1, 17: 1, 28: 1, 14: 3}
Did not match all atoms present	95-26-1	CC1=CC2=C(C=C1)SC(=N2)C	{1: 2, 35: 1, 14: 3, 41: 1}
Did not match all atoms present	95-29-4	CC(C)N(C(C)C)SC1=NC2=CC=CC=C2S1	{1: 4, 3: 2, 33: 1, 40: 1, 41: 1, 14: 4, 35: 1}
Did not match all atoms present	95-30-7	CCN(CC)C(=S)SC1=NC2=CC=CC=C2S1	{1: 2, 2: 2, 35: 1, 33: 1, 40: 1, 41: 1, 7: 1, 14: 4}
Did not match all atoms present	95-31-8	CC(C)(C)NSC1=NC2=CC=CC=C2S1	{1: 3, 35: 1, 4: 1, 40: 1, 41: 1, 14: 4, 31: 1}
Did not match all atoms present	95-32-9	C1COCCN1SSC2=NC3=CC=CC=C3S2	{33: 1, 35: 1, 40: 2, 41: 1, 11: 4, 14: 4, 23: 1}
Did not match all atoms present	95-35-2	C1=CC=C2C(=C1)N=C(S2)SCNC(=O)NCSC3=NC4=CC=CC=C4S3	{2: 2, 35: 2, 40: 2, 41: 2, 14: 8, 24: 1, 31: 2}
Did not match all atoms present	95-46-5	CC1=CC=CC=C1Br	{1: 1, 18: 1, 14: 4}
Did not match all atoms present	95-47-6	CC1=CC=CC=C1C	{1: 2, 14: 4}
Did not match all atoms present	95-48-7	CC1=CC=CC=C1O	{1: 1, 21: 1, 14: 4}
Did not match all atoms present	95-49-8	CC1=CC=CC=C1Cl	{1: 1, 14: 4, 17: 1}
Did not match all atoms present	95-50-1	C1=CC=C(C(=C1)Cl)Cl	{17: 2, 14: 4}
Did not match all atoms present	95-51-2	C1=CC=C(C(=C1)N)Cl	{17: 1, 30: 1, 14: 4}
Did not match all atoms present	95-52-3	CC1=CC=CC=C1F	{16: 1, 1: 1, 14: 4}
Did not match all atoms present	95-53-4	CC1=CC=CC=C1N	{1: 1, 30: 1, 14: 4}
Did not match all atoms present	95-54-5	C1=CC=C(C(=C1)N)N	{30: 2, 14: 4}
Did not match all atoms present	95-55-6	C1=CC=C(C(=C1)N)O	{30: 1, 21: 1, 14: 4}
Did not match all atoms present	95-56-7	C1=CC=C(C(=C1)O)Br	{18: 1, 21: 1, 14: 4}
Did not match all atoms present	95-57-8	C1=CC=C(C(=C1)O)Cl	{17: 1, 21: 1, 14: 4}
Did not match all atoms present	95-58-9	CC1=NC=CN=C1Cl	{1: 1, 35: 2, 14: 2, 17: 1}
Did not match all atoms present	95-62-5	C1[C@H]([C@@H]1N)C2=CC=CC=C2	{11: 1, 12: 2, 30: 1, 14: 5}
Did not match all atoms present	95-63-6	CC1=CC(=C(C=C1)C)C	{1: 3, 14: 3}
Did not match all atoms present	95-64-7	CC1=C(C=C(C=C1)N)C	{1: 2, 30: 1, 14: 3}
Did not match all atoms present	95-65-8	CC1=C(C=C(C=C1)O)C	{1: 2, 21: 1, 14: 3}
Did not match all atoms present	95-66-9	CC1=CC(=C(C=C1)Cl)C	{1: 2, 14: 3, 17: 1}
Did not match all atoms present	95-68-1	CC1=CC(=C(C=C1)N)C	{1: 2, 30: 1, 14: 3}
Did not match all atoms present	95-69-2	CC1=C(C=CC(=C1)Cl)N	{1: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	95-70-5	CC1=C(C=CC(=C1)N)N	{1: 1, 30: 2, 14: 3}
Did not match all atoms present	95-71-6	CC1=C(C=CC(=C1)O)O	{1: 1, 21: 2, 14: 3}
Did not match all atoms present	95-72-7	CC1=CC(=C(C=C1)C)Cl	{1: 2, 14: 3, 17: 1}
Did not match all atoms present	95-73-8	CC1=C(C=C(C=C1)Cl)Cl	{1: 1, 14: 3, 17: 2}
Did not match all atoms present	95-74-9	CC1=C(C=C(C=C1)N)Cl	{1: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	95-75-0	CC1=CC(=C(C=C1)Cl)Cl	{1: 1, 14: 3, 17: 2}
Did not match all atoms present	95-76-1	C1=CC(=C(C=C1N)Cl)Cl	{17: 2, 30: 1, 14: 3}
Did not match all atoms present	95-77-2	C1=CC(=C(C=C1O)Cl)Cl	{17: 2, 21: 1, 14: 3}
Did not match all atoms present	95-78-3	CC1=CC(=C(C=C1)C)N	{1: 2, 30: 1, 14: 3}
Did not match all atoms present	95-79-4	CC1=C(C=C(C=C1)Cl)N	{1: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	95-80-7	CC1=C(C=C(C=C1)N)N	{1: 1, 30: 2, 14: 3}
Did not match all atoms present	95-81-8	CC1=CC(=C(C=C1)Cl)N	{1: 1, 30: 1, 14: 3, 17: 1}
Did not match all atoms present	95-82-9	C1=CC(=C(C=C1Cl)N)Cl	{17: 2, 30: 1, 14: 3}
Did not match all atoms present	95-83-0	C1=CC(=C(C=C1Cl)N)N	{17: 1, 30: 2, 14: 3}
Did not match all atoms present	95-84-1	CC1=CC(=C(C=C1)O)N	{1: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	95-85-2	C1=CC(=C(C=C1Cl)N)O	{17: 1, 30: 1, 21: 1, 14: 3}
Did not match all atoms present	95-86-3	C1=CC(=C(C=C1N)N)O	{30: 2, 21: 1, 14: 3}
Did not match all atoms present	95-87-4	CC1=CC(=C(C=C1)C)O	{1: 2, 21: 1, 14: 3}
Did not match all atoms present	95-88-5	C1=CC(=C(C=C1O)O)Cl	{17: 1, 21: 2, 14: 3}
Did not match all atoms present	95-89-6	CC1=CN=C(C(=N1)Cl)C	{1: 2, 35: 2, 14: 1, 17: 1}
Did not match all atoms present	95-93-2	CC1=CC(=C(C=C1C)C)C	{1: 4, 14: 2}
Did not match all atoms present	95-94-3	C1=C(C(=CC(=C1Cl)Cl)Cl)Cl	{17: 4, 14: 2}
Did not match all atoms present	95-95-4	C1=C(C(=CC(=C1Cl)Cl)Cl)O	{17: 3, 21: 1, 14: 2}
Did not match all atoms present	95-99-8	C(C(=O)O)NC(=S)C(=S)NCC(=O)O	{31: 2, 2: 2, 27: 2, 7: 2}
Did not match all atoms present	950-10-7	CCOP(=O)(N=C1SCC(S1)C)OCC	{1: 3, 2: 2, 41: 2, 11: 1, 12: 1, 34: 1, 15: 1, 22: 2, 29: 1}
Did not match all atoms present	950-35-6	COP(=O)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 38: 1, 22: 3, 14: 4, 29: 1}
Did not match all atoms present	950-37-8	COC1=NN(C(=O)S1)CSP(=S)(OC)OC	{1: 3, 2: 1, 35: 1, 33: 1, 40: 1, 41: 1, 22: 3, 25: 1}
Did not match all atoms present	95004-22-1	CC1CCC[NH+]1CCCOC(=O)C2=CC=C(C=C2)OC3CCCC=C3.[Cl-]	{1: 1, 2: 3, 11: 6, 12: 2, 14: 6, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	95041-38-6	C1=C(C=C(C(=C1Cl)[O-])S(=O)(=O)[O-])Cl.[Na+].[Na+]	{17: 2, 29: 3, 14: 2}
Did not match all atoms present	95058-81-4	C1=CN(C(=O)N=C1N)[C@H]2C([C@@H]([C@H](O2)CO)O)(F)F	{33: 1, 2: 1, 35: 1, 12: 3, 13: 1, 14: 2, 16: 2, 20: 2, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	95061-47-5	CC(=O)O[C@H](C1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{1: 1, 3: 1, 4: 1, 14: 15, 20: 1, 28: 1}
Did not match all atoms present	95061-51-1	CC(=O)O[C@@H](C1=CC=CC=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O	{1: 1, 3: 1, 4: 1, 14: 15, 20: 1, 28: 1}
Did not match all atoms present	95070-72-7	C[C@@H]([C@H](C)P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4.[CH2-]C=C.[O-]Cl(=O)(=O)=O.[Pd+2]	{1: 2, 3: 2, 5: 2, 6: 1, 14: 20, 17: 1, 29: 4}
Did not match all atoms present	95091-93-3	C[Si]1(CC[Si](N1CCCBr)(C)C)C	{1: 4, 2: 3, 11: 2, 18: 1, 33: 1}
Did not match all atoms present	951-39-3	COC1=C(C=C2C3=CC=CC=C3OC2=C1)N	{1: 1, 30: 1, 22: 1, 14: 6, 23: 1}
Did not match all atoms present	951-55-3	CC1=CC2=C(C=C1)NC=C2CC(C(=O)O)N	{32: 1, 1: 1, 2: 1, 3: 1, 14: 4, 27: 1, 30: 1}
Did not match all atoms present	951-77-9	C1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)N)CO)O	{33: 1, 2: 1, 35: 1, 11: 1, 12: 3, 14: 2, 20: 2, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	951-80-4	C1=CC=C2C(=C1)C(=C3C=CC(=CC3=N2)N)N	{35: 1, 30: 2, 14: 7}
Did not match all atoms present	951-82-6	COC1=CC(=CC(=C1OC)OC)CC(=O)O	{1: 3, 2: 1, 27: 1, 22: 3, 14: 2}
Did not match all atoms present	951-86-0	C1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\Cl)/Cl	{17: 2, 14: 10, 7: 2}
Did not match all atoms present	951-97-3	CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)O	{1: 1, 38: 1, 14: 3, 24: 1, 27: 1, 31: 1}
Did not match all atoms present	95118-37-9	[Mn+2].[OH-]	{}
Did not match all atoms present	95156-21-1	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(C7=CC=CC=C7)C8=CC=CC=C8.[O-]Cl(=O)(=O)=O.[Rh]	{17: 1, 29: 4, 14: 64}
Did not match all atoms present	95194-86-8	C1=CC=C(C=C1)CN2C=NC3=C2NC(=NC3=O)Cl	{32: 1, 33: 1, 2: 1, 35: 2, 14: 6, 17: 1, 25: 1}
Did not match all atoms present	952-47-6	CC1=CC(=NNC2=CC=CC=C2)C(=O)C=C1	{1: 1, 34: 1, 14: 8, 15: 2, 25: 1, 31: 1}
Did not match all atoms present	952-54-5	C1COCCN1CNC(=O)C2=NC=CN=C2	{33: 1, 2: 1, 35: 2, 11: 4, 14: 3, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	952-80-7	CC1=CC=CC=C1CCC2=CC=CC=C2C	{1: 2, 2: 2, 14: 8}
Did not match all atoms present	952-97-6	C1=CC=C(C=C1)SC2=CC=C(C=C2)[N+](=O)[O-]	{40: 1, 38: 1, 14: 9}
Did not match all atoms present	95235-29-3	CCN(CC(C)C)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5O2)C)NC6=CC=CC=C6	{1: 4, 2: 2, 3: 1, 33: 1, 13: 1, 14: 14, 23: 1, 28: 1, 31: 1}
Did not match all atoms present	95250-85-4	C=[Fe]	{5: 1}
Did not match all atoms present	95251-52-8	C1=CC(=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C(=O)[O-].[Na+]	{4: 1, 14: 7, 16: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	953-17-3	COP(=S)(OC)SCSC1=CC=C(C=C1)Cl	{1: 2, 2: 1, 40: 2, 14: 4, 17: 1, 22: 2}
Did not match all atoms present	953-26-4	CCOC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 6: 2, 38: 1, 14: 4, 28: 1}
Did not match all atoms present	953-91-3	CC1=CC=C(C=C1)S(=O)(=O)OC2CCCCC2	{1: 1, 11: 5, 12: 1, 14: 4, 22: 1, 29: 2}
Did not match all atoms present	95321-65-6	CC(=O)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.CN1CCOCC1.C1C(O1)CCl	{1: 4, 2: 1, 4: 1, 33: 1, 11: 5, 12: 1, 14: 8, 17: 1, 21: 2, 23: 2, 27: 1}
Did not match all atoms present	95321-68-9	CCCCCCCC/C=C\CCCCCCCCN.COC(=O)C=C.C1=CC(=CC(=C1)CN)CN	{1: 2, 2: 17, 5: 1, 6: 3, 14: 4, 28: 1, 30: 3}
Did not match all atoms present	95378-36-2	CCOP(=O)(C1C(=O)NC(=O)N1)OCC	{32: 2, 1: 2, 2: 2, 12: 1, 22: 2, 25: 2, 29: 1}
Did not match all atoms present	95386-61-1	[Cl-].[K+].[K+]	{17: 1}
Did not match all atoms present	95388-88-8	CC1(CC(N2N1N2C(F)(F)F)(C(F)(F)F)C(F)(F)F)C3=CC=CC=C3	{1: 1, 4: 3, 33: 3, 11: 1, 13: 2, 14: 5, 16: 9}
Did not match all atoms present	954-16-5	CC1=CC(=C(C(=C1)C)C(=O)C2=CC=CC=C2)C	{24: 1, 1: 3, 14: 7}
Did not match all atoms present	954-21-2	CNC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2	{24: 1, 1: 1, 3: 1, 14: 10, 31: 1}
Did not match all atoms present	954-46-1	C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)[N+](=O)[O-]	{38: 1, 14: 9}
Did not match all atoms present	954-81-4	C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCBr	{25: 2, 2: 5, 18: 1, 14: 4, 33: 1}
Did not match all atoms present	95418-58-9	CC(C)(C)OC1=CC=C(C=C1)C=C	{1: 3, 4: 1, 5: 1, 6: 1, 14: 4, 22: 1}
Did not match all atoms present	95465-99-9	CCC(C)SP(=O)(OCC)SC(C)CC	{1: 5, 2: 3, 3: 2, 40: 2, 22: 1, 29: 1}
Did not match all atoms present	955-03-3	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N=O	{1: 6, 34: 1, 4: 2, 14: 2, 21: 1, 29: 1}
Did not match all atoms present	955-07-7	C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)NN)[N+](=O)[O-]	{38: 2, 14: 2, 21: 1, 24: 1, 30: 1, 31: 1}
Did not match all atoms present	955-48-6	CC(C(C1=CC=C(C=C1)NS(=O)(=O)C)O)NC.Cl	{1: 3, 3: 2, 14: 4, 17: 1, 20: 1, 29: 2, 31: 2}
Did not match all atoms present	955-83-9	C1=CC=C(C=C1)C2=CC=C(O2)C3=CC=CC=C3	{14: 12, 23: 1}
Did not match all atoms present	95500-19-9	CC[N+](C)(C)CC.[OH-]	{1: 4, 2: 2}
Did not match all atoms present	95552-76-4	CC(C)(C)N=PC(C)(C)C	{1: 6, 34: 1, 4: 2}
Did not match all atoms present	95566-34-0	CC(C)CCCCCOC(=O)C=C.CC(=C)C(=O)OCCC[Si](OC)(OC)OC.C=CC(=O)N	{1: 6, 2: 8, 3: 1, 5: 3, 6: 2, 7: 1, 22: 3, 24: 1, 28: 2, 30: 1}
Did not match all atoms present	95566-38-4	CC(CN)O.C=O	{1: 1, 2: 1, 3: 1, 5: 1, 20: 1, 30: 1}
Did not match all atoms present	95566-44-2	C[C@@H]1C=CC[C@H]2[C@@H]1C(=O)OC2=O.C=CC1=CC=CC=C1.C(CO)O	{1: 1, 2: 2, 5: 1, 6: 1, 11: 1, 12: 3, 14: 7, 20: 2, 28: 2}
Did not match all atoms present	95566-48-6	CCCCC(CC)COC(=O)C=C.CC(=C)C(=O)OCCC[Si](OC)(OC)OC.C=CC(=O)N	{1: 6, 2: 8, 3: 1, 5: 3, 6: 2, 7: 1, 22: 3, 24: 1, 28: 2, 30: 1}
Did not match all atoms present	95566-49-7	CCCCOC(=O)C=C.CCOC(=O)C(=C)C.CC(=C)C(=O)OCCC[Si](OC)(OC)OC	{1: 7, 2: 7, 5: 3, 6: 1, 7: 2, 22: 3, 28: 3}
Did not match all atoms present	956-03-6	CCCNC(C)(C)COC(=O)C1=CC=CC=C1.Cl	{1: 3, 2: 3, 4: 1, 14: 5, 17: 1, 28: 1, 31: 1}
Did not match all atoms present	956-04-7	C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Cl	{24: 1, 17: 1, 14: 9, 6: 2}
Did not match all atoms present	956-48-9	C1=CC(=O)C=CC1=NC2=CC(=C(C(=C2)Cl)O)Cl	{34: 1, 14: 6, 15: 1, 17: 2, 21: 1, 25: 1}
Did not match all atoms present	956-62-7	[C-]#[N+]C1=CC=C(C=C1)CC2=CC=C(C=C2)[N+]#[C-]	{2: 1, 34: 2, 14: 8}
Did not match all atoms present	956-90-1	C1CCC(CC1)(C2=CC=CC=C2)N3CCCCC3.Cl	{17: 1, 11: 10, 13: 1, 14: 5, 33: 1}
Did not match all atoms present	95619-40-2	CCCOC1=CC(=C(C(=C1)C)C(=O)OCC(C)(C)[NH+]2CCCC2)C.[Cl-]	{1: 5, 2: 3, 4: 1, 11: 4, 14: 2, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	95642-50-5	CN(C)C1=CC=C(C=C1)C2=NC(=O)C=C(S2)O	{1: 2, 35: 1, 33: 1, 41: 1, 14: 5, 21: 1, 25: 1}
Did not match all atoms present	95642-51-6	COC1=C(C=C(C=C1)C2=NC(=O)C=C(S2)O)OC	{1: 2, 35: 1, 41: 1, 14: 4, 21: 1, 22: 2, 25: 1}
Did not match all atoms present	95642-52-7	COC1=CC=C(C=C1)C2=NC(=O)C=C(S2)O	{1: 1, 35: 1, 41: 1, 14: 5, 21: 1, 22: 1, 25: 1}
Did not match all atoms present	95642-53-8	C1=CC(=CC=C1C2=NC(=O)C=C(S2)O)Br	{35: 1, 41: 1, 14: 5, 18: 1, 21: 1, 25: 1}
Did not match all atoms present	95649-00-6	CCCCOCCOP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-].[K+].[K+].[K+].[K+]	{1: 1, 2: 5, 29: 7, 22: 4}
Did not match all atoms present	957-13-1	COP1(=NP(=NP(=N1)(OC)OC)(OC)OC)OC	{1: 6, 35: 3, 22: 6}
Did not match all atoms present	957-51-7	CN(C)C(=O)C(C1=CC=CC=C1)C2=CC=CC=C2	{24: 1, 1: 2, 3: 1, 14: 10, 33: 1}
Did not match all atoms present	957-75-5	C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)Br	{32: 1, 33: 1, 2: 1, 12: 4, 14: 1, 18: 1, 20: 3, 23: 1, 25: 2}
Did not match all atoms present	95719-24-7	CC1=C(C=CC(=C1C)Cl)C(C)C2=CC=CC=C2	{1: 3, 3: 1, 14: 7, 17: 1}
Did not match all atoms present	95719-25-8	CC(C1=CC=CC=C1)C2=CC=CC=C2CCl	{1: 1, 2: 1, 3: 1, 14: 9, 17: 1}
Did not match all atoms present	95727-77-8	CCCC(=O)C1=C(C=CC=C1F)F	{16: 2, 1: 1, 2: 2, 14: 3, 24: 1}
Did not match all atoms present	95770-03-9	C[NH+](C)CCSCC(=O)NC1=CC=CC=C1Cl.[Cl-]	{1: 2, 2: 3, 40: 1, 14: 4, 17: 2, 24: 1, 31: 1}
Did not match all atoms present	958-09-8	C1C(C(OC1N2C=NC3=C2N=CN=C3N)CO)O	{33: 1, 2: 1, 35: 3, 11: 1, 12: 3, 14: 2, 20: 2, 23: 1, 30: 1}
Did not match all atoms present	958-60-1	CCC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C	{1: 2, 2: 1, 38: 2, 7: 1, 34: 1, 14: 3, 31: 1}
Did not match all atoms present	958-93-0	C[NH+](C)CCN(CC1=CSC=C1)C2=CC=CC=N2.[Cl-]	{1: 2, 2: 3, 35: 1, 33: 1, 41: 1, 14: 7, 17: 1}
Did not match all atoms present	95823-41-9	CCC(CO)(CO)COC(=O)C1=C(C=C(C=C1)C(=O)O)C(=O)O	{1: 1, 2: 4, 4: 1, 14: 3, 20: 2, 27: 2, 28: 1}
Did not match all atoms present	95823-42-0	CC(COCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)O)COCCN3C(=O)C4=CC=CC=C4C3=O	{1: 1, 2: 6, 3: 1, 33: 2, 14: 7, 22: 2, 25: 4, 27: 1}
Did not match all atoms present	95860-07-4	CC1=C(C=C(C=C1)[N+](=O)[O-])NO	{1: 1, 20: 1, 38: 1, 14: 3, 31: 1}
Did not match all atoms present	95860-63-2	[Cl-].[Cl-].[Rb+].[Cs+]	{17: 2}
Did not match all atoms present	95860-64-3	[Na+].[Cl-].[Cs+]	{17: 1}
Did not match all atoms present	95860-65-4	[Na+].[Cl-].[Rb+]	{17: 1}
Did not match all atoms present	95860-66-5	[Na+].[Cl-].[K+]	{17: 1}
Did not match all atoms present	95892-10-7	[H+].[H+].[H+].[H+].[H+].CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC(=CC=C4)S(=O)(=O)[O-].CC1=NN(C(=C1N=NC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)[O-])[O-])[O-])C4=CC(=CC=C4)S(=O)(=O)[O-].[Cr+3]	{1: 2, 34: 4, 35: 2, 33: 2, 14: 18, 29: 12}
Did not match all atoms present	95896-78-9	CC1=CC2=NC=C(N=C2C3=C1N(C(=N3)N)C)C	{1: 3, 35: 3, 30: 1, 14: 2, 33: 1}
Did not match all atoms present	959-02-4	C1C2=CC=CC=C2CC3=CC4=CC=CC=C4C=C31	{11: 2, 14: 10}
Did not match all atoms present	959-14-8	CCN(CC)CCC1=NC(=NO1)C2=CC=CC=C2	{1: 2, 2: 4, 35: 2, 33: 1, 14: 5, 23: 1}
Did not match all atoms present	959-22-8	C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]	{28: 1, 38: 1, 14: 9}
Did not match all atoms present	959-24-0	CC(C)NCC(C1=CC=C(C=C1)NS(=O)(=O)C)O.Cl	{1: 3, 2: 1, 3: 2, 14: 4, 17: 1, 20: 1, 29: 2, 31: 2}
Did not match all atoms present	959-26-2	C1=CC(=CC=C1C(=O)OCCO)C(=O)OCCO	{28: 2, 2: 4, 20: 2, 14: 4}
Did not match all atoms present	959-28-4	C1=CC=C(C=C1)C(=O)/C=C/C(=O)C2=CC=CC=C2	{24: 2, 14: 10, 6: 2}
Did not match all atoms present	959-33-1	COC1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC=C2	{24: 1, 1: 1, 22: 1, 14: 9, 6: 2}
Did not match all atoms present	959-55-7	CCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]	{1: 3, 2: 8, 14: 5, 17: 1}
Did not match all atoms present	959-98-8	C1[C@@H]2[C@H](COS(=O)O1)C3(C(=C([C@]2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{11: 2, 12: 2, 13: 3, 15: 2, 17: 6, 23: 2, 29: 1}
Did not match all atoms present	95905-90-1	CN1C2=C(C=C(C=C2)C=NN(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C51	{1: 1, 34: 1, 14: 17, 6: 1, 33: 2}
Did not match all atoms present	95932-85-7	[Na+].[Br-].[Cs+]	{18: 1}
Did not match all atoms present	95993-52-5	C1=CC=C(C=C1)N(C2=CC=CC=C2)/N=C/C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3	{33: 1, 34: 1, 14: 19, 6: 1}
Did not match all atoms present	96-09-3	C1C(O1)C2=CC=CC=C2	{11: 1, 12: 1, 14: 5, 23: 1}
Did not match all atoms present	96-10-6	CC[Al](CC)Cl	{1: 2, 2: 2, 17: 1}
Did not match all atoms present	96-43-5	C1=CSC(=C1)Cl	{17: 1, 14: 3, 41: 1}
Did not match all atoms present	96-45-7	C1CNC(=S)N1	{32: 2, 11: 2, 15: 1}
Did not match all atoms present	96-49-1	C1COC(=O)O1	{11: 2}
Did not match all atoms present	96-50-4	C1=CSC(=N1)N	{41: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	96-53-7	C1CSC(=S)N1	{32: 1, 41: 1, 11: 2, 15: 1}
Did not match all atoms present	96-57-1	CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)[N+](=O)[O-]	{1: 3, 38: 1, 29: 2, 14: 3, 33: 1}
Did not match all atoms present	96-59-3	CC(C)NS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 2, 3: 1, 38: 1, 14: 3, 17: 1, 29: 2, 31: 1}
Did not match all atoms present	96-64-0	CC(C(C)(C)C)OP(=O)(C)F	{1: 5, 3: 1, 4: 1, 16: 1, 22: 1, 29: 1}
Did not match all atoms present	96-65-1	CC1=C(C(=CC(=C1)CC2=CC(=C(C(=C2)C(C)(C)C)O)C)C(C)(C)C)O	{1: 8, 2: 1, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	96-66-2	CC1=CC(=CC(=C1O)C(C)(C)C)SC2=CC(=C(C(=C2)C)O)C(C)(C)C	{40: 1, 1: 8, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	96-67-3	C1=C(C=C(C(=C1S(=O)(=O)O)O)N)[N+](=O)[O-]	{38: 1, 14: 2, 20: 1, 21: 1, 29: 2, 30: 1}
Did not match all atoms present	96-68-4	CC1=CC(=C(C=C1S(=O)(=O)O)C(C)C)O	{1: 3, 3: 1, 14: 2, 20: 1, 21: 1, 29: 2}
Did not match all atoms present	96-69-5	CC1=CC(=C(C=C1SC2=CC(=C(C=C2C)O)C(C)(C)C)C(C)(C)C)O	{40: 1, 1: 8, 4: 2, 21: 2, 14: 4}
Did not match all atoms present	96-70-8	CCC1=CC(=C(C=C1)O)C(C)(C)C	{1: 4, 2: 1, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	96-73-1	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)Cl	{17: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	96-74-2	CS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N	{1: 1, 30: 1, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	96-75-3	C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)O)N	{30: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	96-76-4	CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C	{1: 6, 4: 2, 21: 1, 14: 3}
Did not match all atoms present	96-77-5	C1=CC(=C(C=C1S(=O)(=O)O)S(=O)(=O)O)O	{20: 2, 21: 1, 14: 3, 29: 4}
Did not match all atoms present	96-78-6	CC(=O)NC1=CC(=C(C=C1)N)S(=O)(=O)O	{1: 1, 14: 3, 20: 1, 24: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	96-83-3	CCC(CC1=C(C(=C(C=C1I)I)N)I)C(=O)O	{1: 1, 2: 2, 3: 1, 14: 1, 19: 3, 27: 1, 30: 1}
Did not match all atoms present	96-84-4	CCC(CC1=C(C(=C(C=C1I)I)O)I)C(=O)O	{1: 1, 2: 2, 3: 1, 14: 1, 19: 3, 21: 1, 27: 1}
Did not match all atoms present	96-88-8	CC1=C(C(=CC=C1)C)NC(=O)C2CCCCN2C	{1: 3, 33: 1, 11: 4, 12: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	96-91-3	C1=C(C=C(C(=C1[N+](=O)[O-])O)N)[N+](=O)[O-]	{30: 1, 38: 2, 21: 1, 14: 2}
Did not match all atoms present	96-93-5	C1=C(C=C(C(=C1[N+](=O)[O-])O)N)S(=O)(=O)O	{38: 1, 14: 2, 20: 1, 21: 1, 29: 2, 30: 1}
Did not match all atoms present	96-96-8	COC1=CC(=C(C=C1)N)[N+](=O)[O-]	{1: 1, 30: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	96-97-9	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)O	{38: 1, 27: 1, 21: 1, 14: 3}
Did not match all atoms present	96-98-0	CC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]	{1: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	96-99-1	C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])Cl	{17: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	960-16-7	CCCC[Sn](CCCC)(CCCC)C1=CC=CC=C1	{1: 3, 2: 9, 14: 5}
Did not match all atoms present	960-71-4	B(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3	{14: 15}
Did not match all atoms present	960-92-9	C1=CC=C2C=C3C4=CC=CC=C4C(=CC3=CC2=C1)O	{21: 1, 14: 11}
Did not match all atoms present	961-07-9	C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CO)O	{32: 1, 33: 1, 2: 1, 35: 2, 11: 1, 12: 3, 14: 1, 20: 2, 23: 1, 25: 1, 30: 1}
Did not match all atoms present	961-11-5	COP(=O)(OC)OC(=CCl)C1=CC(=C(C=C1Cl)Cl)Cl	{1: 2, 6: 1, 7: 1, 14: 2, 17: 4, 22: 3, 29: 1}
Did not match all atoms present	961-27-3	CC(=O)C1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)C(=O)C	{24: 2, 1: 2, 11: 1, 14: 6}
Did not match all atoms present	961-38-6	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)N)C(C)(C)C	{1: 9, 4: 3, 30: 1, 14: 2}
Did not match all atoms present	961-45-5	CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=CC=C3	{32: 1, 1: 2, 35: 1, 33: 2, 14: 5, 25: 2}
Did not match all atoms present	961-68-2	C1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 8, 31: 1}
Did not match all atoms present	961-69-3	CCOC(=O)C=C(C)NC(C1=CC=CC=C1)C(=O)[O-].[K+]	{1: 2, 2: 1, 3: 1, 6: 1, 7: 1, 14: 5, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	961-71-7	CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=C2	{1: 2, 2: 3, 14: 10, 33: 2}
Did not match all atoms present	96107-95-8	C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=CC=CC(=C5O)CC6=CC=CC(=C6O)CC7=CC=CC1=C7O)O)O)O	{11: 6, 21: 6, 14: 18}
Did not match all atoms present	96141-86-5	CCN(CC)C1=CC(=C(C=C1)NC2=CC(=NC(=O)C)C(=O)C=C2)C	{1: 4, 2: 2, 33: 1, 34: 1, 14: 6, 15: 2, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	96183-46-9	C[C@H](C[C@@H](C)P(C1=CC=CC=C1)C2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4	{1: 2, 2: 1, 3: 2, 14: 20}
Did not match all atoms present	96195-79-8	CCO[Si](OCC)OCC.C=CCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O	{1: 3, 2: 4, 5: 1, 6: 1, 14: 8, 21: 1, 22: 4, 24: 1}
Did not match all atoms present	962-16-3	C1=CC=C(C=C1)C(=O)OOC(=O)OC2=CC=CC=C2	{28: 1, 14: 10}
Did not match all atoms present	962-32-3	C1=CC=C2C=C3C4=CC=CC=C4C5C(C3=CC2=C1)O5	{12: 2, 14: 10, 23: 1}
Did not match all atoms present	962-58-3	CCOP(=O)(OCC)OC1=NC(=NC(=C1)C)C(C)C	{1: 5, 2: 2, 3: 1, 14: 1, 35: 2, 22: 3, 29: 1}
Did not match all atoms present	96204-36-3	CC1(CN(C(=O)C(N1)(C)C)CC(=NC2CCCCC2)C3=NC(=NC(=N3)C(=NC4CCCCC4)CN5CC(NC(C5=O)(C)C)(C)C)C(=NC6CCCCC6)CN7CC(NC(C7=O)(C)C)(C)C)C	{32: 3, 1: 12, 2: 3, 34: 3, 33: 3, 7: 3, 11: 18, 12: 3, 13: 6, 35: 3, 25: 3}
Did not match all atoms present	96247-23-3	CC(C)(C)C1=CC(=C(C(=C1)C(=O)[O-])O)C(C)(C)C.[K+]	{24: 1, 1: 6, 4: 2, 21: 1, 14: 2}
Did not match all atoms present	96254-05-6	C1=CC=NC(=C1)OC(=O)C(F)(F)F	{16: 3, 28: 1, 35: 1, 4: 1, 14: 4}
Did not match all atoms present	96293-17-3	C1C[C@H](N(C1)CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(=O)C4=CC=CC=C4	{33: 1, 2: 1, 11: 3, 12: 1, 14: 14, 24: 2, 31: 1}
Did not match all atoms present	96294-10-9	C(CO)O.C(C(CO)(CO)CO)O.C(=C/C(=O)O)\C(=O)O.N	{20: 6, 2: 6, 27: 2, 4: 1, 6: 2}
Did not match all atoms present	96294-13-2	[Li+].CC1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)N=NC3=CC4=C(C=C(C=C4C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[K+]	{1: 2, 34: 4, 14: 16, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	96294-14-3	[Li+].CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[K+].[K+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	963-07-5	CCC(CN(C)C)(CN(C)C)OC(=O)C1=CC=CC=C1	{1: 5, 2: 3, 4: 1, 33: 2, 14: 5, 28: 1}
Did not match all atoms present	963-14-4	CCOC1=NN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N	{1: 1, 2: 1, 35: 2, 14: 6, 22: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	963-34-8	CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)N)C	{1: 2, 35: 1, 33: 1, 14: 7, 25: 1, 30: 1}
Did not match all atoms present	963-39-3	C1C(=O)N=C2C=CC(=CC2=C(N1O)C3=CC=CC=C3)Cl	{33: 1, 35: 1, 11: 1, 14: 8, 15: 1, 17: 1, 20: 1, 25: 1}
Did not match all atoms present	963-89-3	CC1=CC2=C(C=C1)N=C3C(=C2C)C=CC4=CC=CC=C43	{1: 2, 35: 1, 14: 9}
Did not match all atoms present	96328-91-5	CCC(CO)(CO)CO.CC(C)C1=CC(=CC(=C1N=C=NC2=C(C=C(C=C2C(C)C)O)C(C)C)C(C)C)O.C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCCO)CCO.C(CCO)CO.C(=O)(Cl)Cl	{1: 9, 2: 15, 3: 4, 4: 1, 8: 3, 11: 5, 34: 4, 14: 12, 17: 2, 20: 7, 21: 2, 24: 1, 28: 1, 29: 2}
Did not match all atoms present	96363-20-1	CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=C(C=C1)OC	{1: 4, 2: 1, 3: 1, 4: 1, 14: 4, 22: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	96379-76-9	[NH4+].NP(=O)([O-])[O-].NP(=O)([O-])[O-].[Al+3]	{29: 6, 30: 2}
Did not match all atoms present	964-52-3	CC1=CC(=C(C=C1OC(=O)C)C(C)C)OCCN(C)C.Cl	{1: 6, 2: 2, 3: 1, 33: 1, 14: 2, 17: 1, 22: 1, 28: 1}
Did not match all atoms present	964-53-4	CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C(C)(C)C	{1: 4, 34: 1, 4: 1, 38: 2, 7: 1, 14: 3, 31: 1}
Did not match all atoms present	964-68-1	C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)C(=O)O)C(=O)O	{24: 1, 27: 2, 14: 8}
Did not match all atoms present	96402-49-2	C1=CC=C2C(=C1)C=CC=C2C[C@@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35	{2: 2, 3: 1, 12: 1, 14: 15, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	96424-97-4	CCOC(=O)ON=C(C)C(=O)C1=CC=CC=C1	{1: 2, 2: 1, 7: 1, 34: 1, 14: 5, 24: 1}
Did not match all atoms present	96440-80-1	CC1=CC(=NN1)C(C)(C)C	{32: 1, 1: 4, 35: 1, 4: 1, 14: 1}
Did not match all atoms present	96446-42-3	CC1=CC(=C(C=C1N=NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)NC(=O)NC4=CC(=C(C=C4C)N=NC5=CC6=C(C=C(C=C6C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])OC.[Na+].[Na+].[Na+].[Na+]	{1: 4, 34: 4, 14: 14, 22: 2, 24: 1, 29: 12, 31: 2}
Did not match all atoms present	96478-09-0	CC(=C)C(=O)OCCC1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2	{1: 1, 2: 2, 35: 2, 5: 1, 7: 1, 14: 7, 21: 1, 33: 1, 28: 1}
Did not match all atoms present	965-52-6	C1=CC(=CC=C1C(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-])O	{34: 1, 38: 1, 6: 1, 14: 6, 21: 1, 23: 1, 24: 1, 31: 1}
Did not match all atoms present	96525-23-4	CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F	{1: 1, 4: 1, 12: 1, 14: 9, 15: 2, 16: 3, 23: 1, 25: 1, 31: 1}
Did not match all atoms present	96549-95-0	C1=CC2=NN(N=C2C=C1)C3=C(C=CC(=C3)CCO)O	{33: 1, 2: 2, 35: 2, 14: 7, 20: 1, 21: 1}
Did not match all atoms present	96563-06-3	CC1C2=CC=CC=C2C3=CC(=C(C=C13)C)C	{1: 3, 12: 1, 14: 6}
Did not match all atoms present	96568-02-4	C1=C(C(=NC(=C1F)Cl)Cl)C(=O)Cl	{16: 1, 17: 3, 35: 1, 14: 1, 24: 1}
Did not match all atoms present	96591-24-1	C#CC1=CC(=CC=C1)N.C1=CC(=CC(=C1)OC2=CC(=CC=C2)OC3=CC=CC(=C3)N)N.C1=CC2=C(C=C1C(=O)C3=CC4=C(C=C3)C(=O)OC4=O)C(=O)OC2=O	{9: 1, 10: 1, 14: 22, 22: 2, 24: 1, 28: 4, 30: 3}
Did not match all atoms present	966-48-3	CC1=C2C=C(C3=CC=CC=C3C2=CC4=CC=CC=C14)OC	{1: 2, 22: 1, 14: 10}
Did not match all atoms present	966-62-1	C[N+](=C1C=CC2=NC3=C(C=CC4=CC=CC=C43)OC2=C1)C.[Cl-]	{1: 2, 35: 1, 33: 1, 14: 9, 17: 1, 23: 1}
Did not match all atoms present	96606-37-0	C1=C(C=C(C(=C1F)C#N)F)F	{16: 3, 37: 1, 14: 2}
Did not match all atoms present	96607-22-6	Cl[Se+]Cl	{17: 2}
Did not match all atoms present	96617-71-9	CCOC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F	{1: 1, 2: 1, 4: 2, 14: 3, 16: 6, 28: 1}
Did not match all atoms present	96653-51-9	C([C@@H](C1C(=C(C(=O)O1)[O-])O)O)O.C([C@@H](C1C(=C(C(=O)O1)[O-])O)O)O.[Ca+2]	{2: 2, 3: 2, 12: 2, 15: 4, 20: 6, 28: 2}
Did not match all atoms present	96682-10-9	C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3	{2: 1, 28: 2, 14: 14}
Did not match all atoms present	96693-05-9	CCCCCCCCOC1=CC=C(C=C1)Br	{1: 1, 2: 7, 22: 1, 18: 1, 14: 4}
Did not match all atoms present	96741-20-7	CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)[C@H]([C@@H](C=C4)O)O	{1: 1, 12: 2, 14: 9, 20: 2}
Did not match all atoms present	96741-21-8	CC1=C2C(=C3C=C[C@H]([C@@H](C3=C1)O)O)C=CC4=CC=CC=C42	{1: 1, 12: 2, 14: 9, 20: 2}
Did not match all atoms present	96790-40-8	CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)[C@@H]([C@H]([C@H]5[C@@H]4O5)O)O	{1: 1, 23: 1, 12: 4, 14: 7, 20: 2}
Did not match all atoms present	96799-02-9	C1=COC(=C1)C2=CC(=NN2)N	{32: 1, 35: 1, 30: 1, 14: 4, 23: 1}
Did not match all atoms present	96799-03-0	C1=CSC(=C1)C2=CC(=NN2)N	{32: 1, 41: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	968-58-1	C1CCN(CC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)O.Cl	{33: 1, 2: 2, 4: 1, 11: 5, 14: 10, 17: 1, 20: 1}
Did not match all atoms present	968-81-0	CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2CCCCC2	{1: 1, 11: 5, 12: 1, 14: 4, 24: 2, 29: 2, 31: 2}
Did not match all atoms present	96811-96-0	CN(C)CCN(CC1=CC=C[Se]1)C2=CC=CC=N2	{1: 2, 2: 3, 35: 1, 14: 7, 33: 2}
Did not match all atoms present	96826-95-8	CCCC(C)C[O-].CCCC(C)C[O-].[Mg+2]	{1: 4, 2: 6, 3: 2, 29: 2}
Did not match all atoms present	96854-34-1	C1=CC=C(C=C1)[C@H](CCO)O	{2: 2, 3: 1, 20: 2, 14: 5}
Did not match all atoms present	96860-89-8	CCCN1C[C@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)NC(=O)N(CC)CC.C(=C\C(=O)O)\C(=O)O	{32: 1, 1: 3, 2: 4, 6: 2, 33: 2, 11: 3, 12: 3, 14: 4, 24: 1, 27: 2, 31: 1}
Did not match all atoms present	96873-68-6	C1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2)NC3=NC(=NC(=N3)NC4=CC(=C(C=C4)S(=O)(=O)[O-])N=NC5C(=NN(C5=O)C6=CC=C(C=C6)S(=O)(=O)[O-])C(=O)[O-])[N+]7=CC=CC(=C7)C(=O)O)NC8=NC(=NC(=N8)NC9=CC(=C(C=C9)S(=O)(=O)[O-])N=NC1C(=NN(C1=O)C1=CC=C(C=C1)S(=O)(=O)[O-])C(=O)[O-])[N+]1=CC=CC(=C1)C(=O)O.[Na+].[Na+].[Na+].[Na+]	{33: 4, 34: 4, 35: 8, 12: 2, 14: 30, 15: 2, 24: 2, 25: 2, 27: 2, 29: 14, 31: 4}
Did not match all atoms present	969-33-5	CN1CCC(=C2C3=CC=CC=C3C=CC4=CC=CC=C42)CC1.Cl	{1: 1, 33: 1, 11: 4, 14: 10, 15: 2, 17: 1}
Did not match all atoms present	96915-04-7	C1=CC2=CC3=C4C(=CC5=C6C4=C2C(=C1)C=C6C=C5)C=C3	{14: 10}
Did not match all atoms present	97-00-7	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl	{17: 1, 38: 2, 14: 3}
Did not match all atoms present	97-02-9	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N	{38: 2, 30: 1, 14: 3}
Did not match all atoms present	97-04-1	C1=CC(=C(C=C1S(=O)(=O)N)C(=O)O)Cl	{17: 1, 30: 1, 27: 1, 29: 2, 14: 3}
Did not match all atoms present	97-05-2	C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O	{27: 1, 20: 1, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	97-06-3	CC1=C(C=C(C=C1)S(=O)(=O)O)[N+](=O)[O-]	{1: 1, 38: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	97-07-4	CS(=O)(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]	{1: 1, 38: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	97-08-5	C1=CC(=C(C=C1S(=O)(=O)Cl)[N+](=O)[O-])Cl	{17: 2, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	97-09-6	C1=CC(=C(C=C1S(=O)(=O)N)[N+](=O)[O-])Cl	{17: 1, 30: 1, 38: 1, 29: 2, 14: 3}
Did not match all atoms present	97-16-5	C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)Cl	{17: 2, 22: 1, 14: 8, 29: 2}
Did not match all atoms present	97-17-6	CCOP(=S)(OCC)OC1=C(C=C(C=C1)Cl)Cl	{1: 2, 2: 2, 22: 3, 14: 3, 17: 2}
Did not match all atoms present	97-18-7	C1=C(C=C(C(=C1Cl)O)SC2=CC(=CC(=C2O)Cl)Cl)Cl	{40: 1, 17: 4, 21: 2, 14: 4}
Did not match all atoms present	97-23-4	C1=CC(=C(C=C1Cl)CC2=C(C=CC(=C2)Cl)O)O	{17: 2, 2: 1, 21: 2, 14: 6}
Did not match all atoms present	97-24-5	C1=CC(=C(C=C1Cl)SC2=C(C=CC(=C2)Cl)O)O	{40: 1, 17: 2, 21: 2, 14: 6}
Did not match all atoms present	97-29-0	C1=CC(=C(C=C1O)O)SC2=C(C=C(C=C2)O)O	{40: 1, 21: 4, 14: 6}
Did not match all atoms present	97-32-5	COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)[N+](=O)[O-]	{1: 1, 38: 1, 14: 8, 22: 1, 24: 1, 31: 1}
Did not match all atoms present	97-34-7	C1=CC(=CC=C1N)NC2=C(C=C(C=C2)S(=O)(=O)O)N	{30: 2, 20: 1, 29: 2, 14: 7, 31: 1}
Did not match all atoms present	97-35-8	CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)N	{1: 3, 2: 2, 33: 1, 14: 3, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	97-36-9	CC1=CC(=C(C=C1)NC(=O)CC(=O)C)C	{24: 2, 1: 3, 2: 1, 14: 3, 31: 1}
Did not match all atoms present	97-39-2	CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N	{1: 2, 34: 1, 7: 1, 14: 8, 30: 1, 31: 1}
Did not match all atoms present	97-43-8	CC(C)(C)C1=CC(=C(C=C1)O)CN(C)C	{1: 5, 2: 1, 4: 1, 33: 1, 14: 3, 21: 1}
Did not match all atoms present	97-44-9	CC(=O)NC1=C(C=CC(=C1)[As](=O)(O)O)O	{1: 1, 14: 3, 20: 2, 21: 1, 24: 1, 29: 1, 31: 1}
Did not match all atoms present	97-50-7	COC1=CC(=C(C=C1N)Cl)OC	{1: 2, 30: 1, 22: 2, 14: 2, 17: 1}
Did not match all atoms present	97-51-8	C1=CC(=C(C=C1[N+](=O)[O-])C=O)O	{26: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	97-52-9	COC1=C(C=CC(=C1)[N+](=O)[O-])N	{1: 1, 30: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	97-53-0	COC1=C(C=CC(=C1)CC=C)O	{1: 1, 2: 1, 5: 1, 6: 1, 14: 3, 21: 1, 22: 1}
Did not match all atoms present	97-54-1	CC=CC1=CC(=C(C=C1)O)OC	{1: 2, 22: 1, 14: 3, 6: 2, 21: 1}
Did not match all atoms present	97-56-3	CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N)C	{1: 2, 34: 2, 30: 1, 14: 7}
Did not match all atoms present	97-60-9	CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])O	{1: 1, 38: 1, 14: 3, 21: 1, 24: 1, 31: 1}
Did not match all atoms present	97-74-5	CN(C)C(=S)SC(=S)N(C)C	{40: 1, 1: 4, 33: 2, 7: 2}
Did not match all atoms present	97-77-8	CCN(CC)C(=S)SSC(=S)N(CC)CC	{40: 2, 1: 4, 2: 4, 33: 2, 7: 2}
Did not match all atoms present	97-80-3	CCCCCCCCC=CCCCCCCCC(=O)N(C)CCS(=O)(=O)O	{1: 2, 2: 16, 6: 2, 33: 1, 20: 1, 24: 1, 29: 2}
Did not match all atoms present	97-93-8	CC[Al](CC)CC	{1: 3, 2: 3}
Did not match all atoms present	97-94-9	B(CC)(CC)CC	{1: 3, 2: 3}
Did not match all atoms present	970-06-9	C1=CC=C(C=C1)C2=CC3=C(C=CC=C3C4=CC=CC=C4)C=C2	{14: 16}
Did not match all atoms present	97043-02-2	CCOCC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC	{1: 5, 2: 2, 40: 1, 11: 2, 12: 1, 14: 4, 22: 4, 24: 1, 25: 1, 31: 1}
Did not match all atoms present	97066-74-5	[Po+5]	{}
Did not match all atoms present	971-60-8	C[N+](C)(C)CCCCCC[N+](C)(C)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-]	{1: 6, 2: 6, 29: 6, 14: 10}
Did not match all atoms present	971-74-4	CN1CC(=O)N=C1N.C1=CC2=C(C=C1O)C(=CN2)CCN.OS(=O)(=O)O	{32: 1, 1: 1, 2: 2, 35: 1, 33: 1, 11: 1, 14: 4, 15: 1, 20: 2, 21: 1, 25: 1, 29: 2, 30: 2}
Did not match all atoms present	97126-35-7	C(#N)[S-].C(#N)[S-].O.[Co+2]	{37: 2}
Did not match all atoms present	97135-96-1	CCN\1C2=CC=CC=C2S/C1=C\C(=C/3\C(=O)N(C(=S)O3)CCS(=O)(=O)O)\C	{1: 2, 2: 3, 33: 2, 6: 1, 7: 1, 41: 1, 14: 4, 15: 3, 20: 1, 23: 1, 25: 1, 29: 2}
Did not match all atoms present	97148-39-5	CO/N=C(/C1=CC=CO1)\C(=O)[O-].[NH4+]	{1: 1, 34: 1, 7: 1, 14: 3, 22: 1, 23: 1, 24: 1}
Did not match all atoms present	97158-56-0	CC(=O)NC1=C(C=CC(=C1)NC2=NC(=NC(=N2)NC3=CC4=C(C(=O)/C(=N\NC5=CC=CC=C5C(=O)O)/C(=C4)S(=O)(=O)O)C=C3)[N+]6=CC=CC(=C6)C(=O)O)N=NC7=CC(=C8C(=C7)C(=CC=C8)S(=O)(=O)O)S(=O)(=O)O.CC(=O)NC1=C(C=CC(=C1)NC2=NC(=NC(=N2)NC3=CC4=C(C(=O)/C(=N\NC5=CC=CC=C5C(=O)O)/C(=C4)S(=O)(=O)O)C=C3)[N+]6=CC=CC(=C6)C(=O)O)N=NC7=CC(=C8C(=C7)C(=CC=C8)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Cr]	{1: 2, 34: 6, 35: 6, 33: 2, 14: 40, 15: 4, 20: 6, 24: 2, 25: 2, 27: 4, 29: 12, 31: 8}
Did not match all atoms present	97170-07-5	CC1=CC2=CC=CC=C2C3=C1C4=C(C=C3)[C@@H]([C@@H]([C@H]5[C@@H]4O5)O)O	{1: 1, 23: 1, 12: 4, 14: 7, 20: 2}
Did not match all atoms present	97170-08-6	CC1=C2C(=C3[C@@H]4[C@@H](O4)[C@@H]([C@H](C3=C1)O)O)C=CC5=CC=CC=C52	{1: 1, 23: 1, 12: 4, 14: 7, 20: 2}
Did not match all atoms present	97170-41-7	CC(C(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3)O	{1: 3, 2: 2, 3: 1, 33: 1, 7: 2, 14: 14, 20: 1, 22: 1}
Did not match all atoms present	972-02-1	C1CCN(CC1)CCCC(C2=CC=CC=C2)(C3=CC=CC=C3)O	{33: 1, 2: 3, 4: 1, 11: 5, 14: 10, 20: 1}
Did not match all atoms present	97205-34-0	C1C(CN(C1=O)CC2=CC=CC=C2)CN	{33: 1, 2: 2, 11: 2, 12: 1, 14: 5, 25: 1, 30: 1}
Did not match all atoms present	97245-28-8	C1=CC(=CC=C1C(=O)C(=O)C(=O)C(=O)C2=CC=C(C=C2)F)F	{16: 2, 24: 4, 14: 8}
Did not match all atoms present	97290-59-0	CC=CN=CC1=CC=CC=C1	{1: 1, 34: 1, 14: 5, 6: 3}
Did not match all atoms present	973-21-7	CCC(C)C1=CC(=CC(=C1OC(=O)OC(C)C)[N+](=O)[O-])[N+](=O)[O-]	{1: 4, 2: 1, 3: 2, 38: 2, 14: 2}
Did not match all atoms present	973-99-9	CCCSS/C(=C(/C)\N(CC1=CN=C(N=C1N)C)C=O)/CCO.Cl	{1: 3, 2: 5, 35: 2, 33: 1, 7: 2, 40: 2, 14: 1, 17: 1, 20: 1, 26: 1, 30: 1}
Did not match all atoms present	97375-45-6	CCCCC(CC)CNCCCN.CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4	{1: 4, 2: 10, 3: 1, 4: 1, 11: 2, 12: 2, 14: 8, 22: 2, 23: 2, 30: 1, 31: 1}
Did not match all atoms present	97375-48-9	CC1=CC=C(C=C1)OCCOC	{1: 2, 2: 2, 22: 2, 14: 4}
Did not match all atoms present	97384-48-0	CC(CC1=CC=CC=C1)(C=C)C#N	{1: 1, 2: 1, 4: 1, 5: 1, 6: 1, 14: 5, 37: 1}
Did not match all atoms present	97392-71-7	CCCCCCCCCCCCCC(C1=CC=CC=C1)C2=CC=CC=C2	{1: 1, 2: 12, 3: 1, 14: 10}
Did not match all atoms present	97393-00-5	CCCCC(CC)COC(=O)C=C.CC1=CC=CC=C1C=C.C=CC1=CC=CC=C1	{1: 3, 2: 5, 3: 1, 5: 3, 6: 3, 14: 9, 28: 1}
Did not match all atoms present	974-29-8	C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)N4C=NC=N4	{33: 1, 35: 2, 14: 17}
Did not match all atoms present	974-68-5	CN(C)P1(=NP(=NP(=N1)(N(C)C)N(C)C)(N(C)C)N(C)C)N(C)C	{1: 12, 35: 3, 33: 6}
Did not match all atoms present	97412-23-2	C/C=C\C1=CC(=C(C=C1)OC(=O)C)OC	{1: 3, 22: 1, 28: 1, 14: 3, 6: 2}
Did not match all atoms present	97434-75-8	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC4=NC(=NC(=N4)NC5=C6C(=C7C(=C5)C(=O)C8=C(N7)C=CC(=C8)Br)C(=O)C9=CC=CC=C9C6=O)NC1=C2C(=C3C(=C1)C(=O)C1=C(N3)C=CC(=C1)Br)C(=O)C1=CC=CC=C1C2=O	{32: 2, 35: 3, 14: 23, 18: 2, 25: 8, 31: 3}
Did not match all atoms present	97460-76-9	CCCCN(CCC1=CC=CC=C1)C2=CC=C(C=C2)C(=C(C#N)C#N)C#N	{1: 1, 2: 5, 37: 3, 33: 1, 7: 2, 14: 9}
Did not match all atoms present	97461-15-9	CCN(CC1=CC=CC=C1)C2=CC(=C(C=C2)C=C(C#N)C#N)C	{1: 2, 2: 2, 37: 2, 6: 1, 33: 1, 7: 1, 14: 8}
Did not match all atoms present	97464-54-5	CC1(CC2(CC(C3=C2C=C(C=C3)O)(C)C)C4=C1C=CC(=C4)O)C.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C(=O)(Cl)Cl	{1: 6, 4: 1, 11: 2, 13: 3, 14: 14, 17: 2, 21: 4, 24: 1}
Did not match all atoms present	97526-58-4	CCCCCCCCCCOC(=O)CCCC(=O)[O-]	{24: 1, 1: 1, 2: 12, 28: 1}
Did not match all atoms present	976-56-7	CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)OCC	{1: 8, 2: 3, 4: 2, 14: 2, 21: 1, 22: 2, 29: 1}
Did not match all atoms present	97600-39-0	CCOC(=O)COC1=C2CC3=CC(=CC(=C3OCC(=O)OCC)CC4=C(C(=CC(=C4)C(C)(C)C)CC5=C(C(=CC(=C5)C(C)(C)C)CC1=CC(=C2)C(C)(C)C)OCC(=O)OCC)OCC(=O)OCC)C(C)(C)C	{1: 16, 2: 8, 4: 4, 11: 4, 14: 8, 22: 4, 28: 4}
Did not match all atoms present	97629-28-2	CC1=C(C(=C(C=C1N)[N+](=O)[O-])N)C	{1: 2, 38: 1, 30: 2, 14: 1}
Did not match all atoms present	97674-02-7	CCCC[Sn](CCCC)(CCCC)C(=C)OCC	{1: 4, 2: 10, 5: 1, 22: 1, 7: 1}
Did not match all atoms present	97683-81-3	CC(C)(C)N1[Si](N([Sn]1(C)C)C(C)(C)C)(C)C	{1: 10, 4: 2, 33: 2}
Did not match all atoms present	977-96-8	CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41	{1: 2, 2: 2, 6: 1, 33: 2, 14: 12, 15: 1}
Did not match all atoms present	97702-94-8	CCN(CC)CC(=O)N(CC)C(C)COC1=C(C=C(C=C1C)C)C.Cl	{1: 7, 2: 5, 3: 1, 33: 2, 14: 2, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	97702-95-9	CCN(CC)CC(=O)N(CC)C(C)COC1=CC=C(C=C1)OC.Cl	{1: 5, 2: 5, 3: 1, 33: 2, 14: 4, 17: 1, 22: 2, 24: 1}
Did not match all atoms present	97702-97-1	CCN(CC)CC(=O)N(CC)C(C)COC1=CC=CC=C1.Cl	{1: 4, 2: 5, 3: 1, 33: 2, 14: 5, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	97702-98-2	CCN(CC)CC(=O)N(CC)C(C)COC1=C(C=C(C=C1)C)C.Cl	{1: 6, 2: 5, 3: 1, 33: 2, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	97702-99-3	CCN(CC)CC(=O)N(CC)C(C)COC1=CC(=CC(=C1)C)C.Cl	{1: 6, 2: 5, 3: 1, 33: 2, 14: 3, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	97703-02-1	CCN(CC)CC(=O)N(C)C(C)COC1=C(C=C(C=C1C)C)C.Cl	{1: 7, 2: 4, 3: 1, 33: 2, 14: 2, 17: 1, 22: 1, 24: 1}
Did not match all atoms present	97703-04-3	CCN(CC)CC(=O)N(C)C(C)COC1=CC=C(C=C1)OC.Cl	{1: 5, 2: 4, 3: 1, 33: 2, 14: 4, 17: 1, 22: 2, 24: 1}
Did not match all atoms present	97703-11-2	CC[NH+](CC)CC(=O)N(C)CCCC1=CC=CC=C1.[Cl-]	{1: 3, 2: 6, 33: 1, 14: 5, 17: 1, 24: 1}
Did not match all atoms present	97775-49-0	[OH-].[OH-].[OH-].[OH-].[Cr+3]	{}
Did not match all atoms present	97780-06-8	CCOC1=NC(=NC(=N1)NC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC	{1: 3, 2: 1, 35: 3, 14: 4, 22: 1, 24: 1, 28: 1, 29: 2, 31: 3}
Did not match all atoms present	978-86-9	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)O	{4: 1, 21: 1, 14: 19}
Did not match all atoms present	97801-05-3	CC1=NC=CN1C(C)CO	{1: 2, 2: 1, 3: 1, 33: 1, 14: 2, 35: 1, 20: 1}
Did not match all atoms present	97805-00-0	COC1=C(C=C(C=C1)C(=O)NCC(=O)NO)OC	{1: 2, 2: 1, 14: 3, 20: 1, 22: 2, 24: 2, 31: 2}
Did not match all atoms present	97845-62-0	C1=NC2=C(N1CCC(CO)C[O-])NC(=NC2=O)N.[Na+]	{32: 1, 33: 1, 2: 4, 3: 1, 14: 1, 35: 2, 20: 1, 25: 1, 29: 1, 30: 1}
Did not match all atoms present	97864-38-5	C[NH+](C)CCCN1C2=CC(=C(C=C2N=C3C1=NC(=O)NC3=O)Cl)Cl.[Cl-]	{32: 1, 1: 2, 2: 3, 35: 2, 33: 1, 14: 2, 17: 3, 25: 2}
Did not match all atoms present	97886-45-8	CC(C)CC1=C(C(=NC(=C1C(=O)SC)C(F)(F)F)C(F)F)C(=O)SC	{1: 4, 2: 1, 3: 2, 4: 1, 40: 2, 16: 5, 35: 1, 24: 2}
Did not match all atoms present	97888-80-7	CC1=CC(=CC(=C1OCC2=CC=CC=C2)C)C(=O)O	{1: 2, 2: 1, 27: 1, 22: 1, 14: 7}
Did not match all atoms present	979-32-8	CCCCC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)O)C	{1: 2, 2: 3, 11: 6, 12: 4, 13: 1, 14: 3, 21: 1, 28: 1}
Did not match all atoms present	97901-22-9	C1CC2=C(CC1CN3C=CN=C3)C=CC(=C2)C(=O)O.Cl	{33: 1, 2: 1, 35: 1, 11: 3, 12: 1, 14: 6, 17: 1, 27: 1}
Did not match all atoms present	97902-52-8	CC(C)C1=C(C=CC(=C1)N)N	{1: 2, 3: 1, 30: 2, 14: 3}
Did not match all atoms present	97903-70-3	COC1=C(C=C(C=C1)S(=O)(=O)F)S(=O)(=O)Cl	{1: 1, 14: 3, 16: 1, 17: 1, 22: 1, 29: 4}
Did not match all atoms present	97919-22-7	C1=CC2=NC(=CN=C2C(=C1)Cl)NS(=O)(=O)C3=CC=C(C=C3)N	{35: 2, 14: 8, 17: 1, 29: 2, 30: 1, 31: 1}
Did not match all atoms present	97925-92-3	C1=CC=C(C=C1)N.C1=CC=C(C=C1)[N+](=O)[O-].C1=CC=C(C=C1)S(=O)(=O)O	{30: 1, 38: 1, 20: 1, 29: 2, 14: 15}
Did not match all atoms present	97931-20-9	CCP(=O)(OC(C)C(C)(C)C)F	{1: 5, 2: 1, 3: 1, 4: 1, 16: 1, 22: 1, 29: 1}
Did not match all atoms present	97945-19-2	C1C=CC[C@H]([C@H]1C(=O)[O-])[NH3+]	{24: 1, 11: 2, 12: 2, 14: 2}
Did not match all atoms present	97945-32-9	CN1C(=CN=C1/C=C/2\CC3CCC2C3)[N+](=O)[O-]	{1: 1, 35: 1, 38: 1, 6: 1, 33: 1, 11: 4, 12: 2, 14: 1, 15: 1}
Did not match all atoms present	97993-27-6	C[Si](C)(C)OC1=CC=C(C=C1)CC2=CC=CC=C2O[Si](C)(C)C	{1: 6, 2: 1, 22: 2, 14: 8}
Did not match all atoms present	97998-55-5	CC(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)C(C)C)C2)O)C(C)C)C(C)C)O	{11: 4, 1: 8, 3: 4, 21: 4, 14: 8}
Did not match all atoms present	98-00-0	C1=COC(=C1)CO	{2: 1, 20: 1, 14: 3, 23: 1}
Did not match all atoms present	98-01-1	C1=COC(=C1)C=O	{26: 1, 14: 3, 23: 1}
Did not match all atoms present	98-02-2	C1=COC(=C1)CS	{2: 1, 39: 1, 14: 3, 23: 1}
Did not match all atoms present	98-03-3	C1=CSC(=C1)C=O	{41: 1, 26: 1, 14: 3}
Did not match all atoms present	98-04-4	C[N+](C)(C)C1=CC=CC=C1.[I-]	{1: 3, 19: 1, 14: 5}
Did not match all atoms present	98-05-5	C1=CC=C(C=C1)[As](=O)(O)O	{20: 2, 29: 1, 14: 5}
Did not match all atoms present	98-06-6	CC(C)(C)C1=CC=CC=C1	{1: 3, 4: 1, 14: 5}
Did not match all atoms present	98-07-7	C1=CC=C(C=C1)C(Cl)(Cl)Cl	{17: 3, 4: 1, 14: 5}
Did not match all atoms present	98-08-8	C1=CC=C(C=C1)C(F)(F)F	{16: 3, 4: 1, 14: 5}
Did not match all atoms present	98-09-9	C1=CC=C(C=C1)S(=O)(=O)Cl	{17: 1, 29: 2, 14: 5}
Did not match all atoms present	98-10-2	C1=CC=C(C=C1)S(=O)(=O)N	{30: 1, 29: 2, 14: 5}
Did not match all atoms present	98-11-3	C1=CC=C(C=C1)S(=O)(=O)O	{20: 1, 29: 2, 14: 5}
Did not match all atoms present	98-12-4	C1CCC(CC1)[Si](Cl)(Cl)Cl	{17: 3, 11: 5, 12: 1}
Did not match all atoms present	98-13-5	C1=CC=C(C=C1)[Si](Cl)(Cl)Cl	{17: 3, 14: 5}
Did not match all atoms present	98-14-6	C1=CC(=CC=C1O)[As](=O)(O)O	{20: 2, 21: 1, 14: 4, 29: 1}
Did not match all atoms present	98-15-7	C1=CC(=CC(=C1)Cl)C(F)(F)F	{16: 3, 17: 1, 4: 1, 14: 4}
Did not match all atoms present	98-16-8	C1=CC(=CC(=C1)N)C(F)(F)F	{16: 3, 4: 1, 30: 1, 14: 4}
Did not match all atoms present	98-17-9	C1=CC(=CC(=C1)O)C(F)(F)F	{16: 3, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	98-18-0	C1=CC(=CC(=C1)S(=O)(=O)N)N	{30: 2, 29: 2, 14: 4}
Did not match all atoms present	98-19-1	CC1=CC(=CC(=C1)C(C)(C)C)C	{1: 5, 4: 1, 14: 3}
Did not match all atoms present	98-23-7	CC1=CC(=CC(=C1C)C)C(C)(C)C	{1: 6, 4: 1, 14: 2}
Did not match all atoms present	98-25-9	CC1=C(C=C(C=C1N)S(=O)(=O)O)N	{1: 1, 30: 2, 20: 1, 29: 2, 14: 2}
Did not match all atoms present	98-27-1	CC1=C(C=CC(=C1)C(C)(C)C)O	{1: 4, 4: 1, 21: 1, 14: 3}
Did not match all atoms present	98-28-2	CC(C)(C)C1=CC(=C(C=C1)O)Cl	{1: 3, 4: 1, 21: 1, 14: 3, 17: 1}
Did not match all atoms present	98-29-3	CC(C)(C)C1=CC(=C(C=C1)O)O	{1: 3, 4: 1, 21: 2, 14: 3}
Did not match all atoms present	98-30-6	CS(=O)(=O)C1=CC(=C(C=C1)O)N	{1: 1, 30: 1, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	98-31-7	C1=CC(=C(C=C1S(=O)(=O)Cl)Cl)Cl	{17: 3, 29: 2, 14: 3}
Did not match all atoms present	98-32-8	C1=CC(=C(C=C1S(=O)(=O)N)N)O	{30: 2, 21: 1, 14: 3, 29: 2}
Did not match all atoms present	98-33-9	CC1=C(C=CC(=C1)S(=O)(=O)O)N	{1: 1, 30: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	98-34-0	CC1=C(C=C(C=C1)S(=O)(=O)O)Cl	{1: 1, 20: 1, 29: 2, 14: 3, 17: 1}
Did not match all atoms present	98-35-1	C1=CC(=C(C=C1S(=O)(=O)O)Cl)N	{17: 1, 30: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	98-36-2	C1=CC(=C(C=C1S(=O)(=O)O)N)Cl	{17: 1, 30: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	98-42-0	COC1=C(C=C(C=C1)S(=O)(=O)O)N	{1: 1, 14: 3, 20: 1, 22: 1, 29: 2, 30: 1}
Did not match all atoms present	98-43-1	C1=CC(=C(C=C1S(=O)(=O)O)N)C(=O)O	{30: 1, 27: 1, 20: 1, 29: 2, 14: 3}
Did not match all atoms present	98-44-2	C1=CC(=C(C=C1S(=O)(=O)O)N)S(=O)(=O)O	{30: 1, 20: 2, 29: 4, 14: 3}
Did not match all atoms present	98-46-4	C1=CC(=CC(=C1)[N+](=O)[O-])C(F)(F)F	{16: 3, 4: 1, 38: 1, 14: 4}
Did not match all atoms present	98-47-5	C1=CC(=CC(=C1)S(=O)(=O)O)[N+](=O)[O-]	{38: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	98-48-6	C1=CC(=CC(=C1)S(=O)(=O)O)S(=O)(=O)O	{20: 2, 29: 4, 14: 4}
Did not match all atoms present	98-49-7	CC(C)C1=CC=C(C=C1)C(C)(C)OO	{1: 4, 3: 1, 4: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	98-50-0	C1=CC(=CC=C1N)[As](=O)(O)O	{30: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	98-51-1	CC1=CC=C(C=C1)C(C)(C)C	{1: 4, 4: 1, 14: 4}
Did not match all atoms present	98-54-4	CC(C)(C)C1=CC=C(C=C1)O	{1: 3, 4: 1, 21: 1, 14: 4}
Did not match all atoms present	98-56-6	C1=CC(=CC=C1C(F)(F)F)Cl	{16: 3, 17: 1, 4: 1, 14: 4}
Did not match all atoms present	98-57-7	CS(=O)(=O)C1=CC=C(C=C1)Cl	{1: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	98-58-8	C1=CC(=CC=C1S(=O)(=O)Cl)Br	{17: 1, 18: 1, 29: 2, 14: 4}
Did not match all atoms present	98-59-9	CC1=CC=C(C=C1)S(=O)(=O)Cl	{1: 1, 29: 2, 14: 4, 17: 1}
Did not match all atoms present	98-60-2	C1=CC(=CC=C1S(=O)(=O)Cl)Cl	{17: 2, 29: 2, 14: 4}
Did not match all atoms present	98-61-3	C1=CC(=CC=C1S(=O)(=O)Cl)I	{17: 1, 19: 1, 29: 2, 14: 4}
Did not match all atoms present	98-62-4	C1=CC(=CC=C1N)S(=O)(=O)F	{16: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	98-64-6	C1=CC(=CC=C1S(=O)(=O)N)Cl	{17: 1, 30: 1, 29: 2, 14: 4}
Did not match all atoms present	98-66-8	C1=CC(=CC=C1S(=O)(=O)O)Cl	{17: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	98-67-9	C1=CC(=CC=C1O)S(=O)(=O)O	{20: 1, 21: 1, 14: 4, 29: 2}
Did not match all atoms present	98-68-0	COC1=CC=C(C=C1)S(=O)(=O)Cl	{1: 1, 29: 2, 22: 1, 14: 4, 17: 1}
Did not match all atoms present	98-69-1	CCC1=CC=C(C=C1)S(=O)(=O)O	{1: 1, 2: 1, 20: 1, 29: 2, 14: 4}
Did not match all atoms present	98-70-4	C=CC1=CC=C(C=C1)S(=O)(=O)O	{14: 4, 20: 1, 5: 1, 6: 1, 29: 2}
Did not match all atoms present	98-71-5	C1=CC(=CC=C1NN)S(=O)(=O)O	{30: 1, 20: 1, 29: 2, 14: 4, 31: 1}
Did not match all atoms present	98-72-6	C1=CC(=CC=C1[N+](=O)[O-])[As](=O)(O)O	{38: 1, 20: 2, 29: 1, 14: 4}
Did not match all atoms present	98-73-7	CC(C)(C)C1=CC=C(C=C1)C(=O)O	{1: 3, 27: 1, 4: 1, 14: 4}
Did not match all atoms present	98-74-8	C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)Cl	{17: 1, 38: 1, 29: 2, 14: 4}
Did not match all atoms present	98-80-6	B(C1=CC=CC=C1)(O)O	{20: 2, 14: 5}
Did not match all atoms present	98-81-7	C=C(C1=CC=CC=C1)Br	{18: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	98-82-8	CC(C)C1=CC=CC=C1	{1: 2, 3: 1, 14: 5}
Did not match all atoms present	98-83-9	CC(=C)C1=CC=CC=C1	{1: 1, 5: 1, 14: 5, 7: 1}
Did not match all atoms present	98-85-1	CC(C1=CC=CC=C1)O	{1: 1, 3: 1, 20: 1, 14: 5}
Did not match all atoms present	98-86-2	CC(=O)C1=CC=CC=C1	{24: 1, 1: 1, 14: 5}
Did not match all atoms present	98-87-3	C1=CC=C(C=C1)C(Cl)Cl	{17: 2, 3: 1, 14: 5}
Did not match all atoms present	98-88-4	C1=CC=C(C=C1)C(=O)Cl	{24: 1, 17: 1, 14: 5}
Did not match all atoms present	98-91-9	C1=CC=C(C=C1)C(=O)S	{24: 1, 14: 5, 39: 1}
Did not match all atoms present	98-92-0	C1=CC(=CN=C1)C(=O)N	{24: 1, 35: 1, 30: 1, 14: 4}
Did not match all atoms present	98-95-3	C1=CC=C(C=C1)[N+](=O)[O-]	{38: 1, 14: 5}
Did not match all atoms present	98-96-4	C1=CN=C(C=N1)C(=O)N	{24: 1, 35: 2, 30: 1, 14: 3}
Did not match all atoms present	98-97-5	C1=CN=C(C=N1)C(=O)O	{35: 2, 27: 1, 14: 3}
Did not match all atoms present	98-98-6	C1=CC=NC(=C1)C(=O)O	{35: 1, 27: 1, 14: 4}
Did not match all atoms present	980-26-7	CC1=CC2=C(C=C1)NC3=CC4=C(C=C3C2=O)NC5=C(C4=O)C=C(C=C5)C	{32: 2, 1: 2, 14: 8, 25: 2}
Did not match all atoms present	980-71-2	CN(C)CCC(C1=CC=C(C=C1)Br)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O	{1: 2, 2: 2, 3: 1, 6: 2, 33: 1, 14: 8, 18: 1, 35: 1, 27: 2}
Did not match all atoms present	98015-45-3	CCN(CC)P1(=NC(C)(C)C)N(CCCN1C)C	{1: 7, 2: 2, 4: 1, 33: 3, 11: 3, 34: 1}
Did not match all atoms present	98041-44-2	C1=CC=C(C(=C1)N=C=S)I	{8: 1, 34: 1, 19: 1, 14: 4}
Did not match all atoms present	98041-69-1	C1=CC(=C(C=C1Br)Cl)N=C=S	{8: 1, 17: 1, 18: 1, 34: 1, 14: 3}
Did not match all atoms present	98046-72-1	CC1=CC=CN2C1=NC3=C2NCC(=C3C)N=O	{32: 1, 1: 2, 34: 1, 35: 1, 33: 1, 11: 1, 14: 3, 15: 2, 29: 1}
Did not match all atoms present	98046-73-2	C1C(=CC2=C(N1)N3C=CC=CC3=N2)N=O	{32: 1, 33: 1, 34: 1, 35: 1, 11: 1, 14: 5, 15: 1, 29: 1}
Did not match all atoms present	98085-64-4	CC(=C)C=C.C=CC1=CC=CC=C1.C1CC=CC1	{1: 1, 5: 3, 6: 2, 7: 1, 11: 3, 14: 7}
Did not match all atoms present	981-18-0	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N=NC4=CC=CC=C4	{34: 2, 4: 1, 14: 20}
Did not match all atoms present	981-40-8	CC(C)(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3	{1: 3, 4: 1, 22: 3, 14: 14, 29: 1}
Did not match all atoms present	98114-59-1	C(N=N)[O-].[K+]	{2: 1, 34: 1, 36: 1, 29: 1}
Did not match all atoms present	98140-03-5	CCNC1=C(C(=NC=N1)Cl)N	{1: 1, 2: 1, 35: 2, 14: 1, 17: 1, 30: 1, 31: 1}
Did not match all atoms present	98150-59-5	[CH-]1[CH-][CH-][C-]([CH-]1)SCCCS[C-]2C=CC=C2.[Fe]	{40: 2, 2: 3, 14: 8}
Did not match all atoms present	98150-60-8	[CH-]1[CH-][CH-][C-]([CH-]1)SCCCCS[C-]2C=CC=C2.[Fe]	{40: 2, 2: 4, 14: 8}
Did not match all atoms present	98150-61-9	[CH-]1[CH-][CH-][C-]([CH-]1)SCCCCCS[C-]2C=CC=C2.[Fe]	{40: 2, 2: 5, 14: 8}
Did not match all atoms present	98150-62-0	[CH-]1[CH-][CH-][C-]([CH-]1)SCCCCCCS[C-]2C=CC=C2.[Fe]	{40: 2, 2: 6, 14: 8}
Did not match all atoms present	98151-91-8	C1=CC2=C([C@@H]([C@H]1O)O)C3=C4C(=C2)C=CC5=C(C=CC(=C54)C=C3)[N+](=O)[O-]	{20: 2, 12: 2, 38: 1, 14: 9}
Did not match all atoms present	98184-17-9	CC1=C(C=C(C=C1C(C)C)Cl)C(C)C	{1: 5, 3: 2, 14: 2, 17: 1}
Did not match all atoms present	98184-18-0	CC1=CC(=C(C=C1C(C)C)Cl)C(C)C	{1: 5, 3: 2, 14: 2, 17: 1}
Did not match all atoms present	98184-19-1	CC1=CC(=C(C(=C1)C(C)C)Cl)C(C)C	{1: 5, 3: 2, 14: 2, 17: 1}
Did not match all atoms present	98195-03-0	C[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)S	{1: 9, 4: 1, 39: 1}
Did not match all atoms present	98198-48-2	CC1=CC(=NC=C1Br)N	{1: 1, 18: 1, 35: 1, 30: 1, 14: 2}
Did not match all atoms present	982-43-4	C1CCN(CC1)CCC2=NC(=NO2)CC(C3=CC=CC=C3)C4=CC=CC=C4.Cl	{33: 1, 2: 3, 3: 1, 11: 5, 14: 10, 17: 1, 35: 2, 23: 1}
Did not match all atoms present	982-57-0	C1=CC(=CC=C1C(C(COC(=O)CCC(=O)[O-])NC(=O)C(Cl)Cl)O)[N+](=O)[O-].[Na+]	{2: 3, 3: 3, 38: 1, 14: 4, 17: 2, 20: 1, 24: 2, 28: 1, 31: 1}
Did not match all atoms present	98203-04-4	C1=CC2=C(C=CC(=C2[N+](=O)[O-])Br)N=C1	{18: 1, 35: 1, 38: 1, 14: 5}
Did not match all atoms present	98231-71-1	C(COCCS(=O)(=O)CCCl)N.Cl	{17: 2, 2: 6, 30: 1, 29: 2, 22: 1}
Did not match all atoms present	98257-47-7	CC1CC2=C(C1=O)C=CC(=C2)[O-].[Na+]	{1: 1, 11: 1, 12: 1, 14: 3, 25: 1}
Did not match all atoms present	98258-72-1	COC(=O)C1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2	{24: 1, 1: 1, 28: 1, 14: 9, 6: 2}
Did not match all atoms present	98266-33-2	CC(C)(C)OC(=O)N[C@H](CC1=CN=CC=C1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 14: 4, 35: 1, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	98271-51-3	CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCCCC4	{1: 1, 2: 3, 33: 2, 41: 1, 11: 5, 14: 7, 24: 1}
Did not match all atoms present	983-79-9	C1=CC=C(C=C1)C(=NN=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{34: 2, 14: 20, 7: 2}
Did not match all atoms present	983-80-2	C1=CC=C(C=C1)P(/C=C\P(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{14: 20, 6: 2}
Did not match all atoms present	983-81-3	C1=CC=C(C=C1)P(C=CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4	{14: 20, 6: 2}
Did not match all atoms present	98349-22-5	C1=C(C(=CC(=C1F)F)F)C#N	{16: 3, 37: 1, 14: 2}
Did not match all atoms present	98362-33-5	CC1=CC=C(C=C1)S(=O)(=O)O.CC(C)(C)CCCCCC(=O)OCC1CO1	{1: 4, 2: 6, 4: 1, 11: 1, 12: 1, 14: 4, 20: 1, 23: 1, 28: 1, 29: 2}
Did not match all atoms present	98459-16-6	C1CCC2=C(C3=CC=CC=C3N=C2CC1)N4CCN(CC4)C5=CC=CC=C5.Cl.Cl	{17: 2, 11: 9, 35: 1, 14: 9, 33: 2}
Did not match all atoms present	98546-51-1	B(C1=CC=C(C=C1)SC)(O)O	{40: 1, 1: 1, 20: 2, 14: 4}
Did not match all atoms present	98565-18-5	CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=C(C=C2)O)C(=O)N[C@H]3[C@@H]4N(C3=O)C(=C(CS4)CSC5=NN=NN5C)C(=O)O.CC1([C@@H](N2[C@H](S1(=O)=O)CC2=O)C(=O)O)C	{1: 4, 2: 2, 3: 1, 33: 5, 40: 1, 41: 1, 11: 4, 12: 4, 13: 1, 14: 4, 15: 2, 35: 3, 21: 1, 24: 2, 25: 4, 27: 2, 29: 2, 31: 2}
Did not match all atoms present	98569-12-1	CC(C)(C)OC(=O)NC1(CCC2=CC=CC=C2C1)C(=O)O	{1: 3, 4: 1, 11: 3, 13: 1, 14: 4, 27: 1, 28: 1, 31: 1}
Did not match all atoms present	98583-25-6	C1(=C(C(=C(C(=C1F)F)N=[N+](C2=C(C(=C(C(=C2F)F)C(F)(F)F)F)F)[O-])F)F)C(F)(F)F	{16: 14, 33: 1, 34: 1, 4: 2, 29: 1}
Did not match all atoms present	98583-27-8	C1=CC(=C(C=C1F)F)N=[N+](C2=C(C=C(C=C2)F)F)[O-]	{16: 4, 33: 1, 34: 1, 29: 1, 14: 6}
Did not match all atoms present	98583-30-3	C1(=C(C(=C(C(=C1F)F)Br)F)F)N=NC2=C(C(=C(C(=C2F)F)Br)F)F	{16: 8, 18: 2, 34: 2}
Did not match all atoms present	98595-02-9	CCCCC(CCl)(C#N)C1=CC=C(C=C1)Cl	{1: 1, 2: 4, 4: 1, 37: 1, 14: 4, 17: 2}
Did not match all atoms present	98619-07-9	CC(=O)C1=C(C=C(C=C1)O)F	{16: 1, 1: 1, 21: 1, 14: 3, 24: 1}
Did not match all atoms present	98672-82-3	C1=CC2=C(C(=CC(=C2C=C1[N+](=O)[O-])S(=O)(=O)[O-])O)[N+]#N	{34: 1, 38: 1, 21: 1, 14: 4, 29: 3}
Did not match all atoms present	987-65-5	C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)([O-])OP(=O)(O)[O-])O)O.[Na+].[Na+]	{33: 1, 2: 1, 35: 3, 12: 4, 14: 2, 20: 4, 22: 3, 23: 1, 29: 5, 30: 1}
Did not match all atoms present	987-78-0	C[N+](C)(C)CCOP(=O)([O-])OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=NC2=O)N)O)O	{1: 3, 2: 3, 35: 1, 33: 1, 12: 4, 14: 2, 20: 3, 22: 3, 23: 1, 25: 1, 29: 3, 30: 1}
Did not match all atoms present	98717-16-9	CCCN1CCCC[C@@H]1C(=O)NC2=C(C=CC=C2C)C	{1: 3, 2: 2, 33: 1, 11: 4, 12: 1, 14: 3, 24: 1, 31: 1}
Did not match all atoms present	98730-04-2	CC1COC2=CC=CC=C2N1C(=O)C(Cl)Cl	{1: 1, 3: 1, 33: 1, 11: 1, 12: 1, 14: 4, 17: 2, 23: 1, 24: 1}
Did not match all atoms present	98754-77-9	C1=CC=C2C(=C1)C(=O)N(C(N2)C3=CC=C(O3)[N+](=O)[O-])O	{32: 1, 33: 1, 38: 1, 12: 1, 14: 6, 20: 1, 23: 1, 25: 1}
Did not match all atoms present	98754-80-4	C1=CC=C2C(=C1)C(=O)N(C(O2)C3=CC=C(O3)[N+](=O)[O-])O	{33: 1, 38: 1, 12: 1, 14: 6, 20: 1, 23: 2, 25: 1}
Did not match all atoms present	98785-33-2	CC(C)(C)S(=O)(=O)CCCl	{1: 3, 2: 2, 4: 1, 29: 2, 17: 1}
Did not match all atoms present	98791-43-6	C1=CC2=CC3=C4C5=C(C=CC5=CC6=C4C2=C1C=C6)C=C3	{14: 10}
Did not match all atoms present	988-93-2	CCN1C2=CC=CC=C2[Se]C1=CC=CC=CC3=[N+](C4=CC=CC=C4[Se]3)CC.CCOS(=O)(=O)[O-]	{1: 3, 2: 3, 6: 5, 33: 2, 14: 8, 15: 1, 22: 1, 29: 3}
Did not match all atoms present	98814-97-2	C[C-]1[C-]([C-]([C-]([C-]1C)C)C)C.C[C-]1C(=C(C(=C1C)C)C)C.[Re]	{1: 10}
Did not match all atoms present	98816-61-6	CC(C)N(CC1=CC=C(C=C1)Br)C(C)C	{1: 4, 2: 1, 3: 2, 33: 1, 14: 4, 18: 1}
Did not match all atoms present	98819-68-2	C1=CC=C(C=C1)[C@@H]2[C@H](O2)CO	{20: 1, 2: 1, 12: 2, 14: 5, 23: 1}
Did not match all atoms present	989-38-8	CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.[Cl-]	{1: 5, 2: 3, 14: 8, 17: 1, 23: 1, 28: 1, 31: 2}
Did not match all atoms present	989-51-5	C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O	{11: 1, 12: 2, 14: 6, 21: 8, 23: 1, 28: 1}
Did not match all atoms present	989-77-5	CCN1C(=CC(=CC2=[N+](C3=C(S2)C=CC4=CC=CC=C43)CC)C)SC5=C1C6=CC=CC=C6C=C5.[Cl-]	{1: 3, 2: 2, 33: 2, 6: 2, 7: 1, 41: 2, 14: 12, 15: 1, 17: 1}
Did not match all atoms present	98919-68-7	C1CC[C@H]([C@@H](C1)C2=CC=CC=C2)O	{20: 1, 11: 4, 12: 2, 14: 5}
Did not match all atoms present	98999-56-5	CCC(COP(=O)([O-])[O-])O.[NH4+].[NH4+]	{1: 1, 2: 2, 3: 1, 20: 1, 22: 1, 29: 3}
Did not match all atoms present	98999-59-8	C1=CC(=C(C=C1S(=O)(=O)[O-])N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[K+].[K+].[K+]	{34: 1, 14: 6, 15: 2, 21: 1, 25: 1, 29: 9, 30: 1, 31: 1}
Did not match all atoms present	99-02-5	CC(=O)C1=CC(=CC=C1)Cl	{24: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	99-03-6	CC(=O)C1=CC(=CC=C1)N	{24: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	99-04-7	CC1=CC=CC(=C1)C(=O)O	{1: 1, 27: 1, 14: 4}
Did not match all atoms present	99-05-8	C1=CC(=CC(=C1)N)C(=O)O	{27: 1, 30: 1, 14: 4}
Did not match all atoms present	99-06-9	C1=CC(=CC(=C1)O)C(=O)O	{27: 1, 21: 1, 14: 4}
Did not match all atoms present	99-07-0	CN(C)C1=CC(=CC=C1)O	{1: 2, 21: 1, 14: 4, 33: 1}
Did not match all atoms present	99-08-1	CC1=CC(=CC=C1)[N+](=O)[O-]	{1: 1, 38: 1, 14: 4}
Did not match all atoms present	99-09-2	C1=CC(=CC(=C1)[N+](=O)[O-])N	{38: 1, 30: 1, 14: 4}
Did not match all atoms present	99-10-5	C1=C(C=C(C=C1O)O)C(=O)O	{27: 1, 21: 2, 14: 3}
Did not match all atoms present	99-11-6	C1=C(C=C(NC1=O)O)C(=O)O	{32: 1, 25: 1, 27: 1, 21: 1, 14: 2}
Did not match all atoms present	99-12-7	CC1=CC(=CC(=C1)[N+](=O)[O-])C	{1: 2, 38: 1, 14: 3}
Did not match all atoms present	99-17-2	C1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC=CC=C3CO)O)O)O	{2: 2, 12: 5, 14: 9, 20: 4, 22: 1, 23: 1, 28: 1}
Did not match all atoms present	99-24-1	COC(=O)C1=CC(=C(C(=C1)O)O)O	{1: 1, 28: 1, 21: 3, 14: 2}
Did not match all atoms present	99-27-4	COC(=O)C1=CC(=CC(=C1)N)C(=O)OC	{1: 2, 28: 2, 30: 1, 14: 3}
Did not match all atoms present	99-28-5	C1=C(C=C(C(=C1Br)O)Br)[N+](=O)[O-]	{18: 2, 38: 1, 21: 1, 14: 2}
Did not match all atoms present	99-29-6	C1=C(C=C(C(=C1Cl)N)Br)[N+](=O)[O-]	{17: 1, 18: 1, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	99-30-9	C1=C(C=C(C(=C1Cl)N)Cl)[N+](=O)[O-]	{17: 2, 38: 1, 30: 1, 14: 2}
Did not match all atoms present	99-31-0	C1=C(C=C(C=C1C(=O)O)N)C(=O)O	{27: 2, 30: 1, 14: 3}
Did not match all atoms present	99-32-1	C1=C(OC(=CC1=O)C(=O)O)C(=O)O	{25: 1, 27: 2, 14: 2, 23: 1}
Did not match all atoms present	99-33-2	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)Cl	{24: 1, 17: 1, 38: 2, 14: 3}
Did not match all atoms present	99-34-3	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)O	{27: 1, 38: 2, 14: 3}
Did not match all atoms present	99-35-4	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{38: 3, 14: 3}
Did not match all atoms present	99-36-5	CC1=CC=CC(=C1)C(=O)OC	{1: 2, 28: 1, 14: 4}
Did not match all atoms present	99-42-3	COC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]	{1: 1, 38: 1, 28: 1, 21: 1, 14: 3}
Did not match all atoms present	99-43-4	CCCCOC1=C(C=CC(=C1)C(=O)OCCN(CC)CC)N	{1: 3, 2: 7, 33: 1, 14: 3, 22: 1, 28: 1, 30: 1}
Did not match all atoms present	99-45-6	CNCC(=O)C1=CC(=C(C=C1)O)O	{1: 1, 2: 1, 14: 3, 21: 2, 24: 1, 31: 1}
Did not match all atoms present	99-50-3	C1=CC(=C(C=C1C(=O)O)O)O	{27: 1, 21: 2, 14: 3}
Did not match all atoms present	99-51-4	CC1=C(C=C(C=C1)[N+](=O)[O-])C	{1: 2, 38: 1, 14: 3}
Did not match all atoms present	99-52-5	CC1=C(C=CC(=C1)[N+](=O)[O-])N	{1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	99-53-6	CC1=C(C=CC(=C1)[N+](=O)[O-])O	{1: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	99-54-7	C1=CC(=C(C=C1[N+](=O)[O-])Cl)Cl	{17: 2, 38: 1, 14: 3}
Did not match all atoms present	99-55-8	CC1=C(C=C(C=C1)[N+](=O)[O-])N	{1: 1, 38: 1, 30: 1, 14: 3}
Did not match all atoms present	99-56-9	C1=CC(=C(C=C1[N+](=O)[O-])N)N	{38: 1, 30: 2, 14: 3}
Did not match all atoms present	99-57-0	C1=CC(=C(C=C1[N+](=O)[O-])N)O	{30: 1, 38: 1, 21: 1, 14: 3}
Did not match all atoms present	99-59-2	COC1=C(C=C(C=C1)[N+](=O)[O-])N	{1: 1, 30: 1, 38: 1, 22: 1, 14: 3}
Did not match all atoms present	99-60-5	C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(=O)O	{17: 1, 27: 1, 38: 1, 14: 3}
Did not match all atoms present	99-61-6	C1=CC(=CC(=C1)[N+](=O)[O-])C=O	{26: 1, 38: 1, 14: 4}
Did not match all atoms present	99-62-7	CC(C)C1=CC(=CC=C1)C(C)C	{1: 4, 3: 2, 14: 4}
Did not match all atoms present	99-63-8	C1=CC(=CC(=C1)C(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 14: 4}
Did not match all atoms present	99-64-9	CN(C)C1=CC=CC(=C1)C(=O)O	{1: 2, 27: 1, 14: 4, 33: 1}
Did not match all atoms present	99-65-0	C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 4}
Did not match all atoms present	99-71-8	CCC(C)C1=CC=C(C=C1)O	{1: 2, 2: 1, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	99-72-9	CC1=CC=C(C=C1)C(C)C=O	{1: 2, 26: 1, 3: 1, 14: 4}
Did not match all atoms present	99-73-0	C1=CC(=CC=C1C(=O)CBr)Br	{24: 1, 2: 1, 18: 2, 14: 4}
Did not match all atoms present	99-75-2	CC1=CC=C(C=C1)C(=O)OC	{1: 2, 28: 1, 14: 4}
Did not match all atoms present	99-76-3	COC(=O)C1=CC=C(C=C1)O	{1: 1, 28: 1, 21: 1, 14: 4}
Did not match all atoms present	99-77-4	CCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 1, 14: 4}
Did not match all atoms present	99-78-5	CC(C)COC(=O)C1=CC=C(C=C1)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1, 14: 4, 28: 1}
Did not match all atoms present	99-79-6	CCOC(=O)CCCCCCCCC(C)C1=CC=C(C=C1)I	{1: 2, 2: 9, 3: 1, 14: 4, 19: 1, 28: 1}
Did not match all atoms present	99-80-9	CN(C1=CC=C(C=C1)N=O)N=O	{1: 1, 34: 2, 29: 2, 14: 4, 33: 1}
Did not match all atoms present	99-81-0	C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-]	{24: 1, 2: 1, 38: 1, 18: 1, 14: 4}
Did not match all atoms present	99-87-6	CC1=CC=C(C=C1)C(C)C	{1: 3, 3: 1, 14: 4}
Did not match all atoms present	99-88-7	CC(C)C1=CC=C(C=C1)N	{1: 2, 3: 1, 30: 1, 14: 4}
Did not match all atoms present	99-89-8	CC(C)C1=CC=C(C=C1)O	{1: 2, 3: 1, 21: 1, 14: 4}
Did not match all atoms present	99-90-1	CC(=O)C1=CC=C(C=C1)Br	{24: 1, 1: 1, 18: 1, 14: 4}
Did not match all atoms present	99-91-2	CC(=O)C1=CC=C(C=C1)Cl	{24: 1, 1: 1, 14: 4, 17: 1}
Did not match all atoms present	99-92-3	CC(=O)C1=CC=C(C=C1)N	{24: 1, 1: 1, 30: 1, 14: 4}
Did not match all atoms present	99-93-4	CC(=O)C1=CC=C(C=C1)O	{24: 1, 1: 1, 21: 1, 14: 4}
Did not match all atoms present	99-94-5	CC1=CC=C(C=C1)C(=O)O	{1: 1, 27: 1, 14: 4}
Did not match all atoms present	99-96-7	C1=CC(=CC=C1C(=O)O)O	{27: 1, 21: 1, 14: 4}
Did not match all atoms present	99-97-8	CC1=CC=C(C=C1)N(C)C	{1: 3, 14: 4, 33: 1}
Did not match all atoms present	99-98-9	CN(C)C1=CC=C(C=C1)N	{1: 2, 30: 1, 14: 4, 33: 1}
Did not match all atoms present	99-99-0	CC1=CC=C(C=C1)[N+](=O)[O-]	{1: 1, 38: 1, 14: 4}
Did not match all atoms present	990-73-8	CCC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 1, 2: 5, 4: 1, 33: 2, 11: 4, 12: 1, 14: 10, 20: 1, 24: 1, 27: 3}
Did not match all atoms present	99011-02-6	CC(C)CN1C=NC2=C1C3=CC=CC=C3N=C2N	{1: 2, 2: 1, 3: 1, 33: 1, 14: 5, 35: 2, 30: 1}
Did not match all atoms present	99020-76-5	CC1(C=CC2=C(O1)C(=C(C3=C2N(C4=CC=CC=C4C3=O)C)OC)[N+](=O)[O-])C	{1: 4, 38: 1, 33: 1, 13: 1, 14: 6, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	99038-11-6	C[Si](C)(C)N[Si](C)(C)C.[Si](Cl)(Cl)Cl	{1: 6, 31: 1, 17: 3}
Did not match all atoms present	99071-30-4	CC(=O)O[Hg]C1=CC(=C(C=C1)O)[Hg]OC(=O)C	{1: 2, 28: 2, 21: 1, 14: 3}
Did not match all atoms present	991-42-4	C1=CC=C(C=C1)C(=C2C3C=C(C2C4C3C(=O)NC4=O)C(C5=CC=CC=C5)(C6=CC=CC=N6)O)C7=CC=CC=N7	{32: 1, 35: 2, 4: 1, 7: 1, 12: 4, 14: 19, 15: 2, 20: 1, 25: 2}
Did not match all atoms present	99148-58-0	CC(=C)C(=O)OCC(COC(=O)C1=CC=C(C=C1)O)O	{1: 1, 2: 2, 3: 1, 5: 1, 7: 1, 14: 4, 20: 1, 21: 1, 28: 2}
Did not match all atoms present	99155-80-3	CCOC1=C(C=C2C(=NCCC2=C1)C)OCC	{1: 3, 2: 2, 35: 1, 11: 2, 14: 2, 15: 1, 22: 2}
Did not match all atoms present	99172-63-1	OOCCCCc1ccccc1	{2: 4, 20: 1, 22: 1, 14: 5}
Did not match all atoms present	992-04-1	C1=CC=C(C=C1)C2=C(C(=C(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7	{14: 30}
Did not match all atoms present	992-59-6	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C4=CC=CC=C4C(=C3)S(=O)(=O)[O-])N)C)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)[O-])N.[Na+].[Na+]	{1: 2, 30: 2, 34: 4, 29: 6, 14: 16}
Did not match all atoms present	992-79-0	C1=CC=C(C=C1)OP2(=NP(=NP(=NP(=N2)(OC3=CC=CC=C3)OC4=CC=CC=C4)(OC5=CC=CC=C5)OC6=CC=CC=C6)(OC7=CC=CC=C7)OC8=CC=CC=C8)OC9=CC=CC=C9	{35: 4, 22: 8, 14: 40}
Did not match all atoms present	992-94-9	C[Si]	{1: 1}
Did not match all atoms present	992-96-1	[2H]CI	{1: 1, 19: 1}
Did not match all atoms present	992-98-3	C(=O)[O-].[Tl+]	{26: 1}
Did not match all atoms present	993-00-0	C[SiH2]Cl	{1: 1, 17: 1}
Did not match all atoms present	993-07-7	C[Si](C)C	{1: 3}
Did not match all atoms present	993-10-2	C[Ge](Cl)(Cl)Cl	{1: 1, 17: 3}
Did not match all atoms present	993-12-4	CP(=S)(C)Cl	{1: 2, 17: 1}
Did not match all atoms present	993-13-5	CP(=O)(O)O	{1: 1, 20: 2, 29: 1}
Did not match all atoms present	993-16-8	C[Sn](Cl)(Cl)Cl	{1: 1, 17: 3}
Did not match all atoms present	993-22-6	CCCC[N+](CCCC)(CCCC)CCCC.[N-]=[N+]=[N-]	{1: 4, 2: 12, 34: 1}
Did not match all atoms present	993-42-0	CC[Ge](Cl)(Cl)Cl	{1: 1, 2: 1, 17: 3}
Did not match all atoms present	993-43-1	CCP(=S)(Cl)Cl	{1: 1, 2: 1, 17: 2}
Did not match all atoms present	993-46-4	CS[Sn](C)(C)C	{40: 1, 1: 4}
Did not match all atoms present	993-50-0	CN(C)[Sn](C)(C)C	{1: 5, 33: 1}
Did not match all atoms present	993-52-2	C[Ge](C)C.C[Ge](C)C	{1: 6}
Did not match all atoms present	993-62-4	CC[Ge](CC)CC.CC[Ge](CC)CC	{1: 6, 2: 6}
Did not match all atoms present	993-63-5	CC[Sn](CC)CC.CC[Sn](CC)CC	{1: 6, 2: 6}
Did not match all atoms present	993-74-8	CN(C)[Sn](C)(C)N(C)C	{1: 6, 33: 2}
Did not match all atoms present	993-86-2	CCOP(=O)(C(C(Cl)(Cl)Cl)O)OCC	{1: 2, 2: 2, 3: 1, 4: 1, 17: 3, 20: 1, 22: 2, 29: 1}
Did not match all atoms present	99304-81-1	C1=CC=C2C(=C1)SC(=S)S2	{41: 2, 14: 4}
Did not match all atoms present	99363-35-6	CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OC3=CC=CC=C3.C1C(O1)CCl.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O	{1: 2, 2: 1, 4: 1, 11: 1, 12: 1, 14: 16, 17: 1, 21: 1, 22: 1, 23: 1, 27: 1, 28: 2}
Did not match all atoms present	99365-26-1	COC1=C(C=C(C=C1)C2(COC3=CC(=CC(=C3C2=O)O)O)O)O	{1: 1, 11: 1, 13: 1, 14: 5, 20: 1, 21: 3, 22: 1, 23: 1, 25: 1}
Did not match all atoms present	99377-76-1	CC(=O)N(C1=CC=CC=C1)OC(=O)C.C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC2=C(C=CC(=C2)O)C=C1C(=O)O	{1: 2, 33: 1, 14: 15, 21: 1, 24: 1, 27: 3, 28: 1}
Did not match all atoms present	99377-77-2	CCCCC(CC)COC(=O)C=C.CC(=C)C1=CC=CC=C1.C=CC(=O)OCCO.C(CCC(=O)O)CCO	{1: 3, 2: 12, 3: 1, 5: 3, 6: 2, 7: 1, 14: 5, 20: 2, 27: 1, 28: 2}
Did not match all atoms present	99377-78-3	CC1=CC=CC=C1OCC2CO2.C=O.C1=CC=C(C=C1)O.C(CNCCNCCN)N	{1: 1, 2: 7, 5: 1, 11: 1, 12: 1, 14: 9, 21: 1, 22: 1, 23: 1, 30: 2, 31: 2}
Did not match all atoms present	99377-81-8	[B-](F)(F)(F)F.CCOC(=O)N1CC[N+](=C2CCCC2)CC1	{1: 1, 2: 1, 33: 2, 11: 8, 15: 1, 16: 4, 28: 1}
Did not match all atoms present	99377-82-9	CC1=[N+](C2=CC3=CC=CC=C3C=C2S1)CCCS(=O)(=O)[O-]	{1: 1, 2: 3, 33: 1, 41: 1, 14: 6, 29: 3}
Did not match all atoms present	99377-83-0	C1CC2C(C1)C3CC2CC3(C4=CC=C(C=C4)OCCO)C5=CC=C(C=C5)OCCO	{2: 4, 11: 5, 12: 4, 13: 1, 14: 8, 20: 2, 22: 2}
Did not match all atoms present	99395-88-7	C1[C@@H](NC(=O)O1)C2=CC=CC=C2	{32: 1, 28: 1, 11: 1, 12: 1, 14: 5}
Did not match all atoms present	99399-22-1	CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)O)C=C(C=C2O)S(=O)(=O)O.C1=CC=NC=C1.C1=CC=NC=C1	{1: 1, 35: 2, 14: 14, 20: 2, 21: 1, 24: 1, 29: 4, 31: 1}
Did not match all atoms present	994-07-0	CO[Si](C)(OC)Cl	{1: 3, 22: 2, 17: 1}
Did not match all atoms present	994-28-5	CC[Ge](CC)(CC)Cl	{1: 3, 2: 3, 17: 1}
Did not match all atoms present	994-29-6	CC[N+](C)(CC)CC.[I-]	{1: 4, 2: 3, 19: 1}
Did not match all atoms present	994-30-9	CC[Si](CC)(CC)Cl	{1: 3, 2: 3, 17: 1}
Did not match all atoms present	994-31-0	CC[Sn](CC)(CC)Cl	{1: 3, 2: 3, 17: 1}
Did not match all atoms present	994-36-5	C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Na]	{20: 1, 2: 2, 27: 3, 4: 1}
Did not match all atoms present	994-43-4	CCC[Ge](CC)(CC)CC	{1: 4, 2: 5}
Did not match all atoms present	994-49-0	CC[Si](CC)(CC)O[Si](CC)(CC)CC	{1: 6, 2: 6, 22: 1}
Did not match all atoms present	994-50-3	CC[Sn](CC)(CC)S[Sn](CC)(CC)CC	{40: 1, 1: 6, 2: 6}
Did not match all atoms present	994-65-0	CCC[Ge](CCC)(CCC)CCC	{1: 4, 2: 8}
Did not match all atoms present	994-71-8	CCCC[Sn](CCCC)(CCCC)C#C[Sn](CCCC)(CCCC)CCCC	{1: 6, 2: 18, 10: 2}
Did not match all atoms present	994-79-6	CCCC[Si](CCCC)(CCCC)CCCC	{1: 4, 2: 12}
Did not match all atoms present	994-89-8	CCCC[Sn](CCCC)(CCCC)C#C	{1: 3, 2: 9, 10: 1, 9: 1}
Did not match all atoms present	994-99-0	CC[Sn](CC)(CC)C#C[Sn](CC)(CC)CC	{1: 6, 2: 6, 10: 2}
Did not match all atoms present	99405-17-1	C[Si](C)(C)C([Si](C)(C)C)S	{1: 6, 3: 1, 39: 1}
Did not match all atoms present	995-25-5	CCC[Si](CCC)(CCC)Cl	{1: 3, 2: 6, 17: 1}
Did not match all atoms present	995-32-4	CCOP(=O)(CCP(=O)(OCC)OCC)OCC	{1: 4, 2: 6, 29: 2, 22: 4}
Did not match all atoms present	995-45-9	CCCC[Si](CCCC)(CCCC)Cl	{1: 3, 2: 9, 17: 1}
Did not match all atoms present	99520-55-5	CC(=O)OC(C#C)C1=CC=C(C=C1)OC	{1: 2, 3: 1, 9: 1, 10: 1, 14: 4, 22: 1, 28: 1}
Did not match all atoms present	99520-56-6	CCOP(=O)(N(C)C)OC(C)C	{1: 5, 2: 1, 3: 1, 33: 1, 22: 2, 29: 1}
Did not match all atoms present	99520-58-8	C1=CC=C2C(=C1)C3=C4C2=C(C5=CC=CC6=C5C4=C(C=C6)C=C3)O	{21: 1, 14: 11}
Did not match all atoms present	99520-64-6	C1=CC=C2C(=C1)C3=CC4=CC=CC5=C4C6=C(C=C5)C7C(C2=C36)O7	{23: 1, 12: 2, 14: 10, 15: 1}
Did not match all atoms present	99520-81-7	CS(=O)(=O)O.CS(=O)(=O)O.CS(=O)(=O)O.C(CO)[C@@H](CO)O	{1: 3, 2: 3, 3: 1, 20: 6, 29: 6}
Did not match all atoms present	99591-73-8	C1COS(=O)(=O)CS(=O)(=O)O1	{11: 3, 29: 4, 23: 2}
Did not match all atoms present	996-05-4	CCCSP(=S)(C)SCCC	{40: 2, 1: 3, 2: 4}
Did not match all atoms present	996-06-5	CCCC[Si](C)(C)CCCC	{1: 4, 2: 6}
Did not match all atoms present	996-07-6	CCCC[Si](C)(CCCC)Cl	{1: 3, 2: 6, 17: 1}
Did not match all atoms present	996-08-7	CCCC[Sn](CCCC)(Br)Br	{1: 2, 2: 6, 18: 2}
Did not match all atoms present	996-30-5	CC(C)C(=O)[O-].[Na+]	{24: 1, 1: 2, 3: 1}
Did not match all atoms present	996-31-6	CC(C(=O)[O-])O.[K+]	{24: 1, 1: 1, 3: 1, 20: 1}
Did not match all atoms present	996-37-2	C[Si](C)(C)N([Si](C)(C)C)[Sn](C)(C)C	{1: 9, 33: 1}
Did not match all atoms present	996-50-9	CCN(CC)[Si](C)(C)C	{1: 5, 2: 2, 33: 1}
Did not match all atoms present	99614-02-5	CC1=NC=CN1CC2CCC3=C(C2=O)C4=CC=CC=C4N3C	{1: 2, 2: 1, 35: 1, 33: 2, 11: 2, 12: 1, 14: 6, 25: 1}
Did not match all atoms present	99643-38-6	CC1=CC2=C(C=C1C)N(C3(N2C)N(C4=C(N3C)C=C(C(=C4)C)C)C)C	{1: 8, 13: 1, 14: 4, 33: 4}
Did not match all atoms present	99643-39-7	C1=CC=C2C=C3C(=CC2=C1)OC4(O3)OC5=CC6=CC=CC=C6C=C5O4	{13: 1, 14: 12, 23: 4}
Did not match all atoms present	99643-40-0	C1=CC=C2C=C3C(=CC2=C1)SC4(S3)SC5=CC6=CC=CC=C6C=C5S4	{41: 4, 13: 1, 14: 12}
Did not match all atoms present	99643-41-1	CN1C2=CC=CC3=C2C(=CC=C3)N(C14N(C5=CC=CC6=C5C(=CC=C6)N4C)C)C	{1: 4, 13: 1, 14: 12, 33: 4}
Did not match all atoms present	99643-42-2	C1=CC2=C3C(=C1)SC4(SC3=CC=C2)SC5=CC=CC6=C5C(=CC=C6)S4	{41: 4, 13: 1, 14: 12}
Did not match all atoms present	99643-43-3	CN1C2=CC=CC=C2N(C13N(C4=CC=CC5=C4C(=CC=C5)N3C)C)C	{1: 4, 13: 1, 14: 10, 33: 4}
Did not match all atoms present	99643-44-4	CN1C2=CC=CC3=C2C(=CC=C3)N(C14SC5=CC=CC=C5S4)C	{1: 2, 41: 2, 13: 1, 14: 10, 33: 2}
Did not match all atoms present	99643-50-2	CN1C2=CC=CC3=C2C(=CC=C3)N(C14CCCC4)C	{1: 2, 11: 4, 13: 1, 14: 6, 33: 2}
Did not match all atoms present	99643-53-5	CC1(SC2=CC=CC3=C2C(=CC=C3)S1)C	{1: 2, 13: 1, 14: 6, 41: 2}
Did not match all atoms present	99643-54-6	CC1(SC2=CC3=CC=CC=C3C=C2S1)C	{1: 2, 13: 1, 14: 6, 41: 2}
Did not match all atoms present	99685-96-8	C12=C3C4=C5C6=C1C7=C8C9=C1C%10=C%11C(=C29)C3=C2C3=C4C4=C5C5=C9C6=C7C6=C7C8=C1C1=C8C%10=C%10C%11=C2C2=C3C3=C4C4=C5C5=C%11C%12=C(C6=C95)C7=C1C1=C%12C5=C%11C4=C3C3=C5C(=C81)C%10=C23	{}
Did not match all atoms present	99686-99-4	CC1=C(N=CN1CC2=CC=CC=C2)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 14: 6}
Did not match all atoms present	99687-00-0	CC1=C(N(C=N1)CC2=CC=CC=C2)[N+](=O)[O-]	{1: 1, 2: 1, 35: 1, 38: 1, 33: 1, 14: 6}
Did not match all atoms present	997-11-5	[2H]N(CC)CC	{1: 2, 2: 2, 31: 1}
Did not match all atoms present	997-49-9	B(SC)(SC)SC	{40: 3, 1: 3}
Did not match all atoms present	997-50-2	CC[Sn](CC)CC	{1: 3, 2: 3}
Did not match all atoms present	99705-50-7	CC(=NO)C1=CC(=CC=C1)C(F)(F)F	{1: 1, 34: 1, 4: 1, 7: 1, 14: 4, 16: 3, 20: 1}
Did not match all atoms present	99711-15-6	COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)[NH2+]CCCSCCCl.[Cl-]	{1: 1, 2: 5, 35: 1, 40: 1, 14: 6, 17: 3, 22: 1}
Did not match all atoms present	99722-81-3	C1=CC=C(C(=C1)OC(F)(F)F)S(=O)(=O)N=C=O	{34: 1, 4: 1, 8: 1, 14: 4, 16: 3, 22: 1, 29: 3}
Did not match all atoms present	99726-59-7	C1=CC(=CC(=C1)Cl)C(C#N)C#N	{17: 1, 3: 1, 37: 2, 14: 4}
Did not match all atoms present	99726-60-0	C1=CC(=CC(=C1)C(F)(F)F)C(C#N)C#N	{16: 3, 3: 1, 4: 1, 37: 2, 14: 4}
Did not match all atoms present	99741-73-8	C1=CC(=CC=C1CN=C=O)N=C=O	{8: 2, 2: 1, 34: 2, 29: 2, 14: 4}
Did not match all atoms present	99747-74-7	C1=CC=C2C(=C1)C=CC=C2OS(=O)(=O)C(F)(F)F	{16: 3, 4: 1, 22: 1, 14: 7, 29: 2}
Did not match all atoms present	99759-48-5	CCN1C[C@@]2(CC[C@@H](C34[C@@H]2[C@@H](C(C31)[C@]5(CC[C@H]6CC4C5C(=O)O6)O)OC(=O)C7=CC=CC=C7)OC)C	{1: 3, 2: 1, 33: 1, 11: 6, 12: 8, 13: 3, 14: 5, 20: 1, 22: 1, 28: 2}
Did not match all atoms present	99770-04-4	C1=CC=NC=C1.C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)O)S(=O)(=O)O	{35: 1, 14: 9, 20: 2, 21: 1, 29: 4, 30: 1}
Did not match all atoms present	99784-47-1	CS(=O)(=O)O.C1CN(CCN1CCN)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)C(=O)/C(=N/NC5=CC=C(C=C5)C(=O)NC6=CC=C(C=C6)N/N=C\7/C(=CC8=C(C7=O)C=CC(=C8)NC9=NC(=NC(=N9)N1CCN(CC1)CCN)N1CCN(CC1)CCN)S(=O)(=O)O)/C(=C4)S(=O)(=O)O)N1CCN(CC1)CCN.C(=O)O	{1: 1, 2: 8, 35: 6, 33: 8, 11: 16, 34: 2, 14: 16, 15: 4, 20: 3, 24: 1, 25: 2, 26: 1, 27: 1, 29: 6, 30: 4, 31: 5}
Did not match all atoms present	99790-95-1	CC(C)CCCCCO[Al](OC(C)C)OC(C)C	{1: 6, 2: 5, 3: 3, 22: 3}
Did not match all atoms present	998-00-5	CC(C)C[Al](CC(C)C)O[Al](CC(C)C)CC(C)C	{1: 8, 2: 4, 3: 4, 22: 1}
Did not match all atoms present	998-29-8	CCC[Si](CCC)CCC	{1: 3, 2: 6}
Did not match all atoms present	998-30-1	CCO[Si](OCC)OCC	{1: 3, 2: 3, 22: 3}
Did not match all atoms present	998-39-0	CCCC[GeH](CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	998-40-3	CCCCP(CCCC)CCCC	{1: 3, 2: 9}
Did not match all atoms present	99800-15-4	CS(=O)(=O)O.C1CN(CC[NH+]1C2=NC(=NC(=N2)NC3=CC4=C(C=C3)C(=O)/C(=N\NC5=CC=C(C=C5)N=NC6=CC=CC=C6)/C(=C4)S(=O)(=O)O)[NH+]7CCN(CC7)CCN)CCN.C(=O)O	{1: 1, 2: 4, 35: 3, 33: 2, 11: 8, 34: 3, 14: 13, 15: 2, 20: 2, 25: 1, 26: 1, 27: 1, 29: 4, 30: 2, 31: 2}
Did not match all atoms present	99803-43-7	O=[Ti]1O[Ti](=O)O1	{29: 2, 23: 2}
Did not match all atoms present	99832-61-8	CC1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C(F)(F)F)C(=O)OC	{1: 2, 35: 1, 4: 1, 33: 1, 11: 1, 13: 1, 14: 8, 15: 1, 16: 3, 17: 1, 24: 1, 28: 1, 31: 1}
Did not match all atoms present	99834-93-2	CCC(C1=CC=C(C=C1)OC2=CC=C(O2)C(=O)C)C(=O)OC	{1: 3, 2: 1, 3: 1, 14: 6, 22: 1, 23: 1, 24: 1, 28: 1}
Did not match all atoms present	99869-36-0	[Li+].[Li+].COC1=CC(=NN(C2=CC(=C(C=C2)NN=C3C(=CC4=CC(=CC(=C4C3=O)O)S(=O)(=O)O)S(=O)(=O)[O-])OC)O)C=CC1=NN=C5C(=CC6=CC(=CC(=C6C5=O)O)S(=O)(=O)[O-])S(=O)(=O)O	{1: 2, 34: 4, 33: 1, 14: 12, 15: 7, 20: 3, 21: 2, 22: 2, 25: 2, 29: 10, 31: 1}
Did not match all atoms present	99869-37-1	COC1=CC(=NN(C2=CC(=C(C=C2)NN=C3C(=CC4=CC(=CC(=C4C3=O)O)S(=O)(=O)O)S(=O)(=O)O)OC)O)C=CC1=NN=C5C(=CC6=CC(=CC(=C6C5=O)O)S(=O)(=O)[O-])S(=O)(=O)O.[Na+]	{1: 2, 34: 4, 33: 1, 14: 12, 15: 7, 20: 4, 21: 2, 22: 2, 25: 2, 29: 9, 31: 1}
Did not match all atoms present	99869-39-3	CC=COC(=O)C(=C)[Si](C)(C)Cl	{1: 3, 5: 1, 6: 2, 7: 1, 17: 1, 28: 1}
Did not match all atoms present	999-29-1	CCOC(=O)CN/C(=C/[N+]#N)/[O-]	{1: 1, 2: 2, 6: 1, 7: 1, 34: 1, 28: 1, 31: 1}
Did not match all atoms present	999-81-5	C[N+](C)(C)CCCl.[Cl-]	{1: 3, 2: 2, 17: 2}
Did not match all atoms present	999-97-3	C[Si](C)(C)N[Si](C)(C)C	{1: 6, 31: 1}
Did not match all atoms present	99900-94-4	C1CN1CCC(=O)OC/C=C/C2=CC=CC=C2	{33: 1, 2: 3, 6: 2, 11: 2, 14: 5, 28: 1}
Did not match all atoms present	99960-09-5	CCOC(=O)C1=CC=CC=C1N=C=S	{1: 1, 2: 1, 8: 1, 34: 1, 14: 4, 28: 1}
Did not match all atoms present	99964-59-7	CC1(CCCC2=CC=CC=C21)OO	{1: 1, 11: 3, 13: 1, 14: 4, 20: 1, 22: 1}
Did not match all atoms present	99999-42-5	CC(=O)[O-].COC1=C(C=C2C(=C1)N(C3=NC(=O)NC(=O)C3=N2)CC[NH+]4CCCC4)Cl	{32: 1, 1: 2, 2: 2, 35: 2, 33: 1, 11: 4, 14: 2, 17: 1, 22: 1, 24: 1, 25: 2}
Matched some atoms repeatedly: [0, 1]	463-79-6	C(=O)(O)O	{27: 2}
Matched some atoms repeatedly: [0, 1]	64-18-6	C(=O)O	{26: 1, 27: 1}
Matched some atoms repeatedly: [10, 15]	1719-83-1	C1=CC2C3C(C1C4C2C(=O)OC4=O)C(=O)OC3=O	{28: 4, 12: 6, 14: 2}
Matched some atoms repeatedly: [10, 17]	67801-49-4	CC(CCO)O.C1CC(=O)OC1=O.C1=CC(=O)OC1=O	{1: 1, 2: 2, 3: 1, 11: 2, 14: 2, 20: 2, 28: 4}
Matched some atoms repeatedly: [10]	10500-34-2	CCCC=CCC1CC(=O)OC1=O	{1: 1, 2: 3, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [10]	1680-36-0	CCCCCCCCC(=O)OC(=O)CCCCCCCC	{1: 2, 2: 14, 28: 2}
Matched some atoms repeatedly: [10]	24954-60-7	C1C[C@H]2C=C[C@@H]1[C@H]3[C@@H]2C(=O)OC3=O	{28: 2, 11: 2, 12: 4, 14: 2}
Matched some atoms repeatedly: [10]	46201-48-3	CCCCCC[C@@H]1CC(=O)OC1=O	{1: 1, 2: 5, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [10]	50639-37-7	C(CCCN1C(=O)N(C(=O)OC1=O)CCCCCCN=C=O)CCN=C=O	{33: 2, 2: 12, 8: 2, 34: 2, 25: 1, 28: 2, 29: 2}
Matched some atoms repeatedly: [10]	595-29-9	C[C@@]12CCC(C1(C)C)C(=O)OC2=O	{1: 3, 11: 2, 12: 1, 13: 2, 28: 2}
Matched some atoms repeatedly: [10]	6708-37-8	C1CC2C=CC1C3C2C(=O)OC3=O	{28: 2, 11: 2, 12: 4, 14: 2}
Matched some atoms repeatedly: [10]	74665-09-1	CCCCC[C@@H](CC)C(=O)OC(=O)CC(C)C	{1: 4, 2: 6, 3: 2, 28: 2}
Matched some atoms repeatedly: [10]	82248-68-8	CC[C@H](/C=C/C)[C@@H]1CC(=O)OC1=O	{1: 2, 2: 1, 3: 1, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [10]	92526-26-6	CCC[C@@H](CC)[C@@H]1CC(=O)OC1=O	{1: 2, 2: 3, 3: 1, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [11, 16]	102083-79-4	CC1CC2C(CC1C3CC(=O)OC3=O)C(=O)OC2=O	{1: 1, 11: 3, 12: 5, 28: 4}
Matched some atoms repeatedly: [11, 16]	26427-28-1	CC1C2C(CC(O1)C3CC(=O)OC3=O)C(=O)OC2=O	{1: 1, 11: 2, 12: 5, 28: 4, 23: 1}
Matched some atoms repeatedly: [11]	146125-53-3	CC(C)(CO)CO.C1=CC(=O)OC1=O.C(CO)O	{1: 2, 2: 4, 4: 1, 14: 2, 20: 4, 28: 2}
Matched some atoms repeatedly: [11]	2082-76-0	CCCCCCCCCC(=O)OC(=O)CCCCCCCCC	{1: 2, 2: 16, 28: 2}
Matched some atoms repeatedly: [11]	25119-65-7	CC(=C)C(=O)OC.C1=CC(=O)OC1=O	{1: 2, 28: 3, 5: 1, 14: 2, 7: 1}
Matched some atoms repeatedly: [11]	5455-81-2	C1C2C3C(C1C(C2Br)Br)C(=O)OC3=O	{28: 2, 18: 2, 11: 1, 12: 6}
Matched some atoms repeatedly: [11]	65605-78-9	CC(C)(CO)CO.C1=CC(=O)OC1=O.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 2, 4: 1, 6: 2, 14: 2, 20: 2, 27: 2, 28: 2}
Matched some atoms repeatedly: [11]	72269-43-3	CCCCCCC=C.CC(=O)OC(=O)C	{1: 3, 2: 5, 28: 2, 5: 1, 6: 1}
Matched some atoms repeatedly: [12]	26680-54-6	CCCCCCC=CC1CC(=O)OC1=O	{1: 1, 2: 5, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [12]	28454-79-7	CC(C)CCCCCC1=CC(=O)OC1=O	{1: 2, 2: 5, 3: 1, 14: 1, 15: 1, 28: 2}
Matched some atoms repeatedly: [12]	336-59-4	C(=O)(C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 14, 28: 2, 4: 6}
Matched some atoms repeatedly: [12]	4200-92-4	CCCCCCCCC1CC(=O)OC1=O	{1: 1, 2: 7, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [12]	52032-05-0	CC(CO)(CO)CO.C1=CC(=O)OC1=O	{1: 1, 2: 3, 4: 1, 14: 2, 20: 3, 28: 2}
Matched some atoms repeatedly: [12]	7757-96-2	CCCCCC/C=C/C1CC(=O)OC1=O	{1: 1, 2: 5, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [13]	207136-99-0	CCCCC=C.CC=C.C1=CC(=O)OC1=O	{1: 2, 2: 3, 5: 2, 6: 2, 14: 2, 28: 2}
Matched some atoms repeatedly: [13]	645-66-9	CCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCC	{1: 2, 2: 20, 28: 2}
Matched some atoms repeatedly: [14]	139018-98-7	CC(=C)C(=O)O.C1CCC2C(C1)C(=O)OC2=O.C1CCC(C(C1)C(=O)OCC2CO2)C(=O)OCC3CO3	{1: 1, 2: 2, 5: 1, 7: 1, 11: 10, 12: 6, 23: 2, 27: 1, 28: 4}
Matched some atoms repeatedly: [14]	18470-76-3	CCCCCCCCCCC1CC(=O)OC1=O	{1: 1, 2: 9, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [14]	53576-34-4	C1C=CC2C1C3CC2C=C3.C1=CC(=O)OC1=O.C(C(CO)O)O	{2: 2, 3: 1, 11: 2, 12: 4, 14: 6, 20: 3, 28: 2}
Matched some atoms repeatedly: [14]	62568-81-4	CCCCCCCC=CCC1CC(=O)OC1=O	{1: 1, 2: 7, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [14]	65970-51-6	CCCCC(CC)C(=O)O.C1=CC(=O)OC1=O.C(CCC(=O)O)CC(=O)O.C(CO)O	{1: 2, 2: 10, 3: 1, 14: 2, 20: 2, 27: 3, 28: 2}
Matched some atoms repeatedly: [14]	72403-53-3	CC(CCO)O.C1C=CCC2C1C(=O)OC2=O.C(CO)COCCCO	{1: 1, 2: 8, 3: 1, 11: 2, 12: 2, 14: 2, 20: 4, 22: 1, 28: 2}
Matched some atoms repeatedly: [15, 22]	41377-05-3	CC(C)(CO)CO.C1C=CCC2C1C(=O)OC2=O.C1=CC(=O)OC1=O.C(CO)O	{1: 2, 2: 4, 4: 1, 11: 2, 12: 2, 14: 4, 20: 4, 28: 4}
Matched some atoms repeatedly: [15]	146865-38-5	CC(C)CCCCCC(=O)O.C1=CC(=O)OC1=O.C(COCCO)O	{1: 2, 2: 9, 3: 1, 14: 2, 20: 2, 22: 1, 27: 1, 28: 2}
Matched some atoms repeatedly: [15]	41086-83-3	C(CO)O.C(COCCO)O.C12C(C(=O)OC1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{2: 6, 12: 2, 13: 3, 15: 2, 17: 6, 20: 4, 22: 1, 28: 2}
Matched some atoms repeatedly: [15]	626-29-9	CCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCC	{1: 2, 2: 24, 28: 2}
Matched some atoms repeatedly: [15]	68227-02-1	CC(=O)OC=C.C=CC(=O)O.C1=CC(=O)OC1=O	{1: 1, 5: 2, 6: 2, 14: 2, 27: 1, 28: 3}
Matched some atoms repeatedly: [15]	71808-36-1	CCCC/C=C/CC/C=C/CCCC(=O)OC(=O)CCCC/C=C/CCC/C=C/CC	{1: 2, 2: 16, 28: 2, 6: 8}
Matched some atoms repeatedly: [15]	75477-02-0	CCOCCO.CC(CO)O.C1=CC(=O)OC1=O	{1: 2, 2: 4, 3: 1, 14: 2, 20: 3, 22: 1, 28: 2}
Matched some atoms repeatedly: [16, 17]	68123-29-5	C(C(CO)(CO)N)O.C(C(CO)(CO)N)O.C(=O)(O)O	{20: 6, 2: 6, 27: 2, 4: 2, 30: 2}
Matched some atoms repeatedly: [16]	19532-92-4	CCCCCCCCCCC=CC1CC(=O)OC1=O	{1: 1, 2: 9, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [16]	19780-11-1	CCCCCCCCCC=CCC1CC(=O)OC1=O	{1: 1, 2: 9, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [16]	42133-47-1	CC(CO)O.CC(C)(CO)CO.C1=CC(=O)OC1=O.C(CCC(=O)O)CC(=O)O	{1: 3, 2: 7, 3: 1, 4: 1, 14: 2, 20: 4, 27: 2, 28: 2}
Matched some atoms repeatedly: [16]	51838-29-0	CC(CO)O.CC(C)(CO)CO.C1=CC(=O)OC1=O	{1: 3, 2: 3, 3: 1, 4: 1, 14: 2, 20: 4, 28: 2}
Matched some atoms repeatedly: [16]	59252-34-5	CCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCC	{1: 2, 2: 26, 28: 2}
Matched some atoms repeatedly: [16]	68683-38-5	CC(C)CC(C)CC(C)C=CCC1CC(=O)OC1=O	{1: 4, 2: 3, 3: 3, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [16]	82168-35-2	C(CO)O.C(=C/C(=O)O)\C(=O)O.C12C(C(=O)OC1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{2: 2, 6: 2, 12: 2, 13: 3, 15: 2, 17: 6, 20: 2, 27: 2, 28: 2}
Matched some atoms repeatedly: [16]	82248-69-9	CCCCCC(C=CCCCC)C1CC(=O)OC1=O	{1: 2, 2: 7, 3: 1, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [17, 18]	72121-90-5	C(CCC(=O)O)CC(=O)O.C(CNCCN)N.C(=O)O	{2: 8, 27: 3, 26: 1, 30: 2, 31: 1}
Matched some atoms repeatedly: [17]	510-39-4	CC(C)C1=C[C@@]23CC[C@@H]4[C@@]([C@H]2C[C@@H]1[C@@H]5[C@H]3C(=O)OC5=O)(CCC[C@@]4(C)C(=O)O)C	{1: 4, 3: 1, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 27: 1, 28: 2}
Matched some atoms repeatedly: [17]	623-65-4	CCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCC	{1: 2, 2: 28, 28: 2}
Matched some atoms repeatedly: [17]	71520-00-8	CCCCCCCCCCCCCC=CC(=O)OC(=O)C=CCCCCCCCCCCCCC	{1: 2, 2: 24, 28: 2, 6: 4}
Matched some atoms repeatedly: [17]	73597-20-3	CC(CCO)O.CC(C)(CO)CO.C1=CC(=O)OC1=O.C(CCC(=O)O)CC(=O)O	{1: 3, 2: 8, 3: 1, 4: 1, 14: 2, 20: 4, 27: 2, 28: 2}
Matched some atoms repeatedly: [18, 32]	21794-01-4	CCCCCC[C@H]([C@H]1[C@H](C2=C(C[C@H](CC3=C1C(=O)OC3=O)[C@@H]([C@@H]4CC=CC(=O)O4)O)C(=O)OC2=O)O)O	{1: 1, 2: 5, 3: 2, 11: 3, 12: 4, 14: 2, 15: 4, 20: 3, 28: 5}
Matched some atoms repeatedly: [18, 32]	31924-91-1	CCCCCC[C@H](C1[C@H](C2=C(CC(CC3=C1C(=O)OC3=O)[C@@H](C4CCCC(=O)O4)O)C(=O)OC2=O)O)O	{1: 1, 2: 5, 3: 2, 11: 5, 12: 4, 15: 4, 20: 3, 28: 5}
Matched some atoms repeatedly: [18]	31473-53-7	CCCCCCCCCCCCC=C.C1=CC(=O)OC1=O	{1: 1, 2: 11, 5: 1, 6: 1, 14: 2, 28: 2}
Matched some atoms repeatedly: [18]	54405-64-0	CCCCCCCCCCCC=CCC1CC(=O)OC1=O	{1: 1, 2: 11, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [18]	63766-46-1	COC=C.C=COCCCCOC=C.C1=CC(=O)OC1=O	{1: 1, 2: 4, 5: 3, 6: 3, 14: 2, 22: 3, 28: 2}
Matched some atoms repeatedly: [18]	68958-33-8	CC(CO)O.CC(COCC(C)O)O.C1=CC(=O)OC1=O	{1: 3, 2: 3, 3: 3, 14: 2, 20: 4, 22: 1, 28: 2}
Matched some atoms repeatedly: [18]	71549-77-4	CC(=C)C1CCC2C1C(CCCC2)(C)C.CC(=O)OC(=O)C	{1: 5, 5: 1, 7: 1, 11: 6, 12: 3, 13: 1, 28: 2}
Matched some atoms repeatedly: [19, 20]	128023-59-6	CCCCCCCCCCCCCCCCN(C)C.C(=O)O	{1: 3, 2: 15, 27: 1, 26: 1, 33: 1}
Matched some atoms repeatedly: [19, 33]	30213-35-5	CCCCCCC(=O)C1C(C2=C(CC(CC3=C1C(=O)OC3=O)C(C4CC=CC(=O)O4)O)C(=O)OC2=O)O	{1: 1, 2: 5, 3: 1, 11: 3, 12: 4, 14: 2, 15: 4, 20: 2, 24: 1, 28: 5}
Matched some atoms repeatedly: [19]	24909-68-0	CCCCCC=CCC=CCCCCCCCC(=O)OC(=O)CCCCCCCC=CCC=CCCCCC	{1: 2, 2: 24, 28: 2, 6: 8}
Matched some atoms repeatedly: [19]	6085-36-5	CCCCCCCCC=CCCCCCCCC(=O)OC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 28, 28: 2, 6: 4}
Matched some atoms repeatedly: [19]	63528-95-0	CC(=O)OC=C.COC(=O)/C=C\C(=O)O.C1=CC(=O)OC1=O	{1: 2, 5: 1, 6: 3, 14: 2, 27: 1, 28: 4}
Matched some atoms repeatedly: [19]	638-08-4	CCCCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 32, 28: 2}
Matched some atoms repeatedly: [19]	64386-68-1	CC(CO)O.C1C=CC2C1C3CC2C=C3.C1=CC(=O)OC1=O.C(CO)O	{1: 1, 2: 3, 3: 1, 11: 2, 12: 4, 14: 6, 20: 4, 28: 2}
Matched some atoms repeatedly: [19]	70815-03-1	CC(C)C(C(C)(C)CO)O.CC(CO)O.C1=CC(=O)OC1=O	{1: 5, 2: 2, 3: 3, 4: 1, 14: 2, 20: 4, 28: 2}
Matched some atoms repeatedly: [20, 21]	164457-81-2	C(CCCN=C=O)CCN=C=O.C(=N)(N)N.C(=N)(N)N.C(=O)(O)O	{2: 6, 36: 2, 7: 2, 8: 2, 34: 2, 27: 2, 29: 2, 30: 4}
Matched some atoms repeatedly: [20]	32072-96-1	CCCCCCCCCCCCCCC=CC1CC(=O)OC1=O	{1: 1, 2: 13, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [20]	4200-91-3	CCCCCCCCCCCCCCCCC1CC(=O)OC1=O	{1: 1, 2: 15, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [20]	69882-15-1	CC(COCC(C)O)O.CC(C)(CO)CO.C1=CC(=O)OC1=O.C(CCC(=O)O)CC(=O)O	{1: 4, 2: 8, 3: 2, 4: 1, 14: 2, 20: 4, 22: 1, 27: 2, 28: 2}
Matched some atoms repeatedly: [20]	70682-81-4	CC(CO)O.C1C2C=CC1C3C2C=CC3O.C1=CC(=O)OC1=O	{1: 1, 2: 1, 3: 1, 11: 1, 12: 5, 14: 6, 20: 3, 28: 2}
Matched some atoms repeatedly: [21]	72018-16-7	CC(C)(CO)CO.C1C=CC2C1C3CC2C=C3.C1=CC(=O)OC1=O	{1: 2, 2: 2, 4: 1, 11: 2, 12: 4, 14: 6, 20: 2, 28: 2}
Matched some atoms repeatedly: [21]	74499-73-3	CCC(CO)(CO)CO.CC(CO)(CO)CO.C1=CC(=O)OC1=O	{1: 2, 2: 7, 4: 2, 14: 2, 20: 6, 28: 2}
Matched some atoms repeatedly: [22]	47458-32-2	CCCCCCCCCCCCCCCCCCC1CC(=O)OC1=O	{1: 1, 2: 17, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [22]	53192-18-0	CCC(CO)(CO)CO.C=CC(=O)O.C1C=CCC2C1C(=O)OC2=O	{1: 1, 2: 4, 4: 1, 5: 1, 6: 1, 11: 2, 12: 2, 14: 2, 20: 3, 27: 1, 28: 2}
Matched some atoms repeatedly: [22]	67066-88-0	CCCCCCCCCCCCCCCC=CCC1CC(=O)OC1=O	{1: 1, 2: 15, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [23]	51877-35-1	CCC(CO)(CO)CO.CC(=C)C(=O)O.C1C=CCC2C1C(=O)OC2=O	{1: 2, 2: 4, 4: 1, 5: 1, 7: 1, 11: 2, 12: 2, 14: 2, 20: 3, 27: 1, 28: 2}
Matched some atoms repeatedly: [23]	72018-14-5	CCC(CO)(CO)CO.C1C=CC2C1C3CC2C=C3.C1=CC(=O)OC1=O	{1: 1, 2: 4, 4: 1, 11: 2, 12: 4, 14: 6, 20: 3, 28: 2}
Matched some atoms repeatedly: [24, 25]	68130-94-9	CN(C)CCN(C)CCN(C)CCN(C)CCN(C)C.C(CO)O.C(=O)O	{1: 7, 2: 10, 33: 5, 20: 2, 26: 1, 27: 1}
Matched some atoms repeatedly: [24]	102286-64-6	CC(C)(C)CCCCCC(=O)OCC1CO1.C1CCC2C(C1)C(=O)OC2=O	{1: 3, 2: 6, 4: 1, 11: 5, 12: 3, 23: 1, 28: 3}
Matched some atoms repeatedly: [24]	33496-48-9	C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 30, 28: 2, 4: 14}
Matched some atoms repeatedly: [25, 26]	68083-47-6	CCCCCCCC/C=C/CCCCCCCC1=NCCN1CCN.C(=O)(O)O	{1: 1, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 27: 2, 30: 1}
Matched some atoms repeatedly: [25, 32]	41377-04-2	CC(C)(CO)CO.C1CC(CCC1CO)CO.C1C=CCC2C1C(=O)OC2=O.C1=CC(=O)OC1=O	{1: 2, 2: 4, 4: 1, 11: 6, 12: 4, 14: 4, 20: 4, 28: 4}
Matched some atoms repeatedly: [26]	50821-50-6	CC(CO)O.CC(C)(C1CCC(CC1)O)C2CCC(CC2)O.C1=CC(=O)OC1=O	{1: 3, 2: 1, 3: 1, 4: 1, 11: 8, 12: 4, 14: 2, 20: 4, 28: 2}
Matched some atoms repeatedly: [26]	63528-94-9	CCCCC(CC)COC(=O)/C=C\C(=O)O.CC(=O)OC=C.C1=CC(=O)OC1=O	{1: 3, 2: 5, 3: 1, 5: 1, 6: 3, 14: 2, 27: 1, 28: 4}
Matched some atoms repeatedly: [27]	189354-27-6	CC(CC(=O)OCC(CO)(CO)CO)CC(C)(C)C.C1CCC2C(C1)C(=O)OC2=O	{1: 4, 2: 6, 3: 1, 4: 2, 11: 4, 12: 2, 20: 3, 28: 3}
Matched some atoms repeatedly: [28]	64347-15-5	CCCCCCCCCCCCCC=CCCCCCCCCCC1CC(=O)OC1=O	{1: 1, 2: 21, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [28]	67989-75-7	CCCCCCC(CCCCCCCCCCCO)O.C1CCC2C(C1)C(=O)OC2=O.C1C(O1)CCl	{1: 1, 2: 17, 3: 1, 11: 5, 12: 3, 17: 1, 20: 2, 23: 1, 28: 2}
Matched some atoms repeatedly: [3, 4]	872-36-6	C1=COC(=O)O1	{28: 2, 14: 2}
Matched some atoms repeatedly: [30]	86689-89-6	C[C@@H](CCCC(C)C)[C@@H]1CC=C2[C@]1(CC[C@H]3[C@H]2C[C@H]([C@H]4[C@]3(CC[C@@H]([C@@H]4CCCC(=O)OC(=O)C=C)O)C)O)C	{1: 5, 2: 6, 3: 2, 5: 1, 6: 1, 11: 6, 12: 7, 13: 2, 14: 1, 15: 1, 20: 2, 28: 2}
Matched some atoms repeatedly: [39]	79679-30-4	C[C@H](CCCC(C)C)[C@@H]1C[C@H]([C@H]2[C@]1([C@@H](C[C@@H]3[C@@H]2CC=C4[C@]3(CC[C@@H](C4)O)C)CCCCCCCCCCC(=O)OC(=O)C=C)C)O	{1: 5, 2: 13, 3: 2, 5: 1, 6: 1, 11: 6, 12: 7, 13: 2, 14: 1, 15: 1, 20: 2, 28: 2}
Matched some atoms repeatedly: [3]	108-24-7	CC(=O)OC(=O)C	{1: 2, 28: 2}
Matched some atoms repeatedly: [3]	3261-87-8	C1C(=O)OC(=O)CS1	{41: 1, 11: 2, 28: 2}
Matched some atoms repeatedly: [3]	407-33-0	C(C(=O)OC(=O)CF)F	{16: 2, 2: 2, 28: 2}
Matched some atoms repeatedly: [3]	4124-30-5	C(C(=O)OC(=O)C(Cl)Cl)(Cl)Cl	{17: 4, 3: 2, 28: 2}
Matched some atoms repeatedly: [3]	4202-74-8	C(C(=O)OC(=O)CN)N	{2: 2, 28: 2, 30: 2}
Matched some atoms repeatedly: [3]	4480-83-5	C1C(=O)OC(=O)CO1	{11: 2, 28: 2, 23: 1}
Matched some atoms repeatedly: [3]	541-88-8	C(C(=O)OC(=O)CCl)Cl	{17: 2, 2: 2, 28: 2}
Matched some atoms repeatedly: [3]	64992-14-9	CC(=O)OC(=O)CC#N	{1: 1, 2: 1, 28: 2, 37: 1}
Matched some atoms repeatedly: [3]	6540-76-7	CC(=O)OC(=O)C.OI	{1: 2, 19: 1, 20: 1, 28: 2}
Matched some atoms repeatedly: [4, 11]	4534-73-0	C1C(C(=O)OC1=O)C2CC(=O)OC2=O	{28: 4, 11: 2, 12: 2}
Matched some atoms repeatedly: [4, 5]	53226-35-0	C(CO)N.C(=O)O	{2: 2, 27: 1, 20: 1, 26: 1, 30: 1}
Matched some atoms repeatedly: [4, 5]	58828-90-3	CN(C)C.C(=O)O	{1: 3, 26: 1, 27: 1, 33: 1}
Matched some atoms repeatedly: [40]	64051-60-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC(=O)OC1=O	{1: 1, 2: 35, 28: 2, 14: 1, 15: 1}
Matched some atoms repeatedly: [42]	64347-17-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=CCCCCCC1CC(=O)OC1=O	{1: 1, 2: 35, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [44]	64347-19-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=CCCCCCC1CC(=O)OC1=O	{1: 1, 2: 37, 6: 2, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [46]	64051-58-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC(=O)OC1=O	{1: 1, 2: 41, 28: 2, 14: 1, 15: 1}
Matched some atoms repeatedly: [4]	108-30-5	C1CC(=O)OC1=O	{11: 2, 28: 2}
Matched some atoms repeatedly: [4]	108-31-6	C1=CC(=O)OC1=O	{28: 2, 14: 2}
Matched some atoms repeatedly: [4]	108-55-4	C1CC(=O)OC(=O)C1	{11: 3, 28: 2}
Matched some atoms repeatedly: [4]	1122-12-9	C1(=C(C(=O)OC1=O)Br)Br	{18: 2, 28: 2, 15: 2}
Matched some atoms repeatedly: [4]	1122-17-4	C1(=C(C(=O)OC1=O)Cl)Cl	{17: 2, 28: 2, 15: 2}
Matched some atoms repeatedly: [4]	115-27-5	C12C(C(=O)OC1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 12: 2, 13: 3, 28: 2, 15: 2}
Matched some atoms repeatedly: [4]	123-62-6	CCC(=O)OC(=O)CC	{1: 2, 2: 2, 28: 2}
Matched some atoms repeatedly: [4]	131907-30-7	C1CC(=O)OC(=O)C1.C(CSCCO)O	{40: 1, 28: 2, 2: 4, 11: 3, 20: 2}
Matched some atoms repeatedly: [4]	35046-67-4	CC1C(=O)OC(=O)C1(C)C	{1: 3, 12: 1, 13: 1, 28: 2}
Matched some atoms repeatedly: [4]	35046-68-5	CC1(C(=O)OC(=O)C1(C)C)C	{1: 4, 28: 2, 13: 2}
Matched some atoms repeatedly: [4]	4756-10-9	C1C(C(=O)OC1=O)CC(=O)O	{27: 1, 28: 2, 2: 1, 11: 1, 12: 1}
Matched some atoms repeatedly: [4]	52192-72-0	C1=CC(=O)OC1=O.C(C(CO)O)O.C(C(CO)(CO)CO)O	{2: 6, 3: 1, 4: 1, 14: 2, 20: 7, 28: 2}
Matched some atoms repeatedly: [4]	56816-51-4	C1=CC(=O)OC1=O.C(CCC(=O)O)CC(=O)O.C(CO)COCCCO	{2: 10, 14: 2, 20: 2, 22: 1, 27: 2, 28: 2}
Matched some atoms repeatedly: [4]	5926-51-2	C1=C(C(=O)OC1=O)Br	{18: 1, 28: 2, 14: 1, 15: 1}
Matched some atoms repeatedly: [4]	6318-55-4	C1=C(C(=O)OC1=O)CC(=O)O	{2: 1, 27: 1, 28: 2, 14: 1, 15: 1}
Matched some atoms repeatedly: [4]	669-78-3	C1(=C(C(=O)OC1=O)F)F	{16: 2, 28: 2, 15: 2}
Matched some atoms repeatedly: [4]	67723-15-3	C1=CC(=O)OC1=O.C(CO)COCCCO.C(CO)O	{28: 2, 2: 8, 20: 4, 22: 1, 14: 2}
Matched some atoms repeatedly: [4]	68140-68-1	C1=CC(=O)OC1=O.C(CO)COCCCO.C(C(CO)(CBr)CBr)O	{2: 10, 4: 1, 14: 2, 18: 2, 20: 4, 22: 1, 28: 2}
Matched some atoms repeatedly: [4]	68921-87-9	C1=CC(=O)OC1=O.C(CO)COCCCO.C(CNCCN)N	{2: 10, 14: 2, 20: 2, 22: 1, 28: 2, 30: 2, 31: 1}
Matched some atoms repeatedly: [4]	96-02-6	C1=C(C(=O)OC1=O)Cl	{17: 1, 28: 2, 14: 1, 15: 1}
Matched some atoms repeatedly: [5, 12]	25574-69-0	C12C3C(C(=O)OC3=O)OC1C(=O)OC2=O	{28: 4, 12: 4, 23: 1}
Matched some atoms repeatedly: [5, 6]	18721-03-4	CCCCN.C(=O)O	{1: 1, 2: 3, 27: 1, 26: 1, 30: 1}
Matched some atoms repeatedly: [5, 6]	68258-70-8	CN(C)C=O.C(=O)O	{1: 2, 26: 2, 27: 1, 33: 1}
Matched some atoms repeatedly: [5]	106-31-0	CCCC(=O)OC(=O)CCC	{1: 2, 2: 4, 28: 2}
Matched some atoms repeatedly: [5]	16844-07-8	CC1C(C(=O)OC1=O)C	{1: 2, 12: 2, 28: 2}
Matched some atoms repeatedly: [5]	17347-61-4	CC1(CC(=O)OC1=O)C	{1: 2, 11: 1, 28: 2, 13: 1}
Matched some atoms repeatedly: [5]	19500-95-9	COCC(=O)OC(=O)COC	{1: 2, 2: 2, 28: 2, 22: 2}
Matched some atoms repeatedly: [5]	2170-03-8	C=C1CC(=O)OC1=O	{11: 1, 28: 2, 5: 1, 15: 1}
Matched some atoms repeatedly: [5]	34876-10-3	CC(=CC(=O)OC(=O)C=C(C)C)C	{1: 4, 28: 2, 6: 2, 7: 2}
Matched some atoms repeatedly: [5]	35046-71-0	CCC1(C(=O)OC(=O)C1(CC)CC)CC	{1: 4, 2: 4, 28: 2, 13: 2}
Matched some atoms repeatedly: [5]	4100-80-5	CC1CC(=O)OC1=O	{1: 1, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [5]	4160-82-1	CC1(CC(=O)OC(=O)C1)C	{1: 2, 11: 2, 28: 2, 13: 1}
Matched some atoms repeatedly: [5]	4166-53-4	CC1CC(=O)OC(=O)C1	{1: 1, 11: 2, 12: 1, 28: 2}
Matched some atoms repeatedly: [5]	5617-74-3	C1C2C1C(=O)OC2=O	{28: 2, 11: 1, 12: 2}
Matched some atoms repeatedly: [5]	5840-76-6	CN1CC(=O)OC1=O	{1: 1, 11: 1, 28: 2, 33: 1}
Matched some atoms repeatedly: [5]	616-02-4	CC1=CC(=O)OC1=O	{1: 1, 28: 2, 14: 1, 15: 1}
Matched some atoms repeatedly: [5]	623-68-7	CC=CC(=O)OC(=O)C=CC	{1: 2, 28: 2, 6: 4}
Matched some atoms repeatedly: [5]	69669-43-8	CCCC(=O)OC(=O)C	{1: 2, 2: 2, 28: 2}
Matched some atoms repeatedly: [5]	70776-23-7	C(C#N)C(=O)OC(=O)CC#N	{2: 2, 28: 2, 37: 2}
Matched some atoms repeatedly: [5]	75125-36-9	CCC1C(=O)OC(=O)C1(CC)CC	{1: 3, 2: 3, 12: 1, 13: 1, 28: 2}
Matched some atoms repeatedly: [5]	760-93-0	CC(=C)C(=O)OC(=O)C(=C)C	{1: 2, 28: 2, 5: 2, 7: 2}
Matched some atoms repeatedly: [5]	766-39-2	CC1=C(C(=O)OC1=O)C	{1: 2, 28: 2, 15: 2}
Matched some atoms repeatedly: [5]	97-72-3	CC(C)C(=O)OC(=O)C(C)C	{1: 4, 3: 2, 28: 2}
Matched some atoms repeatedly: [6, 7]	59101-30-3	CN(C)CCO.C(=O)O	{1: 2, 2: 2, 33: 1, 20: 1, 26: 1, 27: 1}
Matched some atoms repeatedly: [69]	68412-11-3	CCCCCCC(O)C/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CC(O)CCCCCC)COC(=O)CCCCCCC/C=C/CC(O)CCCCCC.CC(=O)OC(=O)C.COCCO	{1: 6, 2: 43, 3: 4, 6: 6, 20: 4, 22: 1, 28: 5}
Matched some atoms repeatedly: [6]	14035-81-5	CCC1CC(=O)OC1=O	{1: 1, 2: 1, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [6]	1468-39-9	CC(C)CC(=O)OC(=O)CC(C)C	{1: 4, 2: 2, 3: 2, 28: 2}
Matched some atoms repeatedly: [6]	1519-23-9	CCC(C)C(=O)OC(=O)C(C)CC	{1: 4, 2: 2, 3: 2, 28: 2}
Matched some atoms repeatedly: [6]	15224-07-4	CCCCC(=O)OC(=O)C	{1: 2, 2: 3, 28: 2}
Matched some atoms repeatedly: [6]	1538-75-6	CC(C)(C)C(=O)OC(=O)C(C)(C)C	{1: 6, 4: 2, 28: 2}
Matched some atoms repeatedly: [6]	2082-59-9	CCCCC(=O)OC(=O)CCCC	{1: 2, 2: 6, 28: 2}
Matched some atoms repeatedly: [6]	2834-23-3	C(=O)(C(F)(F)Cl)OC(=O)C(F)(F)Cl	{16: 4, 17: 2, 4: 2, 28: 2}
Matched some atoms repeatedly: [6]	2840-69-9	CCC1(CC(=O)OC1=O)CC	{1: 2, 2: 2, 11: 1, 28: 2, 13: 1}
Matched some atoms repeatedly: [6]	2938-48-9	CC1(CCC(=O)OC1=O)C	{1: 2, 11: 2, 28: 2, 13: 1}
Matched some atoms repeatedly: [6]	35046-84-5	CCC1C(C(=O)OC1=O)CC	{1: 2, 2: 2, 12: 2, 28: 2}
Matched some atoms repeatedly: [6]	407-25-0	C(=O)(C(F)(F)F)OC(=O)C(F)(F)F	{16: 6, 28: 2, 4: 2}
Matched some atoms repeatedly: [6]	4124-31-6	C(=O)(C(Cl)(Cl)Cl)OC(=O)C(Cl)(Cl)Cl	{17: 6, 4: 2, 28: 2}
Matched some atoms repeatedly: [6]	4462-96-8	C1CC2C1C(=O)OC2=O	{28: 2, 11: 2, 12: 2}
Matched some atoms repeatedly: [6]	52854-78-1	C/C=C/C1C(=O)OC(=O)C1/C(=C(/C(/C=C/C)/C=C/C)\C=C\C)/C=C/C	{1: 5, 3: 1, 6: 10, 7: 2, 12: 2, 28: 2}
Matched some atoms repeatedly: [6]	63521-92-6	C=CCCC(=O)OC(=O)CCC=C	{2: 4, 28: 2, 5: 2, 6: 2}
Matched some atoms repeatedly: [6]	6970-57-6	CCC1(CC(=O)OC(=O)C1)C	{1: 2, 2: 1, 11: 2, 28: 2, 13: 1}
Matched some atoms repeatedly: [6]	699-30-9	C1(=O)C(C(C(=O)O1)(F)F)(F)F	{16: 4, 28: 2, 13: 2}
Matched some atoms repeatedly: [6]	71786-73-7	C=C.C1=CC(=O)OC1=O.C(CO)N	{2: 2, 5: 2, 14: 2, 20: 1, 28: 2, 30: 1}
Matched some atoms repeatedly: [6]	84131-91-9	CC[C@H](C)C(=O)OC(=O)[C@@H](C)CC	{1: 4, 2: 2, 3: 2, 28: 2}
Matched some atoms repeatedly: [6]	9006-26-2	C1CC2=C1C(=O)OC2=O	{11: 2, 28: 2, 15: 2}
Matched some atoms repeatedly: [7, 12]	6053-68-5	C1C2C(C3C1C(=O)OC3=O)C(=O)OC2=O	{28: 4, 11: 1, 12: 4}
Matched some atoms repeatedly: [7, 8, 10, 11]	134971-35-0	CN(C)CCCN.C(=O)O.C(=O)O	{1: 2, 2: 3, 33: 1, 26: 2, 27: 2, 30: 1}
Matched some atoms repeatedly: [7, 8]	68391-54-8	C(CO)NCCO.C(=O)O	{2: 4, 27: 1, 20: 2, 26: 1, 31: 1}
Matched some atoms repeatedly: [7, 8]	86578-21-4	CN(C)CCCN.C(=O)O	{1: 2, 2: 3, 33: 1, 26: 1, 27: 1, 30: 1}
Matched some atoms repeatedly: [7]	2051-49-2	CCCCCC(=O)OC(=O)CCCCC	{1: 2, 2: 8, 28: 2}
Matched some atoms repeatedly: [7]	23684-11-9	CC(C)OCC(=O)OC(=O)C(=C)C	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1, 22: 1, 28: 2}
Matched some atoms repeatedly: [7]	2561-88-8	C1CCCCC(=O)OC(=O)CCC1	{11: 8, 28: 2}
Matched some atoms repeatedly: [7]	3205-94-5	C1CC2=C(C1)C(=O)OC2=O	{11: 3, 28: 2, 15: 2}
Matched some atoms repeatedly: [7]	376-68-1	C1(=O)C(C(C(C(=O)O1)(F)F)(F)F)(F)F	{16: 6, 28: 2, 13: 3}
Matched some atoms repeatedly: [7]	64198-15-8	CC(C)C1=CC(=O)OC1=O	{1: 2, 3: 1, 28: 2, 14: 1, 15: 1}
Matched some atoms repeatedly: [7]	68583-93-7	C/C=C/C1C(C(=O)OC1=O)/C(=C(/C)\C=C\C)/C=C/C.C(CNCCNCCN)N	{1: 4, 2: 6, 6: 6, 7: 2, 12: 2, 28: 2, 30: 2, 31: 2}
Matched some atoms repeatedly: [7]	68877-10-1	C/C=C/C1C(C(=O)OC1=O)/C(=C(/C)\C=C\C)/C=C/C.C(CO)N(CCO)CCO	{1: 4, 2: 6, 33: 1, 6: 6, 7: 2, 12: 2, 20: 3, 28: 2}
Matched some atoms repeatedly: [7]	7539-12-0	C=CCC1CC(=O)OC1=O	{2: 1, 5: 1, 6: 1, 11: 1, 12: 1, 28: 2}
Matched some atoms repeatedly: [8, 9, 11, 12]	128023-58-5	CN(C)CCN(C)C.C(=O)O.C(=O)O	{1: 4, 2: 2, 27: 2, 26: 2, 33: 2}
Matched some atoms repeatedly: [8, 9]	68226-96-0	C(C(CO)(CO)N)O.C(=O)(O)O	{20: 3, 2: 3, 27: 2, 4: 1, 30: 1}
Matched some atoms repeatedly: [8]	10489-75-5	C1CSC2=C(S1)C(=O)OC2=O	{41: 2, 11: 2, 28: 2, 15: 2}
Matched some atoms repeatedly: [8]	13149-00-3	C1CC[C@H]2[C@@H](C1)C(=O)OC2=O	{28: 2, 11: 4, 12: 2}
Matched some atoms repeatedly: [8]	2426-02-0	C1CCC2=C(C1)C(=O)OC2=O	{11: 4, 28: 2, 15: 2}
Matched some atoms repeatedly: [8]	31095-87-1	C1CCC2C(C1)C(=O)OC2=O.C1C(O1)CCl	{2: 1, 11: 5, 12: 3, 17: 1, 23: 1, 28: 2}
Matched some atoms repeatedly: [8]	4773-89-1	C1C=CCC2=C1C(=O)OC2=O	{11: 2, 28: 2, 14: 2, 15: 2}
Matched some atoms repeatedly: [8]	5662-95-3	C1CCC2(C1)CC(=O)OC(=O)C2	{11: 6, 28: 2, 13: 1}
Matched some atoms repeatedly: [8]	595-30-2	CC1(C2CCC1(C(=O)OC2=O)C)C	{1: 3, 11: 2, 12: 1, 13: 2, 28: 2}
Matched some atoms repeatedly: [8]	626-27-7	CCCCCCC(=O)OC(=O)CCCCCC	{1: 2, 2: 10, 28: 2}
Matched some atoms repeatedly: [8]	6953-60-2	CC(=O)SC1CC(=O)OC1=O	{1: 1, 40: 1, 11: 1, 12: 1, 24: 1, 28: 2}
Matched some atoms repeatedly: [8]	85-42-7	C1CCC2C(C1)C(=O)OC2=O	{28: 2, 11: 4, 12: 2}
Matched some atoms repeatedly: [8]	85-43-8	C1C=CCC2C1C(=O)OC2=O	{28: 2, 11: 2, 12: 2, 14: 2}
Matched some atoms repeatedly: [8]	935-79-5	C1C=CC[C@H]2[C@@H]1C(=O)OC2=O	{28: 2, 11: 2, 12: 2, 14: 2}
Matched some atoms repeatedly: [9, 10]	68459-80-3	CN(C)C1CCCCC1.C(=O)O	{1: 2, 33: 1, 11: 5, 12: 1, 26: 1, 27: 1}
Matched some atoms repeatedly: [9, 16]	73003-90-4	CC1=CC(CC2C1C(=O)OC2=O)C3CC(=O)OC3=O	{1: 1, 11: 2, 12: 4, 14: 1, 15: 1, 28: 4}
Matched some atoms repeatedly: [9]	11052-79-2	C[C@]12[C@H]3CC[C@@H]([C@H]1C(=O)OC2=O)O3.C1CNCCN1	{32: 2, 1: 1, 11: 6, 12: 3, 13: 1, 23: 1, 28: 2}
Matched some atoms repeatedly: [9]	127380-62-5	C[C@]12[C@@H]3CC[C@H]([C@H]1C(=O)OC2=O)O3	{1: 1, 11: 2, 12: 3, 13: 1, 23: 1, 28: 2}
Matched some atoms repeatedly: [9]	1694-82-2	CC1=CC[C@@H]2[C@H](C1)C(=O)OC2=O	{1: 1, 11: 2, 12: 2, 14: 1, 15: 1, 28: 2}
Matched some atoms repeatedly: [9]	19438-60-9	CC1CCC2C(C1)C(=O)OC2=O	{1: 1, 11: 3, 12: 3, 28: 2}
Matched some atoms repeatedly: [9]	3425-89-6	CC1=CCC2C(C1)C(=O)OC2=O	{1: 1, 11: 2, 12: 2, 14: 1, 15: 1, 28: 2}
Matched some atoms repeatedly: [9]	356-42-3	C(=O)(C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F	{16: 10, 28: 2, 4: 4}
Matched some atoms repeatedly: [9]	36765-89-6	CCCCC(CC)C(=O)OC(=O)C(CC)CCCC	{1: 4, 2: 8, 3: 2, 28: 2}
Matched some atoms repeatedly: [9]	38628-68-1	CC(=O)NC1CCC(=O)OC1=O	{1: 1, 11: 2, 12: 1, 24: 1, 28: 2, 31: 1}
Matched some atoms repeatedly: [9]	42498-58-8	CC12CC=CCC1C(=O)OC2=O	{1: 1, 11: 2, 12: 1, 13: 1, 14: 2, 28: 2}
Matched some atoms repeatedly: [9]	5333-84-6	CC1C=CCC2C1C(=O)OC2=O	{1: 1, 11: 1, 12: 3, 14: 2, 28: 2}
Matched some atoms repeatedly: [9]	5426-09-5	C1=CC2C3C(C1O2)C(=O)OC3=O	{28: 2, 12: 4, 14: 2, 23: 1}
Matched some atoms repeatedly: [9]	5442-12-6	C1CC2C3C(C1O2)C(=O)OC3=O	{28: 2, 11: 2, 12: 4, 23: 1}
Matched some atoms repeatedly: [9]	56-25-7	CC12C3CCC(C1(C(=O)OC2=O)C)O3	{1: 2, 11: 2, 12: 2, 13: 2, 23: 1, 28: 2}
Matched some atoms repeatedly: [9]	56083-98-8	CC(CO)O.C1=CC(=O)OC1=O.C(CO)COCCCO	{1: 1, 2: 7, 3: 1, 14: 2, 20: 4, 22: 1, 28: 2}
Matched some atoms repeatedly: [9]	57350-72-8	CC(CO)O.C1=CC(=O)OC1=O.C(CCCC(=O)O)CCCC(=O)O	{1: 1, 2: 8, 3: 1, 14: 2, 20: 2, 27: 2, 28: 2}
Matched some atoms repeatedly: [9]	623-66-5	CCCCCCCC(=O)OC(=O)CCCCCCC	{1: 2, 2: 12, 28: 2}
Matched some atoms repeatedly: [9]	826-62-0	C1C2C=CC1C3C2C(=O)OC3=O	{28: 2, 11: 1, 12: 4, 14: 2}
Matched some atoms repeatedly: [9]	97635-66-0	C=CC(=O)N.C1=CC(=O)OC1=O	{5: 1, 6: 1, 14: 2, 24: 1, 28: 2, 30: 1}
OK	100-35-6	CCN(CC)CCCl	{1: 2, 2: 4, 33: 1, 17: 1}
OK	100-36-7	CCN(CC)CCN	{1: 2, 2: 4, 30: 1, 33: 1}
OK	100-37-8	CCN(CC)CCO	{1: 2, 2: 4, 20: 1, 33: 1}
OK	100-38-9	CCN(CC)CCS	{1: 2, 2: 4, 39: 1, 33: 1}
OK	100-40-3	C=CC1CCC=CC1	{14: 2, 11: 3, 12: 1, 5: 1, 6: 1}
OK	100-45-8	C1CC(CC=C1)C#N	{11: 3, 12: 1, 37: 1, 14: 2}
OK	100-49-2	C1CCC(CC1)CO	{20: 1, 2: 1, 11: 5, 12: 1}
OK	100-50-5	C1CC(CC=C1)C=O	{26: 1, 11: 3, 12: 1, 14: 2}
OK	100-60-7	CNC1CCCCC1	{1: 1, 11: 5, 12: 1, 31: 1}
OK	100-64-1	C1CCC(=NO)CC1	{34: 1, 11: 5, 20: 1, 15: 1}
OK	100-72-1	C1CCOC(C1)CO	{20: 1, 2: 1, 11: 4, 12: 1, 23: 1}
OK	100-73-2	C1CC(OC=C1)C=O	{26: 1, 11: 2, 12: 1, 14: 2, 23: 1}
OK	100-74-3	CCN1CCOCC1	{1: 1, 2: 1, 11: 4, 33: 1, 23: 1}
OK	100-75-4	C1CCN(CC1)N=O	{33: 1, 34: 1, 11: 5, 29: 1}
OK	100-76-5	C1CN2CCC1CC2	{33: 1, 11: 6, 12: 1}
OK	100-79-8	CC1(OCC(O1)CO)C	{1: 2, 2: 1, 11: 1, 12: 1, 13: 1, 20: 1, 23: 2}
OK	100-97-0	C1N2CN3CN1CN(C2)C3	{33: 4, 11: 6}
OK	1000-63-1	CCCCOC(C)(C)C	{1: 4, 2: 3, 4: 1, 22: 1}
OK	1000-84-6	CCOC(=N)C	{1: 2, 2: 1, 36: 1, 22: 1, 7: 1}
OK	1000-86-8	CC(=CC(=C)C)C	{1: 3, 5: 1, 6: 1, 7: 2}
OK	1000-87-9	CC(=C=C(C)C)C	{8: 1, 1: 4, 7: 2}
OK	10003-69-7	C(C(=O)O)SC(C(SCC(=O)O)SCC(=O)O)SCC(=O)O	{27: 4, 40: 4, 2: 4, 3: 2}
OK	100042-81-7	CC(=C)C(=O)OC.CC(=C)C(=O)OCCN=C=O	{1: 3, 2: 2, 5: 2, 7: 2, 8: 1, 34: 1, 28: 2, 29: 1}
OK	10008-73-8	C=C1CCC(=O)O1	{11: 2, 28: 1, 5: 1, 15: 1}
OK	10009-70-8	C[C@H](C(=O)O)Br	{27: 1, 1: 1, 18: 1, 3: 1}
OK	100098-21-3	C1CCN2CCCN(C2)CC1	{33: 2, 11: 9}
OK	100098-22-4	C1CCCN2CCCN(C2)CC1	{33: 2, 11: 10}
OK	100098-23-5	C1CN2CCC1N3CCC2CC3	{33: 2, 11: 8, 12: 2}
OK	1001-26-9	CCOC=CC(=O)OCC	{1: 2, 2: 2, 28: 1, 22: 1, 6: 2}
OK	1001-31-6	CCCCCC(CCCC)Cl	{1: 2, 2: 7, 3: 1, 17: 1}
OK	1001-45-2	CCCCCCCCCC(=O)CCCCC	{24: 1, 1: 2, 2: 12}
OK	1001-53-2	CC(=O)NCCN	{24: 1, 1: 1, 2: 2, 30: 1, 31: 1}
OK	1001-55-4	CC(=O)OCC#N	{1: 1, 2: 1, 28: 1, 37: 1}
OK	1001-56-5	C=C=CC#N	{8: 1, 5: 1, 6: 1, 37: 1}
OK	1001-58-7	C(CS)C#N	{2: 2, 37: 1, 39: 1}
OK	1001-89-4	CCCCCC(C)Cl	{1: 2, 2: 4, 3: 1, 17: 1}
OK	100144-29-4	CC(C#CC1CCCC1)O	{1: 1, 3: 1, 10: 2, 11: 4, 12: 1, 20: 1}
OK	10016-20-3	C(C1[C@@H]2C(C([C@H](O1)O[C@@H]3C(O[C@@H](C(C3O)O)O[C@@H]4C(O[C@@H](C(C4O)O)O[C@@H]5C(O[C@@H](C(C5O)O)O[C@@H]6C(O[C@@H](C(C6O)O)O[C@@H]7C(O[C@H](O2)C(C7O)O)CO)CO)CO)CO)CO)O)O)O	{20: 18, 2: 6, 12: 30, 23: 12}
OK	10017-11-5	C=CCN.Cl	{17: 1, 2: 1, 30: 1, 5: 1, 6: 1}
OK	10017-37-5	CC(C)(C)N.Cl	{1: 3, 4: 1, 30: 1, 17: 1}
OK	10018-87-8	CC(=C)C(=O)OCCN(C)C.CC(=O)O	{1: 4, 2: 2, 5: 1, 7: 1, 33: 1, 27: 1, 28: 1}
OK	100182-47-6	CC1=CSCC1	{1: 1, 11: 2, 41: 1, 14: 1, 15: 1}
OK	1002-11-5	CCCCCCCC(CC)Cl	{1: 2, 2: 7, 3: 1, 17: 1}
OK	1002-17-1	CC(C)CCCCCCC(C)C	{1: 4, 2: 6, 3: 2}
OK	1002-23-9	CC(C)C=NCCCCCCN=CC(C)C	{1: 4, 2: 6, 3: 2, 34: 2, 6: 2}
OK	1002-27-3	C=CCC=CC=C	{2: 1, 5: 2, 6: 4}
OK	1002-28-4	CCC#CCCO	{1: 1, 2: 3, 20: 1, 10: 2}
OK	1002-33-1	CCCCC=CC=C	{1: 1, 2: 3, 5: 1, 6: 3}
OK	1002-35-3	C=CCCC=CC=C	{2: 2, 5: 2, 6: 4}
OK	1002-36-4	CCCCC#CCO	{1: 1, 2: 4, 20: 1, 10: 2}
OK	1002-41-1	C(CCl)SSCCCl	{40: 2, 17: 2, 2: 4}
OK	1002-43-3	CCCCCCCCC(C)CC	{1: 3, 2: 8, 3: 1}
OK	1002-56-8	CCCCCCCCC(C)Cl	{1: 2, 2: 7, 3: 1, 17: 1}
OK	1002-57-9	C(CCCC(=O)O)CCCN	{2: 7, 27: 1, 30: 1}
OK	1002-67-1	CCOCCOCCOC	{1: 2, 2: 5, 22: 3}
OK	1002-69-3	CCCCCCCCCCCl	{1: 1, 2: 9, 17: 1}
OK	1002-84-2	CCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 13, 27: 1}
OK	1002-91-1	CCCC=NCCCCCCN=CCCC	{1: 2, 2: 10, 34: 2, 6: 2}
OK	10020-43-6	CCCCCCCCOCCO	{1: 1, 2: 9, 20: 1, 22: 1}
OK	10020-75-4	C=NN1CCOC1=O	{33: 1, 34: 1, 11: 2, 28: 1, 5: 1}
OK	100207-07-6	CC(C)(C)C=C=CBr	{8: 1, 1: 3, 18: 1, 4: 1, 6: 2}
OK	10022-28-3	CCCCCCCC(OC)OC	{1: 3, 2: 6, 3: 1, 22: 2}
OK	10022-50-1	[N+](=O)([O-])F	{16: 1, 38: 1}
OK	10022-60-3	CCC(CC)COC(=O)CCCCC(=O)OCC(CC)CC	{1: 4, 2: 10, 3: 2, 28: 2}
OK	10024-18-7	C=C=CBr	{8: 1, 18: 1, 5: 1, 6: 1}
OK	10024-47-2	CCCCCCCCC=CCCCCCCCC(=O)OCC(C)C	{1: 3, 2: 15, 3: 1, 28: 1, 6: 2}
OK	10024-58-5	CCCCCCCCCC(=O)OCCOCCOCCOC(=O)CCCCCCCCC	{1: 2, 2: 22, 28: 2, 22: 2}
OK	10024-70-1	CC(CC(=O)O)OC	{27: 1, 1: 2, 2: 1, 3: 1, 22: 1}
OK	10024-78-9	CCCCC(CC)CCC(C)N	{1: 3, 2: 6, 3: 2, 30: 1}
OK	10024-89-2	C1COCCN1.Cl	{32: 1, 17: 1, 11: 4, 23: 1}
OK	100243-39-8	C1CNC[C@H]1O	{32: 1, 20: 1, 11: 3, 12: 1}
OK	10025-09-9	CCC(=O)OCCCCCOC(=O)CC	{1: 2, 2: 7, 28: 2}
OK	10025-85-1	N(Cl)(Cl)Cl	{17: 3, 33: 1}
OK	10026-98-9	CC(C)(CO)N(C)C.Cl	{1: 4, 2: 1, 4: 1, 33: 1, 17: 1, 20: 1}
OK	10027-06-2	C=CC(=O)OC1CC2CCC1C2	{28: 1, 11: 4, 12: 3, 5: 1, 6: 1}
OK	10027-07-3	C(CCCC(=O)Cl)CCC(=O)Cl	{24: 2, 17: 2, 2: 6}
OK	10028-15-6	[O-][O+]=O	{29: 2, 22: 1}
OK	10029-04-6	CCOC(=O)C(=C)CO	{1: 1, 2: 2, 5: 1, 7: 1, 20: 1, 28: 1}
OK	1003-03-8	C1CCC(C1)N	{11: 4, 12: 1, 30: 1}
OK	1003-04-9	C1CSCC1=O	{25: 1, 11: 3, 41: 1}
OK	1003-10-7	C1CC(=O)SC1	{25: 1, 11: 3, 41: 1}
OK	1003-14-1	CCCC1CO1	{1: 1, 2: 2, 11: 1, 12: 1, 23: 1}
OK	1003-17-4	CC1(CCCO1)C	{1: 2, 11: 3, 13: 1, 23: 1}
OK	1003-19-6	CCC1(CC1)CC	{1: 2, 2: 2, 11: 2, 13: 1}
OK	1003-30-1	CCC1CCCO1	{1: 1, 2: 1, 11: 3, 12: 1, 23: 1}
OK	1003-38-9	CC1CCC(O1)C	{1: 2, 11: 2, 12: 2, 23: 1}
OK	1003-39-0	CC1CSC(=N)S1.Cl	{1: 1, 36: 1, 41: 2, 11: 1, 12: 1, 15: 1, 17: 1}
OK	1003-41-4	C1=CSC=CC1=O	{25: 1, 14: 4, 41: 1}
OK	1003-64-1	CC=C1CCCCC1	{1: 1, 11: 5, 6: 1, 15: 1}
OK	1003-84-5	CC1(CCN(CC1)C)C	{1: 3, 11: 4, 13: 1, 33: 1}
OK	10030-73-6	CCCCCCC=CCCCCCCCC(=O)O	{1: 1, 2: 12, 27: 1, 6: 2}
OK	10030-74-7	CCCCCCC=CCCCCCCCC(=O)OC	{1: 2, 2: 12, 28: 1, 6: 2}
OK	10030-80-5	C([C@@H]([C@@H]([C@H]([C@H](C=O)O)O)O)O)O	{2: 1, 3: 4, 20: 5, 26: 1}
OK	10031-87-5	CCC(CC)COC(=O)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	10031-92-2	CCCCCCC#CC(=O)OCC	{1: 2, 2: 6, 28: 1, 10: 2}
OK	10032-00-5	CC(=CCC/C(=C/COC(=O)CC(=O)C)/C)C	{1: 4, 2: 4, 6: 2, 7: 2, 24: 1, 28: 1}
OK	10032-02-7	CCCCCC(=O)OCC=C(C)CCC=C(C)C	{1: 4, 2: 7, 28: 1, 6: 2, 7: 2}
OK	10032-05-0	CCCCCCC(OC)OC	{1: 3, 2: 5, 3: 1, 22: 2}
OK	10032-13-0	CCCCCCOC(=O)CC(C)C	{1: 3, 2: 6, 3: 1, 28: 1}
OK	10032-15-2	CCCCCCOC(=O)C(C)CC	{1: 3, 2: 6, 3: 1, 28: 1}
OK	10034-13-6	CCC=COC	{1: 2, 2: 1, 22: 1, 6: 2}
OK	10034-85-2	I	{19: 1}
OK	100347-96-4	CC(=C1C[C@@H]2[C@H]([C@@]2(CC1=O)C)CCC(=O)C)C	{1: 4, 2: 2, 7: 1, 11: 2, 12: 2, 13: 1, 15: 1, 24: 1, 25: 1}
OK	10035-10-6	Br	{18: 1}
OK	10036-12-1	C1CC2CCC1C=CC2=O	{25: 1, 11: 4, 12: 2, 14: 2}
OK	10036-47-2	N(N(F)F)(F)F	{16: 4, 33: 2}
OK	10036-64-3	CC(=O)NC1C(C(C(OC1O)CO)O)O	{1: 1, 2: 1, 12: 5, 20: 4, 23: 1, 24: 1, 31: 1}
OK	100365-71-7	CC=C(C)C=O	{1: 2, 26: 1, 6: 1, 7: 1}
OK	10039-55-1	NN.I	{19: 1, 30: 2}
OK	1004-14-4	CC(C)N1CCOCC1	{11: 4, 1: 2, 3: 1, 33: 1, 23: 1}
OK	1004-24-6	C=C1CCC(CC1)CO	{2: 1, 5: 1, 11: 4, 12: 1, 15: 1, 20: 1}
OK	1004-29-1	CCCCC1CCCO1	{1: 1, 2: 3, 11: 3, 12: 1, 23: 1}
OK	1004-77-9	CC(C)C1CCCCC1=O	{11: 4, 1: 2, 3: 1, 12: 1, 25: 1}
OK	10042-59-8	CCCCCC(CCC)CO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	10042-65-6	CCCCCCCCCCCCCCCCCC(=O)O.CC(CN)O	{1: 2, 2: 17, 3: 1, 20: 1, 27: 1, 30: 1}
OK	10042-66-7	CCCCCCCCCCCCCCCCCC(=O)O.CC(CNCC(C)O)O	{1: 3, 2: 18, 3: 2, 20: 2, 27: 1, 31: 1}
OK	10042-67-8	CCCCCCCCCCCCCCCCCC(=O)O.CC(CN(CC(C)O)CC(C)O)O	{1: 4, 2: 19, 3: 3, 33: 1, 20: 3, 27: 1}
OK	10043-09-1	C1COC(C(O1)OCC2CO2)OCC3CO3	{2: 2, 11: 4, 12: 4, 22: 2, 23: 4}
OK	10047-28-6	CCCCOC(=O)CS	{1: 1, 2: 4, 28: 1, 39: 1}
OK	10048-32-5	CC1CC=CC(=O)O1	{1: 1, 11: 1, 12: 1, 14: 2, 28: 1}
OK	10049-03-3	O=Cl(=O)(=O)OF	{16: 1, 17: 1, 29: 3, 22: 1}
OK	10049-04-4	O=Cl[O]	{17: 1, 29: 2}
OK	1005-51-2	C1=CC2C3C2C=CC1C=C3	{12: 4, 14: 6}
OK	1005-55-6	CC1=C/C(=C/C(=O)C)/SS1	{1: 2, 6: 1, 41: 2, 14: 1, 15: 2, 24: 1}
OK	1005-67-0	CCCCN1CCOCC1	{1: 1, 2: 3, 11: 4, 33: 1, 23: 1}
OK	1005-68-1	CC(C)CCC1CCCC1	{11: 4, 1: 2, 2: 2, 3: 1, 12: 1}
OK	10051-06-6	C(=NF)(N(F)F)N(F)F	{16: 5, 33: 2, 34: 1, 7: 1}
OK	10052-18-3	CC12CCC(C1)CC2	{1: 1, 11: 5, 12: 1, 13: 1}
OK	100524-60-5	C=CC(C)OCCO	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 20: 1, 22: 1}
OK	10056-30-1	CC1CN(CC(O1)C)CCC(C)C	{1: 4, 2: 2, 3: 1, 33: 1, 11: 2, 12: 2, 23: 1}
OK	10058-20-5	CCCCCCOCCOC(=O)CCC(=O)OCCOCCCCCC	{1: 2, 2: 16, 28: 2, 22: 2}
OK	10061-01-5	Cl/C=C\CCl	{17: 2, 2: 1, 6: 2}
OK	10061-02-6	C(/C=C/Cl)Cl	{17: 2, 2: 1, 6: 2}
OK	10061-68-4	CCNCCCNCC	{1: 2, 2: 5, 31: 2}
OK	100684-91-1	C=C.C=CC(=O)O.C1COCCN1	{32: 1, 5: 3, 6: 1, 11: 4, 23: 1, 27: 1}
OK	1007-01-8	C1CC2CC1CC2CC(=O)O	{27: 1, 2: 1, 11: 4, 12: 3}
OK	1007-33-6	CC(CC1CCCCC1)NC.Cl	{1: 2, 2: 1, 3: 1, 11: 5, 12: 1, 17: 1, 31: 1}
OK	100700-20-7	C(CC(=O)N)CN(C#N)N=O	{33: 1, 2: 3, 37: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	100700-21-8	C(C(CN(C#N)N=O)O)C(=O)N	{33: 1, 2: 2, 3: 1, 37: 1, 34: 1, 20: 1, 24: 1, 29: 1, 30: 1}
OK	100700-28-5	CSC(=O)C(CCF)O	{1: 1, 2: 2, 3: 1, 40: 1, 16: 1, 20: 1, 24: 1}
OK	100700-29-6	CC(=O)OCCCCN(CCCC(=O)OC)N=O	{1: 2, 2: 7, 33: 1, 34: 1, 28: 2, 29: 1}
OK	10071-60-0	CCC=CCCl	{1: 1, 2: 2, 6: 2, 17: 1}
OK	10072-50-1	CCC(C)CCCCC(=O)NC(CCN)C(=O)NC(C(C)O)C(=O)NC(CO)C(=O)NC1CCNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CCN)CC(C)C)C(C)O)CCN)CCN)C(C)O	{32: 7, 1: 7, 2: 15, 3: 8, 11: 2, 12: 7, 20: 4, 24: 4, 25: 7, 30: 4, 31: 4}
OK	10075-38-4	CC(=CCCl)Cl	{1: 1, 2: 1, 17: 2, 6: 1, 7: 1}
OK	10076-31-0	CC(C)(C)CN(C)C	{1: 5, 2: 1, 4: 1, 33: 1}
OK	100762-52-5	CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C	{1: 3, 5: 3, 6: 1, 7: 2, 11: 3, 12: 2, 13: 1}
OK	1008-17-9	CCC1CCCC2C1CCCC2	{1: 1, 2: 1, 11: 7, 12: 3}
OK	100836-63-3	CC(C)(C)OC(=O)N=C1N(CCS1)C	{1: 4, 34: 1, 4: 1, 33: 1, 41: 1, 11: 2, 15: 1, 28: 1}
OK	10086-64-3	CCC(C)CF	{16: 1, 1: 2, 2: 2, 3: 1}
OK	100912-15-0	CCCCCCCCCCC(C)(C#C)O	{1: 2, 2: 9, 4: 1, 9: 1, 10: 1, 20: 1}
OK	10097-02-6	CCC(CO)(CO)C(=O)O	{1: 1, 2: 3, 27: 1, 4: 1, 20: 2}
OK	10097-26-4	CCCCCCC(CCCC)COC(=O)C(=C)C	{1: 3, 2: 9, 3: 1, 5: 1, 7: 1, 28: 1}
OK	10097-32-2	[Br]	{18: 1}
OK	10099-70-4	CC(C)OC(=O)C=CC(=O)OC(C)C	{1: 4, 3: 2, 28: 2, 6: 2}
OK	10099-71-5	CCCCCOC(=O)C=CC(=O)OCCCCC	{1: 2, 2: 8, 28: 2, 6: 2}
OK	10099-72-6	C(COCCOC(=O)/C=C\C(=O)O)O	{2: 4, 6: 2, 20: 1, 22: 1, 27: 1, 28: 1}
OK	101-07-5	CCCCC(CC)CN(CCO)CC(CC)CCCC	{1: 4, 2: 12, 3: 2, 20: 1, 33: 1}
OK	101-25-7	C1N2CN(CN1CN(C2)N=O)N=O	{33: 4, 34: 2, 11: 5, 29: 2}
OK	101-33-7	CCCC(CC(OCC)OCC)OCC	{1: 4, 2: 6, 3: 2, 22: 3}
OK	101-34-8	CCCCCCC(OC(=O)C)C/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CC(OC(=O)C)CCCCCC)COC(=O)CCCCCCC/C=C/CC(OC(=O)C)CCCCCC	{1: 6, 2: 41, 3: 4, 28: 6, 6: 6}
OK	101-38-2	C1=C(C(=O)C(=CC1=NCl)Cl)Cl	{17: 3, 34: 1, 25: 1, 14: 2, 15: 3}
OK	101-40-6	CC(CC1CCCCC1)NC	{1: 2, 2: 1, 3: 1, 11: 5, 12: 1, 31: 1}
OK	101-43-9	CC(=C)C(=O)OC1CCCCC1	{1: 1, 5: 1, 7: 1, 11: 5, 12: 1, 28: 1}
OK	101-83-7	C1CCC(CC1)NC2CCCCC2	{11: 10, 12: 2, 31: 1}
OK	1010-74-8	CC(C)C1CCCC2C1CCCC2	{11: 7, 1: 2, 3: 1, 12: 3}
OK	10100-95-5	CCCCCOC(C)(C)C	{1: 4, 2: 4, 4: 1, 22: 1}
OK	101012-97-9	CCCCCCCCCCCCCNCCCCCCCCCCCCC	{1: 2, 2: 24, 31: 1}
OK	10102-44-0	[O]N=O	{34: 1, 29: 2}
OK	10103-17-0	CCCCCCCCC=CCCCCCCCC(=O)O.CCN(CC)CC	{1: 4, 2: 17, 27: 1, 6: 2, 33: 1}
OK	10105-38-1	CCCCCCCCCC(C)CCCCC	{1: 3, 2: 12, 3: 1}
OK	10107-99-0	CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)OCCOCCO)C	{1: 4, 2: 4, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 20: 1, 22: 1, 28: 1}
OK	101074-13-9	CN1CN(C(=O)N(CN(C1=O)C)C)C	{1: 4, 11: 2, 33: 4, 25: 2}
OK	10108-22-2	CCCCCCCCCCCC(=O)OCCCO	{1: 1, 2: 13, 20: 1, 28: 1}
OK	1011-12-7	C1CCC(=C2CCCCC2=O)CC1	{25: 1, 11: 9, 15: 2}
OK	101200-52-6	CC(C)C12CCC(C=C1)(C(C2)(C)C(=O)C)C	{1: 5, 3: 1, 11: 3, 13: 3, 14: 2, 24: 1}
OK	10124-86-4	C(CCCCN=C=O)CCCN=C=O	{8: 2, 2: 8, 34: 2, 29: 2}
OK	101257-71-0	CC1CCNC(C1)(C)C	{32: 1, 1: 3, 11: 3, 12: 1, 13: 1}
OK	10129-44-9	C=CC[N+]1=CC=CC=C1.[Br-]	{33: 1, 2: 1, 5: 1, 6: 1, 14: 5, 18: 1}
OK	10130-91-3	CC1CCCC(C1O)(C)C	{1: 3, 11: 3, 12: 2, 13: 1, 20: 1}
OK	10135-38-3	CC1(CC([N+](=C1)[O-])(C)C)C	{1: 4, 33: 1, 11: 1, 13: 2, 14: 1, 29: 1}
OK	101357-36-2	CC1(CC(CC(N1C)(C)C)C(C(C)(C)C=O)O)C.C(C(C(CC(=O)O)C(=O)O)C(=O)O)C(=O)O.C(C(CO)(CO)CO)O	{1: 7, 2: 6, 3: 3, 4: 2, 33: 1, 11: 2, 12: 1, 13: 2, 20: 5, 26: 1, 27: 4}
OK	101357-37-3	CC1(CC(CC(N1)(C)C)C(C(C)(C)C=O)O)C.C(C(C(CC(=O)O)C(=O)O)C(=O)O)C(=O)O.C(C(CO)(CO)CO)O	{32: 1, 1: 6, 2: 6, 3: 3, 4: 2, 11: 2, 12: 1, 13: 2, 20: 5, 26: 1, 27: 4}
OK	10136-52-4	CCCCCCCC=CCCCCCCCC(=O)O	{1: 1, 2: 13, 27: 1, 6: 2}
OK	10136-65-9	CC1(C2CC1C(C(=O)C2)(C)O)C	{1: 3, 11: 2, 12: 2, 13: 2, 20: 1, 25: 1}
OK	10137-65-2	CCOC(=O)CCCCCC#N	{1: 1, 2: 6, 28: 1, 37: 1}
OK	10137-73-2	C1CCC(C1)OC2CCCC2	{11: 8, 12: 2, 22: 1}
OK	10137-90-3	CCCCC(CC)C=CC(=O)C	{24: 1, 1: 3, 2: 4, 3: 1, 6: 2}
OK	10137-96-9	CCCC(C)COCCO	{1: 2, 2: 5, 3: 1, 20: 1, 22: 1}
OK	10137-98-1	CC(C)CC(C)CC(CC(C)C)OCCO	{1: 5, 2: 5, 3: 4, 20: 1, 22: 1}
OK	10138-02-0	CCCCCCCCCCCC(=O)NCCN	{24: 1, 1: 1, 2: 12, 30: 1, 31: 1}
OK	10138-10-0	CCOC(=O)CCC=O	{1: 1, 2: 3, 28: 1, 26: 1}
OK	10138-17-7	CC1COCC(O1)C	{1: 2, 11: 2, 12: 2, 23: 2}
OK	10138-32-6	CCOC(=O)C1CC2CC1C=C2	{1: 1, 2: 1, 11: 2, 12: 3, 14: 2, 28: 1}
OK	10138-34-8	CCCCOC(=O)C1C(O1)C	{1: 2, 2: 3, 12: 2, 28: 1, 23: 1}
OK	10138-39-3	CC1CC2C(O2)CC1C(=O)OCC=C	{1: 1, 2: 1, 5: 1, 6: 1, 11: 2, 12: 4, 23: 1, 28: 1}
OK	10138-44-0	CCOC1CC(C=CO1)C	{1: 2, 2: 1, 11: 1, 12: 2, 14: 2, 22: 1, 23: 1}
OK	10138-47-3	CCCCC(CC)OCCO	{1: 2, 2: 6, 3: 1, 20: 1, 22: 1}
OK	10138-59-7	CCOC(=O)C1CCCCC1C(=O)OCC	{1: 2, 2: 2, 11: 4, 12: 2, 28: 2}
OK	10138-60-0	CC=CC(C#C)O	{1: 1, 3: 1, 6: 2, 9: 1, 10: 1, 20: 1}
OK	10138-87-1	CCCCC(CC)OCCOCCO	{1: 2, 2: 8, 3: 1, 20: 1, 22: 2}
OK	10138-89-3	CC(CC(OC)OC)OC	{1: 4, 2: 1, 3: 2, 22: 3}
OK	10138-99-5	CN(C)C[C@@H](C(=O)O)N	{1: 2, 2: 1, 3: 1, 33: 1, 27: 1, 30: 1}
OK	101398-58-7	CN(C)CCN=CN(C)C	{1: 4, 2: 2, 34: 1, 6: 1, 33: 2}
OK	10140-75-7	CC(=O)OC(C(CCl)Cl)OC(=O)C	{1: 2, 2: 1, 3: 2, 28: 2, 17: 2}
OK	10140-87-1	CC(=O)OC(CCl)Cl	{1: 1, 2: 1, 3: 1, 28: 1, 17: 2}
OK	10140-89-3	C(C(C=O)Cl)Cl	{17: 2, 2: 1, 3: 1, 26: 1}
OK	10140-99-5	CCOCC(C(OCC)OCC)Cl	{1: 3, 2: 4, 3: 2, 22: 3, 17: 1}
OK	10141-07-8	C/C=C/C(OC(=O)/C=C/C)OC(=O)/C=C/C	{1: 3, 3: 1, 28: 2, 6: 6}
OK	10141-15-8	CC(CC(C)(C)O)OCCC#N	{1: 3, 2: 3, 3: 1, 4: 1, 37: 1, 20: 1, 22: 1}
OK	10141-19-2	CC(C)CC(C)CCCC(C)COC=C	{1: 4, 2: 5, 3: 3, 5: 1, 6: 1, 22: 1}
OK	10141-22-7	CC(CCl)(C=O)Cl	{1: 1, 2: 1, 4: 1, 26: 1, 17: 2}
OK	10141-72-7	CC1CCCCO1	{1: 1, 11: 4, 12: 1, 23: 1}
OK	10143-20-1	CC(C)CC(CC(C)C)CC(CC(C)C)O	{1: 6, 2: 4, 3: 5, 20: 1}
OK	10143-22-3	COCCOC(=O)N(CO)CO	{1: 1, 2: 4, 33: 1, 20: 2, 22: 1, 28: 1}
OK	10143-23-4	CCC(C)C(C)CO	{1: 3, 2: 2, 3: 2, 20: 1}
OK	10143-31-4	CCCN(CCC)C(=O)CCC(=O)OCC	{24: 1, 1: 3, 2: 7, 28: 1, 33: 1}
OK	10143-53-0	CCOCCOCCOC=C	{1: 1, 2: 5, 22: 3, 5: 1, 6: 1}
OK	10143-54-1	C(COCCOCCO)C#N	{2: 6, 20: 1, 37: 1, 22: 2}
OK	10143-56-3	CCCC(C)COCCOCCO	{1: 2, 2: 7, 3: 1, 20: 1, 22: 2}
OK	10143-60-9	CCCCC(CC)COCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 22: 1}
OK	10143-66-5	CC(CCOC)OC	{1: 3, 2: 2, 3: 1, 22: 2}
OK	10143-67-6	CC(OCCOC)OCCOC	{1: 3, 2: 4, 3: 1, 22: 4}
OK	10150-87-5	CC(=O)CCOC(=O)C	{24: 1, 1: 2, 2: 2, 28: 1}
OK	10151-02-7	CC(C)(C)CC(C)(C)NC=O	{1: 5, 2: 1, 4: 2, 26: 1, 31: 1}
OK	10152-75-7	CSC#C	{40: 1, 1: 1, 10: 1, 9: 1}
OK	10152-76-8	CSCC=C	{40: 1, 1: 1, 2: 1, 5: 1, 6: 1}
OK	10152-77-9	CC=CSC	{40: 1, 1: 2, 6: 2}
OK	101550-37-2	CC(C)(C)NC(=O)C=C.C=CC(=O)O	{1: 3, 4: 1, 5: 2, 6: 2, 24: 1, 27: 1, 31: 1}
OK	101555-40-2	COC1=CCCC2C1CCCC2	{1: 1, 11: 6, 12: 2, 14: 1, 15: 1, 22: 1}
OK	101555-41-3	COC1=C2CCCCC2CCC1	{1: 1, 11: 7, 12: 1, 22: 1, 15: 2}
OK	10160-24-4	C(CCCO)CCCBr	{2: 7, 20: 1, 18: 1}
OK	10160-48-2	CCCCCCCCCOC=C	{1: 1, 2: 8, 22: 1, 5: 1, 6: 1}
OK	10160-87-9	CCOC(C#C)OCC	{1: 2, 2: 2, 3: 1, 9: 1, 10: 1, 22: 2}
OK	10161-34-9	CC(=O)O[C@H]1CC[C@@H]2[C@@]1(C=CC3=C4CCC(=O)C=C4CC[C@@H]23)C	{1: 2, 11: 6, 12: 3, 13: 1, 14: 3, 15: 3, 25: 1, 28: 1}
OK	10163-83-4	CC(C)CC(=O)O[C@@H]1[C@H]([C@H]2[C@@H](CC=C3[C@@]2(CC[C@@H](C3)O)C)[C@@]4([C@]1([C@H](CC4)C(=O)C)C)O)OC(=O)C	{1: 6, 2: 1, 3: 1, 11: 6, 12: 6, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 28: 2}
OK	10165-13-6	C1CN1Cl	{17: 1, 11: 2, 33: 1}
OK	101652-13-5	C(/C=C/Br)N=C=O	{2: 1, 6: 2, 8: 1, 34: 1, 18: 1, 29: 1}
OK	1017-93-2	C1CC2C=CC1C(C2(C#N)C#N)(C#N)C#N	{11: 2, 12: 2, 13: 2, 14: 2, 37: 4}
OK	10171-38-7	CCOCO	{1: 1, 2: 2, 20: 1, 22: 1}
OK	10171-76-3	C1CC2CC1CC2CNCC3CC4CCC3C4	{2: 2, 11: 8, 12: 6, 31: 1}
OK	10171-78-5	CC(CNCCCO)N	{1: 1, 2: 4, 3: 1, 20: 1, 30: 1, 31: 1}
OK	10183-34-3	CC(C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)O)N	{1: 5, 3: 5, 24: 4, 27: 1, 30: 1, 31: 4}
OK	101831-59-8	CC1CN(CC(N1N=O)C)C(=O)C	{1: 3, 34: 1, 33: 2, 11: 2, 12: 2, 24: 1, 29: 1}
OK	10191-60-3	CSC(=NC#N)SC	{40: 2, 1: 2, 34: 1, 37: 1, 7: 1}
OK	101913-96-6	C(CCN(C#N)N=O)CC(C(=O)N)O	{33: 1, 2: 4, 3: 1, 37: 1, 34: 1, 20: 1, 24: 1, 29: 1, 30: 1}
OK	10192-32-2	CCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 21, 5: 1, 6: 1}
OK	10193-96-1	CCC(COC(=O)CS)(COC(=O)CS)COC(=O)CS	{1: 1, 2: 7, 4: 1, 28: 3, 39: 3}
OK	10193-98-3	CC(COC(=O)CS)(COC(=O)CS)COC(=O)CS	{1: 1, 2: 6, 4: 1, 28: 3, 39: 3}
OK	10193-99-4	C(C(=O)OCC(COC(=O)CS)(COC(=O)CS)COC(=O)CS)S	{28: 4, 2: 8, 4: 1, 39: 4}
OK	101935-28-8	CCC(=CC(=CC)C)C	{1: 4, 2: 1, 6: 2, 7: 2}
OK	10194-00-0	C(CCC(=O)OCCS)CC(=O)OCCS	{2: 8, 28: 2, 39: 2}
OK	10195-54-7	C(CC(=O)O)CC(=O)OOC(=O)CCCC(=O)O	{2: 6, 27: 2, 28: 2}
OK	10196-39-1	CCC1(COC1)CC	{1: 2, 2: 2, 11: 2, 13: 1, 23: 1}
OK	101976-64-1	CC(=O)ON[N+](=O)[O-]	{1: 1, 28: 1, 38: 1, 31: 1}
OK	10198-23-9	CC(=C)C1CCC(CC1)(C)OC(=O)C	{1: 3, 5: 1, 7: 1, 11: 4, 12: 1, 13: 1, 28: 1}
OK	10198-29-5	C1CCC2C(C1)CCO2	{11: 6, 12: 2, 23: 1}
OK	102-45-4	CC(CC1CCCC1)NC	{1: 2, 2: 1, 3: 1, 11: 4, 12: 1, 31: 1}
OK	102-52-3	COC(CC(OC)OC)OC	{1: 4, 2: 1, 3: 2, 22: 4}
OK	102-53-4	CCN(CC)CN(CC)CC	{1: 4, 2: 5, 33: 2}
OK	102-60-3	CC(CN(CCN(CC(C)O)CC(C)O)CC(C)O)O	{1: 4, 2: 6, 3: 4, 20: 4, 33: 2}
OK	102-69-2	CCCN(CCC)CCC	{1: 3, 2: 6, 33: 1}
OK	102-70-5	C=CCN(CC=C)CC=C	{33: 1, 2: 3, 5: 3, 6: 3}
OK	102-71-6	C(CO)N(CCO)CCO	{33: 1, 2: 6, 20: 3}
OK	102-76-1	CC(=O)OCC(COC(=O)C)OC(=O)C	{1: 3, 2: 2, 3: 1, 28: 3}
OK	102-79-4	CCCCN(CCO)CCO	{1: 1, 2: 7, 20: 2, 33: 1}
OK	102-80-7	CCCCCN(CCCCC)CCN(CCCCC)CCCCC	{1: 4, 2: 18, 33: 2}
OK	102-81-8	CCCCN(CCCC)CCO	{1: 2, 2: 8, 20: 1, 33: 1}
OK	102-82-9	CCCCN(CCCC)CCCC	{1: 3, 2: 9, 33: 1}
OK	102-83-0	CCCCN(CCCC)CCCN	{1: 2, 2: 9, 30: 1, 33: 1}
OK	102-86-3	CCCCCCN(CCCCCC)CCCCCC	{1: 3, 2: 15, 33: 1}
OK	102-87-4	CCCCCCCCCCCCN(CCCCCCCCCCCC)CCCCCCCCCCCC	{1: 3, 2: 33, 33: 1}
OK	102-88-5	CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC	{1: 3, 2: 51, 33: 1}
OK	10202-75-2	C=CCC(CC=C)(CC=C)O	{20: 1, 2: 3, 4: 1, 5: 3, 6: 3}
OK	10203-28-8	CCCCCCCCCCC(C)O	{1: 2, 2: 9, 3: 1, 20: 1}
OK	10203-30-2	CCCCCCCCCC(CC)O	{1: 2, 2: 9, 3: 1, 20: 1}
OK	10203-32-4	CCCCCCCCC(CCC)O	{1: 2, 2: 9, 3: 1, 20: 1}
OK	10203-33-5	CCCCCCCC(CCCC)O	{1: 2, 2: 9, 3: 1, 20: 1}
OK	10203-58-4	CCOC(=O)C(CC(C)C)C(=O)OCC	{1: 4, 2: 3, 3: 2, 28: 2}
OK	10206-21-0	CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CC#N)SC1)C(=O)O	{1: 1, 2: 2, 37: 1, 33: 1, 41: 1, 11: 1, 12: 2, 15: 2, 24: 1, 25: 1, 27: 1, 28: 1, 31: 1}
OK	102071-44-3	CC1(CC(CC(N1C2=NCCO2)(C)C)N)C	{1: 4, 35: 1, 33: 1, 11: 4, 12: 1, 13: 2, 15: 1, 23: 1, 30: 1}
OK	10208-80-7	CC1=C[C@@H]2[C@H](CC1)C(=CC[C@H]2C(C)C)C	{1: 4, 3: 1, 11: 3, 12: 3, 14: 2, 15: 2}
OK	102096-60-6	CC1(COC(=O)[C@@H]1OC(=O)C=C)C	{1: 2, 5: 1, 6: 1, 11: 1, 12: 1, 13: 1, 28: 2}
OK	102107-90-4	CCSSC(C)(C)C	{40: 2, 1: 4, 2: 1, 4: 1}
OK	10213-74-8	CCC(CC)COCCC(=O)O	{27: 1, 1: 2, 2: 5, 3: 1, 22: 1}
OK	10213-75-9	CCCCC(CC)COCCC#N	{1: 2, 2: 7, 3: 1, 37: 1, 22: 1}
OK	10213-77-1	CC(CO)OCC(C)OCC(C)OC	{1: 4, 2: 3, 3: 3, 20: 1, 22: 3}
OK	102145-82-4	CC(=CC(=O)C(F)(F)F)OC	{1: 2, 4: 1, 6: 1, 7: 1, 16: 3, 22: 1, 24: 1}
OK	10215-33-5	CCCCOCCCO	{1: 1, 2: 6, 20: 1, 22: 1}
OK	102155-34-0	CCCCCCC(CCC)C(CCC)CCCCCC	{1: 4, 2: 14, 3: 2}
OK	10218-02-7	C1CC2CCC1C2=O	{25: 1, 11: 4, 12: 2}
OK	10218-04-9	CC12CCC(C1)CC2=O	{1: 1, 11: 4, 12: 1, 13: 1, 25: 1}
OK	10218-83-4	CN(Br)Br	{1: 1, 18: 2, 33: 1}
OK	10218-87-8	CNBr	{1: 1, 18: 1, 31: 1}
OK	10218-88-9	CC(C)(C)NCl	{1: 3, 31: 1, 4: 1, 17: 1}
OK	10218-90-3	CN(C)Br	{1: 2, 18: 1, 33: 1}
OK	10219-75-7	C[C@H]1CCC=C2[C@@]1(C[C@@H](CC2)C(=C)C)C	{1: 3, 5: 1, 7: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 1}
OK	10220-20-9	C1CCN(CC1)SSN2CCCCC2	{40: 2, 33: 2, 11: 10}
OK	10220-23-2	COCCN1CCOCC1	{1: 1, 2: 2, 33: 1, 11: 4, 22: 1, 23: 1}
OK	10220-46-9	CCCCCCCCCCCCCCCCCCOC(=O)CS	{1: 1, 2: 18, 28: 1, 39: 1}
OK	10220-53-8	CCCCCCCCCCCCSCC(=O)N	{24: 1, 1: 1, 2: 12, 30: 1, 40: 1}
OK	10222-01-2	C(#N)C(C(=O)N)(Br)Br	{24: 1, 18: 2, 4: 1, 37: 1, 30: 1}
OK	10226-29-6	CC(=O)CCCCBr	{24: 1, 1: 1, 2: 4, 18: 1}
OK	10226-30-9	CC(=O)CCCCCl	{24: 1, 1: 1, 2: 4, 17: 1}
OK	102272-30-0	CCCCCCC(C(=O)O)(Cl)Cl	{1: 1, 2: 5, 27: 1, 4: 1, 17: 2}
OK	102286-63-5	CC(=O)O.CN(CCCN)CCCN.C1C(O1)CCl	{1: 2, 2: 7, 33: 1, 11: 1, 12: 1, 17: 1, 23: 1, 27: 1, 30: 2}
OK	102286-65-7	CC(C)(C)CCCCCC(=O)OCC1CO1.CC(C)(CO)CO	{1: 5, 2: 8, 4: 2, 11: 1, 12: 1, 20: 2, 23: 1, 28: 1}
OK	10229-10-4	CC#CCCO	{1: 1, 2: 2, 20: 1, 10: 2}
OK	10230-26-9	C1CC(C(C1)Br)Br	{18: 2, 11: 3, 12: 2}
OK	10230-68-9	CC(=O)C[N+](=O)[O-]	{24: 1, 1: 1, 2: 1, 38: 1}
OK	102308-32-7	CC1(N([C@@H](CO1)C=O)C(=O)OC(C)(C)C)C	{1: 5, 4: 1, 33: 1, 11: 1, 12: 1, 13: 1, 23: 1, 26: 1, 28: 1}
OK	10232-90-3	CC1COC(O1)C(CCl)Cl	{1: 1, 2: 1, 3: 1, 11: 1, 12: 2, 17: 2, 23: 2}
OK	10232-91-4	CCC(CC)COCCC#N	{1: 2, 2: 5, 3: 1, 37: 1, 22: 1}
OK	10232-92-5	CC(C)(CO)C(C#N)O	{1: 2, 2: 1, 3: 1, 4: 1, 37: 1, 20: 2}
OK	10232-93-6	COCCOC(=O)C=CC(=O)OCCOC	{1: 2, 2: 4, 28: 2, 22: 2, 6: 2}
OK	102322-85-0	C[C@@H]1[C@@H](C(C2CC1(C2)C)(C)C)OC(=C)C	{1: 5, 5: 1, 7: 1, 11: 2, 12: 3, 13: 2, 22: 1}
OK	10233-13-3	CCCCCCCCCCCC(=O)OC(C)C	{1: 3, 2: 10, 3: 1, 28: 1}
OK	10233-14-4	CCCCCCCCC=CCCCCCCCC(=O)OCCOCCOCCO	{1: 1, 2: 20, 6: 2, 20: 1, 22: 2, 28: 1}
OK	102340-97-6	C1CC2CC1C3=C2C4CC3C=C4	{11: 4, 12: 4, 14: 2, 15: 2}
OK	10235-63-9	CC(=C1CCC(CC1)(C)OC(=O)C)C	{1: 4, 7: 1, 11: 4, 13: 1, 15: 1, 28: 1}
OK	10236-53-0	C(CCN)C[C@@H](C(=O)O)NC(=O)CNC(=O)CN	{2: 6, 3: 1, 24: 2, 27: 1, 30: 2, 31: 2}
OK	1024-57-3	C12C(C(C3C1O3)Cl)C4(C(=C(C2(C4(Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 23: 1, 12: 5, 13: 3, 15: 2}
OK	102418-06-4	C[C@@H]1C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O)N(C)C)O)CC=O)C)O[C@H]3CC[C@@H]([C@H](O3)C)N(C)C	{1: 9, 2: 1, 33: 2, 11: 5, 12: 15, 14: 4, 20: 3, 22: 3, 23: 2, 26: 1, 28: 1}
OK	10248-74-5	CCCCCCCCCCCCCCCCCC(=O)OCCN(CCO)CCO	{1: 1, 2: 22, 20: 2, 28: 1, 33: 1}
OK	1025-15-6	C=CCN1C(=O)N(C(=O)N(C1=O)CC=C)CC=C	{25: 3, 2: 3, 5: 3, 6: 3, 33: 3}
OK	10250-48-3	CC(C)(C)CC(=O)OC	{1: 4, 2: 1, 4: 1, 28: 1}
OK	10250-52-9	CCC(I)I	{19: 2, 1: 1, 2: 1, 3: 1}
OK	102505-08-8	CC=C(C)C(=O)O[C@H]1[C@@H]([C@@]2([C@@H](C[C@@]3(C(=CCC4[C@]3(CCC5[C@@]4(CC[C@@H]([C@]5(C)CO)O[C@H]6[C@@H](C([C@@H]([C@H](O6)C(=O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O)O)O)C)C)C2CC1(C)C)C)O)CO)OC(=O)C.C(CO)N(CCO)CCO	{1: 9, 2: 9, 33: 1, 6: 1, 7: 1, 11: 8, 12: 21, 13: 6, 14: 1, 15: 1, 20: 14, 22: 3, 23: 3, 27: 1, 28: 2}
OK	10256-01-6	C1COCCN1C(=O)CC(=O)N2CCOCC2	{24: 2, 33: 2, 2: 1, 11: 8, 23: 2}
OK	102575-25-7	C1C=CCC2C3C1C23	{11: 2, 12: 4, 14: 2}
OK	102575-26-8	C1CC2C3C2C3C=C1	{11: 2, 12: 4, 14: 2}
OK	10258-54-5	COCCOC(=O)CC#N	{1: 1, 2: 3, 28: 1, 37: 1, 22: 1}
OK	102584-88-3	C(CC(C(=O)N)O)CN(C#N)N=O	{33: 1, 2: 3, 3: 1, 37: 1, 34: 1, 20: 1, 24: 1, 29: 1, 30: 1}
OK	102606-35-9	C1CC2C=CC(C1)C(=C2C#N)C#N	{11: 3, 12: 2, 37: 2, 14: 2, 15: 2}
OK	102608-53-7	CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C	{1: 5, 2: 10, 3: 3, 6: 1, 7: 1, 20: 1}
OK	102612-69-1	COCCOOC(=O)C=C	{1: 1, 2: 2, 5: 1, 6: 1, 22: 2, 28: 1}
OK	102616-54-6	C=CCNC1CCCCC1.C=CCN(CC=C)C1CCCCC1.C=CC(=O)N.Cl	{33: 1, 2: 3, 5: 4, 6: 4, 11: 10, 12: 2, 17: 1, 24: 1, 30: 1, 31: 1}
OK	102616-56-8	C=CCN(CC=C)C1CCCCC1.C=CC(=O)N.Cl	{33: 1, 2: 2, 5: 3, 6: 3, 11: 5, 12: 1, 17: 1, 24: 1, 30: 1}
OK	10264-16-1	CCCCNC(=O)CCC	{24: 1, 1: 2, 2: 5, 31: 1}
OK	10264-17-2	CCCCCCNC(=O)CCC	{24: 1, 1: 2, 2: 7, 31: 1}
OK	10264-24-1	CCCCCCNC(=O)CC	{24: 1, 1: 2, 2: 6, 31: 1}
OK	10264-25-2	CCCCCCNC(=O)CCCC	{24: 1, 1: 2, 2: 8, 31: 1}
OK	10264-55-8	CCC1CCC(=O)C1	{1: 1, 2: 1, 11: 3, 12: 1, 25: 1}
OK	10269-96-2	C(CCC(=O)O)CC[N+](=O)[O-]	{2: 5, 27: 1, 38: 1}
OK	102736-13-0	CCC(C)CCCC(C)(C)Cl	{1: 4, 2: 4, 3: 1, 4: 1, 17: 1}
OK	102745-35-7	CC(C)(C)C#CC=CC#CC(C)(C)C	{1: 6, 10: 4, 4: 2, 6: 2}
OK	10276-09-2	CC(C)(C=C)C(=O)O	{1: 2, 27: 1, 4: 1, 5: 1, 6: 1}
OK	10276-21-8	CC1(CC(=O)C2C(C1)(O2)C)C	{1: 3, 11: 2, 12: 1, 13: 2, 23: 1, 25: 1}
OK	10279-96-6	C1C2CC3CC(O2)CC1O3	{11: 4, 12: 4, 23: 2}
OK	10283-72-4	CCCCCCCCCCCCOC(=O)C=CC(=O)O	{1: 1, 2: 11, 27: 1, 28: 1, 6: 2}
OK	102831-44-7	CCOC(=O)C(C(=O)OCC)NC(=O)OC(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 28: 3, 31: 1}
OK	10284-63-6	COC1[C@@H]([C@H](C([C@@H]([C@@H]1O)O)O)O)O	{1: 1, 12: 6, 22: 1, 20: 5}
OK	10288-13-8	CC(C)C(CBr)Br	{1: 2, 2: 1, 3: 2, 18: 2}
OK	10289-68-6	CCCCCCCCCCC(CC)O	{1: 2, 2: 10, 3: 1, 20: 1}
OK	10289-94-8	CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO	{1: 1, 2: 44, 20: 1, 22: 13, 28: 1}
OK	102900-04-9	CCCCCCCCCCCCCCCCCCN.CCCCCCCCCCCCCCCCCCN.C(CCC(=O)O)CC(=O)O	{1: 2, 2: 38, 27: 2, 30: 2}
OK	10292-98-5	CC1(C2CCC1(CC2=O)C)C	{1: 3, 11: 3, 12: 1, 13: 2, 25: 1}
OK	10294-48-1	O=Cl(=O)(=O)OCl(=O)(=O)=O	{17: 2, 29: 6, 22: 1}
OK	102965-45-7	C(CO)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{20: 2, 2: 4, 27: 3, 4: 1, 30: 1}
OK	10297-05-9	C(CCI)CCl	{17: 1, 2: 4, 19: 1}
OK	10297-06-0	C#CCCCCCl	{9: 1, 2: 4, 10: 1, 17: 1}
OK	10297-09-3	C#CCCCCCC(=O)O	{9: 1, 2: 5, 27: 1, 10: 1}
OK	10297-38-8	CCOSOCC	{40: 1, 1: 2, 2: 2, 22: 2}
OK	10297-57-1	CCCCCCCC(C)(C)O	{1: 3, 2: 6, 4: 1, 20: 1}
OK	10299-30-6	CC(CCC(CO)O)O	{1: 1, 2: 3, 3: 2, 20: 3}
OK	103-00-4	CC(CNC1CCCCC1)O	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 20: 1, 31: 1}
OK	103-08-2	CCCCC(CC)CCC(C)O	{1: 3, 2: 6, 3: 2, 20: 1}
OK	103-09-3	CCCCC(CC)COC(=O)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	103-11-7	CCCCC(CC)COC(=O)C=C	{1: 2, 2: 5, 3: 1, 5: 1, 6: 1, 28: 1}
OK	103-20-8	CCCCC(CC)CCC(CC(C)C)O	{1: 4, 2: 7, 3: 3, 20: 1}
OK	103-23-1	CCCCC(CC)COC(=O)CCCCC(=O)OCC(CC)CCCC	{1: 4, 2: 14, 3: 2, 28: 2}
OK	103-24-2	CCCCC(CC)COC(=O)CCCCCCCC(=O)OCC(CC)CCCC	{1: 4, 2: 17, 3: 2, 28: 2}
OK	103-34-4	C1COCCN1SSN2CCOCC2	{40: 2, 33: 2, 11: 8, 23: 2}
OK	103-44-6	CCCCC(CC)COC=C	{1: 2, 2: 5, 3: 1, 5: 1, 6: 1, 22: 1}
OK	103-75-3	CCOC1CCC=CO1	{1: 1, 2: 1, 11: 2, 12: 1, 14: 2, 22: 1, 23: 1}
OK	103-76-4	C1CN(CCN1)CCO	{32: 1, 33: 1, 2: 2, 11: 4, 20: 1}
OK	103-78-6	CC(=O)CC1CCCCC1	{24: 1, 1: 1, 2: 1, 11: 5, 12: 1}
OK	10302-94-0	CCOC(=O)/C=C(/C(=O)OCC)\Cl	{1: 2, 2: 2, 6: 1, 7: 1, 17: 1, 28: 2}
OK	103021-43-8	CN1CC2C3C1C4C(C3)C2CN4C	{1: 2, 11: 3, 12: 6, 33: 2}
OK	103021-44-9	C1C2C3CN4C2C5C1C3CN5C4	{33: 2, 11: 4, 12: 6}
OK	10305-38-1	CCCCCCOCC(CO)O	{1: 1, 2: 7, 3: 1, 20: 2, 22: 1}
OK	10305-39-2	CCCCCCCOCC(CO)O	{1: 1, 2: 8, 3: 1, 20: 2, 22: 1}
OK	103072-21-5	C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O	{34: 2, 8: 2, 11: 8, 12: 4, 2: 1, 29: 2}
OK	10308-84-6	C(=N)(N)N.OCl(=O)(=O)=O	{36: 1, 7: 1, 17: 1, 20: 1, 29: 3, 30: 2}
OK	10309-20-3	CC1(C2CCC(C2)(C1=C)C(=O)O)C	{1: 2, 5: 1, 11: 3, 12: 1, 13: 2, 15: 1, 27: 1}
OK	10309-50-9	CC1(C2(CCC1(C(=O)C2)C)C)C	{1: 4, 11: 3, 13: 3, 25: 1}
OK	10312-58-0	CC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS	{1: 1, 2: 9, 4: 1, 28: 3, 39: 3}
OK	10312-83-1	COCC=O	{1: 1, 2: 1, 26: 1, 22: 1}
OK	103128-76-3	C[C@@H]1CC[C@H]([C@@H](C1)OCCl)C(C)C	{1: 3, 2: 1, 3: 1, 11: 3, 12: 3, 17: 1, 22: 1}
OK	10315-89-6	CC(C)CN1CCCCC1	{11: 5, 1: 2, 2: 1, 3: 1, 33: 1}
OK	10315-98-7	CC(C)CN1CCOCC1	{1: 2, 2: 1, 3: 1, 33: 1, 11: 4, 23: 1}
OK	10316-79-7	C1CCC(C1)(CO)N	{2: 1, 11: 4, 20: 1, 13: 1, 30: 1}
OK	10317-10-9	CC(CO)CCl	{1: 1, 2: 2, 3: 1, 20: 1, 17: 1}
OK	10318-18-0	C(C(C(=O)O)N)S.Cl	{2: 1, 3: 1, 39: 1, 17: 1, 27: 1, 30: 1}
OK	103185-26-8	CC(C)(C)C#CC12CC3CC(C1)CC(C3)C2	{1: 3, 4: 1, 10: 2, 11: 6, 12: 3, 13: 1}
OK	10321-71-8	CC(C)C=CC(=O)O	{27: 1, 1: 2, 3: 1, 6: 2}
OK	10324-58-0	CCCCCN1CCCCC1	{1: 1, 2: 4, 11: 5, 33: 1}
OK	10326-41-7	C[C@H](C(=O)O)O	{27: 1, 1: 1, 3: 1, 20: 1}
OK	10328-51-5	C1CC(CCC1CNC(=O)CN2CC2)CNC(=O)CN3CC3	{33: 2, 2: 4, 11: 8, 12: 2, 24: 2, 31: 2}
OK	10329-37-0	CC(=CCl)C#N	{1: 1, 17: 1, 37: 1, 6: 1, 7: 1}
OK	10329-90-5	C1CCC(=O)CCCCCC(=O)CC1	{25: 2, 11: 10}
OK	10332-31-7	CCCCCCCCCCCC(=O)OCC(CO)(CO)CO	{1: 1, 2: 14, 4: 1, 20: 3, 28: 1}
OK	103322-56-1	CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)CO	{1: 3, 2: 2, 3: 1, 4: 1, 11: 5, 12: 1, 20: 1, 28: 1, 31: 1}
OK	10333-53-6	CCCN(CCC)CN(CCC)CCC	{1: 4, 2: 9, 33: 2}
OK	10335-69-0	CCCCCCCCC=CCCCCCCCC(=O)NO	{1: 1, 2: 14, 6: 2, 20: 1, 24: 1, 31: 1}
OK	10339-31-8	C(C(=O)O)N[N+](=O)[O-]	{2: 1, 27: 1, 38: 1, 31: 1}
OK	10339-55-6	CC/C(=C/CCC(C)(C=C)O)/C	{1: 3, 2: 3, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	10339-60-3	CCCCCCC=CCCO	{1: 1, 2: 7, 20: 1, 6: 2}
OK	10340-23-5	CCCCCC=CCCO	{1: 1, 2: 6, 20: 1, 6: 2}
OK	10340-84-8	CC(CCC=C(C)C)CCBr	{1: 3, 2: 4, 3: 1, 6: 1, 7: 1, 18: 1}
OK	103404-57-5	CCCCC(C(CO)O)O	{1: 1, 2: 4, 3: 2, 20: 3}
OK	10342-97-9	CC(C)N(C)C(C)C	{1: 5, 3: 2, 33: 1}
OK	10343-99-4	C1CC[C@@H]2[C@H](C1)CCCN2	{32: 1, 11: 7, 12: 2}
OK	103434-09-9	C1CC2(CCC1C2)C#N	{11: 5, 12: 1, 13: 1, 37: 1}
OK	10344-69-1	CCOC(=N)CC(=N)OCC.Cl.Cl	{1: 2, 2: 3, 36: 2, 7: 2, 17: 2, 22: 2}
OK	103443-54-5	C1CO1.C(C(CO)O)O.C(=O)=O	{2: 2, 3: 1, 8: 1, 11: 2, 20: 3, 23: 1, 29: 2}
OK	10347-54-3	C1CC(CCC1CN=C=O)CN=C=O	{34: 2, 8: 2, 11: 4, 12: 2, 2: 2, 29: 2}
OK	10347-88-3	CC(C)(C)C(CCC(=O)O)CC(=O)O	{27: 2, 1: 3, 2: 3, 3: 1, 4: 1}
OK	10348-47-7	CCOC(=O)C(CC(C)C)O	{1: 3, 2: 2, 3: 2, 20: 1, 28: 1}
OK	103513-09-3	CC1CO1.C(CO)O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O	{1: 1, 2: 5, 11: 1, 12: 9, 13: 1, 20: 10, 22: 1, 23: 3}
OK	10352-87-1	CCCOC(=O)C=CC	{1: 2, 2: 2, 28: 1, 6: 2}
OK	10353-53-4	C=CCCC1CO1	{2: 2, 5: 1, 6: 1, 11: 1, 12: 1, 23: 1}
OK	10353-86-3	CC(CN(CCO)CC(C)O)O	{1: 2, 2: 4, 3: 2, 20: 3, 33: 1}
OK	103549-34-4	COC(=O)C12CC3CC(C1)CC(C3)C2Cl	{1: 1, 11: 5, 12: 4, 13: 1, 17: 1, 28: 1}
OK	103549-35-5	COC(=O)C12CC3CC(C1)CC(C3)(C2)Cl	{1: 1, 11: 6, 12: 2, 13: 2, 17: 1, 28: 1}
OK	103549-36-6	COC1C2CC3CC(C2)CC1(C3)C(=O)OC	{1: 2, 11: 5, 12: 4, 13: 1, 22: 1, 28: 1}
OK	103549-37-7	COC(=O)C12CC3CC(C1)CC(C3)(C2)OC	{1: 2, 11: 6, 12: 2, 13: 2, 22: 1, 28: 1}
OK	103554-13-8	CCCCCCC1CCC2CCCCC2C1	{1: 1, 2: 5, 11: 7, 12: 3}
OK	10356-92-0	CN(C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)N=O	{1: 1, 2: 2, 3: 4, 33: 1, 34: 1, 20: 5, 29: 1}
OK	103582-42-9	COC(=C)C1CC2CCC1C2	{1: 1, 5: 1, 7: 1, 11: 4, 12: 3, 22: 1}
OK	103582-44-1	C/C(=C/1\CC2CCC1C2)/OC	{1: 2, 7: 1, 11: 4, 12: 2, 15: 1, 22: 1}
OK	103582-46-3	COC(=C)C1CC2CC1C=C2	{1: 1, 5: 1, 7: 1, 11: 2, 12: 3, 14: 2, 22: 1}
OK	103582-48-5	CC(=C1CC2CC1C=C2)OC	{1: 2, 7: 1, 11: 2, 12: 2, 14: 2, 15: 1, 22: 1}
OK	103582-50-9	COC(=C)C1C2CC3C1C3C2	{1: 1, 5: 1, 7: 1, 11: 2, 12: 5, 22: 1}
OK	103582-51-0	CC(=C1C2CC3C1C3C2)OC	{1: 2, 7: 1, 11: 2, 12: 4, 15: 1, 22: 1}
OK	10359-02-1	CC(C)C1COC1=O	{11: 1, 1: 2, 3: 1, 12: 1, 28: 1}
OK	10359-20-3	CC(C#N)(C#N)C#N	{1: 1, 4: 1, 37: 3}
OK	10359-44-1	C1CC1C=CC2CC2	{11: 4, 12: 2, 6: 2}
OK	10359-64-5	CCC(C)SC	{40: 1, 1: 3, 2: 1, 3: 1}
OK	10359-65-6	CC(C)CSC(C)C	{40: 1, 1: 4, 2: 1, 3: 2}
OK	103619-06-3	CC(=CCCC(C)(C=C)O)CO	{1: 2, 2: 3, 4: 1, 5: 1, 6: 2, 7: 1, 20: 2}
OK	10371-45-6	CCC(C)OC(=O)C=CC	{1: 3, 2: 1, 3: 1, 28: 1, 6: 2}
OK	10373-78-1	CC1(C2CCC1(C(=O)C2=O)C)C	{1: 3, 11: 2, 12: 1, 13: 2, 25: 2}
OK	10374-74-0	CCCCCCC=CCCCCCC	{1: 2, 2: 10, 6: 2}
OK	10375-00-5	CC(=C)C(=O)OCC1CC2CCC1C2	{1: 1, 2: 1, 5: 1, 7: 1, 11: 4, 12: 3, 28: 1}
OK	10375-08-3	CCCCCCCCCCCC(=O)NCCCN	{24: 1, 1: 1, 2: 13, 30: 1, 31: 1}
OK	10378-01-5	CCCCCCC=CCCCCCCCCO	{1: 1, 2: 13, 20: 1, 6: 2}
OK	10378-82-2	CCC1(C(O1)CCC(C)(C=C)OC(=O)C)C	{1: 4, 2: 3, 4: 1, 5: 1, 6: 1, 12: 1, 13: 1, 23: 1, 28: 1}
OK	1038-19-3	CC12CCC3C(C1CC[C@@H]2O)CCC4C3(C[C@](C4)(C#C)O)C	{1: 2, 9: 1, 10: 1, 11: 8, 12: 5, 13: 3, 20: 2}
OK	103831-11-4	C1CNCC1N.Cl.Cl	{32: 1, 17: 2, 11: 3, 12: 1, 30: 1}
OK	103834-29-3	CC(C)C12CCC(O1)(C(C2)O)C	{1: 3, 3: 1, 11: 3, 12: 1, 13: 2, 20: 1, 23: 1}
OK	103837-35-0	CC(COCCCO)OCCCO.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O	{1: 1, 2: 8, 3: 1, 8: 2, 11: 2, 13: 2, 14: 8, 34: 2, 20: 2, 22: 2, 29: 2}
OK	103837-45-2	CC1CO1.CC(CO)O.C1CO1.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O	{1: 2, 2: 2, 3: 1, 8: 2, 11: 5, 12: 1, 13: 2, 14: 8, 34: 2, 20: 2, 23: 2, 29: 2}
OK	103842-92-8	C(CCC(=O)O)CC(=O)O.C(CCO)CO.C(CO)O	{2: 10, 27: 2, 20: 4}
OK	103849-43-0	CC(CCO)O.CC(C)(CO)CO.C(CCC(=O)O)CC(=O)O	{1: 3, 2: 8, 3: 1, 4: 1, 20: 4, 27: 2}
OK	103893-10-3	C1CN(C(=O)N1)N=O	{32: 1, 33: 1, 34: 1, 11: 2, 25: 1, 29: 1}
OK	103905-52-8	C=C(C#C)O	{9: 1, 10: 1, 20: 1, 5: 1, 7: 1}
OK	103905-53-9	C1C=CC=C1O	{11: 1, 20: 1, 14: 3, 15: 1}
OK	103905-54-0	C1C=CC(=C1)O	{11: 1, 20: 1, 14: 3, 15: 1}
OK	10395-51-4	COC1(CC2CCC1C2)OC	{1: 2, 11: 4, 12: 2, 13: 1, 22: 2}
OK	10395-55-8	COC1CC2CCC1C2	{1: 1, 11: 4, 12: 3, 22: 1}
OK	10397-68-9	CC(C(=O)N(C)C)Cl	{24: 1, 1: 3, 3: 1, 33: 1, 17: 1}
OK	103985-40-6	CC1=C(CCC(C1)(C)C)CO	{1: 3, 2: 1, 11: 3, 13: 1, 15: 2, 20: 1}
OK	104-07-4	CCCCCCCCCCCCCCCCCC(=O)OC1CCCCC1	{1: 1, 2: 16, 11: 5, 12: 1, 28: 1}
OK	104-19-8	CN1CCN(CC1)CCN(C)C	{1: 3, 2: 2, 11: 4, 33: 3}
OK	104-50-7	CCCCC1CCC(=O)O1	{1: 1, 2: 3, 11: 2, 12: 1, 28: 1}
OK	104-58-5	C1CCN(CC1)CCCO	{33: 1, 2: 3, 11: 5, 20: 1}
OK	104-61-0	CCCCCC1CCC(=O)O1	{1: 1, 2: 4, 11: 2, 12: 1, 28: 1}
OK	104-67-6	CCCCCCCC1CCC(=O)O1	{1: 1, 2: 6, 11: 2, 12: 1, 28: 1}
OK	104-74-5	CCCCCCCCCCCC[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 11, 33: 1, 14: 5, 17: 1}
OK	104-75-6	CCCCC(CC)CN	{1: 2, 2: 5, 3: 1, 30: 1}
OK	104-76-7	CCCCC(CC)CO	{1: 2, 2: 5, 3: 1, 20: 1}
OK	104-78-9	CCN(CC)CCCN	{1: 2, 2: 5, 30: 1, 33: 1}
OK	104-79-0	CCN(CC)CCNC	{1: 3, 2: 4, 33: 1, 31: 1}
OK	104-80-3	C1CC(OC1CO)CO	{20: 2, 2: 2, 11: 2, 12: 2, 23: 1}
OK	104-89-2	CCC1CCC(NC1)C	{32: 1, 1: 2, 2: 1, 11: 3, 12: 2}
OK	104-97-2	C1CCC(C1)CCC(=O)Cl	{24: 1, 17: 1, 2: 2, 11: 4, 12: 1}
OK	104-99-4	CCN(C)CCN(CC)CC	{1: 4, 2: 5, 33: 2}
OK	104013-09-4	C=CC1C2CC(C1O)C=C2	{5: 1, 6: 1, 11: 1, 12: 4, 14: 2, 20: 1}
OK	10405-27-3	N(F)F	{16: 2, 31: 1}
OK	10407-33-7	COC(=O)CCC1CCCCC1=O	{1: 1, 2: 2, 11: 4, 12: 1, 25: 1, 28: 1}
OK	10409-46-8	CC1(CCCCC1=O)Cl	{1: 1, 11: 4, 25: 1, 13: 1, 17: 1}
OK	10411-93-5	CCC(=O)OC1CCC(CC1)C(C)(C)C	{1: 4, 2: 1, 4: 1, 11: 4, 12: 2, 28: 1}
OK	10412-98-3	CC(=O)CCCC#N	{24: 1, 1: 1, 2: 3, 37: 1}
OK	104133-72-4	CCCCCCCCCCCCCCCOC(C)(C)C	{1: 4, 2: 14, 4: 1, 22: 1}
OK	10417-94-4	CCC=CCC=CCC=CCC=CCC=CCCCC(=O)O	{1: 1, 2: 8, 27: 1, 6: 10}
OK	104195-80-4	C[C@@H]([C@@H](C(=O)O)N)OC	{27: 1, 1: 2, 3: 2, 30: 1, 22: 1}
OK	10420-33-4	CC(=O)C(CC(=O)OC)C(=O)OC	{24: 1, 1: 3, 2: 1, 3: 1, 28: 2}
OK	10420-90-3	C=CC=CC#C	{9: 1, 10: 1, 5: 1, 6: 3}
OK	10420-91-4	CC#CCC#C	{1: 1, 2: 1, 10: 3, 9: 1}
OK	10422-35-2	CCC(C)CBr	{1: 2, 2: 2, 3: 1, 18: 1}
OK	10430-97-4	CCCCCCCCCCOCC(CO)O	{1: 1, 2: 11, 3: 1, 20: 2, 22: 1}
OK	10431-86-4	CCCC(=O)N1CC1	{24: 1, 1: 1, 2: 2, 11: 2, 33: 1}
OK	10431-98-8	CCC1=NCCO1	{1: 1, 2: 1, 35: 1, 11: 2, 15: 1, 23: 1}
OK	104321-62-2	CCOC(=O)/C=C/[C@@H]1COC(O1)(C)C	{1: 3, 2: 1, 6: 2, 11: 1, 12: 1, 13: 1, 23: 2, 28: 1}
OK	10436-39-2	C(C(=C(Cl)Cl)Cl)Cl	{17: 4, 2: 1, 7: 2}
OK	104404-17-3	CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@@H](/C=C/CCCCCCCCCCCCC)O	{1: 2, 2: 29, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	10443-65-9	C=C(C(=O)O)Br	{18: 1, 27: 1, 5: 1, 7: 1}
OK	10448-26-7	CCCCCCCCCC(=O)OCCCCCC	{1: 2, 2: 13, 28: 1}
OK	1045-29-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CC[C@@H]4[C@@]3(C[C@](C4)(C#C)O)C	{1: 2, 9: 2, 10: 2, 11: 8, 12: 4, 13: 4, 20: 2}
OK	1045-69-8	CC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C	{1: 3, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	1045-71-2	C/C(=N/O)/C1=CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 3, 34: 1, 7: 1, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 20: 2}
OK	10450-60-9	OI(=O)(O)(O)(O)O	{19: 1, 20: 5, 29: 1}
OK	104513-12-4	CCCCCCCCCCC=CCCCCCCCCCCO	{1: 1, 2: 19, 20: 1, 6: 2}
OK	10453-89-1	CC(=CC1C(C1(C)C)C(=O)O)C	{1: 4, 6: 1, 7: 1, 12: 2, 13: 1, 27: 1}
OK	104534-96-5	C=C(CC(=O)OCC(F)(F)F)C(=O)OCC(F)(F)F	{2: 3, 4: 2, 5: 1, 7: 1, 16: 6, 28: 2}
OK	10458-14-7	CC1CCC(C(=O)C1)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2, 25: 1}
OK	10458-98-7	CC12CCC(CC1=CCC3C2CCC4(C3CC5C4OC(=O)C5)C)O	{1: 2, 11: 8, 12: 6, 13: 2, 14: 1, 15: 1, 20: 1, 28: 1}
OK	104598-80-3	COC1(CCCC(=C)C1)OC	{1: 2, 5: 1, 11: 4, 13: 1, 15: 1, 22: 2}
OK	104598-81-4	C=C1CCCC2(C1)OCCO2	{15: 1, 23: 2, 11: 6, 5: 1, 13: 1}
OK	10463-48-6	C=CC(CBr)Br	{18: 2, 2: 1, 3: 1, 5: 1, 6: 1}
OK	10469-70-2	CC(=NNC(=O)N)CN.Cl	{1: 1, 2: 1, 7: 1, 34: 1, 17: 1, 24: 1, 30: 2, 31: 1}
OK	10471-28-0	CCOC(=O)CCCCCCCCCCC(=O)OCC	{1: 2, 2: 12, 28: 2}
OK	10471-78-0	CC(=C)C1=NCCO1	{1: 1, 35: 1, 5: 1, 7: 1, 11: 2, 15: 1, 23: 1}
OK	10471-96-2	CCCCC(=O)OC(C)(CCC=C(C)C)C=C	{1: 4, 2: 5, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	10472-24-9	COC(=O)C1CCCC1=O	{1: 1, 11: 3, 12: 1, 28: 1, 25: 1}
OK	10473-14-0	CC(C(=C)C)O	{1: 2, 3: 1, 20: 1, 5: 1, 7: 1}
OK	10474-14-3	CC(CCl)(CBr)Br	{1: 1, 2: 2, 4: 1, 18: 2, 17: 1}
OK	10474-24-5	C=C1C2=CC=CC=C1C=CC=C2	{5: 1, 14: 8, 15: 3}
OK	10476-95-6	CC(=C)C(OC(=O)C)OC(=O)C	{1: 3, 3: 1, 28: 2, 5: 1, 7: 1}
OK	104766-62-3	C1CCC(C1)(C#CC#CC2(CCCC2)O)O	{10: 4, 11: 8, 20: 2, 13: 2}
OK	10477-47-1	C=CC(=O)OCC#C	{2: 1, 5: 1, 6: 1, 9: 1, 10: 1, 28: 1}
OK	10478-42-9	CN(CCC(=O)O)N=O	{1: 1, 34: 1, 33: 1, 2: 2, 27: 1, 29: 1}
OK	10482-53-8	CC/C=C\C/C=C\C/C=C\CCCCCC=C	{1: 1, 2: 8, 5: 1, 6: 7}
OK	10484-11-4	CCCCCCCCCCC(=O)OCCCCC	{1: 2, 2: 13, 28: 1}
OK	10484-35-2	CCCCCCCCCCCCCC(=O)OCCCCC	{1: 2, 2: 16, 28: 1}
OK	10485-70-8	CC(=CCC/C(=C/CC/C(=C/C(=O)OC)/C)/C)C	{1: 5, 2: 4, 28: 1, 6: 3, 7: 3}
OK	104857-88-7	COC(=O)CC(=O)C(C(F)(F)F)(F)F	{1: 1, 2: 1, 4: 2, 16: 5, 24: 1, 28: 1}
OK	10486-19-8	CCCCCCCCCCCCC=O	{1: 1, 2: 11, 26: 1}
OK	10486-26-7	CCC(=O)OC1CC(C2CC(=C(C)C)CC2C(=C1)C)C	{1: 5, 2: 1, 7: 1, 11: 3, 12: 4, 14: 1, 15: 2, 28: 1}
OK	10487-71-5	CC=CC(=O)Cl	{24: 1, 1: 1, 6: 2, 17: 1}
OK	104870-56-6	C[C@H]1CC[C@@H]([C@H](C1)O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 3, 20: 1}
OK	104883-33-2	C(C(=O)OCC(F)(F)F)C(=O)OCC(F)(F)F	{16: 6, 28: 2, 2: 3, 4: 2}
OK	10489-97-1	C1CCC(CC1)(Br)Br	{18: 2, 11: 5, 13: 1}
OK	104910-78-3	C=CC(=O)C(=O)C=C	{24: 2, 5: 2, 6: 2}
OK	10493-43-3	C(=C(F)F)(OC(C(F)(F)F)(F)F)F	{16: 8, 4: 2, 22: 1, 7: 2}
OK	10493-44-4	C(CBr)C(=C(F)F)F	{16: 3, 2: 2, 18: 1, 7: 2}
OK	10493-98-8	C1CC(=O)C(=C1)O	{25: 1, 11: 2, 20: 1, 14: 1, 15: 1}
OK	10494-87-8	CC=C1CCCCCC1	{1: 1, 11: 6, 6: 1, 15: 1}
OK	10496-15-8	CCCCCCSSCCCCCC	{40: 2, 1: 2, 2: 10}
OK	10496-16-9	CCCCCCCSSCCCCCCC	{40: 2, 1: 2, 2: 12}
OK	10496-18-1	CCCCCCCCCCSSCCCCCCCCCC	{40: 2, 1: 2, 2: 18}
OK	10498-35-8	C1CC[C@@H]([C@@H](C1)Cl)Cl	{17: 2, 11: 4, 12: 2}
OK	104987-11-3	C[C@@H]1C[C@@H]([C@@H]2[C@H](C[C@H]([C@@](O2)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H]([C@@H]([C@H](CC(=O)[C@@H](/C=C(/C1)\C)CC=C)O)C)/C(=C/[C@@H]4CC[C@H]([C@@H](C4)OC)O)/C)O)C)OC)OC	{1: 8, 2: 1, 5: 1, 6: 2, 7: 1, 11: 11, 12: 13, 13: 1, 14: 1, 15: 1, 20: 3, 22: 3, 23: 1, 25: 3, 33: 1, 28: 1}
OK	10499-33-9	C1CCCC(=NO)C(CC1)Cl	{34: 1, 11: 6, 12: 1, 15: 1, 17: 1, 20: 1}
OK	105-02-2	C1CC(OC1)COC(=O)CCCCC(=O)OCC2CCCO2	{28: 2, 2: 6, 11: 6, 12: 2, 23: 2}
OK	105-03-3	CCC(CC)COC(=O)CCCCCCCC(=O)OCC(CC)CC	{1: 4, 2: 13, 3: 2, 28: 2}
OK	105-04-4	CCNCCN(CC)CC	{1: 3, 2: 5, 33: 1, 31: 1}
OK	105-08-8	C1CC(CCC1CO)CO	{20: 2, 2: 2, 11: 4, 12: 2}
OK	105-14-6	CCN(CC)CCCC(=O)C	{24: 1, 1: 3, 2: 5, 33: 1}
OK	105-16-8	CCN(CC)CCOC(=O)C(=C)C	{1: 3, 2: 4, 5: 1, 33: 1, 7: 1, 28: 1}
OK	105-17-9	CCN(CC)C/C=C/CN(CC)CC	{1: 4, 2: 6, 6: 2, 33: 2}
OK	105-18-0	CCN(CC)CC#CCN(CC)CC	{1: 4, 2: 6, 10: 2, 33: 2}
OK	105-21-5	CCCC1CCC(=O)O1	{1: 1, 2: 2, 11: 2, 12: 1, 28: 1}
OK	105-28-2	CCCCCCCCCCCCCCCCCC1=NCCN1	{32: 1, 1: 1, 2: 16, 35: 1, 11: 2, 15: 1}
OK	105-29-3	CC(=CCO)C#C	{1: 1, 2: 1, 6: 1, 7: 1, 9: 1, 10: 1, 20: 1}
OK	105-30-6	CCCC(C)CO	{1: 2, 2: 3, 3: 1, 20: 1}
OK	105-31-7	CCCC(C#C)O	{1: 1, 2: 2, 3: 1, 9: 1, 10: 1, 20: 1}
OK	105-33-9	C(C#N)C(CCl)O	{17: 1, 2: 2, 3: 1, 20: 1, 37: 1}
OK	105-34-0	COC(=O)CC#N	{1: 1, 2: 1, 28: 1, 37: 1}
OK	105-35-1	CCNC(=O)CCl	{24: 1, 1: 1, 2: 2, 31: 1, 17: 1}
OK	105-36-2	CCOC(=O)CBr	{1: 1, 2: 2, 28: 1, 18: 1}
OK	105-37-3	CCC(=O)OCC	{1: 2, 2: 2, 28: 1}
OK	105-38-4	CCC(=O)OC=C	{1: 1, 2: 1, 28: 1, 5: 1, 6: 1}
OK	105-39-5	CCOC(=O)CCl	{1: 1, 2: 2, 28: 1, 17: 1}
OK	105-40-8	CCOC(=O)NC	{1: 2, 2: 1, 28: 1, 31: 1}
OK	105-41-9	CCC(C)CC(C)N	{1: 3, 2: 2, 3: 2, 30: 1}
OK	105-42-0	CCC(C)CC(=O)C	{24: 1, 1: 3, 2: 2, 3: 1}
OK	105-43-1	CCC(C)CC(=O)O	{27: 1, 1: 2, 2: 2, 3: 1}
OK	105-44-2	CC(C)CC(=NO)C	{1: 3, 2: 1, 3: 1, 7: 1, 34: 1, 20: 1}
OK	105-45-3	CC(=O)CC(=O)OC	{24: 1, 1: 2, 2: 1, 28: 1}
OK	105-46-4	CCC(C)OC(=O)C	{1: 3, 2: 1, 3: 1, 28: 1}
OK	105-48-6	CC(C)OC(=O)CCl	{1: 2, 2: 1, 3: 1, 28: 1, 17: 1}
OK	105-50-0	CCOC(=O)CC(=O)CC(=O)OCC	{24: 1, 1: 2, 2: 4, 28: 2}
OK	105-53-3	CCOC(=O)CC(=O)OCC	{1: 2, 2: 3, 28: 2}
OK	105-54-4	CCCC(=O)OCC	{1: 2, 2: 3, 28: 1}
OK	105-56-6	CCOC(=O)CC#N	{1: 1, 2: 2, 28: 1, 37: 1}
OK	105-57-7	CCOC(C)OCC	{1: 3, 2: 2, 3: 1, 22: 2}
OK	105-59-9	CN(CCO)CCO	{1: 1, 2: 4, 20: 2, 33: 1}
OK	105-60-2	C1CCC(=O)NCC1	{32: 1, 25: 1, 11: 5}
OK	105-66-8	CCCC(=O)OCCC	{1: 2, 2: 4, 28: 1}
OK	105-68-0	CCC(=O)OCCC(C)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	105-70-4	CC(=O)OCC(COC(=O)C)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 2}
OK	105-74-8	CCCCCCCCCCCC(=O)OOC(=O)CCCCCCCCCCC	{1: 2, 2: 20, 28: 2}
OK	105-75-9	CCCCOC(=O)C=CC(=O)OCCCC	{1: 2, 2: 6, 28: 2, 6: 2}
OK	105-76-0	CCCCOC(=O)/C=C\C(=O)OCCCC	{1: 2, 2: 6, 28: 2, 6: 2}
OK	105-78-2	CNCCN(C)CCN(C)CCNC	{1: 4, 2: 6, 33: 2, 31: 2}
OK	105-79-3	CCCCCC(=O)OCC(C)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	105-80-6	CC(C)COC(=O)CCCCCCCC(=O)OCC(C)C	{1: 4, 2: 9, 3: 2, 28: 2}
OK	105-82-8	CCCOC(C)OCCC	{1: 3, 2: 4, 3: 1, 22: 2}
OK	105-83-9	CN(CCCN)CCCN	{1: 1, 2: 6, 30: 2, 33: 1}
OK	105-84-0	CNCCN(C)CCNC	{1: 3, 2: 4, 33: 1, 31: 2}
OK	105-87-3	CC(=CCC/C(=C/COC(=O)C)/C)C	{1: 4, 2: 3, 28: 1, 6: 2, 7: 2}
OK	105-90-8	CCC(=O)OCC=C(C)CCC=C(C)C	{1: 4, 2: 4, 28: 1, 6: 2, 7: 2}
OK	105-93-1	CCNCCN(CC)CCNCC	{1: 3, 2: 7, 33: 1, 31: 2}
OK	105-95-3	C1CCCCCC(=O)OCCOC(=O)CCCCC1	{11: 13, 28: 2}
OK	105-97-5	CCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCC	{1: 2, 2: 22, 28: 2}
OK	105-99-7	CCCCOC(=O)CCCCC(=O)OCCCC	{1: 2, 2: 10, 28: 2}
OK	10503-96-5	CCCCOCCCl	{1: 1, 2: 5, 22: 1, 17: 1}
OK	105030-48-6	C=CCN1C(=O)N(C(=O)N(C1=O)CC=C)CC=C.C=CC=C	{25: 3, 2: 3, 5: 5, 6: 5, 33: 3}
OK	10507-78-5	CC(CNCCN(CC(C)O)CC(C)O)O	{1: 3, 2: 5, 3: 3, 33: 1, 20: 3, 31: 1}
OK	10508-00-6	CCCCCCCCCCCCNC(=O)CCSCCC(=O)NCCCCCCCCCCCC	{24: 2, 1: 2, 2: 26, 40: 1, 31: 2}
OK	10508-09-5	CCC(C)(C)OOC(C)(C)CC	{1: 6, 2: 2, 4: 2, 22: 2}
OK	105090-34-4	C1CC2CC1N3N2C4CCC3C4	{33: 2, 11: 6, 12: 4}
OK	10512-89-7	C[C@H]1CCN[C@@H]1C(=O)O	{27: 1, 1: 1, 11: 2, 12: 2, 32: 1}
OK	10514-79-1	CC(=C1CCC=C1)C	{15: 1, 1: 2, 11: 2, 14: 2, 7: 1}
OK	10519-11-6	CC(=O)OC1CCC2CCCCC2C1	{1: 1, 11: 7, 12: 3, 28: 1}
OK	10519-20-7	CCCCCC#CC(=O)OCC	{1: 2, 2: 5, 28: 1, 10: 2}
OK	10519-33-2	CCCCCCC=CC(=O)C	{24: 1, 1: 2, 2: 5, 6: 2}
OK	10520-24-8	C1C=CC2C1C3CC2CC3OCCO	{2: 2, 11: 3, 12: 5, 14: 2, 20: 1, 22: 1}
OK	10520-81-7	CCCCCCCCCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 11, 3: 1, 18: 1}
OK	10522-26-6	CCCCCCCCCC(C)CO	{1: 2, 2: 9, 3: 1, 20: 1}
OK	10522-33-5	CCCCC(=O)OCC=C(C)CCC=C(C)C	{1: 4, 2: 6, 28: 1, 6: 2, 7: 2}
OK	10522-34-6	CCCCCCCCCOC(=O)C(C)C	{1: 3, 2: 8, 3: 1, 28: 1}
OK	10522-37-9	CCCCCCCC=CC(=O)C	{24: 1, 1: 2, 2: 6, 6: 2}
OK	10524-01-3	CC(CCl)C=C	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 17: 1}
OK	10524-07-9	CC=CCCCl	{1: 1, 2: 2, 6: 2, 17: 1}
OK	10524-08-0	CC(CC=C)Cl	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 17: 1}
OK	10524-09-1	C(#CC(F)(F)F)C#CC(F)(F)F	{16: 6, 10: 4, 4: 2}
OK	10524-51-3	CN(C)C(N(C)C)(N(C)C)N(C)C	{1: 8, 4: 1, 33: 4}
OK	10524-70-6	CCCC(C)(C)CCO	{1: 3, 2: 4, 4: 1, 20: 1}
OK	10524-71-7	CCC(C)(CC)CCO	{1: 3, 2: 4, 4: 1, 20: 1}
OK	10525-37-8	CCCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 19, 30: 1}
OK	10526-15-5	CCCCC(CC)COC(=O)CCSCCC(=O)OCC(CC)CCCC	{40: 1, 1: 4, 2: 14, 3: 2, 28: 2}
OK	105311-65-7	C(=C(C(F)(F)F)F)(C(=C(F)F)F)F	{16: 8, 4: 1, 7: 4}
OK	105311-66-8	C1(=C(C(C1(C(F)(F)F)F)(F)F)F)F	{16: 8, 4: 1, 13: 2, 15: 2}
OK	10533-67-2	CSCC=NO	{1: 1, 2: 1, 6: 1, 40: 1, 34: 1, 20: 1}
OK	10534-13-1	C1CC(CCC1C#N)C#N	{11: 4, 12: 2, 37: 2}
OK	10535-50-9	CCCCCCCCC(=O)OCC(C)(COC(=O)CCCCCCCC)COC(=O)CCCCCCCC	{1: 4, 2: 24, 4: 1, 28: 3}
OK	10535-52-1	CC(=C)C(=O)OCC1CCCCO1	{1: 1, 2: 1, 5: 1, 7: 1, 11: 4, 12: 1, 23: 1, 28: 1}
OK	10542-44-6	CCCN(CC#C)CC#C	{1: 1, 2: 4, 33: 1, 10: 2, 9: 2}
OK	10542-47-9	CC(C)N(CC=C)CC=C	{1: 2, 2: 2, 3: 1, 5: 2, 6: 2, 33: 1}
OK	10543-57-4	CC(=O)N(CCN(C(=O)C)C(=O)C)C(=O)C	{24: 4, 1: 4, 2: 2, 33: 2}
OK	10543-60-9	CC(=O)N1C2C(N(C1=O)C(=O)C)N(C(=O)N2C(=O)C)C(=O)C	{24: 4, 1: 4, 12: 2, 33: 4, 25: 2}
OK	105431-36-5	CCOC(CBr)Br	{1: 1, 2: 2, 3: 1, 18: 2, 22: 1}
OK	10544-50-0	S1SSSSSSS1	{41: 8}
OK	10544-63-5	CCOC(=O)/C=C/C	{1: 2, 2: 1, 28: 1, 6: 2}
OK	10544-72-6	[N+](=O)([N+](=O)[O-])[O-]	{38: 2}
OK	10544-73-7	N(=O)[N+](=O)[O-]	{34: 1, 29: 1, 38: 1}
OK	10544-95-3	CCCCCCCCCCCCCCC(C)CCC	{1: 3, 2: 15, 3: 1}
OK	10544-96-4	CCCCCCCCCCCCC(C)CCCCC	{1: 3, 2: 15, 3: 1}
OK	10545-99-0	S(Cl)Cl	{40: 1, 17: 2}
OK	10552-94-0	C1C=CCN1N=O	{33: 1, 34: 1, 11: 2, 29: 1, 14: 2}
OK	10553-78-3	CC(=O)SCC(=O)Cl	{24: 2, 1: 1, 2: 1, 40: 1, 17: 1}
OK	10556-96-4	CN1CCCN(C1)C	{1: 2, 11: 4, 33: 2}
OK	10556-98-6	CC(C)N1CN(CN(C1)C(C)C)C(C)C	{11: 3, 1: 6, 3: 3, 33: 3}
OK	10557-44-5	CC(C)C=CC(C)C	{1: 4, 3: 2, 6: 2}
OK	10560-39-1	CC(C)(C)N1CN(CN(C1)C(C)(C)C)C(C)(C)C	{1: 9, 11: 3, 4: 3, 33: 3}
OK	105616-53-3	CCC(C(C)(C)O)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 2}
OK	10563-01-6	C=CC=C=C	{8: 1, 5: 2, 6: 2}
OK	10563-10-7	C1CC2=C(C1)CC2	{11: 5, 15: 2}
OK	10563-11-8	C1CCC2=C(C1)CC2	{11: 6, 15: 2}
OK	10563-23-2	CCNCCCN	{1: 1, 2: 4, 30: 1, 31: 1}
OK	10563-26-5	C(CN)CNCCNCCCN	{2: 8, 30: 2, 31: 2}
OK	10563-29-8	CN(C)CCCNCCCN	{1: 2, 2: 6, 33: 1, 30: 1, 31: 1}
OK	10565-52-3	CC([N+](=O)[O-])([N+](=O)[O-])ON=CC[N+](=O)[O-]	{1: 1, 2: 1, 4: 1, 38: 3, 6: 1, 34: 1, 22: 1}
OK	105674-79-1	CCCCCCCCC=CC(=O)Cl	{24: 1, 1: 1, 2: 7, 6: 2, 17: 1}
OK	10570-40-8	CN1C=NN=C1	{1: 1, 35: 2, 14: 2, 33: 1}
OK	10573-35-0	CC(C)CCCCCOC=C	{1: 2, 2: 5, 3: 1, 5: 1, 6: 1, 22: 1}
OK	10574-01-3	CCCCCCCCC=CCCCCCCCC(=O)NC(C)C	{1: 3, 2: 14, 3: 1, 6: 2, 24: 1, 31: 1}
OK	10574-36-4	CCC/C(=C\C)/C	{1: 3, 2: 2, 6: 1, 7: 1}
OK	10574-37-5	CCC(=C(C)C)C	{1: 4, 2: 1, 7: 2}
OK	10575-41-4	CCC(=O)C#CC	{24: 1, 1: 2, 2: 1, 10: 2}
OK	10575-56-1	CC(C(C)O)C(C)(C)C	{1: 5, 3: 2, 4: 1, 20: 1}
OK	10575-87-8	CCCCCC(CCl)Cl	{1: 1, 2: 5, 3: 1, 17: 2}
OK	10576-12-2	CCOC(=NO)C	{1: 2, 2: 1, 7: 1, 34: 1, 20: 1, 22: 1}
OK	10577-65-8	C1C[CH]C=C1	{11: 2, 14: 3}
OK	10577-96-5	C=CC1=NCCN1	{32: 1, 35: 1, 5: 1, 6: 1, 11: 2, 15: 1}
OK	10578-16-2	FN=NF	{16: 2, 34: 2}
OK	105786-40-1	C1C2C=CC1C(C2C(=O)N)N	{24: 1, 11: 1, 12: 4, 30: 2, 14: 2}
OK	10580-25-3	CCCCCC(=O)OCCC(C)CCC=C(C)C	{1: 4, 2: 8, 3: 1, 6: 1, 7: 1, 28: 1}
OK	10580-77-5	C1C(O1)CCOCCC2CO2	{2: 4, 11: 2, 12: 2, 22: 1, 23: 2}
OK	10586-17-1	CC(C)OC(=O)C(=C)C#N	{1: 2, 3: 1, 37: 1, 7: 1, 28: 1, 5: 1}
OK	10588-10-0	CCCCC(=O)OCC(C)C	{1: 3, 2: 4, 3: 1, 28: 1}
OK	10589-74-9	CCCCCN(C(=O)N)N=O	{1: 1, 2: 4, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	1059-86-5	CC(C)CCCC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)OC(=O)C)C)C	{1: 6, 2: 3, 3: 2, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 28: 1}
OK	105918-65-8	C(#N)SI	{40: 1, 19: 1, 37: 1}
OK	10595-09-2	C(CO)CSCCCO	{40: 1, 2: 6, 20: 2}
OK	10595-82-1	CCCCCCCCCCOC(=O)CCC(=O)OCCCCCCCCCC	{1: 2, 2: 20, 28: 2}
OK	10595-95-6	CCN(C)N=O	{1: 2, 2: 1, 34: 1, 29: 1, 33: 1}
OK	10596-53-9	CN(C)C(=CC=C(N(C)C)N(C)C)N(C)C	{1: 8, 33: 4, 6: 2, 7: 2}
OK	105961-74-8	C=CC1(CC1)C#C	{5: 1, 6: 1, 9: 1, 10: 1, 11: 2, 13: 1}
OK	105961-79-3	CC#CC1(CC1)C#C	{1: 1, 10: 3, 11: 2, 13: 1, 9: 1}
OK	10597-89-4	C[C@H](C(=O)O)O[C@H]([C@H](C=O)NC(=O)C)[C@@H]([C@@H](CO)O)O	{1: 2, 2: 1, 3: 5, 20: 3, 22: 1, 24: 1, 26: 1, 27: 1, 31: 1}
OK	10599-90-3	NCl	{17: 1, 30: 1}
OK	105996-38-1	CCCCOCC(CN(C)C)O	{1: 3, 2: 5, 3: 1, 33: 1, 20: 1, 22: 1}
OK	106-00-3	COCCOC(=O)CCCCC(=O)OCCOC	{1: 2, 2: 8, 28: 2, 22: 2}
OK	106-01-4	CCCCCCCCC(=O)OCCOCCOC(=O)CCCCCCCC	{1: 2, 2: 18, 28: 2, 22: 1}
OK	106-02-5	C1CCCCCCCOC(=O)CCCCCC1	{11: 14, 28: 1}
OK	106-06-9	CCCCCCCCC(=O)OCCOCCOCCOC(=O)CCCCCCCC	{1: 2, 2: 20, 28: 2, 22: 2}
OK	106-07-0	CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOCCO	{1: 1, 2: 24, 20: 1, 22: 3, 28: 1}
OK	106-08-1	CCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCO	{1: 1, 2: 28, 20: 1, 22: 8, 28: 1}
OK	106-10-5	CCCCCCCC(=O)OCCOCCOCCOC(=O)CCCCCCC	{1: 2, 2: 18, 28: 2, 22: 2}
OK	106-11-6	CCCCCCCCCCCCCCCCCC(=O)OCCOCCO	{1: 1, 2: 20, 20: 1, 22: 1, 28: 1}
OK	106-13-8	CCCCCCCCCCCC(=O)OCCOCC	{1: 2, 2: 13, 28: 1, 22: 1}
OK	106-14-9	CCCCCCC(CCCCCCCCCCC(=O)O)O	{27: 1, 1: 1, 2: 15, 3: 1, 20: 1}
OK	106-16-1	CCCCCCC(CC=CCCCCCCCC(=O)NCCO)O	{1: 1, 2: 15, 3: 1, 6: 2, 20: 2, 24: 1, 31: 1}
OK	106-18-3	CCCCCCCCCCCC(=O)OCCCC	{1: 2, 2: 13, 28: 1}
OK	106-19-4	CCCOC(=O)CCCCC(=O)OCCC	{1: 2, 2: 8, 28: 2}
OK	106-20-7	CCCCC(CC)CNCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 31: 1}
OK	106-21-8	CC(C)CCCC(C)CCO	{1: 3, 2: 5, 3: 2, 20: 1}
OK	106-22-9	CC(CCC=C(C)C)CCO	{1: 3, 2: 4, 3: 1, 6: 1, 7: 1, 20: 1}
OK	106-23-0	CC(CCC=C(C)C)CC=O	{1: 3, 2: 3, 3: 1, 6: 1, 7: 1, 26: 1}
OK	106-24-1	CC(=CCCC(=CCO)C)C	{1: 3, 2: 3, 20: 1, 6: 2, 7: 2}
OK	106-26-3	CC(=CCC/C(=C\C=O)/C)C	{1: 3, 2: 2, 26: 1, 6: 2, 7: 2}
OK	106-27-4	CCCC(=O)OCCC(C)C	{1: 3, 2: 4, 3: 1, 28: 1}
OK	106-29-6	CCCC(=O)OCC=C(C)CCC=C(C)C	{1: 4, 2: 5, 28: 1, 6: 2, 7: 2}
OK	106-30-9	CCCCCCC(=O)OCC	{1: 2, 2: 6, 28: 1}
OK	106-32-1	CCCCCCCC(=O)OCC	{1: 2, 2: 7, 28: 1}
OK	106-33-2	CCCCCCCCCCCC(=O)OCC	{1: 2, 2: 11, 28: 1}
OK	106-35-4	CCCCC(=O)CC	{24: 1, 1: 2, 2: 4}
OK	106-36-5	CCCOC(=O)CC	{1: 2, 2: 3, 28: 1}
OK	106-51-4	C1=CC(=O)C=CC1=O	{25: 2, 14: 4}
OK	106-52-5	CN1CCC(CC1)O	{1: 1, 11: 4, 12: 1, 20: 1, 33: 1}
OK	106-55-8	CC1CNC(CN1)C	{32: 2, 1: 2, 11: 2, 12: 2}
OK	106-56-9	CC1CNC(CO1)C	{32: 1, 1: 2, 11: 2, 12: 2, 23: 1}
OK	106-57-0	C1C(=O)NCC(=O)N1	{32: 2, 25: 2, 11: 2}
OK	106-58-1	CN1CCN(CC1)C	{1: 2, 11: 4, 33: 2}
OK	106-60-5	C(CC(=O)O)C(=O)CN	{24: 1, 2: 3, 27: 1, 30: 1}
OK	106-63-8	CC(C)COC(=O)C=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 28: 1}
OK	106-64-9	CCN(C)CCN(C)C	{1: 4, 2: 3, 33: 2}
OK	106-65-0	COC(=O)CCC(=O)OC	{1: 2, 2: 2, 28: 2}
OK	106-66-1	CCN(C)CCN(C)CC	{1: 4, 2: 4, 33: 2}
OK	106-67-2	CCC(CC(C)C)CO	{1: 3, 2: 3, 3: 2, 20: 1}
OK	106-68-3	CCCCCC(=O)CC	{24: 1, 1: 2, 2: 5}
OK	106-69-4	C(CCO)CC(CO)O	{2: 5, 3: 1, 20: 3}
OK	106-70-7	CCCCCC(=O)OC	{1: 2, 2: 4, 28: 1}
OK	106-71-8	C=CC(=O)OCCC#N	{2: 2, 28: 1, 5: 1, 6: 1, 37: 1}
OK	106-72-9	CC(CCC=C(C)C)C=O	{1: 3, 2: 2, 3: 1, 6: 1, 7: 1, 26: 1}
OK	106-73-0	CCCCCCC(=O)OC	{1: 2, 2: 5, 28: 1}
OK	106-74-1	CCOCCOC(=O)C=C	{1: 1, 2: 3, 5: 1, 6: 1, 22: 1, 28: 1}
OK	106-75-2	C(COC(=O)Cl)OCCOC(=O)Cl	{17: 2, 2: 4, 28: 2, 22: 1}
OK	106-79-6	COC(=O)CCCCCCCCC(=O)OC	{1: 2, 2: 8, 28: 2}
OK	106-83-2	CCCCCCCCC1C(O1)CCCCCCCC(=O)OCCCC	{1: 2, 2: 17, 12: 2, 28: 1, 23: 1}
OK	106-85-4	CC1CC2C(O2)CC1COC(=O)C	{1: 2, 2: 1, 11: 2, 12: 4, 23: 1, 28: 1}
OK	106-86-5	C=CC1CCC2C(C1)O2	{11: 3, 12: 3, 5: 1, 6: 1, 23: 1}
OK	106-87-6	C1CC2C(O2)CC1C3CO3	{11: 4, 12: 4, 23: 2}
OK	106-88-7	CCC1CO1	{1: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	106-89-8	C1C(O1)CCl	{17: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	106-90-1	C=CC(=O)OCC1CO1	{2: 1, 5: 1, 6: 1, 11: 1, 12: 1, 23: 1, 28: 1}
OK	106-91-2	CC(=C)C(=O)OCC1CO1	{1: 1, 2: 1, 5: 1, 7: 1, 11: 1, 12: 1, 23: 1, 28: 1}
OK	106-92-3	C=CCOCC1CO1	{2: 2, 5: 1, 6: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	106-93-4	C(CBr)Br	{2: 2, 18: 2}
OK	106-94-5	CCCBr	{1: 1, 2: 2, 18: 1}
OK	106-95-6	C=CCBr	{2: 1, 18: 1, 5: 1, 6: 1}
OK	106-96-7	C#CCBr	{9: 1, 2: 1, 18: 1, 10: 1}
OK	106-97-8	CCCC	{1: 2, 2: 2}
OK	106-98-9	CCC=C	{1: 1, 2: 1, 5: 1, 6: 1}
OK	106-99-0	C=CC=C	{5: 2, 6: 2}
OK	10601-80-6	CCOC(CC(=O)OCC)OCC	{1: 3, 2: 4, 3: 1, 28: 1, 22: 2}
OK	10602-34-3	CCOC(C=CC)OCC	{1: 3, 2: 2, 3: 1, 22: 2, 6: 2}
OK	10602-36-5	CCOC(CC=C)OCC	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 22: 2}
OK	10603-03-9	CC1CCCOC1=O	{1: 1, 11: 3, 12: 1, 28: 1}
OK	10604-70-3	C(CCC(=O)S)CC(=O)S	{24: 2, 2: 4, 39: 2}
OK	10606-42-5	CCOC(=O)CCOC	{1: 2, 2: 3, 28: 1, 22: 1}
OK	1062-96-0	CCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 7, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	106247-35-2	CC(C)(C)CC(C(=O)O)N	{1: 3, 2: 1, 3: 1, 4: 1, 27: 1, 30: 1}
OK	106342-04-5	CC1COC(CO1)C	{1: 2, 11: 2, 12: 2, 23: 2}
OK	106376-59-4	CCCCCN(C)N(C)CCCCC	{1: 4, 2: 8, 33: 2}
OK	10639-26-6	C(C1C(C(C(OC1OC2C(OC(C(C2O)O)O)CO)O)O)O)O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
OK	106392-12-5	CC1CO1.C1CO1	{1: 1, 11: 3, 12: 1, 23: 2}
OK	106508-62-7	CCOC(=O)CCCN=C=O	{1: 1, 2: 4, 8: 1, 34: 1, 28: 1, 29: 1}
OK	106538-38-9	C1CC(C2CCOC2)CO1	{11: 6, 12: 2, 23: 2}
OK	106562-31-6	CC(C)C1CC2CCC1C=C2	{11: 3, 1: 2, 3: 1, 12: 3, 14: 2}
OK	1066-17-7	CCC(C)CCCC(=O)N[C@@H](CCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCN)C(=O)N[C@H]1CCNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)CCN)CC(C)C)CC(C)C)CCN)CCN)[C@@H](C)O	{32: 7, 1: 8, 2: 16, 3: 8, 11: 2, 12: 7, 20: 2, 24: 4, 25: 7, 30: 5, 31: 4}
OK	106623-85-2	CCC1CC2CCC1C=C2	{1: 1, 2: 1, 11: 3, 12: 3, 14: 2}
OK	106631-38-3	CC1(CCCC2(C1CCC(=C)C2CCC(C)(C=C)O)C)C	{1: 4, 2: 2, 4: 1, 5: 2, 6: 1, 11: 5, 12: 2, 13: 2, 15: 1, 20: 1}
OK	106697-43-2	C1CC2CCC1C34C2(C=C3)C=C4	{11: 4, 12: 2, 13: 2, 14: 4}
OK	1067-08-9	CCC(C)(CC)CC	{1: 4, 2: 3, 4: 1}
OK	1067-09-0	CC(CCl)(CCl)CCl	{1: 1, 2: 3, 4: 1, 17: 3}
OK	1067-20-5	CCC(CC)(CC)CC	{1: 4, 2: 4, 4: 1}
OK	106710-59-2	C=C1C2C(=C)C(=C)C(C1=C)C2=O	{25: 1, 12: 2, 5: 4, 15: 4}
OK	106788-55-0	CCCCCCCCCCCCN1CC(OC(C1)C)C	{1: 3, 2: 11, 33: 1, 11: 2, 12: 2, 23: 1}
OK	1068-19-5	CCCC(C)(C)CCC	{1: 4, 2: 4, 4: 1}
OK	1068-27-5	CC(C)(C)OOC(C)(C)C#CC(C)(C)OOC(C)(C)C	{1: 10, 10: 2, 4: 4, 22: 4}
OK	1068-47-9	CC(CS)O	{1: 1, 2: 1, 3: 1, 20: 1, 39: 1}
OK	1068-57-1	CC(=O)NN	{24: 1, 1: 1, 30: 1, 31: 1}
OK	1068-87-7	CCC(C(C)C)C(C)C	{1: 5, 2: 1, 3: 3}
OK	1068-90-2	CCOC(=O)C(C(=O)OCC)NC(=O)C	{1: 3, 2: 2, 3: 1, 24: 1, 28: 2, 31: 1}
OK	106847-76-1	CCCCN(CCCC)C1CCCCN2C1=NCCC2	{1: 2, 2: 6, 35: 1, 33: 2, 11: 7, 12: 1, 15: 1}
OK	106899-94-9	C1CN1.C(CNCCN)N	{32: 1, 2: 4, 11: 2, 30: 2, 31: 1}
OK	1069-23-4	C=CC(C(C=C)O)O	{3: 2, 20: 2, 5: 2, 6: 2}
OK	1069-31-4	C(CC(C(=O)O)N)CN.Cl	{27: 1, 17: 1, 2: 3, 3: 1, 30: 2}
OK	1069-53-0	CC(C)CC(C)C(C)C	{1: 5, 2: 1, 3: 3}
OK	1069-55-2	CC(C)COC(=O)C(=C)C#N	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 28: 1, 37: 1}
OK	106917-30-0	CCCCCCCCCCCCC1CC(=O)N(C1=O)C2CC(N(C(C2)(C)C)C)(C)C	{1: 6, 2: 11, 33: 2, 11: 3, 12: 2, 13: 2, 25: 2}
OK	106955-89-9	CC1CC2C(CC3(C(O2)CC4C(O3)C(=CC(=O)O4)C)C)OC5C1OC6CC7C(CC8C(O7)(C/C=C\C9C(O8)CC1C(O9)CC2C(O1)(C(CC(O2)CC(=C)CO)O)C)C)(OC6(CC5)C)C	{1: 7, 2: 2, 5: 1, 7: 1, 11: 11, 12: 18, 13: 5, 14: 3, 15: 1, 20: 2, 23: 10, 28: 1}
OK	107-00-6	CCC#C	{1: 1, 2: 1, 10: 1, 9: 1}
OK	107-01-7	CC=CC	{1: 2, 6: 2}
OK	107-02-8	C=CC=O	{26: 1, 5: 1, 6: 1}
OK	107-03-9	CCCS	{1: 1, 2: 2, 39: 1}
OK	107-04-0	C(CBr)Cl	{17: 1, 2: 2, 18: 1}
OK	107-05-1	C=CCCl	{17: 1, 2: 1, 5: 1, 6: 1}
OK	107-06-2	C(CCl)Cl	{17: 2, 2: 2}
OK	107-07-3	C(CCl)O	{17: 1, 2: 2, 20: 1}
OK	107-08-4	CCCI	{1: 1, 2: 2, 19: 1}
OK	107-09-5	C(CBr)N	{2: 2, 18: 1, 30: 1}
OK	107-10-8	CCCN	{1: 1, 2: 2, 30: 1}
OK	107-11-9	C=CCN	{2: 1, 30: 1, 5: 1, 6: 1}
OK	107-12-0	CCC#N	{1: 1, 2: 1, 37: 1}
OK	107-13-1	C=CC#N	{5: 1, 6: 1, 37: 1}
OK	107-14-2	C(C#N)Cl	{17: 1, 2: 1, 37: 1}
OK	107-15-3	C(CN)N	{2: 2, 30: 2}
OK	107-16-4	C(C#N)O	{2: 1, 20: 1, 37: 1}
OK	107-18-6	C=CCO	{2: 1, 20: 1, 5: 1, 6: 1}
OK	107-19-7	C#CCO	{9: 1, 2: 1, 20: 1, 10: 1}
OK	107-20-0	C(C=O)Cl	{17: 1, 2: 1, 26: 1}
OK	107-21-1	C(CO)O	{2: 2, 20: 2}
OK	107-22-2	C(=O)C=O	{26: 2}
OK	107-25-5	COC=C	{1: 1, 22: 1, 5: 1, 6: 1}
OK	107-29-9	CC=NO	{1: 1, 34: 1, 20: 1, 6: 1}
OK	107-30-2	COCCl	{1: 1, 2: 1, 22: 1, 17: 1}
OK	107-39-1	CC(=C)CC(C)(C)C	{1: 4, 2: 1, 4: 1, 5: 1, 7: 1}
OK	107-40-4	CC(=CC(C)(C)C)C	{1: 5, 4: 1, 6: 1, 7: 1}
OK	107-41-5	CC(CC(C)(C)O)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 2}
OK	107-45-9	CC(C)(C)CC(C)(C)N	{1: 5, 2: 1, 4: 2, 30: 1}
OK	107-47-1	CC(C)(C)SC(C)(C)C	{40: 1, 1: 6, 4: 2}
OK	107-48-2	CC1(CO1)CC(C)(C)C	{1: 4, 2: 1, 4: 1, 11: 1, 13: 1, 23: 1}
OK	107-54-0	CC(C)CC(C)(C#C)O	{1: 3, 2: 1, 3: 1, 4: 1, 9: 1, 10: 1, 20: 1}
OK	107-58-4	CC(C)(C)NC(=O)C=C	{1: 3, 4: 1, 5: 1, 6: 1, 24: 1, 31: 1}
OK	107-59-5	CC(C)(C)OC(=O)CCl	{1: 3, 2: 1, 4: 1, 28: 1, 17: 1}
OK	107-69-7	C(C(Cl)(Cl)Cl)OC(=O)N	{17: 3, 2: 1, 4: 1, 30: 1, 28: 1}
OK	107-70-0	CC(=O)CC(C)(C)OC	{24: 1, 1: 4, 2: 1, 4: 1, 22: 1}
OK	107-71-1	CC(=O)OOC(C)(C)C	{1: 4, 4: 1, 22: 1, 28: 1}
OK	107-74-4	CC(CCCC(C)(C)O)CCO	{1: 3, 2: 5, 3: 1, 4: 1, 20: 2}
OK	107-75-5	CC(CCCC(C)(C)O)CC=O	{1: 3, 2: 4, 3: 1, 4: 1, 20: 1, 26: 1}
OK	107-80-2	CC(CCBr)Br	{1: 1, 2: 2, 3: 1, 18: 2}
OK	107-81-3	CCCC(C)Br	{1: 2, 2: 2, 3: 1, 18: 1}
OK	107-82-4	CC(C)CCBr	{1: 2, 2: 2, 3: 1, 18: 1}
OK	107-83-5	CCCC(C)C	{1: 3, 2: 2, 3: 1}
OK	107-84-6	CC(C)CCCl	{1: 2, 2: 2, 3: 1, 17: 1}
OK	107-85-7	CC(C)CCN	{1: 2, 2: 2, 3: 1, 30: 1}
OK	107-86-8	CC(=CC=O)C	{1: 2, 26: 1, 6: 1, 7: 1}
OK	107-87-9	CCCC(=O)C	{24: 1, 1: 2, 2: 2}
OK	107-88-0	CC(CCO)O	{1: 1, 2: 2, 3: 1, 20: 2}
OK	107-89-1	CC(CC=O)O	{1: 1, 2: 1, 3: 1, 20: 1, 26: 1}
OK	107-91-5	C(C#N)C(=O)N	{24: 1, 2: 1, 37: 1, 30: 1}
OK	107-92-6	CCCC(=O)O	{1: 1, 2: 2, 27: 1}
OK	107-93-7	C/C=C/C(=O)O	{1: 1, 27: 1, 6: 2}
OK	107-94-8	C(CCl)C(=O)O	{17: 1, 2: 2, 27: 1}
OK	107-95-9	C(CN)C(=O)O	{2: 2, 27: 1, 30: 1}
OK	107-96-0	C(CS)C(=O)O	{2: 2, 27: 1, 39: 1}
OK	107-97-1	CNCC(=O)O	{1: 1, 2: 1, 27: 1, 31: 1}
OK	107-98-2	CC(COC)O	{1: 2, 2: 1, 3: 1, 20: 1, 22: 1}
OK	107-99-3	CN(C)CCCl	{1: 2, 2: 2, 33: 1, 17: 1}
OK	1070-01-5	CCCCCCCCCCN(CCCCCCCCCC)CCCCCCCCCC	{1: 3, 2: 27, 33: 1}
OK	1070-11-7	CC[C@@H](CO)NCCN[C@@H](CC)CO.Cl.Cl	{1: 2, 2: 6, 3: 2, 17: 2, 20: 2, 31: 2}
OK	1070-13-9	CCCC(=C)C=O	{1: 1, 2: 2, 26: 1, 5: 1, 7: 1}
OK	1070-14-0	CC=CC(C=C)O	{1: 1, 3: 1, 20: 1, 5: 1, 6: 3}
OK	1070-32-2	CCCCC(C)CCO	{1: 2, 2: 5, 3: 1, 20: 1}
OK	1070-34-4	CCOC(=O)CCC(=O)O	{1: 1, 2: 3, 27: 1, 28: 1}
OK	1070-35-5	CC(=C)OC(=O)CCC(=O)C	{1: 2, 2: 2, 5: 1, 7: 1, 24: 1, 28: 1}
OK	1070-40-2	CCCC(C#CC(CCC)O)O	{1: 2, 2: 4, 3: 2, 20: 2, 10: 2}
OK	1070-66-2	CCCCC(=C)C=O	{1: 1, 2: 3, 26: 1, 5: 1, 7: 1}
OK	1070-70-8	C=CC(=O)OCCCCOC(=O)C=C	{2: 4, 28: 2, 5: 2, 6: 2}
OK	1070-71-9	C#CC#N	{9: 1, 10: 1, 37: 1}
OK	1070-78-6	C(CCl)C(Cl)(Cl)Cl	{17: 4, 2: 2, 4: 1}
OK	1070-83-3	CC(C)(C)CC(=O)O	{1: 3, 2: 1, 27: 1, 4: 1}
OK	1070-87-7	CC(C)(C)CC(C)(C)C	{1: 6, 2: 1, 4: 2}
OK	1071-26-7	CCCCCC(C)(C)C	{1: 4, 2: 4, 4: 1}
OK	1071-31-4	CC(C)(C)CCCCC(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	1071-73-4	CC(=O)CCCO	{24: 1, 1: 1, 2: 3, 20: 1}
OK	1071-81-4	CC(C)(C)CCC(C)(C)C	{1: 6, 2: 2, 4: 2}
OK	1071-93-8	C(CCC(=O)NN)CC(=O)NN	{24: 2, 2: 4, 30: 2, 31: 2}
OK	1071-98-3	C(#CC#N)C#N	{10: 2, 37: 2}
OK	107133-43-7	C1CC2CC1C3C2C4CC3CC4O	{20: 1, 11: 5, 12: 7}
OK	107175-83-7	C1CC(=O)OC1.C(CNCCN)N.C(CNCCNCCN)N	{2: 10, 11: 3, 28: 1, 30: 4, 31: 3}
OK	107183-90-4	C/C=C/CSC(C)(C)C	{40: 1, 1: 4, 2: 1, 4: 1, 6: 2}
OK	1072-05-5	CC(C)CCCC(C)C	{1: 4, 2: 3, 3: 2}
OK	1072-13-5	C(CSSCCN=C(N)N)N=C(N)N	{40: 2, 2: 4, 34: 2, 30: 4, 7: 2}
OK	1072-16-8	CC(C)CCCCC(C)C	{1: 4, 2: 4, 3: 2}
OK	1072-17-9	C(#CC(=O)O)C#CC(=O)O	{10: 4, 27: 2}
OK	1072-20-4	CC#CC#CC#CC	{1: 2, 10: 6}
OK	1072-21-5	C(CCC=O)CC=O	{2: 4, 26: 2}
OK	1072-33-9	CCCCCCCCCCCCCOC(=O)C	{1: 2, 2: 12, 28: 1}
OK	1072-40-8	COCCOCCOCCOCCOCCOCCOC	{1: 2, 2: 12, 22: 7}
OK	1072-43-1	CC1CS1	{1: 1, 11: 1, 12: 1, 41: 1}
OK	1072-44-2	CN1CC1	{1: 1, 11: 2, 33: 1}
OK	1072-47-5	CC1COCO1	{1: 1, 11: 2, 12: 1, 23: 2}
OK	1072-52-2	C1CN1CCO	{33: 1, 2: 2, 11: 2, 20: 1}
OK	1072-59-9	COC1=CCCC1	{1: 1, 11: 3, 22: 1, 14: 1, 15: 1}
OK	1072-63-5	C=CN1C=CN=C1	{33: 1, 14: 3, 35: 1, 5: 1, 6: 1}
OK	1072-66-8	C1CN1CCC#N	{33: 1, 2: 2, 11: 2, 37: 1}
OK	1072-70-4	CC1CNC(=O)O1	{32: 1, 1: 1, 11: 1, 12: 1, 28: 1}
OK	1072-72-6	C1CSCCC1=O	{25: 1, 11: 4, 41: 1}
OK	1073-07-0	C1CC=CCC=CC1	{11: 4, 14: 4}
OK	1073-13-8	CC1(CCC(=O)C=C1)C	{1: 2, 11: 2, 13: 1, 14: 2, 25: 1}
OK	1073-79-6	CC1CC(=O)CC(O1)C	{1: 2, 11: 2, 12: 2, 25: 1, 23: 1}
OK	1073-93-4	CC(C)N1C(=O)C=CC1=O	{1: 2, 3: 1, 33: 1, 14: 2, 25: 2}
OK	107317-86-2	C1CC23C1(CC2)C4C=CC3C=C4	{11: 4, 12: 2, 13: 2, 14: 4}
OK	1074-51-7	C1CCCC(=NO)CCC1	{34: 1, 11: 7, 20: 1, 15: 1}
OK	1074-58-4	C1CCC(CC1)NCC#N	{2: 1, 11: 5, 12: 1, 37: 1, 31: 1}
OK	1074-62-0	C1CC(CCC1CN)CO	{20: 1, 2: 2, 11: 4, 12: 2, 30: 1}
OK	107454-73-9	C1C2CC3CC1CC3(C2)N=NC45CC6CC(C4)CC5C6	{34: 2, 11: 10, 12: 6, 13: 2}
OK	107454-74-0	C1CC2(CCC1CC2)N=NC34CCC(C3)CC4	{34: 2, 11: 11, 12: 2, 13: 2}
OK	107454-75-1	C1CC2(CCC1C2)N=NC34CC5CC(C3)CC(C5)C4	{34: 2, 11: 11, 12: 4, 13: 2}
OK	1075-89-4	C1CCC2(C1)CC(=O)NC(=O)C2	{32: 1, 25: 2, 11: 6, 13: 1}
OK	107538-05-6	C[C@@]1([C@@H]2CC[C@@H](C2)C1(C)C)NC	{1: 4, 11: 3, 12: 2, 13: 2, 31: 1}
OK	107596-48-5		{}
OK	1076-13-7	C1C2C=CC1C3C2C4CC3C=C4	{11: 2, 12: 6, 14: 4}
OK	1077-28-7	C1CSSC1CCCCC(=O)O	{27: 1, 41: 2, 2: 4, 11: 2, 12: 1}
OK	107868-30-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC(=C)C4=CC(=O)C=C[C@]34C	{1: 2, 5: 1, 11: 5, 12: 3, 13: 2, 14: 3, 15: 2, 25: 2}
OK	1079-01-2	CC(=O)OCC1=CCC2CC1C2(C)C	{1: 3, 2: 1, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 28: 1}
OK	108-00-9	CN(C)CCN	{1: 2, 2: 2, 30: 1, 33: 1}
OK	108-01-0	CN(C)CCO	{1: 2, 2: 2, 20: 1, 33: 1}
OK	108-02-1	CN(C)CCS	{1: 2, 2: 2, 39: 1, 33: 1}
OK	108-03-2	CCC[N+](=O)[O-]	{1: 1, 2: 2, 38: 1}
OK	108-05-4	CC(=O)OC=C	{1: 1, 28: 1, 5: 1, 6: 1}
OK	108-08-7	CC(C)CC(C)C	{1: 4, 2: 1, 3: 2}
OK	108-09-8	CC(C)CC(C)N	{1: 3, 2: 1, 3: 2, 30: 1}
OK	108-10-1	CC(C)CC(=O)C	{24: 1, 1: 3, 2: 1, 3: 1}
OK	108-11-2	CC(C)CC(C)O	{1: 3, 2: 1, 3: 2, 20: 1}
OK	108-12-3	CC(C)CC(=O)Cl	{24: 1, 1: 2, 2: 1, 3: 1, 17: 1}
OK	108-13-4	C(C(=O)N)C(=O)N	{24: 2, 2: 1, 30: 2}
OK	108-14-5	CC(CN(C)C)Cl	{1: 3, 2: 1, 3: 1, 33: 1, 17: 1}
OK	108-15-6	CC(CN(C)C)N	{1: 3, 2: 1, 3: 1, 30: 1, 33: 1}
OK	108-16-7	CC(CN(C)C)O	{1: 3, 2: 1, 3: 1, 20: 1, 33: 1}
OK	108-18-9	CC(C)NC(C)C	{1: 4, 3: 2, 31: 1}
OK	108-19-0	C(=O)(N)NC(=O)N	{24: 2, 30: 2, 31: 1}
OK	108-20-3	CC(C)OC(C)C	{1: 4, 3: 2, 22: 1}
OK	108-21-4	CC(C)OC(=O)C	{1: 3, 3: 1, 28: 1}
OK	108-22-5	CC(=C)OC(=O)C	{1: 2, 28: 1, 5: 1, 7: 1}
OK	108-23-6	CC(C)OC(=O)Cl	{1: 2, 3: 1, 28: 1, 17: 1}
OK	108-26-9	CC1=NNC(=O)C1	{32: 1, 1: 1, 35: 1, 11: 1, 15: 1, 25: 1}
OK	108-27-0	CC1CCC(=O)N1	{32: 1, 1: 1, 11: 2, 12: 1, 25: 1}
OK	108-28-1	C=C1C=CC(=O)O1	{28: 1, 5: 1, 14: 2, 15: 1}
OK	108-29-2	CC1CCC(=O)O1	{1: 1, 11: 2, 12: 1, 28: 1}
OK	108-49-6	CC1CNCC(N1)C	{32: 2, 1: 2, 11: 2, 12: 2}
OK	108-56-5	CCOC(=O)CC(=O)C(=O)OCC	{24: 1, 1: 2, 2: 3, 28: 2}
OK	108-59-8	COC(=O)CC(=O)OC	{1: 2, 2: 1, 28: 2}
OK	108-60-1	CC(CCl)OC(C)CCl	{1: 2, 2: 2, 3: 2, 22: 1, 17: 2}
OK	108-62-3	CC1OC(OC(OC(O1)C)C)C	{1: 4, 12: 4, 23: 4}
OK	108-63-4	CCCCCCC(C)OC(=O)CCCCC(=O)OC(C)CCCCCC	{1: 4, 2: 14, 3: 2, 28: 2}
OK	108-64-5	CCOC(=O)CC(C)C	{1: 3, 2: 2, 3: 1, 28: 1}
OK	108-65-6	CC(COC)OC(=O)C	{1: 3, 2: 1, 3: 1, 28: 1, 22: 1}
OK	108-74-7	CN1CN(CN(C1)C)C	{1: 3, 11: 3, 33: 3}
OK	108-80-5	C1(=O)NC(=O)NC(=O)N1	{32: 3, 25: 3}
OK	108-82-7	CC(C)CC(CC(C)C)O	{1: 4, 2: 2, 3: 3, 20: 1}
OK	108-83-8	CC(C)CC(=O)CC(C)C	{24: 1, 1: 4, 2: 2, 3: 2}
OK	108-84-9	CC(C)CC(C)OC(=O)C	{1: 4, 2: 1, 3: 2, 28: 1}
OK	108-85-0	C1CCC(CC1)Br	{18: 1, 11: 5, 12: 1}
OK	108-87-2	CC1CCCCC1	{1: 1, 11: 5, 12: 1}
OK	108-91-8	C1CCC(CC1)N	{11: 5, 12: 1, 30: 1}
OK	108-93-0	C1CCC(CC1)O	{20: 1, 11: 5, 12: 1}
OK	108-94-1	C1CCC(=O)CC1	{25: 1, 11: 5}
OK	108-97-4	C1=COC=CC1=O	{25: 1, 14: 4, 23: 1}
OK	108149-60-6	CC1(N([C@@H](CO1)C(=O)OC)C(=O)OC(C)(C)C)C	{1: 6, 4: 1, 33: 1, 11: 1, 12: 1, 13: 1, 23: 1, 28: 2}
OK	108171-26-2	CCC(C(C(CC(C(C(C)Cl)Cl)Cl)Cl)Cl)Cl	{1: 2, 2: 2, 3: 6, 17: 6}
OK	108171-27-3	CC(CCCC(CCCC(CCCC(CCCC(CCCC(CCCl)Cl)Cl)Cl)Cl)Cl)Cl	{1: 1, 2: 17, 3: 6, 17: 7}
OK	108215-84-5	CCCCC(CC)CN(C)CCC(CC)CCC	{1: 5, 2: 10, 3: 2, 33: 1}
OK	108249-27-0	C(N(CO)[N+](=O)[O-])O	{33: 1, 2: 2, 20: 2, 38: 1}
OK	108278-70-2	COCCN(C(=O)N)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 22: 1, 24: 1, 29: 1, 30: 1}
OK	108278-73-5	COC(=O)CN(C(=O)N)N=O	{1: 1, 2: 1, 33: 1, 34: 1, 24: 1, 28: 1, 29: 1, 30: 1}
OK	108278-74-6	COC(=O)CCN(C(=O)N)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 24: 1, 28: 1, 29: 1, 30: 1}
OK	108278-75-7	COC(=O)CCCN(C(=O)N)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 24: 1, 28: 1, 29: 1, 30: 1}
OK	108329-81-3	CC(C)(C)OC(=O)NC1(CCSCC1)C(=O)O	{1: 3, 4: 1, 41: 1, 11: 4, 13: 1, 27: 1, 28: 1, 31: 1}
OK	108419-32-5	CCC(C)C(C)CCOC(=O)C	{1: 4, 2: 3, 3: 2, 28: 1}
OK	108419-33-6	CCCC(CCOC(=O)C)C(C)C	{1: 4, 2: 4, 3: 2, 28: 1}
OK	108419-35-8	CCC(C)CC(CC)C(CC)CCOC(=O)C	{1: 5, 2: 6, 3: 3, 28: 1}
OK	108451-26-9	CCC1=CC(=O)C=C(C1=N)CC	{1: 2, 2: 2, 36: 1, 14: 2, 15: 3, 25: 1}
OK	108696-11-3	CC(C)N1CCCCCCC1	{11: 7, 1: 2, 3: 1, 33: 1}
OK	108797-87-1	CC1=CCC(CC1)C(C)CCCC(C)C	{1: 4, 2: 3, 3: 2, 11: 3, 12: 1, 14: 1, 15: 1}
OK	108836-86-8	CCCCCCCCCC(C)(CCCCC)O	{1: 3, 2: 12, 4: 1, 20: 1}
OK	108882-35-5	CCCCCCCCCCCC(Br)Br	{1: 1, 2: 10, 3: 1, 18: 2}
OK	108941-57-7	CC(=O)OC=C.C=CNC=O	{1: 1, 5: 2, 6: 2, 26: 1, 28: 1, 31: 1}
OK	109-01-3	CN1CCNCC1	{32: 1, 1: 1, 11: 4, 33: 1}
OK	109-02-4	CN1CCOCC1	{1: 1, 11: 4, 33: 1, 23: 1}
OK	109-05-7	CC1CCCCN1	{32: 1, 1: 1, 11: 4, 12: 1}
OK	109-07-9	CC1CNCCN1	{32: 2, 1: 1, 11: 3, 12: 1}
OK	109-13-7	CC(C)C(=O)OOC(C)(C)C	{1: 5, 3: 1, 4: 1, 22: 1, 28: 1}
OK	109-15-9	CCCCCCCCOC(=O)C(C)C	{1: 3, 2: 7, 3: 1, 28: 1}
OK	109-16-0	CC(=C)C(=O)OCCOCCOCCOC(=O)C(=C)C	{1: 2, 2: 6, 5: 2, 7: 2, 22: 2, 28: 2}
OK	109-17-1	CC(=C)C(=O)OCCOCCOCCOCCOC(=O)C(=C)C	{1: 2, 2: 8, 5: 2, 7: 2, 22: 3, 28: 2}
OK	109-19-3	CCCCOC(=O)CC(C)C	{1: 3, 2: 4, 3: 1, 28: 1}
OK	109-20-6	CC(C)CC(=O)OCC=C(C)CCC=C(C)C	{1: 5, 2: 4, 3: 1, 6: 2, 7: 2, 28: 1}
OK	109-21-7	CCCCOC(=O)CCC	{1: 2, 2: 5, 28: 1}
OK	109-25-1	CCCCCCC(=O)OCCC(C)C	{1: 3, 2: 7, 3: 1, 28: 1}
OK	109-29-5	C1CCCCCCCC(=O)OCCCCCCC1	{11: 15, 28: 1}
OK	109-30-8	CCCCCCCCCCCCCCCCCC(=O)OCCOCCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 36, 28: 2, 22: 1}
OK	109-31-9	CCCCCCOC(=O)CCCCCCCC(=O)OCCCCCC	{1: 2, 2: 17, 28: 2}
OK	109-37-5	CCCCCCCCCCCC(=O)OCCOCCCC	{1: 2, 2: 15, 28: 1, 22: 1}
OK	109-38-6	CCCCCCCCCCCCCCCCCC(=O)OCCOCCCC	{1: 2, 2: 21, 28: 1, 22: 1}
OK	109-42-2	CCCCOC(=O)CCCCCCCCC=C	{1: 1, 2: 11, 28: 1, 5: 1, 6: 1}
OK	109-43-3	CCCCOC(=O)CCCCCCCCC(=O)OCCCC	{1: 2, 2: 14, 28: 2}
OK	109-44-4	CCOCCOC(=O)CCCCC(=O)OCCOCC	{1: 2, 2: 10, 28: 2, 22: 2}
OK	109-49-9	CC(=O)CCC=C	{24: 1, 1: 1, 2: 2, 5: 1, 6: 1}
OK	109-50-2	CCC#CC(C)O	{1: 2, 2: 1, 3: 1, 20: 1, 10: 2}
OK	109-52-4	CCCCC(=O)O	{1: 1, 2: 3, 27: 1}
OK	109-53-5	CC(C)COC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 22: 1}
OK	109-55-7	CN(C)CCCN	{1: 2, 2: 3, 30: 1, 33: 1}
OK	109-56-8	CC(C)NCCO	{1: 2, 2: 2, 3: 1, 20: 1, 31: 1}
OK	109-58-0	C(CNC(=O)O)N	{2: 2, 27: 1, 30: 1, 31: 1}
OK	109-59-1	CC(C)OCCO	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	109-60-4	CCCOC(=O)C	{1: 2, 2: 2, 28: 1}
OK	109-61-5	CCCOC(=O)Cl	{1: 1, 2: 2, 28: 1, 17: 1}
OK	109-64-8	C(CBr)CBr	{2: 3, 18: 2}
OK	109-65-9	CCCCBr	{1: 1, 2: 3, 18: 1}
OK	109-66-0	CCCCC	{1: 2, 2: 3}
OK	109-67-1	CCCC=C	{1: 1, 2: 2, 5: 1, 6: 1}
OK	109-69-3	CCCCCl	{1: 1, 2: 3, 17: 1}
OK	109-70-6	C(CCl)CBr	{17: 1, 2: 3, 18: 1}
OK	109-71-7	C(C#CI)Cl	{17: 1, 2: 1, 19: 1, 10: 2}
OK	109-73-9	CCCCN	{1: 1, 2: 3, 30: 1}
OK	109-74-0	CCCC#N	{1: 1, 2: 2, 37: 1}
OK	109-75-1	C=CCC#N	{2: 1, 5: 1, 6: 1, 37: 1}
OK	109-76-2	C(CN)CN	{2: 3, 30: 2}
OK	109-77-3	C(C#N)C#N	{2: 1, 37: 2}
OK	109-78-4	C(CO)C#N	{2: 2, 20: 1, 37: 1}
OK	109-79-5	CCCCS	{1: 1, 2: 3, 39: 1}
OK	109-80-8	C(CS)CS	{2: 3, 39: 2}
OK	109-81-9	CNCCN	{1: 1, 2: 2, 30: 1, 31: 1}
OK	109-82-0	C=NCC#N	{2: 1, 34: 1, 5: 1, 37: 1}
OK	109-83-1	CNCCO	{1: 1, 2: 2, 20: 1, 31: 1}
OK	109-84-2	C(CO)NN	{2: 2, 20: 1, 30: 1, 31: 1}
OK	109-85-3	COCCN	{1: 1, 2: 2, 30: 1, 22: 1}
OK	109-86-4	COCCO	{1: 1, 2: 2, 20: 1, 22: 1}
OK	109-87-5	COCOC	{1: 2, 2: 1, 22: 2}
OK	109-89-7	CCNCC	{1: 2, 2: 2, 31: 1}
OK	109-90-0	CCN=C=O	{8: 1, 1: 1, 2: 1, 34: 1, 29: 1}
OK	109-92-2	CCOC=C	{1: 1, 2: 1, 22: 1, 5: 1, 6: 1}
OK	109-93-3	C=COC=C	{22: 1, 5: 2, 6: 2}
OK	109-95-5	CCON=O	{1: 1, 2: 1, 34: 1, 29: 1, 22: 1}
OK	109-96-6	C1C=CCN1	{32: 1, 11: 2, 14: 2}
OK	109-97-7	C1=CNC=C1	{32: 1, 14: 4}
OK	109-98-8	C1CNN=C1	{32: 1, 35: 1, 11: 2, 14: 1}
OK	109-99-9	C1CCOC1	{11: 4, 23: 1}
OK	109037-70-9	CCC(CO)(CO)CO.CC(CSCCO)O.C(CSCCO)O	{1: 2, 2: 11, 3: 1, 4: 1, 40: 2, 20: 7}
OK	109119-91-7	CC1CCC2C1C3C(C3(C)C)CCC2=C	{1: 3, 5: 1, 11: 4, 12: 5, 13: 1, 15: 1}
OK	109153-24-4	CC(=C1N(CCN1C)C)C	{15: 1, 1: 4, 11: 2, 33: 2, 7: 1}
OK	109216-46-8	C=C1C2=CC=CC=C(C2)C(=C)C3=CC=CC=C1C3	{11: 2, 5: 2, 14: 8, 15: 6}
OK	109216-47-9	CC(=C1C2=CC=CC=C(C2)C(=C(C)C)C3=CC=CC=C1C3)C	{15: 6, 1: 4, 11: 2, 14: 8, 7: 2}
OK	109280-15-1	CC1(C2CCC1(C(C2)(OC)OC)C)C	{1: 5, 11: 3, 12: 1, 13: 3, 22: 2}
OK	109299-92-5	CC=CC(=O)N1CCOC1=O	{1: 1, 6: 2, 33: 1, 11: 2, 24: 1, 28: 1}
OK	1093-16-9	CC1(CCCC2(C1CCC3(C2CCC(C)(C=C)O)CO3)C)C	{1: 4, 2: 2, 4: 1, 5: 1, 6: 1, 11: 6, 12: 2, 13: 3, 20: 1, 23: 1}
OK	1093-58-9	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C(C(=O)CC[C@]34C)Cl	{1: 2, 11: 8, 12: 4, 13: 2, 15: 2, 17: 1, 20: 1, 25: 1}
OK	109364-69-4	CC1=C(C2CCC1C(=C2C#N)C#N)C	{1: 2, 11: 2, 12: 2, 37: 2, 15: 4}
OK	109364-70-7	CC1=C(C2CCCC1C(=C2C#N)C#N)C	{1: 2, 11: 3, 12: 2, 37: 2, 15: 4}
OK	109423-00-9	CC1(CC(CC(N1)(C)C)N2CN3C4C5N(C3=O)CN(CN5C(=O)N4C2)C6CC(NC(C6)(C)C)(C)C)C	{32: 2, 1: 8, 33: 6, 11: 8, 12: 4, 13: 4, 25: 2}
OK	109485-61-2	CC(C)CC(C)(C)CC(C)(C)CC(C)(C)C	{1: 9, 2: 3, 3: 1, 4: 3}
OK	109747-77-5	C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O.C(CCCC(=O)O)CCCC(=O)O.C(CCO)CO	{2: 12, 34: 2, 8: 2, 11: 2, 13: 2, 14: 8, 20: 2, 27: 2, 29: 2}
OK	1098-45-9	C[C@@H]([C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C)O)O	{1: 3, 3: 1, 11: 9, 12: 5, 13: 3, 20: 3}
OK	109856-85-1	CCCCCCCCCC[C@@H]1CO1	{1: 1, 2: 9, 11: 1, 12: 1, 23: 1}
OK	110-00-9	C1=COC=C1	{14: 4, 23: 1}
OK	110-01-0	C1CCSC1	{41: 1, 11: 4}
OK	110-02-1	C1=CSC=C1	{41: 1, 14: 4}
OK	110-03-2	CC(C)(CCC(C)(C)O)O	{1: 4, 2: 2, 4: 2, 20: 2}
OK	110-05-4	CC(C)(C)OOC(C)(C)C	{1: 6, 4: 2, 22: 2}
OK	110-06-5	CC(C)(C)SSC(C)(C)C	{40: 2, 1: 6, 4: 2}
OK	110-12-3	CC(C)CCC(=O)C	{24: 1, 1: 3, 2: 2, 3: 1}
OK	110-13-4	CC(=O)CCC(=O)C	{24: 2, 1: 2, 2: 2}
OK	110-14-5	C(CC(=O)N)C(=O)N	{24: 2, 2: 2, 30: 2}
OK	110-15-6	C(CC(=O)O)C(=O)O	{2: 2, 27: 2}
OK	110-16-7	C(=C\C(=O)O)\C(=O)O	{27: 2, 6: 2}
OK	110-17-8	C(=C/C(=O)O)\C(=O)O	{27: 2, 6: 2}
OK	110-18-9	CN(C)CCN(C)C	{1: 4, 2: 2, 33: 2}
OK	110-19-0	CC(C)COC(=O)C	{1: 3, 2: 1, 3: 1, 28: 1}
OK	110-20-3	CC(=NNC(=O)N)C	{1: 2, 34: 1, 7: 1, 24: 1, 30: 1, 31: 1}
OK	110-21-4	C(=O)(N)NNC(=O)N	{24: 2, 30: 2, 31: 2}
OK	110-22-5	CC(=O)OOC(=O)C	{1: 2, 28: 2}
OK	110-26-9	C=CC(=O)NCNC(=O)C=C	{24: 2, 2: 1, 5: 2, 6: 2, 31: 2}
OK	110-27-0	CCCCCCCCCCCCCC(=O)OC(C)C	{1: 3, 2: 12, 3: 1, 28: 1}
OK	110-28-1	CC(C)CCCCCCCOC(=O)CCCCC(=O)OCCCCCC(C)C	{1: 4, 2: 16, 3: 2, 28: 2}
OK	110-29-2	CCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC	{1: 2, 2: 20, 28: 2}
OK	110-30-5	CCCCCCCCCCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 34, 31: 2}
OK	110-32-7	CCCCCCOCCOC(=O)CCCCC(=O)OCCOCCCCCC	{1: 2, 2: 18, 28: 2, 22: 2}
OK	110-33-8	CCCCCCOC(=O)CCCCC(=O)OCCCCCC	{1: 2, 2: 14, 28: 2}
OK	110-34-9	CCCCCCCCCCCCCCCC(=O)OCC(C)C	{1: 3, 2: 15, 3: 1, 28: 1}
OK	110-36-1	CCCCCCCCCCCCCC(=O)OCCCC	{1: 2, 2: 15, 28: 1}
OK	110-38-3	CCCCCCCCCC(=O)OCC	{1: 2, 2: 9, 28: 1}
OK	110-39-4	CCCCCCCCOC(=O)CCC	{1: 2, 2: 9, 28: 1}
OK	110-40-7	CCOC(=O)CCCCCCCCC(=O)OCC	{1: 2, 2: 10, 28: 2}
OK	110-41-8	CCCCCCCCCC(C)C=O	{1: 2, 2: 8, 3: 1, 26: 1}
OK	110-42-9	CCCCCCCCCC(=O)OC	{1: 2, 2: 8, 28: 1}
OK	110-43-0	CCCCCC(=O)C	{24: 1, 1: 2, 2: 4}
OK	110-44-1	C/C=C/C=C/C(=O)O	{1: 1, 27: 1, 6: 4}
OK	110-46-3	CC(C)CCON=O	{1: 2, 34: 1, 3: 1, 2: 2, 22: 1, 29: 1}
OK	110-47-4	CC(C)OCCC#N	{1: 2, 2: 2, 3: 1, 37: 1, 22: 1}
OK	110-48-5	CC(C)OCCCO	{1: 2, 2: 3, 3: 1, 20: 1, 22: 1}
OK	110-49-6	CC(=O)OCCOC	{1: 2, 2: 2, 28: 1, 22: 1}
OK	110-52-1	C(CCBr)CBr	{2: 4, 18: 2}
OK	110-53-2	CCCCCBr	{1: 1, 2: 4, 18: 1}
OK	110-54-3	CCCCCC	{1: 2, 2: 4}
OK	110-56-5	C(CCCl)CCl	{17: 2, 2: 4}
OK	110-57-6	C(/C=C/CCl)Cl	{17: 2, 2: 2, 6: 2}
OK	110-58-7	CCCCCN	{1: 1, 2: 4, 30: 1}
OK	110-59-8	CCCCC#N	{1: 1, 2: 3, 37: 1}
OK	110-60-1	C(CCN)CN	{2: 4, 30: 2}
OK	110-61-2	C(CC#N)C#N	{2: 2, 37: 2}
OK	110-62-3	CCCCC=O	{1: 1, 2: 3, 26: 1}
OK	110-63-4	C(CCO)CO	{2: 4, 20: 2}
OK	110-64-5	C(C=CCO)O	{2: 2, 20: 2, 6: 2}
OK	110-65-6	C(C#CCO)O	{2: 2, 20: 2, 10: 2}
OK	110-66-7	CCCCCS	{1: 1, 2: 4, 39: 1}
OK	110-67-8	COCCC#N	{1: 1, 2: 2, 37: 1, 22: 1}
OK	110-68-9	CCCCNC	{1: 2, 2: 3, 31: 1}
OK	110-69-0	CCCC=NO	{1: 1, 2: 2, 20: 1, 34: 1, 6: 1}
OK	110-70-3	CNCCNC	{1: 2, 2: 2, 31: 2}
OK	110-71-4	COCCOC	{1: 2, 2: 2, 22: 2}
OK	110-72-5	CCNCCN	{1: 1, 2: 3, 30: 1, 31: 1}
OK	110-73-6	CCNCCO	{1: 1, 2: 3, 20: 1, 31: 1}
OK	110-75-8	C=COCCCl	{17: 1, 2: 2, 22: 1, 5: 1, 6: 1}
OK	110-76-9	CCOCCN	{1: 1, 2: 3, 30: 1, 22: 1}
OK	110-77-0	CCSCCO	{40: 1, 1: 1, 2: 3, 20: 1}
OK	110-78-1	CCCN=C=O	{8: 1, 1: 1, 2: 2, 34: 1, 29: 1}
OK	110-80-5	CCOCCO	{1: 1, 2: 3, 20: 1, 22: 1}
OK	110-81-6	CCSSCC	{40: 2, 1: 2, 2: 2}
OK	110-82-7	C1CCCCC1	{11: 6}
OK	110-83-8	C1CCC=CC1	{11: 4, 14: 2}
OK	110-85-0	C1CNCCN1	{32: 2, 11: 4}
OK	110-86-1	C1=CC=NC=C1	{35: 1, 14: 5}
OK	110-87-2	C1CC=COC1	{11: 3, 14: 2, 23: 1}
OK	110-88-3	C1OCOCO1	{11: 3, 23: 3}
OK	110-89-4	C1CCNCC1	{32: 1, 11: 5}
OK	110-90-7	C1NCNCN1	{32: 3, 11: 3}
OK	110-91-8	C1COCCN1	{32: 1, 11: 4, 23: 1}
OK	110-93-0	CC(=CCCC(=O)C)C	{24: 1, 1: 3, 2: 2, 6: 1, 7: 1}
OK	110-94-1	C(CC(=O)O)CC(=O)O	{2: 3, 27: 2}
OK	110-95-2	CN(C)CCCN(C)C	{1: 4, 2: 3, 33: 2}
OK	110-96-3	CC(C)CNCC(C)C	{1: 4, 2: 2, 3: 2, 31: 1}
OK	110-97-4	CC(CNCC(C)O)O	{1: 2, 2: 2, 3: 2, 20: 2, 31: 1}
OK	110-98-5	CC(COCC(C)O)O	{1: 2, 2: 2, 3: 2, 20: 2, 22: 1}
OK	110-99-6	C(C(=O)O)OCC(=O)O	{2: 2, 27: 2, 22: 1}
OK	11002-80-5	CC1C(C2C(C(CC(=C2C(=O)O1)O)O)O)NC(=O)C(C)N	{1: 2, 3: 1, 11: 1, 12: 5, 15: 2, 20: 3, 24: 1, 28: 1, 30: 1, 31: 1}
OK	11003-24-0	CC1CCC(C(C(CC(C(/C=C/C=C(/C(=O)OC(C(/C=C/C=C(/C(CC(CC(CC(CC2CC(C(C(O2)(CC1O)O)O)O)OC(=O)CC(=O)O)O)O)O)\C)C)C(C)CCC/C=C/CCCN=C(N)N)\C)C)O)O)C)O	{1: 7, 2: 7, 3: 1, 6: 2, 7: 1, 11: 9, 12: 16, 13: 1, 14: 6, 15: 2, 34: 1, 20: 10, 23: 1, 27: 1, 28: 2, 30: 2}
OK	11004-30-1	C[C@@H]1CC[C@H]2[C@H]([C@H]3[C@@H](N2C1)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O)C)C)C	{1: 4, 33: 1, 11: 11, 12: 10, 13: 2, 20: 1}
OK	110044-82-1	CCCCC(C=O)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C	{1: 6, 2: 5, 3: 5, 24: 3, 26: 1, 31: 3}
OK	11005-70-2	C[C@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CCC4C3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)O)OC)O	{1: 4, 2: 2, 11: 10, 12: 20, 13: 3, 14: 1, 15: 1, 20: 9, 22: 4, 23: 3, 28: 1}
OK	11006-22-7	CCC(C)C1C(/C=C/C(CC(CC(CC(CC(CC(CC(C(C(C/C=C/C=C/C=C/C=C/C=C/C(=O)O1)O)C)O)O)O)O)O)O)O)C	{1: 4, 2: 1, 3: 1, 11: 7, 12: 11, 14: 12, 20: 8, 28: 1}
OK	11006-31-8	CC1CCC(CC(C(C(C(C(CC(CC(C(C(OC(=O)CCCCCC(C(C(CC/C=C/C(C(/C(=C/C(C(/C(=C/C(C(C(C(CC(/C=C\C(C1O)C)O)O)C)O)O[C@@H]2[C@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)/C)O)C)/C)O)C)O)C)O)C(C)CCCCCCN)C)O)O)O)C)O)C)O)O	{1: 12, 2: 7, 3: 1, 11: 13, 12: 30, 14: 6, 15: 2, 20: 18, 22: 1, 23: 1, 28: 1, 30: 1}
OK	110104-60-4	COC(=CC(=O)OC)CCl	{1: 2, 2: 1, 6: 1, 7: 1, 17: 1, 22: 1, 28: 1}
OK	11014-59-8	C[C@@H]1[C@H]([C@H](CC(O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CCC5(C4CCC3C2)O)C6=CC(=O)OC6)C)C)O)OC7C[C@@H]([C@@H]([C@H](O7)C)OC8C[C@@H]([C@@H]([C@H](O8)C)OC9[C@H]([C@@H]([C@H]([C@@H](O9)CO)O)O)O)OC(=O)C)O	{1: 6, 2: 1, 11: 13, 12: 22, 13: 3, 14: 1, 15: 1, 20: 7, 22: 4, 23: 4, 28: 2}
OK	110225-00-8	CCCCCCCCCCC(CCCCCC)CO	{1: 2, 2: 15, 3: 1, 20: 1}
OK	11024-24-1	C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)[C@H]([C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(C[C@H]([C@@H](C6)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H](C([C@H](O8)CO)O)O[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O)O)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)O)C)C)O)C)OC1	{1: 4, 2: 4, 11: 10, 12: 35, 13: 3, 20: 17, 22: 5, 23: 7}
OK	110270-42-3	CCCCCC[C@H](CF)O	{16: 1, 1: 1, 2: 6, 3: 1, 20: 1}
OK	11028-39-0	CC1=C(CCCC1)C(C)C	{11: 4, 1: 3, 3: 1, 15: 2}
OK	11029-06-4	CC(C)C1=C[C@@H]([C@@](CC1)(C)C=C)C(=C)C	{1: 4, 3: 1, 5: 2, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1}
OK	110319-65-8	C(CN)CNCC=CCN	{2: 5, 30: 2, 6: 2, 31: 1}
OK	110319-68-1	C(CN)CNCC=CCNCCCN	{2: 8, 30: 2, 6: 2, 31: 2}
OK	11032-12-5	CC[C@@H]1C(/C=C(/C=C/C(=O)[C@@H](C[C@@H]([C@@H](C([C@@H](CC(=O)O1)O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)O)N(C)C)O)CC=O)C)\C)COC4[C@@H]([C@@H]([C@@H]([C@H](O4)C)O)OC)OC.Cl	{1: 12, 2: 3, 33: 1, 11: 3, 12: 20, 13: 1, 14: 3, 15: 1, 17: 1, 20: 5, 22: 5, 23: 3, 25: 1, 26: 1, 28: 1}
OK	110378-86-4	CC1(CCCC1)C(=O)O	{27: 1, 1: 1, 11: 4, 13: 1}
OK	110383-31-8	CCC=C(C)C(C)O	{1: 3, 2: 1, 3: 1, 6: 1, 7: 1, 20: 1}
OK	110389-14-5	CCCCOC(=O)C=C.CC(=C)C(=O)OCCN.CC(=C)C(=O)OCCO.Cl	{1: 3, 2: 7, 5: 3, 6: 1, 7: 2, 17: 1, 20: 1, 28: 3, 30: 1}
OK	11044-40-9	CC1=C[C@@H]2[C@@H](CC1)C(=CC[C@H]2C(C)C)C	{1: 4, 3: 1, 11: 3, 12: 3, 14: 2, 15: 2}
OK	110458-84-9	CC1C(C2(CC1CC2CO)C(C)C)C	{1: 4, 2: 1, 3: 1, 11: 2, 12: 4, 13: 1, 20: 1}
OK	110458-85-0	CC1=C(C2(CC1CC2CO)C(=C)C)C	{1: 3, 2: 1, 5: 1, 7: 1, 11: 2, 12: 2, 13: 1, 15: 2, 20: 1}
OK	110458-86-1	CC1C(C2(CC1CC2COC(=O)C)C(C)C)C	{1: 5, 2: 1, 3: 1, 11: 2, 12: 4, 13: 1, 28: 1}
OK	11050-62-7	CC/C=C/CC1=C(C(=O)CC1)C	{1: 2, 2: 2, 6: 2, 11: 2, 15: 2, 25: 1}
OK	110501-56-9	CC(C)N(CCSCCN(C(C)C)C(C)C)C(C)C	{40: 1, 1: 8, 2: 4, 3: 4, 33: 2}
OK	110512-93-1	CC(CSCCO)O.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CSCCO)O	{1: 1, 2: 8, 3: 1, 8: 2, 11: 8, 12: 4, 34: 2, 40: 2, 20: 4, 29: 2}
OK	110516-60-4	CCC1C(=O)C(=CO1)CO	{1: 1, 2: 2, 12: 1, 14: 1, 15: 1, 20: 1, 23: 1, 25: 1}
OK	11052-72-5	CCC1CCC2C(C(C(C3(O2)CCC(C(O3)CC(C)O)C)C)OC(=O)C=CC(C(C(C(=O)C(C(C(C(=O)C(C(C(CC=CC=C1)C)O)C)C)O)C)C)O)C)C	{1: 11, 2: 2, 3: 1, 11: 5, 12: 16, 13: 1, 14: 6, 20: 4, 23: 2, 25: 2, 28: 1}
OK	11054-63-0	CC1[C@@H](C(=O)N2CCCC[C@@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N1)C(C)C)C(C)N)CC(=O)O)CC(=O)O)C(C)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)C/C=C\CCCCCCCC(C)C	{32: 8, 1: 7, 2: 11, 3: 5, 6: 2, 33: 2, 11: 9, 12: 9, 24: 2, 25: 10, 27: 4, 30: 1, 31: 2}
OK	110556-33-7	C[C@@H](CBr)C(=O)OC	{1: 2, 2: 1, 3: 1, 28: 1, 18: 1}
OK	110559-84-7	CCN(C(=O)NCC(=O)C)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 24: 2, 29: 1, 31: 1}
OK	110559-85-8	CC(=O)CN(C(=O)NCCCl)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 17: 1, 24: 2, 29: 1, 31: 1}
OK	110587-14-9	CC(F)Cl	{16: 1, 1: 1, 3: 1, 17: 1}
OK	11062-77-4	[O][O-]	{29: 2}
OK	110675-51-9	CCCCC(Cl)Cl	{1: 1, 2: 3, 3: 1, 17: 2}
OK	11069-19-5	CCC=C(Cl)Cl	{1: 1, 2: 1, 17: 2, 6: 1, 7: 1}
OK	1107-26-2	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=O)/C)/C	{1: 7, 6: 12, 7: 4, 11: 3, 13: 1, 15: 2, 26: 1}
OK	11071-47-9	CC(C)CCCC=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1}
OK	110720-67-7	CCC1(COC1)CO.C1CO1.C(CCCN=C=O)CCN=C=O	{1: 1, 2: 8, 34: 2, 8: 2, 11: 4, 13: 1, 20: 1, 23: 2, 29: 2}
OK	11075-64-2	CC1(CCCC2(C3C1[C@@H](C2(CC3)C)O)C)C	{1: 4, 11: 5, 12: 3, 13: 3, 20: 1}
OK	110763-36-5	CN/C(=C/[N+](=O)[O-])/OC	{1: 2, 6: 1, 38: 1, 7: 1, 22: 1, 31: 1}
OK	11077-03-5	C[C@H]1C[C@@]2([C@H](O[C@](C1)(O2)CCCCCCC[C@@H](C[C@@H]3[C@@H]([C@H]([C@H]([C@@](O3)(C[C@@H]([C@@H](C)/C=C/[C@H](CC[C@H]([C@H]([C@@H]4C[C@H]([C@@H]([C@H](O4)C[C@H]([C@@H](C[C@@H]5[C@H]([C@@H]([C@H]([C@@H](O5)C[C@@H](/C=C\C=C\C[C@H]([C@@H]([C@@H](C/C=C\C(=C)CC[C@@H]([C@H]([C@@H]([C@H](C)C[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)/C=C\[C@H]([C@@H](C[C@@H]7C[C@@H]8C[C@H](O7)[C@H](O8)CC[C@@H]9[C@@H](C[C@H](O9)CN)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)C[C@@H](C)CCCCC[C@H]([C@@H]([C@@H]([C@H]([C@@H]([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)C[C@@H]([C@@H](/C(=C/[C@@H](C[C@@H](C)[C@@H](C(=O)N/C=C/C(=O)NCCCO)O)O)/C)O)O)O)O)O)O)O)O)O)O)C	{1: 7, 2: 34, 3: 29, 5: 1, 6: 13, 7: 2, 11: 6, 12: 32, 13: 3, 20: 42, 23: 10, 24: 2, 30: 1, 31: 2}
OK	11078-23-2	CC1CCC(C(C(CC(C(/C=C/C(=O)OC(C(/C=C/C(C(C(CC(CC(CC2CC(C(C(O2)(CC1O)O)O)O)OC(=O)CC(=O)O)O)O)C)O)C)C(C)CC(C)CCC/C=C/CCCNC(=NC)N)C)O)O)C)O	{1: 8, 2: 8, 3: 2, 6: 2, 7: 1, 11: 8, 12: 17, 13: 1, 14: 4, 34: 1, 20: 10, 23: 1, 27: 1, 28: 2, 30: 1, 31: 1}
OK	110843-97-5	CC1(CC(CC(N1)(C)C)OC(=O)C2(COC3(CCCCC3)OC2)C(=O)OC4CC(NC(C4)(C)C)(C)C)C	{32: 2, 1: 8, 11: 11, 12: 2, 13: 6, 23: 2, 28: 2}
OK	110847-02-4	CC(=O)C[C@H]1[C@H](C1(C)C)CC#N	{1: 3, 2: 2, 37: 1, 12: 2, 13: 1, 24: 1}
OK	110874-83-4	CC=CCCC(=O)CC(=O)OC	{24: 1, 1: 2, 2: 3, 28: 1, 6: 2}
OK	1109-28-0	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O)CO)CO)O)O)O)O	{20: 11, 2: 3, 12: 15, 22: 2, 23: 3}
OK	11094-48-7	C1CC(CC=C1)C2CO2	{11: 4, 12: 2, 14: 2, 23: 1}
OK	111-01-3	CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C	{1: 8, 2: 16, 3: 6}
OK	111-02-4	CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C	{1: 8, 2: 10, 6: 6, 7: 6}
OK	111-03-5	CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O	{1: 1, 2: 16, 3: 1, 6: 2, 20: 2, 28: 1}
OK	111-06-8	CCCCCCCCCCCCCCCC(=O)OCCCC	{1: 2, 2: 17, 28: 1}
OK	111-07-9	CCCCCCCCCCCCCCCC(=O)OCCOC	{1: 2, 2: 16, 28: 1, 22: 1}
OK	111-08-0	CCCCCCCCC=CCCCCCCCC(=O)NCCCN	{1: 1, 2: 17, 6: 2, 24: 1, 30: 1, 31: 1}
OK	111-10-4	CCCCCCCCC=CCCCCCCCC(=O)OCCOC	{1: 2, 2: 16, 28: 1, 22: 1, 6: 2}
OK	111-11-5	CCCCCCCC(=O)OC	{1: 2, 2: 6, 28: 1}
OK	111-12-6	CCCCCC#CC(=O)OC	{1: 2, 2: 4, 28: 1, 10: 2}
OK	111-13-7	CCCCCCC(=O)C	{24: 1, 1: 2, 2: 5}
OK	111-14-8	CCCCCCC(=O)O	{1: 1, 2: 5, 27: 1}
OK	111-15-9	CCOCCOC(=O)C	{1: 2, 2: 3, 28: 1, 22: 1}
OK	111-16-0	C(CCC(=O)O)CCC(=O)O	{2: 5, 27: 2}
OK	111-17-1	C(CSCCC(=O)O)C(=O)O	{40: 1, 2: 4, 27: 2}
OK	111-18-2	CN(C)CCCCCCN(C)C	{1: 4, 2: 6, 33: 2}
OK	111-19-3	C(CCCCC(=O)Cl)CCCC(=O)Cl	{24: 2, 17: 2, 2: 8}
OK	111-20-6	C(CCCCC(=O)O)CCCC(=O)O	{2: 8, 27: 2}
OK	111-21-7	CC(=O)OCCOCCOCCOC(=O)C	{1: 2, 2: 6, 28: 2, 22: 2}
OK	111-24-0	C(CCBr)CCBr	{2: 5, 18: 2}
OK	111-25-1	CCCCCCBr	{1: 1, 2: 5, 18: 1}
OK	111-26-2	CCCCCCN	{1: 1, 2: 5, 30: 1}
OK	111-27-3	CCCCCCO	{1: 1, 2: 5, 20: 1}
OK	111-28-4	CC=CC=CCO	{1: 1, 2: 1, 20: 1, 6: 4}
OK	111-29-5	C(CCO)CCO	{2: 5, 20: 2}
OK	111-30-8	C(CC=O)CC=O	{2: 3, 26: 2}
OK	111-31-9	CCCCCCS	{1: 1, 2: 5, 39: 1}
OK	111-32-0	COCCCCO	{1: 1, 2: 4, 20: 1, 22: 1}
OK	111-33-1	CNCCCNC	{1: 2, 2: 3, 31: 2}
OK	111-34-2	CCCCOC=C	{1: 1, 2: 3, 22: 1, 5: 1, 6: 1}
OK	111-35-3	CCOCCCO	{1: 1, 2: 4, 20: 1, 22: 1}
OK	111-36-4	CCCCN=C=O	{8: 1, 1: 1, 2: 3, 34: 1, 29: 1}
OK	111-37-5	CCNCCNC	{1: 2, 2: 3, 31: 2}
OK	111-39-7	CCCNCCN	{1: 1, 2: 4, 30: 1, 31: 1}
OK	111-40-0	C(CNCCN)N	{2: 4, 30: 2, 31: 1}
OK	111-41-1	C(CNCCO)N	{2: 4, 20: 1, 30: 1, 31: 1}
OK	111-42-2	C(CO)NCCO	{2: 4, 20: 2, 31: 1}
OK	111-43-3	CCCOCCC	{1: 2, 2: 4, 22: 1}
OK	111-44-4	C(CCl)OCCCl	{17: 2, 2: 4, 22: 1}
OK	111-45-5	C=CCOCCO	{2: 3, 22: 1, 20: 1, 5: 1, 6: 1}
OK	111-46-6	C(COCCO)O	{2: 4, 20: 2, 22: 1}
OK	111-47-7	CCCSCCC	{40: 1, 1: 2, 2: 4}
OK	111-48-8	C(CSCCO)O	{40: 1, 2: 4, 20: 2}
OK	111-49-9	C1CCCNCC1	{32: 1, 11: 6}
OK	111-50-2	C(CCC(=O)Cl)CC(=O)Cl	{24: 2, 17: 2, 2: 4}
OK	111-51-3	CN(C)CCCCN(C)C	{1: 4, 2: 4, 33: 2}
OK	111-52-4	CN(C)CC=CCN(C)C	{1: 4, 2: 2, 6: 2, 33: 2}
OK	111-53-5	CN(C)CC#CCN(C)C	{1: 4, 2: 2, 10: 2, 33: 2}
OK	111-55-7	CC(=O)OCCOC(=O)C	{1: 2, 2: 2, 28: 2}
OK	111-56-8	CCCCCCCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 9, 3: 1, 18: 1}
OK	111-59-1	CCCCCCCCC=CCCCCCCCC(=O)OCCC	{1: 2, 2: 16, 28: 1, 6: 2}
OK	111-61-5	CCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 17, 28: 1}
OK	111-62-6	CCCCCCCCC=CCCCCCCCC(=O)OCC	{1: 2, 2: 15, 28: 1, 6: 2}
OK	111-63-7	CCCCCCCCCCCCCCCCCC(=O)OC=C	{1: 1, 2: 16, 28: 1, 5: 1, 6: 1}
OK	111-64-8	CCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 6, 17: 1}
OK	111-65-9	CCCCCCCC	{1: 2, 2: 6}
OK	111-66-0	CCCCCCC=C	{1: 1, 2: 5, 5: 1, 6: 1}
OK	111-67-1	CCCCCC=CC	{1: 2, 2: 4, 6: 2}
OK	111-68-2	CCCCCCCN	{1: 1, 2: 6, 30: 1}
OK	111-69-3	C(CCC#N)CC#N	{2: 4, 37: 2}
OK	111-70-6	CCCCCCCO	{1: 1, 2: 6, 20: 1}
OK	111-71-7	CCCCCCC=O	{1: 1, 2: 5, 26: 1}
OK	111-72-8	CNCC=CCNC	{1: 2, 2: 2, 6: 2, 31: 2}
OK	111-74-0	CCNCCNCC	{1: 2, 2: 4, 31: 2}
OK	111-75-1	CCCCNCCO	{1: 1, 2: 5, 20: 1, 31: 1}
OK	111-76-2	CCCCOCCO	{1: 1, 2: 5, 20: 1, 22: 1}
OK	111-77-3	COCCOCCO	{1: 1, 2: 4, 20: 1, 22: 2}
OK	111-78-4	C1CC=CCCC=C1	{11: 4, 14: 4}
OK	111-79-5	CCCCCCC=CC(=O)OC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	111-80-8	CCCCCCC#CC(=O)OC	{1: 2, 2: 5, 28: 1, 10: 2}
OK	111-81-9	COC(=O)CCCCCCCCC=C	{1: 1, 2: 8, 28: 1, 5: 1, 6: 1}
OK	111-82-0	CCCCCCCCCCCC(=O)OC	{1: 2, 2: 10, 28: 1}
OK	111-83-1	CCCCCCCCBr	{1: 1, 2: 7, 18: 1}
OK	111-84-2	CCCCCCCCC	{1: 2, 2: 7}
OK	111-85-3	CCCCCCCCCl	{1: 1, 2: 7, 17: 1}
OK	111-86-4	CCCCCCCCN	{1: 1, 2: 7, 30: 1}
OK	111-87-5	CCCCCCCCO	{1: 1, 2: 7, 20: 1}
OK	111-88-6	CCCCCCCCS	{1: 1, 2: 7, 39: 1}
OK	111-89-7	COCCCCCOC	{1: 2, 2: 5, 22: 2}
OK	111-90-0	CCOCCOCCO	{1: 1, 2: 5, 20: 1, 22: 2}
OK	111-91-1	C(CCl)OCOCCCl	{17: 2, 2: 5, 22: 2}
OK	111-92-2	CCCCNCCCC	{1: 2, 2: 6, 31: 1}
OK	111-94-4	C(CNCCC#N)C#N	{2: 4, 37: 2, 31: 1}
OK	111-95-5	COCCNCCOC	{1: 2, 2: 4, 22: 2, 31: 1}
OK	111-96-6	COCCOCCOC	{1: 2, 2: 4, 22: 3}
OK	111-97-7	C(CSCCC#N)C#N	{40: 1, 2: 4, 37: 2}
OK	1111-39-3	CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)OC(=O)C)O	{1: 6, 11: 13, 12: 17, 13: 3, 14: 1, 15: 1, 20: 4, 22: 3, 23: 3, 28: 2}
OK	1111-97-3	CC(C)(C#C)Cl	{1: 2, 10: 1, 4: 1, 17: 1, 9: 1}
OK	11111-23-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)C[C@@H]4[C@]5([C@@]3(CC[C@@H](C5)O)C)O4	{1: 2, 11: 8, 12: 5, 13: 3, 20: 1, 23: 1, 25: 1}
OK	111122-57-7	CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)NC(=O)CCCCCCCCC)O	{1: 2, 2: 21, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	1112-35-2	CC(C)(C=C)C=C	{1: 2, 4: 1, 5: 2, 6: 2}
OK	1112-78-3	CC(C)CC(C)(OC)OC	{1: 5, 2: 1, 3: 1, 4: 1, 22: 2}
OK	111256-18-9	CCCCCCCCCCC=C.CCCCCCC=C	{1: 2, 2: 14, 5: 2, 6: 2}
OK	111293-23-3	CCOC(=O)C(C)OC(=O)C=CC(=O)OC(C)C(=O)OCC	{1: 4, 2: 2, 3: 2, 28: 4, 6: 2}
OK	1113-21-9	CC(=CCCC(=CCCC(=CCCC(C)(C=C)O)C)C)C	{1: 5, 2: 6, 4: 1, 5: 1, 6: 4, 7: 3, 20: 1}
OK	1113-59-3	C(C(=O)C(=O)O)Br	{24: 1, 2: 1, 27: 1, 18: 1}
OK	1113-68-4	CC(=O)N(C)C(=O)C	{24: 2, 1: 3, 33: 1}
OK	1113-74-2	CC(C)C(=NO)C(C)C	{1: 4, 34: 1, 3: 2, 20: 1, 7: 1}
OK	111302-96-6	C1C=CC[C@@H]([C@@H]1C(=O)N)N	{24: 1, 11: 2, 12: 2, 30: 2, 14: 2}
OK	1114-51-8	CCC(=O)N(CC)CC	{24: 1, 1: 3, 2: 3, 33: 1}
OK	1114-59-6	CCCN(CCC)C(=O)CC	{24: 1, 1: 3, 2: 5, 33: 1}
OK	1114-71-2	CCCCN(CC)C(=O)SCCC	{24: 1, 1: 3, 2: 6, 40: 1, 33: 1}
OK	1114-76-7	CCCC(=O)N(CC)CC	{24: 1, 1: 3, 2: 4, 33: 1}
OK	1114-92-7	CC(C(C)OC(=O)C)OC(=O)C	{1: 4, 3: 2, 28: 2}
OK	111456-84-9	CCOC(C)(N1C=CN=C1)OCC	{1: 3, 2: 2, 35: 1, 4: 1, 33: 1, 14: 3, 22: 2}
OK	1115-01-1	CCCCCCCCC(C(CCCCCCCC(=O)OC)O)O	{1: 2, 2: 14, 3: 2, 20: 2, 28: 1}
OK	1115-08-8	CC(C=C)C=C	{1: 1, 3: 1, 5: 2, 6: 2}
OK	1115-12-4	C(#N)C(=O)C#N	{24: 1, 37: 2}
OK	1115-20-4	CC(C)(CO)COC(=O)C(C)(C)CO	{1: 4, 2: 3, 4: 2, 20: 2, 28: 1}
OK	1115-30-6	CCOC(=O)CC(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 3, 3: 1, 28: 2}
OK	1115-37-3	CC(C)C(CC#N)C#N	{1: 2, 2: 1, 3: 2, 37: 2}
OK	1115-47-5	CC(=O)NC(CCSC)C(=O)O	{1: 2, 2: 2, 3: 1, 40: 1, 24: 1, 27: 1, 31: 1}
OK	1115-69-1	CC(C(=O)O)NC(=O)C	{24: 1, 1: 2, 3: 1, 27: 1, 31: 1}
OK	1115-70-4	CN(C)C(=N)N=C(N)N.Cl	{1: 2, 34: 1, 36: 1, 33: 1, 7: 2, 17: 1, 30: 2}
OK	1115-90-8	CCCCCC(C(=O)O)N	{27: 1, 1: 1, 2: 4, 3: 1, 30: 1}
OK	1116-22-9	C(CC(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C(=O)O)N	{2: 4, 3: 2, 24: 1, 27: 3, 30: 1, 31: 1}
OK	1116-24-1	CCCN(CCC)C(=O)C	{24: 1, 1: 3, 2: 4, 33: 1}
OK	1116-40-1	CC(C)CN(CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 3, 33: 1}
OK	1116-43-4	C(C#N)N(CC#N)CN(CC#N)CC#N	{33: 2, 2: 5, 37: 4}
OK	1116-54-7	C(CO)N(CCO)N=O	{33: 1, 2: 4, 34: 1, 20: 2, 29: 1}
OK	1116-76-3	CCCCCCCCN(CCCCCCCC)CCCCCCCC	{1: 3, 2: 21, 33: 1}
OK	1116-90-1	CC=C(C)CC=C	{1: 2, 2: 1, 5: 1, 6: 2, 7: 1}
OK	1116-98-9	CC(C)(C)OC(=O)CC#N	{1: 3, 2: 1, 4: 1, 37: 1, 28: 1}
OK	111639-04-4	CCCCCCCCCCCCCCCC(=O)O.CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O	{1: 14, 2: 15, 33: 1, 11: 3, 12: 15, 13: 3, 20: 5, 22: 3, 23: 2, 25: 1, 27: 1, 28: 1}
OK	111652-29-0	CC(C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)O)N	{1: 6, 3: 6, 24: 5, 27: 1, 30: 1, 31: 5}
OK	111681-72-2	CC(CN1CCOCC1)OCCN2CCOCC2	{1: 1, 2: 3, 3: 1, 33: 2, 11: 8, 22: 1, 23: 2}
OK	1117-19-7	CCCOC(=O)CC(=O)OCCC	{1: 2, 2: 5, 28: 2}
OK	1117-41-5	CC(=CCC/C(=C/C=C(\C)/C(=O)C)/C)C	{24: 1, 1: 5, 2: 2, 6: 3, 7: 3}
OK	1117-52-8	CC(=CCC/C(=C/CC/C(=C/CCC(=O)C)/C)/C)C	{24: 1, 1: 5, 2: 6, 6: 3, 7: 3}
OK	1117-55-1	CCCCCCCC(=O)OCCCCCC	{1: 2, 2: 11, 28: 1}
OK	1117-59-5	CCCCCCOC(=O)CCCC	{1: 2, 2: 8, 28: 1}
OK	1117-61-9	C[C@H](CCC=C(C)C)CCO	{1: 3, 2: 4, 3: 1, 6: 1, 7: 1, 20: 1}
OK	1117-65-3	CCCCC=CCC(=O)OCC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	1117-71-1	COC(=O)/C=C/CBr	{1: 1, 2: 1, 28: 1, 18: 1, 6: 2}
OK	1117-77-7	CC(=O)NCC(=O)OC	{24: 1, 1: 2, 2: 1, 28: 1, 31: 1}
OK	1117-79-9	CCCCCC(CC)Cl	{1: 2, 2: 5, 3: 1, 17: 1}
OK	1117-86-8	CCCCCCC(CO)O	{1: 1, 2: 6, 3: 1, 20: 2}
OK	1117-97-1	CNOC	{1: 2, 22: 1, 31: 1}
OK	1117-99-3	C(=NO)C(Cl)(Cl)Cl	{17: 3, 34: 1, 4: 1, 6: 1, 20: 1}
OK	1118-00-9	CC(C)(C)COC	{1: 4, 2: 1, 4: 1, 22: 1}
OK	1118-12-3	CC(C)(C)NC(=O)N	{24: 1, 1: 3, 4: 1, 30: 1, 31: 1}
OK	1118-27-0	CC(C)CC(=O)OC(C)(CCC=C(C)C)C=C	{1: 5, 2: 3, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	1118-39-4	CC(=O)OC(C)(C)CCCC(=C)C=C	{1: 3, 2: 3, 4: 1, 5: 2, 6: 1, 7: 1, 28: 1}
OK	1118-47-4	CC(C)(C)CCC(=O)O	{1: 3, 2: 2, 27: 1, 4: 1}
OK	1118-58-7	CC=CC(=C)C	{1: 2, 5: 1, 6: 2, 7: 1}
OK	1118-60-1	CC(=N)CC#N	{1: 1, 2: 1, 36: 1, 37: 1, 7: 1}
OK	1118-61-2	CC(=CC#N)N	{1: 1, 37: 1, 30: 1, 6: 1, 7: 1}
OK	1118-66-7	CC(=CC(=O)C)N	{24: 1, 1: 2, 30: 1, 6: 1, 7: 1}
OK	1118-68-9	CN(C)CC(=O)O	{1: 2, 2: 1, 27: 1, 33: 1}
OK	1118-69-0	CC(C)NC(=O)C	{24: 1, 1: 3, 3: 1, 31: 1}
OK	1118-71-4	CC(C)(C)C(=O)CC(=O)C(C)(C)C	{24: 2, 1: 6, 2: 1, 4: 2}
OK	1118-84-9	CC(=O)CC(=O)OCC=C	{1: 1, 2: 2, 5: 1, 6: 1, 24: 1, 28: 1}
OK	1118-89-4	CCOC(=O)CC[C@@H](C(=O)OCC)N.Cl	{1: 2, 2: 4, 3: 1, 17: 1, 28: 2, 30: 1}
OK	1118-90-7	C(C[C@@H](C(=O)O)N)CC(=O)O	{27: 2, 2: 3, 3: 1, 30: 1}
OK	1118-92-9	CCCCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 6, 33: 1}
OK	111828-49-0	CC1(OC(C(O1)C(=O)N(C)C)C(=O)N(C)C)C	{1: 6, 33: 2, 12: 2, 13: 1, 23: 2, 24: 2}
OK	111869-19-3	CC(C)(C=C=C)C=C=C	{8: 2, 1: 2, 4: 1, 5: 2, 6: 2}
OK	111869-26-2	CC1(C=C2CCC2=C1)C	{1: 2, 11: 2, 13: 1, 14: 2, 15: 2}
OK	111872-80-1	CCC=CC=CCCCCCCCCCCO	{1: 1, 2: 11, 20: 1, 6: 4}
OK	1119-06-8	CCCCCCC(=O)OCCCCCC	{1: 2, 2: 10, 28: 1}
OK	1119-16-0	CC(C)CCC=O	{1: 2, 2: 2, 3: 1, 26: 1}
OK	1119-19-3	CC#CC=O	{1: 1, 10: 2, 26: 1}
OK	1119-29-5	CC(C)CCC(=O)N	{24: 1, 1: 2, 2: 2, 3: 1, 30: 1}
OK	1119-33-1	CCOC(=O)CCC(C(=O)O)N	{1: 1, 2: 3, 3: 1, 27: 1, 28: 1, 30: 1}
OK	1119-40-0	COC(=O)CCCC(=O)OC	{1: 2, 2: 3, 28: 2}
OK	1119-43-3	COC(=O)C=CC=CC(=O)OC	{1: 2, 28: 2, 6: 4}
OK	1119-44-4	CCCC=CC(=O)C	{24: 1, 1: 2, 2: 2, 6: 2}
OK	1119-46-6	C(CCCl)CC(=O)O	{17: 1, 2: 4, 27: 1}
OK	1119-49-9	CCCCNC(=O)C	{24: 1, 1: 2, 2: 3, 31: 1}
OK	1119-51-3	C=CCCCBr	{2: 3, 18: 1, 5: 1, 6: 1}
OK	1119-58-0	CCCCC#CC(=O)C	{24: 1, 1: 2, 2: 3, 10: 2}
OK	1119-60-4	C=CCCCCC(=O)O	{2: 4, 27: 1, 5: 1, 6: 1}
OK	1119-62-6	C(CSSCCC(=O)O)C(=O)O	{40: 2, 2: 4, 27: 2}
OK	1119-65-9	CCCCC#CC	{1: 2, 2: 3, 10: 2}
OK	1119-68-2	CCCCCNN.Cl	{1: 1, 2: 4, 31: 1, 30: 1, 17: 1}
OK	1119-85-3	C(C=CCC#N)C#N	{2: 2, 37: 2, 6: 2}
OK	1119-86-4	CCCCCCCCC(CO)O	{1: 1, 2: 8, 3: 1, 20: 2}
OK	1119-87-5	CCCCCCCCCCC(CO)O	{1: 1, 2: 10, 3: 1, 20: 2}
OK	1119-88-6	CCCCCCC=CBr	{1: 1, 2: 5, 18: 1, 6: 2}
OK	111917-14-7	C=C1CCC23C1(CCC2)CCC3	{15: 1, 11: 8, 5: 1, 13: 2}
OK	111955-43-2	CCCCCCCCCCCCCCCCCCOCC1CO1	{1: 1, 2: 18, 11: 1, 12: 1, 22: 1, 23: 1}
OK	112-05-0	CCCCCCCCC(=O)O	{1: 1, 2: 7, 27: 1}
OK	112-06-1	CCCCCCCOC(=O)C	{1: 2, 2: 6, 28: 1}
OK	112-07-2	CCCCOCCOC(=O)C	{1: 2, 2: 5, 28: 1, 22: 1}
OK	112-10-7	CCCCCCCCCCCCCCCCCC(=O)OC(C)C	{1: 3, 2: 16, 3: 1, 28: 1}
OK	112-12-9	CCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 8}
OK	112-13-0	CCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 8, 17: 1}
OK	112-14-1	CCCCCCCCOC(=O)C	{1: 2, 2: 7, 28: 1}
OK	112-15-2	CCOCCOCCOC(=O)C	{1: 2, 2: 5, 28: 1, 22: 2}
OK	112-16-3	CCCCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 10, 17: 1}
OK	112-17-4	CCCCCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1}
OK	112-18-5	CCCCCCCCCCCCN(C)C	{1: 3, 2: 11, 33: 1}
OK	112-19-6	CC(=O)OCCCCCCCCCC=C	{1: 1, 2: 9, 28: 1, 5: 1, 6: 1}
OK	112-20-9	CCCCCCCCCN	{1: 1, 2: 8, 30: 1}
OK	112-21-0	CCNC/C=C/CNCC	{1: 2, 2: 4, 6: 2, 31: 2}
OK	112-22-1	CCNCC#CCNCC	{1: 2, 2: 4, 10: 2, 31: 2}
OK	112-24-3	C(CNCCNCCN)N	{2: 6, 30: 2, 31: 2}
OK	112-25-4	CCCCCCOCCO	{1: 1, 2: 7, 20: 1, 22: 1}
OK	112-26-5	C(COCCCl)OCCCl	{17: 2, 2: 6, 22: 2}
OK	112-27-6	C(COCCOCCO)O	{2: 6, 20: 2, 22: 2}
OK	112-28-7	COCCCOCCCO	{1: 1, 2: 6, 20: 1, 22: 2}
OK	112-29-8	CCCCCCCCCCBr	{1: 1, 2: 9, 18: 1}
OK	112-30-1	CCCCCCCCCCO	{1: 1, 2: 9, 20: 1}
OK	112-31-2	CCCCCCCCCC=O	{1: 1, 2: 8, 26: 1}
OK	112-33-4	C(CN)COCCOCCO	{2: 7, 20: 1, 30: 1, 22: 2}
OK	112-34-5	CCCCOCCOCCO	{1: 1, 2: 7, 20: 1, 22: 2}
OK	112-35-6	COCCOCCOCCO	{1: 1, 2: 6, 20: 1, 22: 3}
OK	112-36-7	CCOCCOCCOCC	{1: 2, 2: 6, 22: 3}
OK	112-37-8	CCCCCCCCCCC(=O)O	{1: 1, 2: 9, 27: 1}
OK	112-38-9	C=CCCCCCCCCC(=O)O	{2: 8, 27: 1, 5: 1, 6: 1}
OK	112-39-0	CCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 14, 28: 1}
OK	112-40-3	CCCCCCCCCCCC	{1: 2, 2: 10}
OK	112-41-4	CCCCCCCCCCC=C	{1: 1, 2: 9, 5: 1, 6: 1}
OK	112-42-5	CCCCCCCCCCCO	{1: 1, 2: 10, 20: 1}
OK	112-43-6	C=CCCCCCCCCCO	{2: 9, 20: 1, 5: 1, 6: 1}
OK	112-44-7	CCCCCCCCCCC=O	{1: 1, 2: 9, 26: 1}
OK	112-45-8	C=CCCCCCCCCC=O	{2: 8, 26: 1, 5: 1, 6: 1}
OK	112-46-9	CC=CCCCCCCCCO	{1: 1, 2: 8, 20: 1, 6: 2}
OK	112-47-0	C(CCCCCO)CCCCO	{2: 10, 20: 2}
OK	112-48-1	CCCCOCCOCCCC	{1: 2, 2: 8, 22: 2}
OK	112-49-2	COCCOCCOCCOC	{1: 2, 2: 6, 22: 4}
OK	112-50-5	CCOCCOCCOCCO	{1: 1, 2: 7, 20: 1, 22: 3}
OK	112-51-6	CCCCCSSCCCCC	{40: 2, 1: 2, 2: 8}
OK	112-52-7	CCCCCCCCCCCCCl	{1: 1, 2: 11, 17: 1}
OK	112-53-8	CCCCCCCCCCCCO	{1: 1, 2: 11, 20: 1}
OK	112-54-9	CCCCCCCCCCCC=O	{1: 1, 2: 10, 26: 1}
OK	112-55-0	CCCCCCCCCCCCS	{1: 1, 2: 11, 39: 1}
OK	112-56-1	CCCCOCCOCCSC#N	{40: 1, 1: 1, 2: 7, 37: 1, 22: 2}
OK	112-57-2	C(CNCCNCCNCCN)N	{2: 8, 30: 2, 31: 3}
OK	112-58-3	CCCCCCOCCCCCC	{1: 2, 2: 10, 22: 1}
OK	112-59-4	CCCCCCOCCOCCO	{1: 1, 2: 9, 20: 1, 22: 2}
OK	112-60-7	C(COCCOCCOCCO)O	{2: 8, 20: 2, 22: 3}
OK	112-61-8	CCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 16, 28: 1}
OK	112-62-9	CCCCCCCC/C=C\CCCCCCCC(=O)OC	{1: 2, 2: 14, 28: 1, 6: 2}
OK	112-63-0	CCCCCC=CCC=CCCCCCCCC(=O)OC	{1: 2, 2: 12, 28: 1, 6: 4}
OK	112-64-1	CCCCCCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 12, 17: 1}
OK	112-66-3	CCCCCCCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1}
OK	112-67-4	CCCCCCCCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 14, 17: 1}
OK	112-69-6	CCCCCCCCCCCCCCCCN(C)C	{1: 3, 2: 15, 33: 1}
OK	112-70-9	CCCCCCCCCCCCCO	{1: 1, 2: 12, 20: 1}
OK	112-71-0	CCCCCCCCCCCCCCBr	{1: 1, 2: 13, 18: 1}
OK	112-72-1	CCCCCCCCCCCCCCO	{1: 1, 2: 13, 20: 1}
OK	112-73-2	CCCCOCCOCCOCCCC	{1: 2, 2: 10, 22: 3}
OK	112-75-4	CCCCCCCCCCCCCCN(C)C	{1: 3, 2: 13, 33: 1}
OK	112-76-5	CCCCCCCCCCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 16, 17: 1}
OK	112-77-6	CCCCCCCCC=CCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 14, 6: 2, 17: 1}
OK	112-79-8	CCCCCCCCC=CCCCCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 6: 2}
OK	112-80-1	CCCCCCCC/C=C\CCCCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 6: 2}
OK	112-82-3	CCCCCCCCCCCCCCCCBr	{1: 1, 2: 15, 18: 1}
OK	112-84-5	CCCCCCCC/C=C\CCCCCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 18, 30: 1, 6: 2}
OK	112-85-6	CCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 20, 27: 1}
OK	112-86-7	CCCCCCCCC=CCCCCCCCCCCCC(=O)O	{1: 1, 2: 18, 27: 1, 6: 2}
OK	112-88-9	CCCCCCCCCCCCCCCCC=C	{1: 1, 2: 15, 5: 1, 6: 1}
OK	112-89-0	CCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 17, 18: 1}
OK	112-90-3	CCCCCCCCC=CCCCCCCCCN	{1: 1, 2: 15, 30: 1, 6: 2}
OK	112-91-4	CCCCCCCC/C=C\CCCCCCCC#N	{1: 1, 2: 14, 37: 1, 6: 2}
OK	112-92-5	CCCCCCCCCCCCCCCCCCO	{1: 1, 2: 17, 20: 1}
OK	112-95-8	CCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 18}
OK	112-96-9	CCCCCCCCCCCCCCCCCCN=C=O	{8: 1, 1: 1, 2: 17, 34: 1, 29: 1}
OK	112-98-1	CCCCOCCOCCOCCOCCOCCCC	{1: 2, 2: 14, 22: 5}
OK	112-99-2	CCCCCCCCCCCCCCCCCCNCCCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 31: 1}
OK	1120-06-5	CCCCCCCCC(C)O	{1: 2, 2: 7, 3: 1, 20: 1}
OK	1120-07-6	CCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 7, 30: 1}
OK	1120-10-1	C(CCCCCl)CCCC(=O)O	{17: 1, 2: 8, 27: 1}
OK	1120-12-3	C(CCCCN)CCCC(=O)O	{2: 8, 27: 1, 30: 1}
OK	1120-16-7	CCCCCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 10, 30: 1}
OK	1120-17-8	CCCSC=CSCCC	{40: 2, 1: 2, 2: 4, 6: 2}
OK	1120-21-4	CCCCCCCCCCC	{1: 2, 2: 9}
OK	1120-23-6	CCCCOCCOCCCl	{1: 1, 2: 7, 22: 2, 17: 1}
OK	1120-24-7	CCCCCCCCCCN(C)C	{1: 3, 2: 9, 33: 1}
OK	1120-25-8	CCCCCC/C=C\CCCCCCCC(=O)OC	{1: 2, 2: 12, 28: 1, 6: 2}
OK	1120-28-1	CCCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 18, 28: 1}
OK	1120-29-2	CCCCC#CC#CCCCC	{1: 2, 2: 6, 10: 4}
OK	1120-34-9	CCCCCCCCC=CCCCCCCCCCCCC(=O)OC	{1: 2, 2: 18, 28: 1, 6: 2}
OK	1120-36-1	CCCCCCCCCCCCC=C	{1: 1, 2: 11, 5: 1, 6: 1}
OK	1120-48-5	CCCCCCCCNCCCCCCCC	{1: 2, 2: 14, 31: 1}
OK	1120-49-6	CCCCCCCCCCNCCCCCCCCCC	{1: 2, 2: 18, 31: 1}
OK	1120-53-2	C1=CC=C1	{14: 4}
OK	1120-56-5	C=C1CCC1	{11: 3, 5: 1, 15: 1}
OK	1120-57-6	C1CC(C1)Cl	{17: 1, 11: 3, 12: 1}
OK	1120-59-8	C1CSC=C1	{41: 1, 11: 2, 14: 2}
OK	1120-62-3	CC1CCC=C1	{1: 1, 11: 2, 12: 1, 14: 2}
OK	1120-64-5	CC1=NCCO1	{23: 1, 1: 1, 11: 2, 35: 1, 15: 1}
OK	1120-70-3	C1CCC(C1)(F)F	{16: 2, 11: 4, 13: 1}
OK	1120-72-5	CC1CCCC1=O	{1: 1, 11: 3, 12: 1, 25: 1}
OK	1120-73-6	CC1=CCCC1=O	{1: 1, 11: 2, 25: 1, 14: 1, 15: 1}
OK	1120-97-4	CC1CCOCO1	{1: 1, 11: 3, 12: 1, 23: 2}
OK	1121-05-7	CC1=C(C(=O)CC1)C	{1: 2, 11: 2, 25: 1, 15: 2}
OK	1121-07-9	CN1C(=O)CCC1=O	{1: 1, 11: 2, 33: 1, 25: 2}
OK	1121-14-8	C1CON=C1[N+](=O)[O-]	{23: 1, 35: 1, 11: 2, 38: 1, 15: 1}
OK	1121-18-2	CC1=CCCCC1=O	{1: 1, 11: 3, 25: 1, 14: 1, 15: 1}
OK	1121-20-6	CC1COCOC1C	{1: 2, 11: 2, 12: 2, 23: 2}
OK	1121-33-1	CC1CC(C(=O)C1)C	{1: 2, 11: 2, 12: 2, 25: 1}
OK	1121-35-3	CC(=C1CC1(C)C)C	{15: 1, 1: 4, 11: 1, 13: 1, 7: 1}
OK	1121-37-5	C1CC1C(=O)C2CC2	{24: 1, 11: 4, 12: 2}
OK	1121-64-8	C1CC=CCC(=O)C1	{25: 1, 11: 4, 14: 2}
OK	1121-65-9	C1C=CC=CCC1=O	{25: 1, 11: 2, 14: 4}
OK	1121-66-0	C1CCC(=O)C=CC1	{25: 1, 11: 4, 14: 2}
OK	1121-83-1	CC1(CNC(=O)O1)C	{32: 1, 1: 2, 11: 1, 28: 1, 13: 1}
OK	1121-84-2	CC1CCOC(=O)C1	{1: 1, 11: 3, 12: 1, 28: 1}
OK	1121-87-5	CC1CC(OCO1)C	{1: 2, 11: 2, 12: 2, 23: 2}
OK	1121-89-7	C1CC(=O)NC(=O)C1	{32: 1, 25: 2, 11: 3}
OK	1121-92-2	C1CCCNCCC1	{32: 1, 11: 7}
OK	1121-97-7	CC1(COCOC1)CO	{1: 1, 2: 1, 11: 3, 13: 1, 20: 1, 23: 2}
OK	112112-57-9	C=C1CCC23C1(CCC2)C(=C)CC3	{15: 2, 11: 7, 5: 2, 13: 2}
OK	112112-58-0	C=C1CCC23C1(C(=O)CC2)C(=O)CC3	{15: 1, 25: 2, 11: 6, 5: 1, 13: 2}
OK	112138-33-7	C=C1CCC23C1(CCC2)C(=O)CC3	{15: 1, 25: 1, 11: 7, 5: 1, 13: 2}
OK	112138-34-8	C1CC23CCC(=O)C2(C1)C(=O)CC3	{25: 2, 11: 7, 13: 2}
OK	112182-00-0	CCOC(=O)C=CC=CC(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 6: 4}
OK	1122-10-7	C1(=C(C(=O)NC1=O)Br)Br	{32: 1, 25: 2, 18: 2, 15: 2}
OK	1122-24-3	CC=C1CCCCC1=O	{1: 1, 11: 4, 25: 1, 6: 1, 15: 1}
OK	1122-56-1	C1CCC(CC1)C(=O)N	{24: 1, 11: 5, 12: 1, 30: 1}
OK	1122-60-7	C1CCC(CC1)[N+](=O)[O-]	{11: 5, 12: 1, 38: 1}
OK	1122-84-5	CCOC1=CCCCC1	{1: 1, 2: 1, 11: 4, 14: 1, 15: 1, 22: 1}
OK	1122-98-1	CC(=O)CC1CCCC1	{24: 1, 1: 1, 2: 1, 11: 4, 12: 1}
OK	112245-13-3	CC(C)(C)[C@@H](CO)N	{1: 3, 2: 1, 3: 1, 4: 1, 20: 1, 30: 1}
OK	112275-50-0	CC(C)(C)OC(=O)N1CCCNCC1	{32: 1, 1: 3, 4: 1, 33: 1, 11: 5, 28: 1}
OK	112296-53-4	NNO	{20: 1, 30: 1, 31: 1}
OK	1123-00-8	C1CCC(C1)CC(=O)O	{27: 1, 2: 1, 11: 4, 12: 1}
OK	1123-07-5	CC1CC(OCO1)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 23: 2}
OK	1123-09-7	CC1CC(=CC(=O)C1)C	{1: 2, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	1123-11-1	C1CCCC=C=CCC1	{8: 1, 11: 6, 14: 2}
OK	1123-19-9	CC(=O)C1(CCOC1=O)C	{24: 1, 1: 2, 11: 2, 28: 1, 13: 1}
OK	1123-25-7	CC1(CCCCC1)C(=O)O	{27: 1, 1: 1, 11: 5, 13: 1}
OK	1123-27-9	CC(=O)C1(CCCCC1)O	{24: 1, 1: 1, 11: 5, 20: 1, 13: 1}
OK	1123-34-8	C=CCC1(CCCCC1)O	{2: 1, 5: 1, 6: 1, 11: 5, 13: 1, 20: 1}
OK	1123-40-6	CC1(CC(=O)NC(=O)C1)C	{32: 1, 1: 2, 11: 2, 13: 1, 25: 2}
OK	1123-61-1	CN1C(=O)C(=C(C1=O)Cl)Cl	{1: 1, 33: 1, 17: 2, 25: 2, 15: 2}
OK	1123-86-0	CCC(=O)C1CCCCC1	{24: 1, 1: 1, 2: 1, 11: 5, 12: 1}
OK	112309-61-2	CC1=C(C(=O)OC1O)Cl	{1: 1, 12: 1, 15: 2, 17: 1, 20: 1, 28: 1}
OK	112309-62-3	C(=C(C(Cl)Cl)C(Cl)Cl)C(=O)O	{27: 1, 17: 4, 3: 2, 6: 1, 7: 1}
OK	1124-27-2	CC1CCC(CC1)C(=C)C	{1: 2, 11: 4, 12: 2, 5: 1, 7: 1}
OK	1124-53-4	CC(=O)NC1CCCCC1	{24: 1, 1: 1, 11: 5, 12: 1, 31: 1}
OK	1124-62-5	C1CCC(CC1)CCCCl	{17: 1, 2: 3, 11: 5, 12: 1}
OK	1124-63-6	C1CCC(CC1)CCCO	{20: 1, 2: 3, 11: 5, 12: 1}
OK	1124-78-3	C1CCC=CCCC=CC1	{11: 6, 14: 4}
OK	1124-79-4	C1C/C=C\CCC/C=C\C1	{11: 6, 14: 4}
OK	112400-77-8	CCCC(C)COC(=O)CCCC(=O)OCC(CC)CC	{1: 4, 2: 9, 3: 2, 28: 2}
OK	112484-43-2	CC(C)(C)COC(=O)C(C)(C)C(O)OCC(C)(C)CO	{1: 7, 2: 3, 3: 1, 4: 3, 20: 2, 22: 1, 28: 1}
OK	1125-11-7	CC1C(=O)CC(CC1=O)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 25: 2}
OK	1125-12-8	CC1C2CC2(CC1=O)C(C)C	{1: 3, 3: 1, 11: 2, 12: 2, 13: 1, 25: 1}
OK	1125-21-9	CC1=CC(=O)CC(C1=O)(C)C	{1: 3, 11: 1, 13: 1, 14: 1, 15: 1, 25: 2}
OK	1125-99-1	C1CCC(=CC1)N2CCCC2	{33: 1, 11: 8, 14: 1, 15: 1}
OK	112533-27-4	C1C2C3C4C5CC6C4C2C(C1C3C5=O)C6=O	{25: 2, 11: 2, 12: 10}
OK	1126-09-6	CCOC(=O)C1CCNCC1	{32: 1, 1: 1, 2: 1, 11: 4, 12: 1, 28: 1}
OK	1126-18-7	CCCCC1CCCCC1=O	{1: 1, 2: 3, 11: 4, 12: 1, 25: 1}
OK	1126-56-3	CCC(=O)NC1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1, 24: 1, 31: 1}
OK	1126-58-5	C1=CC=[N+](C=C1)CC(=O)NN.[Cl-]	{33: 1, 2: 1, 14: 5, 17: 1, 24: 1, 30: 1, 31: 1}
OK	1127-08-8	C1CCC(CC1)(C(=O)O)C(=O)O	{27: 2, 11: 5, 13: 1}
OK	1127-68-0	CC1CCC2C1COC(=O)C2C	{1: 2, 11: 3, 12: 4, 28: 1}
OK	112725-15-2	CC(=O)C(N(C)N=O)OC(=O)C	{1: 3, 34: 1, 3: 1, 33: 1, 24: 1, 28: 1, 29: 1}
OK	112748-33-1	CC(CO)OCC1C(C(C(C(O1)OC)OC(C)CO)OC(C)CO)OC(C)CO	{1: 5, 2: 5, 3: 4, 12: 5, 20: 4, 22: 5, 23: 1}
OK	112771-04-7	C1CCN(C1)N2CCCC2	{33: 2, 11: 8}
OK	112789-84-1	CCOC(=O)CCC(C)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1}
OK	1128-00-3	CCOC(=O)C1=C(CCCC1)N	{1: 1, 2: 1, 11: 4, 15: 2, 28: 1, 30: 1}
OK	1128-08-1	CCCCCC1=C(CCC1=O)C	{1: 2, 2: 4, 11: 2, 25: 1, 15: 2}
OK	1128-23-0	C([C@@H]([C@@H]1[C@@H]([C@@H](C(=O)O1)O)O)O)O	{20: 4, 2: 1, 3: 1, 12: 3, 28: 1}
OK	112820-37-8	C(=O)(C(C(F)(F)F)(OC(C(OC(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F)F)F	{16: 18, 24: 1, 4: 8, 22: 2}
OK	112898-44-9	C[C@]1(CCCCC1=O)CCC(=O)OC	{1: 2, 2: 2, 11: 4, 13: 1, 25: 1, 28: 1}
OK	1129-47-1	CC(C)C(=O)OC1CCCCC1	{11: 5, 1: 2, 3: 1, 12: 1, 28: 1}
OK	1129-90-4	C1CCCCCC#CCCCC1	{10: 2, 11: 10}
OK	113-00-8	C(=N)(N)N	{36: 1, 30: 2, 7: 1}
OK	113-18-8	CCC(/C=C/Cl)(C#C)O	{1: 1, 2: 1, 4: 1, 6: 2, 9: 1, 10: 1, 17: 1, 20: 1}
OK	113-48-4	CCCCC(CC)CN1C(=O)C2C3CC(C2C1=O)C=C3	{1: 2, 2: 5, 3: 1, 33: 1, 11: 1, 12: 4, 14: 2, 25: 2}
OK	113035-24-8	CC1=CC2=C(N=C(C2=C1)N(C)C)N(C)C	{1: 5, 35: 1, 33: 2, 14: 2, 15: 5}
OK	113035-25-9	CN(C)C1=C2C=C(C=C2C(=N1)N(C)C)C=O	{1: 4, 35: 1, 33: 2, 14: 2, 15: 5, 26: 1}
OK	113035-26-0	CC(C)(C)C1=CC(=C2C1=C(N=C2N(C)C)N(C)C)C(C)(C)C	{1: 10, 35: 1, 4: 2, 33: 2, 14: 1, 15: 6}
OK	113035-28-2	CC(C)(C)C1=CC2=C(N=C(C2=C1)N3CCCCC3)C(C)(C)C	{1: 6, 35: 1, 4: 2, 33: 1, 11: 5, 14: 2, 15: 5}
OK	113060-10-9	CCCCCCCCCCCCCCOCCCN.CC(=O)O	{1: 2, 2: 16, 27: 1, 30: 1, 22: 1}
OK	113116-18-0	C(C(=O)C(C(C(F)(F)F)(F)F)(F)F)C(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 14, 24: 2, 2: 1, 4: 6}
OK	113184-29-5	CCC(CO)(CO)CO.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O	{1: 1, 2: 5, 34: 2, 4: 1, 8: 2, 11: 2, 13: 2, 14: 8, 20: 3, 29: 2}
OK	1132-20-3	C1CC2CCC1CN(C2)C(=O)CCl	{33: 1, 2: 1, 11: 6, 12: 2, 17: 1, 24: 1}
OK	113263-60-8	CC(CN(CC(C)O)CC(C)O)O.C=CC(=O)O	{1: 3, 2: 3, 3: 3, 5: 1, 6: 1, 33: 1, 20: 3, 27: 1}
OK	113293-50-8	CCCCCCN1CN(CN(C1)CCCCCC)CCCCCC	{1: 3, 2: 15, 11: 3, 33: 3}
OK	1133-23-9	CC(=C1C(=C(C)C)C(C1(C)C)(C)C)C	{1: 8, 15: 2, 13: 2, 7: 2}
OK	1134-23-2	CCN(C1CCCCC1)C(=O)SCC	{1: 2, 2: 2, 33: 1, 40: 1, 11: 5, 12: 1, 24: 1}
OK	113426-22-5	CCCCCC(=CC)C	{1: 3, 2: 4, 6: 1, 7: 1}
OK	1135-66-6	CC1(CCC=C2C13CCC(C3)C2(C)C)C	{1: 4, 11: 5, 12: 1, 13: 3, 14: 1, 15: 1}
OK	113531-94-5	CC1C(COC1O)C(=O)C	{1: 2, 11: 1, 12: 3, 20: 1, 23: 1, 24: 1}
OK	113611-45-3	CCCC(CCCO)O	{1: 1, 2: 5, 3: 1, 20: 2}
OK	113613-35-7	CC(=O)C(C)(C)I	{24: 1, 1: 3, 19: 1, 4: 1}
OK	113664-29-2	CCSC/C=C/C	{40: 1, 1: 2, 2: 2, 6: 2}
OK	113976-92-4	CCCCCCCCCCCCS.CC(=C)C(=O)O.CC(=C)C(=O)OC	{1: 4, 2: 11, 5: 2, 7: 2, 39: 1, 27: 1, 28: 1}
OK	114-07-8	CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O	{1: 13, 2: 1, 33: 1, 11: 3, 12: 15, 13: 3, 20: 5, 22: 3, 23: 2, 25: 1, 28: 1}
OK	114-90-9	C1=CN(C=CC1=C[NH+]=O)COCN2C=CC(=C[NH+]=O)C=C2.[Cl-].[Cl-]	{33: 2, 2: 2, 6: 2, 14: 8, 15: 2, 17: 2, 22: 1, 29: 2, 31: 2}
OK	114119-97-0	CC(CCC(C)C=O)CC(C)(C)C	{1: 5, 2: 3, 3: 2, 4: 1, 26: 1}
OK	114136-87-7	CC(C)(CNCCCCCCNCC(C)(C)[N+](=O)[O-])[N+](=O)[O-]	{1: 4, 2: 8, 4: 2, 38: 2, 31: 2}
OK	1142-70-7	CCC(C)C1(C(=O)NC(=O)NC1=O)CC(=C)Br	{32: 2, 1: 2, 2: 2, 3: 1, 5: 1, 7: 1, 13: 1, 18: 1, 25: 3}
OK	1142-85-4	CC1=CCC(CC1)C(C)(C)OC(=O)CC(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 28: 1}
OK	114232-59-6	CCSC(=C)C(C)C	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1, 40: 1}
OK	114232-60-9	CCC(=C)SCC	{40: 1, 1: 2, 2: 2, 5: 1, 7: 1}
OK	1144-50-9	CC1CCC(C(C1)OC(=O)CC(=O)C)C(C)C	{1: 4, 2: 1, 3: 1, 11: 3, 12: 3, 24: 1, 28: 1}
OK	114535-81-8	CCOC(=O)C=C.CC(=C)C(=O)NCCCN(C)C.CC(=C)C(=O)OC	{1: 6, 2: 4, 5: 3, 6: 1, 7: 2, 24: 1, 33: 1, 28: 2, 31: 1}
OK	114546-62-2	C1CC1C#CC#CC2CC2	{10: 4, 11: 4, 12: 2}
OK	114650-76-9	CC(=O)OC=C.C=CN1CCCCCC1=O.C=CN1CCCC1=O	{1: 1, 5: 3, 6: 3, 33: 2, 11: 8, 25: 2, 28: 1}
OK	114651-37-5	C=COCC1CCC(CC1)CO	{2: 2, 5: 1, 6: 1, 11: 4, 12: 2, 20: 1, 22: 1}
OK	114679-28-6	CCCCCCCCCCCCNCCNC1CC(N(C(C1)(C)C)C(=O)O)(C)C	{1: 5, 2: 13, 33: 1, 11: 2, 12: 1, 13: 2, 27: 1, 31: 2}
OK	114718-69-3	CC1C2CCC(C1C#N)C=C2	{1: 1, 11: 2, 12: 4, 37: 1, 14: 2}
OK	114811-33-5	CCOCCSCCCl	{40: 1, 1: 1, 2: 5, 22: 1, 17: 1}
OK	114811-37-9	C=CSCCSCCO	{40: 2, 2: 4, 20: 1, 5: 1, 6: 1}
OK	114838-32-3	C(CCCCO)CCCC(CBr)Br	{2: 9, 3: 1, 20: 1, 18: 2}
OK	1149-99-1	CC1=C2C(C(C=C2C(=O)C(C13CC3)(C)O)(C)CO)O	{1: 3, 2: 1, 11: 2, 12: 1, 13: 3, 14: 1, 15: 3, 20: 3, 25: 1}
OK	114910-05-3	CCOC(=O)C=C.CCl.C(CN)N	{1: 2, 2: 3, 5: 1, 6: 1, 17: 1, 28: 1, 30: 2}
OK	115-07-1	CC=C	{1: 1, 5: 1, 6: 1}
OK	115-10-6	COC	{1: 2, 22: 1}
OK	115-11-7	CC(=C)C	{1: 2, 5: 1, 7: 1}
OK	115-17-3	C(=O)C(Br)(Br)Br	{18: 3, 4: 1, 26: 1}
OK	115-18-4	CC(C)(C=C)O	{1: 2, 4: 1, 5: 1, 6: 1, 20: 1}
OK	115-19-5	CC(C)(C#C)O	{1: 2, 10: 1, 4: 1, 20: 1, 9: 1}
OK	115-20-8	C(C(Cl)(Cl)Cl)O	{17: 3, 2: 1, 4: 1, 20: 1}
OK	115-22-0	CC(=O)C(C)(C)O	{24: 1, 1: 3, 4: 1, 20: 1}
OK	115-25-3	C1(C(C(C1(F)F)(F)F)(F)F)(F)F	{16: 8, 13: 4}
OK	115-28-6	C1(C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C(=O)O	{17: 6, 27: 2, 12: 2, 13: 3, 15: 2}
OK	115-31-1	CC1(C2CCC1(C(C2)OC(=O)CSC#N)C)C	{1: 3, 2: 1, 37: 1, 40: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	115-44-6	CCC(C)C1(C(=O)NC(=O)NC1=O)CC=C	{32: 2, 1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 13: 1, 25: 3}
OK	115-58-2	CCCCCC1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 2, 2: 5, 13: 1, 25: 3}
OK	115-61-7	CC1=C(C[C@H](CC1)O)/C=C/C2=CCC[C@]3([C@H]2CC[C@@H]3[C@H](C)/C=C/[C@H](C)C(C)C)C	{1: 6, 3: 3, 6: 4, 11: 7, 12: 3, 13: 1, 14: 1, 15: 3, 20: 1}
OK	115-67-3	CCC1(C(=O)N(C(=O)O1)C)C	{1: 3, 2: 1, 33: 1, 13: 1, 25: 1, 28: 1}
OK	115-69-5	CC(CO)(CO)N	{1: 1, 2: 2, 4: 1, 30: 1, 20: 2}
OK	115-70-8	CCC(CO)(CO)N	{1: 1, 2: 3, 4: 1, 30: 1, 20: 2}
OK	115-71-9	CC(=CCCC1(C2CC3C1(C3C2)C)C)CO	{1: 3, 2: 3, 6: 1, 7: 1, 11: 2, 12: 3, 13: 2, 20: 1}
OK	115-76-4	CCC(CC)(CO)CO	{1: 2, 2: 4, 4: 1, 20: 2}
OK	115-77-5	C(C(CO)(CO)CO)O	{20: 4, 2: 4, 4: 1}
OK	115-80-0	CCC(OCC)(OCC)OCC	{1: 4, 2: 4, 4: 1, 22: 3}
OK	115-84-4	CCCCC(CC)(CO)CO	{1: 2, 2: 6, 4: 1, 20: 2}
OK	115-95-7	CC(=CCCC(C)(C=C)OC(=O)C)C	{1: 4, 2: 2, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	115014-77-2	C1CC[C@@H]([C@@H](C1)C(=O)N)N	{24: 1, 11: 4, 12: 2, 30: 2}
OK	115035-54-6	CC(CO)O.C(CCCCC(=O)O)CCCC(=O)O.C(CCC(=O)O)CC(=O)O	{27: 4, 1: 1, 2: 13, 3: 1, 20: 2}
OK	115186-37-3	CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N(C)OC	{1: 5, 4: 1, 33: 2, 11: 3, 12: 1, 22: 1, 24: 1, 28: 1}
OK	115227-74-2	C1CC#CCSCC#CC1	{41: 1, 10: 4, 11: 5}
OK	115235-63-7	CC(C)CCCCCOC(=O)C=C.C=CC(=O)N.C=CN1CCCC1=O	{1: 2, 2: 5, 3: 1, 5: 3, 6: 3, 33: 1, 11: 3, 24: 1, 25: 1, 28: 1, 30: 1}
OK	115245-14-2	C1CCC2C3C=CC=CC2C3C1	{11: 4, 12: 4, 14: 4}
OK	115365-42-9	CCCCCCCCCCCCCCCC(=O)OCC(CCCCCCCCC=CCCCCCCCC)CCCCCCC=CCCCCCCCC	{1: 3, 2: 43, 3: 1, 28: 1, 6: 4}
OK	115365-43-0	CCCCCCCCCCCCCCCCCC(=O)OCC(CCCCCCCCC=CCCCCCCCC)CCCCCCC=CCCCCCCCC	{1: 3, 2: 45, 3: 1, 28: 1, 6: 4}
OK	115395-16-9	CC(CC(=O)O)S	{27: 1, 1: 1, 2: 1, 3: 1, 39: 1}
OK	115440-60-3	C[C@]12CCCC([C@@H]3[C@H]1CC4C3C24C)(C)C	{1: 4, 11: 4, 12: 4, 13: 3}
OK	115457-83-5	CCCCCCCNC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC)O)O)O	{1: 2, 2: 7, 12: 5, 20: 3, 22: 1, 23: 1, 28: 1, 31: 1}
OK	1155-74-4	CCCCCCCCCCCCCC[N+]1=CC=CC=C1.[Br-]	{1: 1, 2: 13, 18: 1, 14: 5, 33: 1}
OK	115524-22-6	C1=C(C(C(C(=C1)Br)O)O)C(=O)O	{12: 2, 14: 2, 15: 2, 18: 1, 20: 2, 27: 1}
OK	115566-02-4	C/C=C\C(=O)CC1CCC(C(O1)CC(=O)NCC(C(C)C(=O)NCCCC2C(CCC3(O2)CCCC(O3)CCC(C)/C=C(\C)/C(C)O)C)O)C	{1: 7, 2: 8, 3: 4, 6: 3, 7: 1, 11: 7, 12: 6, 13: 1, 20: 2, 23: 3, 24: 3, 31: 2}
OK	115724-27-1	CC1CCC(C(C1)C(C)(C)C)OC(=O)C	{1: 5, 11: 3, 4: 1, 12: 3, 28: 1}
OK	115936-72-6	CC1CCC(C(C1)OC(=O)CCC(=O)OC2CC(CCC2C(C)C)C)C(C)C	{1: 6, 2: 2, 3: 2, 11: 6, 12: 6, 28: 2}
OK	115984-51-5	C[C@@H](CCCCCCCOC(=O)CCCCC(=O)O[C@@H]([C@@H]([C@@H]([C@@H](C)O)O)O)O)CO	{1: 2, 2: 12, 3: 5, 20: 5, 28: 2}
OK	116-02-9	CC1CC(CC(C1)(C)C)O	{1: 3, 11: 3, 12: 2, 13: 1, 20: 1}
OK	116-04-1	C/C/1=C/CC(/C=C/CC(=C)CCC1)(C)C	{1: 3, 5: 1, 11: 5, 13: 1, 14: 3, 15: 2}
OK	116-06-3	CC(C)(C=NOC(=O)NC)SC	{1: 4, 34: 1, 4: 1, 6: 1, 40: 1, 28: 1, 31: 1}
OK	116-09-6	CC(=O)CO	{24: 1, 1: 1, 2: 1, 20: 1}
OK	116-11-0	CC(=C)OC	{1: 2, 5: 1, 22: 1, 7: 1}
OK	116-14-3	C(=C(F)F)(F)F	{16: 4, 7: 2}
OK	116-15-4	C(=C(F)F)(C(F)(F)F)F	{16: 6, 4: 1, 7: 2}
OK	116-16-5	C(=O)(C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{24: 1, 17: 6, 4: 2}
OK	116-22-3	CC(C)C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)OCCOCCOC(=O)C4(CCCC5(C4CCC6=CC(CCC65)C(C)C)C)C)C	{1: 8, 2: 4, 3: 2, 11: 14, 12: 6, 13: 4, 14: 2, 15: 2, 22: 1, 28: 2}
OK	116-26-7	CC1=C(C(CC=C1)(C)C)C=O	{1: 3, 11: 1, 13: 1, 14: 2, 15: 2, 26: 1}
OK	116-31-4	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=O)/C)/C	{1: 5, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 26: 1}
OK	116-52-9	C(C(Cl)(Cl)Cl)(NC(=O)NC(C(Cl)(Cl)Cl)O)O	{3: 2, 4: 2, 17: 6, 20: 2, 24: 1, 31: 2}
OK	116-53-0	CCC(C)C(=O)O	{27: 1, 1: 2, 2: 1, 3: 1}
OK	116-54-1	COC(=O)C(Cl)Cl	{1: 1, 3: 1, 28: 1, 17: 2}
OK	116-58-5	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4([C@@H](CO)O)O)C)O	{1: 2, 2: 1, 3: 1, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 4, 25: 1}
OK	116112-94-8	CCCCCCCCCC1NCCS1	{32: 1, 1: 1, 2: 8, 41: 1, 11: 2, 12: 1}
OK	116149-14-5	CCCCN(C)N(C)CCCC	{1: 4, 2: 6, 33: 2}
OK	116164-74-0	CCC(O)OCC	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	1162-53-4	CC(=O)C1=CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 3, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 20: 1, 24: 1}
OK	116230-20-7	C1CC2CC1CN2CCOCCO	{33: 1, 2: 4, 11: 4, 12: 2, 20: 1, 22: 1}
OK	116279-08-4	C#CCC1CCCC1	{9: 1, 2: 1, 11: 4, 12: 1, 10: 1}
OK	116316-76-8	CC#CC#CC1CC1	{1: 1, 10: 4, 11: 2, 12: 1}
OK	116355-83-0	CCCCC(C)C(C(CC(C)CC(CCCCC(CC(C(C)N)O)O)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O	{1: 4, 2: 14, 3: 10, 20: 3, 27: 4, 28: 2, 30: 1}
OK	116355-84-1	CCCCC(C)C(C(CC(C)CCCCCCC(CC(C(C)N)O)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O	{1: 4, 2: 15, 3: 9, 20: 2, 27: 4, 28: 2, 30: 1}
OK	116373-84-3	C1CC(CC2C1CCC2C(=O)CCl)O	{2: 1, 11: 5, 12: 4, 17: 1, 20: 1, 24: 1}
OK	116377-11-8	C=CCC=C=C	{8: 1, 2: 1, 5: 2, 6: 2}
OK	1164-91-6	CC(=O)OC1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C	{1: 3, 11: 9, 12: 5, 13: 2, 25: 1, 28: 1}
OK	1164-99-4	CC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C(C(=O)CC[C@H]34)Cl)C	{1: 2, 11: 8, 12: 5, 13: 1, 15: 2, 17: 1, 25: 1, 28: 1}
OK	116422-39-0	C[C@@H](CO)OC	{1: 2, 2: 1, 3: 1, 20: 1, 22: 1}
OK	116503-39-0	CC(C)(C)C#CC(C)(C)C#CC(C)(C)C	{1: 8, 10: 4, 4: 3}
OK	116529-73-8	C(C#CCI)I	{2: 2, 19: 2, 10: 2}
OK	116557-25-6	CCCCC(C(C)C)N	{1: 3, 2: 3, 3: 2, 30: 1}
OK	116595-45-0	CC=C(C)C=CCC(C)C	{1: 4, 2: 1, 3: 1, 6: 3, 7: 1}
OK	116619-64-8	CCCCCCCCCCCC[C@@H]1CO1	{1: 1, 2: 11, 11: 1, 12: 1, 23: 1}
OK	116632-47-4	CCCC1CCNC1	{32: 1, 1: 1, 2: 2, 11: 3, 12: 1}
OK	116668-48-5	CCC(=CCC=C(C)C)C	{1: 4, 2: 2, 6: 2, 7: 2}
OK	116668-49-6	CC=C(C)CCC(=CC)C	{1: 4, 2: 2, 6: 2, 7: 2}
OK	116723-93-4	CC=C(CO)Cl	{1: 1, 2: 1, 6: 1, 7: 1, 17: 1, 20: 1}
OK	116747-79-6	C(CC(CCCO)(CCCO)N)CO	{20: 3, 2: 9, 4: 1, 30: 1}
OK	116867-32-4	C(C(C(F)(F)Cl)(Cl)Cl)(Cl)Cl	{16: 2, 17: 5, 3: 1, 4: 2}
OK	116910-11-3	CC(C)[C@H]1CO[C@]2(N1C(=O)C=C2)C	{1: 3, 3: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 2, 23: 1, 25: 1}
OK	116964-02-4	CO[C@H]1CC[C@H]2CCN3[C@]2(C1)C4=C(CC3)COC(=O)C4	{1: 1, 33: 1, 11: 9, 12: 2, 13: 1, 15: 2, 22: 1, 28: 1}
OK	117066-76-9	CC(C)[C@@H]1CC[C@@](C=C1)(C)O	{1: 3, 3: 1, 11: 2, 12: 1, 13: 1, 14: 2, 20: 1}
OK	117197-08-7	CCCCCCCCCOC(=O)CCCC	{1: 2, 2: 11, 28: 1}
OK	1172-82-3	CC1CC2C(CCC3(C2CCC3(C(=O)C)OC(=O)C)C)C4(C1=CC(=O)CC4)C	{1: 5, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 24: 1, 25: 1, 28: 1}
OK	1173-13-3	CC1=C(C[C@H](CC1)O)/C=C\C2=CCC[C@]3([C@H]2CC[C@@H]3[C@H](C)CCCC(C)C)C	{1: 5, 2: 3, 3: 2, 6: 2, 11: 7, 12: 3, 13: 1, 14: 1, 15: 3, 20: 1}
OK	1173-26-8	CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C	{1: 3, 2: 1, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 24: 1, 25: 1, 28: 1}
OK	117356-23-7	COC(=O)C(C(C(=O)OC)O)O	{1: 2, 3: 2, 20: 2, 28: 2}
OK	1174-92-1	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC)C)C	{1: 6, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 22: 1}
OK	1175-06-0	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(=O)[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 6, 13: 2, 20: 1, 25: 1}
OK	117574-21-7	C1C2CC(C1CO)C3C2C4CC3C=C4	{20: 1, 2: 1, 11: 3, 12: 7, 14: 2}
OK	1177-87-3	CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C)O)C)O)F)C	{1: 4, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	117823-31-1	C(=O)/C(=C(\C(=O)O)/Cl)/C(Cl)Cl	{27: 1, 17: 3, 26: 1, 3: 1, 7: 2}
OK	118-52-5	CC1(C(=O)N(C(=O)N1Cl)Cl)C	{1: 2, 33: 2, 25: 2, 13: 1, 17: 2}
OK	118-65-0	C/C/1=C/CCC(=C)[C@H]2CC([C@@H]2CC1)(C)C	{1: 3, 5: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 2}
OK	118-75-2	C1(=C(C(=O)C(=C(C1=O)Cl)Cl)Cl)Cl	{17: 4, 25: 2, 15: 4}
OK	118-78-5	C1(C(=O)NC(=O)NC1=O)N	{32: 2, 25: 3, 12: 1, 30: 1}
OK	118129-39-8	CCC(C)(C)OOC(C)(CC)OOC(C)(C)CC	{1: 8, 2: 3, 4: 3, 22: 4}
OK	1182-07-6	CCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 8, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	1182-42-9	CCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 9, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	1182-66-7	CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 10, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	1182-87-2	C[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C=O)O)OC)O	{1: 3, 11: 10, 12: 10, 13: 3, 14: 1, 15: 1, 20: 3, 22: 2, 23: 1, 26: 1, 28: 1}
OK	118276-84-9	CCCCOC(=O)C=C.CC(=C)C(=O)OC.C=CC(=O)OCCO.C(CCC(=O)O)CCO	{1: 3, 2: 10, 5: 3, 6: 2, 7: 1, 20: 2, 27: 1, 28: 3}
OK	1183-04-6	CCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H](C3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 11, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	118354-84-0	CCCCCC(C1C(O1)C=O)O	{1: 1, 2: 4, 3: 1, 12: 2, 20: 1, 23: 1, 26: 1}
OK	118359-59-4	CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)OC)N4)NCCSSCCNC(=O)CC[C@@H](C(=O)O)N	{32: 1, 1: 2, 2: 7, 3: 1, 33: 1, 40: 2, 11: 1, 12: 3, 13: 1, 15: 4, 22: 1, 24: 1, 25: 2, 27: 1, 28: 1, 30: 2, 31: 2}
OK	1184-05-0	CCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 19, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	1184-60-7	CC(=C)F	{16: 1, 1: 1, 5: 1, 7: 1}
OK	1184-76-5	C(F)(F)(I)I	{16: 2, 19: 2, 4: 1}
OK	118400-71-8	CC(C(C(CCSSCCC(C(C(C)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 12, 1: 2, 2: 4, 4: 6, 40: 2}
OK	118436-67-2	C1(=NS[S]=N1)Cl	{17: 1, 35: 2, 41: 2, 15: 1}
OK	118436-69-4	C1(=NC(=N[S]=N1)Cl)Cl	{17: 2, 35: 3, 41: 1, 15: 2}
OK	118436-71-8	C1(=NSS[N]1)C(F)(F)F	{16: 3, 41: 2, 35: 2, 4: 1, 15: 1}
OK	118436-72-9	C1(=NC(=NS[N]1)C(F)(F)F)C(F)(F)F	{16: 6, 41: 1, 35: 3, 4: 2, 15: 2}
OK	118496-02-9	CCCCCC=CCC=CCCCO	{1: 1, 2: 8, 20: 1, 6: 4}
OK	1185-02-0	CCC(C)(C(C)(CC)O)O	{1: 4, 2: 2, 4: 2, 20: 2}
OK	1185-09-7	C(C(SCl)(Cl)Cl)(Cl)Cl	{40: 1, 17: 5, 3: 1, 4: 1}
OK	1185-11-1	C([N+](=O)[O-])([N+](=O)[O-])(F)F	{16: 2, 4: 1, 38: 2}
OK	1185-33-7	CCC(C)(C)CO	{1: 3, 2: 2, 4: 1, 20: 1}
OK	1185-34-8	CC(C)(C=O)C=O	{1: 2, 26: 2, 4: 1}
OK	1185-39-3	CCCC(C)(C)C(=O)O	{1: 3, 2: 2, 27: 1, 4: 1}
OK	118528-85-1	CSC(=O)CC(=O)C(F)(F)F	{1: 1, 2: 1, 4: 1, 40: 1, 16: 3, 24: 2}
OK	118562-73-5	CC(CO)C1CCCCCCCCCCC1	{1: 1, 2: 1, 3: 1, 11: 11, 12: 1, 20: 1}
OK	1186-31-8	CCCC(C)(CC=C)O	{1: 2, 2: 3, 4: 1, 5: 1, 6: 1, 20: 1}
OK	1186-47-6	CC(=O)C(O)O	{24: 1, 1: 1, 3: 1, 20: 2}
OK	1186-53-4	CC(C)C(C)C(C)(C)C	{1: 6, 3: 2, 4: 1}
OK	1186-73-8	COC(=O)C(C(=O)OC)C(=O)OC	{1: 3, 3: 1, 28: 3}
OK	1186-79-4	CCC(C(CC)C(=O)O)C(=O)O	{27: 2, 1: 2, 2: 2, 3: 2}
OK	1186-98-7	COC(=O)C(C(C(=O)OC)Br)Br	{1: 2, 18: 2, 3: 2, 28: 2}
OK	118620-89-6	C#CC(CO)O	{9: 1, 2: 1, 3: 1, 20: 2, 10: 1}
OK	1187-03-7	CCN(CC)C(=O)N(CC)CC	{24: 1, 1: 4, 2: 4, 33: 2}
OK	1187-13-9	CC/C(=C\C)/C(=O)O	{1: 2, 2: 1, 27: 1, 6: 1, 7: 1}
OK	1187-33-3	CCCCN(CCCC)C(=O)CC	{24: 1, 1: 3, 2: 7, 33: 1}
OK	1187-42-4	C(#N)/C(=C(\C#N)/N)/N	{37: 2, 30: 2, 7: 2}
OK	1187-46-8	CCOC(=O)C(C#N)Br	{1: 1, 2: 1, 3: 1, 37: 1, 18: 1, 28: 1}
OK	1187-50-4	CC(C)C[C@@H](C(=O)NCC(=O)NCC(=O)O)N	{1: 2, 2: 3, 3: 2, 24: 2, 27: 1, 30: 1, 31: 2}
OK	1187-58-2	CCC(=O)NC	{24: 1, 1: 2, 2: 1, 31: 1}
OK	1187-59-3	CNC(=O)C=C	{24: 1, 1: 1, 5: 1, 6: 1, 31: 1}
OK	1187-84-4	CSC[C@@H](C(=O)O)N	{1: 1, 2: 1, 3: 1, 40: 1, 27: 1, 30: 1}
OK	1187-93-5	C(=C(F)F)(OC(F)(F)F)F	{16: 6, 4: 1, 22: 1, 7: 2}
OK	1188-01-8	CC(C(=O)NCC(=O)O)N	{1: 1, 2: 1, 3: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	1188-02-9	CCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 4, 3: 1}
OK	1188-21-2	CC(C)C[C@@H](C(=O)O)NC(=O)C	{1: 3, 2: 1, 3: 2, 24: 1, 27: 1, 31: 1}
OK	1188-33-6	CCOC(N(C)C)OCC	{1: 4, 2: 2, 3: 1, 22: 2, 33: 1}
OK	1188-37-0	CC(=O)N[C@@H](CCC(=O)O)C(=O)O	{1: 1, 2: 2, 3: 1, 24: 1, 27: 2, 31: 1}
OK	1188-58-5	CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 3: 1, 20: 1, 28: 2}
OK	1189-09-9	CC(=CCCC(=CC(=O)OC)C)C	{1: 4, 2: 2, 28: 1, 6: 2, 7: 2}
OK	1189-99-7	CCC(C)(C)CCC(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	119-04-0	C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N)O[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O[C@@H]4[C@@H]([C@H]([C@@H]([C@@H](O4)CN)O)O)N)O)O)N	{2: 3, 11: 1, 12: 19, 20: 7, 22: 3, 23: 3, 30: 6}
OK	119-48-2	CCCCN(CCN(CCCC)C(=O)N1CCOCC1)C(=O)N2CCOCC2	{1: 2, 2: 8, 33: 4, 11: 8, 23: 2, 24: 2}
OK	119-60-8	C1CCC(CC1)C(=O)C2CCCCC2	{24: 1, 11: 10, 12: 2}
OK	1190-22-3	CC(CCCl)Cl	{1: 1, 2: 2, 3: 1, 17: 2}
OK	1190-24-5	C(=O)NC(=O)N	{24: 1, 26: 1, 30: 1, 31: 1}
OK	1190-39-2	CCCCOC(=O)CC(=O)OCCCC	{1: 2, 2: 7, 28: 2}
OK	1190-63-2	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCC	{1: 2, 2: 31, 28: 1}
OK	1190-73-4	CC(=O)NCCS	{24: 1, 1: 1, 2: 2, 39: 1, 31: 1}
OK	1190-76-7	C/C=C\C#N	{1: 1, 37: 1, 6: 2}
OK	1190-79-0	CCN=CC	{1: 2, 2: 1, 34: 1, 6: 1}
OK	1190-83-6	CC(C)CCCC(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	1190-92-7	CN(C)C=C[N+](=O)[O-]	{1: 2, 38: 1, 6: 2, 33: 1}
OK	1190-93-8	CC(=O)SCC(=O)O	{24: 1, 1: 1, 2: 1, 27: 1, 40: 1}
OK	1191-04-4	CCCC=CC(=O)O	{1: 1, 2: 2, 27: 1, 6: 2}
OK	1191-08-8	C(CCS)CS	{2: 4, 39: 2}
OK	1191-16-8	CC(=CCOC(=O)C)C	{1: 3, 2: 1, 28: 1, 6: 1, 7: 1}
OK	1191-25-9	C(CCC(=O)O)CCO	{2: 5, 27: 1, 20: 1}
OK	1191-41-9	CCC=CCC=CCC=CCCCCCCCC(=O)OCC	{1: 2, 2: 11, 28: 1, 6: 6}
OK	1191-43-1	C(CCCS)CCS	{2: 6, 39: 2}
OK	1191-45-3	CCCCCCCCCCNCC(CO)O	{1: 1, 2: 11, 3: 1, 20: 2, 31: 1}
OK	1191-62-4	C(CCCCS)CCCS	{2: 8, 39: 2}
OK	1191-67-9	C(CCCCCS)CCCCS	{2: 10, 39: 2}
OK	1191-75-9	CCCCCCCCC=CCCCCCC(=O)O	{1: 1, 2: 12, 27: 1, 6: 2}
OK	1191-87-3	COCCOCCOCCOCCOCCOC	{1: 2, 2: 10, 22: 6}
OK	1191-95-3	C1CC(=O)C1	{25: 1, 11: 3}
OK	1191-96-4	CCC1CC1	{1: 1, 2: 1, 11: 2, 12: 1}
OK	1191-99-7	C1COC=C1	{11: 2, 14: 2, 23: 1}
OK	119152-81-7	CCSC(=O)CSC	{24: 1, 1: 2, 2: 2, 40: 2}
OK	1192-17-2	CCC1(CO1)CC	{1: 2, 2: 2, 11: 1, 13: 1, 23: 1}
OK	1192-18-3	C[C@@H]1CCC[C@@H]1C	{1: 2, 11: 3, 12: 2}
OK	1192-22-9	CCC1C(O1)(C)C	{1: 3, 2: 1, 12: 1, 13: 1, 23: 1}
OK	1192-28-5	C1CCC(=NO)C1	{34: 1, 11: 4, 20: 1, 15: 1}
OK	1192-30-9	C1CC(OC1)CBr	{2: 1, 11: 3, 12: 1, 18: 1, 23: 1}
OK	1192-37-6	C=C1CCCCC1	{11: 5, 5: 1, 15: 1}
OK	1192-63-8	C1CCN(C1)C(=O)Cl	{24: 1, 17: 1, 11: 4, 33: 1}
OK	1192-75-2	C1CN1C(=O)N2CC2	{24: 1, 33: 2, 11: 4}
OK	1192-88-7	C1CCC(=CC1)C=O	{26: 1, 11: 4, 14: 1, 15: 1}
OK	119245-03-3	CCCCCCC(=O)OC(C)CC	{1: 3, 2: 6, 3: 1, 28: 1}
OK	1193-11-9	CC1COC(O1)(C)C	{1: 3, 11: 1, 12: 1, 13: 1, 23: 2}
OK	1193-12-0	CC1(CCCNC1)C	{32: 1, 1: 2, 11: 4, 13: 1}
OK	1193-18-6	CC1=CC(=O)CCC1	{1: 1, 11: 3, 25: 1, 14: 1, 15: 1}
OK	1193-46-0	CC1(CCCCC1O)C	{1: 2, 11: 4, 12: 1, 13: 1, 20: 1}
OK	1193-47-1	CC1(CCCCC1=O)C	{1: 2, 11: 4, 13: 1, 25: 1}
OK	1193-54-0	C1(=C(C(=O)NC1=O)Cl)Cl	{32: 1, 17: 2, 25: 2, 15: 2}
OK	1193-55-1	CC1C(=O)CCCC1=O	{1: 1, 11: 3, 12: 1, 25: 2}
OK	1193-65-3	C1CN2CCC1C(=O)C2.Cl	{17: 1, 11: 5, 12: 1, 33: 1, 25: 1}
OK	1193-70-0	CCCC1CCCC1=O	{1: 1, 2: 2, 11: 3, 12: 1, 25: 1}
OK	1193-81-3	CC(C1CCCCC1)O	{11: 5, 1: 1, 3: 1, 12: 1, 20: 1}
OK	119322-88-2	CC1(O[C@H]([C@@H](O1)CN)CN)C	{1: 2, 2: 2, 12: 2, 13: 1, 23: 2, 30: 2}
OK	119422-08-1	CCNCCCCNCCCCNCCCCNCC	{1: 2, 2: 14, 31: 4}
OK	119437-63-7	C(O[O])F	{16: 1, 2: 1, 29: 1, 22: 1}
OK	119450-45-2	CCCCCCCCCCCCC(C=O)(Cl)Cl	{1: 1, 2: 11, 4: 1, 26: 1, 17: 2}
OK	1195-16-0	CC(=O)NC1CCSC1=O	{1: 1, 41: 1, 11: 2, 12: 1, 24: 1, 25: 1, 31: 1}
OK	1195-42-2	CC(C)NC1CCCCC1	{11: 5, 1: 2, 3: 1, 12: 1, 31: 1}
OK	1195-79-5	CC1(C2CCC(C2)(C1=O)C)C	{1: 3, 11: 3, 12: 1, 13: 2, 25: 1}
OK	1195-91-1	CC1(CC(=O)C(C(=O)C1)Br)C	{1: 2, 11: 2, 12: 1, 13: 1, 18: 1, 25: 2}
OK	1195-92-2	CC(=C)C1CCC2(C(C1)O2)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 2, 13: 1, 23: 1}
OK	1195-93-3	CC1(CCCC(C1=O)(C)C)C	{1: 4, 11: 3, 13: 2, 25: 1}
OK	119515-38-7	CCC(C)OC(=O)N1CCCCC1CCO	{1: 2, 2: 3, 3: 1, 33: 1, 11: 4, 12: 1, 20: 1, 28: 1}
OK	119530-69-7	CCCCCCCCCCCCOC(=O)CCNC1CC(NC(C1)(C)C)(C)C	{32: 1, 1: 5, 2: 13, 11: 2, 12: 1, 13: 2, 28: 1, 31: 1}
OK	119530-70-0	CCCCCCCCCCCCCCOC(=O)CCNC1CC(NC(C1)(C)C)(C)C	{32: 1, 1: 5, 2: 15, 11: 2, 12: 1, 13: 2, 28: 1, 31: 1}
OK	119546-31-5	CC(=C)C(=O)OCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 10, 28: 2, 5: 2, 7: 2}
OK	1196-31-2	C[C@@H]1CC[C@@H](C(=O)C1)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2, 25: 1}
OK	1196-55-0	C1CCC2=CC(=O)CCC2C1	{25: 1, 11: 6, 12: 1, 14: 1, 15: 1}
OK	1196-95-8	C1CCCC2C(C2(Br)Br)CC1	{18: 2, 11: 6, 12: 2, 13: 1}
OK	119691-49-5	CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)CO	{1: 2, 2: 31, 3: 1, 20: 1}
OK	1197-06-4	CC1=CC[C@H](C[C@H]1O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 1}
OK	1197-18-8	C1CC(CCC1CN)C(=O)O	{27: 1, 2: 1, 11: 4, 12: 2, 30: 1}
OK	119820-21-2	C(=C=O)=C(F)F	{8: 2, 16: 2, 29: 1, 7: 1}
OK	119838-44-7	CC(C)(C)[C@@H]1N(C(=O)CN1C(=O)OC(C)(C)C)C	{1: 7, 4: 2, 33: 2, 11: 1, 12: 1, 25: 1, 28: 1}
OK	1199-87-7	CCCC(=O)NC1CCCCC1	{1: 1, 2: 2, 11: 5, 12: 1, 24: 1, 31: 1}
OK	120-29-6	CN1C2CCC1CC(C2)O	{1: 1, 11: 4, 12: 3, 20: 1, 33: 1}
OK	120-40-1	CCCCCCCCCCCC(=O)N(CCO)CCO	{24: 1, 1: 1, 2: 14, 20: 2, 33: 1}
OK	120-43-4	CCOC(=O)N1CCNCC1	{32: 1, 1: 1, 2: 1, 33: 1, 11: 4, 28: 1}
OK	120-70-7	C1=C/C(=C\NCCCN/C=C\2/C(=O)C=CC=C2)/C(=O)C=C1	{2: 3, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
OK	120-74-1	C1C2CC(C1C=C2)C(=O)O	{27: 1, 11: 2, 12: 3, 14: 2}
OK	120-85-4	CC1CN(CCN1C)C	{1: 3, 11: 3, 12: 1, 33: 2}
OK	120-87-6	CCCCCCCCC(C(CCCCCCCC(=O)O)O)O	{27: 1, 1: 1, 2: 14, 3: 2, 20: 2}
OK	120-89-8	C1(=O)C(=O)NC(=O)N1	{32: 2, 25: 3}
OK	120-92-3	C1CCC(=O)C1	{25: 1, 11: 4}
OK	120-93-4	C1CNC(=O)N1	{32: 2, 25: 1, 11: 2}
OK	120-94-5	CN1CCCC1	{1: 1, 11: 4, 33: 1}
OK	1200-89-1	C1C2C=CC1C3C2C(=O)C=CC3=O	{25: 2, 11: 1, 12: 4, 14: 4}
OK	12002-22-1	C=CCO[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)CO)O)O	{2: 4, 5: 1, 6: 1, 12: 8, 13: 1, 20: 7, 22: 2, 23: 2}
OK	12002-53-8	CC1CC(CCC1C(=O)OC(C)(C)C)Cl	{1: 4, 4: 1, 11: 3, 12: 3, 17: 1, 28: 1}
OK	12006-10-9	C[C@H](CCCC(C)C)[C@H]1C[C@H]([C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C=C4[C@@]3(CC[C@H](C4)O)C)OC(=O)C)COC(=O)C)OC(=O)C	{1: 7, 2: 4, 3: 2, 11: 6, 12: 7, 13: 2, 14: 1, 15: 1, 20: 1, 28: 3}
OK	120239-63-6	C(CCN(CCCN)CCCN)CN(CCCN)CCCN	{33: 2, 2: 16, 30: 4}
OK	12024-79-2	C[C@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CCC5C6=CC(=O)OC6)O)C)C)O)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)O	{1: 4, 2: 2, 11: 10, 12: 20, 13: 3, 14: 1, 15: 1, 20: 9, 22: 4, 23: 3, 28: 1}
OK	12029-85-5	CC(=C[C@@H](C(C1=CO[C@@H]([C@@H]2[C@@H]1CC[C@@]3(CO3)[C@@H]4[C@H](O4)C[C@@]25CO5)OC(=O)C)OC(=O)C)OC(=O)C)C	{1: 5, 3: 2, 6: 1, 7: 1, 11: 5, 12: 5, 13: 2, 14: 1, 15: 1, 23: 4, 28: 3}
OK	12029-98-0	O=I(=O)OI(=O)=O	{19: 2, 29: 4, 22: 1}
OK	1203-08-3	CC1=C(C(CC=C1)(C)C)C=CC(=O)C	{1: 4, 6: 2, 11: 1, 13: 1, 14: 2, 15: 2, 24: 1}
OK	12031-51-5	CC(=C[C@H](C(C1=CO[C@@H]([C@@H]2[C@@H]1CC[C@@]3(CO3)[C@@H]4[C@@H](O4)CC2=C)OC(=O)C)OC(=O)C)OC(=O)C)C	{1: 5, 3: 2, 5: 1, 6: 1, 7: 1, 11: 4, 12: 5, 13: 1, 14: 1, 15: 2, 23: 3, 28: 3}
OK	12032-05-2	CC[C@@H]1[C@@]([C@@H]([C@@H](C2=C(C[C@](O2)([C@H]([C@H]([C@H]([C@H](C(=O)O1)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)OC)C)O[C@H]4[C@@H]([C@H](C[C@H](O4)C)N(C)CC)O)C)C)C)O)(C)O	{1: 13, 2: 2, 33: 1, 11: 3, 12: 14, 13: 3, 15: 2, 20: 4, 22: 3, 23: 3, 28: 1}
OK	120373-24-2	CCCCCCCC(=O)CC[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)OC(C)C)O)O	{1: 3, 2: 12, 3: 1, 6: 2, 11: 1, 12: 4, 20: 2, 24: 1, 28: 1}
OK	12040-67-4	CCCCCCCCCCCCCCNCCO.CC(C(=O)O)O	{1: 2, 2: 15, 3: 1, 20: 2, 27: 1, 31: 1}
OK	120650-77-3	CCCCCCCCCCCCC#CC#CCCCCCCCCC(=O)OC	{1: 2, 2: 19, 28: 1, 10: 4}
OK	120850-92-2	C1CCC(CC1)C(C(C2CCCCC2)O)O	{11: 10, 20: 2, 3: 2, 12: 2}
OK	1209-71-8	CC1=C2C[C@@H](CC[C@]2(CCC1)C)C(C)(C)O	{1: 4, 4: 1, 11: 6, 12: 1, 13: 1, 15: 2, 20: 1}
OK	121-05-1	CC(C)N(CCN)C(C)C	{1: 4, 2: 2, 3: 2, 30: 1, 33: 1}
OK	121-21-1	CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C	{1: 5, 2: 1, 5: 1, 6: 4, 7: 1, 11: 1, 12: 3, 13: 1, 15: 2, 25: 1, 28: 1}
OK	121-29-9	CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C(=O)OC)CC=CC=C	{1: 5, 2: 1, 5: 1, 6: 4, 7: 1, 11: 1, 12: 3, 13: 1, 15: 2, 25: 1, 28: 2}
OK	121-44-8	CCN(CC)CC	{1: 3, 2: 3, 33: 1}
OK	121-46-0	C1C2C=CC1C=C2	{11: 1, 12: 2, 14: 4}
OK	121-82-4	C1N(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 3, 11: 3, 38: 3}
OK	121-93-7	CC(C)N(CCO)CCO	{1: 2, 2: 4, 3: 1, 20: 2, 33: 1}
OK	1211-29-6	CC/C=C\C[C@@H]1[C@H](CCC1=O)CC(=O)OC	{1: 2, 2: 3, 6: 2, 11: 2, 12: 2, 25: 1, 28: 1}
OK	121150-60-5	CC(=C)C(=O)OCCCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 12, 28: 2, 5: 2, 7: 2}
OK	121153-49-9	C1=C[C@@H]2[C@@H](O2)[C@H]([C@@H]1O)O	{20: 2, 12: 4, 14: 2, 23: 1}
OK	121222-72-8	CCC=CSC(C)C	{40: 1, 1: 3, 2: 1, 3: 1, 6: 2}
OK	121255-03-6	CC(C)NCCCC(C)CNC(C)C	{1: 5, 2: 4, 3: 3, 31: 2}
OK	12134-99-5	OI=O	{19: 1, 20: 1, 29: 1}
OK	121508-72-3	CN(C)C=NCC#C	{1: 2, 2: 1, 6: 1, 33: 1, 9: 1, 10: 1, 34: 1}
OK	121525-85-7	CC1CCC=NC1	{1: 1, 11: 3, 12: 1, 14: 1, 35: 1}
OK	121564-25-8	C#CSO	{40: 1, 9: 1, 10: 1, 20: 1}
OK	1216-40-6	CCCC(C)C1(C(=O)NC(=O)NC1=O)CC(=C)Br	{32: 2, 1: 2, 2: 3, 3: 1, 5: 1, 7: 1, 13: 1, 18: 1, 25: 3}
OK	121733-05-9	CC1C2C1C(=C)C2	{1: 1, 11: 1, 12: 3, 5: 1, 15: 1}
OK	121733-80-0	CCC(CO)OC(=O)C=C	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 20: 1, 28: 1}
OK	121790-34-9	CC(C)C.C=C.C=CC(=O)O	{27: 1, 1: 3, 3: 1, 5: 3, 6: 1}
OK	121877-65-4	CCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 40, 28: 1}
OK	121906-42-1	CCCCCOC[C@H]1CO1	{1: 1, 2: 5, 11: 1, 12: 1, 22: 1, 23: 1}
OK	121906-44-3	CCCCCCCOC[C@H]1CO1	{1: 1, 2: 7, 11: 1, 12: 1, 22: 1, 23: 1}
OK	121959-79-3	CCCCCC=C=CC(C)(C)C	{8: 1, 1: 4, 2: 4, 4: 1, 6: 2}
OK	122-07-6	CNCC(OC)OC	{1: 3, 2: 1, 3: 1, 22: 2, 31: 1}
OK	122-15-6	CC1(CC(=CC(=O)C1)OC(=O)N(C)C)C	{1: 4, 33: 1, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1, 28: 1}
OK	122-20-3	CC(CN(CC(C)O)CC(C)O)O	{1: 3, 2: 3, 3: 3, 20: 3, 33: 1}
OK	122-31-6	CCOC(CC(OCC)OCC)OCC	{1: 4, 2: 5, 3: 2, 22: 4}
OK	122-32-7	CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC	{1: 3, 2: 44, 3: 1, 28: 3, 6: 6}
OK	122-51-0	CCOC(OCC)OCC	{1: 3, 2: 3, 3: 1, 22: 3}
OK	122-62-3	CCCCC(CC)COC(=O)CCCCCCCCC(=O)OCC(CC)CCCC	{1: 4, 2: 18, 3: 2, 28: 2}
OK	122-96-3	C1CN(CCN1CCO)CCO	{33: 2, 2: 4, 11: 4, 20: 2}
OK	122035-71-6	CC1(CC(CC(N1)(C)C)NC(=O)C(=O)NN)C	{32: 1, 1: 4, 11: 2, 12: 1, 13: 2, 24: 2, 30: 1, 31: 2}
OK	122045-39-0	C[C@@H]1CO[C@H](O1)C(C)C	{11: 1, 1: 3, 3: 1, 12: 2, 23: 2}
OK	122130-63-6	C[C@H](CSN=O)C(=O)N1CCC[C@H]1C(=O)O	{1: 1, 2: 1, 3: 1, 33: 1, 40: 1, 11: 3, 12: 1, 34: 1, 24: 1, 27: 1, 29: 1}
OK	12228-50-1	CC1(CC2(CO1)[C@H]([C@@H](CO2)O)O)O	{1: 1, 11: 3, 12: 2, 13: 2, 20: 3, 23: 2}
OK	122385-15-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 31, 5: 1, 6: 1}
OK	1224-78-8	CC\1=CCCC(/C1=C\C=C(/C)\C=C\C=C(/C)\C=C)(C)C	{1: 5, 5: 1, 6: 6, 7: 2, 11: 2, 13: 1, 14: 1, 15: 2}
OK	122608-92-8	CCCCCCCCCCCOCC1CO1	{1: 1, 2: 11, 11: 1, 12: 1, 22: 1, 23: 1}
OK	122672-46-2	C1C[C@H]([C@H](C1)N)C(=O)O	{27: 1, 11: 3, 12: 2, 30: 1}
OK	1227-51-6	CCCCCCCCCCCCCC1CCCC(=O)O1	{1: 1, 2: 12, 11: 3, 12: 1, 28: 1}
OK	1229-12-5	C[C@]12CCC(=O)C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C	{1: 2, 11: 9, 12: 4, 13: 2, 25: 2}
OK	12292-23-8	CC1=C(C(=O)[C@H]2[C@@H](C1=O)O2)O	{1: 1, 12: 2, 15: 2, 20: 1, 23: 1, 25: 2}
OK	123-00-2	C1COCCN1CCCN	{33: 1, 2: 3, 11: 4, 30: 1, 23: 1}
OK	123-03-5	CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 15, 33: 1, 14: 5, 17: 1}
OK	123-04-6	CCCCC(CC)CCl	{1: 2, 2: 5, 3: 1, 17: 1}
OK	123-05-7	CCCCC(CC)C=O	{1: 2, 2: 4, 3: 1, 26: 1}
OK	123-06-8	CCOC=C(C#N)C#N	{1: 1, 2: 1, 37: 2, 6: 1, 7: 1, 22: 1}
OK	123-10-4	CCN(CC)CCN(C)C	{1: 4, 2: 4, 33: 2}
OK	123-12-6	CCN(CC)CCNCCN(CC)CC	{1: 4, 2: 8, 33: 2, 31: 1}
OK	123-15-9	CCCC(C)C=O	{1: 2, 2: 2, 3: 1, 26: 1}
OK	123-17-1	CC(C)CC(C)CC(CC(C)C)O	{1: 5, 2: 3, 3: 4, 20: 1}
OK	123-18-2	CC(C)CC(C)CC(=O)CC(C)C	{24: 1, 1: 5, 2: 3, 3: 3}
OK	123-19-3	CCCC(=O)CCC	{24: 1, 1: 2, 2: 4}
OK	123-20-6	CCCC(=O)OC=C	{1: 1, 2: 2, 28: 1, 5: 1, 6: 1}
OK	123-23-9	C(CC(=O)OOC(=O)CCC(=O)O)C(=O)O	{2: 4, 27: 2, 28: 2}
OK	123-24-0	CCCCC(CC)CCC(CCC(CC)CC)O	{1: 4, 2: 10, 3: 3, 20: 1}
OK	123-25-1	CCOC(=O)CCC(=O)OCC	{1: 2, 2: 4, 28: 2}
OK	123-28-4	CCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCC	{40: 1, 1: 2, 2: 26, 28: 2}
OK	123-29-5	CCCCCCCCC(=O)OCC	{1: 2, 2: 8, 28: 1}
OK	123-33-1	C1=CC(=O)NNC1=O	{32: 2, 25: 2, 14: 2}
OK	123-34-2	C=CCOCC(CO)O	{2: 3, 3: 1, 5: 1, 6: 1, 20: 2, 22: 1}
OK	123-35-3	CC(=CCCC(=C)C=C)C	{1: 2, 2: 2, 5: 2, 6: 2, 7: 2}
OK	123-36-4	CCCCCCCCC1C(O1)CCCCCCCC(=O)OCC=C	{1: 1, 2: 15, 5: 1, 6: 1, 12: 2, 23: 1, 28: 1}
OK	123-38-6	CCC=O	{1: 1, 2: 1, 26: 1}
OK	123-39-7	CNC=O	{1: 1, 26: 1, 31: 1}
OK	123-42-2	CC(=O)CC(C)(C)O	{24: 1, 1: 3, 2: 1, 4: 1, 20: 1}
OK	123-44-4	CC(C)CC(C)(C)CO	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	123-48-8	CC(=CC(C)(C)C)CC(C)(C)C	{1: 7, 2: 1, 4: 2, 6: 1, 7: 1}
OK	123-51-3	CC(C)CCO	{1: 2, 2: 2, 3: 1, 20: 1}
OK	123-54-6	CC(=O)CC(=O)C	{24: 2, 1: 2, 2: 1}
OK	123-56-8	C1CC(=O)NC1=O	{32: 1, 25: 2, 11: 2}
OK	123-57-9	CC1COCC(N1)C	{32: 1, 1: 2, 11: 2, 12: 2, 23: 1}
OK	123-63-7	CC1OC(OC(O1)C)C	{1: 3, 12: 3, 23: 3}
OK	123-66-0	CCCCCC(=O)OCC	{1: 2, 2: 5, 28: 1}
OK	123-67-1	CNCCCN(C)CCCN(C)CCCNC	{1: 4, 2: 9, 33: 2, 31: 2}
OK	123-68-2	CCCCCC(=O)OCC=C	{1: 1, 2: 5, 28: 1, 5: 1, 6: 1}
OK	123-69-3	C1CCCCOC(=O)CCCCCC=CCCC1	{11: 13, 28: 1, 14: 2}
OK	123-70-6	CNCCCN(C)CCCNC	{1: 3, 2: 6, 33: 1, 31: 2}
OK	123-72-8	CCCC=O	{1: 1, 2: 2, 26: 1}
OK	123-73-9	C/C=C/C=O	{1: 1, 26: 1, 6: 2}
OK	123-75-1	C1CCNC1	{32: 1, 11: 4}
OK	123-76-2	CC(=O)CCC(=O)O	{24: 1, 1: 1, 2: 2, 27: 1}
OK	123-77-3	C(=O)(N)/N=N/C(=O)N	{24: 2, 34: 2, 30: 2}
OK	123-78-4	CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)N)O	{1: 1, 2: 13, 3: 2, 6: 2, 20: 2, 30: 1}
OK	123-79-5	CCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC	{1: 2, 2: 18, 28: 2}
OK	123-80-8	CCC(=O)OCCOC(=O)CC	{1: 2, 2: 4, 28: 2}
OK	123-81-9	C(COC(=O)CS)OC(=O)CS	{2: 4, 28: 2, 39: 2}
OK	123-82-0	CCCCCC(C)N	{1: 2, 2: 4, 3: 1, 30: 1}
OK	123-83-1	CCNCCN(C)C	{1: 3, 2: 3, 33: 1, 31: 1}
OK	123-84-2	CC(CNCCN)O	{1: 1, 2: 3, 3: 1, 20: 1, 30: 1, 31: 1}
OK	123-85-3	C(COCC(=O)N)O	{24: 1, 2: 3, 20: 1, 30: 1, 22: 1}
OK	123-86-4	CCCCOC(=O)C	{1: 2, 2: 3, 28: 1}
OK	123-90-0	C1CSCCN1	{32: 1, 41: 1, 11: 4}
OK	123-91-1	C1COCCO1	{11: 4, 23: 2}
OK	123-92-2	CC(C)CCOC(=O)C	{1: 3, 2: 2, 3: 1, 28: 1}
OK	123-93-3	C(C(=O)O)SCC(=O)O	{40: 1, 2: 2, 27: 2}
OK	123-94-4	CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O	{1: 1, 2: 18, 3: 1, 20: 2, 28: 1}
OK	123-95-5	CCCCCCCCCCCCCCCCCC(=O)OCCCC	{1: 2, 2: 19, 28: 1}
OK	123-96-6	CCCCCCC(C)O	{1: 2, 2: 5, 3: 1, 20: 1}
OK	123-98-8	C(CCCC(=O)Cl)CCCC(=O)Cl	{24: 2, 17: 2, 2: 7}
OK	123-99-9	C(CCCC(=O)O)CCCC(=O)O	{2: 7, 27: 2}
OK	1231-93-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C[C@H](CC[C@H]34)O	{1: 1, 9: 1, 10: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 2}
OK	123483-78-3	CCCCCCCCCCCCCCCCOCC1CO1	{1: 1, 2: 16, 11: 1, 12: 1, 22: 1, 23: 1}
OK	123493-71-0	CCCCCCCCC[C@@H]1CO1	{1: 1, 2: 8, 11: 1, 12: 1, 23: 1}
OK	1235-13-8	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@]24CCCO4)CCC5=CC(=O)CC[C@H]35	{1: 1, 11: 11, 12: 4, 13: 2, 14: 1, 15: 1, 23: 1, 25: 1}
OK	1235-15-0	CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(CC)O)CCC4=CC(=O)CC[C@H]34	{1: 2, 2: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	1235106-66-7	C1CCCCC(C(C(CCCC1)(Br)Br)(Br)Br)(Br)Br	{18: 6, 11: 9, 13: 3}
OK	12357-66-3	N=[NH+]	{36: 2}
OK	1236-49-3	CC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C	{1: 3, 11: 10, 12: 5, 13: 2, 28: 1}
OK	123661-24-5	CCCCC(CC)CNCC(CC)CCCC.C=CC(=O)O	{1: 4, 2: 10, 3: 2, 5: 1, 6: 1, 27: 1, 31: 1}
OK	1238-54-6	CC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34OO	{1: 1, 9: 1, 10: 1, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 20: 2, 22: 1, 25: 1}
OK	123808-97-9	CC(C)[C@@H]1CO[C@@]2(N1C(=O)CC2)C	{1: 3, 3: 1, 33: 1, 11: 3, 12: 1, 13: 1, 23: 1, 25: 1}
OK	1239-31-2	CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3CCC4=O)C)C	{1: 3, 11: 9, 12: 5, 13: 2, 25: 1, 28: 1}
OK	124-02-7	C=CCNCC=C	{2: 2, 5: 2, 6: 2, 31: 1}
OK	124-04-9	C(CCC(=O)O)CC(=O)O	{2: 4, 27: 2}
OK	124-05-0	C(COC(=O)Cl)OC(=O)Cl	{17: 2, 2: 2, 28: 2}
OK	124-06-1	CCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 13, 28: 1}
OK	124-07-2	CCCCCCCC(=O)O	{1: 1, 2: 6, 27: 1}
OK	124-09-4	C(CCCN)CCN	{2: 6, 30: 2}
OK	124-10-7	CCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 12, 28: 1}
OK	124-11-8	CCCCCCCC=C	{1: 1, 2: 6, 5: 1, 6: 1}
OK	124-12-9	CCCCCCCC#N	{1: 1, 2: 6, 37: 1}
OK	124-13-0	CCCCCCCC=O	{1: 1, 2: 6, 26: 1}
OK	124-16-3	CCCCOCCOCC(C)O	{1: 2, 2: 6, 3: 1, 20: 1, 22: 2}
OK	124-17-4	CCCCOCCOCCOC(=O)C	{1: 2, 2: 7, 28: 1, 22: 2}
OK	124-18-5	CCCCCCCCCC	{1: 2, 2: 8}
OK	124-19-6	CCCCCCCCC=O	{1: 1, 2: 7, 26: 1}
OK	124-20-9	C(CCNCCCN)CN	{2: 7, 30: 2, 31: 1}
OK	124-21-0	CCOCCNCCOCC	{1: 2, 2: 6, 22: 2, 31: 1}
OK	124-22-1	CCCCCCCCCCCCN	{1: 1, 2: 11, 30: 1}
OK	124-25-4	CCCCCCCCCCCCCC=O	{1: 1, 2: 12, 26: 1}
OK	124-26-5	CCCCCCCCCCCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 16, 30: 1}
OK	124-28-7	CCCCCCCCCCCCCCCCCCN(C)C	{1: 3, 2: 17, 33: 1}
OK	124-30-1	CCCCCCCCCCCCCCCCCCN	{1: 1, 2: 17, 30: 1}
OK	124-38-9	C(=O)=O	{8: 1, 29: 2}
OK	124-40-3	CNC	{1: 2, 31: 1}
OK	124-42-5	CC(=N)N.Cl	{1: 1, 17: 1, 36: 1, 30: 1, 7: 1}
OK	124-43-6	C(=O)(N)N.OO	{24: 1, 20: 2, 30: 2}
OK	124-48-1	C(Cl)(Br)Br	{17: 1, 18: 2, 3: 1}
OK	124-68-5	CC(C)(CO)N	{1: 2, 2: 1, 4: 1, 30: 1, 20: 1}
OK	124-73-2	C(C(F)(F)Br)(F)(F)Br	{16: 4, 18: 2, 4: 2}
OK	124-76-5	C[C@@]12CC[C@H](C1(C)C)C[C@H]2O	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	124-80-1	C[C@H]1CC[C@H]2[C@@]([C@]3([C@H](C[C@]4([C@@H]5CC[C@@H]6[C@@H]([C@H](CC[C@@]6([C@H]5C[C@]4([C@@H]3CN2C1)O)C)OC(=O)C)O)O)O)O)(C)O	{1: 4, 33: 1, 11: 10, 12: 9, 13: 5, 20: 6, 28: 1}
OK	124-83-4	CC1(C(CCC1(C)C(=O)O)C(=O)O)C	{27: 2, 1: 3, 11: 2, 12: 1, 13: 2}
OK	124-85-6	CC(=O)OC1(CCC2C1(CCC3C2CCC4C3(CC=CC4)C)C)C#C	{1: 3, 9: 1, 10: 1, 11: 8, 12: 4, 13: 3, 14: 2, 28: 1}
OK	124-87-8	CC(=C)[C@@H]1C2[C@@H]3[C@@]4([C@](C1C(=O)O2)(CC5[C@]4(O5)C(=O)O3)O)C.C[C@@]12[C@H]3C4[C@H](C([C@@]1(C[C@@H]5[C@]2(O5)C(=O)O3)O)C(=O)O4)C(C)(C)O	{1: 5, 4: 1, 5: 1, 7: 1, 11: 2, 12: 10, 13: 6, 20: 3, 23: 2, 28: 4}
OK	124-94-7	C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@H]([C@@]2(C(=O)CO)O)O)CCC4=CC(=O)C=C[C@@]43C)F)O	{1: 2, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 4, 24: 1, 25: 1}
OK	124-97-0	CCC(C)C(=O)OC1C(C2C(CN3CC(CCC3C2(C)O)C)C4C1(C5C(C(C6C7(C5(C4)OC6(C(CC7)OC(=O)C(C)(C(C)O)O)O)C)OC(=O)C)OC(=O)C)O)O	{1: 9, 2: 1, 3: 2, 4: 1, 33: 1, 11: 7, 12: 12, 13: 5, 20: 6, 23: 1, 28: 4}
OK	124-98-1	CC1CCC2C(C3(C(CC4(C5CCC6C7(C5(CC4(C3CN2C1)O)OC6(C(CC7)O)O)C)O)O)O)(C)O	{1: 3, 33: 1, 11: 10, 12: 7, 13: 7, 20: 7, 23: 1}
OK	124052-92-2	CC(C)(C)C1=NCC(CN1)O.Cl	{32: 1, 1: 3, 35: 1, 4: 1, 11: 2, 12: 1, 15: 1, 17: 1, 20: 1}
OK	12408-14-9	C1=CC(C2C1C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl)O	{12: 3, 13: 3, 14: 2, 15: 2, 17: 6, 20: 1}
OK	124172-53-8	CC1(CC(CC(N1)(C)C)N(CCCCCCN(C=O)C2CC(NC(C2)(C)C)(C)C)C=O)C	{32: 2, 1: 8, 2: 6, 33: 2, 11: 4, 12: 2, 13: 4, 26: 2}
OK	124287-82-7	CC1(C2CCC(C2)C1(OC)OC)C	{1: 4, 11: 3, 12: 2, 13: 2, 22: 2}
OK	1243297-10-0	CC(COC(C)(C)C)OCC(C)OC(C)(C)C	{1: 8, 2: 2, 3: 2, 4: 2, 22: 3}
OK	124350-34-1	CNCCO.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 6, 27: 2, 20: 1, 31: 1}
OK	12447-33-5		{}
OK	1246-87-3	C1=CN(C=CC1=C[NH+]=O)CC(C(CN2C=CC(=C[NH+]=O)C=C2)O)O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O	{33: 2, 2: 2, 3: 2, 6: 2, 14: 8, 15: 2, 17: 2, 20: 2, 29: 10, 31: 2}
OK	124753-97-5	CCCCCCCCCCCCCC=CC(C(CO)NC(=O)CCCCC)O	{1: 2, 2: 17, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	1249-81-6	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)S)C)C	{1: 5, 2: 3, 3: 2, 39: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1}
OK	1249-84-9	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2N(C)CCCN(C)C)CC=C4[C@@]3(CC[C@@H](C4)O)C.Cl.Cl	{1: 5, 2: 3, 33: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 17: 2, 20: 1}
OK	124949-98-0	CCCCCCCC/C=C\CCCCCCCCN.C=CC(=O)O	{1: 1, 2: 15, 5: 1, 6: 3, 27: 1, 30: 1}
OK	125-04-2	CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4(C(=O)COC(=O)CCC(=O)O)O)C)O	{1: 2, 2: 3, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1, 27: 1, 28: 1}
OK	125-10-0	CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)C)O	{1: 3, 2: 1, 11: 5, 12: 3, 13: 3, 14: 3, 15: 1, 20: 1, 24: 1, 25: 2, 28: 1}
OK	125-12-2	CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C2(C)C)C	{1: 4, 11: 3, 12: 2, 13: 2, 28: 1}
OK	125-40-6	CCC(C)C1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 3, 2: 2, 3: 1, 13: 1, 25: 3}
OK	125-42-8	CC/C=C(\C)/C1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 3, 2: 2, 6: 1, 7: 1, 13: 1, 25: 3}
OK	125-55-3	CC(C)C1(C(=O)NC(=O)N(C1=O)C)CC(=C)Br	{32: 1, 1: 3, 2: 1, 3: 1, 5: 1, 7: 1, 13: 1, 18: 1, 25: 3, 33: 1}
OK	125-64-4	CCC1(C(=O)C(CNC1=O)C)CC	{32: 1, 1: 3, 2: 2, 11: 1, 12: 1, 13: 1, 25: 2}
OK	125-66-6	CC(C)C1=CC23CCC4C(C2CC1C(C3C(=O)O)C(=O)O)(CCCC4(C)C(=O)O)C	{1: 4, 3: 1, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 27: 3}
OK	1250-95-9	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]4[C@@]5([C@@]3(CC[C@@H](C5)O)C)O4)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 6, 13: 3, 20: 1, 23: 1}
OK	125061-94-1	C12(C(C(C(C(C1(C(C3(C(C(C(C(C3(F)F)(F)F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F	{16: 30, 4: 1, 13: 16}
OK	125072-37-9	CCOC=CC(OCC)OCC	{1: 3, 2: 3, 3: 1, 22: 3, 6: 2}
OK	125146-82-9	CCCCCC=CCC	{1: 2, 2: 5, 6: 2}
OK	1253-28-7	CCCCCC(=O)OC1(CCC2C1(CCC3C2CCC4=CC(=O)CCC34)C)C(=O)C	{1: 3, 2: 4, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 24: 1, 25: 1, 28: 1}
OK	1253-88-9	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4(C)C)O)C)C	{1: 7, 2: 3, 3: 2, 11: 7, 12: 5, 13: 3, 14: 1, 15: 1, 20: 1}
OK	125370-60-7	C1C(O1)COCC(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 3: 1, 4: 7, 11: 1, 12: 1, 16: 16, 22: 1, 23: 1}
OK	125379-19-3	CCC(CC)(C(CC)(CC)OC)OC	{1: 6, 2: 4, 4: 2, 22: 2}
OK	12542-30-2	C=CC(=O)OC1C=CC2C1C3CCC2C3	{5: 1, 6: 1, 11: 3, 12: 5, 14: 2, 28: 1}
OK	125513-00-0	CCCCCCC(Br)Br	{1: 1, 2: 5, 3: 1, 18: 2}
OK	125537-14-6	CCCCCCC(=O)OCC1CCC(CC1)COC(=O)CCCCCC	{1: 2, 2: 12, 11: 4, 12: 2, 28: 2}
OK	125542-74-7	C(CN)N.C(=O)(C(=O)Cl)Cl	{24: 2, 17: 2, 2: 2, 30: 2}
OK	12565-60-5	C([C@@H]([C@@H]([C@@H]([C@@H]([C@@H](C(=O)O)O)O)O)O)O)O	{27: 1, 2: 1, 3: 5, 20: 6}
OK	125713-87-3	COCCN1CC=CC=C1	{1: 1, 2: 2, 33: 1, 11: 1, 14: 4, 22: 1}
OK	1258-84-0	CC1=C(C(=O)C=C2C1=CC=C3[C@]2(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4C[C@](CC5)(C)C(=O)OC)C)C)C)C)O	{1: 7, 11: 7, 12: 1, 13: 5, 14: 3, 15: 5, 20: 1, 25: 1, 28: 1}
OK	1259-10-5	C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2([C@@]1(CC[C@@]34[C@H]2CC[C@@H]5[C@]3(C4)CC[C@@H](C5(C)C)OC(=O)C)C)C	{1: 8, 2: 2, 3: 1, 6: 1, 7: 1, 11: 9, 12: 4, 13: 5, 28: 1}
OK	12596-80-4	OOO	{20: 2, 22: 1}
OK	12597-10-3	S1SSSS1	{41: 5}
OK	125974-08-5	C(C1=C(C(=O)OC1O)Cl)Cl	{2: 1, 12: 1, 15: 2, 17: 2, 20: 1, 28: 1}
OK	126-06-7	CC1(C(=O)N(C(=O)N1Cl)Br)C	{1: 2, 33: 2, 13: 1, 17: 1, 18: 1, 25: 2}
OK	126-11-4	C(C(CO)(CO)[N+](=O)[O-])O	{20: 3, 2: 3, 4: 1, 38: 1}
OK	126-13-6	CC(C)C(=O)OC[C@@H]1[C@H]([C@@H]([C@](O1)(COC(=O)C)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C)OC(=O)C(C)C	{1: 14, 2: 3, 3: 6, 12: 8, 13: 1, 22: 1, 23: 2, 28: 8}
OK	126-14-7	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 8, 2: 3, 12: 8, 13: 1, 22: 1, 23: 2, 28: 8}
OK	126-15-8	C1C=CCC2C1C3CC=CCC3(O2)C=O	{11: 4, 12: 3, 13: 1, 14: 4, 23: 1, 26: 1}
OK	126-17-0	CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C)NC1	{32: 1, 1: 4, 11: 10, 12: 8, 13: 3, 14: 1, 15: 1, 20: 1, 23: 1}
OK	126-18-1	C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@H]6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1	{1: 4, 11: 11, 12: 9, 13: 3, 20: 1, 23: 2}
OK	126-19-2	C[C@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@H]6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1	{1: 4, 11: 11, 12: 9, 13: 3, 20: 1, 23: 2}
OK	126-29-4	C/C(=C\C=C\C=C(\C=C\C=C(\C=C\[C@@]12O[C@@]1(C[C@H](CC2(C)C)O)C)/C)/C)/C=C/C=C(/C=C/[C@@]34O[C@@]3(C[C@H](CC4(C)C)O)C)\C	{1: 10, 6: 14, 7: 4, 11: 4, 12: 2, 13: 6, 20: 2, 23: 2}
OK	126-30-7	CC(C)(CO)CO	{1: 2, 2: 2, 4: 1, 20: 2}
OK	126-38-5	CC(CBr)(OC)OC	{1: 3, 2: 1, 4: 1, 18: 1, 22: 2}
OK	126-39-6	CCC1(OCCO1)C	{1: 2, 2: 1, 11: 2, 13: 1, 23: 2}
OK	126-52-3	C#CC1(CCCCC1)OC(=O)N	{9: 1, 10: 1, 11: 5, 13: 1, 28: 1, 30: 1}
OK	126-54-5	C1C2(COCO1)COCOC2	{11: 6, 13: 1, 23: 4}
OK	126-58-9	C(C(CO)(CO)COCC(CO)(CO)CO)O	{20: 6, 2: 8, 4: 2, 22: 1}
OK	126-81-8	CC1(CC(=O)CC(=O)C1)C	{1: 2, 11: 3, 13: 1, 25: 2}
OK	126-84-1	CCOC(C)(C)OCC	{1: 4, 2: 2, 4: 1, 22: 2}
OK	126-86-3	CC(C)CC(C)(C#CC(C)(CC(C)C)O)O	{1: 6, 2: 2, 3: 2, 4: 2, 10: 2, 20: 2}
OK	126-87-4	CCCC(C)(C#CC(C)(CCC)O)O	{1: 4, 2: 4, 4: 2, 10: 2, 20: 2}
OK	126-90-9	CC(=CCC[C@@](C)(C=C)O)C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	126-93-2	C1CCOC(C1)C(=O)N	{24: 1, 11: 4, 12: 1, 30: 1, 23: 1}
OK	126-98-7	CC(=C)C#N	{1: 1, 37: 1, 5: 1, 7: 1}
OK	126-99-8	C=CC(=C)Cl	{17: 1, 5: 2, 6: 1, 7: 1}
OK	12609-83-5	CCCCCCCCCCCC1CO1	{1: 1, 2: 10, 11: 1, 12: 1, 23: 1}
OK	12609-89-1	C[C@H]1/C=C/C=C/C=C/C=C/C=C/C=C/C=C/[C@@H](C[C@H]2[C@@H]([C@H](C[C@](O2)(C[C@H]([C@@H](CC[C@H](CC(=O)C[C@H](CC(=O)O[C@H]([C@@H]([C@@H]1O)C)C)O)O)O)O)O)O)C(=O)O)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O)N)O	{1: 4, 11: 8, 12: 17, 13: 1, 14: 14, 20: 9, 22: 1, 23: 2, 25: 1, 27: 1, 28: 1, 30: 1}
OK	126126-48-5	CCCC(=C=C)OC=C	{1: 1, 2: 2, 5: 2, 6: 1, 7: 1, 8: 1, 22: 1}
OK	12622-04-7	C1CCCC(CC1)C2CCCCCC2	{11: 12, 12: 2}
OK	12624-35-0	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CN	{1: 2, 2: 26, 27: 2, 30: 2, 6: 8}
OK	1264-51-3	CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)O)OC7CC(C(C(O7)C)OC8CC(C(C(O8)C)OC(=O)C)O)O	{1: 6, 11: 13, 12: 17, 13: 3, 14: 1, 15: 1, 20: 4, 22: 3, 23: 3, 28: 2}
OK	126567-38-2	CC(=O)O[C@@H](C#N)C(C)(C)C	{1: 4, 3: 1, 4: 1, 37: 1, 28: 1}
OK	126591-36-4	CN1CN(CN(C1=O)C)CN2CN(C(=O)N(C2)C)C	{1: 4, 2: 1, 11: 4, 33: 6, 25: 2}
OK	126850-29-1	C1CCC(=O)OCC1.C1CCC(=O)OCC1.C1CCC(=O)OCC1.C1CCC(=O)OCC1.C1CCC(=O)OCC1.C1CCC(=O)OCC1.C(C(CO)(CO)COCC(CO)(CO)CO)O	{2: 8, 4: 2, 11: 30, 20: 6, 22: 1, 28: 6}
OK	12687-98-8	C/C/1=C\C=C\C=C\C=C\C=C\CC(CC(CC(CC(CC(=O)CC(CC(CC(=O)CCCCCCCC(OC1=O)C(C)C)O)O)O)O)O)O	{1: 3, 3: 1, 11: 15, 12: 7, 14: 9, 15: 1, 20: 6, 25: 2, 28: 1}
OK	126924-36-5	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C\C=[N+](\C)/[O-])/C)/C	{1: 6, 33: 1, 6: 7, 7: 2, 11: 3, 13: 1, 15: 2, 29: 1}
OK	127-00-4	CC(CCl)O	{1: 1, 2: 1, 3: 1, 20: 1, 17: 1}
OK	127-06-0	CC(=NO)C	{1: 2, 34: 1, 20: 1, 7: 1}
OK	127-07-1	C(=O)(N)NO	{24: 1, 20: 1, 30: 1, 31: 1}
OK	127-17-3	CC(=O)C(=O)O	{24: 1, 1: 1, 27: 1}
OK	127-18-4	C(=C(Cl)Cl)(Cl)Cl	{17: 4, 7: 2}
OK	127-19-5	CC(=O)N(C)C	{24: 1, 1: 3, 33: 1}
OK	127-21-9	C(=O)(C(F)(F)Cl)C(F)(F)Cl	{16: 4, 17: 2, 4: 2, 24: 1}
OK	127-25-3	CC(C)C1=CC2=CCC3[C@@](C2CC1)(CCC[C@@]3(C)C(=O)OC)C	{1: 5, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 28: 1}
OK	127-27-5	CC1(CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C=C	{1: 3, 5: 1, 6: 1, 11: 7, 12: 2, 13: 3, 14: 1, 15: 1, 27: 1}
OK	127-31-1	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O)F	{1: 2, 2: 1, 11: 7, 12: 3, 13: 4, 14: 1, 15: 1, 16: 1, 20: 3, 24: 1, 25: 1}
OK	127-40-2	CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CC(CC2(C)C)O)C)C)C	{1: 10, 6: 14, 7: 4, 11: 3, 12: 3, 13: 2, 14: 1, 15: 3, 20: 2}
OK	127-41-3	CC1=CCCC(C1C=CC(=O)C)(C)C	{1: 4, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	127-43-5	CCC(=O)C=CC1=C(CCCC1(C)C)C	{1: 4, 2: 1, 6: 2, 11: 3, 13: 1, 15: 2, 24: 1}
OK	127-47-9	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/COC(=O)C)/C)/C	{1: 6, 2: 1, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 28: 1}
OK	127-48-0	CC1(C(=O)N(C(=O)O1)C)C	{1: 3, 33: 1, 28: 1, 13: 1, 25: 1}
OK	127-51-5	CC1=CCCC(C1C=C(C)C(=O)C)(C)C	{1: 5, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	127-90-2	C(C(C(Cl)(Cl)Cl)Cl)OCC(C(Cl)(Cl)Cl)Cl	{17: 8, 2: 2, 3: 2, 4: 2, 22: 1}
OK	127-91-3	CC1(C2CCC(=C)C1C2)C	{1: 2, 5: 1, 11: 3, 12: 2, 13: 1, 15: 1}
OK	12710-02-0	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2CC=C(CCC=CC(C(C(C(C=CC=CC=CC=CC=CCCC(=O)OC(CC(CC(CC(CC=CC(CC(CC(CC(=O)C2C)O)O)O)O)O)O)/C=C/C[C@H](/C=C/C[C@@H](CCCN)O)O)C)O)C)O)CCC=C)O)O)O	{1: 4, 2: 7, 3: 2, 5: 1, 6: 5, 11: 12, 12: 18, 14: 15, 15: 1, 20: 13, 22: 1, 23: 1, 25: 1, 28: 1, 30: 1}
OK	12728-25-5	CC1CCC=C(C(=O)OC(CC=CC(CC(CC(C(C(C(C(CC(CC(CC(C(C=C(C(C(C=CC(C(C=CCCC(C(C1O)C)O)C)O)C)O)C)O[C@@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)CO)O)O)O)O)O)O)O)C)O)C)O)O)O)C(C)C(CCCN)O)C	{1: 9, 2: 4, 3: 2, 11: 10, 12: 25, 14: 8, 15: 2, 20: 17, 22: 1, 23: 1, 28: 1, 30: 1}
OK	127310-57-0	C1C(NC1C(=O)O)C(=O)O	{27: 2, 32: 1, 11: 1, 12: 2}
OK	127311-83-5	C[C@]12[C@@H]3CC[C@H]([C@H]1C(=O)SC2=O)O3	{1: 1, 41: 1, 11: 2, 12: 3, 13: 1, 23: 1, 25: 2}
OK	127377-12-2	C=CC(=O)OCC(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{2: 2, 3: 1, 4: 6, 5: 1, 6: 1, 16: 13, 20: 1, 28: 1}
OK	127404-11-9	CCC(F)(Cl)Cl	{16: 1, 1: 1, 2: 1, 4: 1, 17: 2}
OK	12767-71-4	CCCCCCCCCCCCCCCCCCN1CCNC1=O	{32: 1, 1: 1, 2: 17, 33: 1, 11: 2, 25: 1}
OK	12772-47-3	CCCCCCCCC=CCCCCCCCC(=O)O.C(C(CO)(CO)CO)O	{1: 1, 2: 18, 4: 1, 6: 2, 20: 4, 27: 1}
OK	127750-96-3	C=C1C2C(=C)C(=O)C(C1=C)O2	{25: 1, 23: 1, 12: 2, 5: 3, 15: 3}
OK	127750-98-5	C=C1C2C(=O)C(=C)C(C1=O)O2	{25: 2, 23: 1, 12: 2, 5: 2, 15: 2}
OK	127793-16-2	C1C#CCSCC#CCO1	{41: 1, 10: 4, 11: 4, 23: 1}
OK	12789-03-6	C1C2C(C(C1Cl)Cl)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{17: 8, 11: 1, 12: 4, 13: 3, 15: 2}
OK	127913-44-4	C(C#N)[C@@H](CCl)O	{17: 1, 2: 2, 3: 1, 20: 1, 37: 1}
OK	127967-41-3	CCCCCCCCCCCCC(CCCCCCCCCC)C(=O)O	{27: 1, 1: 2, 2: 20, 3: 1}
OK	128-08-5	C1CC(=O)N(C1=O)Br	{25: 2, 18: 1, 11: 2, 33: 1}
OK	128-09-6	C1CC(=O)N(C1=O)Cl	{17: 1, 11: 2, 33: 1, 25: 2}
OK	128-13-2	CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C	{1: 3, 2: 2, 3: 1, 11: 8, 12: 7, 13: 2, 20: 2, 27: 1}
OK	128-20-1	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C	{1: 3, 11: 9, 12: 6, 13: 2, 20: 1, 24: 1}
OK	128-21-2	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)O)C)C	{1: 3, 11: 9, 12: 6, 13: 2, 20: 1, 24: 1}
OK	128-23-4	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)C	{1: 3, 11: 9, 12: 5, 13: 2, 24: 1, 25: 1}
OK	128-27-8	C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@]3(CC[C@@H](C4)O)C)C	{1: 6, 3: 3, 6: 2, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 20: 1}
OK	128-33-6	C[C@H](CCC=C(C)C)[C@H]1CC[C@@H]2[C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C	{1: 5, 2: 2, 3: 1, 6: 1, 7: 1, 11: 9, 12: 4, 13: 2, 15: 2, 20: 1}
OK	128-46-1	CC1C(C(C(O1)OC2C(C(C(C(C2O)O)N=C(N)N)O)N=C(N)N)OC3C(C(C(C(O3)CO)O)O)NC)(CO)O	{1: 2, 2: 2, 34: 2, 7: 2, 12: 14, 13: 1, 20: 8, 22: 2, 23: 2, 30: 4, 31: 1}
OK	128-50-7	CC1(C2CC=C(C1C2)CCO)C	{1: 2, 2: 2, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 20: 1}
OK	128-51-8	CC(=O)OCCC1=CCC2CC1C2(C)C	{1: 3, 2: 2, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 28: 1}
OK	128-53-0	CCN1C(=O)C=CC1=O	{1: 1, 2: 1, 33: 1, 14: 2, 25: 2}
OK	128-68-7	CC1=CC(=O)/C(=C\2/C(=O)C=C(C(=O)C2=O)C)/C(=C1O)O	{1: 2, 20: 2, 25: 4, 14: 2, 15: 6}
OK	128399-28-0	CCCC(C)CCl	{1: 2, 2: 3, 3: 1, 17: 1}
OK	128399-30-4	CC(C)CC(C)Cl	{1: 3, 2: 1, 3: 2, 17: 1}
OK	128478-71-7	C1C2CC3CC1CC(C2)C3(C#N)[N+](=O)[O-]	{11: 5, 12: 4, 13: 1, 38: 1, 37: 1}
OK	128538-82-9	COC1C(CCO1)(Cl)Cl	{1: 1, 11: 2, 12: 1, 13: 1, 17: 2, 22: 1, 23: 1}
OK	128551-39-3	C(CC(C(=O)O)N)CN	{27: 1, 2: 3, 3: 1, 30: 2}
OK	128823-59-6	C(CCC/C=C\CCCC(=O)O)CCCC(=O)O	{2: 10, 27: 2, 6: 2}
OK	128903-20-8	CCC(C)(C#N)C(C)(CC)C#N	{1: 4, 2: 2, 4: 2, 37: 2}
OK	129042-71-3	C1CCC(CC1)C(CC(=O)O)N	{2: 1, 3: 1, 11: 5, 12: 1, 27: 1, 30: 1}
OK	129619-37-0	CC[C@H](CC[C@@H](CC)O)O	{1: 2, 2: 4, 3: 2, 20: 2}
OK	129725-38-8	CCCCCCCCCCC(CCCCCCCC)CC1CC(C(C1)CC(CCCCCCCC)CCCCCCCCCC)CC(CCCCCCCC)CCCCCCCCCC	{11: 2, 1: 6, 2: 51, 3: 3, 12: 3}
OK	129757-67-1	CCCCCCCCON1C(CC(CC1(C)C)OC(=O)CCCCCCCCC(=O)OC2CC(N(C(C2)(C)C)OCCCCCCCC)(C)C)(C)C	{1: 10, 2: 22, 33: 2, 11: 4, 12: 2, 13: 4, 22: 2, 28: 2}
OK	129757-76-2	CCC(CO)(CO)CO.C1CCC(=O)OCC1.C(CCCN=C=O)CCN=C=O	{1: 1, 2: 10, 4: 1, 8: 2, 11: 5, 34: 2, 20: 3, 28: 1, 29: 2}
OK	129872-30-6	C1CC12CC23CC34CC45CC5	{11: 7, 13: 4}
OK	130-01-8	C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O)C	{1: 3, 6: 1, 33: 1, 11: 5, 12: 3, 13: 1, 14: 1, 15: 2, 20: 1, 28: 2}
OK	13000-42-5	C(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C(=O)N	{24: 1, 2: 2, 4: 1, 38: 3, 30: 1}
OK	13002-08-9	CCCCCOC(C)OCCCCC	{1: 3, 2: 8, 3: 1, 22: 2}
OK	13002-10-3	CCCCOC(CC)OCCCC	{1: 3, 2: 7, 3: 1, 22: 2}
OK	13002-15-8	CCCC(OC(C)C)OC(C)C	{1: 5, 2: 2, 3: 3, 22: 2}
OK	13002-16-9	CCCC(OCC(C)C)OCC(C)C	{1: 5, 2: 4, 3: 3, 22: 2}
OK	13005-81-7	CC1(CSSSC1)C	{1: 2, 11: 2, 13: 1, 41: 3}
OK	13006-29-6	CCCCCCCCCC(CO)O	{1: 1, 2: 9, 3: 1, 20: 2}
OK	130073-64-2	C1=C(C(=C[C@@H]([C@@H]1O)O)C(=O)O)C(=O)O	{20: 2, 27: 2, 12: 2, 14: 2, 15: 2}
OK	13010-07-6	CCCN(/C(=N/[N+](=O)[O-])/N)N=O	{1: 1, 2: 2, 38: 1, 33: 1, 7: 1, 34: 2, 29: 1, 30: 1}
OK	13010-08-7	CCCCN(C(=N[N+](=O)[O-])N)N=O	{1: 1, 2: 3, 38: 1, 33: 1, 7: 1, 34: 2, 29: 1, 30: 1}
OK	13010-10-1	CCCCCN(/C(=N/[N+](=O)[O-])/N)N=O	{1: 1, 2: 4, 38: 1, 33: 1, 7: 1, 34: 2, 29: 1, 30: 1}
OK	13010-19-0	C(CN=C=O)CCl	{8: 1, 17: 1, 2: 3, 34: 1, 29: 1}
OK	13010-20-3	C(=O)(N)NN=O	{24: 1, 34: 1, 29: 1, 30: 1, 31: 1}
OK	13010-47-4	C1CCC(CC1)NC(=O)N(CCCl)N=O	{33: 1, 2: 2, 11: 5, 12: 1, 34: 1, 17: 1, 24: 1, 29: 1, 31: 1}
OK	13013-01-9	C(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C(=O)OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{28: 1, 2: 3, 4: 2, 38: 6}
OK	13013-02-0	COC(=O)CCC[N+](=O)[O-]	{1: 1, 2: 3, 28: 1, 38: 1}
OK	130165-76-3	CC(C)C[C@H](CC(=O)O)C(=O)OC	{27: 1, 1: 3, 2: 2, 3: 2, 28: 1}
OK	130165-88-7	COC(=O)[C@H](CC1CCCCC1)CC(=O)O	{1: 1, 2: 2, 3: 1, 11: 5, 12: 1, 27: 1, 28: 1}
OK	13019-16-4	CCCCCC=C(CCCC)C=O	{1: 2, 2: 7, 26: 1, 6: 1, 7: 1}
OK	13019-19-7	CCCCC(C(=C)C)O	{1: 2, 2: 3, 3: 1, 5: 1, 7: 1, 20: 1}
OK	13019-20-0	CCCCC(=O)C(C)C	{24: 1, 1: 3, 2: 3, 3: 1}
OK	13019-22-2	C=CCCCCCCCCO	{2: 8, 20: 1, 5: 1, 6: 1}
OK	13021-02-8	C1CC1[N+](=O)[O-]	{11: 2, 12: 1, 38: 1}
OK	13021-50-6	CCOCC(COC(C)C)O	{1: 3, 2: 3, 3: 2, 20: 1, 22: 2}
OK	13023-00-2	CCC(C(=O)O)(Cl)Cl	{1: 1, 2: 1, 27: 1, 4: 1, 17: 2}
OK	13023-60-4	CCC(CC)(CC)CO	{1: 3, 2: 4, 4: 1, 20: 1}
OK	13027-05-9	C(CNC(=O)OCCO)NC(=O)OCCO	{28: 2, 2: 6, 20: 2, 31: 2}
OK	13027-75-3	C1CC2C1C3C2CC3	{11: 4, 12: 4}
OK	13027-88-8	CC(C)(C(=O)N)O	{24: 1, 1: 2, 4: 1, 30: 1, 20: 1}
OK	13030-50-7	CSC#CC=C	{40: 1, 1: 1, 10: 2, 5: 1, 6: 1}
OK	13035-61-5	CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)OC(=O)C)OC(=O)C)OC(=O)C	{1: 4, 2: 1, 12: 4, 28: 4, 23: 1}
OK	13036-41-4	CCOCNC(=O)C=C	{1: 1, 2: 2, 5: 1, 6: 1, 22: 1, 24: 1, 31: 1}
OK	13036-81-2	CCCN1CN(CN(C1)CCC)CCC	{1: 3, 2: 6, 11: 3, 33: 3}
OK	13036-83-4	CCCCN1CN(CN(C1)CCCC)CCCC	{1: 3, 2: 9, 11: 3, 33: 3}
OK	13038-21-6	C=CCCCCCCCO	{2: 7, 20: 1, 5: 1, 6: 1}
OK	13039-41-3	CCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O	{1: 1, 2: 17, 12: 8, 13: 1, 20: 7, 22: 1, 23: 2, 28: 1}
OK	13041-10-6	COC1C2CCC1C=C2	{1: 1, 11: 2, 12: 3, 22: 1, 14: 2}
OK	13042-02-9	C(CC#N)C=CC#N	{2: 2, 37: 2, 6: 2}
OK	13042-79-0	CC1=CCCCS1	{1: 1, 11: 3, 41: 1, 14: 1, 15: 1}
OK	13044-51-4	CN(C)C1CCC=C1	{1: 2, 11: 2, 12: 1, 14: 2, 33: 1}
OK	13044-92-3	CN(C)CC=CC=CC=C=O	{1: 2, 2: 1, 6: 5, 33: 1, 8: 1, 29: 1}
OK	13046-50-9	CSC(=C(SC)SC)SC	{40: 4, 1: 4, 7: 2}
OK	130466-96-5	CCCCCCCC1CO1	{1: 1, 2: 6, 11: 1, 12: 1, 23: 1}
OK	13048-17-4	C1CC=CC(C1)C#N	{11: 3, 12: 1, 37: 1, 14: 2}
OK	13048-32-3	CCCCCCOC(=O)CBr	{1: 1, 2: 6, 28: 1, 18: 1}
OK	13048-33-4	C=CC(=O)OCCCCCCOC(=O)C=C	{2: 6, 28: 2, 5: 2, 6: 2}
OK	13048-34-5	C=CC(=O)OCCCCCCCCCCOC(=O)C=C	{2: 10, 28: 2, 5: 2, 6: 2}
OK	13048-99-2	CCCCOC(=O)CN.Cl	{1: 1, 2: 4, 28: 1, 30: 1, 17: 1}
OK	13049-89-3	CCCCCC=CCCOC(=O)C	{1: 2, 2: 6, 28: 1, 6: 2}
OK	13055-06-6	C(C(=O)O)N(CC(=O)O)C1C(=O)NC(=O)NC1=O	{32: 2, 33: 1, 2: 2, 12: 1, 25: 3, 27: 2}
OK	13057-17-5	COCBr	{1: 1, 2: 1, 18: 1, 22: 1}
OK	13057-19-7	COCI	{1: 1, 2: 1, 19: 1, 22: 1}
OK	13058-67-8	CCCCC1C/C=C/C=C/C=C/C=C/C(CC2C(C(CC(O2)(CC(CC3C(O3)/C=C/C(=O)O1)O)O)O)C(=O)O)O[C@H]4C(C([C@@H](C(O4)C)O)N)O	{1: 2, 2: 3, 11: 5, 12: 13, 13: 1, 14: 10, 20: 5, 22: 1, 23: 3, 27: 1, 28: 1, 30: 1}
OK	13059-60-4	C(C(=O)NCC(=O)O)N.Cl	{2: 2, 17: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	130607-26-0	C([C@@H]1[C@H]([C@H]([C@]2(O1)C(=O)NC(=O)N2)O)O)O	{32: 2, 2: 1, 12: 3, 13: 1, 20: 3, 23: 1, 25: 2}
OK	13061-80-8	CC=CC(=O)C#C	{24: 1, 1: 1, 10: 1, 6: 2, 9: 1}
OK	13063-43-9	C(#N)C(C#N)(Cl)Cl	{17: 2, 4: 1, 37: 2}
OK	13064-83-0	CC1CCC(CC1)C(=O)O	{27: 1, 1: 1, 11: 4, 12: 2}
OK	13066-51-8	CC(=CCCC(=C)CCO)C	{1: 2, 2: 4, 5: 1, 6: 1, 7: 2, 20: 1}
OK	13072-69-0	C1C2CC3CC1CC(C2)(C3)NC(=O)N	{11: 6, 12: 3, 13: 1, 24: 1, 30: 1, 31: 1}
OK	130720-66-0	C1CCC2(C1)CC(N3N2N3C(F)(F)F)(C(F)(F)F)C(F)(F)F	{16: 9, 33: 3, 11: 5, 4: 3, 13: 2}
OK	130720-67-1	C1CCC2(CC1)CC(N3N2N3C(F)(F)F)(C(F)(F)F)C(F)(F)F	{16: 9, 33: 3, 11: 6, 4: 3, 13: 2}
OK	13073-35-3	CCSCC[C@@H](C(=O)O)N	{1: 1, 2: 3, 3: 1, 40: 1, 27: 1, 30: 1}
OK	13074-39-0	C1C2CC3CC1CC(C2)C3N	{11: 5, 12: 5, 30: 1}
OK	13074-65-2	CCCCCCC1CCCC1=O	{1: 1, 2: 5, 11: 3, 12: 1, 25: 1}
OK	13076-17-0	C[C@@H]1C(=O)O[C@@H](C(=O)O1)C	{1: 2, 12: 2, 28: 2}
OK	13076-19-2	C[C@@H]1C(=O)O[C@H](C(=O)O1)C	{1: 2, 12: 2, 28: 2}
OK	13080-06-3	CCCCC(CC)(C(=O)OCC)C(=O)OCCN(CC)CC	{1: 5, 2: 9, 4: 1, 28: 2, 33: 1}
OK	13080-90-5	C1C2CC(C1C=C2)O	{20: 1, 11: 2, 12: 3, 14: 2}
OK	13081-18-0	CCOC(=O)C(=O)C(F)(F)F	{1: 1, 2: 1, 4: 1, 16: 3, 24: 1, 28: 1}
OK	13081-34-0	CCCCCCCCCCCCSCCOCCO	{40: 1, 1: 1, 2: 15, 20: 1, 22: 1}
OK	13084-45-2	C=COC(CN(F)F)N(F)F	{33: 2, 2: 1, 3: 1, 5: 1, 6: 1, 16: 4, 22: 1}
OK	13084-47-4	C(C(N(F)F)O)N(F)F	{16: 4, 33: 2, 2: 1, 3: 1, 20: 1}
OK	13084-56-5	C1C2C3C4C1C5C2C5C34	{11: 1, 12: 8}
OK	130871-93-1	C1CC2CC1C=C2C(F)(F)F	{4: 1, 11: 3, 12: 2, 14: 1, 15: 1, 16: 3}
OK	13088-64-7	C1CCC(=O)N(CC1)CO	{25: 1, 2: 1, 11: 5, 20: 1, 33: 1}
OK	13089-11-7	COC(=O)C(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 24: 1, 28: 1}
OK	13093-04-4	CNCCCCCCNC	{1: 2, 2: 6, 31: 2}
OK	13093-05-5	CCNCCCCCCNCC	{1: 2, 2: 8, 31: 2}
OK	13095-73-3	C(CC(=O)O)CS	{2: 3, 27: 1, 39: 1}
OK	131-48-6	CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)O)O	{1: 1, 2: 1, 3: 2, 11: 1, 12: 3, 13: 1, 20: 5, 23: 1, 24: 1, 27: 1, 31: 1}
OK	13101-26-3	C(N=C(N)NC#N)O	{2: 1, 37: 1, 7: 1, 34: 1, 20: 1, 30: 1, 31: 1}
OK	13105-52-7	CCCCNC(=O)OCCCC	{1: 2, 2: 6, 28: 1, 31: 1}
OK	13109-70-1	CCCC(=O)OC1CC2CCC1(C2(C)C)C	{1: 4, 2: 2, 11: 3, 12: 2, 13: 2, 28: 1}
OK	131132-77-9	C=COCC1CCC(CC1)COC(=O)CCCC(=O)OCC2CCC(CC2)COC=C	{2: 7, 5: 2, 6: 2, 11: 8, 12: 4, 22: 2, 28: 2}
OK	13115-24-7	CC(=O)N(C)O	{24: 1, 1: 2, 20: 1, 33: 1}
OK	131154-74-0	CCCCCCCCCCCCCOC(=O)CCCCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 30, 28: 1, 6: 2}
OK	13116-53-5	C(C(CCl)(Cl)Cl)Cl	{17: 4, 2: 2, 4: 1}
OK	13116-58-0	C(C(=CCl)Cl)Cl	{17: 3, 2: 1, 6: 1, 7: 1}
OK	13116-60-4	CC(C(Cl)Cl)(Cl)Cl	{1: 1, 3: 1, 4: 1, 17: 4}
OK	131179-08-3	COC(=O)N1C2CCC1CC2	{1: 1, 11: 4, 12: 2, 28: 1, 33: 1}
OK	131198-22-6	CCCCCCCCCCCCCCC/C=C/CC(CC(=O)O)C(=O)OCCOCCOC(=O)CC(C/C=C/CCCCCCCCCCCCCCC)C(=O)O	{1: 2, 2: 36, 3: 2, 6: 4, 22: 1, 27: 2, 28: 2}
OK	131213-98-4	C1CC2C3C4CCC(C3C1C2=O)C4=O	{25: 2, 11: 4, 12: 6}
OK	13122-18-4	CC(CC(=O)OOC(C)(C)C)CC(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2, 22: 1, 28: 1}
OK	13124-69-1	CC1CC2C(C2(C)C)CC1=O	{1: 3, 11: 2, 12: 3, 13: 1, 25: 1}
OK	13125-74-1	CCC(=CCCC(=CCCC(=O)C)C)C	{24: 1, 1: 4, 2: 5, 6: 2, 7: 2}
OK	13129-60-7	C1CCOC(C1)OCCCCCCl	{2: 5, 11: 4, 12: 1, 17: 1, 22: 1, 23: 1}
OK	13133-29-4	COCCCOCCCOCCCO	{1: 1, 2: 9, 20: 1, 22: 3}
OK	13138-51-7	CC(C(CCl)Cl)(Cl)Cl	{1: 1, 2: 1, 3: 1, 4: 1, 17: 4}
OK	13139-15-6	CC(C)C[C@@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 5, 2: 1, 3: 2, 4: 1, 27: 1, 28: 1, 31: 1}
OK	13139-16-7	CC[C@H](C)[C@@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 5, 2: 1, 3: 2, 4: 1, 27: 1, 28: 1, 31: 1}
OK	13140-24-4	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)F	{16: 42, 24: 1, 4: 20, 22: 6}
OK	13140-25-5	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)F	{16: 48, 24: 1, 4: 23, 22: 7}
OK	13140-26-6	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)F	{16: 54, 24: 1, 4: 26, 22: 8}
OK	13140-34-6	COC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F	{16: 11, 1: 1, 4: 5, 22: 1, 28: 1}
OK	131447-88-6	CC(=C)C(CCC(=O)C)CC#N	{1: 2, 2: 3, 3: 1, 5: 1, 7: 1, 24: 1, 37: 1}
OK	131447-89-7	CC(=O)CC[C@H](CC#N)C(C)(C)OC(=O)C	{1: 4, 2: 3, 3: 1, 4: 1, 37: 1, 24: 1, 28: 1}
OK	131447-90-0	CC(C)[C@@H]1CC[C@@]([C@H]([C@H]1C#N)CCC(=O)C)(C)OC(=O)C	{1: 5, 2: 2, 3: 1, 37: 1, 11: 2, 12: 3, 13: 1, 24: 1, 28: 1}
OK	13145-46-5	C1CSC2(S1)SCCS2	{41: 4, 11: 4, 13: 1}
OK	131468-89-8	CC(=O)CC[C@@H]1[C@H](CC1(C)C)C(=C)CCC#N	{1: 3, 2: 4, 5: 1, 7: 1, 11: 1, 12: 2, 13: 1, 24: 1, 37: 1}
OK	13147-25-6	CCN(CCO)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 20: 1, 29: 1}
OK	13150-79-3	CC(C)C1(CC1)C	{11: 2, 1: 3, 3: 1, 13: 1}
OK	13150-81-7	CCCCC(C)CCCC(C)C	{1: 4, 2: 6, 3: 2}
OK	13151-04-7	CCC(C)CCC=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1}
OK	13151-05-8	CCCC(C)CC=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1}
OK	13151-06-9	CC(C)CCCCC=C	{1: 2, 2: 4, 3: 1, 5: 1, 6: 1}
OK	13151-12-7	CCCCC(C)CC=C	{1: 2, 2: 4, 3: 1, 5: 1, 6: 1}
OK	13151-27-4	CCCCCCCCC(=C)C	{1: 2, 2: 7, 5: 1, 7: 1}
OK	13151-29-6	CCCCCCC(C)CC=C	{1: 2, 2: 6, 3: 1, 5: 1, 6: 1}
OK	13151-34-3	CCCCCCCC(C)CC	{1: 3, 2: 7, 3: 1}
OK	13151-35-4	CCCCCC(C)CCCC	{1: 3, 2: 7, 3: 1}
OK	13151-43-4	CC1CCCCCCCCC1	{1: 1, 11: 9, 12: 1}
OK	13151-51-4	CC1CCCCCC1C	{1: 2, 11: 5, 12: 2}
OK	13151-53-6	CC1CCCCC(C1)C	{1: 2, 11: 5, 12: 2}
OK	13151-55-8	CCC1CCCCCC1	{1: 1, 2: 1, 11: 6, 12: 1}
OK	13151-60-5	C1CCCCC=CCCCC1	{11: 9, 14: 2}
OK	13151-61-6	C1CCCC/C=C\CCCC1	{11: 9, 14: 2}
OK	13151-82-1	CCCCCCCCCCC(C)C1CCCCC1	{11: 5, 1: 2, 2: 9, 3: 1, 12: 1}
OK	13151-91-2	CCCCCCCC(CCCCC)C1CCCCC1	{11: 5, 1: 2, 2: 10, 3: 1, 12: 1}
OK	13151-92-3	CCCCCCC(CCCCCC)C1CCCCC1	{11: 5, 1: 2, 2: 10, 3: 1, 12: 1}
OK	13152-02-8	CCC1CCCCCCC1	{1: 1, 2: 1, 11: 7, 12: 1}
OK	13152-05-1	CC1CCCCCC=C1	{1: 1, 11: 5, 12: 1, 14: 2}
OK	13155-57-2	CC1CCCC(C1C=O)(C)C	{1: 3, 26: 1, 11: 3, 12: 2, 13: 1}
OK	13156-01-9	C1CCC(CC1)N2CC(C2)O	{20: 1, 11: 7, 12: 2, 33: 1}
OK	13157-38-5	C(#N)C(=C1SC(=O)S1)C#N	{25: 1, 41: 2, 15: 1, 37: 2, 7: 1}
OK	13159-52-9	CC(=C)C(=O)OCC(CCl)O	{1: 1, 2: 2, 3: 1, 5: 1, 7: 1, 17: 1, 20: 1, 28: 1}
OK	13161-30-3	C1=CC(=O)N(C=C1)O	{25: 1, 21: 1, 14: 4, 33: 1}
OK	13162-05-5	C=CNC=O	{26: 1, 5: 1, 6: 1, 31: 1}
OK	13162-46-4	CCCCCC/C=C/C=C/C=O	{1: 1, 2: 5, 26: 1, 6: 4}
OK	13162-47-5	CCCCCCCC=CC=CC=O	{1: 1, 2: 6, 26: 1, 6: 4}
OK	13163-73-0	C[C@H]1CC[C@@H](CC1=O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2, 25: 1}
OK	131669-35-7	C(C(C(=O)O)NC(CC(=O)O)C(=O)O)C(=O)O	{27: 4, 2: 2, 3: 2, 31: 1}
OK	13169-00-1	COC=C=C	{8: 1, 1: 1, 22: 1, 5: 1, 6: 1}
OK	13169-01-2	CC#COC	{1: 2, 10: 2, 22: 1}
OK	13170-68-8	CCCCCCCCCCCCCCCCCC1=NCCN1CCNC(=O)NCCN2CCN=C2CCCCCCCCCCCCCCCCC	{1: 2, 2: 36, 35: 2, 33: 2, 11: 4, 15: 2, 24: 1, 31: 2}
OK	13171-64-7	COC(=O)[C@H]([C@@H](C(=O)OC)O)O	{1: 2, 3: 2, 20: 2, 28: 2}
OK	13172-31-1	S(SBr)Br	{40: 2, 18: 2}
OK	13172-91-3	CCC=CC(C)CC	{1: 3, 2: 2, 3: 1, 6: 2}
OK	13176-46-0	CCOC(=O)CC(=O)CBr	{24: 1, 1: 1, 2: 3, 28: 1, 18: 1}
OK	13177-38-3	C1=CC(=O)C=C1	{25: 1, 14: 4}
OK	13179-96-9	COCCCCOC	{1: 2, 2: 4, 22: 2}
OK	131867-00-0	CC1CN(CCN1)CCNC(C)CN	{32: 1, 1: 2, 2: 3, 3: 1, 33: 1, 11: 3, 12: 1, 30: 1, 31: 1}
OK	13187-99-0	CCCCCCCCCCC(C)Br	{1: 2, 2: 9, 3: 1, 18: 1}
OK	13188-60-8	C(CCCCCC(=O)O)CCCCC(=O)O.C(CCCN)CCN	{2: 16, 27: 2, 30: 2}
OK	13189-98-5	C(CO)CSC[C@@H](C(=O)O)N	{2: 4, 3: 1, 40: 1, 20: 1, 27: 1, 30: 1}
OK	1319-80-8	CC1(C(=C)C2(C(C1(C(C2(Cl)Cl)(Cl)Cl)Cl)(Cl)Cl)Cl)C	{1: 2, 15: 1, 17: 8, 5: 1, 13: 6}
OK	13190-97-1	CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C	{1: 10, 2: 17, 20: 1, 6: 9, 7: 9}
OK	13192-04-6	COC(=O)CCC(=O)C(=O)OC	{24: 1, 1: 2, 2: 2, 28: 2}
OK	131929-60-7	CC[C@H]1CCCC([C@H](C(=O)C2=C[C@H]3[C@@H]4C[C@@H](C[C@H]4C=C[C@H]3[C@@H]2CC(=O)O1)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OC)OC)C)O[C@H]6CC[C@@H]([C@H](O6)C)N(C)C	{1: 9, 2: 1, 33: 1, 11: 8, 12: 17, 14: 3, 15: 1, 22: 5, 23: 2, 25: 1, 28: 1}
OK	13195-64-7	CC(C)OC(=O)CC(=O)OC(C)C	{1: 4, 2: 1, 3: 2, 28: 2}
OK	13195-66-9	CCCCCCCC(=O)CC(=O)OCC	{24: 1, 1: 2, 2: 8, 28: 1}
OK	13195-80-7	CC=C(Br)Br	{1: 1, 18: 2, 6: 1, 7: 1}
OK	1320-67-8	CCC(O)OC	{1: 2, 2: 1, 3: 1, 20: 1, 22: 1}
OK	13201-46-2	CC=C(C)C(=O)O	{1: 2, 27: 1, 6: 1, 7: 1}
OK	132029-16-4	CCCCCC=CCC=CCC=CCCCCC(=O)OC	{1: 2, 2: 10, 28: 1, 6: 6}
OK	13204-98-3	C(CC(C(=O)O)N)C(CN)O.Cl	{2: 3, 3: 2, 17: 1, 20: 1, 27: 1, 30: 2}
OK	13205-56-6	CCCCCCCCCC(C)N	{1: 2, 2: 8, 3: 1, 30: 1}
OK	13205-57-7	CCCCCCCCCCCC(C)N	{1: 2, 2: 10, 3: 1, 30: 1}
OK	13205-60-2	CCNCC(C)C	{1: 3, 2: 2, 3: 1, 31: 1}
OK	132050-00-1	CN(C)CN(C)C.C(=O)(C(=O)O)O	{1: 4, 2: 1, 27: 2, 33: 2}
OK	13206-46-7	CC(C)(C=O)Br	{1: 2, 18: 1, 4: 1, 26: 1}
OK	1321-89-7	CC(C)CCCCCCC=O	{1: 2, 2: 6, 3: 1, 26: 1}
OK	13211-15-9	CC1(C2CCC(C2)C1=O)C	{1: 2, 11: 3, 12: 2, 13: 1, 25: 1}
OK	13214-58-9	CC([N+](=O)[O-])([N+](=O)[O-])F	{16: 1, 1: 1, 4: 1, 38: 2}
OK	1322-71-0	CCC(=O)/C=C/C1=C(CCCC1(C)C)C	{1: 4, 2: 1, 6: 2, 11: 3, 13: 1, 15: 2, 24: 1}
OK	13220-33-2	CN1CCC(C1)O	{1: 1, 11: 3, 12: 1, 20: 1, 33: 1}
OK	13221-71-1	C1(C(C(C1(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F	{16: 12, 4: 2, 13: 4}
OK	13222-26-9	CC(C)(C(=O)Cl)Cl	{24: 1, 1: 2, 4: 1, 17: 2}
OK	13222-45-2	C(=C(C(F)(F)F)C(F)(F)F)=C(C(F)(F)F)C(F)(F)F	{8: 1, 16: 12, 4: 4, 7: 2}
OK	13222-51-0	CC=CN(C)C	{1: 3, 6: 2, 33: 1}
OK	13224-94-7	CO[C@H]1[C@@H]([C@H](O[C@@H]([C@@H]1O)O)CO)O	{1: 1, 2: 1, 12: 5, 20: 4, 22: 1, 23: 1}
OK	132298-15-8	CC1=CC(=O)C=C(C1=N)C	{1: 2, 25: 1, 36: 1, 14: 2, 15: 3}
OK	132299-20-8	CC(C)C(C(C)C)OCCO	{1: 4, 2: 2, 3: 3, 20: 1, 22: 1}
OK	1323-03-1	CCCCCCCCCCCCCCOC(=O)C(C)O	{1: 2, 2: 13, 3: 1, 20: 1, 28: 1}
OK	1323-38-2	CCCCCCC(CC=CCCCCCCCC(=O)OCC(CO)O)O	{1: 1, 2: 15, 3: 2, 6: 2, 20: 3, 28: 1}
OK	1323-83-7	CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)O	{1: 2, 2: 34, 3: 1, 20: 1, 28: 2}
OK	13231-81-7	CCCC(C)CCO	{1: 2, 2: 4, 3: 1, 20: 1}
OK	13232-00-3	CN(CN(C)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 1, 38: 2, 33: 2}
OK	13236-02-7	C1C(O1)COCC(COCC2CO2)OCC3CO3	{2: 5, 3: 1, 11: 3, 12: 3, 22: 3, 23: 3}
OK	13242-44-9	CN(C)CCS.Cl	{1: 2, 2: 2, 39: 1, 33: 1, 17: 1}
OK	13242-55-2	CC(=O)OC1C2COC(O2)C(C1OC(=O)C)OC(=O)C	{1: 3, 11: 1, 12: 5, 28: 3, 23: 2}
OK	13248-54-9	C1CCC(CC1)OC(=O)Cl	{17: 1, 11: 5, 12: 1, 28: 1}
OK	132486-02-3	CCCCO.CC1CO1.C1CO1.II	{1: 2, 2: 3, 11: 3, 12: 1, 19: 2, 20: 1, 23: 2}
OK	13250-12-9	CC[C@@H](C)N	{1: 2, 2: 1, 3: 1, 30: 1}
OK	13252-14-7	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)O	{16: 17, 27: 1, 4: 8, 22: 2}
OK	13253-44-6	CSCCC1C(=O)NC(=O)N1	{32: 2, 1: 1, 2: 2, 40: 1, 12: 1, 25: 2}
OK	13254-34-7	CC(C)CCCC(C)(C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	13256-06-9	CCCCCN(CCCCC)N=O	{1: 2, 2: 8, 34: 1, 29: 1, 33: 1}
OK	13256-07-0	CCCCCN(C)N=O	{1: 2, 2: 4, 34: 1, 29: 1, 33: 1}
OK	13256-13-8	CCN(C=C)N=O	{1: 1, 2: 1, 5: 1, 6: 1, 33: 1, 34: 1, 29: 1}
OK	13256-15-0	CCOC(=O)N1CCN(CC1)N=O	{1: 1, 2: 1, 33: 2, 11: 4, 34: 1, 28: 1, 29: 1}
OK	13256-19-4	CC(=O)OCCN(CCOC(=O)C)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 28: 2, 29: 1}
OK	13256-22-9	CN(CC(=O)O)N=O	{1: 1, 34: 1, 33: 1, 2: 1, 27: 1, 29: 1}
OK	13256-32-1	CNC(=O)N(C)N=O	{1: 2, 34: 1, 33: 1, 24: 1, 29: 1, 31: 1}
OK	13257-44-8	CCCCCCC#CC(OC)OC	{1: 3, 2: 5, 3: 1, 10: 2, 22: 2}
OK	13262-23-2	CC(C)C(OC(C)C)OC(C)C	{1: 6, 3: 4, 22: 2}
OK	132636-26-1	CCCCCCCCCCC=CC(=O)O	{1: 1, 2: 9, 27: 1, 6: 2}
OK	13269-52-8	CCC=CCC	{1: 2, 2: 2, 6: 2}
OK	13271-49-3	CC1(CC(=CC(=O)C1)Br)C	{1: 2, 11: 2, 13: 1, 14: 1, 15: 1, 18: 1, 25: 1}
OK	13273-84-2	CCCCCC1(OCC(CO1)(C)C)C	{1: 4, 2: 4, 11: 2, 13: 2, 23: 2}
OK	132739-31-2	CC(COC(C)(C)C)OCCCO	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1, 22: 2}
OK	13275-18-8	CC(CCC(C)Cl)Cl	{1: 2, 2: 2, 3: 2, 17: 2}
OK	132752-18-2	CCCCCCCCOC(=O)CCCCC(=O)OCCCCCC	{1: 2, 2: 16, 28: 2}
OK	13278-11-0	CC1CC(CC(C1)(CC(=O)OC(C)(C)C)O)(C)C	{1: 6, 2: 1, 4: 1, 11: 3, 12: 1, 13: 2, 20: 1, 28: 1}
OK	13278-12-1	CC(C)(C)C1CCC(CC1)(CC(=O)OC(C)(C)C)O	{1: 6, 2: 1, 4: 2, 11: 4, 12: 1, 13: 1, 20: 1, 28: 1}
OK	13279-24-8	CNC(=O)N1CC1	{24: 1, 1: 1, 11: 2, 33: 1, 31: 1}
OK	13279-85-1	CCCC(Cl)(Cl)Cl	{1: 1, 2: 2, 4: 1, 17: 3}
OK	13279-87-3	CC(CC(Cl)Cl)Cl	{1: 1, 2: 1, 3: 2, 17: 3}
OK	13280-07-4	C(C#CCCl)O	{17: 1, 2: 2, 20: 1, 10: 2}
OK	13281-11-3	CCCCCCCC(C)S	{1: 2, 2: 6, 3: 1, 39: 1}
OK	13282-82-1	CCCCOCC(COC(=O)C=C)O	{1: 1, 2: 5, 3: 1, 5: 1, 6: 1, 20: 1, 22: 1, 28: 1}
OK	13284-42-9	CCC=CC#N	{1: 1, 2: 1, 37: 1, 6: 2}
OK	13286-71-0	CC(C)CCCCCCCCC(C)C	{1: 4, 2: 8, 3: 2}
OK	13286-73-2	CCCCCCCCCCC(CC)CC	{1: 3, 2: 11, 3: 1}
OK	13286-90-3	CC(C)CCSC	{40: 1, 1: 3, 2: 2, 3: 1}
OK	13286-91-4	CCCC(C)SC	{40: 1, 1: 3, 2: 2, 3: 1}
OK	13286-92-5	CCC(C)(C)SC	{40: 1, 1: 4, 2: 1, 4: 1}
OK	13287-19-9	CCCCCC(C(C)C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	13287-21-3	CCCCCCCC(C)CCCCC	{1: 3, 2: 10, 3: 1}
OK	13287-23-5	CCCCCCCCCC(C)CCCCCCC	{1: 3, 2: 14, 3: 1}
OK	13288-50-1	CCCCCCCCCCC(C)NC(=O)C=C	{1: 2, 2: 9, 3: 1, 5: 1, 6: 1, 24: 1, 31: 1}
OK	132911-34-3	C1CC=C/C(=C/2\CCCC=C2)/C1	{11: 6, 14: 4, 15: 2}
OK	132911-35-4	C1CC=C/C(=C\2/CCCC=C2)/C1	{11: 6, 14: 4, 15: 2}
OK	13293-47-5	C[C@H]1[C@@H]2C[C@@H](C2(C)C)C[C@@H]1N	{1: 3, 11: 2, 12: 4, 13: 1, 30: 1}
OK	13294-71-8	CC=C(C)Br	{1: 2, 18: 1, 6: 1, 7: 1}
OK	13294-73-0	CC(C)(C)C1CCC(=C)CC1	{1: 3, 4: 1, 5: 1, 11: 4, 12: 1, 15: 1}
OK	13296-76-9	CCCCC=CC=CC=CCCCCCCCC(=O)O	{1: 1, 2: 10, 27: 1, 6: 6}
OK	133-06-2	C1C=CCC2C1C(=O)N(C2=O)SC(Cl)(Cl)Cl	{33: 1, 4: 1, 40: 1, 11: 2, 12: 2, 14: 2, 17: 3, 25: 2}
OK	133-08-4	CCCCC(C(=O)OCC)C(=O)OCC	{1: 3, 2: 5, 3: 1, 28: 2}
OK	133-13-1	CCC(C(=O)OCC)C(=O)OCC	{1: 3, 2: 3, 3: 1, 28: 2}
OK	133-21-1	C1C=CC2C1C3CC2C(C3)O	{20: 1, 11: 3, 12: 5, 14: 2}
OK	133-37-9	C(C(C(=O)O)O)(C(=O)O)O	{27: 2, 3: 2, 20: 2}
OK	1330-61-6	CC(C)CCCCCCCOC(=O)C=C	{1: 2, 2: 7, 3: 1, 5: 1, 6: 1, 28: 1}
OK	1330-76-3	CC(C)CCCCCOC(=O)C=CC(=O)OCCCCCC(C)C	{1: 4, 2: 10, 3: 2, 28: 2, 6: 2}
OK	1330-86-5	CC(C)CCCCCOC(=O)CCCCC(=O)OCCCCCC(C)C	{1: 4, 2: 14, 3: 2, 28: 2}
OK	13303-30-5	CC(=C=C1C(C1(C)C)(C)C)C	{8: 1, 1: 6, 15: 1, 13: 2, 7: 1}
OK	13304-29-5	CCN(CC)/N=N/N(CC)CC	{1: 4, 2: 4, 34: 2, 33: 2}
OK	13304-31-9	CC(C)N(C(C)C)N=NN(C(C)C)C(C)C	{1: 8, 34: 2, 3: 4, 33: 2}
OK	13306-59-7	C(CS)OC(=O)C(Cl)(Cl)Cl	{17: 3, 2: 2, 4: 1, 28: 1, 39: 1}
OK	1331-07-3	C(CO)C(O)Cl	{17: 1, 2: 2, 3: 1, 20: 2}
OK	1331-17-5	CC(CO)OCC=C	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 20: 1, 22: 1}
OK	1331-39-1	CCCCC(C)C(C)(C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	1331-45-9	CCC1(CCCCC1OC(=O)C)C#N	{1: 2, 2: 1, 37: 1, 11: 4, 12: 1, 13: 1, 28: 1}
OK	1331-50-6	CCCCC(C)C(C)C(C)C(=O)C	{24: 1, 1: 5, 2: 3, 3: 3}
OK	13311-57-4	C1CCC(CC1)NC(=O)N2CC2	{24: 1, 33: 1, 11: 7, 12: 1, 31: 1}
OK	13312-52-2	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(/C)\C=C\C2=C(CCCC2(C)C)C)/C)/C	{1: 10, 6: 14, 7: 4, 11: 6, 13: 2, 15: 4}
OK	13313-91-2	CCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 2, 4: 1, 28: 1, 17: 3}
OK	13315-23-6	CC1C=NNC1=O	{32: 1, 1: 1, 35: 1, 12: 1, 14: 1, 25: 1}
OK	13320-56-4	CCCCC(Br)Br	{1: 1, 2: 3, 3: 1, 18: 2}
OK	13322-87-7	CO[C@@H]1[C@@H]2[C@H](O[C@@H]1[C@H](CO)O)OC3(O2)CCCCC3	{1: 1, 2: 1, 3: 1, 11: 5, 12: 4, 13: 1, 20: 2, 22: 1, 23: 3}
OK	13325-10-5	C(CCO)CN	{2: 4, 20: 1, 30: 1}
OK	13327-56-5	CCOC(=O)CCSC	{40: 1, 1: 2, 2: 3, 28: 1}
OK	13329-71-0	CCCCCCCCCCCCCCCCCCNC(C)C	{1: 3, 2: 17, 3: 1, 31: 1}
OK	1333-71-7	CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H]([C@H]([C@@H]([C@@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC)O)O)O	{1: 3, 2: 44, 3: 4, 6: 6, 20: 3, 28: 3}
OK	13332-20-2	CC1CCC(CC1)OC(=O)C	{1: 2, 11: 4, 12: 2, 28: 1}
OK	13337-79-6	CCN1C=CC=CC1=O	{1: 1, 2: 1, 33: 1, 14: 4, 25: 1}
OK	13343-98-1	CCCCOCCOC	{1: 2, 2: 5, 22: 2}
OK	13344-00-8	CCOCCCCOCC	{1: 2, 2: 6, 22: 2}
OK	13344-50-8	CCOC(=O)CN(C)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 28: 1, 29: 1}
OK	133445-85-9	COC=CC=C(C(=O)OC)C(=O)OC	{1: 3, 28: 2, 22: 1, 6: 3, 7: 1}
OK	13345-50-1	CCCCCC(C=CC1C=CC(=O)C1CC=CCCCC(=O)O)O	{1: 1, 2: 8, 3: 1, 6: 4, 12: 2, 14: 2, 20: 1, 25: 1, 27: 1}
OK	13349-10-5	C1C2CC3C4C1C5C6CC7CC(C6C4)C3C5(C2)C7	{11: 7, 12: 10, 13: 1}
OK	13349-82-1	C1CN(CCN1)CCOCCO	{32: 1, 33: 1, 2: 4, 11: 4, 20: 1, 22: 1}
OK	1335-18-8	CC1C=CCC(C1OC(=O)C)C(C)C	{1: 4, 3: 1, 11: 1, 12: 3, 14: 2, 28: 1}
OK	1335-48-4	CC(CCCC(=CCO)C)CCC=C(C)C	{1: 4, 2: 6, 3: 1, 6: 2, 7: 2, 20: 1}
OK	1335-49-5	CCCCCCCCCCCCCCCC(=O)OC(C)C(=O)OCC(CO)O	{1: 2, 2: 16, 3: 2, 20: 2, 28: 2}
OK	1335-66-6	CC1CC(=CC(C1C=O)C)C.CC1C=C(CC(C1C)C=O)C	{1: 6, 11: 2, 12: 6, 14: 2, 15: 2, 26: 2}
OK	13350-64-6	C1CCC2C=CC(C1)S2	{41: 1, 11: 4, 12: 2, 14: 2}
OK	13351-29-6	CC12CCCCC1CC(=O)C2	{1: 1, 11: 6, 12: 1, 13: 1, 25: 1}
OK	13358-02-6	CC1C=CCC(C1(C#N)C#N)(C#N)C#N	{1: 1, 37: 4, 11: 1, 12: 1, 13: 2, 14: 2}
OK	13358-76-4	CC1(CC(=CC(=O)C1)N2CCCCC2)C	{1: 2, 33: 1, 11: 7, 13: 1, 14: 1, 15: 1, 25: 1}
OK	13360-61-7	CCCCCCCCCCCCCC=C	{1: 1, 2: 12, 5: 1, 6: 1}
OK	13360-63-9	CCCCNCC	{1: 2, 2: 4, 31: 1}
OK	13361-31-4	CC(C)COC(=O)CC#N	{1: 2, 2: 2, 3: 1, 28: 1, 37: 1}
OK	13361-32-5	C=CCOC(=O)CC#N	{2: 2, 28: 1, 5: 1, 6: 1, 37: 1}
OK	13361-34-7	CCCCC(CC)COC(=O)CC#N	{1: 2, 2: 6, 3: 1, 28: 1, 37: 1}
OK	13361-35-8	CC(C)COC(=O)CCl	{1: 2, 2: 2, 3: 1, 28: 1, 17: 1}
OK	13361-36-9	COCCOC(=O)CCl	{1: 1, 2: 3, 28: 1, 22: 1, 17: 1}
OK	13361-63-2	CC(C)(C)CC#C	{1: 3, 2: 1, 4: 1, 10: 1, 9: 1}
OK	13362-52-2	C(CCCCCCO)CCCCCCO	{2: 13, 20: 2}
OK	13364-16-4	CCCC(C)CN	{1: 2, 2: 3, 3: 1, 30: 1}
OK	13366-73-9	C12C3C(C4C1C5(C(C3(C4(C5(Cl)Cl)Cl)Cl)Cl)Cl)C6C2O6	{17: 6, 12: 8, 13: 4, 23: 1}
OK	13367-29-8	C1CC2CCC2C=C1	{11: 4, 12: 2, 14: 2}
OK	13368-65-5	C[C@@H]1CCCC(=O)C1	{1: 1, 11: 4, 12: 1, 25: 1}
OK	1337-59-3	CCC(=O)OCCNC(=O)C[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 4, 33: 1, 14: 5, 17: 1, 24: 1, 28: 1, 31: 1}
OK	1337-83-3	CCCCCCCCC=CC=O	{1: 1, 2: 7, 26: 1, 6: 2}
OK	1337-89-9	CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)O)C.C(C(CO)O)O	{1: 4, 2: 2, 3: 2, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 20: 3, 27: 1}
OK	13373-83-6	CCCCCCCCCCCCCCCCCCOC(=O)CCC	{1: 2, 2: 19, 28: 1}
OK	13373-97-2	CCCCCCCCCCCCCCCCCCCCS	{1: 1, 2: 19, 39: 1}
OK	13377-46-3	C1CC2CC1C3C2C3	{11: 4, 12: 4}
OK	1338-23-4	CCC(C)(OO)OOC(C)(CC)OO	{1: 4, 2: 2, 4: 2, 22: 4, 20: 2}
OK	1338-40-5	CCCCCCCCCCCCCCCC(=O)OCC([C@@H]1[C@H]([C@@H](CO1)O)O)O	{1: 1, 2: 15, 3: 1, 11: 1, 12: 3, 20: 3, 23: 1, 28: 1}
OK	1338-41-6	CCCCCCCCCCCCCCCCCC(=O)OCC([C@@H]1[C@H]([C@@H](CO1)O)O)O	{1: 1, 2: 17, 3: 1, 11: 1, 12: 3, 20: 3, 23: 1, 28: 1}
OK	13380-94-4	C1CC2C(C1)C3CC2CC3=O	{25: 1, 11: 5, 12: 4}
OK	13382-27-9	C([C@H]([C@@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O	{27: 1, 2: 1, 3: 4, 20: 5}
OK	13388-93-7	CC(=O)C1(CCCC1)C	{24: 1, 1: 2, 11: 4, 13: 1}
OK	13389-42-9	C/C=C/CCCCC	{1: 2, 2: 4, 6: 2}
OK	13392-28-4	CC(C12CC3CC(C1)CC(C3)C2)N	{1: 1, 3: 1, 11: 6, 12: 3, 13: 1, 30: 1}
OK	13393-64-1	C=CCCC=CCCC=C	{2: 4, 5: 2, 6: 4}
OK	13393-65-2	CCCC(C)(C#N)N=NC(C)(CCC)C#N	{1: 4, 2: 4, 4: 2, 34: 2, 37: 2}
OK	13395-36-3	CCOC(=O)C(=O)CC(=O)C(C)(C)C	{24: 2, 1: 4, 2: 2, 4: 1, 28: 1}
OK	13395-71-6	CC1=CC(CCC1=O)(C)C	{1: 3, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	13395-73-8	CC1CC(C=CC1=O)(C)C	{1: 3, 11: 1, 12: 1, 13: 1, 14: 2, 25: 1}
OK	133960-97-1	C1C2C=CC(=O)C1C=CC2=O	{25: 2, 11: 1, 12: 2, 14: 4}
OK	134-28-1	CC1CCC(CC2=C1CCC2C)C(C)(C)OC(=O)C	{1: 5, 4: 1, 11: 5, 12: 3, 15: 2, 28: 1}
OK	134-55-4	C[C@@]12CC[C@@](C1(C)C)(OC2=O)C(=O)O	{27: 1, 1: 3, 11: 2, 28: 1, 13: 3}
OK	134-97-4	CCN1CN(C(=O)N(C1)CO)CO	{1: 1, 2: 3, 33: 3, 11: 2, 20: 2, 25: 1}
OK	134003-03-5	C1C[C@H]2C[C@@H]1C(=O)N2	{32: 1, 25: 1, 11: 3, 12: 2}
OK	134003-04-6	C1[C@H](C=C[C@H]1N)C(=O)O	{27: 1, 11: 1, 12: 2, 30: 1, 14: 2}
OK	13401-56-4	CC(C)(CO)CCl	{1: 2, 2: 2, 4: 1, 20: 1, 17: 1}
OK	13401-85-9	CCCCOC(=O)C(=C)Cl	{1: 1, 2: 3, 5: 1, 7: 1, 17: 1, 28: 1}
OK	13402-02-3	CCCCCCCCCCCCCCCCOC(=O)C=C	{1: 1, 2: 15, 28: 1, 5: 1, 6: 1}
OK	13402-35-2	CCC1=CC=CC=CC=C1	{1: 1, 2: 1, 14: 7, 15: 1}
OK	13402-60-3	CCCCCCCCC(C)S	{1: 2, 2: 7, 3: 1, 39: 1}
OK	13404-51-8	CN(C(=O)NCCCNC(=O)N(C)N=O)N=O	{1: 2, 2: 3, 33: 2, 34: 2, 24: 2, 29: 2, 31: 2}
OK	13407-18-6	C=C1CCC=CC1	{11: 3, 5: 1, 14: 2, 15: 1}
OK	1341-38-4	CCCCCCCCCCCCCCCC(=O)OCCCCCC(C)C	{1: 3, 2: 19, 3: 1, 28: 1}
OK	134112-53-1	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCC1CC(=O)N(C1=O)C2CC(NC(C2)(C)C)(C)C	{32: 1, 1: 6, 2: 27, 33: 1, 11: 3, 12: 2, 13: 2, 25: 2, 27: 1}
OK	134166-58-8	CN(C)C=NCC#N	{1: 2, 2: 1, 37: 1, 6: 1, 33: 1, 34: 1}
OK	13417-08-8	CCCCCCCCCCCCCCCCNC	{1: 2, 2: 15, 31: 1}
OK	13417-43-1	CC=C(C)CCl	{1: 2, 2: 1, 17: 1, 6: 1, 7: 1}
OK	13419-46-0	C(C(C(=O)O)N)S/C(=C\Cl)/Cl	{2: 1, 3: 1, 6: 1, 7: 1, 40: 1, 17: 2, 27: 1, 30: 1}
OK	13419-69-7	CCC/C=C/C(=O)O	{1: 1, 2: 2, 27: 1, 6: 2}
OK	134190-54-8	CCC(F)Cl	{16: 1, 1: 1, 2: 1, 3: 1, 17: 1}
OK	13423-15-9	CC1CCOC1	{1: 1, 11: 3, 12: 1, 23: 1}
OK	13426-49-8	CC(=O)OC1C2C=CC1C=C2	{1: 1, 12: 3, 14: 4, 28: 1}
OK	13429-07-7	CC(COCC(C)OC)O	{1: 3, 2: 2, 3: 2, 20: 1, 22: 2}
OK	13429-83-9	CC1(C2(CCC1(OC2=O)C(=O)O)C)C	{27: 1, 1: 3, 11: 2, 28: 1, 13: 3}
OK	13431-59-9	CC(=O)OCC(C)(COC(=O)C)COC(=O)C	{1: 4, 2: 3, 4: 1, 28: 3}
OK	13432-25-2	CCC(C)C(C(C)C)O	{1: 4, 2: 1, 3: 3, 20: 1}
OK	13433-04-0	CC(C)[C@@H](C(=O)O)NC(=O)[C@H](CC(=O)O)N	{1: 2, 2: 1, 3: 3, 24: 1, 27: 2, 30: 1, 31: 1}
OK	13434-12-3	CC(C)CCNC(=O)C	{24: 1, 1: 3, 2: 2, 3: 1, 31: 1}
OK	13436-46-9	CCOC1CCCO1	{1: 1, 2: 1, 11: 3, 12: 1, 22: 1, 23: 1}
OK	13439-84-4	CN=C(N(C)C)N(C)C	{1: 5, 34: 1, 33: 2, 7: 1}
OK	13439-88-8	CCN=C(N(C)C)N(C)C	{1: 5, 2: 1, 34: 1, 33: 2, 7: 1}
OK	13439-89-9	CCN=C(N(CC)CC)N(CC)CC	{1: 5, 2: 5, 34: 1, 33: 2, 7: 1}
OK	13440-19-2	CO[C@H]1[C@H](O[C@H]2[C@@H]1OC3(O2)CCCCC3)[C@H]4COC5(O4)CCCCC5	{1: 1, 11: 11, 12: 5, 13: 2, 22: 1, 23: 5}
OK	13442-89-2	CCCCCOC(C)OCC	{1: 3, 2: 5, 3: 1, 22: 2}
OK	13444-24-1	CCN1CCCC(C1)O	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 20: 1}
OK	13444-71-8	OI(=O)(=O)=O	{19: 1, 20: 1, 29: 3}
OK	13444-85-4	N(I)(I)I	{33: 1, 19: 3}
OK	13444-87-6	N(=O)Br	{18: 1, 34: 1, 29: 1}
OK	134452-44-1	C(C(F)(F)Cl)(C(Cl)(Cl)Cl)(Cl)Cl	{16: 2, 17: 6, 4: 3}
OK	134454-31-2	CCCCCC1C(O1)CC=CO	{1: 1, 2: 5, 6: 2, 12: 2, 20: 1, 23: 1}
OK	13453-03-7	CC(CCOC(=O)C(=C)C)CC(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1, 5: 1, 7: 1, 28: 1}
OK	13465-07-1	SS	{39: 2}
OK	13466-78-9	CC1=CCC2C(C1)C2(C)C	{1: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1}
OK	13467-82-8	CCCCCCCC(=O)OOC(C)(C)C	{1: 4, 2: 6, 4: 1, 22: 1, 28: 1}
OK	13471-42-6	CCC[C@@H](CC)O	{1: 2, 2: 3, 3: 1, 20: 1}
OK	13472-08-7	CCC(C)(C#N)N=NC(C)(CC)C#N	{1: 4, 2: 2, 4: 2, 34: 2, 37: 2}
OK	13474-70-9	C1CC2(CCC1C2)Br	{18: 1, 11: 5, 12: 1, 13: 1}
OK	13475-47-3	CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCC(=O)OCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 44, 28: 2}
OK	13475-76-8	CCCCCCCCCCCC(CCCC)CCCCCCCCCC	{1: 3, 2: 22, 3: 1}
OK	13475-77-9	CCCCCCCCCCCC(CCCCCCCC)CCCCCCCC	{1: 3, 2: 24, 3: 1}
OK	13475-78-0	CCC(CC)CCC(C)C	{1: 4, 2: 4, 3: 2}
OK	13475-79-1	CC(C)C(C(C)C)C(C)C	{1: 6, 3: 4}
OK	13475-81-5	CCCC(C)(C)C(C)(C)C	{1: 6, 2: 2, 4: 2}
OK	13475-82-6	CC(CC(C)(C)C)CC(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	134769-33-8	C=CCCCCCCCC=CCC#N	{2: 8, 5: 1, 6: 3, 37: 1}
OK	13482-06-9	CCCCCCCCCCCCCC(=O)NCCCN	{24: 1, 1: 1, 2: 15, 30: 1, 31: 1}
OK	13483-18-6	C(COCCl)OCCl	{17: 2, 2: 4, 22: 2}
OK	13483-31-3	CC(=NN(C)C)C	{1: 4, 34: 1, 33: 1, 7: 1}
OK	13483-58-4	CCCCCCCCCCCCCCCCCC(=O)NCCCN(C)CCCNC(=O)CCCCCCCCCCCCCCCCC	{24: 2, 1: 3, 2: 38, 33: 1, 31: 2}
OK	134849-13-1	C=CCCCCCCCCC=CC#N	{2: 8, 5: 1, 6: 3, 37: 1}
OK	13487-64-4	CCCC1CCC=CC1	{1: 1, 2: 2, 11: 3, 12: 1, 14: 2}
OK	13487-72-4	CC1(C2CCC(C2)(C1=C)N)C	{1: 2, 5: 1, 11: 3, 12: 1, 13: 2, 15: 1, 30: 1}
OK	13490-36-3	CCCCCCCCCC(C)CC(=O)O	{27: 1, 1: 2, 2: 9, 3: 1}
OK	13491-79-7	CC(C)(C)C1CCCCC1O	{1: 3, 11: 4, 4: 1, 12: 2, 20: 1}
OK	13494-06-9	CC1CC(=O)C(=O)C1C	{1: 2, 11: 1, 12: 2, 25: 2}
OK	13494-07-0	CC1CC(C(=O)C1=O)C	{1: 2, 11: 1, 12: 2, 25: 2}
OK	134971-34-9	CCOCCCCCCCC/C=C/CCCCCCCCCCCCN	{1: 1, 2: 21, 30: 1, 22: 1, 6: 2}
OK	13501-73-0	CC(C)CC(C)CCO	{1: 3, 2: 3, 3: 2, 20: 1}
OK	13505-34-5	CC(=O)CCCC(=O)C	{24: 2, 1: 2, 2: 3}
OK	135053-11-1	C1C[C@H]([C@H](C1)N)C(=O)N	{24: 1, 11: 3, 12: 2, 30: 2}
OK	13511-13-2	C=CCC1=CCCCC1	{2: 1, 5: 1, 6: 1, 11: 4, 14: 1, 15: 1}
OK	13511-38-1	CC(C)(CCl)C(=O)O	{1: 2, 2: 1, 27: 1, 4: 1, 17: 1}
OK	13514-03-9	CN1C2CCC1CC(C2)Cl	{1: 1, 11: 4, 12: 3, 33: 1, 17: 1}
OK	13515-93-0	CNCC(=O)OC.Cl	{1: 2, 2: 1, 31: 1, 28: 1, 17: 1}
OK	13517-11-8	OBr	{18: 1, 20: 1}
OK	13529-51-6	C(CO)N(CCO)N	{33: 1, 2: 4, 20: 2, 30: 1}
OK	13531-52-7	C(CN)CNCCN	{2: 5, 30: 2, 31: 1}
OK	13531-82-3	CC(C)C(=O)C#C	{24: 1, 1: 2, 10: 1, 3: 1, 9: 1}
OK	13532-18-8	COC(=O)CCSC	{40: 1, 1: 2, 2: 2, 28: 1}
OK	13532-77-9	CC(C)(CCCN)CO	{1: 2, 2: 4, 4: 1, 30: 1, 20: 1}
OK	13532-94-0	CCCCOCCOC(=O)C(=C)C	{1: 2, 2: 5, 5: 1, 7: 1, 22: 1, 28: 1}
OK	13533-05-6	C=CC(=O)OCCOCCO	{2: 4, 5: 1, 6: 1, 20: 1, 22: 1, 28: 1}
OK	13533-08-9	CCCCCCCCC=CCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 15, 5: 1, 6: 2, 7: 1, 28: 1}
OK	13533-18-1	CCCCCCCCC=CCCCCCCCCOC(=O)C=C	{1: 1, 2: 15, 28: 1, 5: 1, 6: 3}
OK	13534-15-1	CCOC(=N)C(=N)OCC	{1: 2, 2: 2, 36: 2, 22: 2, 7: 2}
OK	13536-95-3		{}
OK	13537-45-6	NN.F.F	{16: 2, 30: 2}
OK	135397-33-0	CCCCCCCCCCCCCCC=C.CCCCCCCCCCCCC=C.COCCOCCOC(=O)/C=C\C(=O)OCCOCCOC	{1: 4, 2: 32, 5: 2, 6: 4, 22: 4, 28: 2}
OK	135429-21-9	C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{2: 5, 3: 8, 4: 1, 20: 12, 26: 1, 27: 3}
OK	13545-04-5	CC(C(C)C(=O)O)C(=O)O	{27: 2, 1: 2, 3: 2}
OK	13547-70-1	CC(C)(C)C(=O)CCl	{24: 1, 1: 3, 2: 1, 4: 1, 17: 1}
OK	13552-21-1	CCC(CN)O	{1: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	13552-80-2	CCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCC)OC(=O)CCCCCCCCCC	{1: 3, 2: 29, 3: 1, 28: 3}
OK	13552-96-0	CCCCC/C=C\C/C=C\C=C\C=O	{1: 1, 2: 5, 26: 1, 6: 6}
OK	13553-19-0	C1CCC(C(CC1)O)O	{20: 2, 11: 5, 12: 2}
OK	13558-70-8	COC(=O)NC(=O)CCl	{1: 1, 2: 1, 17: 1, 24: 1, 28: 1, 31: 1}
OK	13559-66-5	CC1(C2CCC1(/C(=N/O)/C2)C)C	{1: 3, 34: 1, 11: 3, 12: 1, 13: 2, 15: 1, 20: 1}
OK	13560-89-9	C1CC2C(CCC3C1C4(C(=C(C3(C4(Cl)Cl)Cl)Cl)Cl)Cl)C5(C(=C(C2(C5(Cl)Cl)Cl)Cl)Cl)Cl	{17: 12, 11: 4, 12: 4, 13: 6, 15: 4}
OK	135616-36-3	CC(C)(C)C1=CC(=CN[C@H]2CCCC[C@@H]2NC=C3C=C(C=C(C3=O)C(C)(C)C)C(C)(C)C)C(=O)C(=C1)C(C)(C)C	{1: 12, 4: 4, 6: 2, 11: 4, 12: 2, 14: 4, 15: 6, 25: 2, 31: 2}
OK	135616-40-9	CC(C1=C/C(=C/N[C@H]2[C@@H](CCCC2)N/C=C/3\C(=O)C(=CC(=C3)C(C)(C)C)C(C)(C)C)/C(=O)C(=C1)C(C)(C)C)(C)C	{1: 12, 4: 4, 6: 2, 11: 4, 12: 2, 14: 4, 15: 6, 25: 2, 31: 2}
OK	13562-76-0	CCC(C)OC(=O)CC(=O)C	{24: 1, 1: 3, 2: 2, 3: 1, 28: 1}
OK	13562-84-0	CCCCCCOC(=O)CC(=O)C	{24: 1, 1: 2, 2: 6, 28: 1}
OK	13567-39-0	CC1CCC2C13CC(C2(C)C)C4(C(C3)O4)C	{1: 4, 11: 4, 12: 4, 13: 3, 23: 1}
OK	13574-14-6	CN(C)CC(=O)N(C)C	{24: 1, 1: 4, 2: 1, 33: 2}
OK	13576-20-0	CN1C(=O)N(N=N1)C	{1: 2, 35: 2, 33: 2, 25: 1}
OK	135876-36-7	C=COCCCCOC(=O)CCCCC(=O)OCCCCOC=C	{2: 12, 22: 2, 28: 2, 5: 2, 6: 2}
OK	13588-94-8	CC(C)C(C(=O)NC(CO)C(=O)O)N	{1: 2, 2: 1, 3: 3, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	13589-15-6	COC(=O)N(CCCl)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 17: 1, 28: 1, 29: 1}
OK	13590-97-1	CCCCCCCCCCCCN=C(N)N.Cl	{1: 1, 2: 11, 7: 1, 34: 1, 17: 1, 30: 2}
OK	13598-46-4	N[NH]	{36: 1, 30: 1}
OK	136-84-5	C1CN(C(=O)N1CO)CO	{25: 1, 2: 2, 11: 2, 20: 2, 33: 2}
OK	13601-94-0	C(C(C(=O)N)(Cl)Cl)Cl	{24: 1, 17: 3, 2: 1, 4: 1, 30: 1}
OK	13602-13-6	CC=C(CCl)Cl	{1: 1, 2: 1, 17: 2, 6: 1, 7: 1}
OK	13603-04-8	CC1CC(NC1)C	{32: 1, 1: 2, 11: 2, 12: 2}
OK	13603-07-1	CC1CCCN(C1)N=O	{1: 1, 34: 1, 33: 1, 11: 4, 12: 1, 29: 1}
OK	13609-67-1	CCCC(=O)OC1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)O)C)C(=O)CO	{1: 3, 2: 3, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	136115-65-6	CCOC(=O)C=CSC	{40: 1, 1: 2, 2: 1, 28: 1, 6: 2}
OK	13612-59-4	C1=CC=CC(C=C1)C#N	{12: 1, 37: 1, 14: 6}
OK	136133-88-5	CCCCCCOC(=O)CCCCC(=O)OC1CCCCC1	{1: 1, 2: 9, 11: 5, 12: 1, 28: 2}
OK	136135-20-1	C(=C(N=O)Cl)(NO)Cl	{34: 1, 7: 2, 17: 2, 20: 1, 29: 1, 31: 1}
OK	136155-46-9	CCCCCCCCCCC(CCCCCCCC)(C(C)O)O.C(CCC(=O)O)CC(=O)O	{1: 3, 2: 20, 3: 1, 4: 1, 20: 2, 27: 2}
OK	13618-93-4	C1CCN2CCCC2C1	{33: 1, 11: 7, 12: 1}
OK	13623-94-4	CSC(=C[N+](=O)[O-])SC	{40: 2, 1: 2, 38: 1, 6: 1, 7: 1}
OK	136315-70-3	CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1C(=O)O	{1: 3, 4: 1, 11: 3, 12: 2, 27: 1, 28: 1, 31: 1}
OK	13637-87-1	N(F)(F)Cl	{16: 2, 17: 1, 33: 1}
OK	13639-16-2	C(C(=O)S)(Cl)Cl	{24: 1, 17: 2, 3: 1, 39: 1}
OK	13643-05-5	CC(C)C=C=C	{8: 1, 1: 2, 3: 1, 5: 1, 6: 1}
OK	13643-08-8	CCCC=CC=CC	{1: 2, 2: 2, 6: 4}
OK	13643-42-0	CC=CC(=O)NCCN1CCNC1=O	{32: 1, 1: 1, 2: 2, 6: 2, 33: 1, 11: 2, 24: 1, 25: 1, 31: 1}
OK	136440-22-7	CC1=NC([N+](=C1)[O-])(C)C	{1: 3, 35: 1, 33: 1, 13: 1, 14: 1, 15: 1, 29: 1}
OK	136465-81-1	CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1	{32: 1, 1: 3, 4: 1, 11: 6, 12: 3, 24: 1, 31: 1}
OK	13647-35-3	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@]45[C@@]3(CC(=C([C@H]4O5)O)C#N)C	{1: 2, 37: 1, 11: 7, 12: 5, 13: 3, 15: 2, 20: 2, 23: 1}
OK	136494-33-2	C1[C@@H]([C@H](O[C@H]1N2C=NC3C2=N/C(=N/O)/N=C3N)CO)O	{33: 1, 2: 1, 35: 3, 11: 1, 12: 4, 34: 1, 14: 1, 15: 3, 20: 3, 23: 1, 30: 1}
OK	13652-33-0	CC1CCCC(C1=N)C	{1: 2, 11: 3, 12: 2, 36: 1, 15: 1}
OK	13657-68-6	C[C@H]1CC/C=C(/CC(=O)[C@@H](CC1=O)C(C)C)\C	{1: 4, 3: 1, 11: 4, 12: 2, 14: 1, 15: 1, 25: 2}
OK	136587-13-8	C(CCN(CCCN)N(N=O)O)CNCCCN	{33: 2, 2: 10, 34: 1, 20: 1, 29: 1, 30: 2, 31: 1}
OK	136630-09-6	C1CC23CCC2(C1)CC=CC3	{11: 7, 13: 2, 14: 2}
OK	136630-10-9	C1CC23CCC=CC2(C1)C3	{11: 6, 13: 2, 14: 2}
OK	13668-61-6	C1CC(C=C1)CC(=O)O	{27: 1, 2: 1, 11: 2, 12: 1, 14: 2}
OK	13669-28-8	CN1CCC(=C)CC1	{1: 1, 33: 1, 11: 4, 5: 1, 15: 1}
OK	13670-31-0	CC(CO)C1=NCCO1	{1: 1, 2: 1, 3: 1, 11: 2, 15: 1, 35: 1, 20: 1, 23: 1}
OK	136705-66-3	CC[C@@H](CC[C@H](CC)O)O	{1: 2, 2: 4, 3: 2, 20: 2}
OK	13675-27-9	C=CCOC(=O)C/C(=C/C(=O)OCC=C)/C(=O)OCC=C	{2: 4, 28: 3, 5: 3, 6: 4, 7: 1}
OK	13678-58-5	CCC(=O)CSC	{24: 1, 1: 2, 2: 2, 40: 1}
OK	13679-85-1	CC1C(=O)CCS1	{1: 1, 11: 2, 12: 1, 41: 1, 25: 1}
OK	13681-75-9	CCCCCCCCOC1=CC(=O)C(=C2NC(=C3C=CC(=CC3=O)OCCCCCCCC)NC(=C4C=CC(=CC4=O)OCCCCCCCC)N2)C=C1	{32: 3, 1: 3, 2: 21, 14: 9, 15: 9, 22: 3, 25: 3}
OK	13688-67-0	C=CCCCCCCCC=C	{2: 7, 5: 2, 6: 2}
OK	13695-31-3	CC(=C)C(=O)OCC(C(C(F)(F)F)(F)F)(F)F	{1: 1, 2: 1, 4: 3, 5: 1, 7: 1, 16: 7, 28: 1}
OK	136954-20-6	CCCC(CCOC(=O)C)S	{1: 2, 2: 4, 3: 1, 28: 1, 39: 1}
OK	136954-25-1	CCCC(CCOC(=O)C)SC(=O)C	{1: 3, 2: 4, 3: 1, 40: 1, 24: 1, 28: 1}
OK	13697-84-2	CC1=CCC=C(C1)OC	{1: 2, 11: 2, 22: 1, 14: 2, 15: 2}
OK	13698-16-3	CCOC(=O)N(Cl)Cl	{1: 1, 2: 1, 28: 1, 33: 1, 17: 2}
OK	137-03-1	CCCCCCCC1CCCC1=O	{1: 1, 2: 6, 11: 3, 12: 1, 25: 1}
OK	137-05-3	COC(=O)C(=C)C#N	{1: 1, 37: 1, 28: 1, 5: 1, 7: 1}
OK	137-18-8	CC1=CC(=O)C(=CC1=O)C	{1: 2, 25: 2, 14: 2, 15: 2}
OK	137-32-6	CCC(C)CO	{1: 2, 2: 2, 3: 1, 20: 1}
OK	137-43-9	C1CCC(C1)Br	{18: 1, 11: 4, 12: 1}
OK	13702-09-5	C#CCSCC#C	{40: 1, 9: 2, 2: 2, 10: 2}
OK	13706-86-0	CC(C)CC(=O)C(=O)C	{24: 2, 1: 3, 2: 1, 3: 1}
OK	137085-37-1	CC[C@@H](/C=C/C1=C(CCCC1(C)C)C)OC(=O)C	{1: 5, 2: 1, 3: 1, 6: 2, 11: 3, 13: 1, 15: 2, 28: 1}
OK	13709-35-8	FSSF	{16: 2, 40: 2}
OK	13720-37-1	CC1=CCCC(C1CCC(C)O)(C)C	{1: 4, 2: 2, 3: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	13721-54-5	CCC#CC=C	{1: 1, 2: 1, 10: 2, 5: 1, 6: 1}
OK	137250-78-3	CC(C)CCCC(C)CC(OC)OC	{1: 5, 2: 4, 3: 3, 22: 2}
OK	13726-67-5	CC(C)(C)OC(=O)N[C@@H](CC(=O)O)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 27: 2, 28: 1, 31: 1}
OK	13726-85-7	CC(C)(C)OC(=O)N[C@@H](CCC(=O)N)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
OK	13730-34-2	CCSSSSCC	{40: 4, 1: 2, 2: 2}
OK	137310-67-9	C=CCCCCCC[C@@H]1CO1	{2: 6, 5: 1, 6: 1, 11: 1, 12: 1, 23: 1}
OK	13734-28-6	CC(C)(C)OC(=O)N[C@@H](CCCCN)C(=O)O	{1: 3, 2: 4, 3: 1, 4: 1, 27: 1, 28: 1, 30: 1, 31: 1}
OK	13734-36-6	CC(C)(C)OC(=O)N(C)CC(=O)O	{1: 4, 2: 1, 4: 1, 33: 1, 27: 1, 28: 1}
OK	13734-41-3	CC(C)[C@@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 5, 3: 2, 4: 1, 27: 1, 28: 1, 31: 1}
OK	137394-53-7	CN1C=CC(=O)N(C1=O)CCCN2C(=O)C=CN(C2=O)CC(=O)OC	{1: 2, 2: 4, 33: 4, 14: 4, 25: 4, 28: 1}
OK	137394-54-8	CN1C2C3C4C2N(C(=O)N(C4=O)CCCN(C3=O)C1=O)CC(=O)OC	{1: 2, 2: 1, 33: 4, 11: 3, 12: 4, 25: 4, 28: 1}
OK	13743-07-2	C(CO)N(C(=O)N)N=O	{33: 1, 2: 2, 34: 1, 20: 1, 24: 1, 29: 1, 30: 1}
OK	13747-10-9	C1CCCCC(=O)CCCCCCCCC(=O)CCC1	{25: 2, 11: 16}
OK	13747-12-1	CC1(CN(C(=O)N(C1OC)CO)CO)C	{1: 3, 2: 2, 33: 2, 11: 1, 12: 1, 13: 1, 20: 2, 22: 1, 25: 1}
OK	13747-73-4	CC(=C1CCCCC1=O)C	{15: 1, 1: 2, 11: 4, 25: 1, 7: 1}
OK	13748-90-8	CC(C)C[C@@H](C(=O)O)O	{27: 1, 1: 2, 2: 1, 3: 2, 20: 1}
OK	13749-37-6	C(CBr)C(Cl)(Cl)Cl	{17: 3, 2: 2, 4: 1, 18: 1}
OK	13749-38-7	C(C(Cl)(Cl)Br)(Cl)Br	{17: 3, 18: 2, 3: 1, 4: 1}
OK	13750-57-7	CCC=CCN1CCCC1	{1: 1, 2: 2, 11: 4, 6: 2, 33: 1}
OK	13752-78-8	CC#CC#N	{1: 1, 10: 2, 37: 1}
OK	13756-48-4	CCOC(=O)NCC#N	{1: 1, 2: 2, 28: 1, 37: 1, 31: 1}
OK	137600-44-3	CCCCCCCCCCCCC(=O)OC(C)(C)C	{1: 4, 2: 11, 4: 1, 28: 1}
OK	137605-95-9	CCCCC(CC)(CCCN)CN	{1: 2, 2: 8, 4: 1, 30: 2}
OK	13762-80-6	NN.OCl(=O)(=O)=O	{17: 1, 20: 1, 29: 3, 30: 2}
OK	137675-05-9	CC(C)N1C(N1)(C)C	{32: 1, 1: 4, 3: 1, 13: 1, 33: 1}
OK	137682-89-4	CCOC(=O)C1(CC1)O	{1: 1, 2: 1, 11: 2, 13: 1, 20: 1, 28: 1}
OK	137694-75-8	CC(=O)O.CN=C(N)NCCC[C@H](C(=O)O)N	{1: 2, 2: 3, 3: 1, 7: 1, 34: 1, 27: 2, 30: 2, 31: 1}
OK	137717-38-5	CCOC(=O)C=C.CC=C.CC(=C)C(=O)OC	{1: 4, 2: 1, 5: 3, 6: 2, 7: 1, 28: 2}
OK	13775-80-9	NN.Br	{18: 1, 30: 2}
OK	13776-62-0	F/N=N/F	{16: 2, 34: 2}
OK	137796-03-3	CC(C)CCCCCCNC1=CCC2=C3C1=CC=C[C@@H]3C(=O)N(C2=O)CCCCCCC(C)C	{1: 4, 2: 12, 3: 2, 33: 1, 11: 1, 12: 1, 14: 4, 15: 4, 25: 2, 31: 1}
OK	137796-06-6	CCC1COC(N1)(C)CCC(C)C	{32: 1, 1: 4, 2: 3, 3: 1, 11: 1, 12: 1, 13: 1, 23: 1}
OK	13798-23-7	S1SSSSS1	{41: 6}
OK	138-15-8	C(CC(=O)O)C(C(=O)O)N.Cl	{27: 2, 17: 1, 2: 2, 3: 1, 30: 1}
OK	138-22-7	CCCCOC(=O)C(C)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1}
OK	138-59-0	C1C(C(C(C=C1C(=O)O)O)O)O	{11: 1, 12: 3, 14: 1, 15: 1, 20: 3, 27: 1}
OK	138-86-3	CC1=CCC(CC1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	138-87-4	CC(=C)C1CCC(CC1)(C)O	{1: 2, 5: 1, 7: 1, 11: 4, 12: 1, 13: 1, 20: 1}
OK	138-91-0	CC(=C)C1CCC(=CC1)C=NO	{1: 1, 34: 1, 5: 1, 6: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	138000-94-9	CC1(N=C(C=[N+]1[O-])C(=O)OC)C	{1: 3, 35: 1, 33: 1, 13: 1, 14: 1, 15: 1, 28: 1, 29: 1}
OK	13804-51-8	CC/C(=C\CC/C(=C/C(=O)OC)/C)/CCC1C(O1)(C)CC	{1: 5, 2: 6, 6: 2, 7: 2, 12: 1, 13: 1, 23: 1, 28: 1}
OK	13811-71-7	CCOC(=O)[C@H]([C@@H](C(=O)OCC)O)O	{1: 2, 2: 2, 3: 2, 20: 2, 28: 2}
OK	138113-79-8	CCCCCCCCC1=NCCN1CCO	{1: 1, 2: 9, 35: 1, 33: 1, 11: 2, 15: 1, 20: 1}
OK	13812-43-6	F/N=N\F	{16: 2, 34: 2}
OK	138126-79-1	CC(COCC(C)OC(=O)C=C)OCC(C)OC(=O)C=C.C=CC(=O)OCC(CO)(CO)COCC(CO)(CO)CO.C1CCC(=O)OCC1	{1: 3, 2: 11, 3: 3, 4: 2, 5: 3, 6: 3, 11: 5, 20: 5, 22: 3, 28: 4}
OK	13814-25-0	FSF	{16: 2, 40: 1}
OK	13814-27-2	CCC(CO)O.CC(=O)O.CC(=O)O	{27: 2, 1: 3, 2: 2, 3: 1, 20: 2}
OK	13815-46-8	CN(C)C1=CCCCC1	{1: 2, 11: 4, 33: 1, 14: 1, 15: 1}
OK	13817-04-4	N=S=O	{40: 1, 36: 1, 29: 1}
OK	13820-09-2	CCCCC(OC)(OC)OC	{1: 4, 2: 3, 4: 1, 22: 3}
OK	138234-60-3	CCC=CCCC(=O)OCC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	138234-61-4	CCCC=CCCC(=O)OCC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	13828-34-7	CC1CCCC(=C(C)C)C1	{15: 1, 1: 3, 11: 4, 12: 1, 7: 1}
OK	13830-58-5	CN=C(N)NN=O	{1: 1, 34: 2, 7: 1, 29: 1, 30: 1, 31: 1}
OK	13830-89-2	CCC(COC(=O)CC=C)(COC(=O)CC=C)COC(=O)CC=C	{1: 1, 2: 7, 4: 1, 5: 3, 6: 3, 28: 3}
OK	13831-03-3	CC(C)(C)OC(=O)C#C	{1: 3, 10: 1, 4: 1, 28: 1, 9: 1}
OK	13831-30-6	CC(=O)OCC(=O)O	{1: 1, 2: 1, 27: 1, 28: 1}
OK	13831-31-7	CC(=O)OCC(=O)Cl	{24: 1, 1: 1, 2: 1, 28: 1, 17: 1}
OK	13835-41-1	CC(CCC=C(C)C)CC=CC(=O)C	{1: 4, 2: 3, 3: 1, 6: 3, 7: 1, 24: 1}
OK	13837-60-0	CC1(CCCC(O1)(C)C#C)C	{1: 3, 9: 1, 10: 1, 11: 3, 13: 2, 23: 1}
OK	13837-75-7	CC(=C)[C@@H]1CC[C@@]2([C@H](C1)O2)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 2, 13: 1, 23: 1}
OK	13838-16-9	C(C(OC(F)F)(F)F)(F)Cl	{16: 5, 17: 1, 3: 2, 4: 1, 22: 1}
OK	13840-74-9	N(=S=O)SN=S=O	{40: 3, 34: 2, 29: 2}
OK	138434-09-0	C(OO)Cl	{17: 1, 2: 1, 20: 1, 22: 1}
OK	138434-10-3	C(C(OO)Cl)Cl	{17: 2, 2: 1, 3: 1, 20: 1, 22: 1}
OK	13845-23-3	SSS	{40: 1, 39: 2}
OK	13846-31-6	C=CCOC(=O)C1CCCCC1C(=O)OCC=C	{2: 2, 5: 2, 6: 2, 11: 4, 12: 2, 28: 2}
OK	138472-76-1	CCCCCCCCCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 17, 1: 1, 2: 9, 4: 8}
OK	138495-42-8	C(C(C(F)(F)F)F)(C(C(F)(F)F)(F)F)F	{16: 10, 3: 2, 4: 3}
OK	13851-11-1	CC(=O)OC1C(C2CCC1(C2)C)(C)C	{1: 4, 11: 3, 12: 2, 13: 2, 28: 1}
OK	138519-53-6	CCC(CN(CCN1CCNC1=O)CC(COC(=O)C(=C)C)O)O	{32: 1, 1: 2, 2: 6, 3: 2, 5: 1, 7: 1, 11: 2, 20: 2, 25: 1, 33: 2, 28: 1}
OK	13857-12-0	C(CCl)NC(=O)NC(=O)N(CCCl)N=O	{33: 1, 2: 4, 34: 1, 17: 2, 24: 2, 29: 1, 31: 2}
OK	13857-55-1	CCC=C(C)CC=C	{1: 2, 2: 2, 5: 1, 6: 2, 7: 1}
OK	13858-09-8	C(=NCl)=O	{8: 1, 17: 1, 34: 1, 29: 1}
OK	13858-85-0	CON=C1CCCCC1	{1: 1, 34: 1, 11: 5, 22: 1, 15: 1}
OK	13860-68-9	CC(=O)OCCCCCCC#C	{1: 1, 2: 6, 28: 1, 10: 1, 9: 1}
OK	13860-69-0	CN(C(=O)NC(=O)N)N=O	{1: 1, 34: 1, 33: 1, 24: 2, 29: 1, 30: 1, 31: 1}
OK	13860-70-3	C1CC(CCC1C(=O)N(CCCl)N=O)C(=O)N(CCCl)N=O	{33: 2, 2: 4, 11: 4, 12: 2, 34: 2, 17: 2, 24: 2, 29: 2}
OK	13861-22-8	CC(=C)C(=O)OCC#C	{1: 1, 2: 1, 5: 1, 7: 1, 9: 1, 10: 1, 28: 1}
OK	13863-41-7	ClBr	{17: 1, 18: 1}
OK	13863-59-7	FBr	{16: 1, 18: 1}
OK	13865-19-5	COC(=O)CCC=O	{1: 1, 2: 2, 28: 1, 26: 1}
OK	13873-84-2	FI	{16: 1, 19: 1}
OK	13877-91-3	CC(=CC/C=C(\C)/C=C)C	{1: 3, 2: 1, 5: 1, 6: 3, 7: 2}
OK	13877-94-6	CC1(CC2C1CCC3(C(O3)CCC2=C)C)C	{1: 3, 5: 1, 11: 5, 12: 3, 13: 2, 15: 1, 23: 1}
OK	13879-35-1	C(CCCCCCN=C=O)CCCCCN=C=O	{8: 2, 2: 12, 34: 2, 29: 2}
OK	138860-92-1	CCCCCCCCCCCCCCCCCC(=O)O.C(CO)O.C(C(CO)O)O	{27: 1, 1: 1, 2: 20, 3: 1, 20: 5}
OK	138879-90-0	CCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OC)O)O)O	{1: 2, 2: 11, 12: 5, 20: 3, 22: 1, 23: 1, 28: 1}
OK	13889-92-4	CCCSC(=O)Cl	{24: 1, 1: 1, 2: 2, 40: 1, 17: 1}
OK	13889-98-0	CC(=O)N1CCNCC1	{24: 1, 1: 1, 11: 4, 33: 1, 32: 1}
OK	13894-28-5	CCN(CC)C=CC(=O)OCC	{1: 3, 2: 3, 28: 1, 6: 2, 33: 1}
OK	13894-61-6	CC/C=C/CC(=O)OC	{1: 2, 2: 2, 28: 1, 6: 2}
OK	13894-62-7	CCC=CCC(=O)OC	{1: 2, 2: 2, 28: 1, 6: 2}
OK	13894-63-8	CCCC=CC(=O)OC	{1: 2, 2: 2, 28: 1, 6: 2}
OK	13897-55-7	CC1CCC(CC1N)N	{1: 1, 11: 3, 12: 3, 30: 2}
OK	13898-47-0	OCl=O	{17: 1, 20: 1, 29: 1}
OK	13898-96-9	C1CCC(C(C1)Cl)Br	{17: 1, 18: 1, 11: 4, 12: 2}
OK	139-13-9	C(C(=O)O)N(CC(=O)O)CC(=O)O	{33: 1, 2: 3, 27: 3}
OK	139-43-5	CCCCCCC(CCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC(CCCCCC)OC(=O)C)OC(=O)CCCCCCCCCCC(CCCCCC)OC(=O)C)OC(=O)C	{1: 6, 2: 47, 3: 4, 28: 6}
OK	139-44-6	CCCCCCC(CCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC(CCCCCC)O)OC(=O)CCCCCCCCCCC(CCCCCC)O)O	{1: 3, 2: 47, 3: 4, 20: 3, 28: 3}
OK	139-45-7	CCC(=O)OCC(COC(=O)CC)OC(=O)CC	{1: 3, 2: 5, 3: 1, 28: 3}
OK	139-87-7	CCN(CCO)CCO	{1: 1, 2: 5, 20: 2, 33: 1}
OK	139-90-2	CC(CN(CCN(CC(C)O)CC(C)O)CCO)O	{1: 3, 2: 7, 3: 3, 20: 4, 33: 2}
OK	139-92-4	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCO)CC(=O)O	{1: 1, 2: 21, 33: 1, 20: 1, 24: 1, 27: 1, 31: 1}
OK	139033-04-8	CN(C)CCCN=CN(C)C	{1: 4, 2: 3, 34: 1, 6: 1, 33: 2}
OK	13905-48-1	CC1CCCC(C1)Br	{1: 1, 18: 1, 11: 4, 12: 2}
OK	13907-80-7	C1CN(CCN1C(=O)N(CCCl)N=O)C(=O)N(CCCl)N=O	{33: 4, 2: 4, 11: 4, 34: 2, 17: 2, 24: 2, 29: 2}
OK	13907-90-9	C(CF)NC(=O)N	{16: 1, 24: 1, 2: 2, 30: 1, 31: 1}
OK	13907-91-0	CNC(=O)NCCF	{16: 1, 1: 1, 2: 2, 24: 1, 31: 2}
OK	13907-92-1	C(CF)NC(=O)NCCF	{16: 2, 24: 1, 2: 4, 31: 2}
OK	13907-96-5	C1CC2CC1CC2NC(=O)NCCF	{2: 2, 11: 4, 12: 3, 16: 1, 24: 1, 31: 2}
OK	13908-00-4	C(CCl)NC(=O)NCC(F)(F)F	{2: 3, 4: 1, 16: 3, 17: 1, 24: 1, 31: 2}
OK	13908-16-2	CC1CC(CC(C1)(C)C)NC(=O)NCCCl	{1: 3, 2: 2, 11: 3, 12: 2, 13: 1, 17: 1, 24: 1, 31: 2}
OK	13908-27-5	C1CCCC(CC1)NC(=O)NCCCl	{2: 2, 11: 6, 12: 1, 17: 1, 24: 1, 31: 2}
OK	13908-62-8	C1CCC(C(C1)NC(=O)NCCCl)NC(=O)NCCCl	{2: 4, 11: 4, 12: 2, 17: 2, 24: 2, 31: 4}
OK	13908-63-9	C1CC(CCC1NC(=O)NCCCl)NC(=O)NCCCl	{2: 4, 11: 4, 12: 2, 17: 2, 24: 2, 31: 4}
OK	13908-81-1	CNC(=O)NC1CCCCC1Cl	{1: 1, 11: 4, 12: 2, 17: 1, 24: 1, 31: 2}
OK	13908-93-5	C1CCC(CC1)NC(=O)N(CCF)N=O	{33: 1, 2: 2, 11: 5, 12: 1, 34: 1, 16: 1, 24: 1, 29: 1, 31: 1}
OK	13909-02-9	C1CC(=O)NC(=O)C1NC(=O)N(CCCl)N=O	{32: 1, 33: 1, 2: 2, 11: 2, 12: 1, 34: 1, 17: 1, 24: 1, 25: 2, 29: 1, 31: 1}
OK	13909-05-2	CCOC(=O)C1(CCCC1)NC(=O)N(CCCl)N=O	{1: 1, 2: 3, 34: 1, 33: 1, 11: 4, 13: 1, 17: 1, 24: 1, 28: 1, 29: 1, 31: 1}
OK	13909-09-6	CC1CCC(CC1)NC(=O)N(CCCl)N=O	{1: 1, 2: 2, 33: 1, 11: 4, 12: 2, 34: 1, 17: 1, 24: 1, 29: 1, 31: 1}
OK	13909-12-1	C1CCC(C(C1)NC(=O)N(CCCl)N=O)Cl	{33: 1, 2: 2, 11: 4, 12: 2, 34: 1, 17: 2, 24: 1, 29: 1, 31: 1}
OK	13909-13-2	C1CC2CC1CC2NC(=O)N(CCCl)N=O	{33: 1, 2: 2, 11: 4, 12: 3, 34: 1, 17: 1, 24: 1, 29: 1, 31: 1}
OK	139257-77-5	CC\1=CCCC(/C1=C\C=C(/C)\C=C\C=C(/C)\[C@H](CO)O)(C)C	{1: 5, 2: 1, 3: 1, 6: 5, 7: 2, 11: 2, 13: 1, 14: 1, 15: 2, 20: 2}
OK	13929-94-7	C1CN2CCC1C=C2	{33: 1, 11: 4, 12: 1, 14: 2}
OK	1393-63-1	C/C(=C\C=C\C=C(/C)\C=C\C=C(\C)/C=C/C(=O)O)/C=C/C=C(\C)/C=C/C(=O)O	{1: 4, 27: 2, 6: 14, 7: 4}
OK	13937-08-1	CCOC(=O)C(C(=O)OCC)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 2}
OK	13937-89-8	CCC=CN1CCCC1	{1: 1, 2: 1, 11: 4, 6: 2, 33: 1}
OK	13945-76-1	CCCCCCCCCCCCOC(=O)CCCCCCCCCCC	{1: 2, 2: 21, 28: 1}
OK	13947-84-7	CCOC(=NC#N)N	{1: 1, 2: 1, 37: 1, 7: 1, 34: 1, 22: 1, 30: 1}
OK	1395-22-8	C[C@@H](C(=O)N[C@@H](C[C@H]1CCC(=O)[C@H]2[C@@H]1O2)C(=O)O)N	{1: 1, 2: 1, 3: 2, 11: 2, 12: 3, 23: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
OK	13952-84-6	CCC(C)N	{1: 2, 2: 1, 3: 1, 30: 1}
OK	139547-12-9	CC1CC(C(=O)O1)C(F)(F)F	{1: 1, 4: 1, 11: 1, 12: 2, 16: 3, 28: 1}
OK	13961-86-9	CCCCCCCC/C=C\CCCCCCCC(=O)O.C(CO)NCCO	{1: 1, 2: 18, 6: 2, 20: 2, 27: 1, 31: 1}
OK	1397-89-3	CC1C=CC=CC=CC=CC=CC=CC=CC(CC2C(C(CC(O2)(CC(CC(C(CCC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)O)C(=O)O)OC3C(C(C(C(O3)C)O)N)O	{1: 4, 11: 8, 12: 18, 13: 1, 14: 14, 20: 10, 22: 1, 23: 2, 27: 1, 28: 1, 30: 1}
OK	13972-49-1	CCN(CCOC(=O)C(=C)C)CCOC(=O)C(=C)C	{1: 3, 2: 5, 5: 2, 33: 1, 7: 2, 28: 2}
OK	13979-28-7	CCOC(=O)C(=C(C)C)C	{1: 4, 2: 1, 28: 1, 7: 2}
OK	1398-61-4	CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O)CO)O)O	{1: 1, 2: 1, 12: 5, 20: 4, 23: 1, 24: 1, 31: 1}
OK	13980-04-6	C1N(CN(CN1N=O)N=O)N=O	{33: 3, 34: 3, 11: 3, 29: 3}
OK	13984-50-4	CC(=O)CCCC(=O)OC	{24: 1, 1: 2, 2: 3, 28: 1}
OK	13984-53-7	CC(=O)C(CCC(=O)OC)C(=O)C	{24: 2, 1: 3, 2: 2, 3: 1, 28: 1}
OK	13984-57-1	CCOC(=O)CCCC(=O)C	{24: 1, 1: 2, 2: 4, 28: 1}
OK	13987-01-4	CCCCC(C)C(C)C.CCCC(C)CC(C)C.CC(C)CC(C)C(C)C	{1: 13, 2: 7, 3: 7}
OK	13987-61-6	CC(C)(C)N=C	{1: 3, 34: 1, 4: 1, 5: 1}
OK	13990-93-7	CC[C@H]1CC[C@H](CC)CC1	{1: 2, 2: 2, 11: 4, 12: 2}
OK	13991-37-2	CCC=CC(=O)O	{1: 1, 2: 1, 27: 1, 6: 2}
OK	13991-67-8	C(CCl)NC(=O)NCC#N	{24: 1, 17: 1, 2: 3, 37: 1, 31: 2}
OK	13991-72-5	CC1CCCC(C1)NC(=O)N(CCCl)N=O	{1: 1, 2: 2, 33: 1, 11: 4, 12: 2, 34: 1, 17: 1, 24: 1, 29: 1, 31: 1}
OK	13991-74-7	CCOC(=O)C1(CCCCC1)NC(=O)N(CCCl)N=O	{1: 1, 2: 3, 34: 1, 33: 1, 11: 5, 13: 1, 17: 1, 24: 1, 28: 1, 29: 1, 31: 1}
OK	139914-54-8	CC1CC(=O)C2CC1C(=O)CC2C	{1: 2, 11: 3, 12: 4, 25: 2}
OK	139944-81-3	CCCCC(CC)COC(=O)C=C.CC(C)(C)CC(C)(C)NC(=O)C=C	{1: 7, 2: 6, 3: 1, 4: 2, 5: 2, 6: 2, 24: 1, 28: 1, 31: 1}
OK	139953-95-0	CCCO/C=C\C=C/C=C\C=C/C=C\CC	{1: 2, 2: 3, 22: 1, 6: 10}
OK	139953-97-2	CC/C=C\C=C/C=C\C=C/C=C\OCC(C)O	{1: 2, 2: 2, 3: 1, 6: 10, 20: 1, 22: 1}
OK	13997-95-0	C=CCSC(=NC#N)SCC=C	{2: 2, 37: 1, 6: 2, 7: 1, 40: 2, 34: 1, 5: 2}
OK	140-03-4	CCCCCCC(CC=CCCCCCCCC(=O)OC)OC(=O)C	{1: 3, 2: 13, 3: 1, 28: 2, 6: 2}
OK	140-04-5	CCCCCCC(CC=CCCCCCCCC(=O)OCCCC)OC(=O)C	{1: 3, 2: 16, 3: 1, 28: 2, 6: 2}
OK	140-05-6	CCCCCCC(CC=CCCCCCCCC(=O)OCCOC)OC(=O)C	{1: 3, 2: 15, 3: 1, 6: 2, 22: 1, 28: 2}
OK	140-07-8	C(CN(CCO)CCO)N(CCO)CCO	{33: 2, 2: 10, 20: 4}
OK	140-31-8	C1CN(CCN1)CCN	{32: 1, 33: 1, 2: 2, 11: 4, 30: 1}
OK	140-55-6	CCC[C@H]1CC[C@@H](CN1)O	{32: 1, 1: 1, 2: 2, 11: 3, 12: 2, 20: 1}
OK	140-72-7	CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.[Br-]	{1: 1, 2: 15, 18: 1, 14: 5, 33: 1}
OK	140-77-2	C1CCC(C1)CCC(=O)O	{27: 1, 2: 2, 11: 4, 12: 1}
OK	140-79-4	C1CN(CCN1N=O)N=O	{33: 2, 34: 2, 11: 4, 29: 2}
OK	140-80-7	CCN(CC)CCCC(C)N	{1: 3, 2: 5, 3: 1, 30: 1, 33: 1}
OK	140-82-9	CCN(CC)CCOCCO	{1: 2, 2: 6, 20: 1, 22: 1, 33: 1}
OK	140-87-4	C(C#N)C(=O)NN	{24: 1, 2: 1, 37: 1, 30: 1, 31: 1}
OK	140-88-5	CCOC(=O)C=C	{1: 1, 2: 1, 28: 1, 5: 1, 6: 1}
OK	140-95-4	C(NC(=O)NCO)O	{24: 1, 2: 2, 20: 2, 31: 2}
OK	1400-61-9	CC1C=CC=CCCC=CC=CC=CC=CC(CC2C(C(CC(O2)(CC(C(CCC(CC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)O)C(=O)O)OC3C(C(C(C(O3)C)O)N)O	{1: 4, 11: 10, 12: 18, 13: 1, 14: 12, 20: 10, 22: 1, 23: 2, 27: 1, 28: 1, 30: 1}
OK	14002-21-2	CN(C)CO	{1: 2, 2: 1, 20: 1, 33: 1}
OK	14002-33-6	C(CNCCCO)CO	{2: 6, 20: 2, 31: 1}
OK	14002-80-3	CC(C)(CO)C(=O)OC	{1: 3, 2: 1, 4: 1, 20: 1, 28: 1}
OK	14003-02-2	CC1=C(CN(N(C1)C)C)C	{1: 4, 11: 2, 33: 2, 15: 2}
OK	1401-69-0	CCC1C(C=C(C=CC(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)O)(C)O)N(C)C)O)CC=O)C)C)COC4C(C(C(C(O4)C)O)OC)OC	{1: 12, 2: 3, 33: 1, 11: 3, 12: 20, 13: 1, 14: 3, 15: 1, 20: 5, 22: 5, 23: 3, 25: 1, 26: 1, 28: 1}
OK	14010-23-2	CCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 16, 28: 1}
OK	14018-58-7	CCCC(C)OO	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	1402-82-0	CCC(C)CCCCC/C=C/CC(=O)NC(CC(=O)O)C(=O)N(C)C(CC(=O)O)C(=O)NC(CC(=O)O)C(=O)NCC(=O)NC(CC(=O)O)C(=O)NCC(=O)NC(C(C)N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC2C(NC(=O)C3CCCCN3C2=O)C	{32: 1, 1: 7, 2: 13, 3: 9, 6: 2, 33: 3, 11: 7, 12: 4, 24: 10, 25: 2, 27: 4, 30: 1, 31: 8}
OK	1402-83-1	CCC1C(C2C(O2)(/C=C/C(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC3CC(C(C(O3)C)OC4CC(C(C(O4)C)O)(C)O)N(C)C)CC=O)C)C)COC5C(C(C(C(O5)C)O)OC)OC	{1: 12, 2: 3, 33: 1, 11: 4, 12: 20, 13: 2, 14: 2, 20: 4, 22: 5, 23: 4, 25: 1, 26: 1, 28: 1}
OK	140210-44-2	CC1(/C(=N\OC)/C(=N/OC)/C(C1)(C)C)C	{1: 6, 34: 2, 11: 1, 13: 2, 15: 2, 22: 2}
OK	140210-45-3	CC\1(CC(/C(=N\OC)/C1=N\OC)(C)C)C	{1: 6, 34: 2, 11: 1, 13: 2, 15: 2, 22: 2}
OK	140224-43-7	CC(C)(C=CCC(C)(C=C)O)O	{1: 3, 2: 1, 4: 2, 5: 1, 6: 3, 20: 2}
OK	14026-03-0	C[C@@H]1CCCCN1N=O	{1: 1, 34: 1, 33: 1, 11: 4, 12: 1, 29: 1}
OK	14027-78-2	CCCCCOC(=O)CCCCC(=O)OCCCCC	{1: 2, 2: 12, 28: 2}
OK	1403-66-3	CC(C1CCC(C(O1)OC2C(CC(C(C2O)OC3C(C(C(CO3)(C)O)NC)O)N)N)N)NC	{1: 4, 3: 1, 11: 4, 12: 11, 13: 1, 20: 3, 22: 2, 23: 2, 30: 3, 31: 2}
OK	14031-86-8	CC(=C)CC(C)(C)CC(C)(C)C	{1: 6, 2: 2, 4: 2, 5: 1, 7: 1}
OK	14032-62-3	C1COC(=O)C1S	{28: 1, 11: 2, 12: 1, 39: 1}
OK	14034-79-8	OF	{16: 1, 20: 1}
OK	14035-96-2	CCCC(C(=O)OC)C(=O)OC	{1: 3, 2: 2, 3: 1, 28: 2}
OK	14036-06-7	CCOC(OCC)OC(=O)C	{1: 3, 2: 2, 3: 1, 28: 1, 22: 2}
OK	14039-08-8	C1C2CC3CC1CC(C2)(C3)NC(=O)N(CCF)N=O	{33: 1, 2: 2, 34: 1, 11: 6, 12: 3, 13: 1, 16: 1, 24: 1, 29: 1, 31: 1}
OK	140401-51-0	CC1(/C(=N/OC)/C(=N\OC)/C(C1)(C)C)C	{1: 6, 34: 2, 11: 1, 13: 2, 15: 2, 22: 2}
OK	14044-68-9	CCS/C=C/SCC	{40: 2, 1: 2, 2: 2, 6: 2}
OK	14049-06-0	C1CCCCCC(CCCCC1)NC(=O)N(CCCl)N=O	{33: 1, 2: 2, 11: 11, 12: 1, 34: 1, 17: 1, 24: 1, 29: 1, 31: 1}
OK	14049-11-7	CC1(C(CCC(O1)(C)C=C)O)C	{1: 3, 5: 1, 6: 1, 11: 2, 12: 1, 13: 2, 20: 1, 23: 1}
OK	1405-86-3	C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O)C)(C)C(=O)O	{1: 7, 11: 9, 12: 14, 13: 6, 14: 1, 15: 1, 20: 5, 22: 2, 23: 2, 25: 1, 27: 3}
OK	1405-90-9	CC1/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C(CC2C(C(CC(O2)(CC(C(CCC(=O)CC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)C(=O)O)OC3C(C(C(C(O3)C)O)N)O	{1: 4, 11: 8, 12: 17, 13: 1, 14: 14, 20: 9, 22: 1, 23: 2, 25: 1, 27: 1, 28: 1, 30: 1}
OK	14064-10-9	CCOC(=O)C(C(=O)OCC)Cl	{1: 2, 2: 2, 3: 1, 28: 2, 17: 1}
OK	14065-32-8	COC(=O)CCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 8, 28: 1, 17: 1}
OK	14072-86-7	CC1(CCC=CC1)C	{1: 2, 11: 3, 13: 1, 14: 2}
OK	14072-87-8	CC(C)(C)C1CCCC=C1	{1: 3, 11: 3, 4: 1, 14: 2, 12: 1}
OK	14073-97-3	C[C@@H]1CC[C@H](C(=O)C1)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2, 25: 1}
OK	14077-58-8	CCOCC(=O)Cl	{24: 1, 1: 1, 2: 2, 22: 1, 17: 1}
OK	14087-70-8	CC1(C[C@H]2[C@H](C2(C)C)C(=O)O1)C	{1: 4, 11: 1, 12: 2, 13: 2, 28: 1}
OK	14087-71-9	CC1(CC2C(C2(C)C)C(=O)O1)C	{1: 4, 11: 1, 12: 2, 13: 2, 28: 1}
OK	14090-87-0	CCCCC(=O)CC(=O)C	{24: 2, 1: 2, 2: 4}
OK	14090-88-1	CCCC(=O)CC(=O)CCC	{24: 2, 1: 2, 2: 5}
OK	14094-13-4	CC(C)(C)SC=C	{40: 1, 1: 3, 4: 1, 5: 1, 6: 1}
OK	141-02-6	CCCCC(CC)COC(=O)C=CC(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 28: 2, 6: 2}
OK	141-03-7	CCCCOC(=O)CCC(=O)OCCCC	{1: 2, 2: 8, 28: 2}
OK	141-04-8	CC(C)COC(=O)CCCCC(=O)OCC(C)C	{1: 4, 2: 6, 3: 2, 28: 2}
OK	141-05-9	CCOC(=O)C=CC(=O)OCC	{1: 2, 2: 2, 28: 2, 6: 2}
OK	141-06-0	CCCCC(=O)OCCC	{1: 2, 2: 5, 28: 1}
OK	141-10-6	CC(=CCC/C(=C/C=C/C(=O)C)/C)C	{24: 1, 1: 4, 2: 2, 6: 4, 7: 2}
OK	141-11-7	CC(CCCC(=C)C)CCOC(=O)C	{1: 3, 2: 5, 3: 1, 5: 1, 7: 1, 28: 1}
OK	141-13-9	CC(CCCC(C)C=O)CCC=C(C)C	{1: 4, 2: 5, 3: 2, 6: 1, 7: 1, 26: 1}
OK	141-14-0	CCC(=O)OCCC(C)CCC=C(C)C	{1: 4, 2: 5, 3: 1, 6: 1, 7: 1, 28: 1}
OK	141-16-2	CCCC(=O)OCCC(C)CCC=C(C)C	{1: 4, 2: 6, 3: 1, 6: 1, 7: 1, 28: 1}
OK	141-17-3	CCCCOCCOCCOC(=O)CCCCC(=O)OCCOCCOCCCC	{1: 2, 2: 18, 28: 2, 22: 4}
OK	141-18-4	CCCCOCCOC(=O)CCCCC(=O)OCCOCCCC	{1: 2, 2: 14, 28: 2, 22: 2}
OK	141-19-5	CCCCOCCOC(=O)CCCCCCCCC(=O)OCCOCCCC	{1: 2, 2: 18, 28: 2, 22: 2}
OK	141-20-8	CCCCCCCCCCCC(=O)OCCOCCO	{1: 1, 2: 14, 20: 1, 22: 1, 28: 1}
OK	141-22-0	CCCCCC[C@@H](C/C=C/CCCCCCCC(=O)O)O	{1: 1, 2: 13, 3: 1, 6: 2, 20: 1, 27: 1}
OK	141-23-1	CCCCCCC(CCCCCCCCCCC(=O)OC)O	{1: 2, 2: 15, 3: 1, 20: 1, 28: 1}
OK	141-24-2	CCCCCCC(CC=CCCCCCCCC(=O)OC)O	{1: 2, 2: 13, 3: 1, 6: 2, 20: 1, 28: 1}
OK	141-25-3	CC(CCCC(=C)C)CCO	{1: 2, 2: 5, 3: 1, 5: 1, 7: 1, 20: 1}
OK	141-26-4	CC(CCCC(=C)C)CC=O	{1: 2, 2: 4, 3: 1, 5: 1, 7: 1, 26: 1}
OK	141-28-6	CCOC(=O)CCCCC(=O)OCC	{1: 2, 2: 6, 28: 2}
OK	141-31-1	C(CC=O)CC(C=O)O	{2: 3, 3: 1, 20: 1, 26: 2}
OK	141-32-2	CCCCOC(=O)C=C	{1: 1, 2: 3, 28: 1, 5: 1, 6: 1}
OK	141-37-7	CC1CC2C(O2)CC1COC(=O)C3CC4C(O4)CC3C	{1: 2, 2: 1, 11: 4, 12: 8, 23: 2, 28: 1}
OK	141-38-8	CCCCCCCCC1C(O1)CCCCCCCC(=O)OCC(CC)CCCC	{1: 3, 2: 19, 3: 1, 12: 2, 23: 1, 28: 1}
OK	141-40-2	C1CC2C(O2)CC1C#N	{11: 3, 12: 3, 37: 1, 23: 1}
OK	141-43-5	C(CO)N	{2: 2, 20: 1, 30: 1}
OK	141-46-8	C(C=O)O	{2: 1, 20: 1, 26: 1}
OK	141-59-3	CC(C)(C)CC(C)(C)S	{1: 5, 2: 1, 4: 2, 39: 1}
OK	141-64-0	CC(C)(C)CC(C)(C)C/C=C/CCl	{1: 5, 2: 3, 4: 2, 6: 2, 17: 1}
OK	141-70-8	CC(C)(C)CC(=C)CC(C)(C)C	{1: 6, 2: 2, 4: 2, 5: 1, 7: 1}
OK	141-72-0	CCCCOC(C)(C)OCCCC	{1: 4, 2: 6, 4: 1, 22: 2}
OK	141-73-1	CC(CC(C)(C)OC)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1, 22: 1}
OK	141-75-3	CCCC(=O)Cl	{24: 1, 1: 1, 2: 2, 17: 1}
OK	141-76-4	C(CI)C(=O)O	{27: 1, 2: 2, 19: 1}
OK	141-78-6	CCOC(=O)C	{1: 2, 2: 1, 28: 1}
OK	141-79-7	CC(=CC(=O)C)C	{24: 1, 1: 3, 6: 1, 7: 1}
OK	141-82-2	C(C(=O)O)C(=O)O	{2: 1, 27: 2}
OK	141-83-3	C(=NC(=O)N)(N)N	{24: 1, 34: 1, 30: 3, 7: 1}
OK	141-91-3	CC1CNCC(O1)C	{32: 1, 1: 2, 11: 2, 12: 2, 23: 1}
OK	141-92-4	CC(CCCC(C)(C)O)CC(OC)OC	{1: 5, 2: 4, 3: 2, 4: 1, 20: 1, 22: 2}
OK	141-94-6	CCCCC(CC)CN1CC(CN(C1)CC(CC)CCCC)(C)N	{1: 5, 2: 10, 3: 2, 33: 2, 11: 3, 13: 1, 30: 1}
OK	141-97-9	CCOC(=O)CC(=O)C	{24: 1, 1: 2, 2: 2, 28: 1}
OK	14106-38-8	CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C2=C4C=C(C(=O)C(=C4)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C	{1: 18, 4: 6, 25: 3, 14: 6, 15: 12}
OK	14106-40-2	CC(C)(C)C1=CC(=C=C=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C	{1: 12, 4: 4, 8: 2, 14: 4, 15: 6, 25: 2}
OK	14109-72-9	CC(=O)CSC	{24: 1, 1: 2, 2: 1, 40: 1}
OK	14112-98-2	CC(=O)CCCCCC(=O)O	{24: 1, 1: 1, 2: 5, 27: 1}
OK	14113-01-0	CCOC(=O)CCCCCCC(=O)O	{1: 1, 2: 7, 27: 1, 28: 1}
OK	14113-56-5	C1CCCCCC(=O)CCCCCCCCC(=O)CCCC1	{25: 2, 11: 18}
OK	14116-69-9	C1[C@@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H](C(O2)O)O)O)O)O)O)O	{2: 1, 11: 1, 12: 9, 20: 7, 22: 1, 23: 2}
OK	14117-17-0	C(C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)O	{16: 9, 20: 1, 2: 1, 4: 4}
OK	14129-48-7	CCCC=CC(=O)CC	{24: 1, 1: 2, 2: 3, 6: 2}
OK	14130-05-3	CCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 18, 30: 1}
OK	14130-06-4	CCCCCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 21, 30: 1}
OK	14130-07-5	CCCCCCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 22, 30: 1}
OK	14130-12-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 27, 30: 1}
OK	14131-84-1	CC1(OCC(O1)C2C3C(C(O2)O)OC(O3)(C)C)C	{1: 4, 11: 1, 12: 5, 13: 2, 20: 1, 23: 5}
OK	141399-60-2	CC(=O)OC=C.COC(=O)C=C.C=CC(=O)NCO	{1: 2, 2: 1, 5: 3, 6: 3, 20: 1, 24: 1, 28: 2, 31: 1}
OK	14140-18-2	CC(C)[C@@](C(C)O)(C(=O)OC[C@H]1CCN2[C@H]1CCC2)O	{1: 3, 2: 1, 3: 2, 4: 1, 33: 1, 11: 5, 12: 2, 20: 2, 28: 1}
OK	14145-44-9	CCC(=C)C(=C)C	{1: 2, 2: 1, 5: 2, 7: 2}
OK	14147-71-8	CN.C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 3: 1, 38: 3, 30: 1}
OK	14152-28-4	CCCCCC(C=CC1C=CC(=O)C1CCCCCCC(=O)O)O	{1: 1, 2: 10, 3: 1, 6: 2, 12: 2, 14: 2, 20: 1, 25: 1, 27: 1}
OK	14155-65-8	C[C@]12CCC3C([C@]1([C@@H](C[C@@H]2C4=CC(=O)OC4)O)O)CC[C@@H]5[C@@]3(CC[C@@H](C5)O)C=O	{1: 1, 11: 9, 12: 6, 13: 3, 14: 1, 15: 1, 20: 3, 26: 1, 28: 1}
OK	14156-10-6	CCCCCCCCCC(=O)OO	{1: 1, 2: 8, 20: 1, 28: 1}
OK	141635-73-6	C1(=O)C2(C(C3(C(C1(C(C(C2(F)F)(C3(F)F)F)(F)F)F)(F)F)F)(F)F)F	{16: 14, 25: 1, 13: 9}
OK	141667-71-2	CCC(C)(CCC(C)C)C(=O)OC=C.CCOC(=O)C=C.CC(=O)OC=C	{1: 6, 2: 4, 3: 1, 4: 1, 5: 3, 6: 3, 28: 3}
OK	14167-59-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 32}
OK	14167-65-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 31, 3: 1}
OK	14167-67-0	CCCCCCCCCCCCCCCCCCCCCCCCCCC(C)CC	{1: 3, 2: 26, 3: 1}
OK	14167-69-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)CC	{1: 3, 2: 30, 3: 1}
OK	14168-01-5	C1C(CC2C1C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 11: 2, 12: 3, 13: 3, 15: 2}
OK	14168-44-6	C(N[N+](=O)[O-])N[N+](=O)[O-]	{2: 1, 38: 2, 31: 2}
OK	14173-62-7	CC(=O)OCN(CN(CN(COC(=O)C)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 4, 28: 2, 38: 3, 33: 3}
OK	14179-94-3	CCC(C)(C#C)Cl	{1: 2, 2: 1, 4: 1, 9: 1, 10: 1, 17: 1}
OK	141812-70-6	C(C=CC=CC=O)O	{2: 1, 20: 1, 26: 1, 6: 4}
OK	14189-31-2	CC(C)CCC(=O)CC(=O)C(F)(F)F	{1: 2, 2: 3, 3: 1, 4: 1, 16: 3, 24: 2}
OK	14189-85-6	CC1=C(C(=O)CC1)OC	{1: 2, 11: 2, 25: 1, 22: 1, 15: 2}
OK	141942-52-1	CC(=O)OC1C(CCO1)(Cl)Cl	{1: 1, 11: 2, 12: 1, 13: 1, 17: 2, 23: 1, 28: 1}
OK	141942-54-3	CC(=O)OC1C(CCCO1)(Cl)Cl	{1: 1, 11: 3, 12: 1, 13: 1, 17: 2, 23: 1, 28: 1}
OK	141942-59-8	CC(=O)OCCC(C(OC(=O)C)OC(=O)C)(Cl)Cl	{1: 3, 2: 2, 3: 1, 4: 1, 17: 2, 28: 3}
OK	141942-61-2	CC(=O)OCCCC(C(OC(=O)C)OC(=O)C)(Cl)Cl	{1: 3, 2: 3, 3: 1, 4: 1, 17: 2, 28: 3}
OK	141942-66-7	C(CC(CO)(Cl)Cl)CO	{17: 2, 2: 4, 4: 1, 20: 2}
OK	141942-85-0	CCOC(=O)C[C@@H](CC#N)O	{1: 1, 2: 3, 3: 1, 37: 1, 20: 1, 28: 1}
OK	14199-83-8	C(C(C(C(C(CO)O)O)O)O)[N+](=O)[O-]	{2: 2, 3: 4, 20: 5, 38: 1}
OK	142-08-5	C1=CC(=O)NC=C1	{32: 1, 25: 1, 14: 4}
OK	142-09-6	CCCCCCOC(=O)C(=C)C	{1: 2, 2: 5, 28: 1, 5: 1, 7: 1}
OK	142-16-5	CCCCC(CC)COC(=O)/C=C\C(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 28: 2, 6: 2}
OK	142-18-7	CCCCCCCCCCCC(=O)OCC(CO)O	{1: 1, 2: 12, 3: 1, 20: 2, 28: 1}
OK	142-19-8	CCCCCCC(=O)OCC=C	{1: 1, 2: 6, 28: 1, 5: 1, 6: 1}
OK	142-20-1	CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOCCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 40, 28: 2, 22: 3}
OK	142-25-6	CNCCN(C)C	{1: 3, 2: 2, 33: 1, 31: 1}
OK	142-26-7	CC(=O)NCCO	{24: 1, 1: 1, 2: 2, 20: 1, 31: 1}
OK	142-28-9	C(CCl)CCl	{17: 2, 2: 3}
OK	142-29-0	C1CC=CC1	{11: 3, 14: 2}
OK	142-30-3	CC(C)(C#CC(C)(C)O)O	{1: 4, 10: 2, 4: 2, 20: 2}
OK	142-45-0	C(#CC(=O)O)C(=O)O	{10: 2, 27: 2}
OK	142-48-3	CCCCCCCCCCCCCCCCCC(=O)N(C)CC(=O)O	{24: 1, 1: 2, 2: 17, 27: 1, 33: 1}
OK	142-55-2	CCCCCCCCCCCC(=O)OCC(C)O	{1: 2, 2: 11, 3: 1, 20: 1, 28: 1}
OK	142-60-9	CCCCCCCCOC(=O)CC	{1: 2, 2: 8, 28: 1}
OK	142-61-0	CCCCCC(=O)Cl	{24: 1, 1: 1, 2: 4, 17: 1}
OK	142-62-1	CCCCCC(=O)O	{1: 1, 2: 4, 27: 1}
OK	142-64-3	C1CNCCN1.Cl.Cl	{32: 2, 17: 2, 11: 4}
OK	142-68-7	C1CCOCC1	{11: 5, 23: 1}
OK	142-73-4	C(C(=O)O)NCC(=O)O	{2: 2, 27: 2, 31: 1}
OK	142-77-8	CCCCCCCCC=CCCCCCCCC(=O)OCCCC	{1: 2, 2: 17, 28: 1, 6: 2}
OK	142-78-9	CCCCCCCCCCCC(=O)NCCO	{24: 1, 1: 1, 2: 12, 20: 1, 31: 1}
OK	142-79-0	C(CCC(=O)Cl)CCC(=O)Cl	{24: 2, 17: 2, 2: 5}
OK	142-81-4	CCCCCCN.Cl	{1: 1, 2: 5, 30: 1, 17: 1}
OK	142-82-5	CCCCCCC	{1: 2, 2: 5}
OK	142-83-6	C/C=C/C=C/C=O	{1: 1, 26: 1, 6: 4}
OK	142-84-7	CCCNCCC	{1: 2, 2: 4, 31: 1}
OK	142-88-1	C1CNCCN1.C(CCC(=O)O)CC(=O)O	{27: 2, 32: 2, 2: 4, 11: 4}
OK	142-90-5	CCCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 11, 28: 1, 5: 1, 7: 1}
OK	142-91-6	CCCCCCCCCCCCCCCC(=O)OC(C)C	{1: 3, 2: 14, 3: 1, 28: 1}
OK	142-92-7	CCCCCCOC(=O)C	{1: 2, 2: 5, 28: 1}
OK	142-94-9	CCCCCCCCCCCCCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 15, 3: 1, 18: 1}
OK	142-95-0	CCCCCCCCN.Cl	{1: 1, 2: 7, 30: 1, 17: 1}
OK	142-96-1	CCCCOCCCC	{1: 2, 2: 6, 22: 1}
OK	1420-88-8	CC(=O)NCCSC(=O)C	{24: 2, 1: 2, 2: 2, 40: 1, 31: 1}
OK	14205-39-1	CC(=CC(=O)OC)N	{1: 2, 28: 1, 30: 1, 6: 1, 7: 1}
OK	14205-46-0	CC(C)OC(=O)/C=C(/C)\N	{1: 3, 3: 1, 6: 1, 7: 1, 28: 1, 30: 1}
OK	14205-47-1	CC(=CC(=O)OCCCCOC(=O)C=C(C)N)N	{1: 2, 2: 4, 6: 2, 7: 2, 28: 2, 30: 2}
OK	14208-08-3	C1=CC=[N+](C=C1)CCCC[N+]2=CC=CC=C2.[Br-].[Br-]	{33: 2, 2: 4, 18: 2, 14: 10}
OK	1421-89-2	CC(=O)OCCN(C)C	{1: 3, 2: 2, 28: 1, 33: 1}
OK	14216-23-0	CC(=C)C(=O)OCCSC	{1: 2, 2: 2, 5: 1, 7: 1, 40: 1, 28: 1}
OK	14216-25-2	CCSCCOC(=O)C(=C)C	{1: 2, 2: 3, 5: 1, 7: 1, 40: 1, 28: 1}
OK	142185-85-1	C[C@@H]1C[C@H]2[C@@H](C[C@H]3[C@H](O2)[C@H]([C@@H]([C@H]4[C@H](O3)[C@H]([C@@H]([C@@]5(O4)CCCO5)C)C)O)C)O[C@H]6C[C@@H]7[C@]([C@@H](C[C@@H]8[C@@H](O7)C/C=C/C[C@@H]9[C@@H](O8)C=C[C@@H]2[C@@H](O9)C=C[C@@H]3[C@@H](O2)C[C@@H]2[C@@H](O3)[C@@H]([C@@H]3[C@@H](O2)CC=C[C@@H](O3)/C=C/[C@@H](CO)O)O)O)(O[C@@H]6C1)C	{1: 5, 2: 1, 3: 1, 6: 2, 11: 12, 12: 29, 13: 2, 14: 8, 20: 5, 23: 13}
OK	142226-75-3	CCOC(=O)CC(C)(C)C(C=C(Cl)Cl)Cl	{1: 3, 2: 2, 3: 1, 4: 1, 6: 1, 7: 1, 17: 3, 28: 1}
OK	14224-84-1	COC1(C2C=CC1C3C2C3)OC	{1: 2, 11: 1, 12: 4, 13: 1, 14: 2, 22: 2}
OK	14224-85-2	COC1(C2CCC1C3C2C3)OC	{1: 2, 11: 3, 12: 4, 13: 1, 22: 2}
OK	14224-86-3	C1CC2C3CC3C1C2=O	{25: 1, 11: 3, 12: 4}
OK	14227-95-3	C1CCN(C1)C(=O)CC#N	{24: 1, 33: 1, 2: 1, 11: 4, 37: 1}
OK	1423-60-5	CC(=O)C#C	{24: 1, 1: 1, 10: 1, 9: 1}
OK	14233-86-4	CCCCN([N+](=O)[O-])F	{16: 1, 1: 1, 2: 3, 38: 1, 33: 1}
OK	14233-87-5	CCC(C)N([N+](=O)[O-])F	{1: 2, 2: 1, 3: 1, 38: 1, 33: 1, 16: 1}
OK	14233-88-6	CC(C)(C)N([N+](=O)[O-])F	{16: 1, 1: 3, 4: 1, 38: 1, 33: 1}
OK	14234-09-4	C1CC2(CCC1(CC2)C(=O)O)C(F)(F)F	{16: 3, 27: 1, 11: 6, 4: 1, 13: 2}
OK	14234-82-3	CC(C)COC(=O)C=CC(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 28: 2, 6: 2}
OK	14236-02-3	CC(C)OC(=O)NCO	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1, 31: 1}
OK	1424-22-2	CC(=O)OC1=CCCCC1	{1: 1, 11: 4, 28: 1, 14: 1, 15: 1}
OK	14246-53-8	CCCCCCCC(=O)NCC(=O)O	{24: 1, 1: 1, 2: 7, 27: 1, 31: 1}
OK	14250-74-9	CCCCCCC(C)(C)C(=O)OC	{1: 4, 2: 5, 4: 1, 28: 1}
OK	14250-79-4	CCCCCC(C)(C)CO	{1: 3, 2: 5, 4: 1, 20: 1}
OK	14250-96-5	CCC=C(C)C=O	{1: 2, 2: 1, 26: 1, 6: 1, 7: 1}
OK	14252-05-2	C1CC2CC1CC(=O)C2	{25: 1, 11: 5, 12: 2}
OK	14252-11-0	C1CCC2CCC(C1)C2=O	{25: 1, 11: 6, 12: 2}
OK	14252-42-7	CCSC(C)SCC	{40: 2, 1: 3, 2: 2, 3: 1}
OK	14252-45-0	CCSC(C)(C)SCC	{40: 2, 1: 4, 2: 2, 4: 1}
OK	14255-23-3	CCC(C)C=C(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1}
OK	14255-64-2	C1C/C=C\CC/C=C\C1	{11: 5, 14: 4}
OK	14259-51-9	CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)CC(C)C)O)C)C)OC)O	{1: 6, 2: 1, 3: 1, 11: 10, 12: 10, 13: 3, 14: 1, 15: 1, 20: 2, 22: 2, 23: 1, 28: 2}
OK	142609-62-9	CC(C)CCOC(=O)[C@H]([C@H](C(=O)O)S)S	{1: 2, 2: 2, 3: 3, 39: 2, 27: 1, 28: 1}
OK	142628-55-5	CCCCCCCCCCCC=CC=O	{1: 1, 2: 10, 26: 1, 6: 2}
OK	142653-61-0	CC/C=C\CCOCCC#N	{1: 1, 2: 5, 22: 1, 6: 2, 37: 1}
OK	142657-72-5	CCCCCC(=O)OCCCCCCC(C)C	{1: 3, 2: 10, 3: 1, 28: 1}
OK	14267-92-6	C#CCCCCl	{9: 1, 2: 3, 10: 1, 17: 1}
OK	1427-61-8	CC12CCC3C(C1CCC2O)CCC4=CC(=O)C=CC34F	{1: 1, 11: 6, 12: 4, 13: 2, 14: 3, 15: 1, 16: 1, 20: 1, 25: 1}
OK	14272-25-4	CC(C)SCC#C	{1: 2, 2: 1, 3: 1, 40: 1, 9: 1, 10: 1}
OK	14272-36-7	CCSC#CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 40: 1, 10: 2}
OK	14272-47-0	CCCCC(CC)CC(=O)O	{27: 1, 1: 2, 2: 5, 3: 1}
OK	14272-82-3	CC/C(=C/C)/C#C	{1: 2, 2: 1, 6: 1, 7: 1, 9: 1, 10: 1}
OK	14273-06-4	CCOC#CC	{1: 2, 2: 1, 10: 2, 22: 1}
OK	14273-85-9	COC(=O)CCCI	{1: 1, 2: 3, 19: 1, 28: 1}
OK	14273-86-0	COC(=O)CCCCCl	{1: 1, 2: 4, 28: 1, 17: 1}
OK	14276-80-3	CCCCCCCCCCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 16, 3: 1}
OK	14276-84-7	CCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 7, 3: 1}
OK	14277-97-5	CC(C=CC=C(C)C1CNC(C1CC(=O)O)C(=O)O)C(=O)O	{32: 1, 1: 2, 2: 1, 3: 1, 6: 3, 7: 1, 11: 1, 12: 3, 27: 3}
OK	142868-93-7	C(CCSCCCl)CSCCCl	{40: 2, 17: 2, 2: 8}
OK	14287-61-7	CC(C)C(C)C(=O)O	{27: 1, 1: 3, 3: 2}
OK	14287-89-9	CN1C2CCC(C2)N1C	{1: 2, 11: 3, 12: 2, 33: 2}
OK	14287-91-3	CN1C2CCC(N1C)C=C2	{1: 2, 11: 2, 12: 2, 14: 2, 33: 2}
OK	14288-15-4	CN1C2CC(N1C)C=C2	{1: 2, 11: 1, 12: 2, 14: 2, 33: 2}
OK	14289-96-4	CC(=C)COCC=C	{1: 1, 2: 2, 5: 2, 6: 1, 7: 1, 22: 1}
OK	14290-92-7	CCSC(C)(C)C	{40: 1, 1: 4, 2: 1, 4: 1}
OK	14296-14-1	C1CCC(CC1)(N=O)[N+](=O)[O-]	{34: 1, 11: 5, 13: 1, 38: 1, 29: 1}
OK	14296-80-1	C=C1CCC1=C	{11: 2, 5: 2, 15: 2}
OK	143-07-7	CCCCCCCCCCCC(=O)O	{1: 1, 2: 10, 27: 1}
OK	143-08-8	CCCCCCCCCO	{1: 1, 2: 8, 20: 1}
OK	143-10-2	CCCCCCCCCCS	{1: 1, 2: 9, 39: 1}
OK	143-13-5	CCCCCCCCCOC(=O)C	{1: 2, 2: 8, 28: 1}
OK	143-15-7	CCCCCCCCCCCCBr	{1: 1, 2: 11, 18: 1}
OK	143-16-8	CCCCCCNCCCCCC	{1: 2, 2: 10, 31: 1}
OK	143-22-6	CCCCOCCOCCOCCO	{1: 1, 2: 9, 20: 1, 22: 3}
OK	143-23-7	C(CCCNCCCCCCN)CCN	{2: 12, 30: 2, 31: 1}
OK	143-24-8	COCCOCCOCCOCCOC	{1: 2, 2: 8, 22: 5}
OK	143-25-9	CCCCCCC=CCCCCCCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 6: 2}
OK	143-27-1	CCCCCCCCCCCCCCCCN	{1: 1, 2: 15, 30: 1}
OK	143-28-2	CCCCCCCCC=CCCCCCCCCO	{1: 1, 2: 15, 20: 1, 6: 2}
OK	143-29-3	CCCCOCCOCCOCOCCOCCOCCCC	{1: 2, 2: 15, 22: 6}
OK	143-37-3	CC(=N)N	{1: 1, 36: 1, 30: 1, 7: 1}
OK	143-50-0	C1(=O)C2(C3(C4(C1(C5(C2(C3(C(C45Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 10, 13: 9, 25: 1}
OK	143-57-7	CCC(C)C(=O)OC1C(C2C(CN3CC(CCC3C2(C)O)C)C4C1(C5C(C(C6C7(C5(C4)OC6(C(CC7)OC(=O)C(C)(CC)O)O)C)OC(=O)C)OC(=O)C)O)O	{1: 9, 2: 2, 3: 1, 4: 1, 33: 1, 11: 7, 12: 12, 13: 5, 20: 5, 23: 1, 28: 4}
OK	143-62-4	C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O	{1: 2, 11: 10, 12: 5, 13: 3, 14: 1, 15: 1, 20: 2, 28: 1}
OK	14300-33-5	C1CC1C(C2CC2)O	{11: 4, 20: 1, 3: 1, 12: 2}
OK	14303-70-9	CCCCCCCCCCCCCC(=O)OCCC	{1: 2, 2: 14, 28: 1}
OK	14304-30-4	CCCCCCCC=CCBr	{1: 1, 2: 7, 18: 1, 6: 2}
OK	14309-32-1	CC1=C(C1)C	{1: 2, 11: 1, 15: 2}
OK	14309-57-0	CCCCCC=CC(=O)C	{24: 1, 1: 2, 2: 4, 6: 2}
OK	14312-20-0	S(Br)Br	{40: 1, 18: 2}
OK	14314-78-4	CCN(CC)CCOC(=O)C(=C)C.Cl	{1: 3, 2: 4, 5: 1, 7: 1, 17: 1, 33: 1, 28: 1}
OK	14315-97-0	COCCC(OC)OC	{1: 3, 2: 2, 3: 1, 22: 3}
OK	1432-43-5	CC(=O)N1CCOC1=O	{24: 1, 1: 1, 11: 2, 28: 1, 33: 1}
OK	14320-37-7	C1C=CCC1=O	{25: 1, 11: 2, 14: 2}
OK	14320-56-0	C1CC2(CCC1(C=C2)C#N)C(=O)O	{27: 1, 11: 4, 13: 2, 14: 2, 37: 1}
OK	14328-54-2	CCC(CC)C(C(=O)O)N	{27: 1, 1: 2, 2: 2, 3: 2, 30: 1}
OK	1433-27-8	CCN=C=NC(C)(C)C	{8: 1, 1: 4, 2: 1, 4: 1, 34: 2}
OK	14332-21-9	OI	{19: 1, 20: 1}
OK	14332-28-6	N=O	{36: 1, 29: 1}
OK	1434-85-1	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@@H]4[C@@H]3CCC(=O)C4	{1: 1, 11: 9, 12: 6, 13: 1, 20: 1, 25: 1}
OK	14347-78-5	CC1(OC[C@H](O1)CO)C	{1: 2, 2: 1, 11: 1, 12: 1, 13: 1, 20: 1, 23: 2}
OK	14349-82-7	C(Cl)(I)(I)I	{17: 1, 19: 3, 4: 1}
OK	14352-59-1	CCCCCC(C)(C)CC(=O)O	{1: 3, 2: 5, 27: 1, 4: 1}
OK	14352-61-5	COC(=O)CC1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1, 28: 1}
OK	14357-94-9	CC1(C(=O)N(C(=O)N(C1=O)CC=C)C)C2=CCCCC2	{1: 2, 2: 1, 5: 1, 6: 1, 33: 2, 11: 4, 13: 1, 14: 1, 15: 1, 25: 3}
OK	1436-27-7	CC(C)CC1C(=O)NC(C(=O)N1)CC(C)C	{32: 2, 1: 4, 2: 2, 3: 2, 12: 2, 25: 2}
OK	1436-34-6	CCCCC1CO1	{1: 1, 2: 3, 11: 1, 12: 1, 23: 1}
OK	1436-59-5	C1CC[C@@H]([C@@H](C1)N)N	{11: 4, 12: 2, 30: 2}
OK	143615-81-0	C[C@@H](CCC=C(C)C)CCBr	{1: 3, 2: 4, 3: 1, 6: 1, 7: 1, 18: 1}
OK	14362-13-1	[CH](Br)Br	{18: 2, 6: 1}
OK	14362-68-6	C(N(F)F)(N(F)F)(N(F)F)F	{16: 7, 33: 3, 4: 1}
OK	14362-73-3	CC(=O)OC1CC2CC1C3C2CCC3	{1: 1, 11: 5, 12: 5, 28: 1}
OK	143673-66-9	CC(C)[C@@H]1C(=O)NCC(=O)N1	{32: 2, 1: 2, 3: 1, 11: 1, 12: 1, 25: 2}
OK	14370-45-7	C1CC2CC1CC2N.Cl	{17: 1, 11: 4, 12: 3, 30: 1}
OK	14370-50-4	C1CC2CC1CC2CN	{2: 1, 11: 4, 12: 3, 30: 1}
OK	14376-79-5	CC1(CC(=O)CC(C1)(C)C)C	{1: 4, 11: 3, 13: 2, 25: 1}
OK	14376-81-9	C1CC(C(C1)Cl)Cl	{17: 2, 11: 3, 12: 2}
OK	14376-82-0	C1CC(C(C1)Br)Cl	{17: 1, 18: 1, 11: 3, 12: 2}
OK	14379-76-1	C1C[C@H](N(C1)C(=O)CNC(=O)CN)C(=O)O	{33: 1, 2: 2, 11: 3, 12: 1, 24: 2, 27: 1, 30: 1, 31: 1}
OK	14379-80-7	C(C(=O)NN)N	{24: 1, 2: 1, 30: 2, 31: 1}
OK	1438-14-8	CC(C)C1CO1	{11: 1, 1: 2, 3: 1, 12: 1, 23: 1}
OK	1438-66-0	CC(=O)OC1CC(=C)C(C2(C1C(CCC2)(C)C)C)CCC(C)(C=C)OC(=O)C	{1: 6, 2: 2, 4: 1, 5: 2, 6: 1, 11: 4, 12: 3, 13: 2, 15: 1, 28: 2}
OK	14380-61-1	[O-]Cl	{17: 1, 29: 1}
OK	14380-62-2	[O-]Br	{18: 1, 29: 1}
OK	143860-04-2	CCN1CCOC1(C)CCC(C)C	{1: 4, 2: 3, 3: 1, 33: 1, 11: 2, 13: 1, 23: 1}
OK	14387-89-4	CC(C)(C)C1C(=O)N1C(C)(C)C	{1: 6, 4: 2, 33: 1, 12: 1, 25: 1}
OK	14389-38-9	CN1CCCCCCCCC1=O	{1: 1, 11: 8, 33: 1, 25: 1}
OK	14398-71-1	CC1CCC2CCCCC2C1	{1: 1, 11: 7, 12: 3}
OK	144-15-0	CCCCC(CC)COC(=O)CC(CC(=O)OCC(CC)CCCC)(C(=O)OCC(CC)CCCC)OC(=O)C	{1: 7, 2: 17, 3: 3, 4: 1, 28: 4}
OK	144-19-4	CC(C)C(C(C)(C)CO)O	{1: 4, 2: 1, 3: 2, 4: 1, 20: 2}
OK	144-24-1	CC(C)CC(C)(C(=O)O)N	{1: 3, 2: 1, 3: 1, 4: 1, 27: 1, 30: 1}
OK	144-39-8	CCC(=O)OC(C)(CCC=C(C)C)C=C	{1: 4, 2: 3, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	144-48-9	C(C(=O)N)I	{24: 1, 2: 1, 19: 1, 30: 1}
OK	144-49-0	C(C(=O)O)F	{16: 1, 2: 1, 27: 1}
OK	144-62-7	C(=O)(C(=O)O)O	{27: 2}
OK	144-68-3	CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C[C@H](CC2(C)C)O)C)\C)\C)/C)/C	{1: 10, 6: 14, 7: 4, 11: 4, 12: 2, 13: 2, 15: 4, 20: 2}
OK	144-90-1	CC(CN)C(=O)O	{27: 1, 1: 1, 2: 1, 3: 1, 30: 1}
OK	14400-67-0	CC1C(=O)C=C(O1)C	{1: 2, 12: 1, 14: 1, 15: 1, 23: 1, 25: 1}
OK	14402-50-7	CCCCCCCCCCC(C)S	{1: 2, 2: 9, 3: 1, 39: 1}
OK	144020-22-4	CC1=CCCC=C(CC=C(C(CC1)C(=O)C)C)C	{1: 4, 11: 5, 12: 1, 14: 3, 15: 3, 24: 1}
OK	14408-42-5	CCCCCCCCC=CCCCCCCCC1=NC(CO1)(C)CO	{1: 2, 2: 15, 35: 1, 6: 2, 11: 1, 13: 1, 15: 1, 20: 1, 23: 1}
OK	14410-21-0	CSSC(F)(F)F	{16: 3, 1: 1, 4: 1, 40: 2}
OK	14410-98-1	C[C@H]1C[C@@H]2[C@H]([C@H]([C@]3(O2)CC[C@H]4[C@@H]5CCC6=CC(=O)CC[C@@]6([C@H]5CC4=C3C)C)C)NC1	{32: 1, 1: 4, 11: 9, 12: 7, 13: 2, 14: 1, 15: 3, 23: 1, 25: 1}
OK	14414-32-5	COC1=CC(=CNNC=C2C=C(C(=O)C(=C2)OC)OC)C=C(C1=O)OC	{1: 4, 6: 2, 14: 4, 15: 6, 22: 4, 25: 2, 31: 2}
OK	144177-48-0	C[C@@H]1CC[C@@H]([C@H](C1)OCCl)C(C)C	{1: 3, 2: 1, 3: 1, 11: 3, 12: 3, 17: 1, 22: 1}
OK	1442-74-6	C1=CN(C=CC1=C[NH+]=O)CC(C(CN2C=CC(=C[NH+]=O)C=C2)O)O.[I-].[I-]	{33: 2, 2: 2, 3: 2, 6: 2, 14: 8, 15: 2, 19: 2, 20: 2, 29: 2, 31: 2}
OK	14426-20-1	CCN(CC)CCO.Cl	{1: 2, 2: 4, 20: 1, 33: 1, 17: 1}
OK	14426-21-2	C(CO)NCCO.Cl	{17: 1, 2: 4, 20: 2, 31: 1}
OK	144271-37-4	CCOC(C)OCCCC#C	{1: 2, 2: 4, 3: 1, 9: 1, 10: 1, 22: 2}
OK	14433-76-2	CCCCCCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 8, 33: 1}
OK	14436-32-9	C=CCCCCCCCC(=O)O	{2: 7, 27: 1, 5: 1, 6: 1}
OK	1444-94-6	C1CCC2C(C1)C(=O)NC2=O	{32: 1, 25: 2, 11: 4, 12: 2}
OK	144437-83-2	CCCCOC(=O)C=C.C=CC(=O)O.C(CO)NCCO	{1: 1, 2: 7, 5: 2, 6: 2, 20: 2, 27: 1, 28: 1, 31: 1}
OK	144437-84-3	CCCCO.CCC(CO)O	{1: 2, 2: 5, 3: 1, 20: 3}
OK	14446-67-4	C=CCN1CCCCC1	{33: 1, 2: 1, 11: 5, 5: 1, 6: 1}
OK	14446-76-5	CC1CC(CN(C1)C)C	{1: 3, 11: 3, 12: 2, 33: 1}
OK	14447-15-5	CCCOC(=O)CC#N	{1: 1, 2: 3, 28: 1, 37: 1}
OK	14447-16-6	CCC(C)OC(=O)CC#N	{1: 2, 2: 2, 3: 1, 28: 1, 37: 1}
OK	14447-25-7	CCC(C)C1OCCO1	{1: 2, 2: 1, 3: 1, 11: 2, 12: 1, 23: 2}
OK	14448-38-5	N(N=O)O	{34: 1, 20: 1, 29: 1, 31: 1}
OK	1445-45-0	CC(OC)(OC)OC	{1: 4, 4: 1, 22: 3}
OK	1445-73-4	CN1CCC(=O)CC1	{1: 1, 11: 4, 33: 1, 25: 1}
OK	144505-55-5	CC(=O)O.CN1CCOCC1	{27: 1, 1: 2, 11: 4, 33: 1, 23: 1}
OK	14451-87-7	CCC1C2CC3CC(C2)CC1C3	{1: 1, 2: 1, 11: 5, 12: 5}
OK	14458-95-8	C1C2C3C(C1[N+](=N2)[O-])C4(C(=C(C3(C4(Cl)Cl)Cl)Cl)Cl)Cl	{33: 1, 35: 1, 11: 1, 12: 4, 13: 3, 15: 2, 17: 6, 29: 1}
OK	14464-29-0	CC(=O)ON1C(=O)CCC1=O	{1: 1, 11: 2, 28: 1, 33: 1, 25: 2}
OK	14465-68-0	CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC	{1: 3, 2: 32, 3: 1, 28: 3, 6: 18}
OK	1447-13-8	CC1(CC1(Cl)Cl)C(=O)OC	{1: 2, 11: 1, 28: 1, 13: 2, 17: 2}
OK	1447-14-9	CC1(CC1(Cl)Cl)C(=O)O	{27: 1, 1: 1, 11: 1, 13: 2, 17: 2}
OK	1447-26-3	CC/C(=C/C(=O)CC)/C	{24: 1, 1: 3, 2: 2, 6: 1, 7: 1}
OK	14470-12-3	CC(CCC#N)Br	{1: 1, 2: 2, 3: 1, 18: 1, 37: 1}
OK	144741-95-7	C1[C@H](O1)CCCCCC[C@@H]2CO2	{2: 6, 11: 2, 12: 2, 23: 2}
OK	14476-30-3	CC(CBr)(Br)Br	{1: 1, 2: 1, 4: 1, 18: 3}
OK	14476-37-0	CCCCCCCC(=O)CCC	{24: 1, 1: 2, 2: 8}
OK	14476-38-1	CCCCCCCCCC(=O)CCCCCCC	{24: 1, 1: 2, 2: 14}
OK	14478-14-9	CC(=CO)C.CC(=O)O	{1: 3, 27: 1, 20: 1, 6: 1, 7: 1}
OK	1448-23-3	CC[C@@](C)(C(=O)O[C@@H]1[C@H]2[C@H]([C@H]([C@]3([C@H]4[C@@]2(CO3)[C@@H](C[C@@H]5[C@@]4([C@@H]([C@H](C=C5C)O)O)C)OC1=O)O)O)C)O	{1: 5, 2: 1, 4: 1, 11: 2, 12: 9, 13: 3, 14: 1, 15: 1, 20: 5, 23: 1, 28: 2}
OK	1448-98-2	C(C#N)C(=O)NC(=O)N	{24: 2, 2: 1, 37: 1, 30: 1, 31: 1}
OK	14486-09-0	CC(C)C(C(=O)NC(CCSC)C(=O)O)N	{1: 3, 2: 2, 3: 3, 40: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	14486-13-6	CC(C)[C@@H](C(=O)O)NC(=O)[C@H](CCSC)N	{1: 3, 2: 2, 3: 3, 40: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	14488-49-4	CNC.OCl(=O)(=O)=O	{1: 2, 31: 1, 20: 1, 29: 3, 17: 1}
OK	1449-05-4	CC1(C2CCC3(C(C2(CCC1O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C	{1: 7, 11: 9, 12: 4, 13: 6, 14: 1, 15: 1, 20: 1, 25: 1, 27: 1}
OK	1449-49-6	CC1CC(=O)C1(C)C	{1: 3, 11: 1, 12: 1, 13: 1, 25: 1}
OK	145-12-0	C[C@]12CCC(=O)C(=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C)O	{1: 3, 11: 8, 12: 3, 13: 3, 15: 2, 20: 2, 25: 1}
OK	145-73-3	C1CC2C(C(C1O2)C(=O)O)C(=O)O	{27: 2, 11: 2, 12: 4, 23: 1}
OK	1450-81-3	C(CC(C(=O)O)Br)CBr	{27: 1, 2: 3, 3: 1, 18: 2}
OK	14507-02-9	CCCCCC=CC=CCO	{1: 1, 2: 5, 20: 1, 6: 4}
OK	145107-27-3	CC1(O[C@@H]2C=C[C@@H]3[C@H]([C@@H]2O1)O3)C	{1: 2, 12: 4, 13: 1, 14: 2, 23: 3}
OK	14515-09-4	C1C2C1C=CC=C2	{11: 1, 12: 2, 14: 4}
OK	14519-03-0	N(Br)Br	{18: 2, 31: 1}
OK	14519-10-9	NBr	{18: 1, 30: 1}
OK	14522-82-8	O=[N+]=O	{34: 1, 29: 2}
OK	14523-53-6	C1CCC2(C1)CCC(=O)C=C2	{25: 1, 11: 6, 13: 1, 14: 2}
OK	1453-17-4	CC1CC(=CC=C1)C	{1: 2, 11: 1, 12: 1, 14: 3, 15: 1}
OK	1453-24-3	CCC1=CCCCC1	{1: 1, 2: 1, 11: 4, 14: 1, 15: 1}
OK	1453-25-4	CC1=CCCCCC1	{1: 1, 11: 5, 14: 1, 15: 1}
OK	1453-50-5	C1CC1C(=O)NC2CC2	{24: 1, 11: 4, 12: 2, 31: 1}
OK	1453-52-7	C1CC1C(=NO)C2CC2	{20: 1, 34: 1, 11: 4, 12: 2, 7: 1}
OK	14531-16-9	CCCCC(C)(CC)CCCC	{1: 4, 2: 7, 4: 1}
OK	145374-29-4	C1C[C@@H]2[C@H](C1)[C@@H]3C[C@H]2C[C@H]3CO	{20: 1, 2: 1, 11: 5, 12: 5}
OK	1454-84-8	CCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 18, 20: 1}
OK	1454-85-9	CCCCCCCCCCCCCCCCCO	{1: 1, 2: 16, 20: 1}
OK	14545-08-5	C#CI	{9: 1, 10: 1, 19: 1}
OK	14548-12-0	CCC=CN(C)C	{1: 3, 2: 1, 6: 2, 33: 1}
OK	14548-31-3	C=CCCC#C	{9: 1, 2: 2, 10: 1, 5: 1, 6: 1}
OK	14548-58-4	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OC(OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])(OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{2: 4, 4: 5, 38: 12, 22: 4}
OK	14548-59-5	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OC(OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{2: 3, 3: 1, 4: 3, 38: 9, 22: 3}
OK	1455-21-6	CCCCCCCCCS	{1: 1, 2: 8, 39: 1}
OK	1455-42-1	CC(C)(CO)C1OCC2(CO1)COC(OC2)C(C)(C)CO	{1: 4, 2: 2, 4: 2, 11: 4, 12: 2, 13: 1, 20: 2, 23: 4}
OK	14551-30-5	CC12C3(C1(C4(C2(C34C)C)C)C)C	{1: 6, 13: 6}
OK	145526-47-2	C1CC(=O)N(C1)CCS	{25: 1, 2: 2, 11: 3, 39: 1, 33: 1}
OK	145556-03-2	CCC(CO)(CO)CO.C(CCCCCC(=O)O)CCCCC(=O)O.C(CCCO)CCO	{1: 1, 2: 20, 27: 2, 4: 1, 20: 5}
OK	145556-04-3	CC(C(=O)C(C)(CCl)Cl)Cl	{1: 2, 2: 1, 3: 1, 4: 1, 17: 3, 24: 1}
OK	1456-28-6	CC1CN(CC(O1)C)N=O	{1: 2, 34: 1, 33: 1, 11: 2, 12: 2, 23: 1, 29: 1}
OK	14564-97-7	C=CCC1CCC=C1	{2: 1, 5: 1, 6: 1, 11: 2, 12: 1, 14: 2}
OK	14565-32-3	C(=NC(=O)C(F)(F)F)=O	{34: 1, 4: 1, 8: 1, 16: 3, 24: 1, 29: 1}
OK	1457-42-7	C1=CC=[N+](N=C1)[O-]	{33: 1, 35: 1, 29: 1, 14: 4}
OK	14575-74-7	C[C@]12CC[C@H](C1)C([C@H]2O)(C)C	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	1458-98-6	CC(=C)CBr	{1: 1, 2: 1, 18: 1, 5: 1, 7: 1}
OK	14595-54-1	C1CCCCCC(=O)CCC=CCCCC1	{25: 1, 11: 12, 14: 2}
OK	14597-42-3	CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4=CC(CCC34C)O)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	1460-16-8	C1CCCC(CC1)C(=O)O	{27: 1, 11: 6, 12: 1}
OK	1460-18-0	C(CCCCCCC(=O)O)CCCCCCC(=O)O	{2: 13, 27: 2}
OK	1460-73-7	CC1CCC=C(C12CCC(C2)C(C)(C)O)C	{1: 4, 4: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 1, 20: 1}
OK	14602-62-1	CC(C(Br)Br)Br	{1: 1, 18: 3, 3: 2}
OK	14602-86-9	CC1CCC(C(C1)OC(=O)Cl)C(C)C	{1: 3, 3: 1, 11: 3, 12: 3, 17: 1, 28: 1}
OK	14604-28-5	C(CCCCCCCCCCCCCCCC(=O)O)CCCCCCCCCCCCCCC(=O)O	{2: 30, 27: 2}
OK	14609-79-1	CC(C)(C)C(C(C)(C)C)O	{1: 6, 3: 1, 4: 2, 20: 1}
OK	1461-03-6	CC1=CC2C(=C(CCCC2(C)C)C)CC1	{1: 4, 11: 5, 12: 1, 13: 1, 14: 1, 15: 3}
OK	1461-27-4	CC1=CCCC(C1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	1461-97-8	C1C[C@H]([C@@H](C1)C(=O)O)C(=O)O	{27: 2, 11: 3, 12: 2}
OK	14610-37-8	CC(C)(C)NC	{1: 4, 4: 1, 31: 1}
OK	14618-49-6	C=CCN(CC=C)C(=O)C(F)(F)F	{33: 1, 2: 2, 4: 1, 5: 2, 6: 2, 16: 3, 24: 1}
OK	14618-65-6	C(C(=O)N)SCC(=O)N	{24: 2, 40: 1, 2: 2, 30: 2}
OK	14618-77-0	CC(C#N)C(=O)OC	{1: 2, 3: 1, 28: 1, 37: 1}
OK	14618-78-1	COC(CCC#N)OC	{1: 2, 2: 2, 3: 1, 37: 1, 22: 2}
OK	1462-03-9	CC1(CCCC1)O	{1: 1, 11: 4, 20: 1, 13: 1}
OK	1462-07-3	CC(C)C1=CCCC1	{11: 3, 1: 2, 3: 1, 14: 1, 15: 1}
OK	1462-10-8	CC(C)(CCCO)O	{1: 2, 2: 3, 4: 1, 20: 2}
OK	1462-11-9	CC(C)(CCCCO)O	{1: 2, 2: 4, 4: 1, 20: 2}
OK	1462-12-0	CCOC(=O)C(=CC)C(=O)OCC	{1: 3, 2: 2, 28: 2, 6: 1, 7: 1}
OK	1462-27-7	CCCC(=O)C1CCCCC1	{24: 1, 1: 1, 2: 2, 11: 5, 12: 1}
OK	1462-34-6	CC(OCCCl)Cl	{1: 1, 2: 2, 3: 1, 22: 1, 17: 2}
OK	1462-52-8	CCCCCCCCCCCCSCCC(=O)O	{40: 1, 1: 1, 2: 13, 27: 1}
OK	1462-54-0	CCCCCCCCCCCCNCCC(=O)O	{1: 1, 2: 13, 27: 1, 31: 1}
OK	1462-96-0	CCC1(CCCC1)O	{1: 1, 2: 1, 11: 4, 20: 1, 13: 1}
OK	1462-97-1	CCCCC1(CCCC1)O	{1: 1, 2: 3, 11: 4, 20: 1, 13: 1}
OK	14620-52-1	CCCCCCCCCCCC(OC)OC	{1: 3, 2: 10, 3: 1, 22: 2}
OK	14620-81-6	C(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)O	{16: 23, 20: 1, 2: 1, 4: 11, 22: 3}
OK	14621-07-9	CC[C@H](CO)N.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 1, 2: 2, 3: 3, 20: 3, 27: 2, 30: 1}
OK	1464-53-5	C1C(O1)C2CO2	{11: 2, 12: 2, 23: 2}
OK	1464-69-3	CC(=C)C(=O)OCCOC=C	{1: 1, 2: 2, 5: 2, 6: 1, 7: 1, 22: 1, 28: 1}
OK	14641-24-8	C(COCC(CO)O)O	{2: 4, 3: 1, 20: 3, 22: 1}
OK	14642-48-9	CC(C(C(C)O)O)O	{1: 2, 3: 3, 20: 3}
OK	146502-80-9	C[C@H]1CC[C@@H]([C@@H](C1)OC(=O)C)C(C)C	{11: 3, 1: 4, 3: 1, 12: 3, 28: 1}
OK	14660-52-7	CCOC(=O)CCCCBr	{1: 1, 2: 5, 28: 1, 18: 1}
OK	14663-73-1	CCCCCCCCCCCCCOCCOCCO	{1: 1, 2: 16, 20: 1, 22: 2}
OK	1467-16-9	C1=CN=CN1.Cl	{32: 1, 17: 1, 35: 1, 14: 3}
OK	1467-79-4	CN(C)C#N	{1: 2, 37: 1, 33: 1}
OK	146724-94-9	C(CN(CCN)N(N=O)O)N	{33: 2, 2: 4, 34: 1, 20: 1, 29: 1, 30: 2}
OK	14676-29-0	CCCCC(CC)C(C)C	{1: 4, 2: 4, 3: 2}
OK	146782-17-4	CCCCC(CC)C(=O)O.CC(C)CCCC(=O)O.C(C(CO)(CO)CO)O	{1: 4, 2: 11, 3: 2, 4: 1, 20: 4, 27: 2}
OK	1468-40-2	C(CSCC(CO)O)O	{40: 1, 2: 4, 3: 1, 20: 3}
OK	14680-21-8	CCN(CC)C(=O)CSC	{24: 1, 1: 3, 2: 3, 40: 1, 33: 1}
OK	14686-13-6	C/C=C/CCCC	{1: 2, 2: 3, 6: 2}
OK	14686-14-7	CCCC=CCC	{1: 2, 2: 3, 6: 2}
OK	14687-15-1	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)OC)O)O)O	{1: 2, 12: 5, 22: 1, 20: 3, 23: 1}
OK	14689-97-5	CC(OCCCl)OCCCl	{1: 1, 2: 4, 3: 1, 22: 2, 17: 2}
OK	1469-48-3	C1C=CC[C@H]2[C@@H]1C(=O)NC2=O	{32: 1, 25: 2, 11: 2, 12: 2, 14: 2}
OK	14691-52-2	N(=O)OO	{34: 1, 20: 1, 29: 1, 22: 1}
OK	14691-59-9	[O-]O	{20: 1, 29: 1}
OK	146918-70-9	CC(=CCCC1=CCC(CC1)(C)C(=O)OC)C	{1: 4, 2: 2, 6: 1, 7: 1, 11: 3, 13: 1, 14: 1, 15: 1, 28: 1}
OK	146918-71-0	CC(=CCCC1=CCCC(C1)(C)C(=O)OC)C	{1: 4, 2: 2, 6: 1, 7: 1, 11: 3, 13: 1, 14: 1, 15: 1, 28: 1}
OK	14693-11-9	C1C2C=CC3C1C3C=C2	{11: 1, 12: 4, 14: 4}
OK	14697-46-2	C(CC(CO)O)CO	{2: 4, 3: 1, 20: 3}
OK	14697-48-4	CCCCCCCOC(=O)CCCCC(=O)OCCCCCCC	{1: 2, 2: 16, 28: 2}
OK	147-71-7	[C@H]([C@@H](C(=O)O)O)(C(=O)O)O	{27: 2, 3: 2, 20: 2}
OK	147-81-9	O=C[C@@H](O)[C@H](O)[C@H](O)CO	{2: 1, 3: 3, 20: 4, 26: 1}
OK	147-85-3	C1C[C@H](NC1)C(=O)O	{27: 1, 32: 1, 11: 3, 12: 1}
OK	14705-50-1	CC(C)CC(=O)C(C)(C)C	{24: 1, 1: 5, 2: 1, 3: 1, 4: 1}
OK	1471-03-0	CCCOCC=C	{1: 1, 2: 3, 22: 1, 5: 1, 6: 1}
OK	1471-04-1	CC(C)(C)OCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 22: 1}
OK	1471-17-6	C=CCOCC(CO)(COCC=C)COCC=C	{2: 7, 4: 1, 5: 3, 6: 3, 20: 1, 22: 3}
OK	1471-18-7	C=CCOCC(COCC=C)(COCC=C)COCC=C	{2: 8, 22: 4, 4: 1, 5: 4, 6: 4}
OK	14716-32-6	CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C	{1: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 24: 1}
OK	1472-09-9	CCCCCCCCC1CC1	{1: 1, 2: 7, 11: 2, 12: 1}
OK	1472-85-1	CCCCCCCCC(C(=O)OCC)C(=O)OCC	{1: 3, 2: 9, 3: 1, 28: 2}
OK	1472-87-3	COC(=O)CCCCCCCCCCCC(=O)OC	{1: 2, 2: 11, 28: 2}
OK	1472-90-8	CCOC(=O)CCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 18, 28: 2}
OK	14720-74-2	CCCC(C)CC(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	14721-66-5	CC(C)CCCC(C)CCCC(C)CCCC(C)CC(=O)O	{27: 1, 1: 5, 2: 10, 3: 4}
OK	14722-40-8	C(CCCCCCCO)CCCCCCCO	{2: 15, 20: 2}
OK	14727-68-5	CCCCCCCCC=CCCCCCCCCN(C)C	{1: 3, 2: 15, 6: 2, 33: 1}
OK	14734-25-9	CC(C)(C)OC(=O)CCC(=O)OC	{1: 4, 2: 2, 4: 1, 28: 2}
OK	14735-70-7	C1C2C=CC1C3C2C(=O)N3	{32: 1, 25: 1, 11: 1, 12: 4, 14: 2}
OK	14738-96-6	CC1=COCO1	{23: 2, 1: 1, 11: 1, 14: 1, 15: 1}
OK	14738-97-7	CC1OC=C(O1)C	{1: 2, 23: 2, 12: 1, 14: 1, 15: 1}
OK	14738-99-9	CC1OCC(=C)O1	{1: 1, 5: 1, 11: 1, 12: 1, 15: 1, 23: 2}
OK	14739-72-1	CCCCCCCCCCC(CCCCC)CCCCCCCCCC	{1: 3, 2: 22, 3: 1}
OK	14739-73-2	CC(CC(C)(C)C)C(C)(C)C	{1: 7, 2: 1, 3: 1, 4: 2}
OK	14743-58-9	CC(C)(C)C1C(C1=O)C(C)(C)C	{1: 6, 4: 2, 12: 2, 25: 1}
OK	14745-52-9	COC(=O)CN1CC1	{1: 1, 2: 1, 11: 2, 28: 1, 33: 1}
OK	14746-98-6	C1CN(C(=O)N1)C(=O)N	{32: 1, 33: 1, 11: 2, 24: 1, 25: 1, 30: 1}
OK	14749-45-2	CCOC(=O)C(CCCCl)C(=O)C	{1: 2, 2: 4, 3: 1, 17: 1, 24: 1, 28: 1}
OK	14749-76-9	CN(C)C1=CC(=C2C1=CC=C2)N(C)C	{1: 4, 33: 2, 14: 4, 15: 4}
OK	147501-85-7	CC(CO)(C(=O)OC)O	{1: 2, 2: 1, 4: 1, 20: 2, 28: 1}
OK	14752-61-5	CCCC#CI	{1: 1, 2: 2, 19: 1, 10: 2}
OK	14752-92-2	CC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)OC.CC(=O)O	{1: 3, 2: 5, 3: 1, 24: 2, 27: 1, 28: 1, 30: 1, 31: 2}
OK	1476-11-5	C(C=CCCl)Cl	{17: 2, 2: 2, 6: 2}
OK	1476-23-9	C=CCN=C=O	{2: 1, 5: 1, 6: 1, 8: 1, 34: 1, 29: 1}
OK	1476-39-7	C(CCN)CCN.Cl.Cl	{17: 2, 2: 5, 30: 2}
OK	14760-99-7	CN(C(=O)C(=O)N(C)[N+](=O)[O-])[N+](=O)[O-]	{24: 2, 1: 2, 38: 2, 33: 2}
OK	14762-94-8	[F]	{16: 1}
OK	14763-81-6	CC(=C)C=C=C	{8: 1, 1: 1, 5: 2, 6: 1, 7: 1}
OK	14765-30-1	CCC(C)C1CCCCC1=O	{1: 2, 2: 1, 3: 1, 11: 4, 12: 1, 25: 1}
OK	1477-57-2	C(CCCCNC(=O)C(Cl)Cl)CCCNC(=O)C(Cl)Cl	{24: 2, 17: 4, 2: 8, 3: 2, 31: 2}
OK	14771-77-8	CC(C)C1C(=O)NCC(=O)N1	{32: 2, 1: 2, 3: 1, 11: 1, 12: 1, 25: 2}
OK	14773-00-3	C[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CCC(=O)C4)C)O)C	{1: 4, 2: 2, 3: 1, 11: 8, 12: 6, 13: 2, 20: 1, 25: 1, 28: 1}
OK	14777-27-6	CC(=N)OC.Cl	{1: 2, 17: 1, 36: 1, 22: 1, 7: 1}
OK	14779-92-1	CC(C)CCCCCC(C)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	1478-04-2	C(F)(Br)(Br)I	{16: 1, 18: 2, 19: 1, 4: 1}
OK	14783-50-7	C1CC2(C1)CCC=C2	{11: 5, 13: 1, 14: 2}
OK	14788-65-9	CC1CC(C2CCCCC2N1C)(C#C)O	{1: 2, 33: 1, 9: 1, 10: 1, 11: 5, 12: 3, 13: 1, 20: 1}
OK	14788-78-4	C[C@H]1C[C@@H]2[C@H]([C@H]([C@]3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5C(=O)C4=C3C)C)OC(=O)C)C)NC1	{32: 1, 1: 5, 11: 8, 12: 8, 13: 2, 14: 1, 15: 3, 23: 1, 25: 1, 28: 1}
OK	14789-33-4	CN1CC2CC(C1)CN(C2)C	{1: 2, 11: 5, 12: 2, 33: 2}
OK	14794-31-1	CCOC(=O)CCC(=O)Cl	{24: 1, 1: 1, 2: 3, 28: 1, 17: 1}
OK	14797-65-0	O=N[O-]	{34: 1, 29: 2}
OK	14797-73-0	[O-][Cl+3]([O-])([O-])[O-]	{17: 1, 29: 4}
OK	14803-30-6	CC1C(=C=C(C)C)C1(C)C	{1: 5, 7: 1, 8: 1, 12: 1, 13: 1, 15: 1}
OK	14803-42-0	CC1CC2CCC1C=C2	{1: 1, 11: 3, 12: 3, 14: 2}
OK	14806-73-6	CC(=O)OCCN(CCO)CCO	{1: 1, 2: 6, 20: 2, 28: 1, 33: 1}
OK	1481-36-3	C1CCC(C1)F	{16: 1, 11: 4, 12: 1}
OK	14811-73-5	COC(=O)CCCCCCCCC=O	{1: 1, 2: 8, 28: 1, 26: 1}
OK	14811-95-1	C=CCCCCCCCCCCCCCCCCC=C	{2: 16, 5: 2, 6: 2}
OK	1482-15-1	CC(C)C(C)(C#C)O	{1: 3, 3: 1, 4: 1, 9: 1, 10: 1, 20: 1}
OK	1482-50-4	C[C@]12CCC(=O)C[C@H]1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O	{1: 2, 2: 1, 11: 8, 12: 5, 13: 3, 20: 3, 24: 1, 25: 1}
OK	1482-91-3	C=CC=CC=CC=C	{5: 2, 6: 6}
OK	1483-07-4	C([C@@H](C(=O)O)N)NC(=O)N	{2: 1, 3: 1, 24: 1, 27: 1, 30: 2, 31: 1}
OK	1483-67-6	CCCCC#CC(=O)O	{1: 1, 2: 3, 27: 1, 10: 2}
OK	148348-13-4	CC(C)C=NC(C)(C)CN1C(OCC1(C)C)C(C)C	{1: 8, 2: 1, 3: 2, 4: 1, 6: 1, 33: 1, 11: 1, 12: 1, 13: 1, 34: 1, 23: 1}
OK	1484-80-6	CCC1CCCCN1	{32: 1, 1: 1, 2: 1, 11: 4, 12: 1}
OK	1484-84-0	C1CCNC(C1)CCO	{32: 1, 20: 1, 2: 2, 11: 4, 12: 1}
OK	1484-87-3	CC(C)CC(C)(C)CCO	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	14845-55-7	CC(C)C1CCCC1=O	{11: 3, 1: 2, 3: 1, 12: 1, 25: 1}
OK	148462-57-1	CCC(=O)OC(C)COC	{1: 3, 2: 2, 3: 1, 28: 1, 22: 1}
OK	14850-22-7	CCCCC=CCC	{1: 2, 2: 4, 6: 2}
OK	14850-23-8	CCCC=CCCC	{1: 2, 2: 4, 6: 2}
OK	14852-31-4	CCCCCCCCCCCCCCC(C)O	{1: 2, 2: 13, 3: 1, 20: 1}
OK	14857-82-0	CC(C)C[C@@H](C(=O)O)NC(=O)CNC(=O)CN	{1: 2, 2: 3, 3: 2, 24: 2, 27: 1, 30: 1, 31: 2}
OK	1486-75-5	C1CCCCCC=CCCCC1	{11: 10, 14: 2}
OK	14866-68-3	[O-]Cl(=O)=O	{17: 1, 29: 3}
OK	14867-83-5	C1=CC2(C=C1)C=CC=C2	{13: 1, 14: 8}
OK	1487-15-6	CC1=CCCO1	{23: 1, 1: 1, 11: 2, 14: 1, 15: 1}
OK	1487-49-6	CC(CC(=O)OC)O	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	1488-25-1	C1=CC2C(O2)C=C1	{12: 2, 14: 4, 23: 1}
OK	148865-00-3	CCC(C)C1C(C=CC2(O1)CC3CC(O2)C/C=C(/C(C(/C=C/C=C/4\COC5C4(C(C=C(C5O)COCOCCOC)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)NC(=O)C)OC)OC)\C)C	{1: 11, 2: 5, 3: 1, 11: 6, 12: 17, 13: 2, 14: 7, 15: 3, 20: 2, 22: 7, 23: 5, 24: 1, 28: 1, 31: 1}
OK	148865-08-1	CCC(C)C1C(C=CC2(O1)CC3CC(O2)C/C=C(/C(C(/C=C/C=C/4\COC5C4(C(C=C(C5O)CO)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)OCOCCOC)OC)OC)\C)C	{1: 10, 2: 5, 3: 1, 11: 6, 12: 17, 13: 2, 14: 7, 15: 3, 20: 3, 22: 7, 23: 5, 28: 1}
OK	148865-44-5	CCC(C)C1C(CCC2(O1)CC3CC(O2)C/C=C(/C(C(/C=C/C=C/4\COC5C4(C(C=C(C5O)COCOCCOC)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)NC(=O)C)OC)OC)\C)C	{1: 11, 2: 5, 3: 1, 11: 8, 12: 17, 13: 2, 14: 5, 15: 3, 20: 2, 22: 7, 23: 5, 24: 1, 28: 1, 31: 1}
OK	1489-47-0	CCCCCC(C)CCCO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	1489-56-1	CC1=CC=CCC1	{1: 1, 11: 2, 14: 3, 15: 1}
OK	1489-57-2	CC1=CCCC=C1	{1: 1, 11: 2, 14: 3, 15: 1}
OK	1489-58-3	C1C(C1C(=O)O)C(=O)O	{27: 2, 11: 1, 12: 2}
OK	1489-60-7	CC1=CCC1	{1: 1, 11: 2, 14: 1, 15: 1}
OK	1489-69-6	C1CC1C=O	{26: 1, 11: 2, 12: 1}
OK	1489-74-3	C1CC(=O)CCCC(=O)C1	{25: 2, 11: 6}
OK	14898-79-4	CC[C@@H](C)O	{1: 2, 2: 1, 3: 1, 20: 1}
OK	14899-36-6	CCCCCCCCCCCCCCCC(=O)OCC(=O)[C@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)O	{1: 4, 2: 15, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	149-29-1	C1C=C2C(=CC(=O)O2)C(O1)O	{11: 1, 12: 1, 14: 2, 15: 2, 20: 1, 23: 1, 28: 1}
OK	149-31-5	CCC(C(C)CO)O	{1: 2, 2: 2, 3: 2, 20: 2}
OK	149-32-6	C(C(C(CO)O)O)O	{2: 2, 3: 2, 20: 4}
OK	149-57-5	CCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 4, 3: 1}
OK	149-73-5	COC(OC)OC	{1: 3, 3: 1, 22: 3}
OK	149-87-1	C1CC(=O)NC1C(=O)O	{27: 1, 25: 1, 11: 2, 12: 1, 32: 1}
OK	1490-04-6	CC1CCC(C(C1)O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 20: 1}
OK	1490-19-3	CC(=O)OCC(C)(C)N=NC(C)(C)COC(=O)C	{1: 6, 2: 2, 4: 2, 34: 2, 28: 2}
OK	1490-25-1	COC(=O)CCC(=O)Cl	{24: 1, 1: 1, 2: 2, 28: 1, 17: 1}
OK	14900-04-0	I[I-]I	{19: 3}
OK	14901-07-6	CC1=C(C(CCC1)(C)C)/C=C/C(=O)C	{1: 4, 6: 2, 11: 3, 13: 1, 15: 2, 24: 1}
OK	14901-08-7	C/[N+](=N/CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)/[O-]	{1: 1, 2: 2, 33: 1, 12: 5, 34: 1, 20: 4, 22: 1, 23: 1, 29: 1}
OK	14905-56-7	CCCCC(C)CCCC(C)CCCC(C)C	{1: 5, 2: 9, 3: 3}
OK	14906-26-4	CC(=CC#COO)C	{1: 2, 6: 1, 7: 1, 10: 2, 20: 1, 22: 1}
OK	14907-98-3	CC1=C(C(=O)C[C@]2([C@H]1C[C@@H]3[C@]45[C@@H]2[C@H]([C@@H]([C@]([C@@H]4[C@H](C(=O)O3)OC(=O)C=C(C)C)(OC5)C(=O)OC)O)O)C)O	{1: 5, 6: 1, 7: 1, 11: 3, 12: 7, 13: 3, 15: 2, 20: 3, 23: 1, 25: 1, 28: 3}
OK	14915-07-2	[O-][O-]	{29: 2}
OK	14916-79-1	CCCC#CCCO	{1: 1, 2: 4, 20: 1, 10: 2}
OK	14916-80-4	CCCCC#CCCO	{1: 1, 2: 5, 20: 1, 10: 2}
OK	14918-21-9	C#CCCCC#N	{9: 1, 2: 3, 10: 1, 37: 1}
OK	14919-01-8	CCCC/C=C/CC	{1: 2, 2: 4, 6: 2}
OK	1492-24-6	CC[C@@H](C(=O)O)N	{27: 1, 1: 1, 2: 1, 3: 1, 30: 1}
OK	14924-53-9	CCOC(=O)C1CCC1	{1: 1, 2: 1, 11: 3, 12: 1, 28: 1}
OK	14925-39-4	C=C(C=O)Br	{18: 1, 26: 1, 5: 1, 7: 1}
OK	1493-01-2	C(F)(I)I	{16: 1, 19: 2, 3: 1}
OK	1493-02-3	C(=O)F	{16: 1, 26: 1}
OK	1493-03-4	C(F)(F)I	{16: 2, 19: 1, 3: 1}
OK	1493-15-8	C(F)(F)(F)S	{16: 3, 4: 1, 39: 1}
OK	149344-81-0	CC(=C)C(=O)OC.C=CC(=O)O.C(CO)N	{1: 2, 2: 2, 5: 2, 6: 1, 7: 1, 20: 1, 27: 1, 28: 1, 30: 1}
OK	14936-66-4	CCCCCCCC(C)OC(=O)C	{1: 3, 2: 6, 3: 1, 28: 1}
OK	14936-67-5	CCCCCCCCCC(C)OC(=O)C	{1: 3, 2: 8, 3: 1, 28: 1}
OK	14947-20-7	CC=CC=CC=CC	{1: 2, 6: 6}
OK	1495-28-9	C(N=O)(F)(Cl)Cl	{16: 1, 17: 2, 34: 1, 4: 1, 29: 1}
OK	1495-50-7	C(#N)F	{16: 1, 37: 1}
OK	14952-05-7	CCCCCC/C=C/C(=O)N	{24: 1, 1: 1, 2: 5, 30: 1, 6: 2}
OK	14959-86-5	CCCCC=CCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 2}
OK	14960-08-8	CCCCCCCCCCCCCCNCCC(=O)O	{1: 1, 2: 15, 27: 1, 31: 1}
OK	14963-40-7	CC1CC=CC1=O	{1: 1, 11: 1, 12: 1, 14: 2, 25: 1}
OK	1497-16-1	C1CC2(C1)CC(=O)NC2=O	{32: 1, 25: 2, 11: 4, 13: 1}
OK	1497-19-4	CCCC1(CC(=O)NC1=O)C	{32: 1, 1: 2, 2: 2, 11: 1, 13: 1, 25: 2}
OK	14970-83-3	C(CCS)CO	{2: 4, 20: 1, 39: 1}
OK	14970-87-7	C(COCCS)OCCS	{2: 6, 22: 2, 39: 2}
OK	14979-39-6	CCCC(C)C(CC)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	14980-92-8	CCCCCCCCCCCCC(C(=O)OCC)Br	{1: 2, 2: 12, 3: 1, 28: 1, 18: 1}
OK	14984-78-2	N(=O)N(F)F	{16: 2, 33: 1, 34: 1, 29: 1}
OK	1499-55-4	COC(=O)CC[C@@H](C(=O)O)N	{1: 1, 2: 2, 3: 1, 27: 1, 28: 1, 30: 1}
OK	14993-07-8	C1CC2C=CCC1C=C2	{11: 3, 12: 2, 14: 4}
OK	149948-69-6	COC(CC(=O)OC)C(=O)OC	{1: 3, 2: 1, 3: 1, 28: 2, 22: 1}
OK	14995-50-7	CC(=C1C2CCC1C=C2)C	{1: 2, 7: 1, 11: 2, 12: 2, 14: 2, 15: 1}
OK	14998-27-7	[O-]Cl=O	{17: 1, 29: 2}
OK	149982-46-7	CCCC=CCOC(=O)CC1CCCC1	{1: 1, 2: 4, 6: 2, 11: 4, 12: 1, 28: 1}
OK	150-25-4	C(CO)N(CCO)CC(=O)O	{33: 1, 2: 5, 27: 1, 20: 2}
OK	150-39-0	C(CN(CC(=O)O)CC(=O)O)N(CCO)CC(=O)O	{33: 2, 2: 7, 27: 3, 20: 1}
OK	150-77-6	CCN(CC)CCN(CC)CC	{1: 4, 2: 6, 33: 2}
OK	150-81-2	CCCCCCCCC=CCCCCCCCC(=O)OCC1CCOC1	{1: 1, 2: 15, 6: 2, 11: 3, 12: 1, 23: 1, 28: 1}
OK	150-84-5	CC(CCC=C(C)C)CCOC(=O)C	{1: 4, 2: 4, 3: 1, 6: 1, 7: 1, 28: 1}
OK	150-86-7	C[C@@H](CCC[C@@H](C)CCCC(=CCO)C)CCCC(C)C	{1: 5, 2: 10, 3: 3, 6: 1, 7: 1, 20: 1}
OK	1500-76-1	CC1(CC(=CC(=O)C1)NC2CCCCC2)C	{1: 2, 11: 7, 12: 1, 13: 1, 14: 1, 15: 1, 25: 1, 31: 1}
OK	15001-42-0	C1=CC=[N+](C=C1)CCCCCCCCCCCCCC[N+]2=CC=CC=C2.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O	{17: 2, 2: 14, 29: 8, 14: 10, 33: 2}
OK	1501-06-0	CCOC(=O)CCC(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 4, 3: 1, 28: 2}
OK	1501-26-4	COC(=O)CCCC(=O)Cl	{24: 1, 1: 1, 2: 3, 28: 1, 17: 1}
OK	1501-27-5	COC(=O)CCCC(=O)O	{1: 1, 2: 3, 27: 1, 28: 1}
OK	1501-58-2	CC1=C(CC1)C	{1: 2, 11: 2, 15: 2}
OK	1501-82-2	C1CCCCC/C=C\CCCC1	{11: 10, 14: 2}
OK	1501-84-4	CC(C12CC3CC(C1)CC(C3)C2)N.Cl	{1: 1, 3: 1, 11: 6, 12: 3, 13: 1, 17: 1, 30: 1}
OK	15013-37-3	CCC(C)CSC	{40: 1, 1: 3, 2: 2, 3: 1}
OK	1502-00-7	CN(C)C(=O)C12CC3CC(C1)CC(C3)C2	{1: 2, 33: 1, 11: 6, 12: 3, 13: 1, 24: 1}
OK	1502-03-0	C1CCCCCC(CCCCC1)N	{11: 11, 12: 1, 30: 1}
OK	1502-04-1	C1CCCC=CCCC=CCC1	{11: 8, 14: 4}
OK	1502-05-2	C1CCCCC(CCCC1)O	{20: 1, 11: 9, 12: 1}
OK	1502-06-3	C1CCCCC(=O)CCCC1	{25: 1, 11: 9}
OK	1502-22-3	C1CCC(=CC1)C2CCCCC2=O	{25: 1, 11: 8, 12: 1, 14: 1, 15: 1}
OK	1502-24-5	CC1CCCC(C1C)O	{1: 2, 11: 3, 12: 3, 20: 1}
OK	1502-38-1	CC1CCCCCCC1	{1: 1, 11: 7, 12: 1}
OK	150226-22-5	CC(C)C1(C(=O)NC(=O)N1)C	{32: 2, 1: 3, 3: 1, 13: 1, 25: 2}
OK	150285-07-7	CCC(C)(C)NC(C)(C)CC(C)(C)C	{1: 8, 2: 2, 4: 3, 31: 1}
OK	15029-30-8	C1CCN(CC1)C(=O)CC#N	{24: 1, 33: 1, 2: 1, 11: 5, 37: 1}
OK	15029-32-0	C1COCCN1C(=O)CC#N	{33: 1, 2: 1, 37: 1, 11: 4, 23: 1, 24: 1}
OK	150403-89-7	CC(=NCCCC[C@@H](C(=O)O)N)N.Cl.Cl	{1: 1, 2: 4, 3: 1, 7: 1, 34: 1, 17: 2, 27: 1, 30: 2}
OK	15045-43-9	CC1(CCC(O1)(C)C)C	{1: 4, 11: 2, 13: 2, 23: 1}
OK	15056-34-5	NN=N	{34: 1, 36: 1, 30: 1}
OK	15056-35-6	[O-]I(=O)(=O)=O	{19: 1, 29: 4}
OK	150632-05-6	CCCCC(CC)CC(C(C)(C)C(C(C)C)O)O.CC(CO)O.C(CCC(=O)O)CC(=O)O	{1: 7, 2: 10, 3: 5, 4: 1, 20: 4, 27: 2}
OK	15065-65-3	[O-]I	{19: 1, 29: 1}
OK	15075-50-0	C=CCOCCOCCO	{2: 5, 22: 2, 20: 1, 5: 1, 6: 1}
OK	150785-53-8	CC[C@@H]1[C@@H]([C@@H]([C@H](C2=C(CC(O2)([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)OC3CC(CC(O3)C)(C)OC)C)OC4C(C(CC(O4)C)N(C)CC)O)C)C)C)O)C	{1: 13, 2: 2, 33: 1, 11: 4, 12: 14, 13: 2, 15: 2, 20: 2, 22: 3, 23: 3, 28: 1}
OK	1508-94-7	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC(=O)[C@]3(C)CCC(=O)O)C	{1: 5, 2: 5, 3: 2, 11: 6, 12: 4, 13: 2, 25: 1, 27: 1}
OK	15080-25-8	CC1(OCC2(O1)C(C3C(CO2)OC(O3)(C)C)O)C	{1: 4, 11: 2, 12: 3, 13: 3, 20: 1, 23: 5}
OK	15080-58-7	CC(CO)(CO)COC(=O)CCCCC(=O)OCC(C)(CO)CO	{1: 2, 2: 10, 4: 2, 20: 4, 28: 2}
OK	15082-13-0	CC1=CC(=C)C1	{1: 1, 11: 1, 5: 1, 14: 1, 15: 2}
OK	1509-34-8	CC[C@@H](C)[C@@H](C(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	1509-35-9	CC[C@H](C)[C@H](C(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	151-00-8	CC(C)C=NO	{1: 2, 34: 1, 3: 1, 20: 1, 6: 1}
OK	151-13-3	CCCCCCC(CC=CCCCCCCCC(=O)OCCCC)O	{1: 2, 2: 16, 3: 1, 6: 2, 20: 1, 28: 1}
OK	151-16-6	C(CSC(=N)N)N	{40: 1, 2: 2, 36: 1, 30: 2, 7: 1}
OK	151-18-8	C(CN)C#N	{2: 2, 37: 1, 30: 1}
OK	151-19-9	CCC(C)CCC(C)(CC)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	151-32-6	CCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCC	{1: 2, 2: 20, 28: 2}
OK	151-51-9	C(=N)=N	{8: 1, 36: 2}
OK	151-56-4	C1CN1	{32: 1, 11: 2}
OK	151-67-7	C(C(F)(F)F)(Cl)Br	{16: 3, 17: 1, 18: 1, 3: 1, 4: 1}
OK	151-83-7	CCC#CC(C)C1(C(=O)NC(=O)N(C1=O)C)CC=C	{32: 1, 1: 3, 2: 2, 3: 1, 5: 1, 6: 1, 33: 1, 10: 2, 13: 1, 25: 3}
OK	1510-31-2	C(=O)(N)N(F)F	{16: 2, 24: 1, 30: 1, 33: 1}
OK	15104-03-7	CC1CCN(CC1)N=O	{1: 1, 34: 1, 33: 1, 11: 4, 12: 1, 29: 1}
OK	15104-61-7	C(C(Cl)Cl)(C(Cl)Cl)Cl	{17: 5, 3: 3}
OK	1511-62-2	C(F)(F)Br	{16: 2, 18: 1, 3: 1}
OK	15111-56-5	CCOC(=O)C1CCC=CC1	{1: 1, 2: 1, 11: 3, 12: 1, 14: 2, 28: 1}
OK	15111-96-3	CC(=C)C1CCC(=CC1)COC(=O)C	{1: 2, 2: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 28: 1}
OK	15114-35-9	C1(=O)NC(=O)N(C(=O)N1)Br	{32: 2, 25: 3, 18: 1, 33: 1}
OK	1512-28-3	C(F)(Cl)I	{16: 1, 17: 1, 3: 1, 19: 1}
OK	15123-69-0	CC1=CC[C@@H]2C3C1[C@]2(CC[C@H]3C(C)C)C	{1: 4, 3: 1, 11: 3, 12: 4, 13: 1, 14: 1, 15: 1}
OK	151259-38-0	CC(C)(C)OC(=O)N(CC=C)CC=C	{1: 3, 2: 2, 4: 1, 5: 2, 6: 2, 33: 1, 28: 1}
OK	1513-60-6	CCOC(=O)C=C(C(F)(F)F)C(F)(F)F	{1: 1, 2: 1, 4: 2, 6: 1, 7: 1, 16: 6, 28: 1}
OK	1513-62-8	COC(=O)C(C(C(C(=O)OC)(F)F)(F)F)(F)F	{16: 6, 1: 2, 4: 3, 28: 2}
OK	1513-88-8	C(CI)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 2: 2, 19: 1, 4: 3}
OK	1513-96-8	C(C(C(C(C(O)F)(F)F)(F)F)(F)F)F	{16: 8, 20: 1, 2: 1, 3: 1, 4: 3}
OK	15130-85-5	C[C@H](CC[C@H]([C@@](C)([C@H]1CC[C@@]2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)C)O)O)O)CO	{1: 4, 2: 3, 3: 2, 4: 1, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 20: 6, 25: 1}
OK	15131-55-2	C1CC(C=C1)OC2CCC=C2	{11: 4, 12: 2, 22: 1, 14: 4}
OK	151328-42-6	CCCN=C(C)N(CC)CC	{1: 4, 2: 4, 34: 1, 33: 1, 7: 1}
OK	15136-26-2	CC1C(=O)NC(C(=O)N1)C(C)C	{32: 2, 1: 3, 3: 1, 12: 2, 25: 2}
OK	1514-42-7	C(C(=O)F)F	{16: 2, 24: 1, 2: 1}
OK	1514-87-0	COC(=O)C(F)(F)Cl	{16: 2, 1: 1, 4: 1, 28: 1, 17: 1}
OK	1515-14-6	CC(C(F)(F)F)(C(F)(F)F)O	{16: 6, 1: 1, 4: 3, 20: 1}
OK	1515-76-0	CC(=O)OC=CC=C	{1: 1, 28: 1, 5: 1, 6: 3}
OK	1515-80-6	CC=CC=CC(=O)OC	{1: 2, 28: 1, 6: 4}
OK	15157-95-6	CC(=C)[CH2]	{1: 1, 5: 2, 7: 1}
OK	15159-40-7	C1COCCN1C(=O)Cl	{24: 1, 17: 1, 11: 4, 33: 1, 23: 1}
OK	1516-01-4	C/C=C/C=C/C#N	{1: 1, 37: 1, 6: 4}
OK	1516-17-2	CC=CC=CCOC(=O)C	{1: 2, 2: 1, 28: 1, 6: 4}
OK	1516-64-9	C(=C(C(F)(F)F)F)(C(F)(F)F)F	{16: 8, 4: 2, 7: 2}
OK	1516-65-0	C(=C(\C(F)(F)F)/F)(\C(F)(F)F)/F	{16: 8, 4: 2, 7: 2}
OK	15162-90-0	N(Br)(Br)Br	{33: 1, 18: 3}
OK	15166-00-4	CC(=C)C(=O)OCCC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 9, 5: 1, 7: 1, 16: 19, 28: 1}
OK	15175-04-9	CCCCCCCCCC(=O)OCCCl	{1: 1, 2: 10, 28: 1, 17: 1}
OK	151789-07-0	CC(C)CCCCCCCCCCOCCCNCCCN	{1: 2, 2: 16, 3: 1, 22: 1, 30: 1, 31: 1}
OK	1518-15-6	C1CC(=C(C#N)C#N)CCC1=C(C#N)C#N	{15: 2, 11: 4, 37: 4, 7: 2}
OK	1518-72-5	CC(C)CSSCC(C)C	{40: 2, 1: 4, 2: 2, 3: 2}
OK	15186-48-8	CC1(OC[C@@H](O1)C=O)C	{1: 2, 11: 1, 12: 1, 13: 1, 23: 2, 26: 1}
OK	151907-79-8	CC(C)(C)OC(=O)NC1CC(C=C1)C(=O)O	{1: 3, 4: 1, 11: 1, 12: 2, 14: 2, 27: 1, 28: 1, 31: 1}
OK	15192-80-0	C/C=C/C=C/C=C/C	{1: 2, 6: 6}
OK	15196-51-7	CCCCCCCCCCCCCCCCCC(=O)OCC(C)(C)COC(=O)CCCCCCCCCCCCCCCCC	{1: 4, 2: 34, 4: 1, 28: 2}
OK	152-58-9	CC12CCC(=O)C=C1CCC3C2CCC4(C3CC[C@@]4(C(=O)CO)O)C	{1: 2, 2: 1, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1}
OK	152-62-5	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@@H]3[C@H]2C=CC4=CC(=O)CC[C@@]34C)C	{1: 3, 11: 6, 12: 4, 13: 2, 14: 3, 15: 1, 24: 1, 25: 1}
OK	152-97-6	C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@H]3[C@H](C[C@@]2([C@H]1C(=O)CO)C)O)C)F	{1: 3, 2: 1, 11: 3, 12: 7, 13: 2, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1}
OK	1521-51-3	C1CC=CC(C1)Br	{18: 1, 11: 3, 12: 1, 14: 2}
OK	15216-10-1	C1CN(C1)N=O	{33: 1, 34: 1, 11: 3, 29: 1}
OK	152187-60-5	C1CCC(=O)OCC1.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O.C(COCCO)O	{2: 5, 34: 2, 8: 2, 11: 7, 13: 2, 14: 8, 20: 2, 22: 1, 28: 1, 29: 2}
OK	152187-68-3	CC1CO1.C1CC(CCC1CO)CO.C1CO1.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O	{1: 1, 2: 3, 34: 2, 8: 2, 11: 9, 12: 3, 13: 2, 14: 8, 20: 2, 23: 2, 29: 2}
OK	15219-34-8	C(=O)(C(=O)Br)Br	{24: 2, 18: 2}
OK	15219-97-3	C(COCC(C(=O)O)N)N	{27: 1, 2: 3, 3: 1, 30: 2, 22: 1}
OK	1522-20-9	C/C(=C/C(=O)C)/O	{24: 1, 1: 2, 20: 1, 6: 1, 7: 1}
OK	1522-22-1	C(C(=O)C(F)(F)F)C(=O)C(F)(F)F	{16: 6, 24: 2, 2: 1, 4: 2}
OK	1522-46-9	CCOC(=O)C(C(C)C)C(=O)C	{24: 1, 1: 4, 2: 1, 3: 2, 28: 1}
OK	1522-88-9	C(C(CI)(CI)CI)I	{2: 4, 19: 4, 4: 1}
OK	15222-64-7	C1C2CC(C1C=C2)C=CC(=O)O	{27: 1, 11: 2, 12: 3, 14: 2, 6: 2}
OK	15232-76-5	CCCCC#CCC	{1: 2, 2: 4, 10: 2}
OK	15232-78-7	CCCCCCC1CCCC=C1	{1: 1, 2: 5, 11: 3, 12: 1, 14: 2}
OK	15232-85-6	CCCCCC1=CCCCC1	{1: 1, 2: 4, 11: 4, 14: 1, 15: 1}
OK	15232-86-7	CCCCCCCC1=CCCCC1	{1: 1, 2: 6, 11: 4, 14: 1, 15: 1}
OK	15232-91-4	CCC(C)C1CCCC=C1	{1: 2, 2: 1, 3: 1, 11: 3, 12: 1, 14: 2}
OK	15232-95-8	C=CCC1CCCC=C1	{2: 1, 5: 1, 6: 1, 11: 3, 12: 1, 14: 2}
OK	152375-23-0	CCCCC[C@H]([C@@H]1[C@@H](O1)C=O)O	{1: 1, 2: 4, 3: 1, 12: 2, 20: 1, 23: 1, 26: 1}
OK	152375-75-2	CC(=C)CCCCCCCCCCCCCCCC(CC(=O)O)C(=O)O	{1: 1, 2: 16, 3: 1, 5: 1, 7: 1, 27: 2}
OK	15250-22-3	CC(C)CCCCC(C)CO	{1: 3, 2: 5, 3: 2, 20: 1}
OK	15263-52-2	CN(C)C(CSC(=O)N)CSC(=O)N.Cl	{1: 2, 2: 2, 3: 1, 33: 1, 40: 2, 17: 1, 24: 2, 30: 2}
OK	15268-40-3	CCCCCCCCCCCCCCCCCCCCCCNCCCN	{1: 1, 2: 24, 30: 1, 31: 1}
OK	15268-49-2	CCCOCC(C)C	{1: 3, 2: 3, 3: 1, 22: 1}
OK	15271-41-7	CNC(=O)ON=C1C2CC(C1Cl)CC2C#N	{1: 1, 34: 1, 37: 1, 11: 2, 12: 4, 15: 1, 17: 1, 28: 1, 31: 1}
OK	1528-21-8	CC=C1CCC1	{1: 1, 11: 3, 6: 1, 15: 1}
OK	1528-22-9	CC(=C1CCC1)C	{15: 1, 1: 2, 11: 3, 7: 1}
OK	1528-25-2	CCCC(=O)C(CC)CC	{24: 1, 1: 3, 2: 4, 3: 1}
OK	1528-30-9	C=C1CCCC1	{11: 4, 5: 1, 15: 1}
OK	152897-19-3	COC1(CC(C1)(OC)OC)OC	{1: 4, 11: 2, 13: 2, 22: 4}
OK	1529-68-6	C(C(C(CBr)Br)Br)Br	{2: 2, 3: 2, 18: 4}
OK	15297-07-1	CC(C)C1CCC(=C)C(=O)C1	{1: 2, 3: 1, 5: 1, 11: 3, 12: 1, 15: 1, 25: 1}
OK	1530-87-6	C1CCN(CC1)C#N	{33: 1, 11: 5, 37: 1}
OK	1530-88-7	C1CCN(C1)C#N	{33: 1, 11: 4, 37: 1}
OK	1530-89-8	C1COCCN1C#N	{33: 1, 11: 4, 37: 1, 23: 1}
OK	15306-27-1	CCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 24, 5: 1, 6: 1}
OK	15333-22-9	CCOC(=O)C=CCCl	{1: 1, 2: 2, 28: 1, 6: 2, 17: 1}
OK	15336-82-0	CCC1(C(=O)N(C(=O)N1CC2CO2)CC3CO3)C	{1: 2, 2: 3, 33: 2, 11: 2, 12: 2, 13: 1, 23: 2, 25: 2}
OK	15337-44-7	C[N]C	{1: 2, 34: 1}
OK	15337-64-1	CCCCCCCCCCCCCCCCCC(=O)OCCCCO	{1: 1, 2: 20, 20: 1, 28: 1}
OK	1534-08-3	CC(=O)SC	{24: 1, 1: 2, 40: 1}
OK	1534-26-5	CCCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 10}
OK	1534-27-6	CCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 9}
OK	15340-96-2	CC(C)CCCC(C)C(C)O	{1: 4, 2: 3, 3: 3, 20: 1}
OK	15352-77-9	CC1=CCC(CC1)(C(C)CCC=C(C)C)O	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 11: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	15358-48-2	C1C[C@@H]2[C@H]3C[C@@H](CN2C(=O)C1)[C@@H]4C[C@H](CCN4C3)O	{20: 1, 11: 9, 12: 5, 33: 2, 25: 1}
OK	15360-42-6	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C.C1(C(=O)NC(=O)N1)NC(=O)N	{32: 2, 1: 4, 11: 8, 12: 6, 13: 2, 14: 1, 15: 1, 24: 2, 25: 2, 28: 1, 30: 1, 31: 1}
OK	15364-23-5	Cl.[Cl-]	{17: 2}
OK	15364-56-4	CC(=O)CN(C)C	{24: 1, 1: 3, 2: 1, 33: 1}
OK	1537-62-8	C(CCl)OC(=O)CF	{16: 1, 17: 1, 2: 3, 28: 1}
OK	153725-47-4	CCOC(=O)[C@@H]1[C@@H](CCCC1(C)C)C	{1: 4, 2: 1, 11: 3, 12: 2, 13: 1, 28: 1}
OK	1538-87-0	CC(OC)Cl	{1: 2, 3: 1, 22: 1, 17: 1}
OK	153922-89-5	C1CC=CC(C1)N	{11: 3, 12: 1, 30: 1, 14: 2}
OK	15394-33-9	CSCCCCSC	{40: 2, 1: 2, 2: 4}
OK	153965-61-8	CC(C)(CO)CO.C1CCC(=O)OCC1.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O	{1: 2, 2: 3, 34: 2, 4: 1, 8: 2, 11: 7, 13: 2, 14: 8, 20: 2, 28: 1, 29: 2}
OK	15397-08-7	C(C(C(C1C(C(C(=O)O1)O)O)O)O)O	{20: 5, 2: 1, 3: 2, 12: 3, 28: 1}
OK	154-21-2	CCCC1CC(N(C1)C)C(=O)NC(C2C(C(C(C(O2)SC)O)O)O)C(C)O	{1: 4, 2: 2, 3: 2, 33: 1, 40: 1, 11: 2, 12: 7, 20: 4, 23: 1, 24: 1, 31: 1}
OK	154-93-8	C(CCl)NC(=O)N(CCCl)N=O	{33: 1, 2: 4, 34: 1, 17: 2, 24: 1, 29: 1, 31: 1}
OK	1540-28-9	CCCC(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 3, 3: 1, 28: 1}
OK	1540-29-0	CCCCC(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 4, 3: 1, 28: 1}
OK	1540-34-7	CCC(C(=O)C)C(=O)C	{24: 2, 1: 3, 2: 1, 3: 1}
OK	1540-35-8	CCCC(C(=O)C)C(=O)C	{24: 2, 1: 3, 2: 2, 3: 1}
OK	1540-36-9	CCCCC(C(=O)C)C(=O)C	{24: 2, 1: 3, 2: 3, 3: 1}
OK	1540-38-1	CC(C)C(C(=O)C)C(=O)C	{24: 2, 1: 4, 3: 2}
OK	1540-80-3	C1CCC#CCCCCCC#CCC1	{10: 4, 11: 10}
OK	1540-94-9	CC(C)CNC(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 31: 1}
OK	154016-61-2	COC(OC)OCC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 22: 3}
OK	154016-62-3	COC(OC)(OC)OCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 22: 4}
OK	15403-25-5	CC(CN(F)F)N(F)F	{16: 4, 1: 1, 2: 1, 3: 1, 33: 2}
OK	15403-89-1	CCC1CC2CC1C=C2	{1: 1, 2: 1, 11: 2, 12: 3, 14: 2}
OK	15409-60-6	CN(C)CC1CCCCC1=O	{1: 2, 2: 1, 33: 1, 11: 4, 12: 1, 25: 1}
OK	1541-09-9	CCCCCCC(C)OC	{1: 3, 2: 5, 3: 1, 22: 1}
OK	1541-20-4	C1CC=CC(C1)C2CCCC=C2	{11: 6, 12: 2, 14: 4}
OK	1541-23-7	CC=CCCC=C	{1: 1, 2: 2, 5: 1, 6: 3}
OK	1541-33-9	CC(CC=C)C=C	{1: 1, 2: 1, 3: 1, 5: 2, 6: 2}
OK	1541-66-8	CCCCCCCCCCCCN(CC(C)O)CC(C)O	{1: 3, 2: 13, 3: 2, 20: 2, 33: 1}
OK	1541-67-9	CCCCCCCCCCCCN(CCO)CCO	{1: 1, 2: 15, 20: 2, 33: 1}
OK	1541-81-7	CCCCCCCCCCCCN1CCOCC1	{1: 1, 2: 11, 11: 4, 33: 1, 23: 1}
OK	154170-44-2	CCCCC(C(C)CCC)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	154171-76-3	CC1(CCC2(C3C14CCC(C4)C3(C)C)OCCO2)C	{1: 4, 11: 7, 12: 2, 13: 4, 23: 2}
OK	15419-91-7	CCCOC(=O)CCCCCCCCC(=O)OCCC	{1: 2, 2: 12, 28: 2}
OK	15421-42-8	CCOC(=O)CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 4: 1, 38: 3, 28: 1}
OK	15423-57-1	C/C/1=C\CC/C(=C/CC(=C(C)C)CC1)/C	{15: 3, 1: 4, 11: 5, 14: 2, 7: 1}
OK	154279-60-4	CCC(C)NC1CCC(CC1)CC2CCC(CC2)NC(C)CC	{1: 4, 2: 3, 3: 2, 11: 8, 12: 4, 31: 2}
OK	15429-36-4	CCOC(=O)N(C)N(C)C(=O)OCC	{1: 4, 2: 2, 28: 2, 33: 2}
OK	15430-62-3	CN(C)C(=O)C(C#N)Br	{1: 2, 3: 1, 37: 1, 33: 1, 18: 1, 24: 1}
OK	15430-91-8	C(C(C(C(C(CI)O)O)O)O)I	{19: 2, 2: 2, 3: 4, 20: 4}
OK	15430-98-5	CCCCCCCC=CCCCCCC	{1: 2, 2: 11, 6: 2}
OK	154336-14-8	C1CCC(=O)OCC1.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O.C(CO)COCCCO	{2: 7, 34: 2, 8: 2, 11: 7, 13: 2, 14: 8, 20: 2, 22: 1, 28: 1, 29: 2}
OK	15435-66-2	N(=N[O-])[O-]	{34: 2, 29: 2}
OK	15438-65-0	COC(=O)NCO	{1: 1, 2: 1, 20: 1, 28: 1, 31: 1}
OK	15438-70-7	C(CO)NC(=O)NCCO	{24: 1, 2: 4, 20: 2, 31: 2}
OK	15438-71-8	C1CC(=O)N(C1)CO	{25: 1, 2: 1, 11: 3, 20: 1, 33: 1}
OK	15439-15-3	C1CC2(C1)C=CC=C2	{11: 3, 13: 1, 14: 4}
OK	15439-16-4	C1CNCCCNCCNCCCNC1	{32: 4, 11: 11}
OK	1544-46-3	C(C=O)F	{16: 1, 2: 1, 26: 1}
OK	1544-53-2	C(C(F)(F)F)S	{16: 3, 2: 1, 4: 1, 39: 1}
OK	15441-59-5	CC12C(CCO1)CC(=O)O2	{1: 1, 11: 3, 12: 1, 13: 1, 23: 1, 28: 1}
OK	15443-37-5	C1C2C3C4C1C5C2C3C4C5=O	{25: 1, 11: 1, 12: 8}
OK	15448-47-2	C[C@@H]1CO1	{1: 1, 11: 1, 12: 1, 23: 1}
OK	15448-75-6	CC(=C=C(C(=C)C)C(C)(C)O)C	{1: 5, 4: 1, 5: 1, 7: 3, 8: 1, 20: 1}
OK	154487-83-9	C(CCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN	{33: 6, 2: 40, 30: 8}
OK	154487-85-1	C(CCN(CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CN(CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN	{33: 14, 2: 88, 30: 16}
OK	15451-14-6	CC(C)(CN(C)C)C=O	{1: 4, 2: 1, 4: 1, 26: 1, 33: 1}
OK	15453-05-1	CC(C)(C(=N)N)N=NC(C)(C)C(=N)N.Cl	{1: 4, 34: 2, 4: 2, 7: 2, 17: 1, 36: 2, 30: 2}
OK	15454-31-6	[O-]I(=O)=O	{19: 1, 29: 3}
OK	15454-33-8	C(O)Cl	{17: 1, 2: 1, 20: 1}
OK	15458-48-7	C1C=CCC2C1C(=O)N(C2=O)CCO	{33: 1, 2: 2, 11: 2, 12: 2, 14: 2, 20: 1, 25: 2}
OK	1546-79-8	C1=CN(C=N1)C(=O)C(F)(F)F	{33: 1, 35: 1, 4: 1, 14: 3, 16: 3, 24: 1}
OK	1546-95-8	C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 12, 27: 1, 3: 1, 4: 5}
OK	15469-77-9	CCCCCCC=CCC(=O)O	{1: 1, 2: 6, 27: 1, 6: 2}
OK	1547-87-1	CN(C)C(=O)C(F)(F)F	{16: 3, 1: 2, 4: 1, 24: 1, 33: 1}
OK	15473-29-7	C(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C#N	{2: 2, 4: 1, 37: 1, 38: 3}
OK	15476-85-4	CC(C)(C)OOCCO	{1: 3, 2: 2, 4: 1, 22: 2, 20: 1}
OK	15486-96-1	C(CBr)C(=O)Cl	{24: 1, 17: 1, 2: 2, 18: 1}
OK	154869-43-9	CC(=O)C[C@@H]1CCCCCC(=O)O[C@@H](CCC(=O)CCC(=O)O1)CC(=O)C	{1: 2, 2: 2, 11: 9, 12: 2, 24: 2, 25: 1, 28: 2}
OK	1549-45-7	C1CCC(CC1)OC(=O)C(F)(F)F	{16: 3, 12: 1, 11: 5, 4: 1, 28: 1}
OK	15496-08-9	CC(C)(C#C)OCCC#N	{1: 2, 2: 2, 4: 1, 37: 1, 9: 1, 10: 1, 22: 1}
OK	15498-42-7	C(COC(=O)C=CC(=O)O)OC(=O)C=CC(=O)O	{2: 2, 27: 2, 28: 2, 6: 4}
OK	15499-23-7	[O]OF	{16: 1, 29: 1, 22: 1}
OK	155-30-6	CSC1C(C(C(C(O1)CO)O)O)O	{1: 1, 2: 1, 40: 1, 12: 5, 20: 4, 23: 1}
OK	155-84-0	CC(=O)N[C@@H](CCCN=C(N)N)C(=O)O	{1: 1, 2: 3, 3: 1, 7: 1, 34: 1, 24: 1, 27: 1, 30: 2, 31: 1}
OK	1550-09-0	C(CCCCl)CCF	{16: 1, 17: 1, 2: 6}
OK	1550-44-3	CC(=O)OCC(F)F	{16: 2, 1: 1, 2: 1, 3: 1, 28: 1}
OK	15501-33-4	CC(C)(C)CI	{1: 3, 2: 1, 19: 1, 4: 1}
OK	15503-87-4	C/C=C/1\C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(CO)O)C	{1: 2, 2: 1, 6: 1, 33: 1, 11: 5, 12: 3, 13: 1, 14: 1, 15: 2, 20: 2, 28: 2}
OK	15506-53-3	C1C(=O)CC1=O	{25: 2, 11: 2}
OK	1551-21-9	CC(C)SC	{40: 1, 1: 3, 3: 1}
OK	1551-32-2	CCC1CCCS1	{1: 1, 2: 1, 11: 3, 12: 1, 41: 1}
OK	1551-34-4	CCCC1CCCS1	{1: 1, 2: 2, 11: 3, 12: 1, 41: 1}
OK	1551-43-5	CCCCC(=O)OC1CCCCC1	{1: 1, 2: 3, 11: 5, 12: 1, 28: 1}
OK	1551-44-6	CCCC(=O)OC1CCCCC1	{1: 1, 2: 2, 11: 5, 12: 1, 28: 1}
OK	1551-89-9	C[C@@H]1CCCC(=O)[C@H]1C	{1: 2, 11: 3, 12: 2, 25: 1}
OK	1552-92-7	CCOC(=O)C=C1CCCCC1	{1: 1, 2: 1, 6: 1, 11: 5, 15: 1, 28: 1}
OK	15520-05-5	CCCCCCCCN(CCO)CCO	{1: 1, 2: 11, 20: 2, 33: 1}
OK	15520-10-2	CC(CCCN)CN	{1: 1, 2: 4, 3: 1, 30: 2}
OK	15521-18-3	CC(CO)N(C)C	{1: 3, 2: 1, 3: 1, 20: 1, 33: 1}
OK	1553-36-2	C1CN1CC(=O)NCCCCCCCCNC(=O)CN2CC2	{24: 2, 33: 2, 2: 10, 11: 4, 31: 2}
OK	15536-15-9	C(CCCN)CCCN.Cl.Cl	{17: 2, 2: 7, 30: 2}
OK	15541-45-4	[O-]Br(=O)=O	{18: 1, 29: 3}
OK	15548-56-8	C1=CC(=O)C(=O)C1=O	{25: 3, 14: 2}
OK	1555-17-5	CCCCCCCCCCCCCCCF	{16: 1, 1: 1, 2: 14}
OK	1555-58-4	CN(CCC#N)CCC#N	{1: 1, 2: 4, 37: 2, 33: 1}
OK	1556-08-7	C1CCCC(CCC1)Cl	{17: 1, 11: 7, 12: 1}
OK	1556-09-8	C1CCCC(CCC1)Br	{18: 1, 11: 7, 12: 1}
OK	1556-18-9	C1CCC(C1)I	{19: 1, 11: 4, 12: 1}
OK	15564-44-0	C1C2C=CC1C3C2C=C3	{11: 1, 12: 4, 14: 4}
OK	15566-80-0	CCCCCCCCC=CCCCCCCCC(=O)NCCNCCN	{1: 1, 2: 18, 6: 2, 24: 1, 30: 1, 31: 2}
OK	15567-46-1	CCCCCCCC(=O)N(C)N=O	{1: 2, 2: 6, 33: 1, 34: 1, 24: 1, 29: 1}
OK	15568-57-7	CCN(CCOC(=O)C)C(=O)C	{24: 1, 1: 3, 2: 3, 28: 1, 33: 1}
OK	1557-57-9	C(#N)N=NC#N	{34: 2, 37: 2}
OK	15572-56-2	CC(C)N.Cl	{1: 2, 3: 1, 30: 1, 17: 1}
OK	15575-30-1	CCN(CC)SSN(CC)CC	{40: 2, 1: 4, 2: 4, 33: 2}
OK	15576-35-9	CN(C)C.OCl(=O)(=O)=O	{1: 3, 33: 1, 20: 1, 29: 3, 17: 1}
OK	15577-26-1	C=CC(=O)OCCC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 9, 5: 1, 6: 1, 16: 19, 28: 1}
OK	15582-50-0	CC1=CCCCC1C(C)C	{1: 3, 3: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	155879-96-2	CCC#CC1(CCCC1)O	{1: 1, 2: 1, 10: 2, 11: 4, 13: 1, 20: 1}
OK	15588-62-2	NO.OCl(=O)(=O)=O	{17: 1, 20: 2, 29: 3, 30: 1}
OK	15589-31-8	CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)(C)C)CC=C	{1: 5, 2: 1, 5: 1, 6: 1, 11: 1, 12: 2, 13: 2, 15: 2, 25: 1, 28: 1}
OK	1559-02-0	CCOC(=O)C1(CC1)C(=O)OCC	{1: 2, 2: 2, 11: 2, 28: 2, 13: 1}
OK	1559-34-8	CCCCOCCOCCOCCOCCO	{1: 1, 2: 11, 20: 1, 22: 4}
OK	1559-35-9	CCCCC(CC)COCCO	{1: 2, 2: 7, 3: 1, 20: 1, 22: 1}
OK	1559-36-0	CCCCC(CC)COCCOCCO	{1: 2, 2: 9, 3: 1, 20: 1, 22: 2}
OK	1559-45-1	CC1=CC(=O)C(O1)(C)C	{1: 3, 13: 1, 14: 1, 15: 1, 23: 1, 25: 1}
OK	15594-90-8	CCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 20, 20: 1}
OK	15598-34-2	C1=CC=NC=C1.OCl(=O)(=O)=O	{17: 1, 35: 1, 20: 1, 29: 3, 14: 5}
OK	156-56-9	C=C1CC1CC(C(=O)O)N	{2: 1, 3: 1, 5: 1, 11: 1, 12: 1, 15: 1, 27: 1, 30: 1}
OK	156-57-0	C(CS)N.Cl	{17: 1, 2: 2, 30: 1, 39: 1}
OK	156-59-2	Cl/C=C\Cl	{17: 2, 6: 2}
OK	156-60-5	Cl/C=C/Cl	{17: 2, 6: 2}
OK	156-87-6	C(CN)CO	{2: 3, 20: 1, 30: 1}
OK	1560-11-8	C1CC=C(C1)C(=O)O	{27: 1, 11: 3, 14: 1, 15: 1}
OK	1560-81-2	CCCCCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 19, 3: 1}
OK	1560-82-3	CCCCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 18, 3: 1}
OK	1560-84-5	CCCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 17, 3: 1}
OK	1560-86-7	CCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 16, 3: 1}
OK	1560-88-9	CCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 15, 3: 1}
OK	1560-89-0	CCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 14, 3: 1}
OK	1560-92-5	CCCCCCCCCCCCCCC(C)C	{1: 3, 2: 13, 3: 1}
OK	1560-93-6	CCCCCCCCCCCCCC(C)C	{1: 3, 2: 12, 3: 1}
OK	1560-95-8	CCCCCCCCCCCCC(C)C	{1: 3, 2: 11, 3: 1}
OK	1560-96-9	CCCCCCCCCCCC(C)C	{1: 3, 2: 10, 3: 1}
OK	1560-97-0	CCCCCCCCCCC(C)C	{1: 3, 2: 9, 3: 1}
OK	1560-98-1	CCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 25, 3: 1}
OK	15600-01-8	C(C(C(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 6, 3: 2, 4: 1}
OK	15601-98-6	CC/C=N/N=C/CC	{1: 2, 2: 2, 34: 2, 6: 2}
OK	15605-28-4	N(=O)OCl(=O)(=O)=O	{17: 1, 34: 1, 29: 4, 22: 1}
OK	156051-16-0	CC1C(CCCO1)Br	{1: 1, 18: 1, 11: 3, 12: 2, 23: 1}
OK	156053-88-2	C(C(F)(F)F)OC(C(F)(F)F)(F)F	{16: 8, 2: 1, 4: 3, 22: 1}
OK	1561-06-4	CCCCCCCCCCCCCCOCC(CO)O	{1: 1, 2: 15, 3: 1, 20: 2, 22: 1}
OK	1561-07-5	CCCCCCCCCCCCOCC(CO)O	{1: 1, 2: 13, 3: 1, 20: 2, 22: 1}
OK	1561-10-0	CCC(C)CCC(=O)OCC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	1561-11-1	CCC(C)CCC(=O)O	{27: 1, 1: 2, 2: 3, 3: 1}
OK	1561-20-2	C(=C(Cl)Cl)C(=O)O	{17: 2, 27: 1, 6: 1, 7: 1}
OK	1561-56-4	CCCCCCCCCCCCCCOCC(CO)OCCCCCCCCCCCC	{1: 2, 2: 26, 3: 1, 20: 1, 22: 2}
OK	1561-75-7	CCCCCCCCCCCCCCCCSSCCCCCCCCCCCCCCCC	{40: 2, 1: 2, 2: 30}
OK	1561-86-0	C1CCC(C(C1)O)Cl	{17: 1, 11: 4, 12: 2, 20: 1}
OK	156122-84-8	CC(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 12, 1: 1, 3: 2, 4: 5, 20: 1}
OK	156153-52-5	CCC(C)C1C(C=CC2(O1)CC3CC(O2)C/C=C(/C(C(/C=C/C=C/4\COC5C4(C(C=C(C5O)COC)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)NC(=O)C)OC)OC)\C)C	{1: 11, 2: 2, 3: 1, 11: 6, 12: 17, 13: 2, 14: 7, 15: 3, 20: 2, 22: 5, 23: 5, 24: 1, 28: 1, 31: 1}
OK	156153-56-9	CC[C@H](C)[C@@H]1[C@H](CC[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)COCOCCOC)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C	{1: 10, 2: 5, 3: 1, 11: 8, 12: 17, 13: 2, 14: 5, 15: 3, 20: 3, 22: 7, 23: 5, 28: 1}
OK	15618-76-5	C(CN(CCC(=O)Cl)[N+](=O)[O-])C(=O)Cl	{24: 2, 17: 2, 2: 4, 38: 1, 33: 1}
OK	15625-88-4	CC(=O)N1C=NC=N1	{24: 1, 1: 1, 35: 2, 14: 2, 33: 1}
OK	1563-83-3	CCN(C(=O)C)C(=O)C	{24: 2, 1: 3, 2: 1, 33: 1}
OK	1563-86-6	CCCCN(C(=O)C)C(=O)C	{24: 2, 1: 3, 2: 3, 33: 1}
OK	1563-90-2	CCCCN(CCCC)C(=O)C	{24: 1, 1: 3, 2: 6, 33: 1}
OK	1564-98-3	CC(CCC1C(O1)(C)C)CCO	{1: 3, 2: 4, 3: 1, 12: 1, 13: 1, 20: 1, 23: 1}
OK	15647-11-7	CC1(CC(CC(C1)(C)CN)O)C	{1: 3, 2: 1, 11: 3, 12: 1, 13: 2, 20: 1, 30: 1}
OK	1565-81-7	CCCCCCCC(CC)O	{1: 2, 2: 7, 3: 1, 20: 1}
OK	15655-33-1	CCCCCCCCCCCCCCCCCC1=NC(CO1)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC	{1: 3, 2: 50, 35: 1, 11: 1, 13: 1, 15: 1, 23: 1, 28: 2}
OK	15657-96-2	CC(C#N)OC(=O)C	{1: 2, 3: 1, 28: 1, 37: 1}
OK	156619-80-6	CCCC=CO	{1: 1, 2: 2, 20: 1, 6: 2}
OK	15666-97-4	CCCCCCCCOC(=O)CC#N	{1: 1, 2: 8, 28: 1, 37: 1}
OK	15667-10-4	CCC(C)(C)OOC1(CCCCC1)OOC(C)(C)CC	{1: 6, 2: 2, 4: 2, 11: 5, 13: 1, 22: 4}
OK	15667-21-7	C1[C@H]([C@H](C(=O)O1)O)O	{20: 2, 11: 1, 12: 2, 28: 1}
OK	1567-14-2	CCC=C(C)C(=O)OC	{1: 3, 2: 1, 28: 1, 6: 1, 7: 1}
OK	1567-75-5	CC(=O)C1(CC1)C	{24: 1, 1: 2, 11: 2, 13: 1}
OK	15672-88-5	CC(C)(C)CCI	{1: 3, 2: 2, 19: 1, 4: 1}
OK	15673-00-4	CC(C)(C)CCN	{1: 3, 2: 2, 4: 1, 30: 1}
OK	15673-04-8	CC(C)(C)CCN(C)C	{1: 5, 2: 2, 4: 1, 33: 1}
OK	15679-02-4	C[C@@H]1CC[C@H]1C	{1: 2, 11: 2, 12: 2}
OK	15689-07-3	C1CC2CC1CC2(CO)CO	{20: 2, 2: 2, 11: 4, 12: 2, 13: 1}
OK	15689-68-6	CCCCCCCCCCCCCCCCC(C)CCCCCCCCCC	{1: 3, 2: 24, 3: 1}
OK	15689-72-2	CCCCCCCCCCCCCCC(C)CCCCCCCCCCCC	{1: 3, 2: 24, 3: 1}
OK	1569-01-3	CCCOCC(C)O	{1: 2, 2: 3, 3: 1, 20: 1, 22: 1}
OK	1569-02-4	CCOCC(C)O	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	1569-03-5	CCCOC(=O)C(C)Cl	{1: 2, 2: 2, 3: 1, 28: 1, 17: 1}
OK	1569-44-4	CCC(C)(CC=C)O	{1: 2, 2: 2, 4: 1, 5: 1, 6: 1, 20: 1}
OK	1569-50-2	CC=CC(C)O	{1: 2, 3: 1, 20: 1, 6: 2}
OK	1569-59-1	CC(C=C)C(C)O	{1: 2, 3: 2, 20: 1, 5: 1, 6: 1}
OK	1569-60-4	CC(CCC=C(C)C)O	{1: 3, 2: 2, 3: 1, 6: 1, 7: 1, 20: 1}
OK	1569-69-3	C1CCC(CC1)S	{11: 5, 12: 1, 39: 1}
OK	157-06-2	C(C[C@H](C(=O)O)N)CN=C(N)N	{2: 3, 3: 1, 7: 1, 34: 1, 27: 1, 30: 3}
OK	157-16-4	C1C=N1	{35: 1, 11: 1, 14: 1}
OK	157-18-6	C1=CO1	{14: 2, 23: 1}
OK	157-22-2	C1N=N1	{35: 2, 11: 1}
OK	157-26-6	C1OO1	{11: 1, 23: 2}
OK	157-33-5	C1C2C1C2	{11: 2, 12: 2}
OK	157-40-4	C1CC12CC2	{11: 4, 13: 1}
OK	157-45-9	C1CC2(C1)CC2	{11: 5, 13: 1}
OK	15706-73-7	CCCCOC(=O)C(C)CC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	1571-60-4	C(=CO)O	{20: 2, 6: 2}
OK	15714-10-0	CC1CCC(=CC1)C(C)CO	{1: 2, 2: 1, 3: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	15719-09-2	C1C2C=CC3C(C3C1=O)C=C2	{25: 1, 11: 1, 12: 4, 14: 4}
OK	1572-52-7	C=C(CCC#N)C#N	{2: 2, 37: 2, 5: 1, 7: 1}
OK	1572-55-0	C(CCN)CC(CCCN)CN	{2: 8, 3: 1, 30: 3}
OK	1572-93-6	C[C@H](C(C)C)O	{1: 3, 3: 2, 20: 1}
OK	1572-99-2	CCOC(=O)C(C)C#N	{1: 2, 2: 1, 3: 1, 28: 1, 37: 1}
OK	15720-25-9	CC1C(NC(=O)N1)CCCCCC(=O)O	{32: 2, 1: 1, 2: 5, 12: 2, 25: 1, 27: 1}
OK	15720-98-6	C(=O)(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 22, 24: 1, 4: 10}
OK	15721-22-9	CCCC(C)(C)C(=O)Cl	{24: 1, 1: 3, 2: 2, 4: 1, 17: 1}
OK	15721-83-2	CCCCCCCCC(=O)OCC(C)(C)C(C(C)C)OC(=O)CCCCCCCC	{1: 6, 2: 15, 3: 2, 4: 1, 28: 2}
OK	15726-15-5	CCCC(=O)C(C)CC	{24: 1, 1: 3, 2: 3, 3: 1}
OK	15727-77-2	CC(C)C(=O)OCC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 28: 1}
OK	1573-17-7	CC(=O)OCC#CCOC(=O)C	{1: 2, 2: 2, 28: 2, 10: 2}
OK	1573-28-0	CCC(C)(CCC(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	1573-58-6	C=C(C(=CCl)Cl)Cl	{17: 3, 5: 1, 6: 1, 7: 2}
OK	15733-49-0	CC1CCCCC1=C(C)C	{15: 1, 1: 3, 11: 4, 12: 1, 7: 1}
OK	1574-32-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 92}
OK	1574-33-0	CC=C(C)C#C	{1: 2, 10: 1, 9: 1, 6: 1, 7: 1}
OK	1574-34-1	CCC(=C)C#C	{1: 1, 2: 1, 5: 1, 7: 1, 9: 1, 10: 1}
OK	1574-40-9	CC=CC#C	{1: 1, 10: 1, 6: 2, 9: 1}
OK	1574-41-0	CC=CC=C	{1: 1, 5: 1, 6: 3}
OK	1575-61-7	C(CCCl)CC(=O)Cl	{24: 1, 17: 2, 2: 4}
OK	1575-72-0	CCCC(CC=C)C(=O)O	{1: 1, 2: 3, 3: 1, 5: 1, 6: 1, 27: 1}
OK	1575-74-2	CC(CC=C)C(=O)O	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 27: 1}
OK	15753-47-6	C1CCC(CC1)(CO)O	{2: 1, 11: 5, 20: 2, 13: 1}
OK	1576-84-7	CC(=O)OCCC=C	{1: 1, 2: 2, 28: 1, 5: 1, 6: 1}
OK	1576-85-8	CC(=O)OCCCC=C	{1: 1, 2: 3, 28: 1, 5: 1, 6: 1}
OK	1576-87-0	CC/C=C/C=O	{1: 1, 2: 1, 26: 1, 6: 2}
OK	1576-95-0	CC/C=C\CO	{1: 1, 2: 2, 20: 1, 6: 2}
OK	1576-96-1	CC/C=C/CO	{1: 1, 2: 2, 20: 1, 6: 2}
OK	15760-35-7	C=C1CC(C1)C#N	{37: 1, 11: 2, 12: 1, 5: 1, 15: 1}
OK	15760-36-8	C=C1CC(C1)C(=O)O	{27: 1, 11: 2, 12: 1, 5: 1, 15: 1}
OK	15761-38-3	C[C@@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 4, 3: 1, 4: 1, 27: 1, 28: 1, 31: 1}
OK	15761-39-4	CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)O	{1: 3, 4: 1, 33: 1, 11: 3, 12: 1, 27: 1, 28: 1}
OK	15764-04-2	C[C@@H]1CC(=O)C=C2[C@]1(CC(=C(C)C)CC2)C	{1: 4, 7: 1, 11: 4, 12: 1, 13: 1, 14: 1, 15: 2, 25: 1}
OK	15766-93-5	COC1CCC=CC1	{1: 1, 11: 3, 12: 1, 22: 1, 14: 2}
OK	1577-18-0	CCC=CCC(=O)O	{1: 1, 2: 2, 27: 1, 6: 2}
OK	1577-22-6	C=CCCCC(=O)O	{2: 3, 27: 1, 5: 1, 6: 1}
OK	1577-52-2	CCCCCC=CCC=CCCCCCCCCO	{1: 1, 2: 13, 20: 1, 6: 4}
OK	1578-21-8	C(=C(Br)Br)C(=O)O	{18: 2, 27: 1, 6: 1, 7: 1}
OK	1578-72-9	C(=C(C(=O)O)Br)Br	{18: 2, 27: 1, 6: 1, 7: 1}
OK	15786-26-2	C1CC=CCCC(C(CCC=C1)O)O	{20: 2, 11: 6, 12: 2, 14: 4}
OK	1579-21-1	C1CC[C@H]2CC(=O)CC[C@H]2C1	{25: 1, 11: 7, 12: 2}
OK	15790-88-2	CCC=CC(=O)OC	{1: 2, 2: 1, 28: 1, 6: 2}
OK	15791-03-4	COC1(C=CC(C=C1)(OC)OC)OC	{1: 4, 22: 4, 13: 2, 14: 4}
OK	15797-21-4	CC1(C(CCC1(C)C(=O)OC)C(=O)OC)C	{1: 5, 11: 2, 12: 1, 13: 2, 28: 2}
OK	15798-64-8	CC=CC=O	{1: 1, 26: 1, 6: 2}
OK	15805-73-9	C=COC(=O)N	{30: 1, 28: 1, 5: 1, 6: 1}
OK	15805-75-1	CCCCCCOC(=O)CCC(=O)OCCCCCC	{1: 2, 2: 12, 28: 2}
OK	15811-52-6	C(=O)(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 26, 24: 1, 4: 12}
OK	15825-93-1	C1C2=C(C=CC=C1C(=CC=C2)Br)Br	{18: 2, 11: 1, 14: 6, 15: 4}
OK	15833-61-1	C1COCC1CO	{20: 1, 2: 1, 11: 3, 12: 1, 23: 1}
OK	15834-04-5	CCCCC(=O)OCC(COC(=O)CCCC)(COC(=O)CCCC)COC(=O)CCCC	{1: 4, 2: 16, 4: 1, 28: 4}
OK	158358-96-4	CCCCC([C@@H](CO)O)(F)F	{1: 1, 2: 4, 3: 1, 4: 1, 16: 2, 20: 2}
OK	1584-03-8	C(=C(C(C(F)(F)F)(F)F)F)(C(F)(F)F)C(F)(F)F	{16: 12, 4: 4, 7: 2}
OK	15840-60-5	CCC=CC(C)C	{1: 3, 2: 1, 3: 1, 6: 2}
OK	15840-81-0	C1C/C=C/CCC/C=C/C1	{11: 6, 14: 4}
OK	15841-11-9	CC1(CCCCCCC(CC1)(C)C)C	{1: 4, 11: 8, 13: 2}
OK	15844-05-0	C1C2C3C4C1C5C2C3C45C(=O)O	{27: 1, 11: 1, 12: 7, 13: 1}
OK	15844-87-8	CCN(CC)C(=O)C(C(=O)C)Cl	{1: 3, 2: 2, 3: 1, 33: 1, 17: 1, 24: 2}
OK	158440-71-2	CC1=C(C2=C(C3(CC3)[C@@](C(=O)C2=C1)(C)O)C)CO	{1: 3, 2: 1, 11: 2, 13: 2, 14: 1, 15: 5, 20: 2, 25: 1}
OK	15846-25-0	CC(=CC(=O)N)N	{24: 1, 1: 1, 30: 2, 6: 1, 7: 1}
OK	15848-22-3	CC(=O)OCCCCCBr	{1: 1, 2: 5, 28: 1, 18: 1}
OK	1585-74-6	CN(C)Cl	{1: 2, 33: 1, 17: 1}
OK	15856-96-9	CCC=CC(=O)N	{24: 1, 1: 1, 2: 1, 30: 1, 6: 2}
OK	158562-62-0	CCCCCCCCCCC=C.CCCCCCCCC=C.CCCCCCC=C	{1: 3, 2: 21, 5: 3, 6: 3}
OK	15860-21-6	CCCCCCCCCCCCCCCCCC(=O)O.C1CCC(CC1)N	{1: 1, 2: 16, 11: 5, 12: 1, 27: 1, 30: 1}
OK	15861-05-9	NF	{16: 1, 30: 1}
OK	15862-72-3	CCOC(=O)C1CCCCN1	{32: 1, 1: 1, 2: 1, 11: 4, 12: 1, 28: 1}
OK	15869-80-4	CCCCC(CC)CC	{1: 3, 2: 5, 3: 1}
OK	15869-85-9	CCCCC(C)CCCC	{1: 3, 2: 6, 3: 1}
OK	15869-86-0	CCCCC(CC)CCC	{1: 3, 2: 6, 3: 1}
OK	15869-87-1	CCCCCCC(C)(C)C	{1: 4, 2: 5, 4: 1}
OK	15869-89-3	CCCC(C)CCC(C)C	{1: 4, 2: 4, 3: 2}
OK	15869-92-8	CCCCC(C)C(C)CC	{1: 4, 2: 4, 3: 2}
OK	15869-93-9	CCCC(C)CC(C)CC	{1: 4, 2: 4, 3: 2}
OK	15869-94-0	CCC(C)CCC(C)CC	{1: 4, 2: 4, 3: 2}
OK	15869-95-1	CCCCC(C)(C)CCC	{1: 4, 2: 5, 4: 1}
OK	15869-96-2	CCCC(C)C(C)CCC	{1: 4, 2: 4, 3: 2}
OK	1587-20-8	COC(=O)CC(CC(=O)OC)(C(=O)OC)O	{1: 3, 2: 2, 4: 1, 20: 1, 28: 3}
OK	1587-21-9	CCCOC(=O)CC(CC(=O)OCCC)(C(=O)OCCC)O	{1: 3, 2: 8, 4: 1, 20: 1, 28: 3}
OK	1587-26-4	CC(=C(C)Cl)Cl	{1: 2, 17: 2, 7: 2}
OK	1587-41-3	C([N+](=O)[O-])([N+](=O)[O-])(Cl)Cl	{17: 2, 4: 1, 38: 2}
OK	15870-07-2	CCCCC(C)CCC(=O)OC	{1: 3, 2: 5, 3: 1, 28: 1}
OK	15870-10-7	CCCCCC(=C)C	{1: 2, 2: 4, 5: 1, 7: 1}
OK	158706-64-0	CCCCOC(=O)C(=C)C.CC(=C)C(=O)O.COC(=O)CCS	{1: 4, 2: 5, 5: 2, 7: 2, 39: 1, 27: 1, 28: 2}
OK	15871-57-5	CC1(CC(CC(N1[O])(C)C)(C(=O)O)N)C	{1: 4, 33: 1, 11: 2, 13: 3, 27: 1, 29: 1, 30: 1}
OK	15872-28-3	C1C2C=CC1C(=C2C(=O)O)C(=O)O	{27: 2, 11: 1, 12: 2, 14: 2, 15: 2}
OK	15872-89-6	CCCCCCCOC(=O)CCC(=O)OCCCCCCC	{1: 2, 2: 14, 28: 2}
OK	15873-56-0	C(C(O)O)Cl	{17: 1, 2: 1, 3: 1, 20: 2}
OK	15874-03-0	CCCCCC(CCCCC)CCCCC(CCCCC)CCCCC	{1: 4, 2: 20, 3: 2}
OK	15874-05-2	CCCCCC(CC)CCC(CCCCC)CCC(CC)CCCCC	{1: 5, 2: 18, 3: 3}
OK	15874-06-3	CCCCCC(CCC)CCC(CCC)CCC(CCC)CCCCC	{1: 5, 2: 18, 3: 3}
OK	15874-34-7	C(C(=O)O)NCO	{2: 2, 27: 1, 20: 1, 31: 1}
OK	15875-13-5	CN(C)CCCN1CN(CN(C1)CCCN(C)C)CCCN(C)C	{1: 6, 2: 9, 11: 3, 33: 6}
OK	15875-44-2	CN.OCl(=O)(=O)=O	{1: 1, 20: 1, 29: 3, 30: 1, 17: 1}
OK	15875-99-7	CC(C)(C)C1CCC(CC1)OC	{1: 4, 11: 4, 4: 1, 22: 1, 12: 2}
OK	15877-57-3	CCC(C)CC=O	{1: 2, 2: 2, 3: 1, 26: 1}
OK	15879-39-7	CC(C)C(=O)NC1CCCCO1	{1: 2, 3: 1, 11: 4, 12: 1, 23: 1, 24: 1, 31: 1}
OK	15879-40-0	CCCC(=O)NC1CCCCO1	{1: 1, 2: 2, 11: 4, 12: 1, 23: 1, 24: 1, 31: 1}
OK	15879-93-3	C(C([C@@H]1[C@@H]([C@@H]2C(O1)O[C@@H](O2)C(Cl)(Cl)Cl)O)O)O	{2: 1, 3: 1, 4: 1, 12: 5, 17: 3, 20: 3, 23: 3}
OK	1589-47-5	CC(CO)OC	{1: 2, 2: 1, 3: 1, 20: 1, 22: 1}
OK	1589-49-7	COCCCO	{1: 1, 2: 3, 20: 1, 22: 1}
OK	15890-40-1	C[C@@H]1CC[C@H](C1C)C	{1: 3, 11: 2, 12: 3}
OK	158948-13-1	CCCCCCCCCC(=O)NCCOCCO	{1: 1, 2: 12, 20: 1, 22: 1, 24: 1, 31: 1}
OK	15897-81-1	C1C2CC3CC1CC(C2)C3C(=O)O	{27: 1, 11: 5, 12: 5}
OK	15899-29-3	C(=O)(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)O	{16: 13, 27: 1, 4: 6}
OK	15899-31-7	C(=O)(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 17, 27: 1, 4: 8}
OK	15899-72-6	CC1CC(=O)C(=C1)O	{1: 1, 11: 1, 12: 1, 14: 1, 15: 1, 20: 1, 25: 1}
OK	15901-42-5	CC1CC(CC(C1)(C)C)N	{1: 3, 11: 3, 12: 2, 13: 1, 30: 1}
OK	15904-30-0	CC(C)C(=O)C(C)(C)CO	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1, 24: 1}
OK	15909-68-9	COC(=O)[C@H]([C@@H]([C@@H](CO)O)O)O	{1: 1, 2: 1, 3: 3, 20: 4, 28: 1}
OK	15909-76-9	COC(=O)C(CO)O	{1: 1, 2: 1, 3: 1, 20: 2, 28: 1}
OK	15910-23-3	C[C@H](CCCC(C)C)C1CC[C@@H]2C1(CC[C@H]3C2CCC4C3(CC=CC4)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 2}
OK	15910-74-4	CN(C)[C@@H]1CCCC[C@H]1O	{1: 2, 11: 4, 12: 2, 20: 1, 33: 1}
OK	15914-95-1	C1CC2CC1C3C2C4CCC3C4	{11: 6, 12: 6}
OK	159171-61-6	C(C(=O)C(C(C(=O)C(=O)O)O)O)O	{24: 2, 27: 1, 2: 1, 3: 2, 20: 3}
OK	15918-08-8	CCCC(=C)CCC	{1: 2, 2: 4, 5: 1, 7: 1}
OK	15925-47-0	CC(=O)CC(=O)SC(C)(C)C	{24: 2, 1: 4, 2: 1, 4: 1, 40: 1}
OK	15930-66-2	CCCCCCCCOCCCN	{1: 1, 2: 10, 30: 1, 22: 1}
OK	15930-71-9	CCCCCCCCOCCCN.CC(=O)O	{1: 2, 2: 10, 27: 1, 30: 1, 22: 1}
OK	15931-59-6	CCN(CC)CO	{1: 2, 2: 3, 20: 1, 33: 1}
OK	15932-89-5	C(O)OO	{2: 1, 20: 2, 22: 1}
OK	15933-07-0	CCC(=O)C(=O)OCC	{24: 1, 1: 2, 2: 2, 28: 1}
OK	15940-88-2	C1CC1C(=O)C(=O)C2CC2	{24: 2, 11: 4, 12: 2}
OK	15940-89-3	CC(=O)C(=O)C1CC1	{24: 2, 1: 1, 11: 2, 12: 1}
OK	15941-09-0	C1CC2(CCC1(CC2)C#N)C(=O)O	{27: 1, 11: 6, 13: 2, 37: 1}
OK	15949-84-5	C(CCCCCBr)CCCCC(=O)Cl	{24: 1, 17: 1, 2: 10, 18: 1}
OK	1595-15-9	C1=CC(=O)/C(=C/NO)/C=C1[N+](=O)[O-]	{38: 1, 6: 1, 14: 3, 15: 2, 20: 1, 25: 1, 31: 1}
OK	15957-72-9	CC(COC(=O)C=CC(=O)OCCN1CCNC1=O)O	{32: 1, 1: 1, 2: 3, 3: 1, 6: 2, 33: 1, 11: 2, 20: 1, 25: 1, 28: 2}
OK	15957-73-0	CCC(COC(=O)C=CC(=O)OCCN1CCNC1=O)O	{32: 1, 1: 1, 2: 4, 3: 1, 6: 2, 33: 1, 11: 2, 20: 1, 25: 1, 28: 2}
OK	1596-84-5	CN(C)NC(=O)CCC(=O)O	{1: 2, 2: 2, 33: 1, 24: 1, 27: 1, 31: 1}
OK	15962-47-7	CC(C(=O)N)NC(=O)C	{24: 2, 1: 2, 3: 1, 30: 1, 31: 1}
OK	15964-17-7	CCCC1COC1=O	{1: 1, 2: 2, 11: 1, 12: 1, 28: 1}
OK	1597-82-6	CC1CC2C3CC(C4=CC(=O)C=CC4(C3C(CC2(C1(C(=O)COC(=O)C)O)C)O)C)F	{1: 4, 2: 1, 11: 3, 12: 6, 13: 3, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	15973-03-2	CC1=CCOCO1	{23: 2, 1: 1, 11: 2, 14: 1, 15: 1}
OK	15973-99-6	C1CN(CN(C1)N=O)N=O	{33: 2, 34: 2, 11: 4, 29: 2}
OK	15980-15-1	C1CSCCO1	{41: 1, 11: 4, 23: 1}
OK	15986-92-2	CC1=NCCN=C1C	{1: 2, 11: 2, 35: 2, 15: 2}
OK	1599-41-3	C(C(F)(F)F)(C(F)(F)Cl)(Cl)Cl	{16: 5, 17: 3, 4: 3}
OK	1599-47-9	CCCCCC(OC)OC	{1: 3, 2: 4, 3: 1, 22: 2}
OK	1599-49-1	CCCCCC1OCC(O1)C	{1: 2, 2: 4, 11: 1, 12: 2, 23: 2}
OK	1599-67-3	CCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 19, 5: 1, 6: 1}
OK	1600-37-9	C(C(=C(Cl)Cl)Cl)(Cl)Cl	{17: 5, 3: 1, 7: 2}
OK	16005-15-5	CCCCCCCCCCCCOC(=O)C=CC	{1: 2, 2: 11, 28: 1, 6: 2}
OK	16005-83-7	CC(C)COCCOC(=O)N(CO)CO	{1: 2, 2: 5, 3: 1, 33: 1, 20: 2, 22: 1, 28: 1}
OK	16006-09-0	CC(C)COCCOC(=O)N	{1: 2, 2: 3, 3: 1, 22: 1, 28: 1, 30: 1}
OK	1601-00-9	CC1CCCC1C(=O)C	{24: 1, 1: 2, 11: 3, 12: 2}
OK	16011-97-5	CNCCCCNC	{1: 2, 2: 4, 31: 2}
OK	16015-11-5	CC1=CCCCO1	{23: 1, 1: 1, 11: 3, 14: 1, 15: 1}
OK	16016-41-4	CC(C)CCOC(=O)[C@@H]([C@H](C(=O)OCCC(C)C)O)O	{1: 4, 2: 4, 3: 4, 20: 2, 28: 2}
OK	160172-95-2	CC(C)N1CCCN2C1=NCCC2	{1: 2, 3: 1, 33: 2, 11: 6, 15: 1, 35: 1}
OK	16021-08-2	C1CC[C@@H]2CC(=O)CC[C@H]2C1	{25: 1, 11: 7, 12: 2}
OK	1603-01-6	CC/C=C/C(C)C=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 3}
OK	1604-01-9	CCCC1=NCCCC1	{1: 1, 2: 2, 11: 4, 35: 1, 15: 1}
OK	1604-02-0	CCCC1(CCCC1)O	{1: 1, 2: 2, 11: 4, 20: 1, 13: 1}
OK	1604-11-1	CC(CC(=O)OC)C(=O)OC	{1: 3, 2: 1, 3: 1, 28: 2}
OK	1604-28-0	CC(=CC=CC(=O)C)C	{24: 1, 1: 3, 6: 3, 7: 1}
OK	1604-32-6	CC(C)CCCC(C)CCC/C(=C/C=C/C(=O)C)/C	{1: 5, 2: 6, 3: 2, 6: 3, 7: 1, 24: 1}
OK	1604-34-8	CC(C)CCCC(C)CCCC(=O)C	{24: 1, 1: 4, 2: 6, 3: 2}
OK	1604-35-9	CC(C)CCCC(C)CCCC(C)(C#C)O	{1: 4, 2: 6, 3: 2, 4: 1, 9: 1, 10: 1, 20: 1}
OK	16042-21-0	CC(C)(C=O)SC	{40: 1, 1: 3, 26: 1, 4: 1}
OK	1605-73-8	C[C](C)C	{1: 3, 7: 1}
OK	1605-89-6	C[C@@H]1CC2=CC(=O)CC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@]([C@]4(CC3)C)(C)O)C	{1: 4, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 1, 25: 1}
OK	16050-65-0	CCN1C(=O)NNC1=O	{32: 2, 1: 1, 2: 1, 33: 1, 25: 2}
OK	16052-40-7	C[C@@H]1CC[C@H]([C@@H](C1)C(=O)O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 27: 1}
OK	16054-41-4	C(C(=O)NNC(=O)C(Cl)Cl)(Cl)Cl	{24: 2, 17: 4, 3: 2, 31: 2}
OK	16058-17-6	CCCCCCCCCCCCC1=NCCN1CCO	{1: 1, 2: 13, 35: 1, 33: 1, 11: 2, 15: 1, 20: 1}
OK	16058-51-8	CCCCCCCCCCCCCCC(C)N(C)C	{1: 4, 2: 13, 3: 1, 33: 1}
OK	1606-08-2	C1CCC(CC1)C2CCCC2	{11: 9, 12: 2}
OK	1606-47-9	CC(C)C(=O)C=C	{24: 1, 1: 2, 3: 1, 5: 1, 6: 1}
OK	1606-49-1	C1CNC=NC1	{32: 1, 35: 1, 11: 3, 14: 1}
OK	1606-83-3	C(C#CCOCC(CCl)O)OCC(CCl)O	{2: 6, 3: 2, 10: 2, 17: 2, 20: 2, 22: 2}
OK	1606-85-5	C(COCC#CCOCCO)O	{2: 6, 20: 2, 10: 2, 22: 2}
OK	16063-24-4	CC(C)(CN(F)F)N(F)F	{16: 4, 1: 2, 2: 1, 4: 1, 33: 2}
OK	16063-79-9	CC(C(C(=O)O)N)C(F)(F)F	{1: 1, 3: 2, 4: 1, 16: 3, 27: 1, 30: 1}
OK	16066-84-5	CC(C)(C)OC(=O)NC	{1: 4, 4: 1, 28: 1, 31: 1}
OK	16069-36-6	C1CCC2C(C1)OCCOCCOC3CCCCC3OCCOCCO2	{11: 16, 12: 4, 23: 6}
OK	16079-88-2	CC1(C(=O)N(C(=O)N1Br)Cl)C	{1: 2, 33: 2, 13: 1, 17: 1, 18: 1, 25: 2}
OK	1608-14-6	CN(C)C(=O)C(=O)N(C)C	{24: 2, 1: 4, 33: 2}
OK	1608-82-8	COC/C(=C/OC)/C#N	{1: 2, 2: 1, 37: 1, 6: 1, 7: 1, 22: 2}
OK	16083-76-4	C=CC(=O)OCC(CC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)O	{2: 2, 3: 1, 4: 5, 5: 1, 6: 1, 16: 11, 20: 1, 28: 1}
OK	16083-79-7	CC(=C)C(=O)OCC(CC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)O	{1: 1, 2: 2, 3: 1, 4: 5, 5: 1, 7: 1, 16: 11, 20: 1, 28: 1}
OK	16083-81-1	CC(=C)C(=O)OCC(CC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)O	{1: 1, 2: 2, 3: 1, 4: 7, 5: 1, 7: 1, 16: 15, 20: 1, 28: 1}
OK	16088-62-3	C[C@H]1CO1	{1: 1, 11: 1, 12: 1, 23: 1}
OK	16089-67-1	CN(C=C1C=CC(=O)C=C1)O	{1: 1, 6: 1, 33: 1, 14: 4, 15: 1, 20: 1, 25: 1}
OK	1609-21-8	CCCCCCCCCC[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 9, 33: 1, 14: 5, 17: 1}
OK	1609-39-8	C1=CC2C=CC1C2Cl	{17: 1, 12: 3, 14: 4}
OK	1609-40-1	CCOC(=O)CCSSCCC(=O)OCC	{40: 2, 1: 2, 2: 6, 28: 2}
OK	1609-42-3	CCSC#CC#C	{40: 1, 1: 1, 2: 1, 10: 3, 9: 1}
OK	1609-86-5	CC(C)(C)N=C=O	{8: 1, 1: 3, 34: 1, 4: 1, 29: 1}
OK	1609-93-4	C(=CCl)C(=O)O	{17: 1, 27: 1, 6: 2}
OK	16090-77-0	CCCCOC(=O)CCCCCCC(=O)OCCCC	{1: 2, 2: 12, 28: 2}
OK	16096-97-2	C([C@@H]([C@H](CS)O)O)S	{2: 2, 3: 2, 20: 2, 39: 2}
OK	1610-23-7	C1CCC(CC1)CCCCCCC2CCCCC2	{2: 6, 11: 10, 12: 2}
OK	1610-24-8	C1CCC(CC1)C(C2CCCCC2)C3CCCCC3	{11: 15, 3: 1, 12: 3}
OK	1610-29-3	CCC=C(C)CO	{1: 2, 2: 2, 20: 1, 6: 1, 7: 1}
OK	16104-45-3	C1C2C3C2C4C1C3N=N4	{35: 2, 11: 1, 12: 6}
OK	16104-50-0	C1C2CC3(CC1CC(C2)(C3)Cl)Cl	{17: 2, 11: 6, 12: 2, 13: 2}
OK	16106-01-7	CCCCCC=CCC=CCC(=O)OC	{1: 2, 2: 6, 28: 1, 6: 4}
OK	16106-59-5	CC(C)C(C)CC=C	{1: 3, 2: 1, 3: 2, 5: 1, 6: 1}
OK	1611-12-7	CCCC=NCC	{1: 2, 2: 3, 34: 1, 6: 1}
OK	1611-50-3	CCOC(=O)NC(C)(C)C	{1: 4, 2: 1, 4: 1, 28: 1, 31: 1}
OK	1611-56-9	C(CCCCCO)CCCCCBr	{2: 11, 20: 1, 18: 1}
OK	1611-57-0	CC(C)(C)CC(C)(C)N=C=O	{1: 5, 2: 1, 4: 2, 8: 1, 34: 1, 29: 1}
OK	1611-65-0	CC(C)CCN=C=O	{1: 2, 2: 2, 3: 1, 8: 1, 34: 1, 29: 1}
OK	16111-27-6	CN(C)CCSC(=N)N.Cl.Cl	{1: 2, 2: 2, 36: 1, 33: 1, 40: 1, 7: 1, 17: 2, 30: 1}
OK	16112-10-0	CC(=O)C1=CCCC1	{24: 1, 1: 1, 11: 3, 14: 1, 15: 1}
OK	16112-59-7	CC1COC(=O)N1	{32: 1, 1: 1, 11: 1, 12: 1, 28: 1}
OK	1612-98-2	CC(C)C1CCC(CC1O)(C)O	{1: 3, 3: 1, 11: 3, 12: 2, 13: 1, 20: 2}
OK	16120-70-0	CCCCN(C=O)N	{1: 1, 2: 3, 26: 1, 30: 1, 33: 1}
OK	16128-68-0	CCC(CS)S	{1: 1, 2: 2, 3: 1, 39: 2}
OK	1613-45-2	CCSCC(C)C	{40: 1, 1: 3, 2: 2, 3: 1}
OK	1613-46-3	CCCCSCCC	{40: 1, 1: 2, 2: 5}
OK	1613-49-6	CCCCC1CCCS1	{1: 1, 2: 3, 11: 3, 12: 1, 41: 1}
OK	1613-51-0	C1CCSCC1	{41: 1, 11: 5}
OK	16130-58-8	C(C#N)C(=O)Cl	{24: 1, 17: 1, 2: 1, 37: 1}
OK	16131-53-6	C1COCCN1SSSSN2CCOCC2	{40: 4, 33: 2, 11: 8, 23: 2}
OK	1614-82-0	COC1=CCC2=C(C1)CC(=CC2)OC	{1: 2, 11: 4, 22: 2, 14: 2, 15: 4}
OK	1614-92-2	C1CCN(CC1)C2=CCCC2	{33: 1, 11: 8, 14: 1, 15: 1}
OK	1615-14-1	C1=CN(C=N1)CCO	{33: 1, 2: 2, 35: 1, 20: 1, 14: 3}
OK	1615-70-9	C=CC=CC#N	{5: 1, 6: 3, 37: 1}
OK	1615-80-1	CCNNCC	{1: 2, 2: 2, 31: 2}
OK	1615-83-4	CCCNNCCC	{1: 2, 2: 4, 31: 2}
OK	161596-62-9	C1[C@H](N[C@@H]1C(=O)O)C(=O)O	{27: 2, 32: 1, 11: 1, 12: 2}
OK	161596-63-0	C1[C@@H](N[C@H]1C(=O)O)C(=O)O	{27: 2, 32: 1, 11: 1, 12: 2}
OK	1616-88-2	COCCOC(=O)N	{1: 1, 2: 2, 28: 1, 30: 1, 22: 1}
OK	161611-74-1	C1(=C(OC(O1)(F)F)F)OC(F)(F)F	{4: 1, 13: 1, 15: 2, 16: 6, 22: 1, 23: 2}
OK	16165-33-6	CCCCCCCCCCCNCCCCCCCCCCC	{1: 2, 2: 20, 31: 1}
OK	161660-94-2	CC(C)(C)OC(=O)N[C@H]1CC[C@H](C1)C(=O)O	{1: 3, 4: 1, 11: 3, 12: 2, 27: 1, 28: 1, 31: 1}
OK	16169-22-5	C#CCOCC(COCC#C)O	{2: 4, 3: 1, 9: 2, 10: 2, 20: 1, 22: 2}
OK	1617-17-0	CC(C#N)Cl	{1: 1, 3: 1, 37: 1, 17: 1}
OK	1617-18-1	CCOC(=O)CC=C	{1: 1, 2: 2, 28: 1, 5: 1, 6: 1}
OK	1617-32-9	CC=CCC(=O)O	{1: 1, 2: 1, 27: 1, 6: 2}
OK	1617-62-5	CCCCCN(C)N/C=C/1\C=C(C=CC1=O)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 6: 1, 33: 1, 14: 3, 15: 2, 25: 1, 31: 1}
OK	1617-63-6	CC(C)CN(C)N/C=C/1\C=C(C=CC1=O)[N+](=O)[O-]	{1: 3, 2: 1, 3: 1, 38: 1, 6: 1, 33: 1, 14: 3, 15: 2, 25: 1, 31: 1}
OK	1617-68-1	CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC(=O)C)C)C	{1: 8, 5: 1, 7: 1, 11: 10, 12: 6, 13: 5, 28: 1}
OK	16179-44-5	C1CCC(CC1)C(=O)OCCO	{20: 1, 2: 2, 11: 5, 12: 1, 28: 1}
OK	1618-22-0	CC1CCC2CC(CCC2C1)C	{1: 2, 11: 6, 12: 4}
OK	1618-23-1	CCC1CCC2CCCCC2C1	{1: 1, 2: 1, 11: 7, 12: 3}
OK	1618-26-4	CSCSC	{40: 2, 1: 2, 2: 1}
OK	16180-96-4	CC(=O)NCCOC(=O)C	{24: 1, 1: 2, 2: 2, 28: 1, 31: 1}
OK	16189-46-1	C1CCC2CCCC2CC1	{11: 8, 12: 2}
OK	1619-34-7	C1CN2CCC1C(C2)O	{20: 1, 11: 5, 12: 2, 33: 1}
OK	1619-56-3	CCC(CC)(C#N)C(=O)OCC	{1: 3, 2: 3, 4: 1, 37: 1, 28: 1}
OK	1619-57-4	CCC(CC)(C(=O)C)C(=O)OCC	{24: 1, 1: 4, 2: 3, 4: 1, 28: 1}
OK	1619-62-1	CCOC(=O)C(C)(C)C(=O)OCC	{1: 4, 2: 2, 4: 1, 28: 2}
OK	1619-84-7	C(=NN=C(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F	{16: 12, 34: 2, 4: 4, 7: 2}
OK	16195-58-7	CC1=C(CC(CC1)(C)C(=C)C)C	{1: 4, 5: 1, 7: 1, 11: 3, 13: 1, 15: 2}
OK	16197-90-3	C(/C=C/C(=O)O)Cl	{17: 1, 2: 1, 27: 1, 6: 2}
OK	1620-14-0	CCN(CC)CC(=O)C	{24: 1, 1: 3, 2: 3, 33: 1}
OK	16200-53-6	C1C2CC3CC1CC3(C2)C(=O)O	{27: 1, 11: 5, 12: 3, 13: 1}
OK	1621-24-5	CC(C1CC1)N	{11: 2, 1: 1, 3: 1, 12: 1, 30: 1}
OK	16212-28-5	C(#N)C(=C(Cl)Cl)Cl	{17: 3, 37: 1, 7: 2}
OK	16215-21-7	CCCCOC(=O)CCS	{1: 1, 2: 5, 28: 1, 39: 1}
OK	16216-91-4	C1C=CC2C=CC1C=C2	{11: 1, 12: 2, 14: 6}
OK	16217-48-4	COC(=O)CC(C(=O)OC)N1CCCCC1	{1: 2, 2: 1, 3: 1, 33: 1, 11: 5, 28: 2}
OK	16219-75-3	CC=C1CC2CC1C=C2	{1: 1, 6: 1, 11: 2, 12: 2, 14: 2, 15: 1}
OK	1622-10-2	CCC(CCCCBr)Br	{1: 1, 2: 5, 3: 1, 18: 2}
OK	16224-24-1	CCCCCCOCC(CCl)O	{1: 1, 2: 7, 3: 1, 17: 1, 20: 1, 22: 1}
OK	16224-33-2	CCCCOCC(CCl)O	{1: 1, 2: 5, 3: 1, 17: 1, 20: 1, 22: 1}
OK	16227-10-4	CCCCN1C=NN=C1	{1: 1, 2: 3, 35: 2, 14: 2, 33: 1}
OK	1623-05-8	C(=C(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F	{16: 10, 4: 3, 22: 1, 7: 2}
OK	16230-28-7	CCC(C(CC)Br)Br	{1: 2, 2: 2, 3: 2, 18: 2}
OK	16246-07-4	CCCCOC(=O)NCC	{1: 2, 2: 4, 28: 1, 31: 1}
OK	1625-49-6	C/C=C(\C)/C(=C)C	{1: 3, 5: 1, 6: 1, 7: 2}
OK	16253-72-8	CCCCC(C)CC(=O)OC(C)CC	{1: 4, 2: 5, 3: 2, 28: 1}
OK	1626-09-1	CC(=O)CCCCC(=O)C	{24: 2, 1: 2, 2: 4}
OK	16260-26-7	CCCCCCCCCCCCCC(=O)OCCCCCCCC	{1: 2, 2: 19, 28: 1}
OK	16260-48-3	C(CSCCO)CSCCO	{40: 2, 2: 7, 20: 2}
OK	16269-13-9	C1C2CC3CC1CC(C2)(C3)CC#N	{2: 1, 11: 6, 12: 3, 13: 1, 37: 1}
OK	16275-44-8	CC(=O)NC1C=CC(=O)O1	{1: 1, 12: 1, 14: 2, 24: 1, 28: 1, 31: 1}
OK	16282-67-0	C(OF)(OF)(F)F	{16: 4, 4: 1, 22: 2}
OK	1629-58-9	CCC(=O)C=C	{24: 1, 1: 1, 2: 1, 5: 1, 6: 1}
OK	1629-60-3	CCCC(=O)C=C	{24: 1, 1: 1, 2: 2, 5: 1, 6: 1}
OK	1630-94-0	CC1(CC1)C	{1: 2, 11: 2, 13: 1}
OK	16301-26-1	CCN=[N+](CC)[O-]	{1: 2, 2: 2, 34: 1, 29: 1, 33: 1}
OK	16302-35-5	CC1=CCOCC1	{23: 1, 1: 1, 11: 3, 14: 1, 15: 1}
OK	1631-25-0	C1CCC(CC1)N2C(=O)C=CC2=O	{25: 2, 11: 5, 12: 1, 14: 2, 33: 1}
OK	16310-13-7	C1CSC(N1)C(=O)O	{27: 1, 32: 1, 11: 2, 12: 1, 41: 1}
OK	163125-34-6	COC1(CCCCC1(OC)OC)OC	{1: 4, 11: 4, 13: 2, 22: 4}
OK	1632-16-2	CCCCC(=C)CC	{1: 2, 2: 4, 5: 1, 7: 1}
OK	1632-68-4	C1CC2CC1CC2O	{20: 1, 11: 4, 12: 3}
OK	1632-70-8	CCCCCCC(C)CCCC	{1: 3, 2: 8, 3: 1}
OK	1632-71-9	CCCCC(C)C(CC)CCC	{1: 4, 2: 6, 3: 2}
OK	1632-73-1	CC1(C2CCC(C2)(C1O)C)C	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	16320-04-0	CC[C@]12C=CC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@]2(C#C)O	{1: 1, 2: 1, 9: 1, 10: 1, 11: 6, 12: 2, 13: 2, 14: 3, 15: 3, 20: 1, 25: 1}
OK	16325-63-6	CC(CC(C)(C)C)CO	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	16325-64-7	CC(CCO)C(C)(C)C	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	16327-13-2	C1C=CC=CC=CC1Br	{18: 1, 11: 1, 12: 1, 14: 6}
OK	1633-00-7	C(CCCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O	{33: 2, 2: 10, 27: 4}
OK	1633-78-9	C(CCCS)CCO	{2: 6, 20: 1, 39: 1}
OK	1633-89-2	CCCC(C)CS	{1: 2, 2: 3, 3: 1, 39: 1}
OK	1633-90-5	CCCC(CC)S	{1: 2, 2: 3, 3: 1, 39: 1}
OK	1633-97-2	CCCC(C)(C)S	{1: 3, 2: 2, 4: 1, 39: 1}
OK	16330-21-5	CCCSC=C	{40: 1, 1: 1, 2: 2, 5: 1, 6: 1}
OK	16331-21-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 27, 18: 1}
OK	16331-24-1	CCCCCCCCCCCCCCCCCCCCCCCCS	{1: 1, 2: 23, 39: 1}
OK	16331-64-9	CC[O-]	{1: 1, 2: 1, 29: 1}
OK	16332-06-2	COCC(=O)N	{24: 1, 1: 1, 2: 1, 30: 1, 22: 1}
OK	16338-48-0	C=CC[C@@H](C(=O)O)N	{2: 1, 3: 1, 5: 1, 6: 1, 27: 1, 30: 1}
OK	16338-97-9	C=CCN(CC=C)N=O	{33: 1, 2: 2, 5: 2, 6: 2, 34: 1, 29: 1}
OK	16339-04-1	CCN(C(C)C)N=O	{1: 3, 34: 1, 3: 1, 33: 1, 2: 1, 29: 1}
OK	16339-05-2	CCCCCN(CCCC)N=O	{1: 2, 2: 7, 34: 1, 29: 1, 33: 1}
OK	16339-07-4	CN1CCN(CC1)N=O	{1: 1, 34: 1, 11: 4, 29: 1, 33: 2}
OK	16339-14-3	CN(C)N(C)N=O	{1: 3, 34: 1, 29: 1, 33: 2}
OK	16339-16-5	CN(CCCl)N=O	{1: 1, 34: 1, 33: 1, 2: 2, 17: 1, 29: 1}
OK	16339-18-7	C(C#N)N(CC#N)N=O	{33: 1, 2: 2, 34: 1, 29: 1, 37: 2}
OK	16339-21-2	CC(=O)CC(C)(C)N(C)N=O	{1: 4, 2: 1, 4: 1, 33: 1, 34: 1, 24: 1, 29: 1}
OK	1634-04-4	CC(C)(C)OC	{1: 4, 4: 1, 22: 1}
OK	1635-02-5	CCC(=C(C)C(=O)C)C	{24: 1, 1: 4, 2: 1, 7: 2}
OK	16354-58-8	CC(=O)N[C@@H](CO)C(=O)O	{1: 1, 2: 1, 3: 1, 20: 1, 24: 1, 27: 1, 31: 1}
OK	16355-92-3	C(CCCCCI)CCCCI	{2: 10, 19: 2}
OK	16356-02-8	COCC#CCOC	{1: 2, 2: 2, 10: 2, 22: 2}
OK	16356-05-1	CCC(=C)C(=C)CC	{1: 2, 2: 2, 5: 2, 7: 2}
OK	16356-11-9	CCCCCC=CC=CC=C	{1: 1, 2: 4, 5: 1, 6: 5}
OK	16356-33-5	CCCCN1CN(C(=O)N(C1)CO)CO	{1: 1, 2: 5, 33: 3, 11: 2, 20: 2, 25: 1}
OK	1636-39-1	C1CCC(C1)C2CCCC2	{11: 8, 12: 2}
OK	1636-41-5	CCCC(CC)C(CC)CCC	{1: 4, 2: 6, 3: 2}
OK	1636-43-7	CCCCC(C)C(C)CCCC	{1: 4, 2: 6, 3: 2}
OK	1636-44-8	CCCCCCC(CC)CCC	{1: 3, 2: 8, 3: 1}
OK	163611-04-9	C(CCN(CCCN(CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CN(CCCN(CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN	{33: 30, 2: 184, 30: 32}
OK	16369-05-4	CC(C)C(CO)N	{1: 2, 2: 1, 3: 2, 20: 1, 30: 1}
OK	16369-12-3	CCCCCCCCC=CCCCCCCC	{1: 2, 2: 13, 6: 2}
OK	16369-17-8	CC(C)CC(CO)N	{1: 2, 2: 2, 3: 2, 20: 1, 30: 1}
OK	16369-21-4	CCCNCCO	{1: 1, 2: 4, 20: 1, 31: 1}
OK	1637-24-7	CC(CC(C)(C)OC(=O)C)OC(=O)C	{1: 5, 2: 1, 3: 1, 4: 1, 28: 2}
OK	1637-31-6	C(=C(C(=CCl)Cl)Cl)Cl	{17: 4, 6: 2, 7: 2}
OK	163702-07-6	COC(F)(F)C(F)(F)C(F)(F)C(F)(F)F	{16: 9, 1: 1, 4: 4, 22: 1}
OK	16377-01-8	C(CCC(=N)N)C[C@@H](C(=O)O)N.Cl	{2: 4, 3: 1, 36: 1, 7: 1, 17: 1, 27: 1, 30: 2}
OK	1638-16-0	CC(COCC(C)OCC(C)O)O	{1: 3, 2: 3, 3: 3, 20: 2, 22: 2}
OK	1638-26-2	CC1(CCCC1)C	{1: 2, 11: 4, 13: 1}
OK	1638-95-5	CC1(CCCC1)S	{1: 1, 11: 4, 13: 1, 39: 1}
OK	16384-97-7	C1CC2C3CC3C1C2O	{20: 1, 11: 3, 12: 5}
OK	16386-93-9	CC(C)(CC=C)C(=O)O	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 27: 1}
OK	16387-55-6	CCCCCC#CC(OCC)OCC	{1: 3, 2: 6, 3: 1, 10: 2, 22: 2}
OK	16387-70-5	CCC#CC#CCC	{1: 2, 2: 2, 10: 4}
OK	16387-71-6	CCCC#CC#CCCC	{1: 2, 2: 4, 10: 4}
OK	16387-72-7	CCCCCC#CC#CCCCCC	{1: 2, 2: 8, 10: 4}
OK	1639-01-6	CC(C)C(C)(C)S	{1: 4, 3: 1, 4: 1, 39: 1}
OK	1639-03-8	CCC(C)(CC)S	{1: 3, 2: 2, 4: 1, 39: 1}
OK	1639-04-9	CCC(C(C)C)S	{1: 3, 2: 1, 3: 2, 39: 1}
OK	1639-09-4	CCCCCCCS	{1: 1, 2: 6, 39: 1}
OK	1639-43-6	CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4O)C)C	{1: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 28: 1}
OK	16395-80-5	CCC(=O)N(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 24: 1, 29: 1}
OK	16397-19-6	CCCCC(CO)N	{1: 1, 2: 4, 3: 1, 20: 1, 30: 1}
OK	16397-75-4	CCCCCC(=O)OCC(CC)CCCC	{1: 3, 2: 9, 3: 1, 28: 1}
OK	1640-89-7	CCC1CCCC1	{1: 1, 2: 1, 11: 4, 12: 1}
OK	16400-63-8	C=C(CCl)Br	{17: 1, 2: 1, 18: 1, 5: 1, 7: 1}
OK	16400-70-7	CCCCC1CC=CC(=O)O1	{1: 1, 2: 3, 11: 1, 12: 1, 14: 2, 28: 1}
OK	16400-72-9	CCCCCCCC1CC=CC(=O)O1	{1: 1, 2: 6, 11: 1, 12: 1, 14: 2, 28: 1}
OK	164002-60-2	CC(C)C=NCCCC(C)CN=CC(C)C	{1: 5, 2: 4, 3: 3, 34: 2, 6: 2}
OK	16409-43-1	CC1CCOC(C1)C=C(C)C	{1: 3, 6: 1, 7: 1, 11: 3, 12: 2, 23: 1}
OK	16409-46-4	CC1CCC(C(C1)OC(=O)CC(C)C)C(C)C	{1: 5, 2: 1, 3: 2, 11: 3, 12: 3, 28: 1}
OK	16416-44-7	CC(C)C=CBr	{1: 2, 18: 1, 3: 1, 6: 2}
OK	16419-78-6	C(#CC#N)C#CC#N	{10: 4, 37: 2}
OK	1642-49-5	C#CCCCCCCCC(=O)O	{9: 1, 2: 7, 27: 1, 10: 1}
OK	1642-54-2	CCN(CC)C(=O)N1CCN(CC1)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 4, 4: 1, 33: 3, 11: 4, 20: 1, 24: 1, 27: 3}
OK	16421-52-6	C1(=O)NNN=N1	{32: 2, 25: 1, 35: 2}
OK	164250-92-4	C1CCC(=O)OCC1.C(CCCN=C=O)CCN=C=O.C(CCCO)CCO	{2: 12, 8: 2, 11: 5, 34: 2, 20: 2, 28: 1, 29: 2}
OK	16429-03-1	CCC1CCC(C1=O)CC	{1: 2, 2: 2, 11: 2, 12: 2, 25: 1}
OK	16432-53-4	CCC(CCCO)O	{1: 1, 2: 4, 3: 1, 20: 2}
OK	164342-38-5	CCOC=C(C(=O)C)C(=O)C(F)(F)F	{1: 2, 2: 1, 4: 1, 6: 1, 7: 1, 16: 3, 22: 1, 24: 2}
OK	16435-49-7	CCCCCCCCCCC(=C)C	{1: 2, 2: 9, 5: 1, 7: 1}
OK	16445-01-5	CCCCCCCCC=CCCCCCCCC(=O)NCCNCCNC(=O)CCCCCCCC=CCCCCCCCC	{24: 2, 1: 2, 2: 32, 6: 4, 31: 3}
OK	1645-75-6	C(=N)(C(F)(F)F)C(F)(F)F	{16: 6, 36: 1, 4: 2, 7: 1}
OK	16456-33-0	C1CC2CC=CCC1C2	{11: 5, 12: 2, 14: 2}
OK	16456-36-3	CCCCCCCCCCCCCCOC(=O)CCCCCCC	{1: 2, 2: 19, 28: 1}
OK	1646-75-9	CC(C)(/C=N/O)SC	{1: 3, 34: 1, 4: 1, 6: 1, 40: 1, 20: 1}
OK	16464-38-3	CCC(C)(C#CCOCCN1CCCCC1)O	{1: 2, 2: 4, 4: 1, 33: 1, 10: 2, 11: 5, 20: 1, 22: 1}
OK	16464-42-9	CC#CC1(CCCC(C1)OCCN(C(C)C)C(C)C)O	{1: 5, 2: 2, 3: 2, 33: 1, 10: 2, 11: 4, 12: 1, 13: 1, 20: 1, 22: 1}
OK	16464-43-0	CC#CC1(CCCC(C1)OCCN2CCCCC2)O	{1: 1, 2: 2, 33: 1, 10: 2, 11: 9, 12: 1, 13: 1, 20: 1, 22: 1}
OK	16466-61-8	CC(C)(C)OC(=O)NNC(=O)OC(C)(C)C	{1: 6, 4: 2, 28: 2, 31: 2}
OK	16468-98-7	CCC1(C(=O)NC(=O)NC1=O)/C(=C/C)/C	{32: 2, 1: 3, 2: 1, 6: 1, 7: 1, 13: 1, 25: 3}
OK	16469-62-8	CCC(=O)C#C	{24: 1, 1: 1, 2: 1, 10: 1, 9: 1}
OK	1647-08-1	CCC(C)(C)CC=C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 1}
OK	1647-16-1	C=CCCCCCCC=C	{2: 6, 5: 2, 6: 2}
OK	1647-23-0	CC(C)(C)CCBr	{1: 3, 2: 2, 4: 1, 18: 1}
OK	1647-26-3	C1CCC(CC1)CCBr	{2: 2, 11: 5, 12: 1, 18: 1}
OK	16473-11-3	C1CC(=O)C2CCC(=O)C1C2	{25: 2, 11: 5, 12: 2}
OK	16474-32-1	[O-]Br(=O)(=O)=O	{18: 1, 29: 4}
OK	16474-36-5	CCCCCCCCCC(=O)OOC(C)(C)C	{1: 4, 2: 8, 4: 1, 22: 1, 28: 1}
OK	16474-41-2	CCCCCCCCCC(=O)OC(C)(C)C	{1: 4, 2: 8, 4: 1, 28: 1}
OK	16474-43-4	CC(C)(C)C(=O)OC(C)(C)C	{1: 6, 4: 2, 28: 1}
OK	16484-17-6	C1CCC2CC(=O)CC2C1	{25: 1, 11: 6, 12: 2}
OK	16484-86-9	CCO/C=C/OCC	{1: 2, 2: 2, 22: 2, 6: 2}
OK	16485-10-2	CC(C)(CO)C(C(=O)NCCCO)O	{1: 2, 2: 4, 3: 1, 4: 1, 20: 3, 24: 1, 31: 1}
OK	16486-94-5	C(=O)(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 21, 27: 1, 4: 10}
OK	16486-96-7	C(=O)(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 25, 27: 1, 4: 12}
OK	16487-33-5	CN1C2CCC1CC(C2)OC	{1: 2, 11: 4, 12: 3, 22: 1, 33: 1}
OK	16487-68-6	CCCCC=C=CC	{8: 1, 1: 2, 2: 3, 6: 2}
OK	16488-99-6	CC(C)N(CCOCC#CC(C)(C)O)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1, 33: 1, 10: 2, 20: 1, 22: 1}
OK	16489-00-2	CC(C)(C#CCOCCN1CCCCC1)O	{1: 2, 2: 3, 4: 1, 33: 1, 10: 2, 11: 5, 20: 1, 22: 1}
OK	1649-08-7	C(C(F)(F)Cl)Cl	{16: 2, 17: 2, 2: 1, 4: 1}
OK	1649-46-3	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@@H]4[C@@]3(C[C@H](C(=O)C4)F)C	{1: 2, 11: 8, 12: 6, 13: 2, 16: 1, 20: 1, 25: 1}
OK	1649-73-6	CCCCCCCCCCCCCCCCCCF	{16: 1, 1: 1, 2: 17}
OK	16491-15-9	CC1CCC=C1C	{1: 2, 11: 2, 12: 1, 14: 1, 15: 1}
OK	16491-24-0	CC=CC=CCOC(=O)C(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 6: 4}
OK	16491-25-1	CCC(=O)OCC=CC=CC	{1: 2, 2: 2, 28: 1, 6: 4}
OK	16491-36-4	CCCC(=O)OCCC=CCC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	164929-15-1	CC1(CC(C(=O)O1)C(F)(F)F)C	{1: 2, 4: 1, 11: 1, 12: 1, 13: 1, 16: 3, 28: 1}
OK	16493-35-9	CCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 10, 28: 1, 5: 1, 7: 1}
OK	16493-62-2	C1[C@@H](OC1=O)C(Cl)(Cl)Cl	{12: 1, 11: 1, 4: 1, 28: 1, 17: 3}
OK	16493-80-4	CCCCC(CC)CCC(=O)O	{27: 1, 1: 2, 2: 6, 3: 1}
OK	16498-05-8	CCC(C)(C#CCOCCN(C(C)C)C(C)C)O	{1: 6, 2: 4, 3: 2, 4: 1, 33: 1, 10: 2, 20: 1, 22: 1}
OK	16499-18-6	CCC[O]	{1: 1, 2: 2, 29: 1}
OK	16499-88-0	CCCCOCCCN	{1: 1, 2: 6, 30: 1, 22: 1}
OK	165038-32-4	CC1([C@@H]2CC[C@@H](C2)[C@]13COC(=O)N3)C	{32: 1, 1: 2, 11: 4, 12: 2, 13: 2, 28: 1}
OK	16507-02-1	CC(C)(CCC(=O)OC)[N+](=O)[O-]	{1: 3, 2: 2, 4: 1, 38: 1, 28: 1}
OK	16508-33-1	CC(C)(C)C1CCC(=O)C(C1)Cl	{1: 3, 4: 1, 11: 3, 12: 2, 17: 1, 25: 1}
OK	16508-97-7	C1CCC(CC1)C(=O)OC2(CCCC2)O	{20: 1, 11: 9, 12: 1, 13: 1, 28: 1}
OK	1651-34-9	CCCCC(=O)OCC(F)(F)F	{16: 3, 1: 1, 2: 4, 4: 1, 28: 1}
OK	165101-57-5	CCCCC(CC)C1N(CCO1)CCCC	{1: 3, 2: 7, 3: 1, 33: 1, 11: 2, 12: 1, 23: 1}
OK	16515-90-5	CCOC(=O)C(C)(C(=O)OCC)C(=O)OCC	{1: 4, 2: 3, 4: 1, 28: 3}
OK	16516-37-3	CCCCCCCCCCCCCCCC(=O)N(CC(C)O)CC(C)O	{1: 3, 2: 16, 3: 2, 33: 1, 20: 2, 24: 1}
OK	16517-11-6	C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 35, 27: 1, 4: 17}
OK	165178-32-5	C(=C(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F.C(=C(F)F)(OC(F)(F)F)F.C(=C(F)F)(F)F	{16: 20, 4: 4, 22: 2, 7: 6}
OK	16519-97-4	[CH2]Br	{18: 1, 5: 1}
OK	16519-98-5	[CH2]I	{19: 1, 5: 1}
OK	1652-81-9	C(C(F)(F)Cl)(C(F)(Cl)Cl)(F)F	{16: 5, 17: 3, 4: 3}
OK	1652-89-7	C(C(F)(F)F)(C(Cl)(Cl)Cl)(Cl)Cl	{16: 3, 17: 5, 4: 3}
OK	1652-96-6	CCCCCCCCCC=CC	{1: 2, 2: 8, 6: 2}
OK	16520-04-0	CO[CH2]	{1: 1, 5: 1, 22: 1}
OK	16526-27-5	C1CC2CC1C3C2CC3	{11: 5, 12: 4}
OK	16528-92-0	C1OCOCOCOCO1	{11: 5, 23: 5}
OK	16529-56-9	CC(C=C)C#N	{1: 1, 3: 1, 5: 1, 6: 1, 37: 1}
OK	16529-76-3	C1CC2C1C3CC2C=C3	{11: 3, 12: 4, 14: 2}
OK	16529-83-2	C1CC2CC1C3C2C=C3	{11: 3, 12: 4, 14: 2}
OK	1653-16-3	CCCCC(CC)CI	{19: 1, 1: 2, 2: 5, 3: 1}
OK	1653-17-4	C(C(Cl)Cl)C(Cl)Cl	{17: 4, 2: 1, 3: 2}
OK	1653-19-6	C=C(C(=C)Cl)Cl	{17: 2, 5: 2, 7: 2}
OK	1653-30-1	CCCCCCCCCC(C)O	{1: 2, 2: 8, 3: 1, 20: 1}
OK	1653-31-2	CCCCCCCCCCCC(C)O	{1: 2, 2: 10, 3: 1, 20: 1}
OK	1653-32-3	CCCCCCCCCCCC(CC)O	{1: 2, 2: 11, 3: 1, 20: 1}
OK	1653-33-4	CCCCCCCCCCC(CCC)O	{1: 2, 2: 11, 3: 1, 20: 1}
OK	1653-34-5	CCCCCCCCCCCCCC(C)O	{1: 2, 2: 12, 3: 1, 20: 1}
OK	1653-40-3	CC(C)CCCCCO	{1: 2, 2: 5, 3: 1, 20: 1}
OK	1653-57-2	CCCCCCCCCCON=O	{1: 1, 2: 9, 34: 1, 29: 1, 22: 1}
OK	16536-57-5	C1CC[C@H]([C@H](C1)O)Br	{20: 1, 18: 1, 11: 4, 12: 2}
OK	16538-93-5	CCCCC1CCCCCCC1	{1: 1, 2: 3, 11: 7, 12: 1}
OK	1654-86-0	CCCCCCCCCCOC(=O)CCCCCCCCC	{1: 2, 2: 17, 28: 1}
OK	1654-87-1	C1CCC2(CCCCC2C1)O	{20: 1, 11: 8, 12: 1, 13: 1}
OK	16544-21-1	C=CC(=O)OCC([N+](=O)[O-])([N+](=O)[O-])F	{2: 1, 4: 1, 5: 1, 6: 1, 16: 1, 38: 2, 28: 1}
OK	16544-70-0	CCCCCCOC(=O)CC(CC(=O)OCCCCCC)(C(=O)OCCCCCC)O	{1: 3, 2: 17, 4: 1, 20: 1, 28: 3}
OK	16545-68-9	C1CC1O	{20: 1, 11: 2, 12: 1}
OK	1655-07-8	CCOC(=O)C1CCCCC1=O	{1: 1, 2: 1, 11: 4, 12: 1, 25: 1, 28: 1}
OK	16554-83-9	C1C=CCC2C1C2	{11: 3, 12: 2, 14: 2}
OK	16556-52-8	CCCCOC1=CC(C(C(C1)(C)C)C(=O)C)(C)C	{1: 6, 2: 3, 11: 1, 12: 1, 13: 2, 14: 1, 15: 1, 22: 1, 24: 1}
OK	1656-48-0	C(COCCC#N)C#N	{2: 4, 37: 2, 22: 1}
OK	16561-29-8	CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)O)CO)[C@H]4[C@@]1(C4(C)C)OC(=O)C)O)C	{1: 6, 2: 13, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	16568-02-8	C/C=N/N(C)C=O	{1: 2, 26: 1, 34: 1, 6: 1, 33: 1}
OK	16580-06-6	CC(C)(C)OOC(=O)CCCCCCCC(=O)OOC(C)(C)C	{1: 6, 2: 7, 4: 2, 22: 2, 28: 2}
OK	16580-23-7	CC1CCCCC1C(C)C	{11: 4, 1: 3, 3: 1, 12: 2}
OK	16580-24-8	CC1CCCC(C1)C(C)C	{11: 4, 1: 3, 3: 1, 12: 2}
OK	16587-71-6	CCC(C)(C)C1CCC(=O)CC1	{1: 3, 2: 1, 4: 1, 11: 4, 12: 1, 25: 1}
OK	16596-38-6	CC(C)CN(CC(C)C)N	{1: 4, 2: 2, 3: 2, 30: 1, 33: 1}
OK	16596-41-1	C1CCN(C1)N	{33: 1, 11: 4, 30: 1}
OK	16597-65-2	CCCC(=O)OCCN(C)C	{1: 3, 2: 4, 28: 1, 33: 1}
OK	1660-04-4	CC(=O)C12CC3CC(C1)CC(C3)C2	{24: 1, 1: 1, 11: 6, 12: 3, 13: 1}
OK	16607-77-5	C=CC=CC#CC=C	{10: 2, 5: 2, 6: 4}
OK	16607-80-0	CN(C)CC1CCCCC1	{1: 2, 2: 1, 11: 5, 12: 1, 33: 1}
OK	16609-28-2	CC1=CC(=C)CC(C1)(C)C	{1: 3, 5: 1, 11: 2, 13: 1, 14: 1, 15: 2}
OK	16613-87-9	CCCCCCCCCCCCNCCO	{1: 1, 2: 13, 20: 1, 31: 1}
OK	16621-37-7	CCSCC(C)O	{40: 1, 1: 2, 2: 2, 3: 1, 20: 1}
OK	16624-68-3	CC(C)C[C@@H](C(=O)N)NC(=O)C	{1: 3, 2: 1, 3: 2, 24: 2, 30: 1, 31: 1}
OK	166248-82-4	CC/C=C\C=C/C=C\C=C/C=C\OCCO	{1: 1, 2: 3, 20: 1, 22: 1, 6: 10}
OK	1663-35-0	COCCOC=C	{1: 1, 2: 2, 22: 2, 5: 1, 6: 1}
OK	1663-39-4	CC(C)(C)OC(=O)C=C	{1: 3, 4: 1, 5: 1, 6: 1, 28: 1}
OK	1663-67-8	C(C(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 2: 1}
OK	16630-55-0	CC(=O)OCCCSC	{40: 1, 1: 2, 2: 3, 28: 1}
OK	16630-65-2	CC(CC(=O)O)SC	{27: 1, 1: 2, 2: 1, 3: 1, 40: 1}
OK	16630-66-3	COC(=O)CSC	{40: 1, 1: 2, 2: 1, 28: 1}
OK	16630-91-4	CCCCCC(C)C=O	{1: 2, 2: 4, 3: 1, 26: 1}
OK	16631-25-7	CCCCCCCCCCCCC(C(=O)OC)Br	{1: 2, 2: 11, 3: 1, 28: 1, 18: 1}
OK	16631-62-2	C/C=C/1\CCCC=C1	{1: 1, 11: 3, 14: 2, 6: 1, 15: 1}
OK	16631-63-3	CCCC1(CCCC1)C	{1: 2, 2: 2, 11: 4, 13: 1}
OK	1664-35-3	CCOC(=O)C1(CCCC1)N	{1: 1, 2: 1, 11: 4, 13: 1, 28: 1, 30: 1}
OK	16642-57-2	CC(C)OOC(C)C	{1: 4, 3: 2, 22: 2}
OK	16644-66-9	CCCCC(Br)(Br)Br	{1: 1, 2: 3, 4: 1, 18: 3}
OK	16644-98-7	CCCCC=CI	{1: 1, 2: 3, 19: 1, 6: 2}
OK	16646-44-9	C=CCOC(C(OCC=C)OCC=C)OCC=C	{22: 4, 2: 4, 3: 2, 5: 4, 6: 4}
OK	16647-05-5	CC(=CCCC(=C=CCC(=O)C)C)C	{1: 4, 2: 3, 6: 2, 7: 2, 8: 1, 24: 1}
OK	16650-10-5	C1(C(O1)(Cl)Cl)(Cl)Cl	{17: 4, 13: 2, 23: 1}
OK	16664-07-6	CC(C)(C1CCCCC1)O	{1: 2, 11: 5, 4: 1, 12: 1, 20: 1}
OK	16668-67-0	C#C/C=C\C#C	{9: 2, 10: 2, 6: 2}
OK	16668-83-0	C1C2CC3CC1CC(C2)C3F	{16: 1, 11: 5, 12: 5}
OK	16669-27-5	CCCCCCCCCCCCCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 21, 28: 1, 5: 1, 7: 1}
OK	16669-59-3	CC(C)COCNC(=O)C=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 22: 1, 24: 1, 31: 1}
OK	16672-66-5	COCCOC(=O)NCO	{1: 1, 2: 3, 20: 1, 22: 1, 28: 1, 31: 1}
OK	16672-70-1	C(COC(=O)NCO)O	{28: 1, 2: 3, 20: 2, 31: 1}
OK	16674-04-7	CC(CCl)C(=O)O	{27: 1, 1: 1, 2: 1, 3: 1, 17: 1}
OK	16675-05-1	CCCCCCCCCCCC(=O)O[C@@]12[C@@H](C1(C)C)[C@@H]3C=C(C[C@]4([C@H]([C@]3([C@@H](C2OC(=O)C)C)O)C=C(C4=O)C)O)CO	{1: 6, 2: 11, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	16676-91-8	CNCC(C(=O)O)N	{1: 1, 2: 1, 3: 1, 27: 1, 30: 1, 31: 1}
OK	16676-96-3	CCCCCCC=CCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 2}
OK	16681-65-5	CN1C=CN=N1	{1: 1, 35: 2, 14: 2, 33: 1}
OK	16681-77-9	CN1C=NN=N1	{1: 1, 35: 3, 14: 1, 33: 1}
OK	16681-78-0	CN1N=CN=N1	{1: 1, 35: 3, 14: 1, 33: 1}
OK	16688-98-5	C(CNCCC#N)C#N.Cl	{17: 1, 2: 4, 37: 2, 31: 1}
OK	1669-44-9	CCCCC=CC(=O)C	{24: 1, 1: 2, 2: 3, 6: 2}
OK	16693-53-1	CCCCCCCCCCCC(=O)N(C)CC(=O)O.C(CO)N(CCO)CCO	{1: 2, 2: 17, 33: 2, 20: 3, 24: 1, 27: 1}
OK	16694-30-7	CCCCCCCCCCCCCCC(=O)CCC(=O)O	{24: 1, 1: 1, 2: 15, 27: 1}
OK	16694-52-3	C(C[N+](=O)[O-])CCl	{17: 1, 2: 3, 38: 1}
OK	16695-31-1	C#CCCCCCCOC1CCCCO1	{2: 6, 9: 1, 10: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	16695-32-2	CCCCC#CCCCCCCOC1CCCCO1	{1: 1, 2: 9, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	16695-40-2	CCCCC=CCCCCCCO	{1: 1, 2: 9, 20: 1, 6: 2}
OK	16696-65-4	C(CCCCCBr)CCCCCBr	{2: 11, 18: 2}
OK	1670-46-8	CC(=O)C1CCCC1=O	{24: 1, 1: 1, 11: 3, 12: 1, 25: 1}
OK	16703-51-8	CN(C)C(=O)C#N	{24: 1, 1: 2, 37: 1, 33: 1}
OK	16703-52-9	CCOC(=O)C(=O)N(C)C	{24: 1, 1: 3, 2: 1, 28: 1, 33: 1}
OK	167078-06-0	CCCCCCCCCCCCCCCCCC(=O)OC1CC(NC(C1)(C)C)(C)C	{32: 1, 1: 5, 2: 16, 11: 2, 12: 1, 13: 2, 28: 1}
OK	167078-08-2	CC(C)NC(C)C.C=CC(=O)O	{1: 4, 3: 2, 5: 1, 6: 1, 27: 1, 31: 1}
OK	167078-09-3	CC(C)(CO)N(C)C.C=CC(=O)O	{1: 4, 2: 1, 4: 1, 5: 1, 6: 1, 33: 1, 20: 1, 27: 1}
OK	167078-10-6	C=CC(=O)O.C(C(CO)(CO)N)O	{2: 3, 4: 1, 5: 1, 6: 1, 20: 3, 27: 1, 30: 1}
OK	167078-12-8	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=CC(=O)O.C(CO)N	{1: 2, 2: 19, 5: 2, 6: 1, 7: 1, 20: 1, 27: 1, 28: 1, 30: 1}
OK	167078-13-9	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(C)(CO)N.C=CC(=O)O	{1: 4, 2: 18, 4: 1, 5: 2, 6: 1, 7: 1, 20: 1, 27: 1, 28: 1, 30: 1}
OK	167078-14-0	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCN(CC)CC.C=CC(=O)O	{1: 5, 2: 20, 5: 2, 6: 1, 7: 1, 33: 1, 27: 1, 28: 1}
OK	167078-15-1	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=CC(=O)O.C(CO)NCCO	{1: 2, 2: 21, 5: 2, 6: 1, 7: 1, 20: 2, 27: 1, 28: 1, 31: 1}
OK	167078-16-2	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(C)(CO)N(C)C.C=CC(=O)O	{1: 6, 2: 18, 4: 1, 5: 2, 6: 1, 7: 1, 20: 1, 33: 1, 27: 1, 28: 1}
OK	167078-17-3	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=CC(=O)O.C(C(CO)(CO)N)O	{1: 2, 2: 20, 4: 1, 5: 2, 6: 1, 7: 1, 20: 3, 27: 1, 28: 1, 30: 1}
OK	167078-18-4	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(CNCC(C)O)O.C=CC(=O)O	{1: 4, 2: 19, 3: 2, 5: 2, 6: 1, 7: 1, 20: 2, 27: 1, 28: 1, 31: 1}
OK	167078-19-5	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.C=CC(=O)O.C(CO)N(CCO)CCO	{1: 2, 2: 23, 5: 2, 6: 1, 7: 1, 20: 3, 33: 1, 27: 1, 28: 1}
OK	167078-20-8	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCCCCC/C=C\CCCCCCCCN.C=CC(=O)O	{1: 3, 2: 32, 5: 2, 6: 3, 7: 1, 27: 1, 28: 1, 30: 1}
OK	16713-66-9	C1CCC(C1)(CC(=O)O)CC(=O)O	{27: 2, 2: 2, 11: 4, 13: 1}
OK	16713-80-7	CC(=O)O[C@H]1[C@H](O[C@H]2[C@@H]1OC(O2)(C)C)[C@H]3COC(O3)(C)C	{1: 5, 11: 1, 12: 5, 13: 2, 23: 5, 28: 1}
OK	16714-68-4	C(C(C(Cl)Cl)(Cl)Cl)Cl	{17: 5, 2: 1, 3: 1, 4: 1}
OK	16714-77-5	CC(C(=O)CCl)Cl	{24: 1, 1: 1, 2: 1, 3: 1, 17: 2}
OK	16715-83-6	CC(C)N(CCOC(=O)C(=C)C)C(C)C	{1: 5, 2: 2, 3: 2, 5: 1, 7: 1, 33: 1, 28: 1}
OK	1672-46-4	C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O)O	{1: 2, 11: 9, 12: 6, 13: 3, 14: 1, 15: 1, 20: 3, 28: 1}
OK	16723-89-0	CC1(CCCCCC(CCC1)(C)C)C	{1: 4, 11: 8, 13: 2}
OK	16724-63-3	CCCCCCCCCCCCCCCCNCCCCCCCCCCCCCCCC	{1: 2, 2: 30, 31: 1}
OK	16725-53-4	CCCCC=CCCCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 6: 2}
OK	16726-19-5	C1CCC2C(C1)CC3CCCCC3N2	{32: 1, 11: 9, 12: 4}
OK	16726-41-3	CC(C)NN.Cl	{31: 1, 1: 2, 3: 1, 30: 1, 17: 1}
OK	16728-49-7	CCCCCCCCOCCC#N	{1: 1, 2: 9, 37: 1, 22: 1}
OK	16728-51-1	CCCCCCCCCCOCCC#N	{1: 1, 2: 11, 37: 1, 22: 1}
OK	16732-83-5	CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(C=CCC4)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 2}
OK	16732-84-6	C[C@H](CCCC(C)C)C1CC[C@@H]2C1(CC[C@H]3C2CCC4C3(CCC=C4)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 2}
OK	16732-86-8	CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4=CCCCC34C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 4, 13: 2, 14: 1, 15: 1}
OK	16736-42-8	CC(=CCCC=C(C)C)C	{1: 4, 2: 2, 6: 2, 7: 2}
OK	1674-10-8	CC1=C(CCCC1)C	{1: 2, 11: 4, 15: 2}
OK	1674-33-5	CCCC(CCl)Cl	{1: 1, 2: 3, 3: 1, 17: 2}
OK	1674-62-0	CN=C(N)N=C(N)N.Cl	{1: 1, 34: 2, 17: 1, 30: 3, 7: 2}
OK	16744-89-1	CC(C)(CCC=C)O	{1: 2, 2: 2, 4: 1, 5: 1, 6: 1, 20: 1}
OK	16745-94-1	CCC(C)C(C)C=C	{1: 3, 2: 1, 3: 2, 5: 1, 6: 1}
OK	16746-02-4	CCCC(=C)C(C)C	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1}
OK	16746-86-4	CCCC(C)C(=C)C	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1}
OK	16746-87-5	CCC(C)CC(=C)C	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1}
OK	16747-25-4	CCCC(C)C(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1}
OK	16747-26-5	CCC(C)CC(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1}
OK	16747-28-7	CCCC(C)(C)C(C)C	{1: 5, 2: 2, 3: 1, 4: 1}
OK	16747-30-1	CCC(C)(C)CC(C)C	{1: 5, 2: 2, 3: 1, 4: 1}
OK	16747-31-2	CCC(C)C(C)(C)CC	{1: 5, 2: 2, 3: 1, 4: 1}
OK	16747-32-3	CCC(CC)C(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1}
OK	16747-33-4	CCC(C)(CC)C(C)C	{1: 5, 2: 2, 3: 1, 4: 1}
OK	16747-38-9	CC(C)C(C)(C)C(C)C	{1: 6, 3: 2, 4: 1}
OK	16747-42-5	CC(C)C(C)CC(C)(C)C	{1: 6, 2: 1, 3: 2, 4: 1}
OK	16747-44-7	CC(C)C(C)(C)C(C)(C)C	{1: 7, 3: 1, 4: 2}
OK	16747-45-8	CC(C(C)(C)C)C(C)(C)C	{1: 7, 3: 1, 4: 2}
OK	16747-50-5	CCC1(CCCC1)C	{1: 2, 2: 1, 11: 4, 13: 1}
OK	1675-69-0	C(CCCC#N)CCCC#N	{2: 7, 37: 2}
OK	16750-40-6	CC(CC#N)N	{1: 1, 2: 1, 3: 1, 37: 1, 30: 1}
OK	16751-58-9	CCCC(CC)N	{1: 2, 2: 3, 3: 1, 30: 1}
OK	16751-59-0	CCCC(CCC)N	{1: 2, 2: 4, 3: 1, 30: 1}
OK	16752-77-5	CC(=NOC(=O)NC)SC	{1: 3, 34: 1, 7: 1, 40: 1, 28: 1, 31: 1}
OK	16754-49-7	CC(C)COC(OCC(C)C)OCC(C)C	{1: 6, 2: 3, 3: 4, 22: 3}
OK	16755-07-0	C1=C(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{32: 1, 2: 1, 12: 4, 14: 1, 15: 1, 20: 3, 23: 1, 25: 2}
OK	16777-87-0	CCOC(CCO)OCC	{1: 2, 2: 4, 3: 1, 20: 1, 22: 2}
OK	16778-70-4	CCN1C=NC=N1	{1: 1, 2: 1, 35: 2, 14: 2, 33: 1}
OK	1678-45-1	CCCCCCCCCCCC(=O)OC(CO)CO	{1: 1, 2: 12, 3: 1, 20: 2, 28: 1}
OK	1678-91-7	CCC1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1}
OK	1678-92-8	CCCC1CCCCC1	{1: 1, 2: 2, 11: 5, 12: 1}
OK	1678-93-9	CCCCC1CCCCC1	{1: 1, 2: 3, 11: 5, 12: 1}
OK	1678-97-3	CC1CCCC(C1C)C	{1: 3, 11: 3, 12: 3}
OK	1678-98-4	CC(C)CC1CCCCC1	{11: 5, 1: 2, 2: 1, 3: 1, 12: 1}
OK	1678-99-5	CCC1CCCC(C1)CC	{1: 2, 2: 2, 11: 4, 12: 2}
OK	16782-44-8	C1C2CC2C3C1C3	{11: 3, 12: 4}
OK	167820-65-7	CC/C=C/C/C=C\CCO	{1: 1, 2: 4, 20: 1, 6: 4}
OK	16783-22-5	C1CCC2C(C1)CCC2=O	{25: 1, 11: 6, 12: 2}
OK	16789-46-1	CCCC(CC)C(C)C	{1: 4, 2: 3, 3: 2}
OK	16789-51-8	CCC=C(CC)CC	{1: 3, 2: 3, 6: 1, 7: 1}
OK	1679-00-1	CCC1CCC(CC1)CC	{1: 2, 2: 2, 11: 4, 12: 2}
OK	1679-06-7	CCCCC(C)S	{1: 2, 2: 3, 3: 1, 39: 1}
OK	1679-07-8	C1CCC(C1)S	{11: 4, 12: 1, 39: 1}
OK	1679-08-9	CC(C)(C)CS	{1: 3, 2: 1, 4: 1, 39: 1}
OK	1679-09-0	CCC(C)(C)S	{1: 3, 2: 1, 4: 1, 39: 1}
OK	1679-36-3	CCC#CC(=O)C	{24: 1, 1: 2, 2: 1, 10: 2}
OK	1679-47-6	CC1CCOC1=O	{1: 1, 11: 2, 12: 1, 28: 1}
OK	1679-49-8	CC1CC(=O)OC1	{1: 1, 11: 2, 12: 1, 28: 1}
OK	1679-51-2	C1CC(CC=C1)CO	{20: 1, 2: 1, 11: 3, 12: 1, 14: 2}
OK	1679-53-4	C(CCCCC(=O)O)CCCCO	{2: 9, 27: 1, 20: 1}
OK	16792-03-3	CC(C)CC(=O)OC(C)(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 28: 1}
OK	1680-21-3	C=CC(=O)OCCOCCOCCOC(=O)C=C	{2: 6, 22: 2, 28: 2, 5: 2, 6: 2}
OK	1681-11-4	CN(C)C1=NC(=NC2=NC=NC21)SC	{1: 3, 35: 4, 33: 1, 40: 1, 12: 1, 14: 1, 15: 3}
OK	16813-18-6	CCCCCCCCCCCCCCCC(C)O	{1: 2, 2: 14, 3: 1, 20: 1}
OK	16813-30-2	C(CCl)NC(=O)NC(=O)NCCCl	{24: 2, 17: 2, 2: 4, 31: 3}
OK	16813-33-5	C1CN(C(=O)N1)C(=O)NCCCl	{32: 1, 33: 1, 2: 2, 11: 2, 17: 1, 24: 1, 25: 1, 31: 1}
OK	16813-36-8	C1CN(C(=O)NC1=O)N=O	{32: 1, 33: 1, 34: 1, 11: 2, 25: 2, 29: 1}
OK	16813-42-6	C(CCl)NC(=O)NNC(=O)NCCCl	{24: 2, 17: 2, 2: 4, 31: 4}
OK	16813-44-8	C1CCC(CC1)C(=O)NCCCl	{2: 2, 11: 5, 12: 1, 17: 1, 24: 1, 31: 1}
OK	16816-67-4	CC(C)(CO)C(C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)C(C(C)(C)CO)O)O	{1: 4, 2: 10, 3: 2, 4: 2, 40: 2, 20: 4, 24: 4, 31: 4}
OK	1682-31-1	C(CI)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 11, 2: 2, 19: 1, 4: 5}
OK	16820-12-5	CCC1(C(=O)NC(=O)N1)C	{32: 2, 1: 2, 2: 1, 13: 1, 25: 2}
OK	16820-18-1	C[C@](CO)(C(=O)O)N	{1: 1, 2: 1, 4: 1, 20: 1, 27: 1, 30: 1}
OK	168253-59-6	CCOC(=O)C[C@@H](C(=O)OCC)NCCCC(C)CN[C@@H](CC(=O)OCC)C(=O)OCC	{1: 5, 2: 10, 3: 3, 28: 4, 31: 2}
OK	168255-30-9	CC(CN(C)C)O.C=CC(=O)O	{1: 3, 2: 1, 3: 1, 5: 1, 6: 1, 33: 1, 20: 1, 27: 1}
OK	16826-16-7	CCN(CC)C=C(C)C	{1: 4, 2: 2, 33: 1, 6: 1, 7: 1}
OK	16830-14-1	CC(C)N(C(=O)N)N=O	{1: 2, 34: 1, 3: 1, 33: 1, 24: 1, 29: 1, 30: 1}
OK	16830-15-2	CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)OC6C(C(C(C(O6)COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)O)O)O)O	{1: 7, 2: 3, 11: 8, 12: 22, 13: 5, 14: 1, 15: 1, 20: 12, 22: 2, 23: 3, 28: 1}
OK	16830-40-3	CCCCCCCCCCCC(=O)O.C(CO)N	{1: 1, 2: 12, 27: 1, 20: 1, 30: 1}
OK	16831-48-4	COC1(CCC=CC1)OC	{1: 2, 22: 2, 11: 3, 13: 1, 14: 2}
OK	16832-21-6	C1CCC2(CC1)O[C@@H]3[C@H]([C@H](O[C@@H]3O2)[C@@H](CO)O)O	{2: 1, 3: 1, 11: 5, 12: 4, 13: 1, 20: 3, 23: 3}
OK	16832-25-0	CCCCCCCCCCCCSCC(C)C(=O)OC	{40: 1, 1: 3, 2: 12, 3: 1, 28: 1}
OK	16839-48-8	CC(=C)C(=O)OCCOCC=C	{1: 1, 2: 3, 5: 2, 6: 1, 7: 1, 22: 1, 28: 1}
OK	16840-84-9	CCCCCCCCCC(CCCCCCCCC)O	{1: 2, 2: 16, 3: 1, 20: 1}
OK	16846-24-5	C[C@@H]1CC=CC=C[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)OC(=O)C)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)CC(C)C)(C)O)N(C)C)O)CC=O)C)O	{1: 11, 2: 2, 3: 1, 33: 1, 11: 4, 12: 15, 13: 1, 14: 4, 20: 3, 22: 3, 23: 2, 26: 1, 28: 3}
OK	16849-88-0	CN(C)C=C(C#N)C#N	{1: 2, 37: 2, 33: 1, 6: 1, 7: 1}
OK	168533-87-7	CCC(CO)(CO)COC(=O)CC(=O)C	{1: 2, 2: 5, 4: 1, 20: 2, 24: 1, 28: 1}
OK	16855-95-1	CC1C=COC=C1	{1: 1, 12: 1, 14: 4, 23: 1}
OK	1686-14-2	CC1(C2CC1C3(C(C2)O3)C)C	{1: 3, 11: 2, 12: 3, 13: 2, 23: 1}
OK	1686-20-0	CC1=CCC(C=C1)C(C)(C)O	{1: 3, 4: 1, 11: 1, 12: 1, 14: 3, 15: 1, 20: 1}
OK	1686-30-2	CC(=C)CCCC(=C)C=C	{1: 1, 2: 3, 5: 3, 6: 1, 7: 2}
OK	1686-62-0	C[C@@]1(CC[C@H]2C(=CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)OC)C)C1)C=C	{1: 4, 5: 1, 6: 1, 11: 7, 12: 2, 13: 3, 14: 1, 15: 1, 28: 1}
OK	16868-13-6	C=CC(=O)OC1CCCC1	{28: 1, 11: 4, 12: 1, 5: 1, 6: 1}
OK	16868-14-7	CC(=C)C(=O)OC1CCCC1	{1: 1, 5: 1, 7: 1, 11: 4, 12: 1, 28: 1}
OK	1687-29-2	COC(=O)C1CCCCC1C(=O)OC	{1: 2, 11: 4, 12: 2, 28: 2}
OK	1687-30-5	C1CCC(C(C1)C(=O)O)C(=O)O	{27: 2, 11: 4, 12: 2}
OK	1687-34-9	CCC12CC3CC(C1)CC(C3)(C2)C	{1: 2, 2: 1, 11: 6, 12: 2, 13: 2}
OK	1687-36-1	CC12CC3(CC(C1)(CC(C2)(C3)C)C)C	{1: 4, 11: 6, 13: 4}
OK	1687-60-1	C(=O)(C(=O)NO)NO	{24: 2, 20: 2, 31: 2}
OK	16874-33-2	C1CC(OC1)C(=O)O	{27: 1, 11: 3, 12: 1, 23: 1}
OK	16883-48-0	CC1CC(C(C1)C)C	{1: 3, 11: 2, 12: 3}
OK	16887-00-6	[Cl-]	{17: 1}
OK	16888-75-8	CC(=NCCN=C(C)C)C	{1: 4, 2: 2, 34: 2, 7: 2}
OK	16889-19-3	CCCC1C(C(OC(O1)CCC)O)CC	{1: 3, 2: 5, 12: 4, 20: 1, 23: 2}
OK	16890-80-5	C(=O)S	{26: 1, 39: 1}
OK	16890-91-8	C1CC(CCC1Cl)Cl	{17: 2, 11: 4, 12: 2}
OK	16891-99-9	CCCCCCCCCCCC[N+](=O)[O-]	{1: 1, 2: 11, 38: 1}
OK	16895-46-8	CC(=C/C=C/C=C)C	{1: 2, 5: 1, 6: 4, 7: 1}
OK	168979-76-8	CCOC(=O)C(C(C(=O)OCC)O)O	{1: 2, 2: 2, 3: 2, 20: 2, 28: 2}
OK	16898-52-5	C1CNCCC1CCCC2CCNCC2	{32: 2, 2: 3, 11: 8, 12: 2}
OK	16899-10-8	CCCCC(CCCCC(=O)O)O	{27: 1, 1: 1, 2: 7, 3: 1, 20: 1}
OK	1690-75-1	CN1CCC(CC1)C(=O)OC	{1: 2, 11: 4, 12: 1, 28: 1, 33: 1}
OK	16900-07-5	CCCCCCCCSCCCC	{40: 1, 1: 2, 2: 10}
OK	16900-08-6	CCCCCCCCCCCCSCCCC	{40: 1, 1: 2, 2: 14}
OK	16906-27-7	CC1(CC1)C=C	{1: 1, 11: 2, 5: 1, 6: 1, 13: 1}
OK	1691-13-0	C(=CF)F	{16: 2, 6: 2}
OK	1691-17-4	C(OC(F)F)(F)F	{16: 4, 3: 2, 22: 1}
OK	1691-89-0	[C](F)(F)Cl	{16: 2, 17: 1, 7: 1}
OK	1691-90-3	[C](F)(Cl)Cl	{16: 1, 17: 2, 7: 1}
OK	169196-93-4	CCCCC(CC)(CO)CO.C(CCCN=C=O)CCN=C=O	{1: 2, 2: 12, 4: 1, 8: 2, 34: 2, 20: 2, 29: 2}
OK	1692-57-5	CC(C)CC(CN(F)F)N(F)F	{16: 4, 1: 2, 2: 2, 3: 2, 33: 2}
OK	16930-93-1	CCCC(=O)OCC=CC=CC	{1: 2, 2: 3, 28: 1, 6: 4}
OK	16930-95-3	CCCCC#CC(=O)OCC	{1: 2, 2: 4, 28: 1, 10: 2}
OK	16930-96-4	CCCCCCOC(=O)C(=CC)C	{1: 3, 2: 5, 28: 1, 6: 1, 7: 1}
OK	16939-73-4	CCCCC=CCOC(=O)C	{1: 2, 2: 4, 28: 1, 6: 2}
OK	1694-29-7	CC(=O)C(C(=O)C)Cl	{24: 2, 1: 2, 3: 1, 17: 1}
OK	1694-31-1	CC(=O)CC(=O)OC(C)(C)C	{24: 1, 1: 4, 2: 1, 4: 1, 28: 1}
OK	1695-77-8	C[C@@H]1CC(=O)[C@]2([C@@H](O1)O[C@@H]3[C@H]([C@@H]([C@@H]([C@@H]([C@H]3O2)NC)O)NC)O)O	{1: 3, 11: 1, 12: 8, 13: 1, 20: 3, 23: 3, 25: 1, 31: 2}
OK	16955-35-4	C1C2C1(C2)C#N	{11: 2, 12: 1, 13: 1, 37: 1}
OK	16957-70-3	CC/C=C(\C)/C(=O)O	{1: 2, 2: 1, 27: 1, 6: 1, 7: 1}
OK	16958-30-8	C[C@@H]1CC2([C@@H](O2)C)C(=O)O[C@@H]3CCN(C/C=C(\C3=O)/COC(=O)[C@]1(C)OC(=O)C)C	{1: 5, 33: 1, 11: 5, 12: 3, 13: 2, 14: 1, 15: 1, 23: 1, 25: 1, 28: 3}
OK	16958-78-4	CCCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 7, 4: 1, 28: 1, 17: 3}
OK	16958-85-3	CCCCCCCCCCCCCCCC(=O)OCCCCCCCC	{1: 2, 2: 21, 28: 1}
OK	16958-88-6	CCCCCCCCOC(=O)CC(=O)OCCCCCCCC	{1: 2, 2: 15, 28: 2}
OK	16958-99-9	C/C=C\OCC(C)C	{1: 3, 2: 1, 3: 1, 22: 1, 6: 2}
OK	1696-20-4	CC(=O)N1CCOCC1	{24: 1, 1: 1, 11: 4, 33: 1, 23: 1}
OK	1696-60-2	COC1=C/C(=C\NN/C=C/2\C=C(C(=O)C=C2)OC)/C=CC1=O	{1: 2, 6: 2, 14: 6, 15: 4, 22: 2, 25: 2, 31: 2}
OK	16960-39-7	C/C(=N/OC(=O)N)/SC	{1: 2, 34: 1, 7: 1, 40: 1, 28: 1, 30: 1}
OK	16967-79-6	C1(C(O1)(Cl)Cl)Cl	{17: 3, 12: 1, 13: 1, 23: 1}
OK	16969-29-2	CCOC=CCC(C)C	{1: 3, 2: 2, 3: 1, 22: 1, 6: 2}
OK	16969-31-6	CCOC=CC(C)C	{1: 3, 2: 1, 3: 1, 22: 1, 6: 2}
OK	16974-10-0	CCCCCCC=CCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 6: 2}
OK	16978-11-3	CC(=O)C1CC(C1(C)C)CC(=O)OC	{1: 4, 2: 1, 11: 1, 12: 2, 13: 1, 24: 1, 28: 1}
OK	16979-29-6	CCCCCCCCCCOCC	{1: 2, 2: 10, 22: 1}
OK	16980-85-1	CCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 22, 5: 1, 6: 1}
OK	16982-46-0	CCC1=NCCS1	{1: 1, 2: 1, 35: 1, 41: 1, 11: 2, 15: 1}
OK	16984-48-8	[F-]	{16: 1}
OK	16993-86-5	CCCCCC=C(C)C	{1: 3, 2: 4, 6: 1, 7: 1}
OK	16995-35-0	C(C(=O)C(Cl)(Cl)Cl)Cl	{24: 1, 17: 4, 2: 1, 4: 1}
OK	1700-10-3	C1C/C=C\C=C/CC1	{11: 4, 14: 4}
OK	17003-75-7	C(C([N+](=O)[O-])([N+](=O)[O-])F)O	{16: 1, 20: 1, 2: 1, 4: 1, 38: 2}
OK	17003-79-1	C(C([N+](=O)[O-])([N+](=O)[O-])F)OCOCC([N+](=O)[O-])([N+](=O)[O-])F	{16: 2, 2: 3, 4: 2, 38: 4, 22: 2}
OK	17013-37-5	CCC(CC)C1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 3, 2: 3, 3: 1, 13: 1, 25: 3}
OK	17013-41-1	CCCCC1(C(=O)NC(=O)NC1=O)CCCC	{32: 2, 1: 2, 2: 6, 13: 1, 25: 3}
OK	17016-83-0	CC(C)[C@H]1COC(=O)N1	{32: 1, 1: 2, 3: 1, 11: 1, 12: 1, 28: 1}
OK	17016-92-1	CC(CO)N.Cl	{1: 1, 2: 1, 3: 1, 17: 1, 20: 1, 30: 1}
OK	17018-07-4	C=CCOCC(COCC=C)O	{2: 4, 3: 1, 5: 2, 6: 2, 20: 1, 22: 2}
OK	17021-26-0	C[C@H]1CC2=CC(=O)CC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@]([C@]4(CC3)C)(C)O)C	{1: 4, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 1, 25: 1}
OK	1703-18-0	CON1C=CC(=O)C=C1	{1: 1, 33: 1, 22: 1, 14: 4, 25: 1}
OK	1703-58-8	C(C(C(CC(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 2: 2, 3: 2}
OK	17030-76-1	C[CH]OC	{1: 2, 22: 1, 6: 1}
OK	17032-46-1	[CH2]S	{5: 1, 39: 1}
OK	1704-62-7	CN(C)CCOCCO	{1: 2, 2: 4, 20: 1, 22: 1, 33: 1}
OK	17042-16-9	CCC(C)C(=O)CC	{24: 1, 1: 3, 2: 2, 3: 1}
OK	17043-10-6	CCCCCCCCC=CCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCC=CCCCCCCCC	{40: 1, 1: 2, 2: 34, 28: 2, 6: 4}
OK	17043-94-6	C1=CN=C[N+](=C1)[O-]	{33: 1, 35: 1, 29: 1, 14: 4}
OK	17046-22-9	CCCCOC(=O)CN=C=O	{1: 1, 2: 4, 8: 1, 34: 1, 28: 1, 29: 1}
OK	17046-24-1	CCOC(=O)CC(C(=O)OCC)N=C=O	{1: 2, 2: 3, 3: 1, 8: 1, 34: 1, 28: 2, 29: 1}
OK	17048-59-8	C1CC23CC=CCC2(C1)C3	{11: 6, 13: 2, 14: 2}
OK	17049-74-0	CC(C)(C)OC(=O)NC(C(F)(F)F)O	{1: 3, 3: 1, 4: 2, 16: 3, 20: 1, 28: 1, 31: 1}
OK	1705-60-8	CC(C)(C)OOC1(CCC(CC1)C(C)(C)C2CCC(CC2)(OOC(C)(C)C)OOC(C)(C)C)OOC(C)(C)C	{1: 14, 4: 5, 11: 8, 12: 2, 13: 2, 22: 8}
OK	1706-50-9	C1CCC(CC1)C2CCCC(C2)C3CCCCC3	{11: 14, 12: 4}
OK	170617-34-2	CCCCOCOCCCC.C1CCOCOC1	{1: 2, 2: 7, 11: 5, 22: 2, 23: 2}
OK	17066-32-9	CC1(C(S1)(C)C)C	{1: 4, 13: 2, 41: 1}
OK	17066-67-0	CC(=C)[C@H]1CC[C@@]2(CCCC(=C)[C@H]2C1)C	{1: 2, 5: 2, 7: 1, 11: 6, 12: 2, 13: 1, 15: 1}
OK	1707-77-3	CC1(OC[C@@H](O1)[C@H]([C@@H]([C@H]2COC(O2)(C)C)O)O)C	{1: 4, 3: 2, 11: 2, 12: 2, 13: 2, 20: 2, 23: 4}
OK	17071-47-5	CCCCOCC(C)C	{1: 3, 2: 4, 3: 1, 22: 1}
OK	17071-54-4	CCCCCCCCOCCCCCC	{1: 2, 2: 12, 22: 1}
OK	1708-29-8	C1C=CCO1	{11: 2, 14: 2, 23: 1}
OK	1708-32-3	C1C=CCS1	{41: 1, 11: 2, 14: 2}
OK	1708-34-5	CCCCCCC1OCCO1	{1: 1, 2: 5, 11: 2, 12: 1, 23: 2}
OK	1708-35-6	CCCCCCC1OCC(O1)CO	{1: 1, 2: 6, 11: 1, 12: 2, 20: 1, 23: 2}
OK	1708-81-2	CCCC=CCCO	{1: 1, 2: 4, 20: 1, 6: 2}
OK	17081-21-9	COCCCOC	{1: 2, 2: 3, 22: 2}
OK	17081-40-2	CCCCCCCCC=CCCCCCCCCNCCCNC(=O)CCCCCCCC=CCCCCCCCC	{24: 1, 1: 2, 2: 32, 6: 4, 31: 2}
OK	17085-84-6	C=CC1(CC1)C=C	{11: 2, 5: 2, 6: 2, 13: 1}
OK	17085-96-0	CCCCCCCC(CC)CC	{1: 3, 2: 8, 3: 1}
OK	17088-73-2	C(O)OOCO	{2: 2, 20: 2, 22: 2}
OK	170899-08-8	CC(C)(C)OC(=O)N[C@H](CC=C)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 5: 1, 6: 1, 27: 1, 28: 1, 31: 1}
OK	1709-03-1	COCCCNC(=O)CCl	{1: 1, 2: 4, 17: 1, 22: 1, 24: 1, 31: 1}
OK	17090-79-8	CC[C@]1(CC[C@@H](O1)[C@]2(CC[C@@]3(O2)C[C@@H]([C@H]([C@H](O3)[C@H](C)[C@@H]([C@@H](C)C(=O)O)OC)C)O)C)[C@@H]4[C@@H](C[C@H](O4)[C@@H]5[C@H](C[C@H]([C@@](O5)(CO)O)C)C)C	{1: 9, 2: 2, 3: 3, 11: 7, 12: 10, 13: 4, 20: 3, 22: 1, 23: 5, 27: 1}
OK	17091-40-6	CC(C)CNCCO	{1: 2, 2: 3, 3: 1, 20: 1, 31: 1}
OK	17091-93-9	CC12C=CC=CC1O2	{1: 1, 12: 1, 13: 1, 14: 4, 23: 1}
OK	17092-92-1	CC1(CCCC2(C1=CC(=O)O2)C)C	{1: 3, 11: 3, 13: 2, 14: 1, 15: 1, 28: 1}
OK	17094-21-2	CC(C(=O)C)C(=O)OC	{24: 1, 1: 3, 3: 1, 28: 1}
OK	17094-34-7	CCOC(=O)CC(=O)C(C)(C)C	{24: 1, 1: 4, 2: 2, 4: 1, 28: 1}
OK	17096-37-6	C(=C(C(=O)Cl)Cl)C(=O)Cl	{24: 2, 17: 3, 6: 1, 7: 1}
OK	17102-64-6	C/C=C/C=C/CO	{1: 1, 2: 1, 20: 1, 6: 4}
OK	17105-75-8	CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C	{1: 6, 2: 2, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	171056-23-8	CCCCCOC(=O)[C@H](C)O	{1: 2, 2: 4, 3: 1, 20: 1, 28: 1}
OK	17121-34-5	CC(CN(CCN(CC(C)O)CC(C)O)CCN(CC(C)O)CC(C)O)O	{1: 5, 2: 9, 3: 5, 20: 5, 33: 3}
OK	17123-60-3	CC(=C)C(CC=C)O	{1: 1, 2: 1, 3: 1, 5: 2, 6: 1, 7: 1, 20: 1}
OK	17123-61-4	CC(=C)CC(C=C)O	{1: 1, 2: 1, 3: 1, 5: 2, 6: 1, 7: 1, 20: 1}
OK	17125-65-4	C(N(F)F)(N(F)F)(N(F)F)N(F)F	{16: 8, 33: 4, 4: 1}
OK	17125-67-6	C(N(C(N(F)F)(F)F)F)(N(F)F)(N(F)F)N(F)F	{16: 11, 33: 5, 4: 2}
OK	1713-85-5	C(C(C(=O)O)O)Cl	{27: 1, 17: 1, 2: 1, 3: 1, 20: 1}
OK	1714-38-1	COC1C=CC=CC=C1	{1: 1, 12: 1, 22: 1, 14: 6}
OK	171485-90-8	CCCCCCCCC/C=C/CC(CC(=O)O)C(=O)OCC(COC(=O)CC(C/C=C/CCCCCCCCC)C(=O)O)OC(=O)CC(C/C=C/CCCCCCCCC)C(=O)O	{1: 3, 2: 32, 3: 4, 6: 6, 27: 3, 28: 3}
OK	1715-30-6	CCCCC(CC)CN=C(N)NC(=NCCCCCCN=C(N)NC(=NCC(CC)CCCC)N)N.Cl.Cl	{1: 4, 2: 16, 3: 2, 7: 4, 34: 4, 17: 2, 30: 4, 31: 2}
OK	1715-40-8	C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)CBr	{2: 1, 11: 1, 12: 1, 13: 3, 15: 2, 17: 6, 18: 1}
OK	17155-65-6	CCCC(C)C1OCCO1	{1: 2, 2: 2, 3: 1, 11: 2, 12: 1, 23: 2}
OK	17157-48-1	C(C=O)Br	{2: 1, 26: 1, 18: 1}
OK	17158-54-2	CCCCCCCCCCCCCCCC=CC1=NCCN1CCO	{1: 1, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 20: 1}
OK	17159-79-4	CCOC(=O)C1CCC(=O)CC1	{1: 1, 2: 1, 11: 4, 12: 1, 25: 1, 28: 1}
OK	17159-80-7	CCOC(=O)C1CCC(CC1)O	{1: 1, 2: 1, 11: 4, 12: 2, 20: 1, 28: 1}
OK	17162-29-7	CC1CCC(C(C1)OC(=O)C(C)O)C(C)C	{1: 4, 3: 2, 11: 3, 12: 3, 20: 1, 28: 1}
OK	17167-73-6	CC=NNC	{1: 2, 34: 1, 6: 1, 31: 1}
OK	1717-00-6	CC(F)(Cl)Cl	{16: 1, 1: 1, 4: 1, 17: 2}
OK	17173-86-3	C(CCl)N(CCCl)N=S=O	{33: 1, 2: 4, 40: 1, 34: 1, 17: 2, 29: 1}
OK	17177-50-3	C1C(O1)C(CO)O	{2: 1, 3: 1, 11: 1, 12: 1, 20: 2, 23: 1}
OK	17177-75-2	CC(C)(C)C1CCC(CC1)C(=O)OC	{1: 4, 11: 4, 4: 1, 12: 2, 28: 1}
OK	17190-74-8	CC=CCC1=C(C(CC1=O)O)C	{1: 2, 2: 1, 6: 2, 11: 1, 12: 1, 15: 2, 20: 1, 25: 1}
OK	17190-90-8	COC1=CC2CCC1C2	{1: 1, 11: 3, 12: 2, 14: 1, 15: 1, 22: 1}
OK	17190-92-0	COC1CC2CC1C=C2	{1: 1, 11: 2, 12: 3, 22: 1, 14: 2}
OK	17197-62-5	CC(C)C1(C(=O)NC1=O)C(C)C	{32: 1, 1: 4, 3: 2, 13: 1, 25: 2}
OK	1720-11-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 29, 3: 1}
OK	1720-38-3	C#CCCCCCCC#C	{9: 2, 2: 6, 10: 2}
OK	17200-00-9	CCCCCCCC/C=C\CCCCCCCC(=O)O.CCNCC	{1: 3, 2: 16, 27: 1, 6: 2, 31: 1}
OK	17209-72-2	C(CN(CCO)CCO)C#N	{33: 1, 2: 6, 20: 2, 37: 1}
OK	17216-62-5	CCOC(=O)C(CCC#N)C(=O)OCC	{1: 2, 2: 4, 3: 1, 28: 2, 37: 1}
OK	17224-09-8	C1(N(N1F)F)(F)F	{16: 4, 33: 2, 13: 1}
OK	17227-17-7	CC1CC(OC(O1)(C)C)C	{1: 4, 11: 1, 12: 2, 13: 1, 23: 2}
OK	1723-00-8	C1CCN[C@H](C1)C(=O)O	{27: 1, 32: 1, 11: 4, 12: 1}
OK	1723-94-0	C1COCCN1CCN2CCOCC2	{33: 2, 2: 2, 11: 8, 23: 2}
OK	172376-82-8	CC(CC/C=C(/C)\CCC=C(C)C)CC=O	{1: 4, 2: 5, 3: 1, 6: 2, 7: 2, 26: 1}
OK	1724-39-6	C1CCCCCC(CCCCC1)O	{20: 1, 11: 11, 12: 1}
OK	17247-58-4	C1CC(C1)CBr	{2: 1, 11: 3, 12: 1, 18: 1}
OK	1725-01-5	C1CCCCOCCCCCCOC(=O)CCC1	{11: 14, 28: 1, 23: 1}
OK	1725-03-7	C1CCCCCOC(=O)CCCC1	{11: 10, 28: 1}
OK	1725-04-8	C1CCCCCCOC(=O)CCCCC1	{11: 12, 28: 1}
OK	1725-16-2	C1CCCCSCCCCOC(=O)CCC1	{41: 1, 11: 12, 28: 1}
OK	1725-74-2	C(C(/C(=C(/C(CCl)Cl)\Cl)/Cl)Cl)Cl	{17: 6, 2: 2, 3: 2, 7: 2}
OK	1725-82-2	C(C#CI)O	{2: 1, 19: 1, 20: 1, 10: 2}
OK	17256-39-2	CC(CCl)N(C)C.Cl	{1: 3, 2: 1, 3: 1, 33: 1, 17: 2}
OK	17256-52-9	C1(=C(F)F)OC(C(O1)(F)F)(C(F)(F)F)F	{4: 1, 7: 1, 13: 2, 15: 1, 16: 8, 23: 2}
OK	17256-78-9	NO.F	{16: 1, 20: 1, 30: 1}
OK	1726-08-5	CN(C)C=O.C(C(=O)O)Cl	{33: 1, 2: 1, 1: 2, 17: 1, 26: 1, 27: 1}
OK	17264-01-6	CC(C1CCCC=C1)O	{1: 1, 3: 1, 11: 3, 12: 1, 14: 2, 20: 1}
OK	17264-02-7	CCC(C1CCCCC1)O	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 20: 1}
OK	17268-47-2	CN(C)CCC(=O)N(C)C	{24: 1, 1: 4, 2: 2, 33: 2}
OK	17277-57-5	CCCCSCC#C	{40: 1, 1: 1, 2: 4, 10: 1, 9: 1}
OK	1728-25-2	C1CCC=CC(=O)CC1	{25: 1, 11: 5, 14: 2}
OK	1728-38-7	CC1=C(CCCC1)OC	{1: 2, 11: 4, 22: 1, 15: 2}
OK	1728-46-7	CC(C)(C)C1CCCCC1=O	{1: 3, 11: 4, 4: 1, 12: 1, 25: 1}
OK	17283-81-7	CC1=C(C(CCC1)(C)C)CCC(=O)C	{1: 4, 2: 2, 11: 3, 13: 1, 15: 2, 24: 1}
OK	172843-97-9	CC(C)(C)OC(=O)NC1(CCOCC1)C(=O)O	{1: 3, 4: 1, 11: 4, 13: 1, 23: 1, 27: 1, 28: 1, 31: 1}
OK	1729-67-5	COC(=O)C(CBr)Br	{1: 1, 2: 1, 3: 1, 28: 1, 18: 2}
OK	17290-00-5	CC(=O)OC1CC2CCC1C2OC(=O)C	{1: 2, 11: 3, 12: 4, 28: 2}
OK	17299-07-9	C[C@H](CC[C@@H](C)O)O	{1: 2, 2: 2, 3: 2, 20: 2}
OK	17299-41-1	CC1=CC(=O)CCC1(C)C	{1: 3, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	17301-22-3	CCCCCCC(C)CCC(C)C	{1: 4, 2: 7, 3: 2}
OK	17301-23-4	CCCCCC(C)CCCC(C)C	{1: 4, 2: 7, 3: 2}
OK	17301-24-5	CCCCC(C)CCCCC(C)C	{1: 4, 2: 7, 3: 2}
OK	17301-25-6	CCCC(C)CCCCCC(C)C	{1: 4, 2: 7, 3: 2}
OK	17301-26-7	CCC(C)CCCCCCC(C)C	{1: 4, 2: 7, 3: 2}
OK	17301-28-9	CCCCCC(C)CCC(C)CC	{1: 4, 2: 7, 3: 2}
OK	17301-29-0	CCCCC(C)CCCC(C)CC	{1: 4, 2: 7, 3: 2}
OK	17301-30-3	CCCC(C)CCCCC(C)CC	{1: 4, 2: 7, 3: 2}
OK	17301-31-4	CCC(C)CCCCCC(C)CC	{1: 4, 2: 7, 3: 2}
OK	17301-32-5	CCCCC(C)CCC(C)CCC	{1: 4, 2: 7, 3: 2}
OK	17301-33-6	CCCC(C)CCCC(C)CCC	{1: 4, 2: 7, 3: 2}
OK	17301-94-9	CCCCCC(C)CCC	{1: 3, 2: 6, 3: 1}
OK	17302-01-1	CCCCC(C)(CC)CC	{1: 4, 2: 5, 4: 1}
OK	17302-02-2	CCCC(CC)(CC)CC	{1: 4, 2: 5, 4: 1}
OK	17302-04-4	CCCC(C)(CC)CCC	{1: 4, 2: 5, 4: 1}
OK	17302-11-3	CCCCCCC(CC)CC	{1: 3, 2: 7, 3: 1}
OK	17302-12-4	CCCCC(CC)CCCC	{1: 3, 2: 7, 3: 1}
OK	17302-13-5	CCCCC(CCC)CCC	{1: 3, 2: 7, 3: 1}
OK	17302-14-6	CCCCCCCC(C)(C)C	{1: 4, 2: 6, 4: 1}
OK	17302-15-7	CCCCCCC(C)(C)CC	{1: 4, 2: 6, 4: 1}
OK	17302-16-8	CCCCCC(C)(CC)CC	{1: 4, 2: 6, 4: 1}
OK	17302-17-9	CCCCC(CC)(CC)CC	{1: 4, 2: 6, 4: 1}
OK	17302-18-0	CCCCCC(C)(C)CCC	{1: 4, 2: 6, 4: 1}
OK	17302-19-1	CCCCC(C)(CC)CCC	{1: 4, 2: 6, 4: 1}
OK	17302-20-4	CCCC(C)(CCC)CCC	{1: 4, 2: 6, 4: 1}
OK	17302-21-5	CCCC(CC)(CC)CCC	{1: 4, 2: 6, 4: 1}
OK	17302-22-6	CCCCCC(C)C(C)CC	{1: 4, 2: 5, 3: 2}
OK	17302-23-7	CCCCC(C)C(C)CCC	{1: 4, 2: 5, 3: 2}
OK	17302-24-8	CCCCCC(C)CC(C)C	{1: 4, 2: 5, 3: 2}
OK	17302-25-9	CCCCC(C)CC(C)CC	{1: 4, 2: 5, 3: 2}
OK	17302-26-0	CCCC(C)CC(C)CCC	{1: 4, 2: 5, 3: 2}
OK	17302-27-1	CCCCC(C)CCC(C)C	{1: 4, 2: 5, 3: 2}
OK	17302-28-2	CCCC(C)CCCC(C)C	{1: 4, 2: 5, 3: 2}
OK	17302-29-3	CCC(C)CCCCC(C)C	{1: 4, 2: 5, 3: 2}
OK	17302-30-6	CC(C)CCCCCC(C)C	{1: 4, 2: 5, 3: 2}
OK	17302-31-7	CCCC(C)CCC(C)CC	{1: 4, 2: 5, 3: 2}
OK	17302-32-8	CCC(C)CCCC(C)CC	{1: 4, 2: 5, 3: 2}
OK	17302-33-9	CCCCCC(C)CCCCC	{1: 3, 2: 8, 3: 1}
OK	17302-37-3	CCCCCCCCC(C)(C)C	{1: 4, 2: 7, 4: 1}
OK	17302-38-4	CCCCCCCC(C)(C)CC	{1: 4, 2: 7, 4: 1}
OK	17302-39-5	CCCCCCC(C)(CC)CC	{1: 4, 2: 7, 4: 1}
OK	17302-40-8	CCCCCC(CC)(CC)CC	{1: 4, 2: 7, 4: 1}
OK	1731-79-9	COC(=O)CCCCCCCCCCC(=O)OC	{1: 2, 2: 10, 28: 2}
OK	1731-81-3	CCCCCCCCCCCOC(=O)C	{1: 2, 2: 10, 28: 1}
OK	1731-84-6	CCCCCCCCC(=O)OC	{1: 2, 2: 7, 28: 1}
OK	1731-86-8	CCCCCCCCCCC(=O)OC	{1: 2, 2: 9, 28: 1}
OK	1731-88-0	CCCCCCCCCCCCC(=O)OC	{1: 2, 2: 11, 28: 1}
OK	1731-92-6	CCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 15, 28: 1}
OK	1731-94-8	CCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 17, 28: 1}
OK	17312-39-9	CCCCCCC(C)(C)CCC	{1: 4, 2: 7, 4: 1}
OK	17312-40-2	CCCCCC(C)(CC)CCC	{1: 4, 2: 7, 4: 1}
OK	17312-41-3	CCCCC(C)(CCC)CCC	{1: 4, 2: 7, 4: 1}
OK	17312-42-4	CCCCC(CC)(CC)CCC	{1: 4, 2: 7, 4: 1}
OK	17312-44-6	CCCCCCCC(C)C(C)C	{1: 4, 2: 6, 3: 2}
OK	17312-45-7	CCCCCCC(C)C(C)CC	{1: 4, 2: 6, 3: 2}
OK	17312-46-8	CCCCCC(C)C(C)CCC	{1: 4, 2: 6, 3: 2}
OK	17312-48-0	CCCCCC(C)CC(C)CC	{1: 4, 2: 6, 3: 2}
OK	17312-49-1	CCCCC(C)CC(C)CCC	{1: 4, 2: 6, 3: 2}
OK	17312-50-4	CCCCCC(C)CCC(C)C	{1: 4, 2: 6, 3: 2}
OK	17312-51-5	CCCC(C)CCCCC(C)C	{1: 4, 2: 6, 3: 2}
OK	17312-52-6	CCC(C)CCCCCC(C)C	{1: 4, 2: 6, 3: 2}
OK	17312-53-7	CCCCC(C)CCC(C)CC	{1: 4, 2: 6, 3: 2}
OK	17312-54-8	CCCC(C)CCCC(C)CC	{1: 4, 2: 6, 3: 2}
OK	17312-55-9	CCC(C)CCCCC(C)CC	{1: 4, 2: 6, 3: 2}
OK	17312-56-0	CCCC(C)CCC(C)CCC	{1: 4, 2: 6, 3: 2}
OK	17312-57-1	CCCCCCCCCC(C)CC	{1: 3, 2: 9, 3: 1}
OK	17312-58-2	CCCCCCCCC(CC)CC	{1: 3, 2: 9, 3: 1}
OK	17312-61-7	CCCCCCC(CCC)CCC	{1: 3, 2: 9, 3: 1}
OK	17312-62-8	CCCCCC(CCC)CCCC	{1: 3, 2: 9, 3: 1}
OK	17312-63-9	CCCCC(CCCC)CCCC	{1: 3, 2: 9, 3: 1}
OK	17312-64-0	CCCCCCCCCC(C)(C)C	{1: 4, 2: 8, 4: 1}
OK	17312-65-1	CCCCCCCCC(C)(C)CC	{1: 4, 2: 8, 4: 1}
OK	17312-68-4	CCCCCCCC(C)(C)CCC	{1: 4, 2: 8, 4: 1}
OK	17312-72-0	CCCC(CCC)(CCC)CCC	{1: 4, 2: 8, 4: 1}
OK	17312-73-1	CCCCCCC(C)(C)CCCC	{1: 4, 2: 8, 4: 1}
OK	17312-76-4	CCCCCC(C)(C)CCCCC	{1: 4, 2: 8, 4: 1}
OK	17312-77-5	CCCCCCCCC(C)C(C)C	{1: 4, 2: 7, 3: 2}
OK	17312-78-6	CCCCCCCC(C)C(C)CC	{1: 4, 2: 7, 3: 2}
OK	17312-79-7	CCCCCCC(C)C(C)CCC	{1: 4, 2: 7, 3: 2}
OK	17312-80-0	CCCCCCCC(C)CC(C)C	{1: 4, 2: 7, 3: 2}
OK	17312-81-1	CCCCCCC(C)CC(C)CC	{1: 4, 2: 7, 3: 2}
OK	17312-82-2	CCCCCC(C)CC(C)CCC	{1: 4, 2: 7, 3: 2}
OK	17312-83-3	CCCCC(C)CC(C)CCCC	{1: 4, 2: 7, 3: 2}
OK	1732-00-9	CCCC=CCCC(=O)OC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	1732-08-7	COC(=O)CCCCCC(=O)OC	{1: 2, 2: 5, 28: 2}
OK	1732-09-8	COC(=O)CCCCCCC(=O)OC	{1: 2, 2: 6, 28: 2}
OK	1732-10-1	COC(=O)CCCCCCCC(=O)OC	{1: 2, 2: 7, 28: 2}
OK	17325-90-5	CCC(=O)C(=C(C)C)C	{24: 1, 1: 4, 2: 1, 7: 2}
OK	17327-22-9	COC1=CCOCC1	{1: 1, 11: 3, 14: 1, 15: 1, 22: 1, 23: 1}
OK	17329-61-2	CCCCCCCCCCCCCCCCCC(=O)OCCN(CCO)CCO.CC(=O)O	{1: 2, 2: 22, 33: 1, 20: 2, 27: 1, 28: 1}
OK	1733-16-0	COC(=O)CCC(C(=O)OC)C(=O)OC	{1: 3, 2: 2, 3: 1, 28: 3}
OK	17334-55-3	CC1CCC=C2C1(C3C(C3(C)C)CC2)C	{1: 4, 11: 4, 12: 3, 13: 2, 14: 1, 15: 1}
OK	17336-84-4	CC(C=CN(C)C)N(C)C	{1: 5, 3: 1, 6: 2, 33: 2}
OK	17337-12-1	CCCCCC(F)(F)F	{16: 3, 1: 1, 2: 4, 4: 1}
OK	17339-60-5	CN(C)CCSSCCN(C)C.Cl.Cl	{40: 2, 1: 4, 2: 4, 33: 2, 17: 2}
OK	17341-93-4	C(C(Cl)(Cl)Cl)OC(=O)Cl	{17: 4, 2: 1, 4: 1, 28: 1}
OK	17342-08-4	C1CC(=O)N[C@@H]1CO	{32: 1, 2: 1, 11: 2, 12: 1, 20: 1, 25: 1}
OK	17346-16-6	CC(C)(C(=O)C(C)(C)Br)Br	{24: 1, 1: 4, 18: 2, 4: 2}
OK	17348-59-3	CC(C)OC(C)(C)C	{1: 5, 3: 1, 4: 1, 22: 1}
OK	17351-28-9	CC1=C(CC=CC1)C	{1: 2, 11: 2, 14: 2, 15: 2}
OK	17352-32-8	CCCCCCCCCCCCCCCCCCC=O	{1: 1, 2: 17, 26: 1}
OK	17355-83-8	CC(C)COC(=O)C(F)(F)F	{1: 2, 2: 1, 3: 1, 4: 1, 16: 3, 28: 1}
OK	17356-19-3	C#CC1(CCCC1)O	{9: 1, 10: 1, 11: 4, 20: 1, 13: 1}
OK	17360-35-9	C1CCN(C1)CC#CCN2CCCC2=O.C1CCN(C1)CC#CCN2CCCC2=O.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O	{33: 4, 2: 4, 6: 6, 10: 4, 11: 14, 25: 2, 27: 6}
OK	17361-44-3	CCCCCCCCCCCCCCNCCCCCCCCCCCCCC	{1: 2, 2: 26, 31: 1}
OK	1737-80-0	C(C(F)(F)F)(C(F)(F)F)(N)N	{16: 6, 4: 3, 30: 2}
OK	17373-27-2	CCCCCCCCCN(C)C	{1: 3, 2: 8, 33: 1}
OK	17373-28-3	CCCCCCCCCCCN(C)C	{1: 3, 2: 10, 33: 1}
OK	17373-29-4	CCCCCCCCCCCCCN(C)C	{1: 3, 2: 12, 33: 1}
OK	1738-25-6	CN(C)CCC#N	{1: 2, 2: 2, 37: 1, 33: 1}
OK	1738-36-9	COCC#N	{1: 1, 2: 1, 37: 1, 22: 1}
OK	17392-83-5	C[C@H](C(=O)OC)O	{1: 2, 3: 1, 20: 1, 28: 1}
OK	17397-89-6	C/C=C/C/C=C/CCC(=O)[C@@H]1[C@@H](O1)C(=O)N	{1: 1, 2: 3, 6: 4, 12: 2, 23: 1, 24: 2, 30: 1}
OK	174-73-2	C1CC2CC23C1C3	{11: 4, 12: 2, 13: 1}
OK	17406-45-0	CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)C)C)C)NC1	{32: 1, 1: 4, 2: 3, 11: 12, 12: 28, 13: 3, 20: 12, 22: 4, 23: 5}
OK	17409-41-5	C(CO)N(CCO)C(=O)CO	{24: 1, 33: 1, 2: 5, 20: 3}
OK	1741-01-1	CNN(C)C	{1: 3, 33: 1, 31: 1}
OK	1741-41-9	CCOC(C(C)C)OCC	{1: 4, 2: 2, 3: 2, 22: 2}
OK	1741-83-9	CCCCCSC	{40: 1, 1: 2, 2: 4}
OK	1741-84-0	CCCSCC(C)C	{40: 1, 1: 3, 2: 3, 3: 1}
OK	17414-27-6	CC/C=C/SC	{40: 1, 1: 2, 2: 1, 6: 2}
OK	17415-51-9	C1CC(=O)NC1.C1N(CN(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{32: 1, 25: 1, 11: 7, 38: 4, 33: 4}
OK	17417-00-4	CC(C)C(C(=O)OC)O	{1: 3, 3: 2, 20: 1, 28: 1}
OK	17425-25-1	CC(C(C(F)F)(F)F)O	{16: 4, 1: 1, 3: 2, 4: 1, 20: 1}
OK	1743-13-1	C1NNCN2N1CNNC2	{32: 4, 33: 2, 11: 4}
OK	1743-34-6	C/C=C/C=C/C=C/C#C	{1: 1, 10: 1, 6: 6, 9: 1}
OK	1743-61-9	CC1=CCC(CC1)(C)C=C	{1: 2, 5: 1, 6: 1, 11: 3, 13: 1, 14: 1, 15: 1}
OK	17430-98-7	C[C@@H](C1CCCCC1)N	{11: 5, 1: 1, 3: 1, 12: 1, 30: 1}
OK	17431-55-9	CCC[C@@H]1C[C@H](N(C1)C)C(=O)N[C@@H]([C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)SC)O)O)O)[C@@H](C)Cl.Cl	{1: 4, 2: 2, 3: 2, 33: 1, 40: 1, 11: 2, 12: 7, 17: 2, 20: 3, 23: 1, 24: 1, 31: 1}
OK	17435-72-2	CCOC(=O)C(=C)CBr	{1: 1, 2: 2, 5: 1, 7: 1, 18: 1, 28: 1}
OK	17438-89-0	CCCCCCCCCCC(C)CCCCCCCC	{1: 3, 2: 16, 3: 1}
OK	1744-71-4	CCCCNNCCCC	{1: 2, 2: 6, 31: 2}
OK	17453-92-8	CCCCCC(C)(C)CCCC	{1: 4, 2: 7, 4: 1}
OK	17453-93-9	CCCCCCCC(C)CCCC	{1: 3, 2: 9, 3: 1}
OK	17454-42-1	C1CC[C@H]2[C@H](C1)OCCOCCOCCO2	{11: 10, 12: 2, 23: 4}
OK	17454-48-7	C1CCC2C(C1)OCCOCCOCCOCCO2	{11: 12, 12: 2, 23: 5}
OK	17454-53-4	C1CCC2C(C1)OCCOCCOCCOCCOCCO2	{11: 14, 12: 2, 23: 6}
OK	17455-13-9	C1COCCOCCOCCOCCOCCO1	{11: 12, 23: 6}
OK	17455-23-1	C1CCC2C(C1)OCCOCCOCCOC3CCCCC3OCCOCCOCCO2	{11: 20, 12: 4, 23: 8}
OK	1746-77-6	CC(C)OC(=O)N	{1: 2, 3: 1, 28: 1, 30: 1}
OK	17462-58-7	CCC(C)OC(=O)Cl	{1: 2, 2: 1, 3: 1, 28: 1, 17: 1}
OK	17463-01-3	CCCCCCC=CC(=O)OCC	{1: 2, 2: 6, 28: 1, 6: 2}
OK	17464-88-9	COCN1C2C(N(C1=O)COC)N(C(=O)N2COC)COC	{1: 4, 2: 4, 33: 4, 12: 2, 22: 4, 25: 2}
OK	17465-86-0	C(C1C2C(C(C(O1)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(C(C7O)O)OC8C(OC(C(C8O)O)OC9C(OC(O2)C(C9O)O)CO)CO)CO)CO)CO)CO)CO)O)O)O	{20: 24, 2: 8, 12: 40, 23: 16}
OK	17471-59-9	CN(C)CC=CN(C)C	{1: 4, 2: 1, 6: 2, 33: 2}
OK	17472-04-7	CC(=O)OC1CCCCC1=O	{1: 1, 11: 4, 12: 1, 28: 1, 25: 1}
OK	17481-19-5	C(CS)CCl	{17: 1, 2: 3, 39: 1}
OK	17489-40-6	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@H](C2)CC[C@@H]4[C@@H]3[C@H](C[C@]5(C4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)C)O)O)O	{1: 3, 11: 9, 12: 11, 13: 3, 14: 1, 15: 1, 20: 5, 22: 1, 23: 1, 28: 1}
OK	17497-53-9	C1CCC(=CC1)I	{19: 1, 11: 4, 14: 1, 15: 1}
OK	175-56-4	C1CCC2(C1)CCC2	{11: 7, 13: 1}
OK	1750-51-2	CC1CCC2C(CCCC2C1)C	{1: 2, 11: 6, 12: 4}
OK	17511-60-3	CCC(=O)OC1CC2CC1C3C2C=CC3	{1: 1, 2: 1, 11: 3, 12: 5, 14: 2, 28: 1}
OK	17526-74-8	CCCCCC(=O)OCC1CO1	{1: 1, 2: 5, 11: 1, 12: 1, 23: 1, 28: 1}
OK	17527-28-5	C1CC(CC=C1)C=CC2CCC=CC2	{11: 6, 12: 2, 14: 4, 6: 2}
OK	17527-29-6	C=CC(=O)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 6, 5: 1, 6: 1, 16: 13, 28: 1}
OK	17527-31-0	C=CC(=O)OCCC(C(F)(F)F)(F)F	{2: 2, 4: 2, 5: 1, 6: 1, 16: 5, 28: 1}
OK	17530-24-4	CC(C)(C)C#CC(C)(C)C	{1: 6, 10: 2, 4: 2}
OK	17530-61-9	C1CC2CCC=C(C1)C2	{11: 6, 12: 1, 14: 1, 15: 1}
OK	17530-69-7	CC1(CC(=CC(=O)C1)Cl)C	{1: 2, 11: 2, 13: 1, 14: 1, 15: 1, 17: 1, 25: 1}
OK	175385-79-2	CCCCOC(=O)C[C@@H](C(=O)OCCCC)NCCCCCCN[C@@H](CC(=O)OCCCC)C(=O)OCCCC	{1: 4, 2: 20, 3: 2, 28: 4, 31: 2}
OK	1754-57-0	CN(C)CCNN	{1: 2, 2: 2, 33: 1, 30: 1, 31: 1}
OK	17547-68-1	C1CC2C=CC1C(=O)C2=O	{25: 2, 11: 2, 12: 2, 14: 2}
OK	1755-15-3	CC(=O)C1C(=O)CC(CC1=O)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 24: 1, 25: 2}
OK	17557-23-2	CC(C)(COCC1CO1)COCC2CO2	{1: 2, 2: 4, 4: 1, 11: 2, 12: 2, 22: 2, 23: 2}
OK	17557-41-4	C1COC(C1(Cl)Cl)Cl	{17: 3, 11: 2, 12: 1, 13: 1, 23: 1}
OK	1757-42-2	CC1CCC(=O)C1	{1: 1, 11: 3, 12: 1, 25: 1}
OK	17575-20-1	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)O)O[C@H]7C[C@@H]([C@@H]([C@H](O7)C)O[C@H]8C[C@@H]([C@@H](C(O8)C)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)OC(=O)C)O	{1: 6, 2: 1, 11: 13, 12: 22, 13: 3, 14: 1, 15: 1, 20: 7, 22: 4, 23: 4, 28: 2}
OK	17575-21-2	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)O)O)C)C)O)O[C@H]7C[C@@H]([C@@H]([C@H](O7)C)O[C@H]8C[C@@H]([C@@H]([C@H](O8)C)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)OC(=O)C)O	{1: 6, 2: 1, 11: 12, 12: 23, 13: 3, 14: 1, 15: 1, 20: 8, 22: 4, 23: 4, 28: 2}
OK	17575-22-3	CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CC(C5(C4(CCC5C6=CC(=O)OC6)O)C)O)C)O)OC7CC(C(C(O7)C)OC8CC(C(C(O8)C)OC9C(C(C(C(O9)CO)O)O)O)OC(=O)C)O	{1: 6, 2: 1, 11: 12, 12: 23, 13: 3, 14: 1, 15: 1, 20: 8, 22: 4, 23: 4, 28: 2}
OK	17576-35-1	COC=CC(OC)OC	{1: 3, 3: 1, 22: 3, 6: 2}
OK	1758-33-4	C[C@@H]1[C@@H](O1)C	{1: 2, 12: 2, 23: 1}
OK	1758-51-6	C([C@H]([C@H](C=O)O)O)O	{2: 1, 3: 2, 20: 3, 26: 1}
OK	1758-74-3	CC(C(=O)O)N=C(N)N	{1: 1, 34: 1, 3: 1, 7: 1, 27: 1, 30: 2}
OK	17587-22-3	CC(C)(C)C(=O)CC(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 1: 3, 2: 1, 4: 4, 24: 2}
OK	1759-53-1	C1CC1C(=O)O	{27: 1, 11: 2, 12: 1}
OK	1759-58-6	C[C@@H]1CC[C@H](C1)C	{1: 2, 11: 3, 12: 2}
OK	1759-64-4	CC1CCCC=C1C	{1: 2, 11: 3, 12: 1, 14: 1, 15: 1}
OK	1759-71-3	CC(=O)OC1CCCCC1OC(=O)C	{1: 2, 11: 4, 12: 2, 28: 2}
OK	1759-81-5	CC1CC=CC1	{1: 1, 11: 2, 12: 1, 14: 2}
OK	17597-95-4	CCCCCCOCC(OC)OC	{1: 3, 2: 6, 3: 1, 22: 3}
OK	17598-65-1	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3C[C@H]([C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)C)O)O[C@H]7C[C@@H]([C@@H]([C@H](O7)C)O[C@H]8C[C@@H]([C@@H]([C@H](O8)C)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O)O	{1: 5, 2: 1, 11: 12, 12: 23, 13: 3, 14: 1, 15: 1, 20: 9, 22: 4, 23: 4, 28: 1}
OK	176-63-6	C1CCC2(CC1)CCCC2	{11: 9, 13: 1}
OK	176-80-7	C1CCC2(CC1)CCCN2	{32: 1, 11: 8, 13: 1}
OK	17603-57-5	CCC/C(=C/C=C)/C	{1: 2, 2: 2, 5: 1, 6: 2, 7: 1}
OK	17603-76-8	CCCCC#CC(=C)C	{1: 2, 2: 3, 10: 2, 5: 1, 7: 1}
OK	17605-67-3	CC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C	{1: 6, 2: 2, 3: 2, 6: 1, 7: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	17605-83-3	C[C@@H]1[C@H]2[C@H](CC3[C@@]2(CCC4C3CCC5[C@@]4(CCC(C5)[C@@]6([C@@H]([C@H]([C@H]([C@@H](O6)CO)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O)O)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)C)C)OC11CCC(CN1)C.Cl	{32: 1, 1: 4, 2: 3, 11: 12, 12: 27, 13: 4, 17: 1, 20: 13, 22: 3, 23: 5}
OK	17606-95-0	COC(=O)/C/1=C/C(=O)CCCCC1	{1: 1, 11: 5, 14: 1, 15: 1, 25: 1, 28: 1}
OK	17609-31-3	CC=CC=CC=CC=O	{1: 1, 26: 1, 6: 6}
OK	1761-67-7	CN=C	{1: 1, 34: 1, 5: 1}
OK	1761-71-3	C1CC(CCC1CC2CCC(CC2)N)N	{2: 1, 11: 8, 12: 4, 30: 2}
OK	17611-82-4	CCC(CC#N)C#N	{1: 1, 2: 2, 3: 1, 37: 2}
OK	17615-91-7	CCCCCC(C)C(C)CCCC	{1: 4, 2: 7, 3: 2}
OK	17616-03-4	CCCCCCCCCCCCN1C(=O)C=CC1=O	{1: 1, 2: 11, 33: 1, 14: 2, 25: 2}
OK	17617-45-7	CC(=C)C1C2C3C4(C(C1C(=O)O2)(CC5C4(O5)C(=O)O3)O)C	{1: 2, 5: 1, 7: 1, 11: 1, 12: 5, 13: 3, 20: 1, 23: 1, 28: 2}
OK	17618-77-8	CCCC(=CC)C	{1: 3, 2: 2, 6: 1, 7: 1}
OK	17618-97-2	C1C=CC2C1C=CC2	{11: 2, 12: 2, 14: 4}
OK	17619-36-2	CCCSSSC	{40: 3, 1: 2, 2: 2}
OK	17627-10-0	CCCCCCCCCCCCCCCC(=O)NC(CSSCC(C(=O)O)NC(=O)CCCCCCCCCCCCCCC)C(=O)O	{1: 2, 2: 30, 3: 2, 40: 2, 24: 2, 27: 2, 31: 2}
OK	17627-41-7	CCCCCCOC(=O)C=C(C)C	{1: 3, 2: 5, 28: 1, 6: 1, 7: 1}
OK	17627-44-0	CC1=CCC(CC1)C(=CCC=C(C)C)C	{1: 4, 2: 1, 6: 2, 7: 2, 11: 3, 12: 1, 14: 1, 15: 1}
OK	17634-51-4	CCC1C=CC=CC=C1	{1: 1, 2: 1, 12: 1, 14: 6}
OK	17639-76-8	CC(C(=O)OC)OC	{1: 3, 3: 1, 28: 1, 22: 1}
OK	17639-93-9	CC(C(=O)OC)Cl	{1: 2, 3: 1, 28: 1, 17: 1}
OK	17640-02-7	CC(C(=O)OC)(Cl)Cl	{1: 2, 4: 1, 28: 1, 17: 2}
OK	17640-03-8	CCOC(=O)C(C)(Cl)Cl	{1: 2, 2: 1, 4: 1, 28: 1, 17: 2}
OK	17640-12-9	COC(=O)C(=C(Cl)Cl)Cl	{1: 1, 17: 3, 28: 1, 7: 2}
OK	17640-15-2	COC(=O)C#N	{1: 1, 28: 1, 37: 1}
OK	17640-25-4	COC(=O)C(OC)(Cl)Cl	{1: 2, 4: 1, 28: 1, 22: 1, 17: 2}
OK	17640-26-5	CCOCC(=O)OC	{1: 2, 2: 2, 28: 1, 22: 1}
OK	17642-74-9	CC1OCCS1	{1: 1, 11: 2, 12: 1, 41: 1, 23: 1}
OK	17643-36-6	C#CCCCCCCCCO	{9: 1, 2: 8, 20: 1, 10: 1}
OK	17643-54-8	COC(=O)NNC(=O)OC	{1: 2, 28: 2, 31: 2}
OK	1765-26-0	C1COC(O1)(C(F)(F)F)C(F)(F)F	{16: 6, 11: 2, 4: 2, 13: 1, 23: 2}
OK	1765-48-6	C(C(C(C(C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 20, 27: 1, 3: 1, 4: 9}
OK	1765-92-0	C1C(O1)CC(C(C(F)(F)F)(F)F)(F)F	{2: 1, 4: 3, 11: 1, 12: 1, 16: 7, 23: 1}
OK	17658-63-8	CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)CO	{1: 2, 2: 33, 3: 1, 20: 1}
OK	176590-87-7	C=CCOCCO.C=CCOCC1CO1.C=CCl	{2: 5, 5: 3, 6: 3, 11: 1, 12: 1, 17: 1, 20: 1, 22: 2, 23: 1}
OK	1766-41-2	C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 50, 4: 24}
OK	17660-58-1	CCOC(=O)CC(C(=O)OCC)(S)S	{1: 2, 2: 3, 4: 1, 28: 2, 39: 2}
OK	17660-99-0	CN(C)C(=O)NCO	{1: 2, 2: 1, 33: 1, 20: 1, 24: 1, 31: 1}
OK	17661-50-6	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCC	{1: 2, 2: 29, 28: 1}
OK	17669-40-8	CCCC#CC(=C)C	{1: 2, 2: 2, 10: 2, 5: 1, 7: 1}
OK	1767-46-0	CC[C@H](C)CCCO	{1: 2, 2: 4, 3: 1, 20: 1}
OK	17671-27-1	CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 41, 28: 1}
OK	17673-25-5	CC1C(C2(C(C2(C)C)C3C1(C4C=C(C(=O)C4(CC(=C3)CO)O)C)O)O)O	{1: 4, 2: 1, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 5, 25: 1}
OK	17673-49-3	CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 31, 28: 1, 6: 2}
OK	17673-50-6	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 31, 28: 1, 6: 2}
OK	17677-15-5	CCCCCCCCCCCCOCC(CCl)O	{1: 1, 2: 13, 3: 1, 17: 1, 20: 1, 22: 1}
OK	17678-60-3	CCCCCCCCCCCCCCCN(C)C	{1: 3, 2: 14, 33: 1}
OK	17678-85-2	CC(C)C1C=CC=CC=C1	{1: 2, 3: 1, 12: 1, 14: 6}
OK	17679-92-4	CCCCC#CC=C	{1: 1, 2: 3, 10: 2, 5: 1, 6: 1}
OK	1768-31-6	C(C(=O)C(Cl)(Cl)Cl)(Cl)Cl	{24: 1, 17: 5, 3: 1, 4: 1}
OK	1768-34-9	COC#N	{1: 1, 37: 1, 22: 1}
OK	1768-64-5	C1COCCC1Cl	{17: 1, 11: 4, 12: 1, 23: 1}
OK	17682-70-1	CC1(OCC2C(O1)C3C(O2)(OC(O3)(C)C)CO)C	{1: 4, 2: 1, 11: 1, 12: 3, 13: 3, 20: 1, 23: 5}
OK	17686-53-2	CN=C(NC#N)N(C)C	{1: 3, 34: 1, 37: 1, 33: 1, 7: 1, 31: 1}
OK	17687-74-0	C1CCC(CC1)C(C2CCCCC2)(C3CCCCC3)O	{12: 3, 11: 15, 4: 1, 20: 1}
OK	17687-75-1	C1CC2CC1CC2C(C3CC4CCC3C4)(C5CC6CCC5C6)O	{12: 9, 11: 12, 4: 1, 20: 1}
OK	17689-16-6	C1CCC(=O)SCC1	{25: 1, 11: 5, 41: 1}
OK	17696-11-6	C(CCCC(=O)O)CCCBr	{2: 7, 27: 1, 18: 1}
OK	17696-23-0	CN(C)C(=O)C1CC1	{24: 1, 1: 2, 11: 2, 12: 1, 33: 1}
OK	17696-64-9	CCC(C)OC(=O)CCl	{1: 2, 2: 2, 3: 1, 28: 1, 17: 1}
OK	17696-95-6	CNC(=O)NN	{24: 1, 1: 1, 30: 1, 31: 2}
OK	17697-53-9	CC(C)N=[N+](C(C)C)[O-]	{1: 4, 34: 1, 3: 2, 29: 1, 33: 1}
OK	17697-55-1	CCCN=[N+](CCC)[O-]	{1: 2, 2: 4, 34: 1, 29: 1, 33: 1}
OK	17699-05-7	CC1=CCC2CC1C2(C)CCC=C(C)C	{1: 4, 2: 2, 6: 1, 7: 1, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1}
OK	17699-14-8	CC1CCC(C2C13C2C(=CC3)C)C(C)C	{1: 4, 3: 1, 11: 3, 12: 4, 13: 1, 14: 1, 15: 1}
OK	17699-86-4	C=CC1CC=C(C)CC1	{1: 1, 5: 1, 6: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	177-10-6	C1CCC2(CC1)OCCO2	{11: 7, 13: 1, 23: 2}
OK	177-11-7	C1CNCCC12OCCO2	{32: 1, 11: 6, 13: 1, 23: 2}
OK	1770-80-5	CCCCOC(=O)C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)OCCCC	{1: 2, 2: 6, 12: 2, 13: 3, 15: 2, 17: 6, 28: 2}
OK	17705-81-6	CCCCCCCCC=CCCCCCCCC(=O)OCC(CC)N	{1: 2, 2: 16, 3: 1, 6: 2, 28: 1, 30: 1}
OK	17715-00-3	C#CCC1CCCCC1	{9: 1, 2: 1, 11: 5, 12: 1, 10: 1}
OK	17719-79-8	C=CCN(CCO)CC=C	{33: 1, 2: 4, 20: 1, 5: 2, 6: 2}
OK	1772-01-6	C1=CC(=C(N)N=O)NC=C1	{32: 1, 34: 1, 7: 1, 14: 4, 15: 1, 29: 1, 30: 1}
OK	1772-25-4	C(CC#N)CC(CCC#N)C#N	{2: 5, 3: 1, 37: 3}
OK	1772-43-6	CC1=NC(CO1)(C)C	{1: 3, 35: 1, 11: 1, 13: 1, 15: 1, 23: 1}
OK	17721-95-8	CC1CCCC(N1N=O)C	{1: 2, 34: 1, 33: 1, 11: 3, 12: 2, 29: 1}
OK	1773-89-3	COC(=O)C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)OC	{1: 2, 12: 2, 13: 3, 15: 2, 17: 6, 28: 2}
OK	17736-08-2	CCCCCCCC/C=C\CCCCCCCC(=O)N(C)CC(=O)O.C(CO)N(CCO)CCO	{1: 2, 2: 21, 6: 2, 33: 2, 20: 3, 24: 1, 27: 1}
OK	17739-45-6	C1CCOC(C1)OCCBr	{2: 2, 11: 4, 12: 1, 18: 1, 22: 1, 23: 1}
OK	17741-60-5	C=CC(=O)OCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 10, 5: 1, 6: 1, 16: 21, 28: 1}
OK	17742-78-8	CC(C)(C)OOCO	{1: 3, 2: 1, 4: 1, 22: 2, 20: 1}
OK	17746-05-3	CCCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 9, 17: 1}
OK	17746-06-4	CCCCCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 11, 17: 1}
OK	17746-08-6	CCCCCCCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 13, 17: 1}
OK	17746-46-2	CC(C)(C(=O)OC)N=O	{1: 3, 34: 1, 4: 1, 29: 1, 28: 1}
OK	177473-73-3	COC1=CC(=O)/C(=C\2/NC(=NC(=N2)SC)SC)/C=C1	{32: 1, 1: 3, 35: 2, 40: 2, 14: 3, 15: 5, 22: 1, 25: 1}
OK	177484-43-4	C(#N)C(C(F)(F)F)(OC(C(C(OC(=C(F)F)F)(F)F)(F)F)(F)F)F.C(=C(F)F)(OC(F)(F)F)F.C(=C(F)F)(F)F	{16: 23, 4: 6, 37: 1, 22: 3, 7: 6}
OK	1775-39-9	C(C=CCCl)O	{17: 1, 2: 2, 20: 1, 6: 2}
OK	17756-81-9	C(CNC(=O)CCl)C#N	{24: 1, 17: 1, 2: 3, 37: 1, 31: 1}
OK	17759-85-2	C=C(Cl)Br	{17: 1, 18: 1, 5: 1, 7: 1}
OK	17760-91-7	C1CC2CCC3C2C1CC3	{11: 6, 12: 4}
OK	17766-28-8	C1CCC(CC1)N2CCNCC2	{32: 1, 33: 1, 11: 9, 12: 1}
OK	17768-41-1	C1C2CC3CC1CC(C2)(C3)CN	{2: 1, 11: 6, 12: 3, 13: 1, 30: 1}
OK	1777-44-2	C1CC2CC1C3C2C4CC4C3	{11: 5, 12: 6}
OK	17773-41-0	CSCCC(C#N)O	{1: 1, 2: 2, 3: 1, 37: 1, 40: 1, 20: 1}
OK	17773-64-7	CC(C)C(=C)Cl	{1: 2, 3: 1, 17: 1, 5: 1, 7: 1}
OK	17773-65-8	CC(=C(C)Cl)C	{1: 3, 17: 1, 7: 2}
OK	17773-66-9	CC(C)C(C)(Cl)Cl	{1: 3, 3: 1, 4: 1, 17: 2}
OK	1778-02-5	CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C	{1: 4, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 24: 1, 28: 1}
OK	1779-13-1	CCCCCCCCC=CCCCCCCCC	{1: 2, 2: 14, 6: 2}
OK	1779-19-7	C1COCOCCO1	{11: 5, 23: 3}
OK	1779-60-8	CCCOC(=O)CC(=O)C	{24: 1, 1: 2, 2: 3, 28: 1}
OK	1779-81-3	C1CSC(=N1)N	{35: 1, 11: 2, 41: 1, 30: 1, 15: 1}
OK	17793-95-2	C1=C[C@H]([C@H](C=C1)O)O	{20: 2, 12: 2, 14: 4}
OK	17794-44-4	CCCC(=O)NC	{24: 1, 1: 2, 2: 2, 31: 1}
OK	17797-03-4	C1CCC(CC1)SCl	{40: 1, 17: 1, 11: 5, 12: 1}
OK	178032-63-8	CC1(O[C@@H]2[C@@H]3C[C@H]([C@@H]2O1)NC3=O)C	{32: 1, 1: 2, 11: 1, 12: 4, 13: 1, 23: 2, 25: 1}
OK	17804-59-0	CCOC(=O)CC(C)(C)CC(=O)OCC	{1: 4, 2: 4, 4: 1, 28: 2}
OK	1781-78-8	C1CCCC#CCC1	{10: 2, 11: 6}
OK	17829-37-7	CC[CH]C=C	{1: 1, 2: 1, 5: 1, 6: 2}
OK	1783-96-6	C([C@H](C(=O)O)N)C(=O)O	{27: 2, 2: 1, 3: 1, 30: 1}
OK	17831-71-9	C=CC(=O)OCCOCCOCCOCCOC(=O)C=C	{2: 8, 22: 3, 28: 2, 5: 2, 6: 2}
OK	17832-30-3	CCCCCCC(CCC(CCCCCC)C(=O)N)C(=O)N	{24: 2, 1: 2, 2: 12, 3: 2, 30: 2}
OK	17837-41-1	CC1CCS1	{1: 1, 11: 2, 12: 1, 41: 1}
OK	17839-26-8	CCCCCNCC	{1: 2, 2: 5, 31: 1}
OK	17853-64-4	C1CCC23CC=CCC2(C1)CSC3	{41: 1, 11: 8, 13: 2, 14: 2}
OK	1786-08-9	CC1=CCOC(C1)C=C(C)C	{1: 3, 6: 1, 7: 1, 11: 2, 12: 1, 14: 1, 15: 1, 23: 1}
OK	1786-94-3	CCCCOCCOCCOCCOCCOCCO	{1: 1, 2: 13, 20: 1, 22: 5}
OK	17860-39-8	COC(=O)C(C)(C)OC	{1: 4, 4: 1, 22: 1, 28: 1}
OK	17872-55-8	CC(CO)(CO)C(=O)OC	{1: 2, 2: 2, 4: 1, 20: 2, 28: 1}
OK	1790-22-3	C(CCl)C(CCl)Cl	{17: 3, 2: 3, 3: 1}
OK	17909-77-2	C/C(=C\C/C=C(\C)/C=C)/CC/C=C(\C)/C=O	{1: 3, 2: 3, 5: 1, 6: 4, 7: 3, 26: 1}
OK	17912-17-3	CCCC(CCCCBr)Br	{1: 1, 2: 6, 3: 1, 18: 2}
OK	17913-18-7	COCCCCCl	{1: 1, 2: 4, 22: 1, 17: 1}
OK	1792-17-2	CCCCNC(=O)NCCCC	{24: 1, 1: 2, 2: 6, 31: 2}
OK	1792-81-0	C1CC[C@@H]([C@@H](C1)O)O	{20: 2, 11: 4, 12: 2}
OK	1793-68-6	CCCCCCCCCCCC(=O)OCCN(CCO)CCO	{1: 1, 2: 16, 20: 2, 28: 1, 33: 1}
OK	17931-55-4	C1CC2CCCC(C1)C2=O	{25: 1, 11: 6, 12: 2}
OK	17931-67-8	C1C2CC3CC1C(C2)C3=O	{25: 1, 11: 4, 12: 4}
OK	17937-38-1	C1=CC(=O)C(=CNCCNC=C2C=C(C=CC2=O)Br)C=C1Br	{2: 2, 6: 2, 14: 6, 15: 4, 18: 2, 25: 2, 31: 2}
OK	1794-84-9	C([N+](=O)[O-])Cl	{17: 1, 2: 1, 38: 1}
OK	1795-09-1	CC1CCCS1	{1: 1, 11: 3, 12: 1, 41: 1}
OK	1795-13-7	CC1C(C(C(C(C1C)C)C)C)C	{1: 6, 12: 6}
OK	1795-15-9	CCCCCCCCC1CCCCC1	{1: 1, 2: 7, 11: 5, 12: 1}
OK	1795-16-0	CCCCCCCCCCC1CCCCC1	{1: 1, 2: 9, 11: 5, 12: 1}
OK	1795-17-1	CCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 11, 11: 5, 12: 1}
OK	1795-18-2	CCCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 13, 11: 5, 12: 1}
OK	1795-19-3	C1CCC(CC1)C2CCC(CC2)C3CCCCC3	{11: 14, 12: 4}
OK	1795-20-6	CCCCCCCCC1CCCC1	{1: 1, 2: 7, 11: 4, 12: 1}
OK	1795-21-7	CCCCCCCCCCC1CCCC1	{1: 1, 2: 9, 11: 4, 12: 1}
OK	1795-22-8	CCCCCCCCCCCCCCC1CCCC1	{1: 1, 2: 13, 11: 4, 12: 1}
OK	1795-26-2	C[C@H]1C[C@H](C)C[C@@H](C)C1	{1: 3, 11: 3, 12: 3}
OK	1795-48-8	CC(C)N=C=O	{8: 1, 1: 2, 34: 1, 3: 1, 29: 1}
OK	17952-11-3	CCCCCOCC	{1: 2, 2: 5, 22: 1}
OK	17976-80-6	C(CCCO)CCC#N	{2: 6, 20: 1, 37: 1}
OK	17977-09-2	CC(COC(=O)C=C)([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 4: 1, 5: 1, 6: 1, 38: 2, 28: 1}
OK	17977-11-6	CCC(COC(=O)C(=C)C)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 5: 1, 38: 1, 7: 1, 28: 1}
OK	17977-13-8	CC(=C)C(=O)OCC(C)([N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 1, 4: 1, 5: 1, 38: 2, 7: 1, 28: 1}
OK	1798-20-5	CCCCCCCNC(=O)NCCCCCCC	{24: 1, 1: 2, 2: 12, 31: 2}
OK	17987-54-1	CC12CCCCC1(CCCC2)OC	{1: 2, 11: 8, 13: 2, 22: 1}
OK	1799-84-4	CC(=C)C(=O)OCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 4, 5: 1, 7: 1, 16: 9, 28: 1}
OK	17990-11-3	C=C1CC[C@H]2[C@@](C)(C=O)CCC[C@]2(C)[C@H]1CCC(C)=CCO	{1: 3, 2: 3, 5: 1, 6: 1, 7: 1, 11: 5, 12: 2, 13: 2, 15: 1, 20: 1, 26: 1}
OK	17994-25-1	C1CC1(C(=O)O)O	{27: 1, 11: 2, 20: 1, 13: 1}
OK	17994-26-2	C1C2C=CC1C(=O)C2=O	{25: 2, 11: 1, 12: 2, 14: 2}
OK	17997-40-9	N#C[N-]C#N	{34: 1, 37: 2}
OK	17997-65-8	C1CC2CCC1C(C2O)N	{20: 1, 11: 4, 12: 4, 30: 1}
OK	180-43-8	C1CCC2(CC1)CCCCC2	{11: 10, 13: 1}
OK	180-72-3	C1C2(CSSS1)CSSSC2	{41: 6, 11: 4, 13: 1}
OK	180-84-7	C1CCOC2(C1)CCCCO2	{11: 8, 13: 1, 23: 2}
OK	180-97-2	C1CSC2(SC1)SCCCS2	{41: 4, 11: 6, 13: 1}
OK	1801-72-5	C=CCNC(=O)NCC=C	{24: 1, 2: 2, 5: 2, 6: 2, 31: 2}
OK	18012-46-9	C1C/2C1/C=C\C=C/C=C2	{11: 1, 12: 2, 14: 6}
OK	18016-43-8	CCCCCCCCC=CCCCCCCCC(=O)O.C(CNCCN)N	{1: 1, 2: 18, 6: 2, 27: 1, 30: 2, 31: 1}
OK	18017-50-0	C1CCN/C(=C/2\CCCN=C2)/C1	{32: 1, 35: 1, 11: 7, 14: 1, 15: 2}
OK	18020-65-0	CC(C(=C)C(=O)OC)O	{1: 2, 3: 1, 5: 1, 7: 1, 20: 1, 28: 1}
OK	18023-86-4	CCCCCCCCCCCCSCC(CO)O	{40: 1, 1: 1, 2: 13, 3: 1, 20: 2}
OK	18024-09-4	C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 29, 27: 1, 4: 14}
OK	18031-40-8	CC(=C)[C@H]1CCC(=CC1)C=O	{1: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	180389-78-0	CCCCCCCCCCCCCCOCCCNCCC#N	{1: 1, 2: 18, 37: 1, 22: 1, 31: 1}
OK	1804-15-5	CC(=CN=O)NO	{1: 1, 34: 1, 6: 1, 7: 1, 20: 1, 29: 1, 31: 1}
OK	1805-22-7	C1(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	{16: 12, 4: 1, 13: 5}
OK	18060-77-0	CC=CC(=O)OC(C)C	{1: 3, 3: 1, 28: 1, 6: 2}
OK	18065-96-8	CCC1C(N2CC(C(=O)CC2C3(C1(C=C(C(=C3)OC)OC)S)S)CC(C)C)CC.Cl	{1: 6, 2: 3, 3: 1, 33: 1, 11: 2, 12: 4, 13: 2, 14: 2, 15: 2, 17: 1, 22: 2, 25: 1, 39: 2}
OK	18068-06-9	COC1CCC(CC1)O	{1: 1, 11: 4, 12: 2, 22: 1, 20: 1}
OK	18068-26-3	C=CCSCSCC=C	{40: 2, 2: 3, 5: 2, 6: 2}
OK	18069-17-5	CC(CCC(=O)O)C(=O)O	{27: 2, 1: 1, 2: 2, 3: 1}
OK	1807-02-9	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@@H](C[C@]4([C@H]3CC[C@]4(C)O)C)O	{1: 3, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 2, 25: 1}
OK	1807-14-3	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)C=C[C@]34C	{1: 2, 2: 1, 11: 6, 12: 3, 13: 3, 14: 3, 15: 1, 20: 2, 24: 1, 25: 1}
OK	18071-35-7	CCCN(CCC)CC#N	{1: 2, 2: 5, 37: 1, 33: 1}
OK	18073-84-2	C1CN(CCC1CCCC2CCN(CC2)CCO)CCO	{20: 2, 2: 7, 11: 8, 12: 2, 33: 2}
OK	1808-09-9	C1CCC(CC1)C2CCCC=C2	{11: 8, 12: 2, 14: 2}
OK	18085-02-4	CC(=O)OCC(C=C)OC(=O)C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 28: 2}
OK	1809-02-5	CC(=C)C(=C)Cl	{1: 1, 17: 1, 5: 2, 7: 2}
OK	1809-05-8	CCC(CC)I	{19: 1, 1: 2, 2: 2, 3: 1}
OK	1809-10-5	CCC(CC)Br	{1: 2, 2: 2, 3: 1, 18: 1}
OK	1809-53-6	CCN(CC)/C=C/C#C	{1: 2, 2: 2, 6: 2, 33: 1, 9: 1, 10: 1}
OK	18094-01-4	CCCCCCCCCCCC(=C)C	{1: 2, 2: 10, 5: 1, 7: 1}
OK	180982-90-5	CCCCCCCCCCOCCCNC(=O)CO	{1: 1, 2: 13, 20: 1, 22: 1, 24: 1, 31: 1}
OK	180982-91-6	CCCCCCCCOCCCNC(=O)CO	{1: 1, 2: 11, 20: 1, 22: 1, 24: 1, 31: 1}
OK	181-15-7	C1CCCC2(CC1)CCCCC2	{11: 11, 13: 1}
OK	181-28-2	C1CCC2(CC1)OCCCCO2	{11: 9, 13: 1, 23: 2}
OK	1812-50-6	CCCCC(C)(C)S	{1: 3, 2: 3, 4: 1, 39: 1}
OK	18122-77-5	C1CC(C(CC1C(C(C2CCC(C(C2)Br)Br)Br)Br)Br)Br	{11: 6, 18: 6, 3: 2, 12: 6}
OK	181258-87-7	CCC(C)(C)C1CCC(CC1)OCC	{1: 4, 2: 2, 4: 1, 11: 4, 12: 2, 22: 1}
OK	18126-38-0	CC(C=C)C1C=CCCC1C=O	{1: 1, 3: 1, 5: 1, 6: 1, 11: 2, 12: 2, 14: 2, 26: 1}
OK	18130-74-0	F.[F-]	{16: 2}
OK	18136-00-0	C1CN(CCC1CCCC2CCN(CC2)CCC#N)CCC#N	{33: 2, 2: 7, 11: 8, 12: 2, 37: 2}
OK	18137-88-7	C=C1CCCO1	{23: 1, 11: 3, 5: 1, 15: 1}
OK	18139-02-1	C(C([N+](=O)[O-])([N+](=O)[O-])F)N	{16: 1, 2: 1, 4: 1, 38: 2, 30: 1}
OK	18139-03-2	C(C([N+](=O)[O-])([N+](=O)[O-])F)NCC([N+](=O)[O-])([N+](=O)[O-])F	{16: 2, 2: 2, 4: 2, 38: 4, 31: 1}
OK	1814-88-6	CC(C(F)(F)F)(F)F	{16: 5, 1: 1, 4: 2}
OK	1817-89-6	CCCC(C)OCC	{1: 3, 2: 3, 3: 1, 22: 1}
OK	18172-67-3	CC1([C@H]2CCC(=C)[C@@H]1C2)C	{1: 2, 5: 1, 11: 3, 12: 2, 13: 1, 15: 1}
OK	18190-44-8	C1CC(=O)N(C1=O)CCO	{25: 2, 2: 2, 11: 2, 20: 1, 33: 1}
OK	18197-22-3	C(=O)NC=O	{26: 2, 31: 1}
OK	18198-40-8	CC(C)CCCCCCN(CCCCCCC(C)C)CCCCCCC(C)C	{1: 6, 2: 18, 3: 3, 33: 1}
OK	182-01-4	C1CCC2(CC1)OOC3(CCCCC3)OOC4(CCCCC4)OO2	{11: 15, 13: 3, 23: 6}
OK	1820-09-3	CC1=C[C@H]([C@H]2C[C@@H]1C2(C)C)O	{1: 3, 11: 1, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	18207-29-9	CCCCCCCCN(C(=O)N)N=O	{1: 1, 2: 7, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	18209-43-3	C1CC2CCC(C2C1)C(=O)O	{27: 1, 11: 5, 12: 3}
OK	1821-02-9	CCCC(=O)C(=O)O	{24: 1, 1: 1, 2: 2, 27: 1}
OK	18217-12-4	CCC(C)CCC(=O)C	{24: 1, 1: 3, 2: 3, 3: 1}
OK	18218-27-4	CC(=O)OC1CC(=C)C1	{1: 1, 5: 1, 11: 2, 12: 1, 15: 1, 28: 1}
OK	1822-45-3	CC(CN(C)C)N(C)C	{1: 5, 2: 1, 3: 1, 33: 2}
OK	1822-74-8	CSC=C	{40: 1, 1: 1, 5: 1, 6: 1}
OK	1822-86-2	C=CC(=C)Br	{18: 1, 5: 2, 6: 1, 7: 1}
OK	182212-41-5	CC(=C)C(=O)OCCOC(=O)C(=C)C.CC(=C)C(=O)OCC=C	{1: 3, 2: 3, 5: 4, 6: 1, 7: 3, 28: 3}
OK	182241-06-1	CCOC(=O)C[C@@H](C(=O)OCC)NCCCC(C)CN[C@@H](CC(=O)OCC)C(=O)OCC.C(CCCN=C=O)CCN=C=O	{1: 5, 2: 16, 3: 3, 8: 2, 34: 2, 28: 4, 29: 2, 31: 2}
OK	182287-51-0	CC(C)(C)OC(=O)NC(CC1CCOCC1)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 11: 4, 12: 1, 23: 1, 27: 1, 28: 1, 31: 1}
OK	18231-53-3	CCC(=C)C(C)(C)C	{1: 4, 2: 1, 4: 1, 5: 1, 7: 1}
OK	18231-61-3	C(C=CCN)N	{2: 2, 30: 2, 6: 2}
OK	18232-30-9	CCCCC#CC(OCC)OCC	{1: 3, 2: 5, 3: 1, 10: 2, 22: 2}
OK	1824-94-8	COC1C(C(C(C(O1)CO)O)O)O	{1: 1, 2: 1, 12: 5, 20: 4, 22: 1, 23: 1}
OK	18240-68-1	CCCC(C(=O)O)(Cl)Cl	{1: 1, 2: 2, 27: 1, 4: 1, 17: 2}
OK	18240-70-5	CCCCC(C(=O)O)(Cl)Cl	{1: 1, 2: 3, 27: 1, 4: 1, 17: 2}
OK	18244-47-8	C1CCC2(CC1)CCC(CC2)C(=O)O	{27: 1, 11: 9, 12: 1, 13: 1}
OK	18251-82-6	CC(C)CNCC(C)C.Cl	{31: 1, 1: 4, 2: 2, 3: 2, 17: 1}
OK	18254-57-4	CCCCCCCCCCCC(C1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 10, 3: 1, 12: 2}
OK	18261-92-2	CCCCCCCCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 15}
OK	18263-25-7	CCCCCCCCCCCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 13, 3: 1, 18: 1}
OK	18264-75-0	C(=NN)(N)N[N+](=O)[O-]	{34: 1, 31: 1, 38: 1, 30: 2, 7: 1}
OK	18266-55-2	CCC(=O)NCCO	{24: 1, 1: 1, 2: 3, 20: 1, 31: 1}
OK	18267-36-2	CCOC(=O)CC(C)(C)O	{1: 3, 2: 2, 4: 1, 20: 1, 28: 1}
OK	18268-70-7	CCCCC(CC)C(=O)OCCOCCOCCOCCOC(=O)C(CC)CCCC	{1: 4, 2: 16, 3: 2, 28: 2, 22: 3}
OK	182699-77-0	C[C@H]1[C@@H]2CCC(=C[C@@H]2OC1=O)C	{1: 2, 11: 2, 12: 3, 14: 1, 15: 1, 28: 1}
OK	18271-82-4	COC(C(Cl)(Cl)Cl)O	{1: 1, 3: 1, 4: 1, 17: 3, 20: 1, 22: 1}
OK	18273-20-6	C1CCC(C(C1)N(F)F)N(F)F	{16: 4, 33: 2, 11: 4, 12: 2}
OK	18273-24-0	CC(CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])(N(F)F)N(F)F	{1: 1, 2: 2, 4: 2, 38: 3, 33: 2, 16: 4}
OK	18273-30-8	C(C(N(F)F)[N+](=O)[O-])(N)N(F)F	{16: 4, 33: 2, 3: 2, 38: 1, 30: 1}
OK	18276-99-8	CCCCCCCCCCCCCC(=O)CCCC	{24: 1, 1: 2, 2: 15}
OK	18277-86-6	CCCCCCCCCCCCCCOC(=O)CCl	{1: 1, 2: 14, 28: 1, 17: 1}
OK	18281-04-4	CCCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 18, 28: 1}
OK	18281-05-5	CCCCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 19, 28: 1}
OK	18281-07-7	CCCCCCCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 22, 28: 1}
OK	18294-87-6	C1CCC(=CC1)CC(=O)O	{27: 1, 2: 1, 11: 4, 14: 1, 15: 1}
OK	18295-25-5	CC(C)C(C)Br	{1: 3, 18: 1, 3: 2}
OK	18295-27-7	CC(C)C(C)I	{19: 1, 1: 3, 3: 2}
OK	18295-59-5	CCCC(CCC)C=O	{1: 2, 2: 4, 3: 1, 26: 1}
OK	18295-64-2	CCC#CCCCCCCCl	{1: 1, 2: 7, 10: 2, 17: 1}
OK	18296-44-1	CC(C)CC(=O)O[C@H]1C=C2[C@@H]([C@@]13CO3)[C@@H](OC=C2COC(=O)C)OC(=O)CC(C)C	{1: 5, 2: 3, 3: 2, 11: 1, 12: 3, 13: 1, 14: 2, 15: 2, 23: 2, 28: 3}
OK	18299-85-9	CCCCCCCCCCCCCCCCCCCCCCOC(=O)C=C	{1: 1, 2: 21, 28: 1, 5: 1, 6: 1}
OK	183-84-6	C1CCC2(CC1)OOC3(CCCCC3)OO2	{11: 10, 13: 2, 23: 4}
OK	183-97-1	C1CC2(CCC13OCCO3)OCCO2	{11: 8, 13: 2, 23: 4}
OK	1830-54-2	COC(=O)CC(=O)CC(=O)OC	{24: 1, 1: 2, 2: 2, 28: 2}
OK	1830-78-0	CC(=C)C(=O)OCC(COC(=O)C(=C)C)O	{1: 2, 2: 2, 3: 1, 5: 2, 7: 2, 20: 1, 28: 2}
OK	18300-04-4	C1C2C(C(C1Br)Br)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{11: 1, 12: 4, 13: 3, 15: 2, 17: 6, 18: 2}
OK	18300-91-9	CCCCCCCCCCCCCCC#N	{1: 1, 2: 13, 37: 1}
OK	18304-13-7	C(COC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)COCCC#N)OCCC#N)OCCC#N)COCCC#N)OCCC#N)OCCC#N)OCCC#N)C#N	{2: 19, 37: 8, 12: 8, 13: 1, 22: 9, 23: 2}
OK	18312-12-4	C1CC2CCC1CN(C2)C(=O)CI	{33: 1, 2: 1, 11: 6, 12: 2, 19: 1, 24: 1}
OK	18318-83-7	CCCC=CC(OC)OC	{1: 3, 2: 2, 3: 1, 22: 2, 6: 2}
OK	18323-44-9	CCCC1CC(N(C1)C)C(=O)NC(C2C(C(C(C(O2)SC)O)O)O)C(C)Cl	{1: 4, 2: 2, 3: 2, 33: 1, 40: 1, 11: 2, 12: 7, 17: 1, 20: 3, 23: 1, 24: 1, 31: 1}
OK	18328-90-0	CCNCC(=C)C	{1: 2, 2: 2, 31: 1, 5: 1, 7: 1}
OK	18328-91-1	CCC=NCC	{1: 2, 2: 2, 34: 1, 6: 1}
OK	18344-37-1	CCCC(C)CCCC(C)CCCC(C)CCCC(C)C	{1: 6, 2: 11, 3: 4}
OK	18361-48-3	CCC(=O)OC1C(OC(CC1(C)O)OC2C(OC(C(C2N(C)C)O)OC3C(CC(C(/C=C\C=C\CC(OC(=O)CC(C3OC)OC(=O)C)C)O)C)CC=O)C)C	{1: 10, 2: 2, 33: 1, 11: 4, 12: 15, 13: 1, 14: 4, 20: 3, 22: 3, 23: 2, 26: 1, 28: 3}
OK	18362-64-6	CC(C)C(=O)CC(=O)C(C)C	{24: 2, 1: 4, 2: 1, 3: 2}
OK	18362-97-5	CCCCC(=O)OC(C)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	183673-71-4	CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)O)N	{1: 3, 4: 1, 33: 1, 11: 4, 13: 1, 27: 1, 28: 1, 30: 1}
OK	1837-91-8	C1(C(C(C(C(C1Br)Br)Br)Br)Br)Br	{18: 6, 12: 6}
OK	18370-87-1	CCSCCOC=C	{1: 1, 2: 3, 5: 1, 6: 1, 40: 1, 22: 1}
OK	18371-13-6	CCC(C)(CC)CO	{1: 3, 2: 3, 4: 1, 20: 1}
OK	18371-24-9	CC(CCI)I	{19: 2, 1: 1, 2: 2, 3: 1}
OK	18371-25-0	C#CC(F)F	{16: 2, 9: 1, 10: 1, 3: 1}
OK	18371-72-7	CCCCCCCCCCOCC(CCl)O	{1: 1, 2: 11, 3: 1, 17: 1, 20: 1, 22: 1}
OK	1838-73-9	CCCC(C(C)CC)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	1838-94-4	CC1(CO1)C=C	{1: 1, 5: 1, 6: 1, 11: 1, 13: 1, 23: 1}
OK	18381-45-8	CCOC(CCC#N)OCC	{1: 2, 2: 4, 3: 1, 37: 1, 22: 2}
OK	18381-53-8	CCOC(=O)C(C(C(C(=O)Cl)(F)F)(F)F)(F)F	{1: 1, 2: 1, 4: 3, 16: 6, 17: 1, 24: 1, 28: 1}
OK	18383-49-8	CC(=C)[C@@H]1C[C@H]2[C@](O2)(C(=O)C1)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 2, 13: 1, 23: 1, 25: 1}
OK	1839-11-8	CCCCCCC=CC=CCCCCCCCC(=O)O	{1: 1, 2: 12, 27: 1, 6: 4}
OK	1839-63-0	CC1CC(CC(C1)C)C	{1: 3, 11: 3, 12: 3}
OK	18394-00-8	CCCCCCCCCC(=O)CCCCCCCC	{24: 1, 1: 2, 2: 15}
OK	184-05-4	C1CCC2(C1)SSC3(CCCC3)SS2	{41: 4, 11: 8, 13: 2}
OK	1840-42-2	C([N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])F	{16: 1, 4: 1, 38: 3}
OK	18404-63-2	C12C(C(C(=O)O1)O)OC(=O)C2O	{20: 2, 12: 4, 28: 2}
OK	18409-17-1	CCCCCC=CCO	{1: 1, 2: 5, 20: 1, 6: 2}
OK	18409-20-6	CCC/C=C/C=C/CO	{1: 1, 2: 3, 20: 1, 6: 4}
OK	18409-46-6	C(=C/C=O)\C=C\C=O	{26: 2, 6: 4}
OK	1841-46-9	CC(=C)C(=O)OCC(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 1, 3: 1, 4: 7, 5: 1, 7: 1, 16: 16, 28: 1}
OK	18413-14-4	CCNN.Cl	{1: 1, 2: 1, 31: 1, 30: 1, 17: 1}
OK	184181-27-9	CCCCC(CC)COCC(CN(C)C)O	{1: 4, 2: 7, 3: 2, 33: 1, 20: 1, 22: 1}
OK	1842-05-3	C(C(F)(Cl)Cl)F	{16: 2, 17: 2, 2: 1, 4: 1}
OK	18420-41-2	C1CCOC(C1)CCl	{17: 1, 2: 1, 11: 4, 12: 1, 23: 1}
OK	18420-46-7	CC(C)COC(=O)CCCCCCCCC(=O)OCC(C)C	{1: 4, 2: 10, 3: 2, 28: 2}
OK	18424-96-9	CN1CCOC(=O)C1	{1: 1, 11: 3, 28: 1, 33: 1}
OK	18431-82-8	CC1=CCC2(CC1)C(=C)CCCC2(C)C	{1: 3, 5: 1, 11: 6, 13: 2, 14: 1, 15: 2}
OK	18432-37-6	CC(C)CC1CCC(=O)O1	{1: 2, 2: 1, 3: 1, 11: 2, 12: 1, 28: 1}
OK	18432-39-8	C(C([N+](=O)[O-])([N+](=O)[O-])F)N(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-]	{16: 2, 33: 1, 2: 2, 4: 2, 38: 5}
OK	18433-93-7	CC1COC(O1)CC(C)C	{1: 3, 2: 1, 3: 1, 11: 1, 12: 2, 23: 2}
OK	18435-20-6	CCCCCCCCCCC(C)C(C)C	{1: 4, 2: 9, 3: 2}
OK	18435-22-8	CCCCCCCCCCCC(C)CC	{1: 3, 2: 11, 3: 1}
OK	18435-23-9	CCCCCCCCCCCC(C)C(C)C	{1: 4, 2: 10, 3: 2}
OK	18435-45-5	CCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 16, 5: 1, 6: 1}
OK	18435-53-5	CCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 27, 5: 1, 6: 1}
OK	18435-54-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 28, 5: 1, 6: 1}
OK	18435-55-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 29, 5: 1, 6: 1}
OK	18436-37-8	CCCCCCC1CCOC1=O	{1: 1, 2: 5, 11: 2, 12: 1, 28: 1}
OK	1844-09-3	CCCCCCCCCCCCCCCCCCSCCCCCCCCCCCCCCCCCC	{40: 1, 1: 2, 2: 34}
OK	18444-66-1	CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3C=C(C(=O)C4(C)C)O)C)C)C)O)O	{1: 9, 4: 2, 6: 2, 11: 3, 12: 4, 13: 4, 14: 2, 15: 2, 20: 3, 24: 1, 25: 2, 28: 1}
OK	18444-79-6	CC1CC(=O)C=C(C12CCC(=C(C)C)C2)C	{1: 4, 7: 1, 11: 4, 12: 1, 13: 1, 14: 1, 15: 2, 25: 1}
OK	18444-89-8	CC1(C2CCC3(C2)C(C1=C)CCC3C(=O)OC)C	{1: 3, 5: 1, 11: 5, 12: 3, 13: 2, 15: 1, 28: 1}
OK	18448-47-0	COC(=O)C1=CCCCC1	{1: 1, 11: 4, 28: 1, 14: 1, 15: 1}
OK	18448-68-5	CCCCCCCCCCCCOCC(CNCCO)O	{1: 1, 2: 15, 3: 1, 20: 2, 22: 1, 31: 1}
OK	18449-60-0	CCC(C)OC(=O)C(C)O	{1: 3, 2: 1, 3: 2, 20: 1, 28: 1}
OK	1845-25-6	C[C@@]1([C@H]2C[C@H](C2(C)C)CC1=O)O	{1: 3, 11: 2, 12: 2, 13: 2, 20: 1, 25: 1}
OK	1845-30-3	CC1=C[C@@H]([C@H]2C[C@@H]1C2(C)C)O	{1: 3, 11: 1, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	1845-59-6	CC1CCC(CC1O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 20: 1}
OK	18451-96-2	CCCCCOC(=O)CCCCCCCCC=C	{1: 1, 2: 12, 28: 1, 5: 1, 6: 1}
OK	1846-68-0	CCCCCC#CC=O	{1: 1, 2: 4, 26: 1, 10: 2}
OK	1846-70-4	CCCCCCC#CC(=O)O	{1: 1, 2: 5, 27: 1, 10: 2}
OK	18476-57-8	CC=CC(C)C(C)C=CC	{1: 4, 3: 2, 6: 4}
OK	18479-49-7	CC(C)CCCC(C)(C=C)O	{1: 3, 2: 3, 3: 1, 4: 1, 5: 1, 6: 1, 20: 1}
OK	18479-57-7	CCC(C)CCCC(C)(C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	18479-58-8	CC(CCCC(C)(C)O)C=C	{1: 3, 2: 3, 3: 1, 4: 1, 5: 1, 6: 1, 20: 1}
OK	18479-68-0	CC1=CCC(CC1)C(C)CO	{1: 2, 2: 1, 3: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	18492-65-4	CCC=CCCC(OCC)OCC	{1: 3, 2: 5, 3: 1, 22: 2, 6: 2}
OK	18495-26-6	CCCCC#CCBr	{1: 1, 2: 4, 18: 1, 10: 2}
OK	18495-30-2	C(C(C(Cl)Cl)Cl)Cl	{17: 4, 2: 1, 3: 2}
OK	185-49-9	C1CCC2(C1)CC2	{11: 6, 13: 1}
OK	185-65-9	C1CCC2(CC1)CC2	{11: 7, 13: 1}
OK	185-70-6	C1CCC2(CC1)CO2	{11: 6, 13: 1, 23: 1}
OK	185-94-4	C1CC2C1C2	{11: 3, 12: 2}
OK	1850-14-2	COC(OC)(OC)OC	{1: 4, 4: 1, 22: 4}
OK	18503-90-7	CCCCOC(N(C)C)OCCCC	{1: 4, 2: 6, 3: 1, 22: 2, 33: 1}
OK	1851-23-6	C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4O)C)O	{1: 2, 11: 9, 12: 6, 13: 2, 20: 2}
OK	18516-18-2	CC(CO)(CO)C=O	{1: 1, 2: 2, 4: 1, 26: 1, 20: 2}
OK	18516-37-5	CCCCCCCCCC(=C)C	{1: 2, 2: 8, 5: 1, 7: 1}
OK	1852-04-6	C(CCCCC(=O)O)CCCCC(=O)O	{2: 9, 27: 2}
OK	1852-14-8	C(CNC(=O)N)NC(=O)N	{24: 2, 2: 2, 30: 2, 31: 2}
OK	1852-16-0	CCCCOCNC(=O)C=C	{1: 1, 2: 4, 5: 1, 6: 1, 22: 1, 24: 1, 31: 1}
OK	1852-17-1	C1CNC(=O)NC1	{32: 2, 25: 1, 11: 3}
OK	1852-53-5	CC12CCC(CC1CCC3C2CCC4(C3CCC4O)C)O	{1: 2, 11: 9, 12: 6, 13: 2, 20: 2}
OK	1852-58-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C[C@H](C4=CC(=O)CC[C@]34C)F	{1: 2, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 16: 1, 20: 1, 25: 1}
OK	1852-61-5	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C[C@@H](CC[C@]34C)O	{1: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 2}
OK	18521-07-8	CCCCC=CC(C)(C)O	{1: 3, 2: 3, 4: 1, 6: 2, 20: 1}
OK	18523-60-9	CCCC(C)C1C(C(=O)O1)(C)C	{1: 4, 2: 2, 3: 1, 12: 1, 13: 1, 28: 1}
OK	18526-07-3	CN(C)CCCOC(=O)C=C	{1: 2, 2: 3, 5: 1, 6: 1, 33: 1, 28: 1}
OK	18530-46-6	C1CC2C(C1)C3CC2CC3N	{11: 5, 12: 5, 30: 1}
OK	18530-56-8	CN(C)C(=O)NC1CC2CC1C3C2CCC3	{1: 2, 33: 1, 11: 5, 12: 5, 24: 1, 31: 1}
OK	185387-36-4	C1[C@@H]([C@H](N1)C(=O)O)CC(=O)O	{27: 2, 32: 1, 2: 1, 11: 1, 12: 2}
OK	1854-23-5	CCC(CN1CCOCC1)(CN2CCOCC2)[N+](=O)[O-]	{1: 1, 2: 3, 4: 1, 38: 1, 33: 2, 11: 8, 23: 2}
OK	1854-26-8	C(N1C(C(N(C1=O)CO)O)O)O	{20: 4, 2: 2, 12: 2, 33: 2, 25: 1}
OK	185429-83-8	C[C@@H]1C2=C(CCCC2(C)C)CC[C@]1(C)C(=O)C	{1: 5, 11: 5, 12: 1, 13: 2, 15: 2, 24: 1}
OK	18545-44-3	CCC(C(=O)OC)(Cl)Cl	{1: 2, 2: 1, 4: 1, 28: 1, 17: 2}
OK	18545-83-0	CCOC(=O)CCC(C)C(=O)OCC	{1: 3, 2: 4, 3: 1, 28: 2}
OK	18546-37-7	C(C=O)[C@H]([C@H](CO)O)O	{2: 2, 3: 2, 20: 3, 26: 1}
OK	18549-40-1	CC1(O[C@@H]2[C@H]([C@H](O[C@@H]2O1)[C@@H](CO)O)O)C	{1: 2, 2: 1, 3: 1, 12: 4, 13: 1, 20: 3, 23: 3}
OK	1855-63-6	C1CCC(=CC1)C#N	{11: 4, 37: 1, 14: 1, 15: 1}
OK	18550-94-2	CCCCCCC1OCC(CO1)O	{1: 1, 2: 5, 11: 2, 12: 2, 20: 1, 23: 2}
OK	185517-21-9	CCCCCC[C@@H](CCC)C(=O)O	{27: 1, 1: 2, 2: 7, 3: 1}
OK	1857-24-5	C=C1CC[C@H]2[C@@](C)(CO)CCC[C@]2(C)[C@H]1CC/C(C)=C/CO	{1: 3, 2: 4, 5: 1, 6: 1, 7: 1, 11: 5, 12: 2, 13: 2, 15: 1, 20: 2}
OK	18589-27-0	CCCCC(C)I	{19: 1, 1: 2, 2: 3, 3: 1}
OK	18589-29-2	CCCCCC(C)I	{19: 1, 1: 2, 2: 4, 3: 1}
OK	18593-92-5	CC(C)C(CO)C(C)C	{1: 4, 2: 1, 3: 3, 20: 1}
OK	18598-63-5	COC(=O)[C@H](CS)N.Cl	{1: 1, 2: 1, 3: 1, 39: 1, 17: 1, 28: 1, 30: 1}
OK	18599-20-7	C(CBr)C(C(F)(F)Br)(F)F	{16: 4, 2: 2, 4: 2, 18: 2}
OK	18599-22-9	C=CC(C(F)(F)Br)(F)F	{16: 4, 18: 1, 4: 2, 5: 1, 6: 1}
OK	185996-33-2	CC1(OC[C@@H](O1)CC(=O)N)C	{1: 2, 2: 1, 11: 1, 12: 1, 13: 1, 23: 2, 24: 1, 30: 1}
OK	1860-13-5	CC[C@H]1OC[C@@H](O1)C	{1: 2, 2: 1, 11: 1, 12: 2, 23: 2}
OK	1860-21-5	CC(C)(C)OC(=O)C(Cl)(Cl)Cl	{1: 3, 4: 2, 28: 1, 17: 3}
OK	1860-26-0	CCCCC(CC)CN(CC(CC)CCCC)CC(CC)CCCC	{1: 6, 2: 15, 3: 3, 33: 1}
OK	1860-27-1	CCCCOC(C)C	{1: 3, 2: 3, 3: 1, 22: 1}
OK	1860-44-2	C(CCCCCCl)CCCCC(=O)O	{17: 1, 2: 10, 27: 1}
OK	18600-02-7	CCOC(=O)C1=C(OC2=C(C1(C)C)CCC(C2)C)C	{1: 5, 2: 1, 11: 3, 12: 1, 13: 1, 15: 4, 23: 1, 28: 1}
OK	18600-41-4	COCCCN.Cl	{1: 1, 2: 3, 30: 1, 22: 1, 17: 1}
OK	1861-21-8	CC(C)C1(C(=O)NC(=O)N(C1=O)C)CC=C	{32: 1, 1: 3, 2: 1, 3: 1, 5: 1, 6: 1, 33: 1, 13: 1, 25: 3}
OK	18610-33-8	CC=CC(C)Cl	{1: 2, 3: 1, 6: 2, 17: 1}
OK	1862-07-3	CN(C)CCCCCCO	{1: 2, 2: 6, 20: 1, 33: 1}
OK	18621-75-5	CC(=O)OCC=CCOC(=O)C	{1: 2, 2: 2, 28: 2, 6: 2}
OK	18621-76-6	C=CC(=O)OCC=CCOC(=O)C=C	{2: 2, 28: 2, 5: 2, 6: 4}
OK	18625-22-4	CC(C)C[C@H](C(=O)NCC(=O)NCC(=O)O)N	{1: 2, 2: 3, 3: 2, 24: 2, 27: 1, 30: 1, 31: 2}
OK	18631-83-9	CC=C1CC1	{1: 1, 11: 2, 6: 1, 15: 1}
OK	18631-84-0	CC1CC1=C	{1: 1, 11: 1, 12: 1, 5: 1, 15: 1}
OK	18633-25-5	CCCCCCCCCCCCCC1CO1	{1: 1, 2: 12, 11: 1, 12: 1, 23: 1}
OK	18636-91-4	CN(C)C1CCCC1	{1: 2, 11: 4, 12: 1, 33: 1}
OK	18636-94-7	CCC(CC)N(C)C	{1: 4, 2: 2, 3: 1, 33: 1}
OK	18641-57-1	CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC	{1: 3, 2: 62, 3: 1, 28: 3}
OK	18641-70-8	CCC(C)C(=O)C(C)C	{24: 1, 1: 4, 2: 1, 3: 2}
OK	18641-71-9	CCCC(C)C(=O)C(C)C	{24: 1, 1: 4, 2: 2, 3: 2}
OK	18641-81-1	CCC(C)OC(C)C	{1: 4, 2: 1, 3: 2, 22: 1}
OK	18641-82-2	CCCCCOCCC	{1: 2, 2: 6, 22: 1}
OK	18664-94-3	C(CCOCCC#N)COCCC#N	{2: 8, 37: 2, 22: 2}
OK	18668-68-3	C=C=CCBr	{8: 1, 2: 1, 18: 1, 5: 1, 6: 1}
OK	1867-95-4	CCCCCCCCOC(=O)C(C(F)(F)F)(F)F	{16: 5, 1: 1, 2: 7, 4: 2, 28: 1}
OK	18675-20-2	CCCCC(C)CC(C)(C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	18675-24-6	CCCCCCCCC(C)CO	{1: 2, 2: 8, 3: 1, 20: 1}
OK	18675-27-9	CC1CCC(=CC1O)C(C)C	{1: 3, 3: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 1}
OK	18679-18-0	CCCCCC=CCC1CCC(=O)O1	{1: 1, 2: 5, 6: 2, 11: 2, 12: 1, 28: 1}
OK	18679-48-6	CC1(C2CCC(O1)(C(C2)O)C)C	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1, 23: 1}
OK	1868-53-7	C(F)(Br)Br	{16: 1, 18: 2, 3: 1}
OK	18680-27-8	C[C@@]1([C@H]2C[C@H](C2(C)C)C[C@H]1O)O	{1: 3, 11: 2, 12: 3, 13: 2, 20: 2}
OK	186817-74-3	CCC(C)OC(=O)[C@H](C)O	{1: 3, 2: 1, 3: 2, 20: 1, 28: 1}
OK	18684-63-4	C1CC2CCC1CC2O	{20: 1, 11: 5, 12: 3}
OK	1871-52-9	C1CC=CC=CC=C1	{11: 2, 14: 6}
OK	1871-57-4	C=C(CCl)CCl	{17: 2, 2: 2, 5: 1, 7: 1}
OK	1871-58-5	CC(CCl)(CCl)Cl	{1: 1, 2: 2, 4: 1, 17: 3}
OK	1871-67-6	CCCCCC=CC(=O)O	{1: 1, 2: 4, 27: 1, 6: 2}
OK	1871-72-3	CC(CBr)F	{16: 1, 1: 1, 2: 1, 3: 1, 18: 1}
OK	1871-73-4	CCC(CBr)F	{16: 1, 1: 1, 2: 2, 3: 1, 18: 1}
OK	1871-89-2	C(CO)NC(=O)C(=O)NCCO	{24: 2, 2: 4, 20: 2, 31: 2}
OK	1871-96-1	C(CCCCC#N)CCCC#N	{2: 8, 37: 2}
OK	18715-02-1	C1C=CCOO1	{11: 2, 14: 2, 23: 2}
OK	18719-14-7	CC(=O)SCCN(C)C	{24: 1, 1: 3, 2: 2, 40: 1, 33: 1}
OK	18719-43-2	CCOC(=O)C(CCCCl)C(=O)OCC	{1: 2, 2: 5, 3: 1, 28: 2, 17: 1}
OK	18719-58-9	C(CCl)OC(OCCCl)OCCCl	{17: 3, 2: 6, 3: 1, 22: 3}
OK	18720-30-4	C1CC2(CCC1C2)C(=O)O	{27: 1, 11: 5, 12: 1, 13: 1}
OK	18720-62-2	CCCCC(C(C)C)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	18720-65-5	CCC(C)CC(CC)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	18720-66-6	CCC(CCC(C)C)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	18729-48-1	CC1CCC(C1)O	{1: 1, 11: 3, 12: 2, 20: 1}
OK	1873-25-2	CCC(CCl)O	{1: 1, 2: 2, 3: 1, 20: 1, 17: 1}
OK	1873-29-6	CC(C)CN=C=O	{1: 2, 2: 1, 3: 1, 8: 1, 34: 1, 29: 1}
OK	18736-95-3	CC#CC1CCCCC1	{1: 1, 10: 2, 11: 5, 12: 1}
OK	18738-11-9	CCCCCC[C@H](C/C=C\CCCCCCCC(=O)O)O.C(CO)N	{1: 1, 2: 15, 3: 1, 6: 2, 20: 2, 27: 1, 30: 1}
OK	1874-62-0	CCOCC(CO)O	{1: 1, 2: 3, 3: 1, 20: 2, 22: 1}
OK	18742-02-4	C1COC(O1)CCBr	{2: 2, 11: 2, 12: 1, 18: 1, 23: 2}
OK	18747-42-7	CC(=O)CC1CCCCN1C	{1: 2, 2: 1, 33: 1, 11: 4, 12: 1, 24: 1}
OK	18755-31-2	CCCCCCC(CCO)CO	{1: 1, 2: 8, 3: 1, 20: 2}
OK	18755-33-4	CCCCCC(CCC#N)(C(=O)OCC)C(=O)OCC	{1: 3, 2: 8, 4: 1, 37: 1, 28: 2}
OK	18760-79-7	CN(C)C1CCCC1O	{1: 2, 11: 3, 12: 2, 20: 1, 33: 1}
OK	18774-85-1	CCCCCCN(C(=O)N)N=O	{1: 1, 2: 5, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	187753-13-5	CC(C)(C)OC(=O)N1CCC(CC1C(=O)OC)O	{1: 4, 4: 1, 33: 1, 11: 3, 12: 2, 20: 1, 28: 2}
OK	1878-18-8	CCC(C)CS	{1: 2, 2: 2, 3: 1, 39: 1}
OK	18787-63-8	CCCCCCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 13}
OK	18787-64-9	CCCCCCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 13}
OK	18787-66-1	CCCCCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 12}
OK	1879-06-7	CC1CCC(CC1)C(=O)C	{24: 1, 1: 2, 11: 4, 12: 2}
OK	18791-02-1	C(C(C(=O)Cl)Br)Br	{24: 1, 17: 1, 2: 1, 3: 1, 18: 2}
OK	18794-74-6	CCCCCCCCCCCCCCCCCCOCC(COCCCCCCCCCCCCCCCCCC)O	{1: 2, 2: 36, 3: 1, 20: 1, 22: 2}
OK	18794-84-8	CC(=CCC/C(=C/CCC(=C)C=C)/C)C	{1: 3, 2: 4, 5: 2, 6: 3, 7: 3}
OK	18796-02-6	CC1=[N+](C(N(C1(C)C)O)(C)C)[O-]	{1: 5, 33: 2, 13: 2, 15: 1, 20: 1, 29: 1}
OK	18796-04-8	CC(COCC(CCl)O)OCC(CCl)O	{1: 1, 2: 5, 3: 3, 17: 2, 20: 2, 22: 2}
OK	18803-78-6	CCCCCCCCCOC(=O)CCCCCCCC(=O)OCCCCCCCCC	{1: 2, 2: 23, 28: 2}
OK	18805-25-9	CN=C(SC)SC	{40: 2, 1: 3, 34: 1, 7: 1}
OK	1882-42-4	CC(C)(C)C1CCNCC1	{32: 1, 1: 3, 11: 4, 4: 1, 12: 1}
OK	18820-82-1	C1=CC=NC=C1.Br	{18: 1, 35: 1, 14: 5}
OK	18829-55-5	CCCC/C=C/C=O	{1: 1, 2: 3, 26: 1, 6: 2}
OK	18829-56-6	CCCCCCC=CC=O	{1: 1, 2: 5, 26: 1, 6: 2}
OK	18835-02-4	CCOC(=O)CC(C(=O)C)C(=O)C	{24: 2, 1: 3, 2: 2, 3: 1, 28: 1}
OK	18835-32-0	CCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 20, 5: 1, 6: 1}
OK	18835-33-1	CCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 23, 5: 1, 6: 1}
OK	18835-34-2	CCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 25, 5: 1, 6: 1}
OK	18840-45-4	CC(C)([C@H](C(=O)O)N)SSC[C@@H](C(=O)O)N	{1: 2, 2: 1, 3: 2, 4: 1, 40: 2, 27: 2, 30: 2}
OK	1885-48-9	C(C(F)(F)F)OC(F)F	{16: 5, 2: 1, 3: 1, 4: 1, 22: 1}
OK	18854-31-4	CCCOCCOCC	{1: 2, 2: 5, 22: 2}
OK	18854-51-8	CCCCOCCOCC=C	{1: 1, 2: 6, 22: 2, 5: 1, 6: 1}
OK	18854-56-3	CCCOCCOCCC	{1: 2, 2: 6, 22: 2}
OK	18854-58-5	CCCCOCCOCCC	{1: 2, 2: 7, 22: 2}
OK	18856-68-3	CCOC(=O)C(=CN(C)C)C(=O)OCC	{1: 4, 2: 2, 6: 1, 33: 1, 7: 1, 28: 2}
OK	188570-78-7	CC/C=C\CCOC(=O)C1CC1	{1: 1, 2: 3, 6: 2, 11: 2, 12: 1, 28: 1}
OK	18860-95-2	C/C(=C\CBr)/CBr	{1: 1, 2: 2, 18: 2, 6: 1, 7: 1}
OK	18866-73-4	C(C=CCBr)Br	{2: 2, 18: 2, 6: 2}
OK	188669-42-3	CCCC(C)(C#N)N=NC(C)(CC)C#N	{1: 4, 2: 3, 4: 2, 34: 2, 37: 2}
OK	18871-66-4	CC(N(C)C)(OC)OC	{1: 5, 4: 1, 22: 2, 33: 1}
OK	1888-57-9	CC(C)CC(=O)C(C)C	{24: 1, 1: 4, 2: 1, 3: 2}
OK	1888-71-7	C(=C(Cl)Cl)(C(Cl)(Cl)Cl)Cl	{17: 6, 4: 1, 7: 2}
OK	1888-85-3	CCC(C)OC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 22: 1}
OK	1888-89-7	C1C(O1)CCC2CO2	{2: 2, 11: 2, 12: 2, 23: 2}
OK	1888-90-0	C=C1CCCC=C1	{11: 3, 5: 1, 14: 2, 15: 1}
OK	1888-91-1	CC(=O)N1CCCCCC1=O	{24: 1, 1: 1, 11: 5, 33: 1, 25: 1}
OK	1888-94-4	CC(=C)C(=O)OCCCl	{1: 1, 2: 2, 5: 1, 7: 1, 17: 1, 28: 1}
OK	18883-66-4	CN(C(=O)NC1C(C(C(OC1O)CO)O)O)N=O	{1: 1, 2: 1, 33: 1, 12: 5, 34: 1, 20: 4, 23: 1, 24: 1, 29: 1, 31: 1}
OK	18888-46-5	CC(C)SC=C	{40: 1, 1: 2, 3: 1, 5: 1, 6: 1}
OK	1889-08-3	CN1CCCCCCC1=O	{1: 1, 11: 6, 33: 1, 25: 1}
OK	1889-96-9	CC1(C(=C(C(=O)C1(C)C)O)O)C	{1: 4, 25: 1, 20: 2, 13: 2, 15: 2}
OK	1889-98-1	CC1(C(=O)C(=O)C(=O)C1(C)C)C	{1: 4, 13: 2, 25: 3}
OK	1889-99-2	CC1(C(=C(C(=O)C1(C)C)O)Br)C	{1: 4, 13: 2, 15: 2, 18: 1, 20: 1, 25: 1}
OK	18899-19-9	CCCCCCCCC=CCCCCCC	{1: 2, 2: 12, 6: 2}
OK	18899-23-5	CCCCCCCCCCC=CCCCCCC	{1: 2, 2: 14, 6: 2}
OK	1890-04-6	C1C(C=CC1Br)Br	{18: 2, 11: 1, 12: 2, 14: 2}
OK	189047-80-1	CCCCOCC(C)OCC(C)OC(=O)CCCCC(=O)OC(C)COC(C)COCCCC	{1: 6, 2: 14, 3: 4, 28: 2, 22: 4}
OK	18908-66-2	CCCCC(CC)CBr	{1: 2, 2: 5, 3: 1, 18: 1}
OK	1891-45-8	CC1=C[C@H]2[C@@H](CC1)[C@](CCCC2(C)C)(C)O	{1: 4, 11: 5, 12: 2, 13: 2, 14: 1, 15: 1, 20: 1}
OK	18910-61-7	CCCCCN(C)N/N=C\1/C(=NC=N1)C(=O)N	{1: 2, 2: 4, 35: 2, 33: 1, 34: 1, 14: 1, 15: 2, 24: 1, 30: 1, 31: 1}
OK	18912-80-6	CC(C)COCCOCCO	{1: 2, 2: 5, 3: 1, 20: 1, 22: 2}
OK	18912-81-7	CCCCCOCCOCCO	{1: 1, 2: 8, 20: 1, 22: 2}
OK	18913-31-0	C=C=CCO	{8: 1, 2: 1, 20: 1, 5: 1, 6: 1}
OK	18913-35-4	COC(=O)C=C=C	{8: 1, 1: 1, 28: 1, 5: 1, 6: 1}
OK	1892-29-1	C(CSSCCO)O	{40: 2, 2: 4, 20: 2}
OK	1892-57-5	CCN=C=NCCCN(C)C	{8: 1, 1: 3, 2: 4, 34: 2, 33: 1}
OK	18922-69-5	CN1N=CC=N1	{1: 1, 35: 2, 14: 2, 33: 1}
OK	18928-00-2	CC(=O)N(CCCC1C(=O)NC(C(=O)N1)CCCN(C(=O)C)O)O	{32: 2, 1: 2, 2: 6, 33: 2, 12: 2, 20: 2, 24: 2, 25: 2}
OK	18932-14-4	CCCCC(C)CC(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	189321-65-1	CC(C)(C)OC(=O)NC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O	{1: 6, 4: 2, 33: 1, 11: 4, 13: 1, 27: 1, 28: 2, 31: 1}
OK	18933-92-1	CC(C)CC(C)OC(=O)C=C	{1: 3, 2: 1, 3: 2, 5: 1, 6: 1, 28: 1}
OK	18936-17-9	CCC(C)C#N	{1: 2, 2: 1, 3: 1, 37: 1}
OK	18937-78-5	CCCCC#CC(=O)OC	{1: 2, 2: 3, 28: 1, 10: 2}
OK	18937-79-6	CCCC#CC(=O)OC	{1: 2, 2: 2, 28: 1, 10: 2}
OK	18941-94-1	CCOC(=O)C1CC1=C	{1: 1, 2: 1, 5: 1, 11: 1, 12: 1, 15: 1, 28: 1}
OK	189440-77-5	COC(=O)CC/C=C/CC=C	{1: 1, 2: 3, 28: 1, 5: 1, 6: 3}
OK	18951-57-0	CCOC=CC(C)(C)C	{1: 4, 2: 1, 4: 1, 22: 1, 6: 2}
OK	18951-85-4	C[C@H](CCC=C(C)C)CC(=O)O	{1: 3, 2: 3, 3: 1, 6: 1, 7: 1, 27: 1}
OK	18963-00-3	C(C(CCl)(CCl)Cl)Cl	{17: 4, 2: 3, 4: 1}
OK	18963-01-4	CC(CCl)(C(Cl)Cl)Cl	{1: 1, 2: 1, 3: 1, 4: 1, 17: 4}
OK	1898-13-1	C/C/1=C\CC/C(=C/C/C=C(\C=C\C(CC1)C(C)C)/C)/C	{1: 5, 3: 1, 11: 5, 12: 1, 14: 5, 15: 3}
OK	1899-05-4	C1CCCCCSCCCCOC(=O)CCCC1	{41: 1, 11: 14, 28: 1}
OK	18991-98-5	CCCCOC(=O)CBr	{1: 1, 2: 4, 28: 1, 18: 1}
OK	18991-99-6	CCCCCCCOC(=O)CBr	{1: 1, 2: 7, 28: 1, 18: 1}
OK	18992-01-3	CCCCCCCCCCCCCCOC(=O)CBr	{1: 1, 2: 14, 28: 1, 18: 1}
OK	18993-09-4	CC(=O)CCCCCCCCC(=O)OC	{24: 1, 1: 2, 2: 8, 28: 1}
OK	18997-19-8	CC(C)(C)C(=O)OCCl	{1: 3, 2: 1, 4: 1, 28: 1, 17: 1}
OK	18999-28-5	CCCCC=CC(=O)O	{1: 1, 2: 3, 27: 1, 6: 2}
OK	1900-58-9	CCOC1(CCC(CC1)C(C)(C)C)OCC	{1: 5, 2: 2, 4: 1, 11: 4, 12: 1, 13: 1, 22: 2}
OK	19005-04-0	C1CC2C=CC1C(=C2C#N)C#N	{11: 2, 12: 2, 37: 2, 14: 2, 15: 2}
OK	19006-63-4	CCCN1C=CC=CC1=O	{1: 1, 2: 2, 33: 1, 14: 4, 25: 1}
OK	19009-39-3	CC(C)N(C(C)C)C(=O)Cl	{24: 1, 1: 4, 3: 2, 33: 1, 17: 1}
OK	19009-56-4	CCCCCCCCC(C)C=O	{1: 2, 2: 7, 3: 1, 26: 1}
OK	19013-37-7	CC(CC(=O)OC)CC(=O)OC	{1: 3, 2: 2, 3: 1, 28: 2}
OK	19026-91-6	C1=CC=C2C=CC=CC(=C1)C2(F)F	{16: 2, 13: 1, 14: 8, 15: 2}
OK	1903-22-6	CCOC(=O)C=C1CCCC1	{1: 1, 2: 1, 6: 1, 11: 4, 15: 1, 28: 1}
OK	19036-43-2	CC(C)(CN)C(=O)O	{1: 2, 2: 1, 27: 1, 4: 1, 30: 1}
OK	19037-72-0	CC1(CC=CC1)C	{1: 2, 11: 2, 13: 1, 14: 2}
OK	19059-14-4	N(=O)O[O-]	{34: 1, 29: 2, 22: 1}
OK	19059-68-8	CC(C)(CN(C)C)CO	{1: 4, 2: 2, 4: 1, 20: 1, 33: 1}
OK	1906-79-2	CC[N+]1=CC=CC=C1.[Br-]	{1: 1, 2: 1, 18: 1, 14: 5, 33: 1}
OK	1906-82-7	CCOC(=O)CNC(=O)C	{24: 1, 1: 2, 2: 2, 28: 1, 31: 1}
OK	19060-10-7	COC(CC=O)OC	{1: 2, 2: 1, 3: 1, 26: 1, 22: 2}
OK	19060-15-2	COC(CCCN)OC	{1: 2, 2: 3, 3: 1, 30: 1, 22: 2}
OK	19062-98-7	CCCC[O]	{1: 1, 2: 3, 29: 1}
OK	19069-48-8	CC1CCC2C13CC=C(C(C3)C2(C)C)C	{1: 4, 11: 4, 12: 3, 13: 2, 14: 1, 15: 1}
OK	1907-46-6	CCC(CC)(CC=C)O	{1: 2, 2: 3, 4: 1, 5: 1, 6: 1, 20: 1}
OK	19074-24-9	CCCCC(CC)COC(=O)CCCCCCCCCCC(=O)OCC(CC)CCCC	{1: 4, 2: 20, 3: 2, 28: 2}
OK	19074-25-0	C1CC23CCC2(C1)C3	{11: 6, 13: 2}
OK	190774-49-3	C#CCCOC(=O)Cl	{9: 1, 2: 2, 28: 1, 10: 1, 17: 1}
OK	19078-32-1	CC1=NN=C(C1(C)C)C	{1: 4, 35: 2, 13: 1, 15: 2}
OK	19078-35-4	CC1CCC23C1CC(C2(C)C)CCC3C	{1: 4, 11: 5, 12: 4, 13: 2}
OK	19078-97-8	CCCCC(=O)C(C)(C)C	{24: 1, 1: 4, 2: 3, 4: 1}
OK	19079-66-4	CCCCC(C(=O)O)NC(=O)C(C)N	{1: 2, 2: 3, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	1908-11-8	CCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 13, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	19089-47-5	CCOC(C)CO	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	19089-92-0	CCCCCCOC(=O)C=CC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	19090-03-0	C1CC(=O)CSC1	{25: 1, 11: 4, 41: 1}
OK	19091-98-6	CCN[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 31: 1}
OK	19093-20-0	CCC=CCCC(=O)C	{24: 1, 1: 2, 2: 3, 6: 2}
OK	19102-90-0	COC(=O)CCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 14, 28: 2}
OK	19105-63-6	CCN1C(=O)CC2(C1=O)CCN(CC2)C.Br	{1: 2, 2: 1, 33: 2, 11: 5, 13: 1, 18: 1, 25: 2}
OK	1911-01-9	CN1CCN(C1=C2N(CCN2C)C)C	{1: 4, 11: 4, 33: 4, 15: 2}
OK	19132-06-0	C[C@@H]([C@H](C)O)O	{1: 2, 3: 2, 20: 2}
OK	19139-31-2	CCCCCCOC(=O)C=CC(=O)OCCCCCC	{1: 2, 2: 10, 28: 2, 6: 2}
OK	191403-65-3	CC(=O)O[C@H]1CC(=O)OC1	{1: 1, 11: 2, 12: 1, 28: 2}
OK	19145-91-6	CC1CC(OC(O1)C)C	{1: 3, 11: 1, 12: 3, 23: 2}
OK	19145-96-1	CCOC(=O)C1CCC(CC1)C(=O)OCC	{1: 2, 2: 2, 11: 4, 12: 2, 28: 2}
OK	19149-77-0	C(CCl)SSSCCCl	{40: 3, 17: 2, 2: 4}
OK	19150-21-1	CCCCCCC=CCC	{1: 2, 2: 6, 6: 2}
OK	19155-35-2	C=CCSCCCl	{40: 1, 17: 1, 2: 3, 5: 1, 6: 1}
OK	19155-54-5	CC(C)(CN(C)C)[N+](=O)[O-]	{1: 4, 2: 1, 4: 1, 38: 1, 33: 1}
OK	19184-10-2	C/C=C\F	{16: 1, 1: 1, 6: 2}
OK	19184-65-7	C(C(CO)(CO)CBr)O	{20: 3, 2: 4, 4: 1, 18: 1}
OK	19184-67-9	CC(C)(CC(=O)OC)CC(=O)OC	{1: 4, 2: 2, 4: 1, 28: 2}
OK	19192-82-6	C12C3C1C(=O)OC23	{28: 1, 12: 4}
OK	1920-21-4	CC1=COC(CC1)(C)C=O	{1: 2, 11: 2, 13: 1, 14: 1, 15: 1, 23: 1, 26: 1}
OK	19201-34-4	CC(OC(C)C(=O)O)C(=O)O	{27: 2, 1: 2, 3: 2, 22: 1}
OK	19201-36-6	C=CC(=O)OCCOC(=O)C=CC(=O)O	{2: 2, 27: 1, 28: 2, 5: 1, 6: 3}
OK	19202-92-7	CC1CC2C3C(C4(C1C=CC4=O)C)OC(C3(C(=O)O2)C)(C)O	{1: 4, 11: 1, 12: 5, 13: 3, 14: 2, 20: 1, 23: 1, 25: 1, 28: 1}
OK	1921-70-6	CC(C)CCCC(C)CCCC(C)CCCC(C)C	{1: 6, 2: 9, 3: 4}
OK	19213-72-0	CCOC(=O)N1C=CN=C1	{1: 1, 2: 1, 35: 1, 33: 1, 14: 3, 28: 1}
OK	19218-94-1	CCCCCCCCCCCCCCI	{1: 1, 2: 13, 19: 1}
OK	19219-01-3	C1CC1C(C#N)(C2CC2)C(C#N)(C3CC3)C4CC4	{12: 4, 11: 8, 4: 2, 37: 2}
OK	1922-36-7	CC(=O)C1C(CC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)C(=O)N	{1: 4, 11: 7, 12: 6, 13: 2, 14: 1, 15: 1, 24: 2, 28: 1, 30: 1}
OK	192230-35-6	CCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCC.CC(COC(=O)C(=C)C)O.CC(=O)OC=C	{1: 5, 2: 15, 3: 1, 5: 2, 6: 3, 7: 1, 20: 1, 28: 4}
OK	19230-81-0	CN1CC(=O)N=C1N.Cl	{1: 1, 35: 1, 33: 1, 11: 1, 15: 1, 17: 1, 25: 1, 30: 1}
OK	19234-20-9	CC(C)OCCOC(=O)C	{1: 3, 2: 2, 3: 1, 28: 1, 22: 1}
OK	1924-47-6	CC(CNCC(C)([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 2, 4: 2, 38: 4, 31: 1}
OK	19244-91-8	CC(=CN1CCN(CC1)C=C(C)C)C	{1: 4, 11: 4, 33: 2, 6: 2, 7: 2}
OK	19244-98-5	C(=N)(N)N.Br	{18: 1, 36: 1, 30: 2, 7: 1}
OK	19245-70-6	CC(C)(C)C1CCC(=C)C(C1)O	{1: 3, 4: 1, 5: 1, 11: 3, 12: 2, 15: 1, 20: 1}
OK	19245-85-3	C[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)NC(=O)C	{24: 3, 1: 4, 3: 3, 27: 1, 31: 3}
OK	19246-18-5	C([C@@H](C(=O)NCC(=O)O)N)S	{2: 2, 3: 1, 39: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	19247-05-3	C(C(=O)O)N(CC(=O)O)N	{33: 1, 2: 2, 27: 2, 30: 1}
OK	19248-94-3	CC=C(C)COC(=O)C	{1: 3, 2: 1, 28: 1, 6: 1, 7: 1}
OK	19249-04-8	CN(C)CCOC(=O)CCC(=O)OCCN(C)C	{1: 4, 2: 6, 28: 2, 33: 2}
OK	19264-94-9	CCC(C)(C)CCO	{1: 3, 2: 3, 4: 1, 20: 1}
OK	19269-28-4	CCCC(C)CC=O	{1: 2, 2: 3, 3: 1, 26: 1}
OK	19269-85-3	S1SSS1	{41: 4}
OK	1927-25-9	C(CO)C(C(=O)O)N	{27: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	1927-59-9	CC(C)(C)OC1CCCO1	{1: 3, 4: 1, 11: 3, 12: 1, 22: 1, 23: 1}
OK	1927-63-5	CCCCCCOC1CCCCO1	{1: 1, 2: 5, 11: 4, 12: 1, 22: 1, 23: 1}
OK	1927-68-0	CCCCOC1CCCCO1	{1: 1, 2: 3, 11: 4, 12: 1, 22: 1, 23: 1}
OK	1927-70-4	CC(C)OC1CCCCO1	{1: 2, 3: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	1928-30-9	CCCCCCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 20, 3: 1}
OK	19284-67-4	CC(C)SC=C(Cl)Cl	{1: 2, 3: 1, 6: 1, 7: 1, 40: 1, 17: 2}
OK	1929-77-7	CCCN(CCC)C(=O)SCCC	{24: 1, 1: 3, 2: 6, 40: 1, 33: 1}
OK	19309-63-8	CC(C)(N(F)F)N(F)F	{16: 4, 1: 2, 4: 1, 33: 2}
OK	1931-60-8	C=C(CC(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 2: 1, 5: 1, 7: 1}
OK	1931-62-0	CC(C)(C)OOC(=O)C=CC(=O)O	{1: 3, 4: 1, 6: 2, 22: 1, 27: 1, 28: 1}
OK	1931-63-1	COC(=O)CCCCCCCC=O	{1: 1, 2: 7, 28: 1, 26: 1}
OK	1931-83-5	CC(C)CC(C)(C)COC(=O)CCCCCCCC(=O)OCC(C)(C)CC(C)C	{1: 8, 2: 11, 3: 2, 4: 2, 28: 2}
OK	19313-57-6	CCCCCCCCCCSCCCC	{40: 1, 1: 2, 2: 12}
OK	19313-61-2	CCCCCCCCCCSCC	{40: 1, 1: 2, 2: 10}
OK	19317-11-4	CC(=CCCC(=CCCC(=CC=O)C)C)C	{1: 4, 2: 4, 26: 1, 6: 3, 7: 3}
OK	1932-04-3	C1CCN(CC1)CCN2CCCCC2	{33: 2, 2: 2, 11: 10}
OK	1932-92-9	CCC(=O)OCC#C	{1: 1, 2: 2, 28: 1, 10: 1, 9: 1}
OK	19322-27-1	CC1=C(C(=O)CO1)O	{1: 1, 11: 1, 15: 2, 20: 1, 23: 1, 25: 1}
OK	19327-37-8	CCCCCCCCOCCOCCO	{1: 1, 2: 11, 20: 1, 22: 2}
OK	19327-38-9	CCCCCCCCOCCOCCOCCO	{1: 1, 2: 13, 20: 1, 22: 3}
OK	19327-39-0	CCCCCCCCOCCOCCOCCOCCO	{1: 1, 2: 15, 20: 1, 22: 4}
OK	19329-89-6	CC(C)CCOC(=O)C(C)O	{1: 3, 2: 2, 3: 2, 20: 1, 28: 1}
OK	193338-30-6	CC1=CC=C([C@H]([C@H]1O)O)C(=O)O	{1: 1, 12: 2, 14: 2, 15: 2, 20: 2, 27: 1}
OK	193338-31-7	C1=C([C@H]([C@H](C(=C1)Cl)O)O)C(=O)O	{12: 2, 14: 2, 15: 2, 17: 1, 20: 2, 27: 1}
OK	19340-91-1	CCCC(C#N)N(CC)CC	{1: 3, 2: 4, 3: 1, 37: 1, 33: 1}
OK	19347-73-0	C(CCC(=O)Cl)CCCl	{24: 1, 17: 2, 2: 5}
OK	19351-18-9	CC1(NCCS1)C	{32: 1, 1: 2, 11: 2, 13: 1, 41: 1}
OK	19352-85-3	C=CC#CN1CCCC1	{33: 1, 10: 2, 11: 4, 5: 1, 6: 1}
OK	19353-21-0	CC(C)C(C)CC=O	{1: 3, 2: 1, 3: 2, 26: 1}
OK	19354-27-9	COCC1CCCO1	{1: 1, 2: 1, 11: 3, 12: 1, 22: 1, 23: 1}
OK	19355-69-2	CC(C)(C#N)N	{1: 2, 4: 1, 37: 1, 30: 1}
OK	19356-22-0	CCC=CCC=CCC=CCCCCCCCC(=O)OO	{1: 1, 2: 10, 20: 1, 6: 6, 28: 1}
OK	1936-40-9	CC(CN(CCCl)CCCl)Cl.Cl	{1: 1, 2: 5, 3: 1, 33: 1, 17: 4}
OK	19362-94-8	CC(C(=C)C#N)O	{1: 1, 3: 1, 37: 1, 7: 1, 20: 1, 5: 1}
OK	1937-19-5	C(=NN)(N)N.Cl	{17: 1, 34: 1, 30: 3, 7: 1}
OK	1937-54-8	CC(C)C(CCC(=O)C)C=CC(=C)C	{1: 4, 2: 2, 3: 2, 5: 1, 6: 2, 7: 1, 24: 1}
OK	1937-62-8	CCCCCCCCC=CCCCCCCCC(=O)OC	{1: 2, 2: 14, 28: 1, 6: 2}
OK	1937-63-9	CCCCCCC=CCCCCCCCCCC(=O)OC	{1: 2, 2: 14, 28: 1, 6: 2}
OK	19377-95-8	CC1(CC2(CC2(C1=O)C(C)(C)C)C(C)(C)C)C	{1: 8, 11: 2, 4: 2, 13: 3, 25: 1}
OK	19386-05-1	C=C1CC2CCC1C=C2	{11: 3, 12: 2, 5: 1, 14: 2, 15: 1}
OK	19386-06-2	CCOC(=O)CC(=O)C12CC3CC(C1)CC(C3)C2	{1: 1, 2: 2, 11: 6, 12: 3, 13: 1, 24: 1, 28: 1}
OK	19393-45-4	COC(=O)/C=C(\C(=O)OC)/Cl	{1: 2, 17: 1, 28: 2, 6: 1, 7: 1}
OK	19396-83-9	C1CC2CC1CC2C=O	{26: 1, 11: 4, 12: 3}
OK	19398-47-1	C(CBr)C(CBr)O	{2: 3, 3: 1, 20: 1, 18: 2}
OK	19398-48-2	CC(=C(C)Br)Br	{1: 2, 18: 2, 7: 2}
OK	19398-53-9	CC(CC(C)Br)Br	{1: 2, 2: 1, 3: 2, 18: 2}
OK	19398-75-5	CCC1CCC(C1)CC	{1: 2, 2: 2, 11: 3, 12: 2}
OK	19398-77-7	CCC(CC)C(CC)CC	{1: 4, 2: 4, 3: 2}
OK	19398-78-8	CCC(CC)C(CC)(CC)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	19398-85-7	CC=CCCCCC=CC	{1: 2, 2: 4, 6: 4}
OK	19398-88-0	CCCCCC=CCCC	{1: 2, 2: 6, 6: 2}
OK	19398-89-1	CCCCC/C=C/CCC	{1: 2, 2: 6, 6: 2}
OK	1940-18-7	CCC1(CCCCC1)O	{1: 1, 2: 1, 11: 5, 20: 1, 13: 1}
OK	19403-24-8	CC1(CCC(N=N1)(C)C)C	{1: 4, 11: 2, 13: 2, 35: 2}
OK	19408-46-9	CC1C(CC(C(O1)OC2C(C(C(C(C2O)O)O)O)O)N)N=C(C(=O)O)N	{1: 1, 34: 1, 7: 1, 11: 1, 12: 10, 20: 5, 22: 1, 23: 1, 27: 1, 30: 2}
OK	1941-52-2	CCSC(C(C(C(C(CO)O)O)O)O)SCC	{40: 2, 1: 2, 2: 3, 3: 5, 20: 5}
OK	1941-79-3	C(CCCC(=O)OO)CCCC(=O)OO	{28: 2, 2: 7, 20: 2}
OK	19411-41-7	CC(C)C(C)(C)C(C)O	{1: 5, 3: 2, 4: 1, 20: 1}
OK	19415-92-0	C=CC(=O)NCN1CCN(C1=O)CNC(=O)C=C	{33: 2, 2: 2, 5: 2, 6: 2, 11: 2, 24: 2, 25: 1, 31: 2}
OK	1942-45-6	CCCC#CCCC	{1: 2, 2: 4, 10: 2}
OK	1942-46-7	CCCCC#CCCCC	{1: 2, 2: 6, 10: 2}
OK	1942-52-5	CCN(CC)CCS.Cl	{1: 2, 2: 4, 39: 1, 33: 1, 17: 1}
OK	194205-01-1	CC(=O)N(C)[C@@H]1[C@H]2CN3[C@@H]1[C@@H](O2)C=C3	{1: 2, 33: 2, 11: 1, 12: 4, 14: 2, 23: 1, 24: 1}
OK	19424-34-1	CC(C)CCCC#N	{1: 2, 2: 3, 3: 1, 37: 1}
OK	1943-08-4	CCCCCCCCNC(=O)NCCCCCCCC	{24: 1, 1: 2, 2: 14, 31: 2}
OK	1943-09-5	CCCCCCCCCCN(CCCCCCCCCC)C(=O)N	{24: 1, 1: 2, 2: 18, 30: 1, 33: 1}
OK	1943-16-4	C([N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])Cl	{17: 1, 4: 1, 38: 3}
OK	1943-83-5	C(CCl)N=C=O	{8: 1, 17: 1, 2: 2, 34: 1, 29: 1}
OK	1943-84-6	CCCCCCCCCCCCCCCCN=C=O	{8: 1, 1: 1, 2: 15, 34: 1, 29: 1}
OK	19430-93-4	C=CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 9, 4: 4, 5: 1, 6: 1}
OK	19434-65-2	C(CCl)C=O	{17: 1, 2: 2, 26: 1}
OK	19435-68-8	CCNCCCCNCC	{1: 2, 2: 6, 31: 2}
OK	19435-97-3	CC1=C[C@H]2[C@@H](CC[C@@]([C@H]2CC1)(C)O)C(C)C	{1: 4, 3: 1, 11: 4, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	19444-84-9	C1COC(=O)C1O	{20: 1, 11: 2, 12: 1, 28: 1}
OK	19445-25-1	OBr(=O)(=O)=O	{18: 1, 20: 1, 29: 3}
OK	19446-68-5	C1CC2C1C23CC3	{11: 4, 12: 2, 13: 1}
OK	19447-29-1	CCCCCCC#CC	{1: 2, 2: 5, 10: 2}
OK	19449-26-4	CN(C)C1OCCO1	{1: 2, 11: 2, 12: 1, 33: 1, 23: 2}
OK	1945-53-5	CC(C)C1=CC2=C(CC1)C3(CCCC(C3CC2)(C)C(=O)O)C	{1: 4, 3: 1, 11: 7, 12: 1, 13: 2, 14: 1, 15: 3, 27: 1}
OK	1945-91-1	CC(=O)OCC=COC(=O)C	{1: 2, 2: 1, 28: 2, 6: 2}
OK	1946-00-5	CC(=C)C1CCC(C(C1)O)(C)O	{1: 2, 5: 1, 7: 1, 11: 3, 12: 2, 13: 1, 20: 2}
OK	1946-82-3	CC(=O)N[C@@H](CCCCN)C(=O)O	{1: 1, 2: 4, 3: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	19461-38-2	CC[C@H](C)[C@@H](C(=O)O)NC(=O)CN	{1: 2, 2: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	19465-00-0	CC1(CCC1(C)C=C)C=C	{1: 2, 11: 2, 5: 2, 6: 2, 13: 2}
OK	19466-47-8	CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 9, 12: 6, 13: 2, 20: 1}
OK	1947-58-6	C(C(C(CO)Br)Br)O	{2: 2, 3: 2, 20: 2, 18: 2}
OK	19475-35-5	CN(C)CCCN(C)CCCN	{1: 3, 2: 6, 30: 1, 33: 2}
OK	19475-69-5	CN(C)CCCNCCCNCCCN	{1: 2, 2: 9, 33: 1, 30: 1, 31: 2}
OK	19477-24-8	CCC(C)CCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 7, 2: 16, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	1948-31-8	C[C@@H](C(=O)N[C@@H](C)C(=O)O)N	{1: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	19481-82-4	CC(C#N)Br	{1: 1, 18: 1, 3: 1, 37: 1}
OK	19482-57-6	CCCCC#CC(C)(C)C	{1: 4, 2: 3, 4: 1, 10: 2}
OK	19484-26-5	CCCCCCCCCCCCCS	{1: 1, 2: 12, 39: 1}
OK	19487-61-7	CCCCCCCC=CCOC(=O)C	{1: 2, 2: 7, 28: 1, 6: 2}
OK	19489-10-2	CC[C@@H]1CCC[C@@H](C1)C	{1: 2, 2: 1, 11: 4, 12: 2}
OK	1949-88-8	C([C@@H]([C@@H]([C@@H]([C@H](C=O)O)O)O)O)O	{2: 1, 3: 4, 20: 5, 26: 1}
OK	1949-89-9	C(C=O)[C@H]([C@H]([C@@H](CO)O)O)O	{2: 2, 3: 3, 20: 4, 26: 1}
OK	195065-80-6	CC12CCC(CC1O2)C(C)(C)OC(=O)C3CCC4C(C3)O4	{1: 3, 4: 1, 11: 6, 12: 5, 13: 1, 23: 2, 28: 1}
OK	1951-11-7	CC(CC(=O)Cl)Cl	{24: 1, 1: 1, 2: 1, 3: 1, 17: 2}
OK	1951-12-8	CC(CC(=O)O)Cl	{27: 1, 1: 1, 2: 1, 3: 1, 17: 1}
OK	1952-38-1	C1=C/C(=C/NCCO)/C(=O)C=C1	{2: 2, 6: 1, 14: 4, 15: 1, 20: 1, 25: 1, 31: 1}
OK	1952-67-6	CCC1(C(=O)NC(=O)NC1=O)CC=CC	{32: 2, 1: 2, 2: 2, 6: 2, 13: 1, 25: 3}
OK	19522-67-9	CC(C)NCCN	{1: 2, 2: 2, 3: 1, 30: 1, 31: 1}
OK	19522-69-1	CCCCNCCN	{1: 1, 2: 5, 30: 1, 31: 1}
OK	1953-02-2	CC(C(=O)NCC(=O)O)S	{1: 1, 2: 1, 3: 1, 39: 1, 24: 1, 27: 1, 31: 1}
OK	1953-33-9	CCCCC1C(=O)NC(=O)NC1=O	{32: 2, 1: 1, 2: 3, 12: 1, 25: 3}
OK	19539-78-7	C1=CC23C=CC=CC2(C=C1)C=C3	{13: 2, 14: 10}
OK	1954-28-5	C1C(O1)COCCOCCOCCOCC2CO2	{2: 8, 11: 2, 12: 2, 22: 4, 23: 2}
OK	19540-05-7	C1C2N1C2	{33: 1, 11: 2, 12: 1}
OK	19547-89-8	CCOC(=O)[C@H](CSC(=O)C)NC(=O)C	{1: 3, 2: 2, 3: 1, 40: 1, 24: 2, 28: 1, 31: 1}
OK	19549-70-3	CCCCC(C(C)(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	19549-71-4	CCCCC(C)(C(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	19549-72-5	CCCC(C)C(C(C)C)O	{1: 4, 2: 2, 3: 3, 20: 1}
OK	19549-73-6	CC(C)CCC(C(C)C)O	{1: 4, 2: 2, 3: 3, 20: 1}
OK	19549-74-7	CCC(C)CC(C)(CC)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	19549-77-0	CCCC(C)(CC(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	19549-79-2	CCC(C)C(C(C)CC)O	{1: 4, 2: 2, 3: 3, 20: 1}
OK	19549-80-5	CC(C)CC(C)CC(=O)C	{24: 1, 1: 4, 2: 2, 3: 2}
OK	19549-83-8	CC(C)CCC(=O)C(C)C	{24: 1, 1: 4, 2: 2, 3: 2}
OK	19549-84-9	CCC(C)C(=O)C(C)CC	{24: 1, 1: 4, 2: 2, 3: 2}
OK	19549-87-2	CCCC(C)CC(=C)C	{1: 3, 2: 3, 3: 1, 5: 1, 7: 1}
OK	19549-97-4	CC(C)CC#CC(C)C	{1: 4, 2: 1, 3: 2, 10: 2}
OK	19549-98-5	CC(C)CCC(C)(C#C)O	{1: 3, 2: 2, 3: 1, 4: 1, 9: 1, 10: 1, 20: 1}
OK	1955-45-9	CC1(COC1=O)C	{1: 2, 11: 1, 28: 1, 13: 1}
OK	19550-03-9	CCCC(C)C(C)(C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	19550-05-1	CCC(C)C(C)C(C)O	{1: 4, 2: 1, 3: 3, 20: 1}
OK	19550-07-3	CC(C)CC(C(C)C)O	{1: 4, 2: 1, 3: 3, 20: 1}
OK	19550-08-4	CCC(C)C(C)(CC)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	19550-10-8	CCC(C)C(C)C(=O)C	{24: 1, 1: 4, 2: 1, 3: 2}
OK	19550-14-2	CCC(=O)C(C)(C)CC	{24: 1, 1: 4, 2: 2, 4: 1}
OK	19550-30-2	CC(C)C(C)CO	{1: 3, 2: 1, 3: 2, 20: 1}
OK	19550-40-4	CC1CCC(C=C1)C	{1: 2, 11: 2, 12: 2, 14: 2}
OK	19550-46-0	CC1CCC(C1)(C)O	{1: 2, 11: 3, 12: 1, 13: 1, 20: 1}
OK	19550-48-2	CC1CC=C(C1)C	{1: 2, 11: 2, 12: 1, 14: 1, 15: 1}
OK	19550-56-2	CC(C)CCC#CCCC(C)C	{1: 4, 2: 4, 3: 2, 10: 2}
OK	19550-73-3	CC1CC(=O)CC1C	{1: 2, 11: 2, 12: 2, 25: 1}
OK	19550-75-5	CCCC=CC(C)(C)C	{1: 4, 2: 2, 4: 1, 6: 2}
OK	19550-82-4	CCC(C)C(=CC)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1}
OK	19550-83-5	CCC(C)(C)C=CC	{1: 4, 2: 1, 4: 1, 6: 2}
OK	19550-87-9	CC/C(=C(/C)\CC)/C	{1: 4, 2: 2, 7: 2}
OK	19550-89-1	CC(C)(C)C(CC=C)O	{1: 3, 2: 1, 3: 1, 4: 1, 5: 1, 6: 1, 20: 1}
OK	19550-90-4	CC(C)C(C)(CC=C)O	{1: 3, 2: 1, 3: 1, 4: 1, 5: 1, 6: 1, 20: 1}
OK	195835-96-2	C(CC=O)CCl	{17: 1, 2: 3, 26: 1}
OK	19594-40-2	CCCCCCCC(=O)CC(C)C	{24: 1, 1: 3, 2: 7, 3: 1}
OK	19596-07-7	C#CCCC#N	{9: 1, 2: 2, 10: 1, 37: 1}
OK	19600-63-6	C=CCCCCC1CO1	{2: 4, 5: 1, 6: 1, 11: 1, 12: 1, 23: 1}
OK	1961-77-9	CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=C(C4=CC(=O)CC[C@]34C)Cl)C)O	{1: 3, 11: 6, 12: 3, 13: 3, 14: 2, 15: 2, 17: 1, 20: 1, 24: 1, 25: 1}
OK	19615-27-1	CC(=O)N1CCCC=C1	{24: 1, 1: 1, 11: 3, 14: 2, 33: 1}
OK	19616-52-5	C1CC=C2NCCCN2C1	{32: 1, 33: 1, 11: 6, 14: 1, 15: 1}
OK	19617-43-7	CCOC(=O)N=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 28: 1, 29: 1}
OK	19617-44-8	CCOC(=O)NC(=O)OCC	{1: 2, 2: 2, 28: 2, 31: 1}
OK	19636-23-8	C[C@]12C=CC3=C4CC/C(=N/O)/C=C4CC[C@H]3[C@@H]1CCC2(C#C)O	{1: 1, 34: 1, 9: 1, 10: 1, 11: 6, 12: 2, 13: 2, 14: 3, 15: 4, 20: 2}
OK	19641-26-0	CN1CCCCC(=O)CCCC1	{1: 1, 11: 8, 33: 1, 25: 1}
OK	19645-77-3	C1(C(=O)NC(=O)NC1=O)Cl	{32: 2, 17: 1, 12: 1, 25: 3}
OK	19653-33-9	CCOC(=O)CCN1CCCCC1	{1: 1, 2: 3, 11: 5, 28: 1, 33: 1}
OK	19656-98-5	CC1CC=CC=C1	{1: 1, 11: 1, 12: 1, 14: 4}
OK	19659-64-4	CCCCCCCCCCCC(=O)SC(=O)CCCCCCCCCCC	{24: 2, 1: 2, 2: 20, 40: 1}
OK	19660-16-3	C=CC(=O)OCC(CBr)Br	{2: 2, 3: 1, 5: 1, 6: 1, 18: 2, 28: 1}
OK	19678-58-1	CC(C)C1CCNCC1	{11: 4, 1: 2, 3: 1, 12: 1, 32: 1}
OK	1968-40-7	CCOC(=O)CCC=C	{1: 1, 2: 3, 28: 1, 5: 1, 6: 1}
OK	19685-21-3	COCCOCCOCCOCC=C	{1: 1, 2: 7, 22: 4, 5: 1, 6: 1}
OK	19686-73-8	CC(CBr)O	{1: 1, 2: 1, 3: 1, 20: 1, 18: 1}
OK	19689-19-1	CCCCC=CCCCC	{1: 2, 2: 6, 6: 2}
OK	1969-43-3	CCCCCCCOCC	{1: 2, 2: 7, 22: 1}
OK	19693-75-5	COC1OCCO1	{1: 1, 11: 2, 12: 1, 22: 1, 23: 2}
OK	19694-12-3	CCC(C)(C)N=NC(C)(C)CC	{1: 6, 2: 2, 4: 2, 34: 2}
OK	19700-21-1	C[C@H]1CCC[C@@]2([C@@]1(CCCC2)O)C	{1: 2, 11: 7, 12: 1, 13: 2, 20: 1}
OK	19701-83-8	C[C@@H](C(=O)NC)NC(=O)C	{24: 2, 1: 3, 3: 1, 31: 2}
OK	19701-84-9	CC(C)[C@@H](C(=O)NC)NC(=O)C	{24: 2, 1: 4, 3: 2, 31: 2}
OK	19718-39-9	CCCN/N=C/CC	{1: 2, 2: 3, 34: 1, 6: 1, 31: 1}
OK	19719-81-4	CN1CCCCCCC1	{1: 1, 11: 7, 33: 1}
OK	1972-28-7	CCOC(=O)N=NC(=O)OCC	{1: 2, 2: 2, 28: 2, 34: 2}
OK	19721-22-3	C(CO)CS	{2: 3, 20: 1, 39: 1}
OK	19721-37-0	C=CC(=O)OCCSCCOC(=O)C=C	{40: 1, 2: 4, 28: 2, 5: 2, 6: 2}
OK	197234-17-6	CCOC(=O)CC(C)(C)C(=O)CBr	{1: 3, 2: 3, 4: 1, 18: 1, 24: 1, 28: 1}
OK	19727-16-3	CCC(CO)(COC(=O)C(=C)C)COC(=O)C(=C)C	{1: 3, 2: 4, 4: 1, 5: 2, 7: 2, 20: 1, 28: 2}
OK	19729-30-7	CC(C(=O)O)NC(=O)CNC(=O)CN	{1: 1, 2: 2, 3: 1, 24: 2, 27: 1, 30: 1, 31: 2}
OK	1974-04-5	CCCCCC(C)Br	{1: 2, 2: 4, 3: 1, 18: 1}
OK	1974-05-6	CCCCC(CC)Br	{1: 2, 2: 4, 3: 1, 18: 1}
OK	19740-18-2	C1C2CC3CC1C[C](C2)C3	{11: 6, 12: 3, 15: 1}
OK	19740-34-2	CC1(C2CC3CC(C2)CC1C3)C	{1: 2, 11: 5, 12: 4, 13: 1}
OK	19740-75-1	C1CC2C=CC=CC1O2	{11: 2, 12: 2, 14: 4, 23: 1}
OK	1975-78-6	CCCCCCCCCC#N	{1: 1, 2: 8, 37: 1}
OK	19752-94-4	COCC1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1, 22: 1}
OK	19754-57-5	C1CCOC(C1)OCCCCCCCCCl	{2: 8, 11: 4, 12: 1, 17: 1, 22: 1, 23: 1}
OK	19754-59-7	CCCCC#CCCCCCCCCOC1CCCCO1	{1: 1, 2: 11, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	19757-97-2	COC(C(=O)OC)O	{1: 2, 3: 1, 20: 1, 22: 1, 28: 1}
OK	19759-75-2	CCCCCCCCCCCCSCCC(=O)OC	{40: 1, 1: 2, 2: 13, 28: 1}
OK	19764-58-0	CC(CN)N(C)C	{1: 3, 2: 1, 3: 1, 30: 1, 33: 1}
OK	19766-29-1	CSC1=NCCCC1	{40: 1, 1: 1, 11: 4, 35: 1, 15: 1}
OK	1977-33-9	CC(C)(CO)C(C(=O)NCCCC(=O)O)O	{1: 2, 2: 4, 3: 1, 4: 1, 20: 2, 24: 1, 27: 1, 31: 1}
OK	19774-35-7	CCOC=CC=C	{1: 1, 2: 1, 22: 1, 5: 1, 6: 3}
OK	19780-10-0	CCCCCCCC(=O)CCCC	{24: 1, 1: 2, 2: 9}
OK	19780-12-2	CCCCCCC#CCCCC	{1: 2, 2: 8, 10: 2}
OK	19780-25-7	CCC(=CC)C=O	{1: 2, 2: 1, 26: 1, 6: 1, 7: 1}
OK	19780-31-5	CCCCC(CC)CCC(CC)O	{1: 3, 2: 7, 3: 2, 20: 1}
OK	19780-34-8	CCCCCCCCCCC(=C)CC	{1: 2, 2: 10, 5: 1, 7: 1}
OK	19780-35-9	CCOC(=O)C1C(O1)C	{1: 2, 2: 1, 12: 2, 28: 1, 23: 1}
OK	19780-39-3	CCCCC(CC)C(C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	19780-40-6	CCC(CC)CCC(C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	19780-41-7	CCCCC(CC)(CC)O	{1: 3, 2: 5, 4: 1, 20: 1}
OK	19780-42-8	CCCC(C(CC)CC)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	19780-44-0	CCC(CC)C(CC)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	19780-46-2	CCC(CC)C=CC	{1: 3, 2: 2, 3: 1, 6: 2}
OK	19780-51-9	CC=C1CCCCCCC1	{1: 1, 11: 7, 6: 1, 15: 1}
OK	19780-54-2	CCC1=C(CCCC1)C	{1: 2, 2: 1, 11: 4, 15: 2}
OK	19780-56-4	CCC1=C(CCC1)C	{1: 2, 2: 1, 11: 3, 15: 2}
OK	19780-60-0	CCCCC(CC)C(=C)C	{1: 3, 2: 4, 3: 1, 5: 1, 7: 1}
OK	19780-61-1	CCCCC(=C(C)C)CC	{1: 4, 2: 4, 7: 2}
OK	19780-63-3	CCC(CC)C(C)(C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	19780-65-5	CCC(C)(CC)C(=O)C	{24: 1, 1: 4, 2: 2, 4: 1}
OK	19780-66-6	CCC(CC)C(=C)C	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1}
OK	19780-67-7	CCC(=C(C)C)CC	{1: 4, 2: 2, 7: 2}
OK	19780-68-8	CCC(=CC)C(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1}
OK	19780-71-3	CCCCC(CC)CC(CC)O	{1: 3, 2: 6, 3: 2, 20: 1}
OK	19780-80-4	CCCCCCC(=C)CCCCCC	{1: 2, 2: 10, 5: 1, 7: 1}
OK	19780-84-8	CCC(CC#C)O	{1: 1, 2: 2, 3: 1, 9: 1, 10: 1, 20: 1}
OK	19780-85-9	C1CN(CCC1CCCO)CCO	{20: 2, 2: 5, 11: 4, 12: 1, 33: 1}
OK	19780-90-6	CCC(CC(C)O)O	{1: 2, 2: 2, 3: 2, 20: 2}
OK	19780-94-0	CC(CCCC(=O)OC)C(=O)OC	{1: 3, 2: 3, 3: 1, 28: 2}
OK	19780-96-2	CC(C)CCC(CCC(C)C)O	{1: 4, 2: 4, 3: 3, 20: 1}
OK	19781-07-8	CC(C)(CCCCC(C)(C)O)O	{1: 4, 2: 4, 4: 2, 20: 2}
OK	19781-10-3	CCCCCC(C)(C(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	19781-11-4	CC(C)CCC(CC(C)C)O	{1: 4, 2: 3, 3: 3, 20: 1}
OK	19781-13-6	CCCC(C)(CCC(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	19781-18-1	CCCCCC(=C(C)C)C	{1: 4, 2: 4, 7: 2}
OK	19781-24-9	CCC(C)(C)C(C)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1}
OK	19781-26-1	CCCCC(CC)C(CC)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	19781-27-2	CCC(CC)CCC(CC)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	19781-29-4	CCCCC(=O)C(CC)CC	{24: 1, 1: 3, 2: 5, 3: 1}
OK	19781-52-3	CC(C=C)C(C)(C)O	{1: 3, 3: 1, 4: 1, 5: 1, 6: 1, 20: 1}
OK	19781-53-4	CC(=C)CC(C)(C)O	{1: 3, 2: 1, 4: 1, 5: 1, 7: 1, 20: 1}
OK	19781-54-5	CC(C)C(C(=C)C)O	{1: 3, 3: 2, 20: 1, 5: 1, 7: 1}
OK	19781-68-1	CCC1CC1C	{1: 2, 2: 1, 11: 1, 12: 2}
OK	19781-72-7	CCCCCCCCCCC(=O)CCCCCCCCCC	{24: 1, 1: 2, 2: 18}
OK	19781-73-8	CCCCCCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 16, 11: 5, 12: 1}
OK	19781-77-2	CCC(CCC=C)O	{1: 1, 2: 3, 3: 1, 5: 1, 6: 1, 20: 1}
OK	19781-81-8	CCC#CCC(C)O	{1: 2, 2: 2, 3: 1, 20: 1, 10: 2}
OK	19781-86-3	CCCCCCCC#CCCCCCCC	{1: 2, 2: 12, 10: 2}
OK	19788-49-9	CCOC(=O)C(C)S	{1: 2, 2: 1, 3: 1, 28: 1, 39: 1}
OK	19792-94-0	C(CC(C(Cl)(Cl)Br)Br)CCl	{17: 3, 2: 3, 3: 1, 4: 1, 18: 2}
OK	197921-94-1	C(CCOCC(CS)O)COCC(CS)O	{2: 8, 3: 2, 20: 2, 22: 2, 39: 2}
OK	19805-75-5	CC1(C=C(C(N1)(C)C)C(=O)N)C	{32: 1, 1: 4, 13: 2, 14: 1, 15: 1, 24: 1, 30: 1}
OK	19812-63-6	CCOC(=O)CCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 14, 28: 2}
OK	19812-64-7	C(CCCCCCCO)CCCCCCO	{2: 14, 20: 2}
OK	19816-73-0	CCCCCCCCCCCCCC(=O)OO	{1: 1, 2: 12, 20: 1, 28: 1}
OK	19825-93-5	CCCCOC(=O)CC=CC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	19832-87-2	CC1=CC(=O)C(=CC1=O)Cl	{1: 1, 17: 1, 25: 2, 14: 2, 15: 2}
OK	19836-28-3	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])N(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 2: 2, 4: 2, 38: 7}
OK	19836-78-3	CN1CCOC1=O	{1: 1, 11: 2, 28: 1, 33: 1}
OK	1984-77-6	CCCCCCCCCCCC(=O)OCC1CO1	{1: 1, 2: 11, 11: 1, 12: 1, 23: 1, 28: 1}
OK	198404-98-7	CC1(C(CC2C1(C2)C)CC3CC3(C)CO)C	{1: 4, 2: 2, 11: 3, 12: 3, 13: 3, 20: 1}
OK	19841-72-6	CCCCCC(C(C)(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	19841-74-8	CCC1=CCC=CC1	{1: 1, 2: 1, 11: 2, 14: 3, 15: 1}
OK	19845-37-5	CCCCCCCCCCCCCCC(CN(CCO)CCO)O	{1: 1, 2: 18, 3: 1, 20: 3, 33: 1}
OK	1985-48-4	CC1CCCCC(=O)N1	{32: 1, 1: 1, 11: 4, 12: 1, 25: 1}
OK	1985-84-8	CC1CC2C(O2)CC1COC(=O)CCCCC(=O)OCC3CC4C(O4)CC3C	{1: 2, 2: 6, 11: 4, 12: 8, 23: 2, 28: 2}
OK	19855-39-1	C[C@@H]1[C@H]([C@H](C[C@H](O1)O[C@@H]2[C@H](O[C@@H](C[C@@H]2O[C@@H]3C[C@@H]([C@@H]([C@H](O3)C)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5CC[C@]6([C@@H](C5)CC[C@@H]7[C@@H]6CC[C@]8(C7(C[C@@H]([C@@H]8C9=CC(=O)OC9)O)O)C)C)C)O)O	{1: 5, 2: 1, 11: 12, 12: 23, 13: 3, 14: 1, 15: 1, 20: 9, 22: 4, 23: 4, 28: 1}
OK	19858-14-1	COCC1CS1	{1: 1, 2: 1, 41: 1, 11: 1, 12: 1, 22: 1}
OK	19866-50-3	CCC(=CC(=O)O)C	{1: 2, 2: 1, 27: 1, 6: 1, 7: 1}
OK	19869-78-4	CC(C)(CBr)F	{16: 1, 1: 2, 2: 1, 4: 1, 18: 1}
OK	19872-52-7	CC(=O)CC(C)(C)S	{24: 1, 1: 3, 2: 1, 4: 1, 39: 1}
OK	19889-37-3	CCC(C)(CC)C(=O)O	{1: 3, 2: 2, 27: 1, 4: 1}
OK	19889-77-1	C1CCNC(C1)C(=O)N	{24: 1, 32: 1, 11: 4, 12: 1, 30: 1}
OK	19889-94-2	C[C@H]1[C@H]2C[C@H](C2(C)C)C[C@@H]1O	{1: 3, 11: 2, 12: 4, 13: 1, 20: 1}
OK	1989-50-0	C1CC2(CCC1(CC2)C(=O)O)Br	{27: 1, 18: 1, 11: 6, 13: 2}
OK	1989-52-2	CCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 15, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	19890-00-7	CC1([C@H]2C[C@@H]1C(=C)C(=O)C2)C	{1: 2, 5: 1, 11: 2, 12: 2, 13: 1, 15: 1, 25: 1}
OK	19891-74-8	CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/CC/C=C(\C)/CO)/C)/C)/C)C	{1: 9, 2: 5, 20: 1, 6: 18, 7: 8}
OK	19894-97-4	CC1([C@H]2CC=C([C@@H]1C2)CO)C	{1: 2, 2: 1, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 20: 1}
OK	19894-99-6	C[C@@]12[C@@H]3C[C@@H](C3(C)C)C[C@@H]1O2	{1: 3, 11: 2, 12: 3, 13: 2, 23: 1}
OK	19895-66-0	C=C(C(C(C(=C)O)O)O)O	{3: 2, 20: 4, 5: 2, 7: 2}
OK	19902-08-0	CC1([C@@H]2CCC(=C)[C@H]1C2)C	{1: 2, 5: 1, 11: 3, 12: 2, 13: 1, 15: 1}
OK	19909-70-7	CC(C)(C)C(=O)C(=O)C(=O)C(=O)C(C)(C)C	{24: 4, 1: 6, 4: 2}
OK	19910-30-6	CC(C(=O)OC)C(C)(C)C	{1: 5, 3: 1, 4: 1, 28: 1}
OK	19912-62-0	CC1=C[C@H]2[C@@H](CC[C@]([C@H]2CC1)(C)O)C(C)C	{1: 4, 3: 1, 11: 4, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	19912-83-5	CC1=CC[C@@]2(CC1)C(=CCCC2(C)C)C	{1: 4, 11: 5, 13: 2, 14: 2, 15: 2}
OK	19916-65-5	C1CC2CC1CC2(Cl)Cl	{17: 2, 11: 4, 12: 2, 13: 1}
OK	19918-17-3	CC(C)(C)C1=CCC(=O)O1	{1: 3, 4: 1, 11: 1, 14: 1, 15: 1, 28: 1}
OK	19932-26-4	C1C(O1)COCC(C(F)F)(F)F	{2: 2, 3: 1, 4: 1, 11: 1, 12: 1, 16: 4, 22: 1, 23: 1}
OK	19932-27-5	C1C(O1)COCC(C(C(C(F)F)(F)F)(F)F)(F)F	{2: 2, 3: 1, 4: 3, 11: 1, 12: 1, 16: 8, 22: 1, 23: 1}
OK	19935-86-5	CCCN(C(=O)OCC)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 28: 1, 29: 1}
OK	19942-78-0	CCCCCCCCSC#N	{40: 1, 1: 1, 2: 7, 37: 1}
OK	19945-22-3	CC(=O)N(CCCl)CCCl	{24: 1, 1: 1, 2: 4, 33: 1, 17: 2}
OK	19945-61-0	CC(=CCCC(=CC=C)C)C	{1: 3, 2: 2, 5: 1, 6: 3, 7: 2}
OK	1996-88-9	CC(=C)C(=O)OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 8, 5: 1, 7: 1, 16: 17, 28: 1}
OK	19961-27-4	CCNC(C)C	{1: 3, 2: 1, 3: 1, 31: 1}
OK	19967-57-8	CC(C=O)Br	{1: 1, 18: 1, 3: 1, 26: 1}
OK	19971-12-1	CC1(C(C(=O)C(C(N1)(C)C)Br)Br)C.Br	{32: 1, 1: 4, 12: 2, 13: 2, 18: 3, 25: 1}
OK	19975-56-5	CSC1=NCCS1	{1: 1, 35: 1, 40: 1, 41: 1, 11: 2, 15: 1}
OK	19987-14-5	CC12CCCC(O1)(OO2)C	{1: 2, 11: 3, 13: 2, 23: 3}
OK	1999-33-3	C([C@@H](C(=O)O)NC(=O)CN)C(=O)N	{2: 2, 3: 1, 24: 2, 27: 1, 30: 2, 31: 1}
OK	1999-34-4	CSCCC(C(=O)O)NC(=O)CN	{1: 1, 2: 3, 3: 1, 40: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	1999-46-8	CC(C)C(C(=O)O)NC(=O)C(C)N	{1: 3, 3: 3, 24: 1, 27: 1, 30: 1, 31: 1}
OK	2000-40-0	C(C(Cl)(Cl)Cl)(NC(=O)N)O	{3: 1, 4: 1, 17: 3, 20: 1, 24: 1, 30: 1, 31: 1}
OK	20007-72-1	CC12CCC(=O)C=C1CCCC2=O	{1: 1, 11: 5, 13: 1, 14: 1, 15: 1, 25: 2}
OK	2001-95-8	CC1C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O1)C(C)C)C(C)C)C(C)C)C)C(C)C)C(C)C)C(C)C)C)C(C)C)C(C)C)C(C)C	{32: 6, 1: 21, 3: 9, 12: 12, 25: 6, 28: 6}
OK	20013-73-4	CC1=CCCC(C1=O)(C)C	{1: 3, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	20019-64-1	CC1(C=CC(=O)O1)C	{1: 2, 28: 1, 13: 1, 14: 2}
OK	2002-24-6	C(CO)N.Cl	{17: 1, 2: 2, 20: 1, 30: 1}
OK	20023-43-2	CC=C=C1CCCCC1	{8: 1, 1: 1, 11: 5, 6: 1, 15: 1}
OK	2003-31-8	C(#CCl)C#N	{17: 1, 10: 2, 37: 1}
OK	2003-32-9	C(#CI)C#N	{10: 2, 19: 1, 37: 1}
OK	2003-82-9	CC#CBr	{1: 1, 10: 2, 18: 1}
OK	20030-30-2	CC1CC=C(C(=O)C1C)C	{1: 3, 11: 1, 12: 2, 14: 1, 15: 1, 25: 1}
OK	20031-21-4	CC1(O[C@@H]2[C@H]([C@H](O[C@@H]2O1)CO)O)C	{1: 2, 2: 1, 12: 4, 13: 1, 20: 2, 23: 3}
OK	20038-12-4	CC(=C)CCBr	{1: 1, 2: 2, 18: 1, 5: 1, 7: 1}
OK	2004-67-3	CC(CC(=C)C)O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 20: 1}
OK	2004-70-8	C=C/C=C/C	{1: 1, 5: 1, 6: 3}
OK	20053-88-7	CC(=C)/C=C/CC(C)(C=C)O	{1: 2, 2: 1, 4: 1, 5: 2, 6: 3, 7: 1, 20: 1}
OK	20053-89-8	CC1=C(CCCCC1)C	{1: 2, 11: 5, 15: 2}
OK	20054-25-5	CC(=C)CCCCCC(=C)C	{1: 2, 2: 5, 5: 2, 7: 2}
OK	20055-93-0	CC1C2(C1(C(=C)C(=C2C)C)C)C	{1: 5, 15: 3, 12: 1, 5: 1, 13: 2}
OK	20056-22-8	CC(CCC=C(C)C)CC=C(C)C(=O)C	{1: 5, 2: 3, 3: 1, 6: 2, 7: 2, 24: 1}
OK	20056-92-2	CCCC/C=C\CCCCCCO	{1: 1, 2: 9, 20: 1, 6: 2}
OK	20063-89-2	C1CNC1C(=O)O	{27: 1, 32: 1, 11: 2, 12: 1}
OK	20063-92-7	CCCCC/C=C/CC	{1: 2, 2: 5, 6: 2}
OK	20063-97-2	C/C=C/CCCCCCC	{1: 2, 2: 6, 6: 2}
OK	20073-50-1	C1COCN1CCO	{33: 1, 2: 2, 11: 3, 20: 1, 23: 1}
OK	2008-41-5	CCSC(=O)N(CC(C)C)CC(C)C	{1: 5, 2: 3, 3: 2, 33: 1, 40: 1, 24: 1}
OK	2008-75-5	C1CCN(CC1)CCCl.Cl	{17: 2, 2: 2, 11: 5, 33: 1}
OK	2009-74-7	CC(C)CC=CC(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 6: 2}
OK	2009-83-8	C(CCCCl)CCO	{17: 1, 2: 6, 20: 1}
OK	2009-84-9	C1CCOC(C1)OCCCCCCCl	{2: 6, 11: 4, 12: 1, 17: 1, 22: 1, 23: 1}
OK	20103-35-9	CCCCCCCCCCCCCCCCCC1=NC(CO1)(CO)COC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 35: 1, 11: 1, 13: 1, 15: 1, 20: 1, 23: 1, 28: 1}
OK	201167-72-8	CC(C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)OCC(COC(=O)C(C)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)O)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)O)O	{1: 12, 2: 2, 3: 13, 20: 3, 28: 12}
OK	201167-74-0	CC(C(=O)OC(C)C(=O)OC(C)C(=O)OC(C)C(=O)OC[C@H]([C@H]([C@@H]([C@H](COC(=O)C(C)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)O)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)O)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)O)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)O)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)OC(=O)C(C)O)O	{1: 24, 2: 2, 3: 28, 20: 6, 28: 24}
OK	20117-47-9	CC1(CCC1)O	{1: 1, 11: 3, 20: 1, 13: 1}
OK	20120-24-5	CCOC(=O)CCN1CCOCC1	{1: 1, 2: 3, 33: 1, 11: 4, 23: 1, 28: 1}
OK	20121-96-4	CCC(C)CCCCCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 12, 3: 1}
OK	20125-84-2	CCCCC=CCCO	{1: 1, 2: 5, 20: 1, 6: 2}
OK	2013-12-9	CCC[C@H](C(=O)O)N	{27: 1, 1: 1, 2: 2, 3: 1, 30: 1}
OK	20130-95-4	C/C=C/C=C=C	{8: 1, 1: 1, 5: 1, 6: 3}
OK	20132-74-5	CC(=O)C(C(=O)NC)(Cl)Cl	{24: 2, 1: 2, 31: 1, 4: 1, 17: 2}
OK	20138-28-7	CCCCCCCCCCCC(=O)NCCOCCO	{1: 1, 2: 14, 20: 1, 22: 1, 24: 1, 31: 1}
OK	20149-50-2	C[C@H]1CC[C@@H]2CC3([C@@H]1CC[C@@H]3C)OC2(C)C	{1: 4, 11: 5, 12: 4, 13: 2, 23: 1}
OK	2016-05-9	CN(C)C(OC1CCCCC1)OC2CCCCC2	{1: 2, 3: 1, 33: 1, 11: 10, 12: 2, 22: 2}
OK	2016-42-4	CCCCCCCCCCCCCCN	{1: 1, 2: 13, 30: 1}
OK	2016-48-0	CCCCCCCCCCCCN(C)C.Cl	{1: 3, 2: 11, 33: 1, 17: 1}
OK	2016-56-0	CCCCCCCCCCCCN.CC(=O)O	{1: 2, 2: 11, 27: 1, 30: 1}
OK	2016-57-1	CCCCCCCCCCN	{1: 1, 2: 9, 30: 1}
OK	20165-38-2	C(C([N+](=O)[O-])(F)F)([N+](=O)[O-])([N+](=O)[O-])F	{16: 3, 4: 2, 38: 3}
OK	20165-39-3	C(C([N+](=O)[O-])([N+](=O)[O-])F)([N+](=O)[O-])([N+](=O)[O-])F	{16: 2, 4: 2, 38: 4}
OK	20184-89-8	CCCCCC#CCC	{1: 2, 2: 5, 10: 2}
OK	20184-91-2	CCCCC#CCCC	{1: 2, 2: 5, 10: 2}
OK	20193-20-8	CCCNCC	{1: 2, 2: 3, 31: 1}
OK	20193-21-9	CCCCNCCC	{1: 2, 2: 5, 31: 1}
OK	20194-48-3	CC(C)CCCCCCCCCCCCCO	{1: 2, 2: 13, 3: 1, 20: 1}
OK	20194-68-7	CC1=CC(=O)CC(C1C=CC(=O)C)(C)C	{1: 4, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1, 25: 1}
OK	201947-87-7	CCCCCCCCCCCCOC(=O)C=C.CCCCCCCCCCCCS.C=CC(=O)O	{1: 2, 2: 22, 5: 2, 6: 2, 39: 1, 27: 1, 28: 1}
OK	20198-49-6	CCC(C)C#CC	{1: 3, 2: 1, 3: 1, 10: 2}
OK	20198-77-0	CCN1C(=O)C(=C(C1=O)Cl)Cl	{1: 1, 2: 1, 33: 1, 15: 2, 17: 2, 25: 2}
OK	20198-92-9	CCCCCCCCCCCCCCCCCC(=O)NC	{24: 1, 1: 2, 2: 16, 31: 1}
OK	20201-24-5	CCOC(=O)C(=O)C(C)C	{24: 1, 1: 3, 2: 1, 3: 1, 28: 1}
OK	20207-13-0	C1COCCN1CCOCCN	{33: 1, 2: 4, 11: 4, 22: 1, 23: 1, 30: 1}
OK	20207-36-7	CCCCCCCCCCCC(=O)OCCOCCCCCC	{1: 2, 2: 17, 28: 1, 22: 1}
OK	2021-19-4	CCCCN1C(=O)C2CC=CCC2C1=O	{1: 1, 2: 3, 33: 1, 11: 2, 12: 2, 14: 2, 25: 2}
OK	2021-21-8	C1C[C@@H]([C@@H]2CC[C@H]([C@@H]1O)O2)O	{20: 2, 11: 4, 12: 4, 23: 1}
OK	202187-27-7	C1C2C=CC1C(C2C(=O)O)N	{27: 1, 11: 1, 12: 4, 30: 1, 14: 2}
OK	20224-38-8	C1C2C=CC1C(C2O)O	{20: 2, 11: 1, 12: 4, 14: 2}
OK	20233-04-9	C(#N)SC(Cl)(Cl)Cl	{40: 1, 17: 3, 4: 1, 37: 1}
OK	20237-34-7	C=C/C=C/CC	{1: 1, 2: 1, 5: 1, 6: 3}
OK	2024-54-6	CCOC(=O)C(C(C)C(F)(F)F)Br	{1: 2, 2: 1, 3: 2, 4: 1, 16: 3, 18: 1, 28: 1}
OK	20241-99-0	CCC(COCC=C)(COCC=C)COC(=O)C(=C)C	{1: 2, 2: 6, 4: 1, 5: 3, 6: 2, 7: 1, 22: 2, 28: 1}
OK	20244-61-5	C1=C(C(=O)C(=CC1(Br)Br)Br)Br	{25: 1, 18: 4, 13: 1, 14: 2, 15: 2}
OK	20244-70-6	C(=CI)I	{19: 2, 6: 2}
OK	2025-55-0	C[CH]C	{1: 2, 6: 1}
OK	202591-85-3	CC#CCOC(=O)Cl	{1: 1, 2: 1, 28: 1, 10: 2, 17: 1}
OK	2026-48-4	CC(C)[C@@H](CO)N	{1: 2, 2: 1, 3: 2, 20: 1, 30: 1}
OK	20264-60-2	CC(C)(C)C#CC#CC#CC(C)(C)C	{1: 6, 10: 6, 4: 2}
OK	20264-61-3	CC(C)(C)C#CC#CC#CC#CC(C)(C)C	{1: 6, 10: 8, 4: 2}
OK	20264-62-4	CC(C)(C)C#CC#CC#CC#CC#CC(C)(C)C	{1: 6, 10: 10, 4: 2}
OK	20267-19-0	CC(C)(C)C(=O)OCCO	{1: 3, 2: 2, 4: 1, 20: 1, 28: 1}
OK	20267-21-4	CC(C)(C)C(=O)OCCOCCO	{1: 3, 2: 4, 4: 1, 20: 1, 22: 1, 28: 1}
OK	20267-74-7	CCCCCSC(=N)N	{1: 1, 2: 4, 36: 1, 7: 1, 40: 1, 30: 1}
OK	20278-84-6	CCC(C)C(C)CC(C)C	{1: 5, 2: 2, 3: 3}
OK	20278-85-7	CCC(C)CC(C)C(C)C	{1: 5, 2: 2, 3: 3}
OK	20278-87-9	CCCC(C)C(C)(C)CC	{1: 5, 2: 3, 3: 1, 4: 1}
OK	20278-88-0	CCCC(C)(C)C(C)CC	{1: 5, 2: 3, 3: 1, 4: 1}
OK	20278-89-1	CCC(C)C(C)C(C)CC	{1: 5, 2: 2, 3: 3}
OK	20279-25-8	CCC(=O)OC1CC2CCC1(C2(C)C)C	{1: 4, 2: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	20279-40-7	CC(C)COC(=O)CCC(=O)O	{27: 1, 1: 2, 2: 3, 3: 1, 28: 1}
OK	20279-44-1	CCCCOC(=O)C(=O)C	{24: 1, 1: 2, 2: 3, 28: 1}
OK	20279-49-6	CCCCCOC(=O)CCC(=O)C	{24: 1, 1: 2, 2: 6, 28: 1}
OK	20279-51-0	CCCCCCOC(=O)C(C)O	{1: 2, 2: 5, 3: 1, 20: 1, 28: 1}
OK	2028-52-6	CCC(C)(C#CBr)O	{1: 2, 2: 1, 4: 1, 10: 2, 18: 1, 20: 1}
OK	2028-63-9	CC(C#C)O	{1: 1, 10: 1, 3: 1, 20: 1, 9: 1}
OK	20284-29-1	CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C/CCCCCCCC)(COCC(COC(=O)CCCCCCC/C=C\CCCCCCCC)(COC(=O)CCCCCCC/C=C/CCCCCCCC)COC(=O)CCCCCCC/C=C/CCCCCCCC)COCC(COC(=O)CCCCCCC/C=C/CCCCCCCC)(COC(=O)CCCCCCC/C=C/CCCCCCCC)COC(=O)CCCCCCC/C=C/CCCCCCCC	{1: 8, 2: 124, 4: 3, 6: 16, 22: 2, 28: 8}
OK	20290-84-0	CCCCCCCCC=CCCCCCCCC(=O)OCCCCCC	{1: 2, 2: 19, 28: 1, 6: 2}
OK	20290-99-7	CCC1C2CCCC(O2)(O1)C	{1: 2, 2: 1, 11: 3, 12: 2, 13: 1, 23: 2}
OK	20291-60-5	CCCCCCSC	{40: 1, 1: 2, 2: 5}
OK	20291-61-6	CCCCCCCSC	{40: 1, 1: 2, 2: 6}
OK	20291-91-2	CCCC(CC)C(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	20291-95-6	CCC(C)CCC(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	20292-01-7	CCCCCCOC(=O)CS	{1: 1, 2: 6, 28: 1, 39: 1}
OK	20292-08-4	CCCCCCCCCCCC(=O)OCC(CC)CCCC	{1: 3, 2: 15, 3: 1, 28: 1}
OK	20292-09-5	CCCCCCCCCCCCOC(=O)CCCCCCC	{1: 2, 2: 17, 28: 1}
OK	20294-76-2	CCCCCCCCCCCCCCCCC(CO)O	{1: 1, 2: 16, 3: 1, 20: 2}
OK	20295-17-4	C1C=CCC23C1(CC=CC2)C=C3	{11: 4, 13: 2, 14: 6}
OK	20298-72-0	CC(=O)OC1CCCC(C1)C(C)(C)C	{1: 4, 11: 4, 4: 1, 12: 2, 28: 1}
OK	2030-83-3	CCCCCCCCC=CCC	{1: 2, 2: 8, 6: 2}
OK	2030-84-4	CCCCCCCC=CCCC	{1: 2, 2: 8, 6: 2}
OK	20306-75-6	CC(=O)CC(=O)NC	{24: 2, 1: 2, 2: 1, 31: 1}
OK	20307-83-9	CC(CCC=C(C)C)C1CCC(=C)C=C1	{1: 3, 2: 2, 3: 1, 5: 1, 6: 1, 7: 1, 11: 2, 12: 1, 14: 2, 15: 1}
OK	20307-84-0	CC(C)C1=CC(C(CC1)(C)C=C)C(=C)C	{1: 4, 3: 1, 5: 2, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1}
OK	20309-77-7	CC1CC(CC1C)(C)C	{1: 4, 11: 2, 12: 2, 13: 1}
OK	20311-78-8	CCC[C@H](CC/C=C/C=C/C#CC#C/C=C/CO)O	{1: 1, 2: 5, 3: 1, 6: 6, 10: 4, 20: 2}
OK	2032-34-0	CCOC(CC#N)OCC	{1: 2, 2: 3, 3: 1, 37: 1, 22: 2}
OK	2032-35-1	CCOC(CBr)OCC	{1: 2, 2: 3, 3: 1, 18: 1, 22: 2}
OK	2032-76-0	CSC(Cl)Cl	{40: 1, 1: 1, 3: 1, 17: 2}
OK	20324-32-7	CC(COC(C)COC)O	{1: 3, 2: 2, 3: 2, 20: 1, 22: 2}
OK	20324-33-8	CC(COC(C)COC(C)COC)O	{1: 4, 2: 3, 3: 3, 20: 1, 22: 3}
OK	2033-24-1	CC1(OC(=O)CC(=O)O1)C	{1: 2, 11: 1, 28: 2, 13: 1}
OK	203302-90-3	CC(CC(F)(F)F)CBr	{1: 1, 2: 2, 3: 1, 4: 1, 16: 3, 18: 1}
OK	20333-39-5	CCSSC	{40: 2, 1: 2, 2: 1}
OK	20334-52-5	CCC=C=O	{8: 1, 1: 1, 2: 1, 29: 1, 6: 1}
OK	2034-25-5	C(CCO)CC(=O)NN	{24: 1, 2: 4, 20: 1, 30: 1, 31: 1}
OK	2034-53-9	CC1(C2CCC1CC2)C	{1: 2, 11: 4, 12: 2, 13: 1}
OK	20344-52-9	CC(C)(C)C1(CCCCC1)O	{1: 3, 11: 5, 4: 1, 13: 1, 20: 1}
OK	20348-51-0	CCCCCCCC=CC	{1: 2, 2: 6, 6: 2}
OK	2035-89-4	CN(C)N=C	{1: 2, 34: 1, 5: 1, 33: 1}
OK	2035-99-6	CCCCCCCC(=O)OCCC(C)C	{1: 3, 2: 8, 3: 1, 28: 1}
OK	20352-67-4	CCCCCCNCC	{1: 2, 2: 6, 31: 1}
OK	20368-76-7	C1C(O1)CCl.C1N2CN3CN1CN(C2)C3	{33: 4, 2: 1, 11: 7, 12: 1, 17: 1, 23: 1}
OK	2037-62-9	CC(CO)(CO)C1CCCCC1	{1: 1, 2: 2, 4: 1, 11: 5, 12: 1, 20: 2}
OK	20377-79-1	C1CC(C(C1)Br)O	{20: 1, 18: 1, 11: 3, 12: 2}
OK	2038-03-1	C1COCCN1CCN	{33: 1, 2: 2, 11: 4, 30: 1, 23: 1}
OK	2038-40-6	CC12CCCC(N1)CC(C2)O	{32: 1, 1: 1, 11: 5, 12: 2, 13: 1, 20: 1}
OK	20380-30-7	C1=CC2C1C3C2C=C3	{12: 4, 14: 4}
OK	20387-39-7	C(CCCOCC(CCl)O)CCOCC(CCl)O	{17: 2, 2: 10, 3: 2, 20: 2, 22: 2}
OK	20389-01-9	C1=C(C(=O)C(=CC1=O)I)I	{25: 2, 19: 2, 14: 2, 15: 2}
OK	20395-24-8	CCCCCCCC(Cl)Cl	{1: 1, 2: 6, 3: 1, 17: 2}
OK	20395-25-9	C(CCl)C(Cl)Cl	{17: 3, 2: 2, 3: 1}
OK	20395-28-2	CC(=O)OCCCCCCl	{1: 1, 2: 5, 28: 1, 17: 1}
OK	20396-54-7	CCOOC(C)(C)C	{1: 4, 2: 1, 4: 1, 22: 2}
OK	20397-57-3	C1C2CN3CC1C(=O)N(C2)C3	{25: 1, 11: 5, 12: 2, 33: 2}
OK	2040-64-4	CCCCCCCCCCCCCC(=O)OCCCCCCCCCCCC	{1: 2, 2: 23, 28: 1}
OK	2040-73-5	C1=CC=CC=CC=CC=CC=CC=CC=CC=C1	{14: 18}
OK	2040-95-1	CCCCC1CCCC1	{1: 1, 2: 3, 11: 4, 12: 1}
OK	2040-96-2	CCCC1CCCC1	{1: 1, 2: 2, 11: 4, 12: 1}
OK	20404-94-8	COC(C(C(F)(F)F)(C(F)(F)F)Br)(F)Br	{16: 7, 1: 1, 18: 2, 4: 4, 22: 1}
OK	20407-84-5	CCCCCCCCCC=CC=O	{1: 1, 2: 8, 26: 1, 6: 2}
OK	20411-17-0	CN1C2CCC1C(CC2)OC	{1: 2, 11: 4, 12: 3, 22: 1, 33: 1}
OK	20412-38-8	CC(C)(C)COC(=O)Cl	{1: 3, 2: 1, 4: 1, 28: 1, 17: 1}
OK	20417-61-2	CCOC(=O)C1CC1C=O	{1: 1, 2: 1, 11: 1, 12: 2, 26: 1, 28: 1}
OK	204191-42-4	CCC(CC)C(CC(=O)O)N	{27: 1, 1: 2, 2: 3, 3: 2, 30: 1}
OK	20422-68-8	CCC1(CC(N(C2C1CCCC2)C)C)O	{1: 3, 2: 1, 33: 1, 11: 5, 12: 3, 13: 1, 20: 1}
OK	20428-74-4	COC(=O)C(Cl)Br	{1: 1, 18: 1, 3: 1, 28: 1, 17: 1}
OK	20429-33-8	CCCCCCCCC=CCCCCCCCC(=O)NCCOCCO	{1: 1, 2: 18, 6: 2, 20: 1, 22: 1, 24: 1, 31: 1}
OK	2043-43-8	CC(C(=O)N)O	{24: 1, 1: 1, 3: 1, 20: 1, 30: 1}
OK	2043-52-9	C(CI)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 15, 2: 2, 19: 1, 4: 7}
OK	2043-53-0	C(CI)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 17, 2: 2, 19: 1, 4: 8}
OK	2043-54-1	C(CI)C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 21, 2: 2, 19: 1, 4: 10}
OK	2043-55-2	C(CI)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 9, 2: 2, 19: 1, 4: 4}
OK	2043-57-4	C(CI)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 2: 2, 19: 1, 4: 6}
OK	2043-61-0	C1CCC(CC1)C=O	{26: 1, 11: 5, 12: 1}
OK	20431-91-8	CC1CC(C2CCCCC2N1C)(C=C)O	{1: 2, 5: 1, 6: 1, 33: 1, 11: 5, 12: 3, 13: 1, 20: 1}
OK	20439-47-8	C1CC[C@H]([C@@H](C1)N)N	{11: 4, 12: 2, 30: 2}
OK	2044-08-8	C1CCC(=CC1)Br	{18: 1, 11: 4, 14: 1, 15: 1}
OK	2044-21-5	CCCCCCCCCNCCCCCCCCC	{1: 2, 2: 16, 31: 1}
OK	2044-22-6	CCCCCCCCCN(CCCCCCCCC)CCCCCCCCC	{1: 3, 2: 24, 33: 1}
OK	2044-37-3	CCC(CC)(C#CC(CC)(CC)O)O	{1: 4, 2: 4, 4: 2, 10: 2, 20: 2}
OK	2044-64-6	CC(=O)CC(=O)N(C)C	{24: 2, 1: 3, 2: 1, 33: 1}
OK	20441-70-7	CCCCCCCCCCCCCCCC(=O)OCCOCCCC	{1: 2, 2: 19, 28: 1, 22: 1}
OK	20442-06-2	CCCCOCCOC(=O)CCC	{1: 2, 2: 7, 28: 1, 22: 1}
OK	20442-11-9	CCCCCCCCC(=O)OCCOCCCC	{1: 2, 2: 12, 28: 1, 22: 1}
OK	2045-78-5	C=C1CC(=C)C1	{11: 2, 5: 2, 15: 2}
OK	20454-81-3	CC12CCC(C1)(CC2)C	{1: 2, 11: 5, 13: 2}
OK	20457-75-4	CCCCCC[C@H](CC=CCCCCCCCC(=O)NCCCN(C)C)O	{1: 3, 2: 16, 3: 1, 6: 2, 33: 1, 20: 1, 24: 1, 31: 1}
OK	20461-54-5	[I-]	{19: 1}
OK	20461-95-4	CCOC(=O)C(SCC)SCC	{40: 2, 1: 3, 2: 3, 3: 1, 28: 1}
OK	20461-99-8	CCOC(=O)C1SCCS1	{1: 1, 2: 1, 41: 2, 11: 2, 12: 1, 28: 1}
OK	20462-00-4	CCOC(=O)C1SCCCS1	{1: 1, 2: 1, 41: 2, 11: 3, 12: 1, 28: 1}
OK	20474-93-5	CC=CC(=O)OCC=C	{1: 1, 2: 1, 28: 1, 5: 1, 6: 3}
OK	20479-69-0	C/C=C/C1CC1	{1: 1, 11: 2, 12: 1, 6: 2}
OK	20479-71-4	C/C=C(/C)\C1CC1	{1: 2, 11: 2, 12: 1, 6: 1, 7: 1}
OK	20482-11-5	C[C@@H]([C@@H]1CC[C@](O1)(C)C=C)C(=O)CC=C(C)C	{1: 4, 2: 1, 3: 1, 5: 1, 6: 2, 7: 1, 11: 2, 12: 1, 13: 1, 23: 1, 24: 1}
OK	20485-44-3	CC(C)(C(C)(C)N)N	{1: 4, 4: 2, 30: 2}
OK	20487-40-5	CCC(=O)OC(C)(C)C	{1: 4, 2: 1, 4: 1, 28: 1}
OK	20488-28-2	C1CC(NC1)C(=O)N2CCCC2C(=O)O	{32: 1, 33: 1, 11: 6, 12: 2, 24: 1, 27: 1}
OK	20488-34-0	CCCC=CC(C)C	{1: 3, 2: 2, 3: 1, 6: 2}
OK	20489-53-6	C[C@@H]1CC(=O)C[C@H]2[C@]1(C[C@@H](CC2)C(=C)C)C	{1: 3, 5: 1, 7: 1, 11: 5, 12: 3, 13: 1, 25: 1}
OK	2049-66-3	CCC(C(C)C)(C(=O)OCC)C(=O)OCC	{1: 5, 2: 3, 3: 1, 4: 1, 28: 2}
OK	2049-67-4	CCOC(=O)CC=CC(=O)OCC	{1: 2, 2: 3, 28: 2, 6: 2}
OK	2049-80-1	CCOC(=O)C(CC=C)C(=O)OCC	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 28: 2}
OK	2049-86-7	CCOC(=O)C(C(C(=O)C)C(=O)OCC)C(=O)C	{24: 2, 1: 4, 2: 2, 3: 2, 28: 2}
OK	2050-01-3	CC(C)CCOC(=O)C(C)C	{1: 4, 2: 2, 3: 2, 28: 1}
OK	2050-09-1	CCCCC(=O)OCCC(C)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	2050-20-6	CCOC(=O)CCCCCC(=O)OCC	{1: 2, 2: 7, 28: 2}
OK	2050-23-9	CCOC(=O)CCCCCCC(=O)OCC	{1: 2, 2: 8, 28: 2}
OK	2050-54-6	CCCCN(CCCC)C#N	{1: 2, 2: 6, 37: 1, 33: 1}
OK	2050-60-4	CCCCOC(=O)C(=O)OCCCC	{1: 2, 2: 6, 28: 2}
OK	2050-61-5	CC(C)COC(=O)C(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 28: 2}
OK	2050-77-3	CCCCCCCCCCI	{1: 1, 2: 9, 19: 1}
OK	2050-87-5	C=CCSSSCC=C	{40: 3, 2: 2, 5: 2, 6: 2}
OK	2050-92-2	CCCCCNCCCCC	{1: 2, 2: 8, 31: 1}
OK	2050-99-9	CC(C)CCC(=O)CCC(C)C	{24: 1, 1: 4, 2: 4, 3: 2}
OK	2051-00-5	CC(C)CCOC(=O)C(=O)OCCC(C)C	{1: 4, 2: 4, 3: 2, 28: 2}
OK	2051-04-9	CC(C)CCSSCCC(C)C	{40: 2, 1: 4, 2: 4, 3: 2}
OK	2051-28-7	C1CCC2C(C1)CCCN2	{32: 1, 11: 7, 12: 2}
OK	2051-30-1	CCC(C)CCCC(C)C	{1: 4, 2: 4, 3: 2}
OK	2051-31-2	CCCCCCC(CCC)O	{1: 2, 2: 7, 3: 1, 20: 1}
OK	2051-32-3	CCCCCC(CC)(CC)O	{1: 3, 2: 6, 4: 1, 20: 1}
OK	2051-33-4	CC(C)CCC(CO)C(C)C	{1: 4, 2: 3, 3: 3, 20: 1}
OK	2051-38-9	CCC(C)OC(=O)CC(C)C	{1: 4, 2: 2, 3: 2, 28: 1}
OK	2051-50-5	CCCCCCC(C)OC(=O)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	2051-78-7	CCCC(=O)OCC=C	{1: 1, 2: 3, 28: 1, 5: 1, 6: 1}
OK	20513-79-5	CCCCCCCC1=NCCN1CCN	{1: 1, 2: 8, 35: 1, 33: 1, 11: 2, 15: 1, 30: 1}
OK	20514-41-4	CC(=CC=C(C)C(=O)O)C(=O)O	{1: 2, 27: 2, 6: 2, 7: 2}
OK	20515-19-9	CC=CCC(=O)OC	{1: 2, 2: 1, 28: 1, 6: 2}
OK	2052-01-9	CC(C)(C(=O)O)Br	{1: 2, 18: 1, 27: 1, 4: 1}
OK	2052-15-5	CCCCOC(=O)CCC(=O)C	{24: 1, 1: 2, 2: 5, 28: 1}
OK	20521-44-2	C#CCCCCCCCCC#C	{9: 2, 2: 8, 10: 2}
OK	2053-29-4	C=N	{36: 1, 5: 1}
OK	20534-58-1	C1CC2(CCC1CC2)O	{20: 1, 11: 6, 12: 1, 13: 1}
OK	20547-99-3	CC1CC(=O)CC(C1=O)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 25: 2}
OK	205503-96-4	C1=C([C@H]([C@H](C(=C1)I)O)O)C(=O)O	{12: 2, 14: 2, 15: 2, 19: 1, 20: 2, 27: 1}
OK	205504-03-6	CC1=C(C=C([C@H]([C@H]1O)O)C(=O)O)I	{1: 1, 12: 2, 14: 1, 15: 3, 19: 1, 20: 2, 27: 1}
OK	20555-04-8	C[C@H]1CC[C@@H]2[C@H]([C@]3([C@@]1(C=CC3=O)O)C)OC(=O)C2=C	{1: 2, 5: 1, 11: 2, 12: 3, 13: 2, 14: 2, 15: 1, 20: 1, 25: 1, 28: 1}
OK	20556-11-0	CC(C)C(C(=O)O)NC(=O)C(CCCCN)N	{1: 2, 2: 4, 3: 3, 24: 1, 27: 1, 30: 2, 31: 1}
OK	20556-16-5	CC(C)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)N	{1: 2, 2: 1, 3: 3, 24: 1, 27: 2, 30: 1, 31: 1}
OK	20557-45-3	CC1(CCCC1O)O	{1: 1, 11: 3, 12: 1, 13: 1, 20: 2}
OK	20558-16-1	CC1C(C2CCC1C2)C	{1: 2, 11: 3, 12: 4}
OK	205587-32-2	C1=C([C@H]([C@H](C(=C1Cl)Cl)O)O)C(=O)O	{12: 2, 14: 1, 15: 3, 17: 2, 20: 2, 27: 1}
OK	2056-74-8	CC(C)(C)N=S=NC(C)(C)C	{40: 1, 1: 6, 34: 2, 4: 2}
OK	20562-02-1	C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)CO)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O[C@@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C	{1: 5, 2: 2, 33: 1, 11: 10, 12: 24, 13: 2, 14: 1, 15: 1, 20: 9, 22: 3, 23: 3}
OK	20562-03-2	C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)CC4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CCC(C6)O[C@H]7[C@@H]([C@H](C([C@H](O7)CO)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)O)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C	{1: 6, 2: 1, 33: 1, 11: 10, 12: 24, 13: 2, 14: 1, 15: 1, 20: 8, 22: 3, 23: 3}
OK	20562-79-2	COC(=O)C(C(=C(F)F)F)(F)F	{16: 5, 1: 1, 4: 1, 28: 1, 7: 2}
OK	20565-75-7	CCCCCCCCC=CCCCCCCCC1=NCCN1CCN	{1: 1, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 30: 1}
OK	205692-62-2	CC1=NC2(CCCCC2)[N+](=C1)[O-]	{1: 1, 35: 1, 33: 1, 11: 5, 13: 1, 14: 1, 15: 1, 29: 1}
OK	20577-33-7	CCCN=CC	{1: 2, 2: 2, 34: 1, 6: 1}
OK	20577-61-1	CC(=O)CC(=O)C(=O)OC	{24: 2, 1: 2, 2: 1, 28: 1}
OK	2058-94-8	C(=O)(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 21, 27: 1, 4: 10}
OK	20582-85-8	CSCCCCO	{40: 1, 1: 1, 2: 4, 20: 1}
OK	205829-17-0	C1CN(NC1=O)C(=O)CCl	{32: 1, 33: 1, 2: 1, 11: 2, 17: 1, 24: 1, 25: 1}
OK	20583-66-8	C(C(=O)C(C(C(F)(F)F)(F)F)(F)F)C(=O)C(F)(F)F	{16: 10, 24: 2, 2: 1, 4: 4}
OK	20586-29-2	CC1=CCC(C(C1)C(=O)OC)C(=O)OC	{1: 3, 11: 2, 12: 2, 14: 1, 15: 1, 28: 2}
OK	20589-85-9	C(=C(C(Cl)Cl)Cl)Cl	{17: 4, 3: 1, 6: 1, 7: 1}
OK	20592-10-3	CCCCCCC(CC)CO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	205985-91-7	CC1N[C@H](CS1)C(=O)O	{32: 1, 1: 1, 41: 1, 11: 1, 12: 2, 27: 1}
OK	205985-92-8	CCC1N[C@H](CS1)C(=O)O	{32: 1, 1: 1, 2: 1, 41: 1, 11: 1, 12: 2, 27: 1}
OK	205985-94-0	C1=C([C@H]([C@H](C(=C1)C(F)(F)F)O)O)C(=O)O	{4: 1, 12: 2, 14: 2, 15: 2, 16: 3, 20: 2, 27: 1}
OK	20599-27-3	CCC=CCBr	{1: 1, 2: 2, 18: 1, 6: 2}
OK	20599-77-3	CCCCCCCCCC(=O)O.C1COCCN1	{32: 1, 1: 1, 2: 8, 11: 4, 23: 1, 27: 1}
OK	20600-63-9	C=CCSCC(=O)O	{40: 1, 2: 2, 27: 1, 5: 1, 6: 1}
OK	20602-52-2	CC(NC=O)NC=O	{1: 1, 26: 2, 3: 1, 31: 2}
OK	20602-77-1	CC(=C)C(=O)OCCCN(C)C	{1: 3, 2: 3, 5: 1, 33: 1, 7: 1, 28: 1}
OK	20602-80-6	C=CC(=O)NC(=O)C=C	{24: 2, 5: 2, 6: 2, 31: 1}
OK	20603-00-3	C1CCCN(CC1)CCO	{33: 1, 2: 2, 11: 6, 20: 1}
OK	20605-01-0	CCOC(=O)C(CO)(CO)C(=O)OCC	{1: 2, 2: 4, 4: 1, 20: 2, 28: 2}
OK	20607-85-6	CC(C)(C)C#CC(=O)OC	{1: 4, 10: 2, 4: 1, 28: 1}
OK	20615-04-7	C1CCC(=NN=C2CCCC2)C1	{34: 2, 11: 8, 15: 2}
OK	20618-05-7	COC(=O)C(C(Cl)Cl)(Cl)Cl	{1: 1, 3: 1, 4: 1, 28: 1, 17: 4}
OK	20618-07-9	COC(=O)C(C(Cl)Cl)Cl	{1: 1, 3: 2, 28: 1, 17: 3}
OK	2062-98-8	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)F	{16: 12, 24: 1, 4: 5, 22: 1}
OK	20626-39-5	CCOC(=O)C=CSC=CC(=O)OCC	{40: 1, 1: 2, 2: 2, 28: 2, 6: 4}
OK	20633-06-1	CC1(CC(C(=O)C1=O)(C)C)C	{1: 4, 11: 1, 13: 2, 25: 2}
OK	20634-92-8	CCCN(CC)CCC	{1: 3, 2: 5, 33: 1}
OK	20637-49-4	COCC(COC)OC	{1: 3, 2: 2, 3: 1, 22: 3}
OK	20642-83-5	C1CCC2C=CC(C1)O2	{11: 4, 12: 2, 14: 2, 23: 1}
OK	206439-01-2	CCC1=CC(=O)C=C(C1=N)C	{1: 2, 2: 1, 36: 1, 14: 2, 15: 3, 25: 1}
OK	206439-03-4	CC1=CC(=O)C=C(C1=NC(=O)CCl)C	{1: 2, 2: 1, 34: 1, 14: 2, 15: 3, 17: 1, 24: 1, 25: 1}
OK	206439-04-5	CCC1=CC(=O)C=C(C1=NC(=O)CCl)CC	{1: 2, 2: 3, 34: 1, 14: 2, 15: 3, 17: 1, 24: 1, 25: 1}
OK	2065-35-2	C1(C(C1(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 6, 13: 3}
OK	20651-89-2	CC1(CCC(C(=O)C1=O)(C)C)C	{1: 4, 11: 2, 13: 2, 25: 2}
OK	20652-39-5	CCOC(=O)N(C(C)C)C(C)C	{1: 5, 2: 1, 3: 2, 28: 1, 33: 1}
OK	20654-47-1	CCCC(C)(C)C#N	{1: 3, 2: 2, 4: 1, 37: 1}
OK	20656-23-9	C12C3C4C3C5C4C1C25	{12: 8}
OK	20657-21-0	CC(=O)OC1CCC=C1	{1: 1, 11: 2, 12: 1, 14: 2, 28: 1}
OK	20661-60-3	CN(CC(=O)O)[N+](=O)[O-]	{1: 1, 2: 1, 27: 1, 38: 1, 33: 1}
OK	20669-04-9	CCC(C)(C)C(=O)C	{24: 1, 1: 4, 2: 1, 4: 1}
OK	20669-05-0	CCC(C)(C)C(=O)C(C)(C)C	{24: 1, 1: 6, 2: 1, 4: 2}
OK	2067-33-6	C(CCBr)CC(=O)O	{2: 4, 27: 1, 18: 1}
OK	20679-58-7	C(C=CCOC(=O)CBr)OC(=O)CBr	{2: 4, 28: 2, 18: 2, 6: 2}
OK	20679-59-8	C=C1CC=CC=C1	{11: 1, 5: 1, 14: 4, 15: 1}
OK	2068-24-8	C(C(=O)O)SCSCC(=O)O	{40: 2, 2: 3, 27: 2}
OK	20680-10-8	CCCOC(C)OCC	{1: 3, 2: 3, 3: 1, 22: 2}
OK	20682-80-8	CCCCCCCO[O]	{1: 1, 2: 6, 29: 1, 22: 1}
OK	20685-34-1	C=CC(C=C)(C=C)C=C	{4: 1, 5: 4, 6: 4}
OK	20687-01-8	CC(=CI)C	{1: 2, 19: 1, 6: 1, 7: 1}
OK	20701-68-2	C(CCC/C=C\CCCCCCCC(=O)O)CCCC(=O)O	{2: 14, 27: 2, 6: 2}
OK	20702-82-3	C1CSC(N1)C(C(C(C(CO)O)O)O)O	{32: 1, 2: 1, 3: 4, 41: 1, 11: 2, 12: 1, 20: 5}
OK	20706-25-6	CCCOCCOC(=O)C	{1: 2, 2: 4, 28: 1, 22: 1}
OK	20707-94-2	COC(=O)CCSSSCCC(=O)OC	{40: 3, 1: 2, 2: 4, 28: 2}
OK	20710-38-7	CCC/C(=C/C)/C	{1: 3, 2: 2, 6: 1, 7: 1}
OK	20711-10-8	CCC=CCCCCCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 6: 2}
OK	20717-38-8	CN1CN(N(CN1C)C)C	{1: 4, 11: 2, 33: 4}
OK	20726-63-0	CCNCC.CC(=O)O	{1: 3, 2: 2, 27: 1, 31: 1}
OK	20728-03-4	CC(CC1CC2CCC1C2)C=O	{1: 1, 2: 1, 3: 1, 11: 4, 12: 3, 26: 1}
OK	20729-41-3	CC=N	{1: 1, 36: 1, 6: 1}
OK	20731-23-1	COC(=O)CCCCCCC=C	{1: 1, 2: 6, 28: 1, 5: 1, 6: 1}
OK	20732-22-3	CCCN(CCC)CCC#N	{1: 2, 2: 6, 37: 1, 33: 1}
OK	20734-29-6	CCC(=O)CC(=O)C(C)(C)C	{24: 2, 1: 4, 2: 2, 4: 1}
OK	20739-58-6	CCCCCC#CCO	{1: 1, 2: 5, 20: 1, 10: 2}
OK	20739-59-7	CCC(C#CC)O	{1: 2, 2: 1, 3: 1, 20: 1, 10: 2}
OK	2074-80-8	CC(C)(CCl)Br	{1: 2, 2: 1, 4: 1, 18: 1, 17: 1}
OK	20748-86-1	CCCC(CC(C)O)O	{1: 2, 2: 3, 3: 2, 20: 2}
OK	20748-87-2	CCCCCCOC(=O)C(CC)CCCC	{1: 3, 2: 9, 3: 1, 28: 1}
OK	207505-73-5	CC1=CCC(CC1)C(C)(C)OC(=O)C2CCC=CC2	{1: 3, 4: 1, 11: 6, 12: 2, 14: 3, 15: 1, 28: 1}
OK	20754-04-5	CCCCC(=O)C(C)CC	{24: 1, 1: 3, 2: 4, 3: 1}
OK	20757-87-3	C=CC(=O)CCCl	{24: 1, 17: 1, 2: 2, 5: 1, 6: 1}
OK	207597-75-9	CC(CCCC(C)(C)OC)CC=CC(=CC(=O)O)C	{1: 5, 2: 4, 3: 1, 4: 1, 6: 3, 7: 1, 22: 1, 27: 1}
OK	20769-85-1	CC(C)(C(=O)Br)Br	{24: 1, 1: 2, 18: 2, 4: 1}
OK	2077-92-1	CC(=O)NC1CCC(CC1)NC(=O)C	{24: 2, 1: 2, 11: 4, 12: 2, 31: 2}
OK	20777-49-5	CC1CCC(CC1OC(=O)C)C(=C)C	{1: 3, 5: 1, 7: 1, 11: 3, 12: 3, 28: 1}
OK	2078-71-9	C(CO)NC(=O)N	{24: 1, 2: 2, 20: 1, 30: 1, 31: 1}
OK	20780-48-7	CCC(C)(CCCC(C)C)OC(=O)C	{1: 5, 2: 4, 3: 1, 4: 1, 28: 1}
OK	20780-49-8	CC(C)CCCC(C)CCOC(=O)C	{1: 4, 2: 5, 3: 2, 28: 1}
OK	2079-95-0	CCCCCCCCCCCCCCS	{1: 1, 2: 13, 39: 1}
OK	2080-58-2	C1CSC(=O)S1	{25: 1, 11: 2, 41: 2}
OK	2080-89-9	CC/C=C(\CC)/C=C	{1: 2, 2: 2, 5: 1, 6: 2, 7: 1}
OK	208041-98-9	CCCCCC(CCC)C#N	{1: 2, 2: 6, 3: 1, 37: 1}
OK	20809-46-5	CCCC(=O)CCC(C)C	{24: 1, 1: 3, 2: 4, 3: 1}
OK	2081-44-9	C1COCCC1O	{20: 1, 11: 4, 12: 1, 23: 1}
OK	20810-06-4	CCCCNCC(C)C	{1: 3, 2: 4, 3: 1, 31: 1}
OK	20810-21-3	CCCCCCC=CCCC	{1: 2, 2: 7, 6: 2}
OK	20810-22-4	CCCCC=CC(OCC)OCC	{1: 3, 2: 5, 3: 1, 22: 2, 6: 2}
OK	208113-95-5	CC(C)[C@H](CC(=O)O)C(=O)OC	{27: 1, 1: 3, 2: 1, 3: 2, 28: 1}
OK	20817-72-5	CCC(C=CC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C	{1: 6, 2: 1, 3: 3, 6: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1}
OK	20820-77-3	COC(=O)C/C(=C/C(=O)OC)/C(=O)OC	{1: 3, 2: 1, 28: 3, 6: 1, 7: 1}
OK	20825-07-4	C(C(=O)C(C(F)(F)F)(F)F)C(=O)C(F)(F)F	{16: 8, 24: 2, 2: 1, 4: 3}
OK	20825-71-2	C1C=COC1=O	{11: 1, 28: 1, 14: 2}
OK	20826-94-2	CCOC(=O)CC1CCCC1=O	{1: 1, 2: 2, 11: 3, 12: 1, 25: 1, 28: 1}
OK	20830-75-5	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5C[C@H]([C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)O)C)C)C)O)O	{1: 5, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 6, 22: 3, 23: 3, 28: 1}
OK	20839-15-0	CCCCCCCCCC(=O)O[C@@]12[C@@H](C1(C)C)[C@@H]3C=C(C[C@]4([C@H]([C@]3([C@@H]([C@H]2OC(=O)C)C)O)C=C(C4=O)C)O)CO	{1: 6, 2: 9, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	2084-18-6	CC(C)C(C)S	{1: 3, 3: 2, 39: 1}
OK	2084-19-7	CCCC(C)S	{1: 2, 2: 2, 3: 1, 39: 1}
OK	20845-34-5	CN1CCCCC1CO	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 20: 1}
OK	20846-91-7	C(CNC(CC(=O)O)C(=O)O)NC(CC(=O)O)C(=O)O	{27: 4, 2: 4, 3: 2, 31: 2}
OK	2085-66-7	CCC(C)(C)NC(C)(C)C	{1: 6, 2: 1, 4: 2, 31: 1}
OK	20858-12-2	CC(C)(C1=NCCN1)N=NC(C)(C)C2=NCCN2	{32: 2, 1: 4, 34: 2, 35: 2, 4: 2, 11: 4, 15: 2}
OK	20859-02-3	CC(C)(C)[C@@H](C(=O)O)N	{27: 1, 1: 3, 3: 1, 4: 1, 30: 1}
OK	20859-23-8	C([C@@H](C(=O)O)Br)C(=O)O	{27: 2, 2: 1, 3: 1, 18: 1}
OK	2088-07-5	CCC(C(=C)C)O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 20: 1}
OK	2088-35-9	C1CC1(Cl)Cl	{17: 2, 11: 2, 13: 1}
OK	20881-04-3	CC1(OC[C@@H]2[C@H](O1)[C@@H]3[C@H](O2)OC(O3)(C)C)C	{1: 4, 11: 1, 12: 4, 13: 2, 23: 5}
OK	20882-04-6	CC(=C)C(=O)OCCOC(=O)CCC(=O)O	{1: 1, 2: 4, 5: 1, 7: 1, 27: 1, 28: 2}
OK	2090-14-4	C1CCC2C(C1)CCC3C2CCC4C3CCCC4	{11: 12, 12: 6}
OK	2090-15-5	CCCCCCC(C1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 5, 3: 1, 12: 2}
OK	2090-16-6	C1CCC(CC1)CCC(CCC2CCCCC2)CCC3CCCCC3	{11: 15, 2: 6, 3: 1, 12: 3}
OK	2090-38-2	CC1CC(C(CC1C)C)C	{1: 4, 11: 2, 12: 4}
OK	20913-25-1	CCOC(=O)C1CC1C	{1: 2, 2: 1, 11: 1, 12: 2, 28: 1}
OK	20913-35-3	CCN(CC)C1=C(C(=C1C(=O)OCC)N(CC)CC)C(=O)OCC	{1: 6, 2: 6, 28: 2, 33: 2, 15: 4}
OK	20913-68-2	CCC(C[C@@H](C(=O)O)N)C(=O)O	{27: 2, 1: 1, 2: 2, 3: 2, 30: 1}
OK	20917-49-1	C1CCCN(CCC1)N=O	{33: 1, 34: 1, 11: 7, 29: 1}
OK	20917-50-4	C1CCCCN(CCC1)N=O	{33: 1, 34: 1, 11: 8, 29: 1}
OK	20919-96-4	C(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C[N+](=O)[O-]	{2: 3, 4: 1, 38: 4}
OK	20919-97-5	CC(C(C)([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 2, 4: 2, 38: 4}
OK	20919-99-7	C(C(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{2: 2, 3: 1, 4: 2, 38: 7}
OK	20937-57-9	CC(CC#CC(=C)C)O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 10: 2, 20: 1}
OK	20938-74-3	CC(=O)NSC	{24: 1, 1: 2, 40: 1, 31: 1}
OK	20939-00-8	CC1=C(C1C(=O)OC)C	{1: 3, 12: 1, 28: 1, 15: 2}
OK	2094-72-6	C1C2CC3CC1CC(C2)(C3)C(=O)Cl	{24: 1, 17: 1, 11: 6, 12: 3, 13: 1}
OK	2094-73-7	CCOC(=O)C12CC3CC(C1)CC(C3)C2	{1: 1, 2: 1, 11: 6, 12: 3, 13: 1, 28: 1}
OK	2094-75-9	CCC(C)(C)C=O	{1: 3, 2: 1, 4: 1, 26: 1}
OK	2094-92-0	C1CSCCOCO1	{41: 1, 11: 5, 23: 2}
OK	2094-97-5	C1CSCO1	{41: 1, 11: 3, 23: 1}
OK	2094-98-6	C1CCC(CC1)(C#N)N=NC2(CCCCC2)C#N	{34: 2, 11: 10, 13: 2, 37: 2}
OK	20959-33-5	CCCCCCCCCCC(C)CCCCCC	{1: 3, 2: 14, 3: 1}
OK	20965-27-9	C(CCCBr)CCC#N	{2: 6, 18: 1, 37: 1}
OK	20968-70-1	C=C1CCCC1=C	{11: 3, 5: 2, 15: 2}
OK	20996-62-7	CCSCC(=O)C	{24: 1, 1: 2, 2: 2, 40: 1}
OK	2100-17-6	C=CCCC=O	{2: 2, 26: 1, 5: 1, 6: 1}
OK	21016-46-6	CC(C)C=C(C)C(=O)O	{27: 1, 1: 3, 3: 1, 6: 1, 7: 1}
OK	21020-24-6	CC(C#C)Cl	{1: 1, 10: 1, 3: 1, 17: 1, 9: 1}
OK	21020-26-8	CCC(CC)C#C	{1: 2, 2: 2, 3: 1, 10: 1, 9: 1}
OK	21020-27-9	CC#CC(C)C	{1: 3, 10: 2, 3: 1}
OK	2103-16-4	CC(C(=O)O)C(C)(C)C(=O)O	{27: 2, 1: 3, 3: 1, 4: 1}
OK	2103-18-6	CCC(C(=O)O)C(CC)(CC)C(=O)O	{27: 2, 1: 3, 2: 3, 3: 1, 4: 1}
OK	21035-44-9	CCC(C)NCC	{1: 3, 2: 2, 3: 1, 31: 1}
OK	21036-96-4	CCCN1C(=O)C(=O)N(C1=O)CCC	{1: 2, 2: 4, 33: 2, 25: 3}
OK	2104-19-0	COC(=O)CCCCCCCC(=O)O	{1: 1, 2: 7, 27: 1, 28: 1}
OK	21041-71-4	CC(C)CNN=CC(C)C	{1: 4, 2: 1, 3: 2, 6: 1, 34: 1, 31: 1}
OK	21058-26-4	CCC[C](C)C	{1: 3, 2: 2, 7: 1}
OK	21059-09-6	CC1CC(C(=O)C(C1)C2CC(=O)NC(=O)C2CCO)C	{32: 1, 1: 2, 2: 2, 11: 3, 12: 5, 20: 1, 25: 3}
OK	2106-54-9	C(=O)(C(C(C(C(C(F)(F)Cl)(F)Cl)(F)F)(F)Cl)(F)F)O	{16: 8, 17: 3, 27: 1, 4: 5}
OK	21062-20-4	C(C(=O)Cl)OCC(=O)Cl	{24: 2, 17: 2, 2: 2, 22: 1}
OK	21063-40-1	COC(=O)C(=O)[C@H]([C@@H]([C@@H](CO)O)O)O	{1: 1, 2: 1, 3: 3, 20: 4, 24: 1, 28: 1}
OK	21063-71-8	CCC/C=C\CCC(=O)OC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	21071-39-6	CCSC=O	{40: 1, 1: 1, 2: 1, 26: 1}
OK	21078-72-8	CCCCCCC(C)(CC)O	{1: 3, 2: 6, 4: 1, 20: 1}
OK	21078-81-9	CCCCCCCCC(CCCC)CO	{1: 2, 2: 11, 3: 1, 20: 1}
OK	21078-83-1	CCCCCCCCCC(CCCC)O	{1: 2, 2: 11, 3: 1, 20: 1}
OK	21078-85-3	CCCCCCCCCCC(CCCC)CO	{1: 2, 2: 13, 3: 1, 20: 1}
OK	21078-87-5	CCCCCCCCCCCC(CCCC)O	{1: 2, 2: 13, 3: 1, 20: 1}
OK	2108-92-1	C1CCC(CC1)(Cl)Cl	{17: 2, 11: 5, 13: 1}
OK	21083-33-0	C1=CC(=C=O)C(=O)C=C1	{8: 1, 25: 1, 29: 1, 14: 4, 15: 1}
OK	21086-43-1	CCC(=CC)N1CCCCC1	{1: 2, 2: 1, 6: 1, 33: 1, 11: 5, 7: 1}
OK	2109-22-0	CC(C=O)C1CCCCC1	{11: 5, 1: 1, 26: 1, 3: 1, 12: 1}
OK	2109-23-1	CC(C)C(C)(CO)CO	{1: 3, 2: 2, 3: 1, 4: 1, 20: 2}
OK	2109-64-0	CCCCN(CCCC)CC(C)O	{1: 3, 2: 7, 3: 1, 20: 1, 33: 1}
OK	2109-66-2	CC(CN1CCOCC1)O	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 20: 1, 23: 1}
OK	2109-98-0	CC(C)C(C)C=O	{1: 3, 26: 1, 3: 2}
OK	2110-78-3	CC(C)(C(=O)OC)O	{1: 3, 4: 1, 20: 1, 28: 1}
OK	21101-85-9	CC(C#N)C(C)(C)C	{1: 4, 3: 1, 4: 1, 37: 1}
OK	21101-88-2	CCC(C)CC#N	{1: 2, 2: 2, 3: 1, 37: 1}
OK	21102-09-0	CCC(C(C)O)C(C)(C)C	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	21102-13-6	CCC(C)C(C)C(C)(C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	21102-88-5	CC1C2CCCCC2CCC1=O	{1: 1, 11: 6, 12: 3, 25: 1}
OK	2111-75-3	CC(=C)C1CCC(=CC1)C=O	{1: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	21115-77-5	CC1=CCCC=C(CCC(=CCC1)C)C	{1: 3, 11: 6, 14: 3, 15: 3}
OK	2112-08-5	C[C@@]12CCC[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@H](C4)C(=C)C5)C(=O)OC)OC2=O	{1: 2, 5: 1, 11: 7, 12: 4, 13: 3, 15: 1, 28: 2}
OK	211241-68-8	CC1=CCCC(C1C=CC(C)O)(C)C	{1: 4, 3: 1, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	21129-09-9	CCCCCCCCCCCCC(CO)O	{1: 1, 2: 12, 3: 1, 20: 2}
OK	21129-27-1	CC(C)C1CCC(CC1)(C)O	{1: 3, 3: 1, 11: 4, 12: 1, 13: 1, 20: 1}
OK	211299-54-6	C[C@@H]1CC[C@@H]2[C@@]13CC(C2(C)C)C4(C(C3)OC(O4)(C)C)C	{1: 6, 11: 4, 12: 4, 13: 4, 23: 2}
OK	211323-05-6	CC/C=C\C/C=C/CCOC(=O)C	{1: 2, 2: 4, 28: 1, 6: 4}
OK	2114-11-6	C=CCOC(=O)N	{2: 1, 30: 1, 28: 1, 5: 1, 6: 1}
OK	2114-18-3	C(CCl)OC(=O)N	{17: 1, 2: 2, 28: 1, 30: 1}
OK	2114-20-7	CCCCCCOC(=O)N	{1: 1, 2: 5, 28: 1, 30: 1}
OK	2114-32-1	CCC(C1CCCCC1)OC(=O)C	{1: 2, 2: 1, 3: 1, 11: 5, 12: 1, 28: 1}
OK	2114-42-3	C=CCC1CCCCC1	{2: 1, 11: 5, 12: 1, 5: 1, 6: 1}
OK	21145-78-8	C=CC1CC2CCC1C=C2	{14: 2, 11: 3, 12: 3, 5: 1, 6: 1}
OK	21149-19-9	CC(=CC(C=C)C(C)(C)O)C	{1: 4, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	21150-81-2	CCCCCC(=O)NCCCCCCNC(=O)CCCCC	{24: 2, 1: 2, 2: 14, 31: 2}
OK	21150-82-3	CCCCCCNC(=O)CCCCC(=O)NCCCCCC	{24: 2, 1: 2, 2: 14, 31: 2}
OK	21157-12-0	CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1C(=O)O)O.C1CCC(CC1)NC2CCCCC2	{1: 3, 4: 1, 33: 1, 11: 12, 12: 4, 20: 1, 27: 1, 28: 1, 31: 1}
OK	2117-11-5	CC(CC#C)O	{1: 1, 2: 1, 3: 1, 9: 1, 10: 1, 20: 1}
OK	21170-10-5	CC12CC(=O)CC1(CC(=O)C2)C	{1: 2, 11: 4, 13: 2, 25: 2}
OK	21179-48-6	CCCCOC(=O)C(CBr)Br	{1: 1, 2: 4, 3: 1, 28: 1, 18: 2}
OK	21188-58-9	CCCC(CC(=O)OC)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1}
OK	21188-61-4	CCCC(CC(=O)OCC)OC(=O)C	{1: 3, 2: 4, 3: 1, 28: 2}
OK	21195-59-5	CC1=CCC(C=C1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 1, 12: 1, 14: 3, 15: 1}
OK	21209-30-3	CCCCCCCCC=CCCCCCCCC(=O)OCCOCCOC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 32, 28: 2, 22: 1, 6: 4}
OK	2121-66-6	CCOC(=O)C(CC(C(=O)OCC)C(=O)OCC)C(=O)OCC	{1: 4, 2: 5, 3: 2, 28: 4}
OK	2121-67-7	CC(CC(C)C(=O)O)C(=O)O	{27: 2, 1: 2, 2: 1, 3: 2}
OK	2121-68-8	CC(CC(C)C(=O)OC)C(=O)OC	{1: 4, 2: 1, 3: 2, 28: 2}
OK	21217-75-4	CC(=C)C(=O)OCCOCCOCCOCCO	{1: 1, 2: 8, 5: 1, 7: 1, 20: 1, 22: 3, 28: 1}
OK	2122-29-4	C1CCN2CC3CC(C2C1)CN4C3C(CCC4)O	{20: 1, 11: 10, 12: 5, 33: 2}
OK	21224-03-3	CCCCCCCCC=CCCCCCCCC(=O)OCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 34, 28: 2, 6: 4}
OK	2123-88-8	CCCCCCCCCCCC(=O)OOC(C)(C)C	{1: 4, 2: 10, 4: 1, 22: 1, 28: 1}
OK	21249-59-2	CC(CC(=O)OC)Br	{1: 2, 2: 1, 3: 1, 28: 1, 18: 1}
OK	21250-85-1	CCOC(=NOC)C	{1: 3, 2: 1, 34: 1, 22: 2, 7: 1}
OK	212555-40-3	CC(C)(CO)CO.C(CC(=O)O)C(=O)O	{1: 2, 2: 4, 27: 2, 4: 1, 20: 2}
OK	21259-20-1	CC1=C[C@@H]2[C@](C[C@@H]1OC(=O)CC(C)C)([C@]3([C@@H]([C@H]([C@H]([C@]34CO4)O2)O)OC(=O)C)C)COC(=O)C	{1: 6, 2: 2, 3: 1, 11: 2, 12: 5, 13: 3, 14: 1, 15: 1, 20: 1, 23: 2, 28: 3}
OK	21266-88-6	CCCCC(C(C)Br)Br	{1: 2, 2: 3, 3: 2, 18: 2}
OK	21266-90-0	CCCC(C(CC)Br)Br	{1: 2, 2: 3, 3: 2, 18: 2}
OK	212755-85-6	CC1N[C@H](C(S1)(C)C)C(=O)O	{32: 1, 1: 3, 41: 1, 12: 2, 13: 1, 27: 1}
OK	21280-29-5	CC1(CCCC23C1CC(CC2)(C(=O)O3)C)C	{1: 3, 11: 6, 12: 1, 13: 3, 28: 1}
OK	21282-96-2	CC(=O)CC(=O)OCCOC(=O)C=C	{1: 1, 2: 3, 5: 1, 6: 1, 24: 1, 28: 2}
OK	21282-97-3	CC(=C)C(=O)OCCOC(=O)CC(=O)C	{1: 2, 2: 3, 5: 1, 7: 1, 24: 1, 28: 2}
OK	21284-11-7	C/C=C\C(=O)O[C@@H]1C[C@@H]2[C@]3(C1([C@@]4([C@H](O2)C=C([C@H]5[C@@H]4O5)C)C)C)CO3	{1: 4, 6: 2, 11: 2, 12: 5, 13: 3, 14: 1, 15: 1, 23: 3, 28: 1}
OK	21284-22-0	C12C3C4C1C5(C2C3=C45)O	{20: 1, 12: 5, 13: 1, 15: 2}
OK	2129-95-5	CCCCCCC=C(C)C	{1: 3, 2: 5, 6: 1, 7: 1}
OK	21291-99-6	C(C(CN)N)N	{2: 2, 3: 1, 30: 3}
OK	21293-01-6	CC=C(C)C(=CC)C	{1: 4, 6: 2, 7: 2}
OK	21293-29-8	CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C	{1: 4, 6: 3, 7: 1, 11: 1, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1, 27: 1}
OK	21298-22-6	C(CN(F)F)CN(F)F	{16: 4, 33: 2, 2: 3}
OK	21306-21-8	C1(=C(C(=O)C(C(=C1Cl)Cl)(Cl)Cl)Cl)Cl	{17: 6, 25: 1, 13: 1, 15: 4}
OK	2131-27-3	CCCCCCCCCCOC(=O)CCCCCCCC(=O)OCCCCCCCCCC	{1: 2, 2: 25, 28: 2}
OK	21326-62-5	CC(C(C)(C)O)Cl	{1: 3, 3: 1, 4: 1, 20: 1, 17: 1}
OK	213270-36-1	CC(C)C[C@@H](CC(=O)O)C(=O)OC	{27: 1, 1: 3, 2: 2, 3: 2, 28: 1}
OK	213270-44-1	COC(=O)[C@@H](CC(=O)O)C1CCCCC1	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 27: 1, 28: 1}
OK	2133-34-8	C1CN[C@@H]1C(=O)O	{27: 1, 32: 1, 11: 2, 12: 1}
OK	2133-40-6	COC(=O)[C@@H]1CCCN1.Cl	{32: 1, 1: 1, 11: 3, 12: 1, 17: 1, 28: 1}
OK	2134-29-4	C(CO)C=O	{2: 2, 20: 1, 26: 1}
OK	2134-48-7	CC(C#N)N	{1: 1, 3: 1, 37: 1, 30: 1}
OK	2135-17-3	C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C)F	{1: 3, 2: 1, 11: 3, 12: 5, 13: 4, 14: 3, 15: 1, 16: 2, 20: 3, 24: 1, 25: 1}
OK	2136-70-1	CCCCCCCCCCCCCCOCCO	{1: 1, 2: 15, 20: 1, 22: 1}
OK	2136-71-2	CCCCCCCCCCCCCCCCOCCO	{1: 1, 2: 17, 20: 1, 22: 1}
OK	2136-72-3	CCCCCCCCCCCCCCCCCCOCCO	{1: 1, 2: 19, 20: 1, 22: 1}
OK	2136-73-4	CCCCCCCCCCCCCCCCCCCCOCCO	{1: 1, 2: 21, 20: 1, 22: 1}
OK	2136-74-5	CCCCCCCCCCCCCCCCCCCCCCOCCO	{1: 1, 2: 23, 20: 1, 22: 1}
OK	21362-69-6	CC12CCC3C(C1CCC2OC4(CCCC4)OC)CCC5C3(CC6C(C5)S6)C	{1: 3, 41: 1, 11: 12, 12: 7, 13: 3, 22: 2}
OK	21370-71-8	C1CC[C@H]2[C@H](C1)CCCC2=O	{25: 1, 11: 7, 12: 2}
OK	21377-44-6	C1C=CCC23C1(CC=CC2)C(=O)C3=O	{25: 2, 11: 4, 13: 2, 14: 4}
OK	21377-45-7	C1CCC23CC=CCC2(C1)C(=O)C3=O	{25: 2, 11: 6, 13: 2, 14: 2}
OK	21377-46-8	C1CCC23CCCCC2(C1)C(=O)C3=O	{25: 2, 11: 8, 13: 2}
OK	21378-21-2	CC1=CC(CCC1)O	{1: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	2139-93-7	CCOC(=O)N(C(=O)C)OC(=O)C	{24: 1, 1: 3, 2: 1, 28: 2, 33: 1}
OK	21391-98-0	CC(C)C1CCC(=CC1)C=O	{1: 2, 3: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	21400-25-9	CC(=C(Cl)Cl)Cl	{1: 1, 17: 3, 7: 2}
OK	2141-58-4	C(CC#N)/C=C\C#N	{2: 2, 37: 2, 6: 2}
OK	2141-59-5	N#C/C=C/CCC#N	{2: 2, 37: 2, 6: 2}
OK	2141-62-0	CCOCCC#N	{1: 1, 2: 3, 37: 1, 22: 1}
OK	21411-81-4	CC1CCC(C(C1)N)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 30: 1}
OK	21416-67-1	CC(CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2	{32: 2, 1: 1, 2: 1, 3: 1, 33: 2, 11: 4, 25: 4}
OK	21426-37-9	C1CC12CCC23CC3	{11: 6, 13: 2}
OK	2143-53-5	C1=C[CH]C=C1	{14: 5}
OK	2143-61-5	CCCCOC1=CC2=CC[C@@H]3[C@@H]([C@]2(CC1)C)CC[C@]4([C@H]3CC[C@]4(C)O)C	{1: 4, 2: 3, 11: 7, 12: 3, 13: 3, 14: 2, 15: 2, 20: 1, 22: 1}
OK	21436-03-3	C1CC[C@@H]([C@H](C1)N)N	{11: 4, 12: 2, 30: 2}
OK	2144-41-4	C[C@@H]1CC[C@@H](O1)C	{1: 2, 11: 2, 12: 2, 23: 1}
OK	2144-53-8	CC(=C)C(=O)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 6, 5: 1, 7: 1, 16: 13, 28: 1}
OK	2144-54-9	CC(=C)C(=O)OCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 10, 5: 1, 7: 1, 16: 21, 28: 1}
OK	21451-76-3	CC=C(C)O	{1: 2, 20: 1, 6: 1, 7: 1}
OK	21457-22-7	CC1=CSC2=NC(CC(N12)(C)C)(C)O.Cl	{1: 4, 35: 1, 33: 1, 41: 1, 11: 1, 13: 2, 14: 1, 15: 2, 17: 1, 20: 1}
OK	21459-04-1	S1SSSSSS1	{41: 7}
OK	2146-36-3	C1CC2CCCC3C2C(C1)CC3	{11: 8, 12: 4}
OK	2146-37-4	CC=C1CCCC1	{1: 1, 11: 4, 6: 1, 15: 1}
OK	2146-38-5	CCC1=CCCC1	{1: 1, 2: 1, 11: 3, 14: 1, 15: 1}
OK	2146-41-0	CCC1CC2CCC1C2	{1: 1, 2: 1, 11: 4, 12: 3}
OK	21460-36-6	CC(COCC=C)O	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 20: 1, 22: 1}
OK	21461-84-7	C1CC(=O)O[C@@H]1C(=O)O	{27: 1, 28: 1, 11: 2, 12: 1}
OK	21462-09-9	C1C2CC(C1CC2O)O	{20: 2, 11: 3, 12: 4}
OK	21464-76-6	CCC1OCCC(O1)C	{1: 2, 2: 1, 11: 2, 12: 2, 23: 2}
OK	21466-08-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3CC[C@H](C4)O	{1: 1, 9: 1, 10: 1, 11: 9, 12: 4, 13: 2, 15: 2, 20: 2}
OK	21476-57-3	CC(=C)C(=O)OC(CN(C)C)CN(C)C	{1: 5, 2: 2, 3: 1, 5: 1, 7: 1, 33: 2, 28: 1}
OK	21482-12-2	CC(CO)OCC(C)OCC(C)OCC(C)OCC(C)O	{1: 5, 2: 5, 3: 5, 20: 2, 22: 4}
OK	21484-05-9	C(=C(\C(=C(Cl)Cl)Cl)/Cl)\Cl	{17: 5, 6: 1, 7: 3}
OK	214899-21-5	C[C@@H]1C[C@@H]([C@@]2(C[C@@H]3[C@H](O2)C4C[C@@H](C[C@@](O3)(O4)CC(=C)[C@@H]5[C@H](C[C@H]([C@@](O5)([C@@H]([C@@H]6C[C@@H]7[C@H](O6)C[C@H]([C@@]8(O7)CC[C@@]9(O8)C=CC[C@H](O9)/C=C/CCC(=O)O)C)O)O)C)C)C)NC1)C	{32: 1, 1: 6, 2: 3, 3: 1, 5: 1, 6: 2, 7: 1, 11: 11, 12: 14, 13: 5, 14: 2, 20: 2, 23: 8, 27: 1}
OK	2149-70-4	C(CC(C(=O)O)N)CN=C(N)N[N+](=O)[O-]	{2: 3, 3: 1, 38: 1, 7: 1, 34: 1, 27: 1, 30: 2, 31: 1}
OK	21490-63-1	C[C@H]1[C@@H](O1)C	{1: 2, 12: 2, 23: 1}
OK	2150-02-9	C(CS)OCCS	{2: 4, 22: 1, 39: 2}
OK	21504-43-8	CCOC(=CC)OCC	{1: 3, 2: 2, 22: 2, 6: 1, 7: 1}
OK	21508-07-6	CCCCC(C(C)O)O	{1: 2, 2: 3, 3: 2, 20: 2}
OK	21509-92-2	C(CNCCNCCNCCNC(=O)NCCNCCNCCNCCN)N	{24: 1, 2: 16, 30: 2, 31: 8}
OK	21517-94-2	C1C2CC3CC1CC(C2)[CH]3	{11: 5, 12: 4, 14: 1}
OK	2152-44-5	CCCCC(=O)O[C@@]1([C@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)C(=O)CO	{1: 4, 2: 4, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	215226-70-3	C(/C(=C(/C(=O)O)\Cl)/C=O)Cl	{17: 2, 2: 1, 27: 1, 26: 1, 7: 2}
OK	215226-71-4	C/C(=C(\C(=O)O)/Cl)/C=O	{1: 1, 26: 1, 27: 1, 17: 1, 7: 2}
OK	215226-72-5	C(C(=CC(=O)O)C(Cl)Cl)Cl	{2: 1, 3: 1, 6: 1, 7: 1, 17: 3, 27: 1}
OK	215226-73-6	C(C(=C(C(=O)O)Cl)C(Cl)Cl)Cl	{27: 1, 17: 4, 2: 1, 3: 1, 7: 2}
OK	21524-26-5	CCCCC1CCC=CC1	{1: 1, 2: 3, 11: 3, 12: 1, 14: 2}
OK	21531-91-9	CCCC(CCO)O	{1: 1, 2: 4, 3: 1, 20: 2}
OK	21539-47-9	CCNCCC#N	{1: 1, 2: 3, 37: 1, 31: 1}
OK	2154-50-9	CC[O]	{1: 1, 2: 1, 29: 1}
OK	2154-62-3	[CH2]CC=C	{2: 1, 5: 2, 6: 1}
OK	21542-96-1	CCCCCCCCCCCCCCCCCCCCCCN(C)C	{1: 3, 2: 21, 33: 1}
OK	21544-02-5	C1CC(C(C1)N)CN	{2: 1, 11: 3, 12: 2, 30: 2}
OK	21544-03-6	C1C=CCC(C1C(=O)OCC2CO2)C(=O)OCC3CO3	{2: 2, 11: 4, 12: 4, 14: 2, 23: 2, 28: 2}
OK	2155-60-4	CCCCOC(=O)CC(=C)C(=O)OCCCC	{1: 2, 2: 7, 28: 2, 5: 1, 7: 1}
OK	2155-94-4	CN(C)CC=C	{1: 2, 2: 1, 5: 1, 6: 1, 33: 1}
OK	2156-71-0	C1CCN(CC1)Cl	{17: 1, 11: 5, 33: 1}
OK	2156-72-1	CC(C)(C)N(Cl)Cl	{1: 3, 4: 1, 33: 1, 17: 2}
OK	2156-96-9	CCCCCCCCCCOC(=O)C=C	{1: 1, 2: 9, 28: 1, 5: 1, 6: 1}
OK	2156-97-0	CCCCCCCCCCCCOC(=O)C=C	{1: 1, 2: 11, 28: 1, 5: 1, 6: 1}
OK	21565-41-3	CC(=O)N1C=NN=N1	{24: 1, 1: 1, 35: 3, 14: 1, 33: 1}
OK	2157-01-9	CCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 7, 28: 1, 5: 1, 7: 1}
OK	2157-16-6	C(CCOC(=O)Cl)COC(=O)Cl	{17: 2, 2: 4, 28: 2}
OK	2157-31-5	CCC(C(C)(C)CO)O	{1: 3, 2: 2, 3: 1, 4: 1, 20: 2}
OK	2157-56-4	CC(=NO)CC(=NO)C	{1: 2, 2: 1, 20: 2, 34: 2, 7: 2}
OK	21570-35-4	CCCC(CC(C)C)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	21571-91-5	CCC(CC)(Cl)Cl	{1: 2, 2: 2, 4: 1, 17: 2}
OK	2158-03-4	C1CCN(CC1)C(=O)N	{24: 1, 33: 1, 11: 5, 30: 1}
OK	2158-08-9	CCCCCCCCCCCCCCCCCCNC(=O)N	{24: 1, 1: 1, 2: 17, 30: 1, 31: 1}
OK	2158-09-0	CCCCCCCCCCCCNC(=O)N	{24: 1, 1: 1, 2: 11, 30: 1, 31: 1}
OK	2158-31-8	C1CCCC(=NO)CC1	{34: 1, 11: 6, 20: 1, 15: 1}
OK	2158-55-6	CC1CCCC(CC1)(C)C	{1: 3, 11: 5, 12: 1, 13: 1}
OK	2158-76-1	C1=CC(=O)C(=CC1=O)N(CCO)CCO	{33: 1, 2: 4, 14: 3, 15: 1, 20: 2, 25: 2}
OK	2158-77-2	CC1=C(C(=O)C(=CC1=O)N(C)CCO)C	{1: 3, 2: 2, 33: 1, 14: 1, 15: 3, 20: 1, 25: 2}
OK	2158-78-3	CC1=CC(=O)C(=CC1=O)N(C)CCO	{1: 2, 2: 2, 33: 1, 14: 2, 15: 2, 20: 1, 25: 2}
OK	21586-21-0	CC(CC(C)(C)N)N	{1: 3, 2: 1, 3: 1, 4: 1, 30: 2}
OK	21587-74-6	C1C2(COC(O1)CCCN)COC(OC2)CCCN	{2: 6, 11: 4, 12: 2, 13: 1, 23: 4, 30: 2}
OK	2159-75-3	CCCCN=NCCCC	{1: 2, 2: 6, 34: 2}
OK	2160-89-6	C=CC(=O)OC(C(F)(F)F)C(F)(F)F	{3: 1, 4: 2, 5: 1, 6: 1, 16: 6, 28: 1}
OK	2160-93-2	CC(C)(C)N(CCO)CCO	{1: 3, 2: 4, 4: 1, 20: 2, 33: 1}
OK	2160-94-3	C1CC(CC=C1)(CO)CO	{2: 2, 11: 3, 20: 2, 13: 1, 14: 2}
OK	2161-90-2	COC1=CC=CCC1	{1: 1, 11: 2, 22: 1, 14: 3, 15: 1}
OK	2161-93-5	CC1=CCCC(=C1)OC	{1: 2, 11: 2, 22: 1, 14: 2, 15: 2}
OK	2162-86-9	CCN1CCCC(C1)C	{1: 2, 2: 1, 11: 4, 12: 1, 33: 1}
OK	2162-91-6	CCCCCN(CC)CC	{1: 3, 2: 6, 33: 1}
OK	2162-92-7	CCCCC(CCl)Cl	{1: 1, 2: 4, 3: 1, 17: 2}
OK	2162-98-3	C(CCCCCCl)CCCCCl	{17: 2, 2: 10}
OK	2162-99-4	C(CCCCCl)CCCCl	{17: 2, 2: 8}
OK	2163-00-0	C(CCCCl)CCCl	{17: 2, 2: 6}
OK	2163-42-0	CC(CO)CO	{1: 1, 2: 2, 3: 1, 20: 2}
OK	2163-44-2	CCOC(=O)C(C1CCCCC1)C(=O)OCC	{1: 2, 2: 2, 3: 1, 11: 5, 12: 1, 28: 2}
OK	2163-48-6	CCCC(C(=O)OCC)C(=O)OCC	{1: 3, 2: 4, 3: 1, 28: 2}
OK	2163-69-1	CN(C)C(=O)NC1CCCCCCC1	{1: 2, 33: 1, 11: 7, 12: 1, 24: 1, 31: 1}
OK	21635-90-5	C1CC2CC1C3C2C4CC3C=C4	{11: 4, 12: 6, 14: 2}
OK	2164-19-4	C[C@H]1CCCC[C@H]1N	{1: 1, 11: 4, 12: 2, 30: 1}
OK	21643-42-5	CCCCCCCCCCCCCCOC(=O)C=C	{1: 1, 2: 13, 28: 1, 5: 1, 6: 1}
OK	21652-58-4	C=CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 17, 4: 8, 5: 1, 6: 1}
OK	21655-48-1	C[C@@H]1CNC[C@@H](N1)C	{32: 2, 1: 2, 11: 2, 12: 2}
OK	21657-71-6	C1=CC2C(C=C1)C3C2C=CC=C3	{12: 4, 14: 8}
OK	216583-60-7	CCCCCCCCCCCCCCCCCC(=O)O.C(COCCO)N	{1: 1, 2: 20, 20: 1, 22: 1, 27: 1, 30: 1}
OK	21662-09-9	CCCCCC=CCCC=O	{1: 1, 2: 6, 26: 1, 6: 2}
OK	21668-03-1	CCCCCCCCCCCCOC(=O)CCC(=O)O	{1: 1, 2: 13, 27: 1, 28: 1}
OK	2167-23-9	CCC(C)(OOC(C)(C)C)OOC(C)(C)C	{1: 8, 2: 1, 4: 3, 22: 4}
OK	2167-31-9	C(#N)/C(=C(/C#N)\C(F)(F)F)/C(F)(F)F	{16: 6, 4: 2, 37: 2, 7: 2}
OK	2167-39-7	CC1CCO1	{1: 1, 11: 2, 12: 1, 23: 1}
OK	21676-01-7	CCC=CCCCl	{1: 1, 2: 3, 6: 2, 17: 1}
OK	21678-37-5	CC(C)C(=O)N(C)C	{24: 1, 1: 4, 3: 1, 33: 1}
OK	21681-47-0	CC1CC2CC1C3C2C4CC3C=C4	{1: 1, 11: 3, 12: 7, 14: 2}
OK	2169-64-4	CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C(=O)NC(=O)C=N2)OC(=O)C)OC(=O)C	{32: 1, 1: 3, 2: 1, 35: 1, 33: 1, 12: 4, 14: 1, 23: 1, 25: 2, 28: 3}
OK	21697-94-9	C(CCC(=O)O)CC(=O)O.C(CN)COCCOCCCN	{2: 12, 27: 2, 30: 2, 22: 2}
OK	21698-32-8	CCCC(=O)OCCC=C	{1: 1, 2: 4, 28: 1, 5: 1, 6: 1}
OK	21700-31-2	C(C(C(Cl)(Cl)Cl)Cl)Cl	{17: 5, 2: 1, 3: 1, 4: 1}
OK	21715-90-2	C1C2C=CC1C3C2C(=O)N(C3=O)O	{33: 1, 11: 1, 12: 4, 14: 2, 20: 1, 25: 2}
OK	21722-83-8	CC(=O)OCCC1CCCCC1	{1: 1, 2: 2, 11: 5, 12: 1, 28: 1}
OK	21729-98-6	COC(=O)NC#N	{1: 1, 28: 1, 37: 1, 31: 1}
OK	2173-56-0	CCCCCOC(=O)CCCC	{1: 2, 2: 7, 28: 1}
OK	21732-17-2	C1=NN=NN1CC(=O)O	{33: 1, 2: 1, 27: 1, 14: 1, 35: 3}
OK	21744-12-7	C1CC2CCC1CN2N=O	{33: 1, 34: 1, 11: 5, 12: 2, 29: 1}
OK	21746-40-7	CCCN1C(=O)C=CC1=O	{1: 1, 2: 2, 33: 1, 14: 2, 25: 2}
OK	21747-46-6	C[C@@H]1CCC2=C(CC[C@@H]3[C@H]([C@H]12)C3(C)C)C	{1: 4, 11: 4, 12: 4, 13: 1, 15: 2}
OK	2175-91-9	CC(=C1C=CC=C1)C	{1: 2, 15: 1, 14: 4, 7: 1}
OK	2177-18-6	C=CC(=O)OC=C	{28: 1, 5: 2, 6: 2}
OK	2177-22-2	CCC1(COC1)CCl	{1: 1, 2: 2, 11: 2, 13: 1, 17: 1, 23: 1}
OK	2177-32-4	CC(C)CC(=O)C=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 24: 1}
OK	2177-77-7	CCCC(C)C(=O)OC	{1: 3, 2: 2, 3: 1, 28: 1}
OK	2177-78-8	CCC(C)CC(=O)OC	{1: 3, 2: 2, 3: 1, 28: 1}
OK	2177-81-3	CCCCC(C)C(=O)OC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	2177-82-4	CCC(C)CCC(=O)OC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	2177-83-5	CC(C)CCCC(=O)OC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	2177-86-8	CCCCCCC(C)C(=O)OC	{1: 3, 2: 5, 3: 1, 28: 1}
OK	21778-29-0	CCCCCCCCCCCC(=O)O.C1COCCN1	{32: 1, 1: 1, 2: 10, 11: 4, 23: 1, 27: 1}
OK	2179-57-9	C=CCSSCC=C	{40: 2, 2: 2, 5: 2, 6: 2}
OK	2179-58-0	CSSCC=C	{40: 2, 1: 1, 2: 1, 5: 1, 6: 1}
OK	2179-59-1	CCCSSCC=C	{40: 2, 1: 1, 2: 3, 5: 1, 6: 1}
OK	2179-60-4	CCCSSC	{40: 2, 1: 2, 2: 2}
OK	21807-69-2	C1CCC(C(C1)C(=O)OCC2CO2)C(=O)OCC(COC(=O)C3CCCCC3C(=O)OCC4CO4)(COC(=O)C5CCCCC5C(=O)OCC6CO6)COC(=O)C7CCCCC7C(=O)OCC8CO8	{2: 8, 4: 1, 11: 20, 12: 12, 23: 4, 28: 8}
OK	2181-19-3	C1CN2CCC1(CC2)Br	{33: 1, 18: 1, 11: 6, 13: 1}
OK	21811-29-0	C([O])(F)(F)F	{16: 3, 4: 1, 29: 1}
OK	2182-55-0	C=COC1CCCCC1	{22: 1, 11: 5, 12: 1, 5: 1, 6: 1}
OK	21824-93-1	CCCCOC(=O)C(=C(C(Cl)(Cl)Cl)Cl)Cl	{1: 1, 2: 3, 4: 1, 7: 2, 17: 5, 28: 1}
OK	21835-00-7	CC1CC(=O)C(=C1C)O	{1: 2, 11: 1, 12: 1, 15: 2, 20: 1, 25: 1}
OK	21835-01-8	CCC1=C(C(=O)CC1)O	{1: 1, 2: 1, 11: 2, 15: 2, 20: 1, 25: 1}
OK	21842-58-0	C[C@H]1C[C@@H]2[C@H]([C@H](C3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5C(=O)[C@@H]4[C@H]3C)C)O)C)NC1	{32: 1, 1: 4, 11: 8, 12: 10, 13: 2, 14: 1, 15: 1, 20: 1, 23: 1, 25: 1}
OK	21849-74-1	CCN(CC)N(C)C	{1: 4, 2: 2, 33: 2}
OK	21856-89-3	CC(=O)CCCCO	{24: 1, 1: 1, 2: 4, 20: 1}
OK	21867-64-1	CCCN1CCNCC1	{32: 1, 1: 1, 2: 2, 11: 4, 33: 1}
OK	2188-18-3	CC(C)(C)OC(=O)N[C@@H](CCCN=C(N)N[N+](=O)[O-])C(=O)O	{1: 3, 2: 3, 3: 1, 4: 1, 38: 1, 7: 1, 34: 1, 27: 1, 28: 1, 30: 1, 31: 2}
OK	21884-26-4	CC(C)OC(=O)CCC(=O)C	{24: 1, 1: 3, 2: 2, 3: 1, 28: 1}
OK	21889-88-3	CC(=O)CCCC=C	{24: 1, 1: 1, 2: 3, 5: 1, 6: 1}
OK	2190-48-9	CC(C)(C=C)Cl	{1: 2, 4: 1, 5: 1, 6: 1, 17: 1}
OK	21947-75-1	C[C@H]1[C@H](O1)Cl	{1: 1, 23: 1, 12: 2, 17: 1}
OK	21947-76-2	CC1C(O1)Cl	{1: 1, 23: 1, 12: 2, 17: 1}
OK	21948-47-0	CCCCCC(C(C)Cl)Cl	{1: 2, 2: 4, 3: 2, 17: 2}
OK	2195-84-8	CC(=O)OC(OC(F)(F)F)(F)F	{16: 5, 1: 1, 4: 2, 22: 1, 28: 1}
OK	2196-23-8	CC=CC=CC=C	{1: 1, 5: 1, 6: 5}
OK	21962-24-3	CC=CC(OC)OC	{1: 3, 3: 1, 22: 2, 6: 2}
OK	21963-26-8	CCCCCC1C=CC(=O)O1	{1: 1, 2: 4, 12: 1, 14: 2, 28: 1}
OK	21964-23-8	CCC(=CC)Br	{1: 2, 2: 1, 18: 1, 6: 1, 7: 1}
OK	21964-25-0	CCCCCCCCCCCCCCC(C)(C)CC(=O)O	{1: 3, 2: 14, 27: 1, 4: 1}
OK	21964-44-3	CCCCCCC(C=C)O	{1: 1, 2: 5, 3: 1, 5: 1, 6: 1, 20: 1}
OK	21964-48-7	C=CCCCCCCCCCC=C	{2: 9, 5: 2, 6: 2}
OK	21964-49-8	C=CCCCCCCCCCCC=C	{2: 10, 5: 2, 6: 2}
OK	21964-51-2	C=CCCCCCCCCCCCCC=C	{2: 12, 5: 2, 6: 2}
OK	21968-17-2	CCCNC(C)C	{1: 3, 2: 2, 3: 1, 31: 1}
OK	21974-48-1	CC1CC(NC(C1)C)C	{32: 1, 1: 3, 11: 2, 12: 3}
OK	2198-20-1	C1CCCCC=CCCC1	{11: 8, 14: 2}
OK	2198-23-4	CCCCC=CCCC	{1: 2, 2: 5, 6: 2}
OK	2198-45-0	CCCCC(CCCC)N	{1: 2, 2: 6, 3: 1, 30: 1}
OK	2198-61-0	CCCCCC(=O)OCCC(C)C	{1: 3, 2: 6, 3: 1, 28: 1}
OK	2198-72-3	CCCC(CCC)(CCC)O	{1: 3, 2: 6, 4: 1, 20: 1}
OK	21981-37-3	CC(C)(C)NC(C)(C)C	{1: 6, 4: 2, 31: 1}
OK	21983-72-2	CC(=O)C(C)(OC)OC	{24: 1, 1: 4, 4: 1, 22: 2}
OK	21986-03-8	C=C=C=C=C	{8: 3, 5: 2}
OK	21987-21-3	CC(C)CCCCCCCCCCCO	{1: 2, 2: 11, 3: 1, 20: 1}
OK	21997-30-8	C=CCN1C=CC=CC1=O	{33: 1, 2: 1, 5: 1, 6: 1, 14: 4, 25: 1}
OK	220075-01-4	COC(=O)C(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)OC	{1: 2, 2: 2, 3: 1, 4: 6, 16: 13, 28: 2}
OK	22023-23-0	CCCCCCCCCCCCCOCCCNCCCN	{1: 1, 2: 18, 30: 1, 22: 1, 31: 1}
OK	22023-64-9	CCCN=C(C)C	{1: 3, 2: 2, 34: 1, 7: 1}
OK	22025-20-3	CCCC(C)(C)C(C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	22026-12-6	CCCCCCCC(=O)CCCCC	{24: 1, 1: 2, 2: 10}
OK	22029-76-1	CC1=C(C(CCC1)(C)C)C=CC(C)O	{1: 4, 3: 1, 6: 2, 11: 3, 13: 1, 15: 2, 20: 1}
OK	2203-24-9	C(=NN)(NN)NN	{34: 1, 31: 2, 30: 3, 7: 1}
OK	2203-34-1	CC(CCCl)O	{1: 1, 2: 2, 3: 1, 20: 1, 17: 1}
OK	2203-36-3	CC(CCOC(=O)C)Cl	{1: 2, 2: 2, 3: 1, 28: 1, 17: 1}
OK	2203-73-8	CCOC1OC(C(O1)(C)C)(C)C	{1: 5, 2: 1, 12: 1, 13: 2, 22: 1, 23: 2}
OK	2203-80-7	CC(C)CCC#C	{1: 2, 2: 2, 3: 1, 10: 1, 9: 1}
OK	22030-19-9	CC1=C(C(CCC1)(C)C)C=CC(C)OC(=O)C	{1: 5, 3: 1, 6: 2, 11: 3, 13: 1, 15: 2, 28: 1}
OK	22031-31-8	CCCCCCCCCCCCN.C(#N)S	{1: 1, 2: 11, 37: 1, 30: 1, 39: 1}
OK	22031-52-3	C1CC2C(C1)NC2=O	{32: 1, 25: 1, 11: 3, 12: 2}
OK	22037-73-6	CC(C=C)Br	{1: 1, 18: 1, 3: 1, 5: 1, 6: 1}
OK	22038-56-8	CC=C(C(=O)O)Cl	{1: 1, 27: 1, 17: 1, 6: 1, 7: 1}
OK	22038-57-9	CC=C(C(=O)OC)Cl	{1: 2, 17: 1, 28: 1, 6: 1, 7: 1}
OK	22041-19-6	CCOC(=O)CN1CCCC1	{1: 1, 2: 2, 11: 4, 28: 1, 33: 1}
OK	22041-39-0	CN(C)C(=O)CCN1CCCC1	{24: 1, 1: 2, 2: 2, 11: 4, 33: 2}
OK	22047-49-0	CCCCCCCCCCCCCCCCCC(=O)OCC(CC)CCCC	{1: 3, 2: 21, 3: 1, 28: 1}
OK	220497-69-8	COC(=O)[C@@H](CC1CCCCC1)CC(=O)O	{1: 1, 2: 2, 3: 1, 11: 5, 12: 1, 27: 1, 28: 1}
OK	220497-93-8	CC1(O[C@H]2[C@H](C[C@H]([C@@H]2O1)N)C(=O)O)C	{1: 2, 11: 1, 12: 4, 13: 1, 23: 2, 27: 1, 30: 1}
OK	220498-07-7	COC(=O)[C@H](CC(=O)O)C1CCCCC1	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 27: 1, 28: 1}
OK	220498-08-8	CC(C)[C@@H](CC(=O)O)C(=O)OC	{27: 1, 1: 3, 2: 1, 3: 2, 28: 1}
OK	2205-73-4	CC(=O)S[C@@H]1CC2=CC(=O)C[C@@H]([C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@]([C@]4(CC3)C)(C)O)C)SC(=O)C	{1: 5, 40: 2, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 20: 1, 24: 2, 25: 1}
OK	2205-78-9	CC(=O)OC1=CC2=CC[C@@H]3[C@@H]([C@H]2CC1)CC[C@]4([C@H]3CC[C@]4(C#C)OC(=O)C)C	{1: 3, 9: 1, 10: 1, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 28: 2}
OK	220507-10-8	CC1(O[C@H]2[C@H]3C[C@@H]([C@H]2O1)NC3=O)C	{32: 1, 1: 2, 11: 1, 12: 4, 13: 1, 23: 2, 25: 1}
OK	22052-81-9	CCOC(C(F)(F)F)(F)F	{16: 5, 1: 1, 2: 1, 4: 2, 22: 1}
OK	22052-84-2	COC(C(F)(F)F)(C(F)(F)F)F	{16: 7, 1: 1, 4: 3, 22: 1}
OK	22056-82-2	CCOCC=O	{1: 1, 2: 2, 26: 1, 22: 1}
OK	22058-01-1	CCCCCCCC#CCCC	{1: 2, 2: 8, 10: 2}
OK	22059-21-8	C1CC1(C(=O)O)N	{27: 1, 11: 2, 13: 1, 30: 1}
OK	2206-23-7	C/C=C/C#C	{1: 1, 10: 1, 6: 2, 9: 1}
OK	2206-24-8	CN(C)/C=C/C#C	{1: 2, 10: 1, 33: 1, 6: 2, 9: 1}
OK	2206-69-1	CC1=C(C2(C(C2(C1=O)C)(C)C)C)C	{1: 6, 25: 1, 13: 3, 15: 2}
OK	2206-89-5	C=CC(=O)OCCCl	{17: 1, 2: 2, 28: 1, 5: 1, 6: 1}
OK	220622-96-8	CCCCCCCCCCCCCCO.CCCCCCCCCCCCCO.CCCCCCCCCCCCO.C(CO)O.C(C(=O)O)O	{1: 3, 2: 39, 27: 1, 20: 6}
OK	2207-01-4	C[C@@H]1CCCC[C@@H]1C	{1: 2, 11: 4, 12: 2}
OK	2207-03-6	C[C@@H]1CCC[C@@H](C)C1	{1: 2, 11: 4, 12: 2}
OK	2207-04-7	CC1CCC(CC1)C	{1: 2, 11: 4, 12: 2}
OK	2207-27-4	COC1(C(=C(C(=C1Cl)Cl)Cl)Cl)OC	{1: 2, 17: 4, 13: 1, 22: 2, 15: 4}
OK	2207-76-3	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H](C4=CC(=O)CC[C@]34C)OO)C	{1: 5, 2: 3, 3: 2, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 22: 1, 25: 1}
OK	22072-19-1	C1CC(CSC1)O	{20: 1, 11: 4, 12: 1, 41: 1}
OK	2208-89-1	C(#N)NC(=O)N	{24: 1, 37: 1, 30: 1, 31: 1}
OK	2209-86-1	C(C(CO)(CCl)CCl)O	{17: 2, 2: 4, 4: 1, 20: 2}
OK	22092-38-2	CCCCCCCCCCCCCCCC1CO1	{1: 1, 2: 14, 11: 1, 12: 1, 23: 1}
OK	22092-57-5	CC(C)(CCCCCCC(C)(C)O)O	{1: 4, 2: 6, 4: 2, 20: 2}
OK	22092-58-6	CC(C)(CCCCCCCC(C)(C)O)O	{1: 4, 2: 7, 4: 2, 20: 2}
OK	22092-59-7	CC(C)(CCCCCCCCC(C)(C)O)O	{1: 4, 2: 8, 4: 2, 20: 2}
OK	22094-18-4	COC(CBr)(CBr)OC	{1: 2, 2: 2, 4: 1, 18: 2, 22: 2}
OK	22094-23-1	CC(C=O)OC(=O)C	{1: 2, 26: 1, 3: 1, 28: 1}
OK	22094-81-1	CCCCC1CC2CC1C=C2	{1: 1, 2: 3, 11: 2, 12: 3, 14: 2}
OK	22094-83-3	CCCCCCC1CC2CC1C=C2	{1: 1, 2: 5, 11: 2, 12: 3, 14: 2}
OK	22094-85-5	CCCCCCCCCCC1CC2CC1C=C2	{1: 1, 2: 9, 11: 2, 12: 3, 14: 2}
OK	2210-07-3	CC1CCC(=O)NCC1	{32: 1, 1: 1, 11: 4, 12: 1, 25: 1}
OK	2210-25-5	CC(C)NC(=O)C=C	{1: 2, 3: 1, 5: 1, 6: 1, 24: 1, 31: 1}
OK	2210-28-8	CCCOC(=O)C(=C)C	{1: 2, 2: 2, 28: 1, 5: 1, 7: 1}
OK	2210-32-4	CCC(C)OC(=O)C=CC(=O)OC(C)CC	{1: 4, 2: 2, 3: 2, 28: 2, 6: 2}
OK	2210-62-0	CCCCCCCCCCCCCCCC(=O)O.C(CO)N	{1: 1, 2: 16, 27: 1, 20: 1, 30: 1}
OK	22104-62-7	CC(CN(C)C)C(=O)C	{24: 1, 1: 4, 2: 1, 3: 1, 33: 1}
OK	22104-77-4	CCCCC=CCO	{1: 1, 2: 4, 20: 1, 6: 2}
OK	22104-79-6	CCCCCCC=CCO	{1: 1, 2: 6, 20: 1, 6: 2}
OK	22104-80-9	CCCCCCCC=CCO	{1: 1, 2: 7, 20: 1, 6: 2}
OK	2211-64-5	C1CCC(CC1)NO	{20: 1, 11: 5, 12: 1, 31: 1}
OK	2211-69-0	CC=C(C)Cl	{1: 2, 17: 1, 6: 1, 7: 1}
OK	2211-70-3	CCC(=C)Cl	{1: 1, 2: 1, 17: 1, 5: 1, 7: 1}
OK	22118-09-8	C(C(=O)Cl)Br	{24: 1, 17: 1, 2: 1, 18: 1}
OK	22118-12-3	CCC(C(=O)Cl)Br	{1: 1, 2: 1, 3: 1, 17: 1, 18: 1, 24: 1}
OK	2212-32-0	CN(C)CCN(C)CCO	{1: 3, 2: 4, 20: 1, 33: 2}
OK	2212-67-1	CCSC(=O)N1CCCCCC1	{1: 1, 2: 1, 33: 1, 40: 1, 11: 6, 24: 1}
OK	2212-99-9	CC1(C[C@H]2C=C([C@]34C[C@@]3([C@H]2C1)C(=O)OC4O)C=O)C	{1: 2, 11: 3, 12: 3, 13: 3, 14: 1, 15: 1, 20: 1, 26: 1, 28: 1}
OK	22122-36-7	CC1=CCOC1=O	{1: 1, 11: 1, 28: 1, 14: 1, 15: 1}
OK	22127-86-2	CCCCCCCC(CC#C)O	{1: 1, 2: 7, 3: 1, 9: 1, 10: 1, 20: 1}
OK	22128-43-4	CCCCC(C)(CC#C)O	{1: 2, 2: 4, 4: 1, 9: 1, 10: 1, 20: 1}
OK	22128-62-7	C(OC(=O)Cl)Cl	{17: 2, 2: 1, 28: 1}
OK	2213-00-5	CC1(C[C@H]2C=C([C@@]3(CC3([C@H]2C1)C(=O)OC)C=O)C=O)C	{1: 3, 11: 3, 12: 2, 13: 3, 14: 1, 15: 1, 26: 2, 28: 1}
OK	2213-08-3	CCOC(=O)CCNC	{1: 2, 2: 3, 28: 1, 31: 1}
OK	2213-23-2	CCCC(C)CC(C)C	{1: 4, 2: 3, 3: 2}
OK	2213-32-3	CC(C)CC(=C)C	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1}
OK	2213-43-6	C1CCN(CC1)N	{33: 1, 11: 5, 30: 1}
OK	2214-81-5	C1CCC=NCC1	{35: 1, 11: 5, 14: 1}
OK	22157-31-9	CC[C@@H](C)Cl	{1: 2, 2: 1, 3: 1, 17: 1}
OK	2216-21-9	CCCCCCCCC[N+](=O)[O-]	{1: 1, 2: 8, 38: 1}
OK	2216-30-0	CCC(C)CCC(C)C	{1: 4, 2: 3, 3: 2}
OK	2216-32-2	CCCC(CC)CCC	{1: 3, 2: 5, 3: 1}
OK	2216-33-3	CCCCCC(C)CC	{1: 3, 2: 5, 3: 1}
OK	2216-34-4	CCCCC(C)CCC	{1: 3, 2: 5, 3: 1}
OK	2216-35-5	CCCCCCCC(C)Br	{1: 2, 2: 6, 3: 1, 18: 1}
OK	2216-36-6	CCCCCCCC(C)Cl	{1: 2, 2: 6, 3: 1, 17: 1}
OK	2216-51-5	C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 20: 1}
OK	2216-52-6	C[C@@H]1CC[C@H]([C@H](C1)O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 20: 1}
OK	2216-70-8	CC=CC=CCC(C)C	{1: 3, 2: 1, 3: 1, 6: 4}
OK	2216-81-1	CCCCCCCOC(=O)CC	{1: 2, 2: 7, 28: 1}
OK	2216-87-7	CCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 8}
OK	2217-02-9	C[C@@]12CC[C@@H](C1)C([C@@H]2O)(C)C	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	2217-08-5	CCCC1(C(=O)NC(=O)NC1=O)CCC	{32: 2, 1: 2, 2: 4, 13: 1, 25: 3}
OK	2217-14-3	CCCOC(=O)C(C(C(=O)OCCC)O)O	{1: 2, 2: 4, 3: 2, 20: 2, 28: 2}
OK	2217-15-4	CC(C)OC(=O)C(C(C(=O)OC(C)C)O)O	{1: 4, 3: 4, 20: 2, 28: 2}
OK	2217-17-6	CC(C)CC(C)C(C)CC(C)C	{1: 6, 2: 2, 3: 4}
OK	2217-88-1	CCCCN(CCCC)C(=O)OCC	{1: 3, 2: 7, 28: 1, 33: 1}
OK	22186-64-7	C1(=C(C2(C3(C1(C23C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 18, 4: 6, 13: 4, 15: 2}
OK	2219-30-9	CC(C)([C@H](C(=O)O)N)S.Cl	{1: 2, 3: 1, 4: 1, 39: 1, 17: 1, 27: 1, 30: 1}
OK	2219-66-1	C(C#CCBr)Br	{2: 2, 18: 2, 10: 2}
OK	22195-47-7	CC1(OCC(O1)CN)C	{1: 2, 2: 1, 11: 1, 12: 1, 13: 1, 23: 2, 30: 1}
OK	2220-40-8	C1CC2C=CC1CC2=O	{25: 1, 11: 3, 12: 2, 14: 2}
OK	22202-65-9	CC#CCCCCCCCC(=O)O	{1: 1, 2: 7, 27: 1, 10: 2}
OK	22205-64-7	C1CCNCC1.C(#N)S	{32: 1, 11: 5, 37: 1, 39: 1}
OK	22207-84-7	C=C1CN2CCC1CC2	{33: 1, 11: 5, 12: 1, 5: 1, 15: 1}
OK	22208-25-9	CCC(COC(=O)CC(=O)C)(COC(=O)CC(=O)C)COC(=O)CC(=O)C	{24: 3, 1: 4, 2: 7, 4: 1, 28: 3}
OK	22227-75-4	CC(=C)C(Cl)Cl	{1: 1, 3: 1, 17: 2, 5: 1, 7: 1}
OK	2223-54-3	CC1(C=CC(C=C1)(C)C)C	{1: 4, 13: 2, 14: 4}
OK	22236-53-9	CCC(C)([N+](=O)[O-])Cl	{1: 2, 2: 1, 4: 1, 38: 1, 17: 1}
OK	22236-61-9	CC1(CC(C2C1CCCC2)(C)C3CCCCC3)C	{1: 3, 11: 10, 12: 3, 13: 2}
OK	2224-15-9	C1C(O1)COCCOCC2CO2	{2: 4, 11: 2, 12: 2, 22: 2, 23: 2}
OK	2224-37-5	CCCC(C[N+](=O)[O-])O	{1: 1, 2: 3, 3: 1, 20: 1, 38: 1}
OK	2224-44-4	CCC(CN1CCOCC1)[N+](=O)[O-]	{1: 1, 2: 2, 3: 1, 38: 1, 33: 1, 11: 4, 23: 1}
OK	2224-49-9	CCCCCCCCCCCC(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 16, 27: 1, 20: 3, 33: 1}
OK	2225-98-1	CC1(C2C1CC3(C(C2)O3)C)C	{1: 3, 11: 2, 12: 3, 13: 2, 23: 1}
OK	22250-05-1	C1CCC2(CC1)O[C@H]3[C@H]4[C@H]([C@@H](OC(O4)C5[C@@H]([C@@H]6[C@H](O5)OC7(O6)CCCCC7)O)O)O[C@H]3O2	{20: 2, 11: 10, 12: 10, 13: 2, 23: 8}
OK	2226-03-1	CC(=O)OCC=C1C2CCC(C2)C1(C)C	{1: 3, 2: 1, 6: 1, 11: 3, 12: 2, 13: 1, 15: 1, 28: 1}
OK	22262-60-8	COC(=O)C(CBr)CBr	{1: 1, 2: 2, 3: 1, 28: 1, 18: 2}
OK	2227-17-0	C1(=C(C(C(=C1Cl)Cl)(C2(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 10, 13: 2, 15: 8}
OK	2228-98-0	CC(C)(C)C1CCC=CC1	{1: 3, 11: 3, 4: 1, 14: 2, 12: 1}
OK	22287-02-1	CCCCC(=O)CCC(C)C	{24: 1, 1: 3, 2: 5, 3: 1}
OK	22289-05-0	CC(=O)CCC(=C)C(=O)C	{24: 2, 1: 2, 2: 2, 5: 1, 7: 1}
OK	2230-70-8	CC1CC(CCC1=O)(C)C	{1: 3, 11: 3, 12: 1, 13: 1, 25: 1}
OK	22306-28-1	CCCCCCCC(C)CCCCCCC	{1: 3, 2: 12, 3: 1}
OK	22315-31-7	CC(=CCN1CC2CCC(C1=O)N2C)C	{1: 3, 2: 1, 33: 2, 6: 1, 7: 1, 11: 3, 12: 2, 25: 1}
OK	22319-24-0	CCCC(=O)C=C(C)C	{24: 1, 1: 3, 2: 2, 6: 1, 7: 1}
OK	22323-45-1	C[C@]12CC[C@H]3C(=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)C1(CCC2=O)O	{1: 2, 11: 6, 12: 4, 13: 3, 14: 1, 15: 1, 20: 3, 25: 2}
OK	22323-82-6	CC1(OC[C@@H](O1)CO)C	{1: 2, 2: 1, 11: 1, 12: 1, 13: 1, 20: 1, 23: 2}
OK	22328-93-4	CCCC(C)C(CC=C)(C(=O)OCC)C(=O)OCC	{1: 4, 2: 5, 3: 1, 4: 1, 5: 1, 6: 1, 28: 2}
OK	2233-00-3	C=CC(Cl)(Cl)Cl	{17: 3, 4: 1, 5: 1, 6: 1}
OK	2234-26-6	C1CC2CC1CC2C#N	{11: 4, 12: 3, 37: 1}
OK	2234-75-5	CC1CCC(C(C1)C)C	{1: 3, 11: 3, 12: 3}
OK	22348-95-4	CCCCCC(=O)CC(=O)OC	{24: 1, 1: 2, 2: 5, 28: 1}
OK	22348-96-5	CCCCCCCC(=O)CC(=O)OC	{24: 1, 1: 2, 2: 7, 28: 1}
OK	22349-03-7	CCCCCCCCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 18, 11: 5, 12: 1}
OK	2235-00-9	C=CN1CCCCCC1=O	{25: 1, 11: 5, 5: 1, 6: 1, 33: 1}
OK	2235-12-3	C=C/C=C/C=C	{5: 2, 6: 4}
OK	2235-46-3	CCN(CC)C(=O)CC(=O)C	{24: 2, 1: 3, 2: 3, 33: 1}
OK	2236-11-5	COC(=O)C1CCCCC1O	{1: 1, 11: 4, 12: 2, 20: 1, 28: 1}
OK	2237-92-5	CC/C=C/C1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 2, 2: 2, 6: 2, 13: 1, 25: 3}
OK	22370-55-4	CC(C)CCCCCCCC=C	{1: 2, 2: 7, 3: 1, 5: 1, 6: 1}
OK	223719-29-7	CC(C)(C)C1CCC2C(C1)OCCOCCOC3CC(CCC3OCCOCCO2)C(C)(C)C	{1: 6, 11: 14, 4: 2, 12: 6, 23: 6}
OK	223736-95-6	CCCCCCCCCCCCCCCCCC(=O)OCC1COC2(O1)CCCCC2	{1: 1, 2: 17, 11: 6, 12: 1, 13: 1, 23: 2, 28: 1}
OK	2238-07-5	C1C(O1)COCC2CO2	{2: 2, 11: 2, 12: 2, 22: 1, 23: 2}
OK	22381-86-8	CCCCCCCC(C=CC)O	{1: 2, 2: 6, 3: 1, 20: 1, 6: 2}
OK	2239-78-3	CCCCCCCCCCCCCCCC(=O)OCCC	{1: 2, 2: 16, 28: 1}
OK	22393-85-7	CCCCCCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 27, 28: 1, 6: 2}
OK	22393-86-8	CCCCCCCCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 29, 28: 1, 6: 2}
OK	22393-96-0	CCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 33, 28: 1, 6: 2}
OK	22397-29-1	CN(C)CCOCCC#N	{1: 2, 2: 4, 37: 1, 22: 1, 33: 1}
OK	22397-31-5	C(COCCOCCOCCC#N)C#N	{2: 8, 37: 2, 22: 3}
OK	22397-33-7	CC1(CCC(OOC(OO1)(C)C)(C)C)C	{1: 6, 11: 2, 13: 3, 23: 4}
OK	22398-09-0	CCCC1CCNCC1	{32: 1, 1: 1, 2: 2, 11: 4, 12: 1}
OK	22398-14-7	COC=C(C(=O)OC)C(=O)OC	{1: 3, 28: 2, 22: 1, 6: 1, 7: 1}
OK	2240-88-2	C(CO)C(F)(F)F	{16: 3, 20: 1, 2: 2, 4: 1}
OK	22401-53-2	CC(=O)OC1(C=CC(O1)[N+](=O)[O-])C(=O)OC	{1: 2, 38: 1, 12: 1, 13: 1, 14: 2, 23: 1, 28: 2}
OK	22410-44-2	COC(C(F)(F)F)(F)F	{16: 5, 1: 1, 4: 2, 22: 1}
OK	22410-58-8	C(=C(C#N)Cl)Cl	{17: 2, 37: 1, 6: 1, 7: 1}
OK	22413-02-1	CCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 35, 28: 1}
OK	22413-03-2	CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 37, 28: 1}
OK	22414-24-0	CC1(C=CC(O1)OC)OC	{1: 3, 12: 1, 13: 1, 14: 2, 22: 2, 23: 1}
OK	22414-68-2	CCCCCCCCCC(=C)C=O	{1: 1, 2: 8, 26: 1, 5: 1, 7: 1}
OK	22417-45-4	CC(C)CC(CC(C)C)CO	{1: 4, 2: 3, 3: 3, 20: 1}
OK	22418-49-1	CC(=C)COC	{1: 2, 2: 1, 5: 1, 22: 1, 7: 1}
OK	2242-98-0	C[C@]12CCC(=O)C=C1[C@H](C[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@]4(C(=O)CO)O)C)O)O	{1: 2, 2: 1, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 20: 4, 24: 1, 25: 1}
OK	22421-97-2	CC(C)(C(=O)OC)Cl	{1: 3, 4: 1, 28: 1, 17: 1}
OK	22422-34-0	C[C@]1([C@@H]2C[C@@H](C2(C)C)C[C@@H]1O)O	{1: 3, 11: 2, 12: 3, 13: 2, 20: 2}
OK	22425-90-7	CC1CC(SC(O1)C)C	{1: 3, 11: 1, 12: 3, 41: 1, 23: 1}
OK	22425-92-9	CC1CC(SC(S1)C(C)(C)C)C	{1: 5, 11: 1, 4: 1, 12: 3, 41: 2}
OK	2243-27-8	CCCCCCCCC#N	{1: 1, 2: 7, 37: 1}
OK	2243-33-6	CC1=CC[C@H](C=C1)C(C)C	{1: 3, 3: 1, 11: 1, 12: 1, 14: 3, 15: 1}
OK	2243-88-1	CC1(C2CCC1(C(=O)C2[N+](=O)[O-])C)C	{1: 3, 38: 1, 11: 2, 12: 2, 13: 2, 25: 1}
OK	2243-98-3	CCCCCCCCCC#C	{1: 1, 2: 8, 10: 1, 9: 1}
OK	22430-66-6	C(#N)N=C=O	{8: 1, 34: 1, 29: 1, 37: 1}
OK	22431-10-3	CCCC(C)NC	{1: 3, 2: 2, 3: 1, 31: 1}
OK	22431-89-6	CC1(CCC(OO1)(C)C)C	{1: 4, 11: 2, 13: 2, 23: 2}
OK	22431-90-9	CC1(CC(OO1)(C)C)C	{1: 4, 11: 1, 13: 2, 23: 2}
OK	22432-79-7	CCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCC	{1: 2, 2: 35, 28: 1}
OK	22432-80-0	CCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCC	{1: 2, 2: 37, 28: 1}
OK	22433-33-6	CCCCCCC=C=C	{8: 1, 1: 1, 2: 5, 5: 1, 6: 1}
OK	22438-36-4	CCC(C)SC(C)C	{40: 1, 1: 4, 2: 1, 3: 2}
OK	22438-39-7	CCCCCCCCCCSC	{40: 1, 1: 2, 2: 9}
OK	2244-02-2	CCCCCCCCC=CC	{1: 2, 2: 7, 6: 2}
OK	2244-07-7	CCCCCCCCCCC#N	{1: 1, 2: 9, 37: 1}
OK	2244-16-8	CC1=CC[C@@H](CC1=O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	2244-85-1	CCCCCCC1CCOCO1	{1: 1, 2: 5, 11: 3, 12: 1, 23: 2}
OK	22445-43-8	CN1CCCCO1	{1: 1, 11: 4, 33: 1, 23: 1}
OK	22445-44-9	CN1CCCO1	{1: 1, 11: 3, 33: 1, 23: 1}
OK	2245-30-9	CC(C)(C)C1CO1	{1: 3, 11: 1, 4: 1, 12: 1, 23: 1}
OK	22451-48-5	CC(=C)C1CCC(CC1)CO	{1: 1, 2: 1, 5: 1, 7: 1, 11: 4, 12: 2, 20: 1}
OK	22451-73-6	CC1CCC2=C(CCC(CC12)C(C)(C)O)C	{1: 4, 4: 1, 11: 5, 12: 3, 15: 2, 20: 1}
OK	22452-25-1	CC1CC(SCO1)C	{1: 2, 11: 2, 12: 2, 41: 1, 23: 1}
OK	22457-23-4	CCC(C)CC(=NO)CC	{1: 3, 2: 3, 3: 1, 7: 1, 34: 1, 20: 1}
OK	22460-59-9	CC(CCC(C(=C)C)O)C=C	{1: 2, 2: 2, 3: 2, 5: 2, 6: 1, 7: 1, 20: 1}
OK	22461-89-8	CCC1CCCC(=O)C1	{1: 1, 2: 1, 11: 4, 12: 1, 25: 1}
OK	22469-52-9	CC(C)[C@@H]1CC[C@]2([C@H]3[C@@H]1[C@H]4[C@@]2([C@H]4C3)C)C	{11: 3, 1: 4, 3: 1, 12: 5, 13: 2}
OK	2247-91-8	CC(=O)OC(=C)C(F)(F)F	{1: 1, 4: 1, 5: 1, 7: 1, 16: 3, 28: 1}
OK	22471-55-2	CCOC(=O)[C@@H]1[C@H](CCCC1(C)C)C	{1: 4, 2: 1, 11: 3, 12: 2, 13: 1, 28: 1}
OK	22483-09-6	COC(CN)OC	{1: 2, 2: 1, 3: 1, 30: 1, 22: 2}
OK	22487-87-2	CCC(C)CC=CC	{1: 3, 2: 2, 3: 1, 6: 2}
OK	22497-19-4	CC1(CC(N=N1)(C)C(=O)OC)C	{1: 4, 11: 1, 28: 1, 13: 2, 35: 2}
OK	22502-03-0	CC(=O)CC(=O)OCCOC	{24: 1, 1: 2, 2: 3, 28: 1, 22: 1}
OK	22509-00-8	C1CC2CC1N=[N+]2[O-]	{33: 1, 11: 3, 12: 2, 29: 1, 35: 1}
OK	2252-78-0	C(C(F)(F)F)(C(F)(F)Br)F	{16: 6, 18: 1, 3: 1, 4: 2}
OK	2252-84-8	C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 3: 1, 4: 2}
OK	2252-95-1	C(=C=C(F)F)=C(F)F	{8: 2, 16: 4, 7: 2}
OK	22520-96-3	FI(F)F	{16: 3, 19: 1}
OK	22524-32-9	CCOC(=O)C(Cl)Br	{1: 1, 2: 1, 3: 1, 17: 1, 18: 1, 28: 1}
OK	22531-00-6	CCCCC1CCC=C1	{1: 1, 2: 3, 11: 2, 12: 1, 14: 2}
OK	22537-15-1	[Cl]	{17: 1}
OK	22539-72-6	CC(C)C1=CCC(=CC1)CO	{1: 2, 2: 1, 3: 1, 11: 2, 14: 2, 15: 2, 20: 1}
OK	22545-60-4	C1C2CC3CC1CC(C2)(C3)CN=C(CS)N.Cl	{2: 2, 34: 1, 7: 1, 11: 6, 12: 3, 13: 1, 17: 1, 39: 1, 30: 1}
OK	22551-26-4	CSCC(CO)O	{40: 1, 1: 1, 2: 2, 3: 1, 20: 2}
OK	22554-74-1	C1C(C(CO1)O)O	{20: 2, 11: 2, 12: 2, 23: 1}
OK	22555-53-9	CC(C)[C@@]12C[C@@H]1C(=C)[C@@H](C2)O	{1: 2, 3: 1, 5: 1, 11: 2, 12: 2, 13: 1, 15: 1, 20: 1}
OK	22567-21-1	C[C@H]1CC[C@@H](C[C@@H]1O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 3, 20: 1}
OK	22567-36-8	CC1=CC[C@H](CC1)[C@@]2(CC[C@@H](C(O2)(C)C)O)C	{1: 4, 11: 5, 12: 2, 13: 2, 14: 1, 15: 1, 20: 1, 23: 1}
OK	2257-35-4	C(=C(Cl)Cl)(C(=O)O)Cl	{17: 3, 27: 1, 7: 2}
OK	2257-46-7	COC(=O)C=C(Cl)Cl	{1: 1, 17: 2, 28: 1, 6: 1, 7: 1}
OK	2257-52-5	CC(C)NN	{1: 2, 3: 1, 30: 1, 31: 1}
OK	22570-53-2	C[C@]12CC[C@@H]([C@@H]1CC[C@@]3([C@@H]2CC[C@H]4[C@]3(C[C@@H]([C@@H]5[C@@]4(CCCC5(C)C)C)O)C)C)C(C)(C)O	{1: 8, 4: 1, 11: 10, 12: 6, 13: 5, 20: 2}
OK	22571-83-1	CC1(C(CC1C(=O)OC)CC(=O)OC)C	{1: 4, 2: 1, 11: 1, 12: 2, 13: 1, 28: 2}
OK	22571-95-5	C/C=C(\C)/C(=O)O[C@@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@@]([C@H](C)O)(C(C)C)O	{1: 5, 2: 1, 3: 2, 4: 1, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 2, 28: 2}
OK	22579-30-2	C1CCCC(CC1)CCBr	{2: 2, 11: 6, 12: 1, 18: 1}
OK	2258-58-4	CC=C(C)CC(=O)OC	{1: 3, 2: 1, 28: 1, 6: 1, 7: 1}
OK	22583-29-5	CN(C)C(=N)N.Cl	{1: 2, 36: 1, 33: 1, 7: 1, 17: 1, 30: 1}
OK	22584-31-2	C(CNCCN)C#N	{2: 4, 37: 1, 30: 1, 31: 1}
OK	22585-31-5	CC(C)(C)C(=C=C)C(C)(C)C	{8: 1, 1: 6, 4: 2, 5: 1, 7: 1}
OK	22589-04-4	CCCCCCCCCCCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 18}
OK	22590-50-7	C=CCOC1CC2CC1CC2OCC=C	{2: 2, 5: 2, 6: 2, 11: 3, 12: 4, 22: 2}
OK	22591-21-5	CC(C)(C)C(=O)C(Cl)Cl	{24: 1, 1: 3, 3: 1, 4: 1, 17: 2}
OK	22601-92-9	CC(=C)C1C(C(CCC1(C)C=C)COC(=O)C)(C)C	{1: 5, 2: 1, 5: 2, 6: 1, 7: 1, 11: 2, 12: 2, 13: 2, 28: 1}
OK	22604-06-4	C1C(=O)N=C(S1)SCC(=O)O	{2: 1, 35: 1, 40: 1, 41: 1, 11: 1, 15: 1, 25: 1, 27: 1}
OK	22610-61-3	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO)O	{1: 1, 2: 18, 3: 1, 20: 2, 28: 1}
OK	22616-15-5	CCCCCCC(C)(C=C)O	{1: 2, 2: 5, 4: 1, 5: 1, 6: 1, 20: 1}
OK	22625-57-6	C1C(OC(=O)N1)CCl	{32: 1, 2: 1, 11: 1, 12: 1, 17: 1, 28: 1}
OK	22627-70-9	CCOC1=CC(=O)CC1	{1: 1, 2: 1, 11: 2, 14: 1, 15: 1, 22: 1, 25: 1}
OK	22630-75-7	C1CC2CCC2=C1	{11: 4, 12: 1, 14: 1, 15: 1}
OK	22632-59-3	CCCC(CCC)C(=O)OC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	22634-89-5	CC1CC(OC(O1)C=C)(C)C	{1: 3, 5: 1, 6: 1, 11: 1, 12: 2, 13: 1, 23: 2}
OK	22635-78-5	C1C=CC12CC=C2	{11: 2, 13: 1, 14: 4}
OK	2264-21-3	[C](F)(F)F	{16: 3, 7: 1}
OK	226409-30-9	C=COCCCCOC(=O)C(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)OCCCCOC=C	{2: 10, 3: 1, 4: 6, 5: 2, 6: 2, 16: 13, 22: 2, 28: 2}
OK	22644-27-5	C[C@H](CC(=O)OC)C(=O)OC	{1: 3, 2: 1, 3: 1, 28: 2}
OK	22644-28-6	C[C@H](CCO)CO	{1: 1, 2: 3, 3: 1, 20: 2}
OK	22645-33-6	CCCCCCC1COC(OC1)C	{1: 2, 2: 5, 11: 2, 12: 2, 23: 2}
OK	22658-92-0	CCCCC[C@H](CC)O	{1: 2, 2: 5, 3: 1, 20: 1}
OK	22663-61-2	CCCCCCCCCCC(C)CO	{1: 2, 2: 10, 3: 1, 20: 1}
OK	22663-64-5	CCCCCCC(C)CCO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	22677-62-9	CC(C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)O)N	{1: 2, 2: 4, 3: 3, 24: 1, 27: 1, 30: 2, 31: 1}
OK	2268-32-8	C(=C/Cl)\F	{16: 1, 17: 1, 6: 2}
OK	2268-46-4	C(C(F)(F)Cl)(C(Cl)(Cl)Cl)(F)F	{16: 4, 17: 4, 4: 3}
OK	2268-98-6	CC(=O)[C@H]1CC[C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)OC(=O)C)C	{1: 4, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 24: 1, 25: 1, 28: 1}
OK	2269-21-8	CCCCCCCCCCCCCCCCN(CC(C)O)CC(C)O	{1: 3, 2: 17, 3: 2, 20: 2, 33: 1}
OK	22695-02-9	CC(C)COC(=O)CCSCCC(=O)OCC(C)C	{40: 1, 1: 4, 2: 6, 3: 2, 28: 2}
OK	2270-40-8	CC1=C[C@@H]2[C@](CC1)([C@]3([C@@H]([C@H]([C@H]([C@]34CO4)O2)O)OC(=O)C)C)COC(=O)C	{1: 4, 2: 1, 11: 3, 12: 4, 13: 3, 14: 1, 15: 1, 20: 1, 23: 2, 28: 2}
OK	2270-57-7	CCC(C)(CCC=C(C)C)O	{1: 4, 2: 3, 4: 1, 6: 1, 7: 1, 20: 1}
OK	2270-59-9	CC(=CCCBr)C	{1: 2, 2: 2, 18: 1, 6: 1, 7: 1}
OK	2270-60-2	CC(CCC=C(C)C)CC(=O)OC	{1: 4, 2: 3, 3: 1, 6: 1, 7: 1, 28: 1}
OK	22704-38-7	C/C=C\1/CCC=C1	{1: 1, 11: 2, 14: 2, 6: 1, 15: 1}
OK	2271-93-4	C1CN1C(=O)NCCCCCCNC(=O)N2CC2	{24: 2, 33: 2, 2: 6, 11: 4, 31: 2}
OK	22710-11-8	CCC(C)OC(=O)C(C)Cl	{1: 3, 2: 1, 3: 2, 28: 1, 17: 1}
OK	22710-13-0	CCC(C(=O)OCC(C)C)Cl	{1: 3, 2: 2, 3: 2, 28: 1, 17: 1}
OK	22715-68-0	CC(C(=O)NC)NC(=O)C	{24: 2, 1: 3, 3: 1, 31: 2}
OK	2273-41-8	CC(C)(C#N)N1CCCCC1	{1: 2, 11: 5, 4: 1, 37: 1, 33: 1}
OK	22734-04-9	C1CC=C(C1)CC#N	{2: 1, 11: 3, 37: 1, 14: 1, 15: 1}
OK	22736-20-5	C12(C3(C1(C4(C2(C34C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 18, 4: 6, 13: 6}
OK	2274-11-5	C=CC(=O)OCCOC(=O)C=C	{2: 2, 28: 2, 5: 2, 6: 2}
OK	2274-80-8	CCCCCCCCCCCCNCC(=O)O	{1: 1, 2: 12, 27: 1, 31: 1}
OK	22748-16-9	CC1(CC(=O)C=C1)C	{1: 2, 11: 1, 13: 1, 14: 2, 25: 1}
OK	22750-93-2	CCOCl(=O)(=O)=O	{1: 1, 2: 1, 29: 3, 22: 1, 17: 1}
OK	22759-33-7	CC1(C2CCC1(C(=O)C2O)C)C	{1: 3, 11: 2, 12: 2, 13: 2, 20: 1, 25: 1}
OK	22759-34-8	CC1(C2CCC1(C(C2=O)O)C)C	{1: 3, 11: 2, 12: 2, 13: 2, 20: 1, 25: 1}
OK	22767-90-4	CC(C)(C)C(=O)CC(=O)C(F)(F)F	{16: 3, 1: 3, 2: 1, 4: 2, 24: 2}
OK	22768-18-9	CCCC=C(C)CC	{1: 3, 2: 3, 6: 1, 7: 1}
OK	22769-00-2	C/C=C/C1C(CC1)/C=C/C	{1: 2, 11: 2, 12: 2, 6: 4}
OK	2277-19-2	CCC=CCCCCC=O	{1: 1, 2: 5, 26: 1, 6: 2}
OK	22771-44-4	CC(=C)C1CCC(C=C1)(C)O	{1: 2, 5: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 2, 20: 1}
OK	22787-68-4	CC(C(=C)C(=O)OC)OC(=O)C	{1: 3, 3: 1, 28: 2, 5: 1, 7: 1}
OK	2279-18-7	C=CCOC1CC2CC1C3C2CC=C3	{2: 1, 5: 1, 6: 1, 11: 3, 12: 5, 14: 2, 22: 1}
OK	22790-12-1	CC(=O)OCCOCCOCCOCCOC(=O)C	{1: 2, 2: 8, 28: 2, 22: 3}
OK	22790-13-2	CC(=O)OCCOCCOCCOCCOCCOC(=O)C	{1: 2, 2: 10, 28: 2, 22: 4}
OK	22795-97-7	CCN1CCC[C@@H]1CN	{1: 1, 2: 2, 33: 1, 11: 3, 12: 1, 30: 1}
OK	2280-27-5	CC(C)([C@@H](C(=O)O)N)O	{1: 2, 3: 1, 4: 1, 20: 1, 27: 1, 30: 1}
OK	2280-44-6	C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)O)O)O)O	{20: 5, 2: 1, 12: 5, 23: 1}
OK	2280-48-0	CC(C)([C@H](C(=O)O)N)O	{1: 2, 3: 1, 4: 1, 20: 1, 27: 1, 30: 1}
OK	22808-06-6	CC(C)(C)C=CC(C)(C)C	{1: 6, 4: 2, 6: 2}
OK	22809-37-6	C(CCC(=O)Cl)CCBr	{24: 1, 17: 1, 2: 5, 18: 1}
OK	22811-21-8	CCCCCCC(CCCC)(C(=NO)CCCC)O	{1: 3, 2: 11, 4: 1, 7: 1, 34: 1, 20: 2}
OK	22812-90-4	CCCSCCO	{40: 1, 1: 1, 2: 4, 20: 1}
OK	22823-50-3	CC(C)(C)OC(=O)N[C@@H](CCSC)C(=O)O.C1CCC(CC1)NC2CCCCC2	{1: 4, 2: 2, 3: 1, 4: 1, 40: 1, 11: 10, 12: 2, 27: 1, 28: 1, 31: 2}
OK	22825-58-7	CCN1CCCN1CC	{1: 2, 2: 2, 11: 3, 33: 2}
OK	22833-90-5	CC(C)(C)/C=C/C(=C)C(C)(C)C	{1: 6, 4: 2, 5: 1, 6: 2, 7: 1}
OK	22838-58-0	CC(C)[C@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 5, 3: 2, 4: 1, 27: 1, 28: 1, 31: 1}
OK	228412-89-3	CC(=O)COCC(COCC(=O)C)OCC(=O)C	{24: 3, 1: 3, 2: 5, 3: 1, 22: 3}
OK	22842-10-0	CC(=CCCC#C)C	{1: 2, 2: 2, 6: 1, 7: 1, 9: 1, 10: 1}
OK	22842-41-7	CC1(CC(=O)CC(S1)(C)C)C	{1: 4, 41: 1, 11: 2, 13: 2, 25: 1}
OK	22858-74-8	C1CC(CC=C1)CCC=O	{2: 2, 11: 3, 12: 1, 26: 1, 14: 2}
OK	2287-57-2	COC(=O)C12CCC(C1)CC2	{1: 1, 11: 5, 12: 1, 13: 1, 28: 1}
OK	2287-83-4	CCCCC(CC)COC(=O)CC(=C)C(=O)OCC(CC)CCCC	{1: 4, 2: 11, 3: 2, 5: 1, 7: 1, 28: 2}
OK	22874-80-2	CCCCOC(=O)CCC=C	{1: 1, 2: 5, 28: 1, 5: 1, 6: 1}
OK	2288-32-6	C/[N+](=N\CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)/[O-]	{1: 1, 2: 3, 33: 1, 12: 10, 34: 1, 20: 7, 22: 2, 23: 2, 29: 1}
OK	22880-03-1	CCCCCC=CC=CCCCCCCCCC(=O)O	{1: 1, 2: 12, 27: 1, 6: 4}
OK	22882-95-7	CCCCCC=CCC=CCCCCCCCC(=O)OC(C)C	{1: 3, 2: 12, 3: 1, 28: 1, 6: 4}
OK	22885-98-9	CC1C(=CC(=O)O1)O	{1: 1, 12: 1, 14: 1, 15: 1, 20: 1, 28: 1}
OK	22890-10-4	CCCCCCCC(=O)NCCCN(C)C	{24: 1, 1: 3, 2: 9, 33: 1, 31: 1}
OK	22890-14-8	CCCCCCCCCCCC(=O)NCCCN(C)C.CC(=O)O	{1: 4, 2: 13, 33: 1, 24: 1, 27: 1, 31: 1}
OK	22907-72-8	CC(C)C1CCC(CC1)C(C)C	{11: 4, 1: 4, 3: 2, 12: 2}
OK	22909-87-1	CCCCCCC(=O)OCCS	{1: 1, 2: 7, 28: 1, 39: 1}
OK	22919-58-0	CC/C(=C\1/C=CC(=O)C=C1O)/NO	{1: 1, 2: 1, 7: 1, 14: 3, 15: 2, 20: 2, 25: 1, 31: 1}
OK	2292-79-7	C1C2CC3C4C1C5CC(C4)CC3C5C2	{11: 6, 12: 8}
OK	2294-38-4	CC[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 1, 33: 1, 14: 5, 17: 1}
OK	2294-41-9	C1C2C=CC1C(=C2)Cl	{17: 1, 11: 1, 12: 2, 14: 3, 15: 1}
OK	2294-72-6	CCCCCC#CCCCC	{1: 2, 2: 7, 10: 2}
OK	2295-31-0	C1C(=O)NC(=O)S1	{32: 1, 25: 2, 11: 1, 41: 1}
OK	22954-83-2	CC1=CC(OC(=O)C1)(C)C	{1: 3, 11: 1, 13: 1, 14: 1, 15: 1, 28: 1}
OK	2296-13-1	CCCCCCNCCCCCC.Cl	{1: 2, 2: 10, 31: 1, 17: 1}
OK	2296-14-2	CCCCCCCCNCCCCCCCC.Cl	{1: 2, 2: 14, 31: 1, 17: 1}
OK	2296-53-9	C1CCN(CC1)C(=O)C(Cl)(Cl)Cl	{24: 1, 17: 3, 11: 5, 4: 1, 33: 1}
OK	22966-70-7	CC(C)(C=CC(C)(C)Cl)Cl	{1: 4, 4: 2, 6: 2, 17: 2}
OK	2297-30-5	CCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4OC(=O)CC)C)C	{1: 4, 2: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 2}
OK	22980-23-0	C1=CC2C1C(=O)O2	{28: 1, 12: 2, 14: 2}
OK	23009-74-7	C/C=C(/C)\CCl	{1: 2, 2: 1, 17: 1, 6: 1, 7: 1}
OK	23009-76-9	COC(=O)C(C(C(CO)O)O)O	{1: 1, 2: 1, 3: 3, 20: 4, 28: 1}
OK	23010-00-6	CC(C)/C=C/Cl	{1: 2, 3: 1, 6: 2, 17: 1}
OK	23010-04-0	CCC(C)(CCl)Cl	{1: 2, 2: 2, 4: 1, 17: 2}
OK	23010-05-1	CCC(C)C(Cl)Cl	{1: 2, 2: 1, 3: 2, 17: 2}
OK	23010-07-3	CC(CCl)C(C)Cl	{1: 2, 2: 1, 3: 2, 17: 2}
OK	23010-35-7	CCCCCCCCCCCCCCC(C)Cl	{1: 2, 2: 13, 3: 1, 17: 1}
OK	23014-56-4	CC1(CCCCCCCCC(CCCCCCCC1)(C)C)C	{1: 4, 11: 16, 13: 2}
OK	23014-57-5	CC1(CCCCCC(CCC(CCCCCC(CC1)(C)C)(C)C)(C)C)C	{1: 8, 11: 14, 13: 4}
OK	2303-16-4	CC(C)N(C(C)C)C(=O)SC/C(=C/Cl)/Cl	{1: 4, 2: 1, 3: 2, 33: 1, 6: 1, 7: 1, 40: 1, 17: 2, 24: 1}
OK	2303-17-5	CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl	{1: 4, 2: 1, 3: 2, 33: 1, 7: 2, 40: 1, 17: 3, 24: 1}
OK	23031-36-9	CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC#C	{1: 5, 2: 1, 6: 1, 7: 1, 9: 1, 10: 1, 11: 1, 12: 3, 13: 1, 15: 2, 25: 1, 28: 1}
OK	23032-21-5	CC(C)C[C@H](C(=O)OC)N	{1: 3, 2: 1, 3: 2, 28: 1, 30: 1}
OK	23037-20-9	CC1(CC(CC(N1)(C)C)(C#N)O)C	{32: 1, 1: 4, 37: 1, 11: 2, 13: 3, 20: 1}
OK	23044-57-7	CC(C)(C)N=C1N(N1C(C)(C)C)C	{1: 7, 34: 1, 4: 2, 33: 2, 15: 1}
OK	2305-05-7	CCCCCCCCC1CCC(=O)O1	{1: 1, 2: 7, 11: 2, 12: 1, 28: 1}
OK	2305-25-1	CCCC(CC(=O)OCC)O	{1: 2, 2: 4, 3: 1, 20: 1, 28: 1}
OK	2305-26-2	C1C=CC[C@@H]([C@@H]1C(=O)O)C(=O)O	{27: 2, 11: 2, 12: 2, 14: 2}
OK	2305-59-1	CC1(CN=CN1)C	{32: 1, 1: 2, 35: 1, 11: 1, 13: 1, 14: 1}
OK	23051-84-5	CCCCCCCC=CCCCC	{1: 2, 2: 9, 6: 2}
OK	23054-59-3	CCCCCC(=O)NCC(C)O	{1: 2, 2: 5, 3: 1, 20: 1, 24: 1, 31: 1}
OK	23054-60-6	CCCCCCCC(=O)NCC(C)O	{1: 2, 2: 7, 3: 1, 20: 1, 24: 1, 31: 1}
OK	23054-61-7	CCCCCCCCCC(=O)NCC(C)O	{1: 2, 2: 9, 3: 1, 20: 1, 24: 1, 31: 1}
OK	23056-94-2	CCC#CC(=C)C	{1: 2, 2: 1, 10: 2, 5: 1, 7: 1}
OK	23057-35-4	C1CCC2=CCC(C1)C2	{11: 6, 12: 1, 14: 1, 15: 1}
OK	23057-36-5	C1CC=C2CCC(C1)C2	{11: 6, 12: 1, 14: 1, 15: 1}
OK	2306-78-7	CC(=CCCC(=CCCC(C)(C=C)OC(=O)C)C)C	{1: 5, 2: 4, 4: 1, 5: 1, 6: 3, 7: 2, 28: 1}
OK	2306-88-9	CCCCCCCCOC(=O)CCCCCCC	{1: 2, 2: 13, 28: 1}
OK	2306-89-0	CCCCCCCCCCOC(=O)CCCCCCC	{1: 2, 2: 15, 28: 1}
OK	2306-91-4	CCCCCCCCCC(=O)OCCC(C)C	{1: 3, 2: 10, 3: 1, 28: 1}
OK	2306-92-5	CCCCCCCCCC(=O)OCCCCCCCC	{1: 2, 2: 15, 28: 1}
OK	23067-13-2	CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@@H]3[C@H]([C@@H](C[C@@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O.C([C@H]([C@H]([C@@H]([C@H](C(C(=O)O)O)O)O)O)O)O	{1: 13, 2: 2, 3: 5, 33: 1, 11: 3, 12: 15, 13: 3, 20: 11, 22: 3, 23: 2, 25: 1, 27: 1, 28: 1}
OK	23068-91-9	COC(CCCC(=O)OC)OC	{1: 3, 2: 3, 3: 1, 28: 1, 22: 2}
OK	2307-06-4	CCCCCCCCCCCCCCCCC1CCCC2(C1)CCCC2	{1: 1, 2: 15, 11: 8, 12: 1, 13: 1}
OK	2307-10-0	CCCSC(=O)C	{24: 1, 1: 2, 2: 2, 40: 1}
OK	23070-53-3	CC1=CCCCCCCCCCC1	{1: 1, 11: 10, 14: 1, 15: 1}
OK	23072-51-7	C(C([N+](=O)[O-])([N+](=O)[O-])F)([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{16: 1, 4: 2, 38: 5}
OK	23074-36-4	CCC(=C)Br	{1: 1, 2: 1, 18: 1, 5: 1, 7: 1}
OK	23074-42-2	C1C2CC3CC1CC(C2)(C3)C#N	{11: 6, 12: 3, 13: 1, 37: 1}
OK	23074-59-1	CC(C)COC1=CC(=O)CCC1	{1: 2, 2: 1, 3: 1, 11: 3, 14: 1, 15: 1, 22: 1, 25: 1}
OK	2308-18-1	CC(C)CCOC(=O)CC(=O)C	{24: 1, 1: 3, 2: 3, 3: 1, 28: 1}
OK	2308-38-5	CCCC(=O)OC(C)(C)C	{1: 4, 2: 2, 4: 1, 28: 1}
OK	2308-42-1	CNC=C	{1: 1, 5: 1, 6: 1, 31: 1}
OK	230969-99-0	CCCCCCCCCCCCOCCC	{1: 2, 2: 13, 22: 1}
OK	23097-98-5	CCC#CC(C)(C)CC	{1: 4, 2: 2, 4: 1, 10: 2}
OK	2310-98-7	CC(C)(Cl)Br	{1: 2, 18: 1, 4: 1, 17: 1}
OK	2311-14-0	CC(Br)(Br)Br	{1: 1, 18: 3, 4: 1}
OK	2311-46-8	CCCCCC(=O)OC(C)C	{1: 3, 2: 4, 3: 1, 28: 1}
OK	2311-59-3	CCCCCCCCCC(=O)OC(C)C	{1: 3, 2: 8, 3: 1, 28: 1}
OK	23110-15-8	CC(=CCC1C(O1)(C)C2C(C(CCC23CO3)OC(=O)C=CC=CC=CC=CC(=O)O)OC)C	{1: 4, 2: 1, 6: 9, 7: 1, 11: 3, 12: 4, 13: 2, 22: 1, 23: 2, 27: 1, 28: 1}
OK	23117-36-4	C=CC(=O)OCC1CCC(CC1)CO	{2: 2, 5: 1, 6: 1, 11: 4, 12: 2, 20: 1, 28: 1}
OK	2313-01-1	CCC1=CCC(=O)O1	{1: 1, 2: 1, 11: 1, 14: 1, 15: 1, 28: 1}
OK	2313-65-7	CCCC(C)C(C)O	{1: 3, 2: 2, 3: 2, 20: 1}
OK	2313-68-0	CCCCCOC(=O)C(C)(C)C	{1: 4, 2: 4, 4: 1, 28: 1}
OK	23132-47-0	CC1(CN1C)C	{1: 3, 11: 1, 13: 1, 33: 1}
OK	23133-37-1	CCCN1CCC(=O)CC1	{1: 1, 2: 2, 11: 4, 33: 1, 25: 1}
OK	23135-18-4	C/C=C/C(=O)N(C)C	{24: 1, 1: 3, 6: 2, 33: 1}
OK	23135-22-0	CNC(=O)O/N=C(/C(=O)N(C)C)\SC	{1: 4, 34: 1, 33: 1, 40: 1, 7: 1, 24: 1, 28: 1, 31: 1}
OK	2314-40-1	C1=CSC(=O)S1	{25: 1, 14: 2, 41: 2}
OK	2314-78-5	CCN1C(=O)CCC1=O	{1: 1, 2: 1, 11: 2, 33: 1, 25: 2}
OK	2314-97-8	C(F)(F)(F)I	{16: 3, 19: 1, 4: 1}
OK	23144-52-7	C(CCCCCl)CCCO	{17: 1, 2: 8, 20: 1}
OK	23144-68-5	C1CCC(CC1)NC(=O)C(Cl)(Cl)Cl	{4: 1, 11: 5, 12: 1, 17: 3, 24: 1, 31: 1}
OK	2315-36-8	CCN(CC)C(=O)CCl	{24: 1, 1: 2, 2: 3, 33: 1, 17: 1}
OK	2315-43-7	CC(C)CCN(C)C	{1: 4, 2: 2, 3: 1, 33: 1}
OK	23153-23-3	ClC(Cl)CC(Cl)(Cl)Cl	{17: 5, 2: 1, 3: 1, 4: 1}
OK	23154-08-7	C=C(C1CC1)C2CC2	{11: 4, 12: 2, 5: 1, 7: 1}
OK	23155-97-7	CC1=C(CCCC1)C=C	{1: 1, 11: 4, 5: 1, 6: 1, 15: 2}
OK	23158-89-6	CC(=C)C(=O)OCCNC(C)(C)C.Cl	{1: 4, 2: 2, 4: 1, 5: 1, 7: 1, 17: 1, 28: 1, 31: 1}
OK	23159-07-1	C1CCN(C1)CCCN	{33: 1, 2: 3, 11: 4, 30: 1}
OK	23169-87-1	C/C=C(\C)/O	{1: 2, 20: 1, 6: 1, 7: 1}
OK	2317-91-1	C=C(F)Cl	{16: 1, 17: 1, 5: 1, 7: 1}
OK	23171-85-9	CCC(C)(C)C(C)(C)O	{1: 5, 2: 1, 4: 2, 20: 1}
OK	23174-55-2	C1(=C(C2(C1(C(=C2C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F	{16: 18, 4: 6, 13: 2, 15: 4}
OK	2318-18-5	C/C=C\1/C[C@H]([C@@](C(=O)OC/C/2=C/CN(CC[C@H](C2=O)OC1=O)C)(C)O)C	{1: 4, 6: 1, 33: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 2, 20: 1, 25: 1, 28: 2}
OK	2318-25-4	CCOC(=N)CC(=O)OCC.Cl	{1: 2, 2: 3, 36: 1, 7: 1, 17: 1, 22: 1, 28: 1}
OK	23181-80-8	C(CCCN)CCC#N	{2: 6, 37: 1, 30: 1}
OK	23186-70-1	CCCCCOCC=C	{1: 1, 2: 5, 22: 1, 5: 1, 6: 1}
OK	2319-29-1	CCCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 8, 30: 1}
OK	2319-57-5	C([C@@H]([C@H](CO)O)O)O	{2: 2, 3: 2, 20: 4}
OK	2319-61-1	CC(C1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 3: 1, 12: 2}
OK	23192-42-9	CCCCCCCCC=CCCCCCCOC(=O)C	{1: 2, 2: 13, 28: 1, 6: 2}
OK	23197-86-6	C1C=CC2C1C3CC2C4C3C5CC4C6C5C7CC6C=C7	{11: 4, 12: 12, 14: 4}
OK	2320-30-1	CC1CC(CC(=O)C1)C	{1: 2, 11: 3, 12: 2, 25: 1}
OK	23201-84-5	CC(C)N=NC(C)C	{1: 4, 34: 2, 3: 2}
OK	23211-28-1	CCC1(CN2C3CCC(N2C1)CC3)CC	{1: 2, 2: 2, 33: 2, 11: 6, 12: 2, 13: 1}
OK	23213-96-9	CCOC(=N)C(Cl)(Cl)Cl	{1: 1, 2: 1, 4: 1, 7: 1, 17: 3, 22: 1, 36: 1}
OK	23217-98-3	CC1CC2CCCC3C2C(C1)CCC3	{1: 1, 11: 8, 12: 5}
OK	23220-25-9	CCCCCCCCCC(=O)NC	{24: 1, 1: 2, 2: 8, 31: 1}
OK	2323-81-1	CCOC(=O)CCCCCl	{1: 1, 2: 5, 28: 1, 17: 1}
OK	23235-61-2	CCC(CO)(CO)COCC(CC)(CO)CO	{1: 2, 2: 8, 4: 2, 22: 1, 20: 4}
OK	23238-40-6	CCCCCCCCCCOCCO	{1: 1, 2: 11, 20: 1, 22: 1}
OK	23246-96-0	C/C=C\1/CC(=C)[C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(CO)O	{1: 1, 2: 1, 5: 1, 6: 1, 33: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 3, 20: 2, 28: 2}
OK	2325-17-9	CC(C)C(C(=O)O)NC(=O)CN	{1: 2, 2: 1, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	2325-18-0	CCCC(C(=O)O)NC(=O)C(C)N	{1: 2, 2: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	23255-69-8	CC1=C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)OC(=O)C)C)CO	{1: 3, 2: 1, 11: 1, 12: 5, 13: 3, 14: 1, 15: 1, 20: 3, 23: 2, 25: 1, 28: 1}
OK	23261-20-3	C1C(O1)C(C(C2CO2)O)O	{11: 2, 20: 2, 3: 2, 12: 2, 23: 2}
OK	23267-57-4	CC(=O)C=CC12C(CCCC1(O2)C)(C)C	{1: 4, 6: 2, 11: 3, 13: 3, 23: 1, 24: 1}
OK	23268-00-0	NN.Br.Br	{18: 2, 30: 2}
OK	23282-20-4	CC1=C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3([C@@H]([C@H]([C@H](C34CO4)O2)O)O)C)CO	{1: 2, 2: 1, 11: 1, 12: 5, 13: 3, 14: 1, 15: 1, 20: 4, 23: 2, 25: 1}
OK	23283-97-8	C[C@@H]1CC[C@@H]([C@H](C1)O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 20: 1}
OK	23305-64-8	CCCOCCOCCOCCO	{1: 1, 2: 8, 20: 1, 22: 3}
OK	23314-06-9	CC(C)(C)N=CN(C)C	{1: 5, 34: 1, 4: 1, 6: 1, 33: 1}
OK	23315-05-1	CCCCCCC=C[N+](=NC(COC)C(C)O)[O-]	{1: 3, 2: 6, 3: 2, 6: 2, 33: 1, 34: 1, 20: 1, 22: 1, 29: 1}
OK	23326-27-4	CC#CC(=O)OC	{1: 2, 10: 2, 28: 1}
OK	23328-69-0	C1COCCN1Cl	{17: 1, 11: 4, 33: 1, 23: 1}
OK	23336-49-4	CCCCCCC(=O)OCC(C)(COC(=O)CCCCCC)COC(=O)CCCCCC	{1: 4, 2: 18, 4: 1, 28: 3}
OK	23337-88-4	CCCN(C)N(C)CCC	{1: 4, 2: 4, 33: 2}
OK	23337-93-1	CCN(C)N(C)CC	{1: 4, 2: 2, 33: 2}
OK	23349-98-6	C=CCSCCC(=O)O	{40: 1, 2: 3, 27: 1, 5: 1, 6: 1}
OK	23350-58-5	C/C=C/C(=O)N	{24: 1, 1: 1, 30: 1, 6: 2}
OK	23351-51-1	C(C(C(C(C(C(C(=O)O)O)O)O)O)O)O	{27: 1, 2: 1, 3: 5, 20: 6}
OK	23356-96-9	C1C[C@H](NC1)CO	{32: 1, 20: 1, 2: 1, 11: 3, 12: 1}
OK	23361-69-5	CCCC(=O)OCC(C)(C)C	{1: 4, 2: 3, 4: 1, 28: 1}
OK	23361-74-2	CCCCC(=O)OC(C)CC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	23361-78-6	CCCCC(=O)OC(C)(C)C	{1: 4, 2: 3, 4: 1, 28: 1}
OK	23370-68-5	CC1(CC(CC(C1)(C)CN2C(=O)N(C2=O)CC3(CC(CC(C3)(C)C)N=C=O)C)N=C=O)C	{1: 6, 2: 2, 34: 2, 33: 2, 8: 2, 11: 6, 12: 2, 13: 4, 25: 2, 29: 2}
OK	2338-45-6	CC(C)C(CC(=O)O)C(=O)O	{27: 2, 1: 2, 2: 1, 3: 2}
OK	23381-92-2	CCCCCCCC=C(C)C	{1: 3, 2: 6, 6: 1, 7: 1}
OK	23382-12-9	C(CO)N.Br	{2: 2, 20: 1, 18: 1, 30: 1}
OK	23394-15-2	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)CCCCC(=O)O[C@H]5CC[C@@]6([C@H]7CC[C@]8([C@H]([C@@H]7CC=C6C5)CC[C@@H]8[C@H](C)CCCC(C)C)C)C)C)C	{1: 10, 2: 10, 3: 4, 11: 16, 12: 10, 13: 4, 14: 2, 15: 2, 28: 2}
OK	23397-76-4	C1CCC2(CC1)OC[C@@H](O2)[C@@H]3[C@@H]([C@@H]4[C@H](O3)OC5(O4)CCCCC5)O	{20: 1, 11: 11, 12: 5, 13: 2, 23: 5}
OK	23410-40-4	CCCCCCCCC(=O)N1CCCCCC1	{24: 1, 1: 1, 2: 7, 11: 6, 33: 1}
OK	23412-21-7	CCC(C)OC(=O)C(C)C	{1: 4, 2: 1, 3: 2, 28: 1}
OK	23418-37-3	CCCCC(C)(CCC)O	{1: 3, 2: 5, 4: 1, 20: 1}
OK	23418-38-4	CCCCCC(C)(CCC)O	{1: 3, 2: 6, 4: 1, 20: 1}
OK	23418-82-8	C1CC(CCCC(C1)O)O	{20: 2, 11: 6, 12: 2}
OK	23433-04-7	CCCCC(CCO)O	{1: 1, 2: 5, 3: 1, 20: 2}
OK	23433-05-8	CCCCCC(CCO)O	{1: 1, 2: 6, 3: 1, 20: 2}
OK	23433-07-0	CCCCCCC(CCO)O	{1: 1, 2: 7, 3: 1, 20: 2}
OK	23436-19-3	CC(C)COCC(C)O	{1: 3, 2: 2, 3: 2, 20: 1, 22: 1}
OK	23438-77-9	CC1=CC(=O)C(CC1)(C)C	{1: 3, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	23443-59-6	CC[CH]CC	{1: 2, 2: 2, 6: 1}
OK	23448-68-2	CCCCC(=O)OCCCC(OOC(C)(C)C)OOC(C)(C)C	{1: 7, 2: 6, 3: 1, 4: 2, 22: 4, 28: 1}
OK	2345-12-2	CC(=O)CCCCCCCCCCC(=O)O	{24: 1, 1: 1, 2: 10, 27: 1}
OK	2345-24-6	CC(C)C(=O)OCC=C(C)CCC=C(C)C	{1: 5, 2: 3, 3: 1, 6: 2, 7: 2, 28: 1}
OK	2345-27-9	CCCCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 11}
OK	2345-28-0	CCCCCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 12}
OK	2345-51-9	C#CCC(=O)O	{9: 1, 2: 1, 27: 1, 10: 1}
OK	23458-49-3	CCCCN=C1C(C(=O)C1(C)C)(C)C	{1: 5, 2: 3, 34: 1, 13: 2, 25: 1, 15: 1}
OK	2346-00-1	CC1=NCCS1	{1: 1, 11: 2, 41: 1, 35: 1, 15: 1}
OK	2346-81-8	CCCC(CC)Cl	{1: 2, 2: 3, 3: 1, 17: 1}
OK	23470-00-0	CCCCCCCCCCCCCCCC(=O)OC(CO)CO	{1: 1, 2: 16, 3: 1, 20: 2, 28: 1}
OK	23474-91-1	CC=CC(=O)OOC(C)(C)C	{1: 4, 4: 1, 22: 1, 6: 2, 28: 1}
OK	2348-55-2	CC[CH]C	{1: 2, 2: 1, 6: 1}
OK	2349-07-7	CCCCCCOC(=O)C(C)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	2349-13-5	CCCCCCCOC(=O)C(C)C	{1: 3, 2: 6, 3: 1, 28: 1}
OK	2350-11-0	CCCCCCCCCCC(C)Cl	{1: 2, 2: 9, 3: 1, 17: 1}
OK	2350-21-2	CCCCC(C)CCCl	{1: 2, 2: 5, 3: 1, 17: 1}
OK	2350-24-5	CCC(C)CCCCCl	{1: 2, 2: 5, 3: 1, 17: 1}
OK	2350-26-7	CCC(C)C(C)CCCl	{1: 3, 2: 3, 3: 2, 17: 1}
OK	2351-15-7	C(C1[C@@H](C(C([C@H](O1)O)N)O)O)O	{20: 4, 2: 1, 12: 5, 30: 1, 23: 1}
OK	2351-90-8	CCCCCC=CC(=O)OCC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	23521-49-5	CCOC=CBr	{1: 1, 2: 1, 22: 1, 18: 1, 6: 2}
OK	23522-05-6	C[C@H]1[C@@H]2CC[C@]3(C(=O)CCC(=C3[C@H]2OC1=O)C)C	{1: 3, 11: 4, 12: 3, 13: 1, 15: 2, 25: 1, 28: 1}
OK	2354-06-5	C(C(F)(Cl)Cl)(C(Cl)(Cl)Cl)(F)F	{16: 3, 17: 5, 4: 3}
OK	23542-51-0	C=CCCC[N+](=O)[O-]	{2: 3, 38: 1, 5: 1, 6: 1}
OK	23559-36-6	C1(C(C(C2C(C1O)O2)O)O)O	{20: 4, 12: 6, 23: 1}
OK	2356-61-8	C(C(OC(F)(F)F)(F)F)(F)F	{16: 7, 3: 1, 4: 2, 22: 1}
OK	23578-35-0	CC(C)(CCC(C)(C)N)N	{1: 4, 2: 2, 4: 2, 30: 2}
OK	2358-38-5	CCCC(F)F	{16: 2, 1: 1, 2: 2, 3: 1}
OK	23580-51-0	CCCCCC(C)(C#C)O	{1: 2, 2: 4, 4: 1, 9: 1, 10: 1, 20: 1}
OK	2359-11-7	C1CCC2(CC1)N(CCO2)CCO	{33: 1, 2: 2, 11: 7, 13: 1, 20: 1, 23: 1}
OK	2359-15-1	CC(=C)C(=O)NCNC(=O)C(=C)C	{1: 2, 2: 1, 5: 2, 7: 2, 24: 2, 31: 2}
OK	23601-40-3	COCCOCCOCCOCCOCCOCCO	{1: 1, 2: 12, 20: 1, 22: 6}
OK	23602-10-0	CCC(C)(C)NC=O	{1: 3, 2: 1, 4: 1, 26: 1, 31: 1}
OK	23603-63-6	C1CC1C=C(C2CC2)C3CC3	{11: 6, 12: 3, 6: 1, 7: 1}
OK	23605-05-2	C[C@@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3([C@H]4C[C@H]([C@@]5([C@H](CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)O)C=O)O)O)O	{1: 2, 11: 9, 12: 10, 13: 4, 14: 1, 15: 1, 20: 6, 22: 1, 23: 1, 26: 1, 28: 1}
OK	2363-58-8	CC12CCC3C(C1CCC2O)CCC4C3(CC5C(C4)S5)C	{1: 2, 41: 1, 11: 8, 12: 7, 13: 2, 20: 1}
OK	2363-71-5	CCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 19, 27: 1}
OK	2363-88-4	CCCCCC=CC=CC=O	{1: 1, 2: 4, 26: 1, 6: 4}
OK	236408-20-1	C[C@@H](C1(C=CC(O1)OC)OC)O	{1: 3, 3: 1, 12: 1, 13: 1, 14: 2, 20: 1, 22: 2, 23: 1}
OK	2365-30-2	C(CCl)N(C(=O)N)N=O	{33: 1, 2: 2, 34: 1, 17: 1, 24: 1, 29: 1, 30: 1}
OK	2365-48-2	COC(=O)CS	{1: 1, 2: 1, 28: 1, 39: 1}
OK	23654-92-4	CC1SC(SS1)C	{1: 2, 12: 2, 41: 3}
OK	23657-27-4	C1C[C@H]2C[C@@H]1[C@@H]3[C@H]2SSS3	{41: 3, 11: 3, 12: 4}
OK	2366-31-6	C(=CBr)F	{16: 1, 18: 1, 6: 2}
OK	2366-36-1	C(C(Cl)(Cl)Cl)F	{16: 1, 17: 3, 2: 1, 4: 1}
OK	2366-52-1	CCCCF	{16: 1, 1: 1, 2: 3}
OK	23661-84-9	CC(C)(C)OOC(C)(C)CCC(C)(C)OO	{1: 7, 2: 2, 4: 3, 22: 3, 20: 1}
OK	2367-25-1	COC(=O)/C=C/CF	{16: 1, 1: 1, 2: 1, 28: 1, 6: 2}
OK	23674-86-4	CCCC(=O)O[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)O)C)C(=O)COC(=O)C	{1: 4, 2: 3, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 2, 20: 1, 24: 1, 25: 1, 28: 2}
OK	23691-13-6	C=CC(=C)CBr	{2: 1, 18: 1, 5: 2, 6: 1, 7: 1}
OK	2370-12-9	CCCC(C)(C)CO	{1: 3, 2: 3, 4: 1, 20: 1}
OK	2370-13-0	CCCCC(C)(C)CO	{1: 3, 2: 4, 4: 1, 20: 1}
OK	2370-14-1	CCCCCCC(C)(C)CO	{1: 3, 2: 6, 4: 1, 20: 1}
OK	2370-15-2	CCCCCCCCC(C)(C)CO	{1: 3, 2: 8, 4: 1, 20: 1}
OK	2370-63-0	CCOCCOC(=O)C(=C)C	{1: 2, 2: 3, 5: 1, 7: 1, 22: 1, 28: 1}
OK	23700-63-2	CC(C)(C)C#CI	{1: 3, 10: 2, 19: 1, 4: 1}
OK	23708-56-7	CCCCCC(CCCCC)O	{1: 2, 2: 8, 3: 1, 20: 1}
OK	2371-08-6	CC(CC(C)(C)C)CCl	{1: 4, 2: 2, 3: 1, 4: 1, 17: 1}
OK	2371-19-9	CCCCC(C)C(=O)C	{24: 1, 1: 3, 2: 3, 3: 1}
OK	2371-42-8	CC1(C2CCC1(C(C2)(C)O)C)C	{1: 4, 11: 3, 12: 1, 13: 3, 20: 1}
OK	2372-99-8	C1SCSCSCSCS1	{41: 5, 11: 5}
OK	23726-93-4	C/C=C/C(=O)C1=C(C=CCC1(C)C)C	{1: 4, 6: 2, 11: 1, 13: 1, 14: 2, 15: 2, 24: 1}
OK	2373-00-4	C1SCSCSCS1	{41: 4, 11: 4}
OK	2373-51-5	CSCCl	{40: 1, 1: 1, 2: 1, 17: 1}
OK	2373-84-4	CCC1(C(=O)NC(=O)NC1=O)CC=C	{32: 2, 1: 1, 2: 2, 5: 1, 6: 1, 13: 1, 25: 3}
OK	23733-65-5	CC1CCC(=CC1=O)C(C)C	{1: 3, 3: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	23733-88-2	CC1=CCC(CC1)(C)C(=O)OC	{1: 3, 11: 3, 13: 1, 14: 1, 15: 1, 28: 1}
OK	23734-06-7	CC(=C)C1C(C=CCC1=C)O	{1: 1, 5: 2, 7: 1, 11: 1, 12: 2, 14: 2, 15: 1, 20: 1}
OK	23747-14-0	CC1(CC(=O)C=C2C13CCC(C3)C2(C)C)C	{1: 4, 11: 4, 12: 1, 13: 3, 14: 1, 15: 1, 25: 1}
OK	23747-43-5	CCOC(=O)C(C)SSC	{40: 2, 1: 3, 2: 1, 3: 1, 28: 1}
OK	23747-45-7	CC(C)CC(=O)SC	{24: 1, 1: 3, 2: 1, 3: 1, 40: 1}
OK	2375-76-0	CC(=O)CC(=O)C(F)(F)Cl	{1: 1, 2: 1, 4: 1, 16: 2, 17: 1, 24: 2}
OK	23757-42-8	C1(=NC(NC1(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F)N	{32: 1, 35: 1, 4: 4, 13: 2, 15: 1, 16: 12, 30: 1}
OK	23764-31-0	CCCNCCCN	{1: 1, 2: 5, 30: 1, 31: 1}
OK	23778-52-1	COCCOCCOCCOCCOCCO	{1: 1, 2: 10, 20: 1, 22: 5}
OK	2378-02-1	C(C(F)(F)F)(C(F)(F)F)(C(F)(F)F)O	{16: 9, 20: 1, 4: 4}
OK	2378-08-7	C(=O)(C(F)(Cl)Cl)C(Cl)(Cl)Cl	{16: 1, 17: 5, 4: 2, 24: 1}
OK	23783-42-8	COCCOCCOCCOCCO	{1: 1, 2: 8, 20: 1, 22: 4}
OK	23787-90-8	CC1(CCC(=O)C2C13CCC(C3)C2(C)C)C	{1: 4, 11: 5, 12: 2, 13: 3, 25: 1}
OK	2380-27-0	CCCCCCC(=O)CCCCCCCCCCC(=O)OC	{24: 1, 1: 2, 2: 15, 28: 1}
OK	2381-87-5	CC1=CC(=O)OCC1	{1: 1, 11: 2, 28: 1, 14: 1, 15: 1}
OK	23811-08-7	C[C@H]1CCC=C(C12CC[C@H](C2)C(C)(C)O)C	{1: 4, 4: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 1, 20: 1}
OK	2384-70-5	CCCCCCCC#CC	{1: 2, 2: 6, 10: 2}
OK	2384-73-8	CCCC#CC=C	{1: 1, 2: 2, 10: 2, 5: 1, 6: 1}
OK	2384-85-2	CCCCCCC#CCC	{1: 2, 2: 6, 10: 2}
OK	2384-86-3	CCCCCC#CCCC	{1: 2, 2: 6, 10: 2}
OK	2384-90-9	CCCCC=C=C	{8: 1, 1: 1, 2: 3, 5: 1, 6: 1}
OK	2384-92-1	CCCC=CC=C	{1: 1, 2: 2, 5: 1, 6: 3}
OK	23847-08-7	C1CCC(=O)N(CC1)SSN2CCCCCC2=O	{40: 2, 25: 2, 11: 10, 33: 2}
OK	2385-85-5	C12(C3(C4(C5(C3(C(C1(C5(C2(C4(Cl)Cl)Cl)Cl)Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 12, 13: 10}
OK	23850-78-4	CC(C)CC1CO1	{1: 2, 2: 1, 3: 1, 11: 1, 12: 1, 23: 1}
OK	23853-10-3	CCOC(=O)CN1CCCCC1	{1: 1, 2: 2, 11: 5, 28: 1, 33: 1}
OK	2386-87-0	C1CC2C(O2)CC1COC(=O)C3CCC4C(C3)O4	{28: 1, 2: 1, 11: 6, 12: 6, 23: 2}
OK	2386-90-5	C1CC(C2C1O2)OC3CCC4C3O4	{11: 4, 12: 6, 22: 1, 23: 2}
OK	2387-23-7	C1CCC(CC1)NC(=O)NC2CCCCC2	{24: 1, 11: 10, 12: 2, 31: 2}
OK	2387-59-9	C(C(C(=O)O)N)SCC(=O)O	{27: 2, 40: 1, 2: 2, 3: 1, 30: 1}
OK	2387-71-5	C(C[C@@H](C(=O)O)N)CN=C(N)N[C@@H](CC(=O)O)C(=O)O	{2: 4, 3: 2, 7: 1, 34: 1, 27: 3, 30: 2, 31: 1}
OK	2387-78-2	CC1CCC2CC3=C(CCC13C2(C)C)C	{1: 4, 11: 5, 12: 2, 13: 2, 15: 2}
OK	238758-29-7	CC(C)CCCCCCCCCCCCCCCOC(=O)C(C)(C)C	{1: 5, 2: 15, 3: 1, 4: 1, 28: 1}
OK	23878-88-8	CC1CC(N=C(O1)C=C)(C)C	{1: 3, 35: 1, 5: 1, 6: 1, 11: 1, 12: 1, 13: 1, 15: 1, 23: 1}
OK	2388-12-7	CCCCCCCCCCCC(=O)OO	{1: 1, 2: 10, 20: 1, 28: 1}
OK	23889-83-0	CC1(C=NN2C1N3C(C(C=N3)(C)C)N4C2C(C=N4)(C)C)C	{1: 6, 35: 3, 33: 3, 12: 3, 13: 3, 14: 3}
OK	2390-09-2	CCCCCCCCC=CCCCCCCCCCC(=O)OC	{1: 2, 2: 16, 28: 1, 6: 2}
OK	23916-33-8	CC=CCOC(=O)C=C	{1: 1, 2: 1, 28: 1, 5: 1, 6: 3}
OK	23930-19-0	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C	{1: 3, 11: 8, 12: 6, 13: 2, 20: 1, 24: 1, 25: 1}
OK	2394-23-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)CO)CCC4=CC(=O)CC[C@]34CO	{1: 1, 2: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1}
OK	23943-96-6	C[C@H](C(=O)O)OC	{27: 1, 1: 2, 3: 1, 22: 1}
OK	23950-98-3	CCCC1CCC(C(C1)OC)O	{1: 2, 2: 2, 11: 3, 12: 3, 20: 1, 22: 1}
OK	23953-00-6	C[C@@H](C(=O)O)OC	{27: 1, 1: 2, 3: 1, 22: 1}
OK	2396-43-2	CCCC1OC(OC(O1)CCC)CCC	{1: 3, 2: 6, 12: 3, 23: 3}
OK	2396-63-6	C#CCCCC#C	{9: 2, 2: 3, 10: 2}
OK	2396-65-8	C#CCCCCCC#C	{9: 2, 2: 5, 10: 2}
OK	2396-80-7	COC(=O)CCCC=C	{1: 1, 2: 3, 28: 1, 5: 1, 6: 1}
OK	2396-83-0	CC/C=C/CC(=O)OCC	{1: 2, 2: 3, 28: 1, 6: 2}
OK	2396-84-1	CCOC(=O)/C=C/C=C/C	{1: 2, 2: 1, 28: 1, 6: 4}
OK	2396-85-2	CCCCCC=CC(=O)OC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	23965-86-8	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C/C(=N/O)/CC[C@H]34	{1: 1, 34: 1, 9: 1, 10: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 2, 20: 2}
OK	23978-09-8	C1COCCOCCN2CCOCCOCCN1CCOCCOCC2	{33: 2, 11: 18, 23: 6}
OK	23978-55-4	C1COCCOCCNCCOCCOCCN1	{32: 2, 11: 12, 23: 4}
OK	23979-29-5	C1C2C=CC1C3C2N=N3	{35: 2, 11: 1, 12: 4, 14: 2}
OK	23979-30-8	C1CC2CC1C3C2N=N3	{35: 2, 11: 3, 12: 4}
OK	23985-25-3	CC(C)CC(=O)C=C(C)C=C	{1: 3, 2: 1, 3: 1, 5: 1, 6: 2, 7: 1, 24: 1}
OK	23986-74-5	C/C/1=C\CCC(=C)/C=C/[C@@H](CC1)C(C)C	{1: 3, 3: 1, 5: 1, 11: 4, 12: 1, 14: 3, 15: 2}
OK	2399-48-6	C=CC(=O)OCC1CCCO1	{2: 1, 5: 1, 6: 1, 11: 3, 12: 1, 23: 1, 28: 1}
OK	2400-66-0	CCCCCCCCCCCCCCCCCCCC=O	{1: 1, 2: 18, 26: 1}
OK	2402-58-6	CCCCCCCCCCCCOC(=O)C=CC(=O)OCCCCCCCCCCCC	{1: 2, 2: 22, 28: 2, 6: 2}
OK	2402-83-7	C1C(CO1)(CBr)CBr	{18: 2, 2: 2, 11: 2, 13: 1, 23: 1}
OK	24026-79-7	CCCCC(CCNC(=O)C)N1CCCCC1	{1: 2, 2: 5, 3: 1, 33: 1, 11: 5, 24: 1, 31: 1}
OK	24028-46-4	C1CN(CCN1)CCNCCN	{32: 1, 33: 1, 2: 4, 11: 4, 30: 1, 31: 1}
OK	24029-74-1	C1CCC2(CC2)C3(C1)CC3	{11: 8, 13: 2}
OK	2403-55-6	CC(=CN1CCOCC1)C	{1: 2, 6: 1, 33: 1, 11: 4, 23: 1, 7: 1}
OK	2403-57-8	CC(=CN1CCCC1)C	{1: 2, 11: 4, 33: 1, 6: 1, 7: 1}
OK	2403-88-5	CC1(CC(CC(N1)(C)C)O)C	{32: 1, 1: 4, 11: 2, 12: 1, 13: 2, 20: 1}
OK	2403-89-6	CC1(CC(CC(N1C)(C)C)O)C	{1: 5, 33: 1, 11: 2, 12: 1, 13: 2, 20: 1}
OK	24031-96-7	CNC(=O)ON=C1CSCCSC1	{1: 1, 34: 1, 41: 2, 11: 4, 15: 1, 28: 1, 31: 1}
OK	2404-35-5	C1CCCC(CC1)Br	{18: 1, 11: 6, 12: 1}
OK	2404-44-6	CCCCCCCCC1CO1	{1: 1, 2: 7, 11: 1, 12: 1, 23: 1}
OK	24041-60-9	C[C@H]1[C@@H]2C[C@@H](C2(C)C)C[C@@H]1O	{1: 3, 11: 2, 12: 4, 13: 1, 20: 1}
OK	24046-80-8	C12C3C4C1C5C2C3C4N=N5	{35: 2, 12: 8}
OK	24047-72-1	C[C@]1([C@@H]2C[C@@H](C2(C)C)CC1=O)O	{1: 3, 11: 2, 12: 2, 13: 2, 20: 1, 25: 1}
OK	24048-14-4	CC(CCC=C(C)CCC=C(C)C)CO	{1: 4, 2: 5, 3: 1, 6: 2, 7: 2, 20: 1}
OK	24050-09-7	CCC1NCCS1	{32: 1, 1: 1, 2: 1, 41: 1, 11: 2, 12: 1}
OK	24050-10-0	CCCC1NCCS1	{32: 1, 1: 1, 2: 2, 41: 1, 11: 2, 12: 1}
OK	24050-11-1	CC(C)C1NCCS1	{32: 1, 1: 2, 3: 1, 41: 1, 11: 2, 12: 1}
OK	24050-16-6	CC1NCCS1	{32: 1, 1: 1, 11: 2, 12: 1, 41: 1}
OK	2407-43-4	CCC1C=CC(=O)O1	{1: 1, 2: 1, 12: 1, 14: 2, 28: 1}
OK	2407-68-3	CN(C)C=CC#N	{1: 2, 37: 1, 6: 2, 33: 1}
OK	2407-94-5	C1CCC(CC1)(O)OOC2(CCCCC2)O	{11: 10, 20: 2, 13: 2, 22: 2}
OK	24070-77-7	CC1CCCC1O	{1: 1, 11: 3, 12: 2, 20: 1}
OK	24079-95-6	CCOC(=O)C1C(CC(=O)C=C1C)C(C)C	{1: 4, 2: 1, 3: 1, 11: 1, 12: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	2408-20-0	CCC(=O)OCC=C	{1: 1, 2: 2, 28: 1, 5: 1, 6: 1}
OK	2408-37-9	CC1CCCC(C1=O)(C)C	{1: 3, 11: 3, 12: 1, 13: 1, 25: 1}
OK	24088-97-9	C#CCCCCCCCl	{9: 1, 2: 6, 10: 1, 17: 1}
OK	24089-00-7	CCCCCC(C)(C=C)O	{1: 2, 2: 4, 4: 1, 5: 1, 6: 1, 20: 1}
OK	2409-52-1	CCOC(=O)CC(=C)C(=O)OCC	{1: 2, 2: 3, 28: 2, 5: 1, 7: 1}
OK	2411-36-1	CCCCCCCN(CCCCCCC)CCCCCCC	{1: 3, 2: 18, 33: 1}
OK	2411-58-7	CCCCCCCCCCCN=C=O	{8: 1, 1: 1, 2: 10, 34: 1, 29: 1}
OK	2412-80-8	CC(C)CCC(=O)OC	{1: 3, 2: 2, 3: 1, 28: 1}
OK	24139-32-0	C1CCC23CC=CCC2(C1)C=C3	{11: 6, 13: 2, 14: 4}
OK	24139-33-1	C1CCC23C=CC=CC2(C1)C=C3	{11: 4, 13: 2, 14: 6}
OK	2415-72-7	CCCC1CC1	{1: 1, 2: 2, 11: 2, 12: 1}
OK	24152-39-4	CCCCC1CCNCC1	{32: 1, 1: 1, 2: 3, 11: 4, 12: 1}
OK	24156-95-4	CC1=CC(=O)C(C1)(C)C	{1: 3, 11: 1, 13: 1, 14: 1, 15: 1, 25: 1}
OK	2417-82-5	C1C[CH]1	{11: 2, 14: 1}
OK	2417-90-5	C(CBr)C#N	{2: 2, 18: 1, 37: 1}
OK	24173-47-5	CCC(=CCCC(C)(C#C)O)C	{1: 3, 2: 3, 4: 1, 6: 1, 7: 1, 9: 1, 10: 1, 20: 1}
OK	2418-14-6	C(C(C(=O)O)S)(C(=O)O)S	{27: 2, 3: 2, 39: 2}
OK	2418-45-3	C[C@H](C=C[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C	{1: 7, 3: 3, 6: 2, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 28: 1}
OK	2418-95-3	CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)O)N	{1: 3, 2: 4, 3: 1, 4: 1, 27: 1, 28: 1, 30: 1, 31: 1}
OK	2419-34-3	C(CC(=O)N)[C@@H](C(=O)O)NC(=O)C(F)(F)F	{2: 2, 3: 1, 4: 1, 16: 3, 24: 2, 27: 1, 30: 1, 31: 1}
OK	2419-73-0	C(C(C(CCl)O)O)Cl	{17: 2, 2: 2, 3: 2, 20: 2}
OK	2419-94-5	CC(C)(C)OC(=O)N[C@@H](CCC(=O)O)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 27: 2, 28: 1, 31: 1}
OK	24194-62-5	C1COCCOCCOCOCCOCCO1	{11: 11, 23: 6}
OK	24199-46-0	CCC(=CCCC(=O)C)C	{24: 1, 1: 3, 2: 3, 6: 1, 7: 1}
OK	2420-29-3	CCCCCCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCO	{1: 1, 2: 29, 20: 1, 22: 6}
OK	2420-94-2	CC(=C)C(=O)OCCN.Cl	{1: 1, 2: 2, 5: 1, 7: 1, 17: 1, 28: 1, 30: 1}
OK	2421-26-3	CC(C)(N=O)Cl	{1: 2, 34: 1, 4: 1, 29: 1, 17: 1}
OK	24211-64-1	C[C@]12CC[C@H]3[C@H](C1(CC[C@@H]2C4=CC(=O)OC4)O)CC[C@@H]5[C@@]3(C[C@H]([C@@H](C5)O)O)C=O	{1: 1, 11: 9, 12: 6, 13: 3, 14: 1, 15: 1, 20: 3, 26: 1, 28: 1}
OK	24211-81-2	C[C@@H]1CC2([C@]3([C@@H](O1)O[C@H]4C[C@@H]5CC[C@@H]6[C@@H]([C@]5(C[C@@H]4O3)C=O)CC[C@]7(C6(CC[C@@H]7C8=CC(=O)OC8)O)C)O)N=CCS2	{1: 2, 35: 1, 41: 1, 11: 11, 12: 8, 13: 5, 14: 2, 15: 1, 20: 2, 23: 3, 26: 1, 28: 1}
OK	24214-70-8	C1CCCC(=NN=C2CCCCCC2)CC1	{34: 2, 11: 12, 15: 2}
OK	2422-85-7	C=CC1CCC1C=C	{11: 2, 12: 2, 5: 2, 6: 2}
OK	2422-86-8	C1C=CC2C1C=C2	{11: 1, 12: 2, 14: 4}
OK	2422-95-9	C=CCOCC1CS1	{2: 2, 5: 1, 6: 1, 41: 1, 11: 1, 12: 1, 22: 1}
OK	24229-53-6	CN(C)CCNCCN	{1: 2, 2: 4, 33: 1, 30: 1, 31: 1}
OK	2423-01-0	CCCCC1=CCCC1	{1: 1, 2: 3, 11: 3, 14: 1, 15: 1}
OK	2423-10-1	CCCCCCCC/C=C\CCCCCCCC=O	{1: 1, 2: 14, 26: 1, 6: 2}
OK	2423-65-6	C1=C[N+](=CC=N1)[O-]	{33: 1, 35: 1, 29: 1, 14: 4}
OK	2423-84-9	C1=C[N+](=O)C=CN1[O-]	{33: 2, 29: 2, 14: 4}
OK	24230-08-8	CCCC(C)(C1CC1)O	{1: 2, 2: 2, 4: 1, 11: 2, 12: 1, 20: 1}
OK	24237-00-1	CCCCC1C=C(CC(O1)C)C	{1: 3, 2: 3, 11: 1, 12: 2, 14: 1, 15: 1, 23: 1}
OK	2424-01-3	CN(CC=C)CC=C	{1: 1, 2: 2, 5: 2, 6: 2, 33: 1}
OK	2424-32-0	C1C(C1(C#N)C#N)(C#N)C#N	{11: 1, 13: 2, 37: 4}
OK	2424-58-0	C=CCOC(=O)C=CC(=O)O	{2: 1, 27: 1, 28: 1, 5: 1, 6: 3}
OK	2424-59-1	C1CCC(CC1)OC(=O)C=CC(=O)O	{27: 1, 28: 1, 11: 5, 12: 1, 6: 2}
OK	2424-62-6	CCCCCCCCCCCCCCCCCCOC(=O)C=CC(=O)O	{1: 1, 2: 17, 27: 1, 28: 1, 6: 2}
OK	2424-90-0	C(CCCCCCCC(=O)O)CCCCCCCC(=O)O	{2: 15, 27: 2}
OK	2424-92-2	C(CCCCCCCCCC(=O)O)CCCCCCCCC(=O)O	{2: 18, 27: 2}
OK	2424-98-8	CC(C)C(=O)OC=C	{1: 2, 3: 1, 28: 1, 5: 1, 6: 1}
OK	24247-53-8	CC=C(C=O)Br	{1: 1, 18: 1, 26: 1, 6: 1, 7: 1}
OK	2425-06-1	C1C=CCC2C1C(=O)N(C2=O)SC(C(Cl)Cl)(Cl)Cl	{33: 1, 3: 1, 4: 1, 40: 1, 11: 2, 12: 2, 14: 2, 17: 4, 25: 2}
OK	2425-33-4	C1CCC(C(C1)O)Br	{20: 1, 18: 1, 11: 4, 12: 2}
OK	2425-54-9	CCCCCCCCCCCCCCCl	{1: 1, 2: 13, 17: 1}
OK	2425-66-3	CC(CCl)[N+](=O)[O-]	{1: 1, 2: 1, 3: 1, 38: 1, 17: 1}
OK	2425-74-3	CC(C)(C)NC=O	{1: 3, 26: 1, 4: 1, 31: 1}
OK	2425-77-6	CCCCCCCCC(CCCCCC)CO	{1: 2, 2: 13, 3: 1, 20: 1}
OK	2425-79-8	C1C(O1)COCCCCOCC2CO2	{2: 6, 11: 2, 12: 2, 22: 2, 23: 2}
OK	24253-25-6	CC(C)(CC=C)C=C	{1: 2, 2: 1, 4: 1, 5: 2, 6: 2}
OK	24253-30-3	CCC(=O)CC=C	{24: 1, 1: 1, 2: 2, 5: 1, 6: 1}
OK	24254-55-5	CCCCC(C)OO	{1: 2, 2: 3, 3: 1, 20: 1, 22: 1}
OK	24254-56-6	CCCC(CC)OO	{1: 2, 2: 3, 3: 1, 20: 1, 22: 1}
OK	24254-57-7	CCC(CC)OO	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	2426-07-5	C1C(O1)CCCCC2CO2	{2: 4, 11: 2, 12: 2, 23: 2}
OK	2426-08-6	CCCCOCC1CO1	{1: 1, 2: 4, 11: 1, 12: 1, 22: 1, 23: 1}
OK	2426-54-2	CCN(CC)CCOC(=O)C=C	{1: 2, 2: 4, 5: 1, 6: 1, 33: 1, 28: 1}
OK	24264-08-2	CCC(=C=O)CC	{8: 1, 1: 2, 2: 2, 29: 1, 7: 1}
OK	24268-10-8	C/C=C/OC=C	{1: 1, 22: 1, 5: 1, 6: 3}
OK	24270-66-4	C(C(F)F)(C(F)F)F	{16: 5, 3: 3}
OK	24270-67-5	C(CF)C(F)F	{16: 3, 2: 2, 3: 1}
OK	24277-35-8	CC(C)(C)OC(=O)N[C@@H](CCC(=O)N)C(=O)O.C1CCC(CC1)NC2CCCCC2	{1: 3, 2: 2, 3: 1, 4: 1, 11: 10, 12: 2, 24: 1, 27: 1, 28: 1, 30: 1, 31: 2}
OK	24279-91-2	CC1=C(C(=O)C(=C(C1=O)N2CC2)C(COC(=O)N)OC)N3CC3	{1: 2, 2: 1, 3: 1, 33: 2, 11: 4, 15: 4, 22: 1, 25: 2, 28: 1, 30: 1}
OK	24282-51-7	CC(=O)C1(CC(OC1(C)C)(C)C)O	{1: 5, 11: 1, 13: 3, 20: 1, 23: 1, 24: 1}
OK	24293-43-4	CCCCC(CC)COC(=O)CSCC(=O)OCC(CC)CCCC	{40: 1, 1: 4, 2: 12, 3: 2, 28: 2}
OK	24298-08-6	CC=C(C)I	{1: 2, 19: 1, 6: 1, 7: 1}
OK	2430-00-4	CCN(CC)C(=O)C(Cl)(Cl)Cl	{1: 2, 2: 2, 4: 1, 33: 1, 17: 3, 24: 1}
OK	2430-22-0	CC(C)CCCCCCO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	2430-27-5	CCCC(CCC)C(=O)N	{24: 1, 1: 2, 2: 4, 3: 1, 30: 1}
OK	2430-49-1	CCCC(C)C1(C(=O)NC(=O)NC1=O)C=C	{32: 2, 1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 13: 1, 25: 3}
OK	2430-94-6	CCCCCCC=CCCCC(=O)O	{1: 1, 2: 8, 27: 1, 6: 2}
OK	24304-84-5	C(CSCCO)N	{40: 1, 2: 4, 20: 1, 30: 1}
OK	24306-18-1	CCCCCCCCC(=CCCCCCCC)CCCCCCCC	{1: 3, 2: 20, 6: 1, 7: 1}
OK	2431-31-4	CC(=C=C=C(C)C)C	{8: 2, 1: 4, 7: 2}
OK	2431-50-7	C=C(C(CCl)Cl)Cl	{17: 3, 2: 1, 3: 1, 5: 1, 7: 1}
OK	2431-52-9	C(C(C(CCl)(Cl)Cl)Cl)Cl	{17: 5, 2: 2, 3: 1, 4: 1}
OK	2431-54-1	C(C=C(CCl)Cl)Cl	{17: 3, 2: 2, 6: 1, 7: 1}
OK	24314-99-6	C[C](F)F	{16: 2, 1: 1, 7: 1}
OK	24317-94-0	CCCCCC(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 5, 3: 1, 28: 1}
OK	24317-95-1	CCCCCCCCC(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 8, 3: 1, 28: 1}
OK	2432-39-5	CCC(C)SC(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 40: 1}
OK	2432-42-0	CCC(=O)SCC	{24: 1, 1: 2, 2: 2, 40: 1}
OK	2432-43-1	CCCSC(=O)CC	{24: 1, 1: 2, 2: 3, 40: 1}
OK	2432-51-1	CCCC(=O)SC	{24: 1, 1: 2, 2: 2, 40: 1}
OK	2432-52-2	CCCCSC(=O)CCC	{24: 1, 1: 2, 2: 5, 40: 1}
OK	2432-63-5	CCCOC(=O)C=CC(=O)OCCC	{1: 2, 2: 4, 28: 2, 6: 2}
OK	2432-74-8	C(CCC#N)CCN	{2: 5, 37: 1, 30: 1}
OK	2432-77-1	CCCCCC(=O)SC	{24: 1, 1: 2, 2: 4, 40: 1}
OK	2432-87-3	CCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCC	{1: 2, 2: 22, 28: 2}
OK	2432-88-4	CCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCC	{1: 2, 2: 30, 28: 2}
OK	2432-89-5	CCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCC	{1: 2, 2: 26, 28: 2}
OK	2432-92-0	CCCCC(=O)SCC	{24: 1, 1: 2, 2: 4, 40: 1}
OK	2432-99-7	C(CCCCCN)CCCCC(=O)O	{2: 10, 27: 1, 30: 1}
OK	24323-21-5	CCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 6, 3: 1}
OK	24323-23-7	CCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 7, 3: 1}
OK	24323-25-9	CCCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 8, 3: 1}
OK	24323-31-7	CCCCCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 10, 3: 1}
OK	24325-56-2	C1C2CC3CC1CC(C2)(C3)N=NC45CC6CC(C4)CC(C6)C5	{34: 2, 11: 12, 12: 6, 13: 2}
OK	2433-14-9	C1CCC(CC1)C2CCC(CC2)O	{20: 1, 11: 9, 12: 3}
OK	2433-96-7	CCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 21, 27: 1}
OK	2433-97-8	CCCCCCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 21, 28: 1}
OK	24330-52-7	CC(CCS)S	{1: 1, 2: 2, 3: 1, 39: 2}
OK	24331-09-7	C(#N)C(C#N)(C#N)C#N	{4: 1, 37: 4}
OK	24331-71-3	CC(C)(C)C(=O)N(C)C	{24: 1, 1: 5, 4: 1, 33: 1}
OK	24331-72-4	CCN(CC)C(=O)C(C)(C)C	{24: 1, 1: 5, 2: 2, 4: 1, 33: 1}
OK	24332-20-5	COCC(OC)OC	{1: 3, 2: 1, 3: 1, 22: 3}
OK	24332-22-7	CCC=CCC(=O)C	{24: 1, 1: 2, 2: 2, 6: 2}
OK	24337-52-8	CC(C1CCCCC1O)O	{11: 4, 1: 1, 3: 1, 12: 2, 20: 2}
OK	2434-49-3	CC1CC(=O)NC(=O)N1	{32: 2, 1: 1, 11: 1, 12: 1, 25: 2}
OK	24342-04-9	CCC#CC(=O)OC	{1: 2, 2: 1, 28: 1, 10: 2}
OK	24346-78-9	CCCCCCCN(C(=O)N)N=O	{1: 1, 2: 6, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	24347-58-8	C[C@H]([C@@H](C)O)O	{1: 2, 3: 2, 20: 2}
OK	2435-16-7	CCCCCCCC1CCCO1	{1: 1, 2: 6, 11: 3, 12: 1, 23: 1}
OK	2435-53-2	C1(=C(C(=O)C(=O)C(=C1Cl)Cl)Cl)Cl	{17: 4, 25: 2, 15: 4}
OK	2435-54-3	C1(=C(C(=O)C(=O)C(=C1Br)Br)Br)Br	{25: 2, 18: 4, 15: 4}
OK	2435-85-0	C1CC2CCC3CCCC4C3C2C(C1)CC4	{11: 10, 12: 6}
OK	24356-00-1	CCC(C=C)Cl	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 17: 1}
OK	2436-90-0	CC(CCC=C(C)C)C=C	{1: 3, 2: 2, 3: 1, 5: 1, 6: 2, 7: 1}
OK	24365-47-7	CC(C)C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C=O)NC(=O)C	{1: 5, 2: 5, 3: 5, 7: 1, 34: 1, 24: 3, 26: 1, 30: 2, 31: 3}
OK	2437-25-4	CCCCCCCCCCCC#N	{1: 1, 2: 10, 37: 1}
OK	2437-56-1	CCCCCCCCCCCC=C	{1: 1, 2: 10, 5: 1, 6: 1}
OK	2437-97-0	CC1=CCC2CC1OC2(C)C	{1: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 23: 1}
OK	2438-10-0	CC1=CC[C@@](CC1)(C(C)C)O	{1: 3, 3: 1, 11: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	2438-20-2	CCC(C)COC(=O)CC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	2439-10-3	CCCCCCCCCCCCN=C(N)N.CC(=O)O	{1: 2, 2: 11, 7: 1, 34: 1, 27: 1, 30: 2}
OK	2439-35-2	CN(C)CCOC(=O)C=C	{1: 2, 2: 2, 5: 1, 6: 1, 33: 1, 28: 1}
OK	2439-54-5	CCCCCCCCNC	{1: 2, 2: 7, 31: 1}
OK	2439-55-6	CCCCCCCCCCCCCCCCCCNC	{1: 2, 2: 17, 31: 1}
OK	2439-79-4	CC12CCCCC1C2	{1: 1, 11: 5, 12: 1, 13: 1}
OK	24393-94-0	C[C@H]1C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)O)C)CO	{1: 2, 2: 1, 11: 2, 12: 6, 13: 3, 20: 4, 23: 2, 25: 1}
OK	2441-06-7	CCOC(=O)C(C(C)C)O	{1: 3, 2: 1, 3: 2, 20: 1, 28: 1}
OK	2441-97-6	C1CC=CC(C1)Cl	{17: 1, 11: 3, 12: 1, 14: 2}
OK	24410-84-2	CCC=CC(=O)OCC	{1: 2, 2: 2, 28: 1, 6: 2}
OK	2442-10-6	CCCCCC(C=C)OC(=O)C	{1: 2, 2: 4, 3: 1, 5: 1, 6: 1, 28: 1}
OK	2442-49-1	CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 22, 28: 1}
OK	24425-97-6	C(C(C(Cl)(Cl)Cl)(Cl)Cl)Cl	{17: 6, 2: 1, 4: 2}
OK	24426-16-2	CCN(CC)CCNCCN	{1: 2, 2: 6, 33: 1, 30: 1, 31: 1}
OK	24426-40-2	CCNCC#N	{1: 1, 2: 2, 37: 1, 31: 1}
OK	2443-04-1	CCCC1CCC(C1)C	{1: 2, 2: 2, 11: 3, 12: 2}
OK	2443-39-2	CCCCCCCCC1C(O1)CCCCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 12: 2, 23: 1}
OK	2443-46-1	C1C2=CC=CC=C1C=CC=C2	{11: 1, 14: 8, 15: 2}
OK	2443-89-2	CC(C)(C)C(I)I	{19: 2, 1: 3, 3: 1, 4: 1}
OK	2443-91-6	CC(C)(C)C(Br)Br	{1: 3, 18: 2, 3: 1, 4: 1}
OK	24430-29-3	C1C=CCC12C=CC=C2	{11: 2, 13: 1, 14: 6}
OK	24434-09-1	CCC(CCC(CC)O)O	{1: 2, 2: 4, 3: 2, 20: 2}
OK	2444-37-3	CSCC(=O)O	{40: 1, 1: 1, 2: 1, 27: 1}
OK	2444-49-7	C=CCSSSSCC=C	{40: 4, 2: 2, 5: 2, 6: 2}
OK	24442-57-7	CC(=O)OC(CBr)Br	{1: 1, 2: 1, 3: 1, 28: 1, 18: 2}
OK	24442-69-1	C#CCC#C	{9: 2, 2: 1, 10: 2}
OK	24443-15-0	CC(C)(CCBr)Br	{1: 2, 2: 2, 4: 1, 18: 2}
OK	24448-04-2	CCCCCCCCCCCCCCCCCC1=NC(CO1)(CC)CO	{1: 2, 2: 18, 35: 1, 11: 1, 13: 1, 15: 1, 20: 1, 23: 1}
OK	2445-67-2	CCC(C)C(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 28: 1}
OK	2445-69-4	CCC(C)COC(=O)C(C)C	{1: 4, 2: 2, 3: 2, 28: 1}
OK	2445-72-9	CCCCCOC(=O)C(C)C	{1: 3, 2: 4, 3: 1, 28: 1}
OK	2445-76-3	CCCCCCOC(=O)CC	{1: 2, 2: 6, 28: 1}
OK	2445-77-4	CCC(C)COC(=O)CC(C)C	{1: 4, 2: 3, 3: 2, 28: 1}
OK	2445-78-5	CCC(C)COC(=O)C(C)CC	{1: 4, 2: 3, 3: 2, 28: 1}
OK	24459-40-3	C1CCCCC(C(=O)C(CCCC1)Br)Br	{25: 1, 18: 2, 11: 9, 12: 2}
OK	2446-83-5	CC(C)OC(=O)/N=N/C(=O)OC(C)C	{1: 4, 34: 2, 3: 2, 28: 2}
OK	2446-84-6	COC(=O)/N=N/C(=O)OC	{1: 2, 34: 2, 28: 2}
OK	24461-38-9	CC=CN1CC1	{1: 1, 11: 2, 6: 2, 33: 1}
OK	24468-13-1	CCCCC(CC)COC(=O)Cl	{1: 2, 2: 5, 3: 1, 28: 1, 17: 1}
OK	24472-02-4	C1COC2(OC1)OCCCO2	{11: 6, 13: 1, 23: 4}
OK	24475-56-7	CCCCCCSCCO	{40: 1, 1: 1, 2: 7, 20: 1}
OK	24480-26-0	C1CN1CCCCNC(=O)C(=O)NCCCCN2CC2	{24: 2, 33: 2, 2: 8, 11: 4, 31: 2}
OK	24480-30-6	C1CN1CCCNC(=O)C(=O)N	{33: 1, 2: 3, 11: 2, 24: 2, 30: 1, 31: 1}
OK	2449-10-7	CCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCC	{1: 2, 2: 18, 28: 2}
OK	24493-53-6	C=CC(=O)OCCCOC(=O)C=C	{2: 3, 28: 2, 5: 2, 6: 2}
OK	24493-59-2	CC(=C)C(=O)OCCOCCOCCOC	{1: 2, 2: 6, 5: 1, 7: 1, 22: 3, 28: 1}
OK	2450-71-7	C#CCN	{9: 1, 2: 1, 10: 1, 30: 1}
OK	2451-62-9	C1C(O1)CN2C(=O)N(C(=O)N(C2=O)CC3CO3)CC4CO4	{33: 3, 2: 3, 11: 3, 12: 3, 23: 3, 25: 3}
OK	24516-39-0	CCCCCCCCC=CCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 21, 3: 2, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	24518-94-3	C1CC2(CCC13CC3)CC2	{11: 8, 13: 2}
OK	24519-85-5	C1CSC2=C(S1)C(=O)NC2=O	{32: 1, 25: 2, 11: 2, 41: 2, 15: 2}
OK	2452-99-5	CC1CCCC1C	{1: 2, 11: 3, 12: 2}
OK	24529-88-2	CCCCCCCCC=CCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 30, 3: 1, 6: 4, 20: 1, 28: 2}
OK	2453-00-1	CC1CCC(C1)C	{1: 2, 11: 3, 12: 2}
OK	2453-46-5	C1CCCC(CC1)Cl	{17: 1, 11: 6, 12: 1}
OK	24539-28-4	COC(=O)C12C3C4C1C5C2C3C45C(=O)O	{1: 1, 27: 1, 12: 6, 13: 2, 28: 1}
OK	2454-11-7	C[C@@]1(CC[C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2CCC4=CC(=O)C(=C[C@]34C)C=O)O)C)O	{1: 3, 11: 5, 12: 4, 13: 3, 14: 2, 15: 2, 20: 2, 25: 1, 26: 1}
OK	24543-59-7	C[C@]12CCC(=O)O[C@@H]1[C@H](C[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C)Br	{1: 3, 11: 7, 12: 5, 13: 3, 18: 1, 20: 1, 28: 1}
OK	24545-81-1	CC1=CC(=O)C2(C1C2)C(C)C	{1: 3, 3: 1, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 25: 1}
OK	2455-24-5	CC(=C)C(=O)OCC1CCCO1	{1: 1, 2: 1, 5: 1, 7: 1, 11: 3, 12: 1, 23: 1, 28: 1}
OK	24551-95-9	CCCCC(CCCC)C(=O)OC	{1: 3, 2: 6, 3: 1, 28: 1}
OK	24551-99-3	CCCCN(C)CCC	{1: 3, 2: 5, 33: 1}
OK	2456-27-1	CCCCCCCCCOCCCCCCCCC	{1: 2, 2: 16, 22: 1}
OK	2456-28-2	CCCCCCCCCCOCCCCCCCCCC	{1: 2, 2: 18, 22: 1}
OK	2456-43-1	C1CCC(CC1)C2CCCCC2C3CCCCC3	{11: 14, 12: 4}
OK	24560-98-3	CCCCCCCC[C@@H]1[C@@H](O1)CCCCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 12: 2, 23: 1}
OK	24564-77-0	C1C(O1)CC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 7, 11: 1, 12: 1, 16: 15, 23: 1}
OK	24566-95-8	C1CCC(=O)N(CC1)CCCN	{25: 1, 2: 3, 11: 5, 30: 1, 33: 1}
OK	24567-27-9	CCC(=O)O.C(CO)O	{1: 1, 2: 3, 27: 1, 20: 2}
OK	24569-29-7	CC1CCC2=C(CCC(=O)C2)C(=O)CC1	{1: 1, 11: 7, 12: 1, 25: 2, 15: 2}
OK	24569-89-9	C1C2CC34CC1CC3(C2)C4	{11: 6, 12: 2, 13: 2}
OK	24579-70-2	CCN(CC)C(=O)O	{1: 2, 2: 2, 27: 1, 33: 1}
OK	24584-23-4	CC(=O)SC1CC2CCC1C2	{24: 1, 1: 1, 11: 4, 12: 3, 40: 1}
OK	24587-26-6	C/C(=C\C=C)/C=C	{1: 1, 5: 2, 6: 3, 7: 1}
OK	2459-05-4	CCOC(=O)/C=C/C(=O)O	{1: 1, 2: 1, 27: 1, 28: 1, 6: 2}
OK	24598-62-7	CN1CC(=O)N(C1=O)C	{1: 2, 11: 1, 33: 2, 25: 2}
OK	24599-57-3	C1C=CC=CC1=O	{25: 1, 11: 1, 14: 4}
OK	2460-77-7	CC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)C	{1: 6, 4: 2, 25: 2, 14: 2, 15: 2}
OK	24602-86-6	CCCCCCCCCCCCCN1CC(OC(C1)C)C	{1: 3, 2: 12, 33: 1, 11: 2, 12: 2, 23: 1}
OK	2461-15-6	CCCCC(CC)COCC1CO1	{1: 2, 2: 6, 3: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	2461-18-9	CCCCCCCCCCCCOCC1CO1	{1: 1, 2: 12, 11: 1, 12: 1, 22: 1, 23: 1}
OK	2461-40-7	CCCC(=O)OCC1CO1	{1: 1, 2: 3, 11: 1, 12: 1, 23: 1, 28: 1}
OK	24612-75-7	CC1CCC(CC1C)(C)C	{1: 4, 11: 3, 12: 2, 13: 1}
OK	24612-83-7	CCCC#CCC=C	{1: 1, 2: 3, 10: 2, 5: 1, 6: 1}
OK	24613-65-8	C(CCCCI)CCCCI	{2: 9, 19: 2}
OK	24615-84-7	C=CC(=O)OCCC(=O)O	{2: 2, 27: 1, 28: 1, 5: 1, 6: 1}
OK	24618-31-3	COC1CCCCC1Br	{1: 1, 18: 1, 11: 4, 12: 2, 22: 1}
OK	2462-94-4	CCCCCCCCC=CCCCCCCCCCC(=O)O	{1: 1, 2: 16, 27: 1, 6: 2}
OK	24621-61-2	C[C@@H](CCO)O	{1: 1, 2: 2, 3: 1, 20: 2}
OK	24625-82-9	CCCCCCCCOC(=O)C(C)Br	{1: 2, 2: 7, 3: 1, 28: 1, 18: 1}
OK	24629-25-2	CC[C@H](C)[C@@H](CO)N	{1: 2, 2: 2, 3: 2, 20: 1, 30: 1}
OK	2463-02-7	CCCCCC=CCC=CCCCCCCCCCC(=O)OC	{1: 2, 2: 14, 28: 1, 6: 4}
OK	2463-63-0	CCCCC=CC=O	{1: 1, 2: 3, 26: 1, 6: 2}
OK	24634-95-5	CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 23, 28: 1}
OK	2465-32-9	CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCC/C=C\CCCCCCCC	{1: 2, 2: 30, 3: 1, 6: 4, 20: 1, 28: 2}
OK	2465-93-2	C(COCC(COCCC#N)OCCC#N)C#N	{2: 8, 3: 1, 37: 3, 22: 3}
OK	24650-10-0	C1CCC(C(C1)CC2CCC(CC2)N)N	{2: 1, 11: 8, 12: 4, 30: 2}
OK	24652-51-5	CC=C(C)C(C)O	{1: 3, 3: 1, 20: 1, 6: 1, 7: 1}
OK	24653-75-6	CC(=O)CS	{24: 1, 1: 1, 2: 1, 39: 1}
OK	2466-76-4	CC(=O)N1C=CN=C1	{24: 1, 1: 1, 35: 1, 14: 3, 33: 1}
OK	2467-09-6	C1CCNC(C1)C2CCCNC2	{32: 2, 11: 8, 12: 2}
OK	2467-10-9	C(CCCl)CC(Cl)(Cl)Cl	{17: 4, 2: 4, 4: 1}
OK	2469-34-3	CC1(CCC2(CCC3=C(C2C1)C(CC4C3(CCC5C4(CC(C(C5(C)C(=O)O)O)O)C)C)CCl)C(=O)O)C	{1: 5, 2: 1, 11: 9, 12: 6, 13: 5, 15: 2, 17: 1, 20: 2, 27: 2}
OK	2469-45-6	CCCCCCCCCCCCSCCCCCCCCCCCC	{40: 1, 1: 2, 2: 22}
OK	24691-16-5	C[C@@H]1C[C@@H](CC(C1)(C)C)OC(=O)C	{1: 4, 11: 3, 12: 2, 13: 1, 28: 1}
OK	24691-18-7	C[C@@H]1C[C@H](CC(C1)(C)C)OC(=O)C	{1: 4, 11: 3, 12: 2, 13: 1, 28: 1}
OK	24692-43-1	CC1CN=S=N1	{1: 1, 11: 1, 12: 1, 35: 2, 41: 1}
OK	24692-45-3	CC1(CN=S=N1)C	{1: 2, 11: 1, 13: 1, 35: 2, 41: 1}
OK	24696-26-2	CCCCCCCCCCCCCCCC(=O)NC(CO)C(C=CCCCCCCCCCCCCC)O	{1: 2, 2: 27, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	2470-11-3	CN(CC#C)CC1CCCCC1	{1: 1, 2: 2, 33: 1, 9: 1, 10: 1, 11: 5, 12: 1}
OK	2470-68-0	CCCCCCCNCCCCCCC	{1: 2, 2: 12, 31: 1}
OK	24708-53-0	C(N(F)F)(F)F	{16: 4, 33: 1, 3: 1}
OK	24717-85-9	CC=C(C)C(=O)OCCC(C)CCC=C(C)C	{1: 5, 2: 4, 3: 1, 6: 2, 7: 2, 28: 1}
OK	24717-86-0	CC(C)C(=O)OC1CC2CCC1(C2(C)C)C	{1: 5, 3: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	24719-68-4	C1CSC(=C2SCCS2)S1	{41: 4, 11: 4, 15: 2}
OK	24724-18-3	C(CCCCC(CBr)Br)CCCCO	{2: 10, 3: 1, 20: 1, 18: 2}
OK	2473-01-0	CCCCCCCCCCl	{1: 1, 2: 8, 17: 1}
OK	2473-03-2	CCCCCCCCCCCCl	{1: 1, 2: 10, 17: 1}
OK	24748-23-0	CCC1(OOC(OOC(OO1)(C)CC)(C)CC)C	{1: 6, 2: 3, 13: 3, 23: 6}
OK	2475-93-6	CC(=NO)C(C)(C)C	{1: 4, 34: 1, 4: 1, 20: 1, 7: 1}
OK	24764-40-7	CC(C)(C)N1C=CC=C1	{1: 3, 4: 1, 14: 4, 33: 1}
OK	24764-88-3	CC(C)(C)N=CC=NC(C)(C)C	{1: 6, 34: 2, 4: 2, 6: 2}
OK	24764-90-7	CC(C)N=CC=NC(C)C	{1: 4, 34: 2, 3: 2, 6: 2}
OK	24764-97-4	CCC(C=O)Br	{26: 1, 1: 1, 2: 1, 3: 1, 18: 1}
OK	24765-57-9	CCCCC(CCCC)(CO)CO	{1: 2, 2: 8, 4: 1, 20: 2}
OK	24768-43-2	CCCCCCSCCC	{40: 1, 1: 2, 2: 7}
OK	24768-46-5	CCCCCCCSCCC	{40: 1, 1: 2, 2: 8}
OK	24770-64-7	CC1(CCCC(C1)(C)C)C	{1: 4, 11: 4, 13: 2}
OK	24771-25-3	COC(=NC#N)OC	{1: 2, 34: 1, 37: 1, 22: 2, 7: 1}
OK	24771-52-6	C(CCOCC(CCl)O)CCOCC(CCl)O	{17: 2, 2: 9, 3: 2, 20: 2, 22: 2}
OK	24772-63-2	C(CCCCI)CCCI	{2: 8, 19: 2}
OK	24774-58-1	CC(CCC(C)Br)Br	{1: 2, 2: 2, 3: 2, 18: 2}
OK	2478-10-6	C=CC(=O)OCCCCO	{28: 1, 2: 4, 20: 1, 5: 1, 6: 1}
OK	24786-78-5	C(#N)S.NN	{37: 1, 30: 2, 39: 1}
OK	248-21-5	C1C2C3CNC2C4C1C3CN4	{32: 2, 11: 3, 12: 6}
OK	2480-23-1	CC(C)C(C(=O)O)NC	{27: 1, 1: 3, 3: 2, 31: 1}
OK	24800-25-7	CC(CO)OCC(C)OCC(C)OCC(C)O	{1: 4, 2: 4, 3: 4, 20: 2, 22: 3}
OK	24800-44-0	CC(CO)OCC(C)OCC(C)O	{1: 3, 2: 3, 3: 3, 20: 2, 22: 2}
OK	24817-92-3	CCCCCCOC(=O)CC(CC(=O)OCCCCCC)(C(=O)OCCCCCC)OC(=O)C	{1: 4, 2: 17, 4: 1, 28: 4}
OK	2482-39-5	CCCCCCC/C=C/C(=O)OC	{1: 2, 2: 6, 28: 1, 6: 2}
OK	2482-57-7	CCC(CBr)O	{1: 1, 2: 2, 3: 1, 20: 1, 18: 1}
OK	24823-81-2	CCC(OC)(OC)OC	{1: 4, 2: 1, 4: 1, 22: 3}
OK	24829-11-6	C1C(O1)CCCCCC2CO2	{2: 5, 11: 2, 12: 2, 23: 2}
OK	2483-57-0	COC(=O)C[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 1}
OK	24830-94-2	C[C@H]([C@H](C(=O)O)N)O	{27: 1, 1: 1, 3: 2, 20: 1, 30: 1}
OK	2484-65-3	C1CCCCCC=CCCCCC1	{11: 11, 14: 2}
OK	24851-93-2	CCCCCC1=C(CCC1)OC(=O)C	{1: 2, 2: 4, 11: 3, 28: 1, 15: 2}
OK	24851-98-7	CCCCCC1C(CCC1=O)CC(=O)OC	{1: 2, 2: 5, 11: 2, 12: 2, 25: 1, 28: 1}
OK	24854-14-6	CN(C)C(=C)SC	{40: 1, 1: 3, 33: 1, 5: 1, 7: 1}
OK	24854-67-9	C1C(O1)CCCCCCC2CO2	{2: 6, 11: 2, 12: 2, 23: 2}
OK	2486-84-2	CCCCCCCCCCNCCCCCCCCCC.Cl	{1: 2, 2: 18, 31: 1, 17: 1}
OK	2486-85-3	CCCCCCCCCCCCNCCCCCCCCCCCC.Cl	{1: 2, 2: 22, 31: 1, 17: 1}
OK	24887-75-0	C[C@@]12CCC[C@H]1[C@@H]3CCC4CCCC[C@@]4([C@H]3CC2)C	{1: 2, 11: 11, 12: 4, 13: 2}
OK	248917-86-4	CCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CO)O)O)COC(=O)CCCCCCCCCCCCCCC)O)O)O	{1: 2, 2: 31, 12: 8, 13: 1, 20: 6, 22: 1, 23: 2, 28: 2}
OK	24892-49-7	CC(C)(CC(C)(C)O)O	{1: 4, 2: 1, 4: 2, 20: 2}
OK	249-87-6	C1CC2CCC1C3C2CC3	{11: 6, 12: 4}
OK	2490-16-6	CCC(C)CCCCCCCCCCCCCCC(=O)OC	{1: 3, 2: 15, 3: 1, 28: 1}
OK	2490-49-5	CCC(C)CCCCCCCCCCCCC(=O)OC	{1: 3, 2: 13, 3: 1, 28: 1}
OK	2490-53-1	CCCCCCCCCCCCCCC(C)C(=O)OC	{1: 3, 2: 13, 3: 1, 28: 1}
OK	2490-97-3	CC(=O)NC(CCC(=O)N)C(=O)O	{1: 1, 2: 2, 3: 1, 24: 2, 27: 1, 30: 1, 31: 1}
OK	24903-95-5	CC1(C2CCC(=O)C1C2)C	{1: 2, 11: 3, 12: 2, 13: 1, 25: 1}
OK	2491-06-7	CN(C)CC(=O)O.Cl	{1: 2, 2: 1, 27: 1, 33: 1, 17: 1}
OK	24910-63-2	CC=C(C)C(C)C	{1: 4, 3: 1, 6: 1, 7: 1}
OK	24910-84-7	C=CC(=O)OCC(CCl)Cl	{2: 2, 3: 1, 5: 1, 6: 1, 17: 2, 28: 1}
OK	24915-95-5	CCOC(=O)C[C@@H](C)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 1}
OK	2492-09-3	C/C=C(/C)\C(=O)O[C@@H]1CCN2[C@@H]1[C@H](CC2)COC(=O)/C(=C\C)/CO	{1: 3, 2: 2, 33: 1, 6: 2, 7: 2, 11: 4, 12: 3, 20: 1, 28: 2}
OK	2492-18-4	CCCCCC(=O)OC(C)(C)C	{1: 4, 2: 4, 4: 1, 28: 1}
OK	2492-22-0	C/C=C(/C)\CCC=C(C)C	{1: 4, 2: 2, 6: 2, 7: 2}
OK	2492-34-4	CCC[CH]C	{1: 2, 2: 2, 6: 1}
OK	2492-36-6	CCC[CH2]	{1: 1, 2: 2, 5: 1}
OK	2492-74-2	C=CSO	{40: 1, 20: 1, 5: 1, 6: 1}
OK	24928-15-2	C[C@@H]1[C@H]([C@@]2([C@@H](C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)CO)O)C)O)OC(=O)C)OC(=O)C	{1: 6, 2: 1, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	24928-17-4	CCCCCCCCCC(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)O)CO)[C@H]4[C@@]1(C4(C)C)OC(=O)CCCCCCCCC)O)C	{1: 6, 2: 17, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	24928-26-5	CCCCCCCCCC(=O)N(CCC)CCC	{24: 1, 1: 3, 2: 12, 33: 1}
OK	249297-16-3	C[C@@H]1CCC([C@@H](C1)OCC2CO2)C(C)C	{1: 3, 2: 1, 3: 1, 11: 4, 12: 4, 22: 1, 23: 1}
OK	2493-44-9	CCCC[CH]C	{1: 2, 2: 3, 6: 1}
OK	24935-97-5	C=CCOC(=O)NCO	{2: 2, 5: 1, 6: 1, 20: 1, 28: 1, 31: 1}
OK	24938-16-7	CCCCOC(=O)C(=C)C.CC(=C)C(=O)OC.CC(=C)C(=O)OCCN(C)C	{1: 7, 2: 5, 5: 3, 33: 1, 7: 3, 28: 3}
OK	24947-95-3	C1CC[C@H]([C@@H](C1)C(=O)N)O	{24: 1, 20: 1, 11: 4, 12: 2, 30: 1}
OK	24948-66-1	CCCCCC#CCC=C	{1: 1, 2: 5, 10: 2, 5: 1, 6: 1}
OK	24948-81-0	CC(C)N(C(C)C)Cl	{1: 4, 3: 2, 33: 1, 17: 1}
OK	24949-35-7	CSCCCSC	{40: 2, 1: 2, 2: 3}
OK	24949-38-0	CCCCCCC=CCCCCC	{1: 2, 2: 9, 6: 2}
OK	2495-27-4	CCCCCCCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 15, 28: 1, 5: 1, 7: 1}
OK	24951-77-7	CC=CC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 3, 3: 2, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	24959-67-9	[Br-]	{18: 1}
OK	2497-18-9	CCCC=CCOC(=O)C	{1: 2, 2: 3, 28: 1, 6: 2}
OK	2497-21-4	CCC(=O)C=CC	{24: 1, 1: 2, 2: 1, 6: 2}
OK	24973-90-8	C1CC2(CC2)C3(C1)CC3	{11: 7, 13: 2}
OK	24981-14-4	C#CF	{16: 1, 9: 1, 10: 1}
OK	2499-58-3	CCCCCCCOC(=O)C=C	{1: 1, 2: 6, 28: 1, 5: 1, 6: 1}
OK	2499-59-4	CCCCCCCCOC(=O)C=C	{1: 1, 2: 7, 28: 1, 5: 1, 6: 1}
OK	2499-95-8	CCCCCCOC(=O)C=C	{1: 1, 2: 5, 28: 1, 5: 1, 6: 1}
OK	24993-08-6	F.F.F.F.F.F	{16: 6}
OK	250-21-5	C1CC2C3C1C2CC3	{11: 4, 12: 4}
OK	250-22-6	C1C2CC3CC1C3C2	{11: 4, 12: 4}
OK	25005-42-9	CCC(CO)(CO)N.Cl	{1: 1, 2: 3, 4: 1, 17: 1, 20: 2, 30: 1}
OK	25006-60-4	CC(C)OC(=O)C(Cl)Cl	{1: 2, 3: 2, 28: 1, 17: 2}
OK	2501-01-1	C(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F	{16: 22, 4: 10, 22: 2}
OK	25022-43-9	CCC(=C)OC	{1: 2, 2: 1, 5: 1, 22: 1, 7: 1}
OK	25037-32-5	C(CCCCC(=O)O)CCCC(=O)O.C(CO)O	{2: 10, 27: 2, 20: 2}
OK	25038-71-5	C=C.C(=C(F)F)(F)F	{16: 4, 5: 2, 7: 2}
OK	25044-01-3	CCC(=O)C(=C)C	{24: 1, 1: 2, 2: 1, 5: 1, 7: 1}
OK	2505-03-5	C=C1CCCCCC1	{11: 6, 5: 1, 15: 1}
OK	2505-06-8	CC1CCC=CCC1	{1: 1, 11: 4, 12: 1, 14: 2}
OK	25054-29-9	CC(=C=C)C=C	{8: 1, 1: 1, 5: 2, 6: 1, 7: 1}
OK	25065-63-8	CCCCCCCCCCCCCCCC(=O)NCCNCCO	{24: 1, 1: 1, 2: 18, 20: 1, 31: 2}
OK	2507-55-3	CCCCCCCCCCCCC(C(=O)O)O	{27: 1, 1: 1, 2: 11, 3: 1, 20: 1}
OK	2508-29-4	C(CCN)CCO	{2: 5, 20: 1, 30: 1}
OK	25085-03-4	CC(=C)C(=O)O.C=CC(=O)N	{1: 1, 5: 2, 6: 1, 7: 1, 24: 1, 27: 1, 30: 1}
OK	25086-89-9	CC(=O)OC=C.C=CN1CCCC1=O	{1: 1, 5: 2, 6: 2, 33: 1, 11: 3, 25: 1, 28: 1}
OK	25090-71-5	CC1CC2(C(C2(C)C)C3C1(C4C=C(C(=O)C4(CC(=C3)COC(=O)C)O)C)O)OC(=O)C(C)C	{1: 7, 2: 1, 3: 1, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 2, 25: 1, 28: 2}
OK	25090-72-6	C/C=C(\C)/C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)COC(=O)C)O)C	{1: 7, 2: 1, 6: 1, 7: 1, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 2, 25: 1, 28: 2}
OK	25090-73-7	CCC(C)C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)COC(=O)C)O)C	{1: 7, 2: 2, 3: 1, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 2, 25: 1, 28: 2}
OK	25103-09-7	CC(C)CCCCCOC(=O)CS	{1: 2, 2: 6, 3: 1, 28: 1, 39: 1}
OK	25103-58-6	CC(C)C(C)(C)C(C)(C)C(C)(C)S	{1: 8, 3: 1, 4: 3, 39: 1}
OK	25103-87-1	C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 8, 27: 2, 20: 2}
OK	25109-57-3	CC(=O)C(CBr)Br	{24: 1, 1: 1, 2: 1, 3: 1, 18: 2}
OK	2511-91-3	CCCCCC1CC1	{1: 1, 2: 4, 11: 2, 12: 1}
OK	2511-92-4	CCCCC1CC1C	{1: 2, 2: 3, 11: 1, 12: 2}
OK	2511-95-7	CC1CC1C	{1: 2, 11: 1, 12: 2}
OK	25111-05-1	CCCCCCCCC=CCCCCCCCC(=O)OCC(CC)(CO)COC(=O)CCCCCCCC=CCCCCCCCC	{1: 3, 2: 32, 4: 1, 6: 4, 20: 1, 28: 2}
OK	25116-80-7	C1CCN(CC1)SN2CCCCC2	{40: 1, 33: 2, 11: 10}
OK	25117-24-2	CCCCCCCCCCC(C)CCC	{1: 3, 2: 11, 3: 1}
OK	25117-26-4	CCCCCCCCCCCCC(C)CCC	{1: 3, 2: 13, 3: 1}
OK	25117-27-5	CCCCCCCCCCCCCCCC(C)CCC	{1: 3, 2: 16, 3: 1}
OK	25117-32-2	CCCCCCCCCC(C)CCCC	{1: 3, 2: 11, 3: 1}
OK	25117-33-3	CCCCCCCCCCC(C)CCCC	{1: 3, 2: 12, 3: 1}
OK	25118-28-9	CCC(CCCBr)Br	{1: 1, 2: 4, 3: 1, 18: 2}
OK	2512-14-3	CCCCCCCCCCCC(=O)N(CCOC(=O)CCCCCCCCCCC)CCOC(=O)CCCCCCCCCCC	{24: 1, 1: 3, 2: 34, 28: 2, 33: 1}
OK	25122-46-7	CCC(=O)OC1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)C)C(=O)CCl	{1: 4, 2: 2, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 17: 1, 20: 1, 24: 1, 25: 1, 28: 1}
OK	25122-57-0	CCCC(=O)OC1(C(CC2C1(CC(=O)C3(C2CCC4=CC(=O)C=CC43C)F)C)C)C(=O)CCl	{1: 4, 2: 3, 11: 4, 12: 3, 13: 4, 14: 3, 15: 1, 16: 1, 17: 1, 24: 1, 25: 2, 28: 1}
OK	25125-84-2	C/C=C(\C)/OC	{1: 3, 22: 1, 6: 1, 7: 1}
OK	25136-53-2	C=CCOC(CO)CO	{2: 3, 3: 1, 5: 1, 6: 1, 20: 2, 22: 1}
OK	2514-52-5	C1(=C(C(C(C1=O)(Cl)Cl)(Cl)Cl)Cl)Cl	{17: 6, 25: 1, 13: 2, 15: 2}
OK	2514-53-6	C(COC(=O)C(Cl)(Cl)Cl)OC(=O)C(Cl)(Cl)Cl	{17: 6, 2: 2, 4: 2, 28: 2}
OK	25144-04-1	C[C@@H]1CCC[C@H]1O	{1: 1, 11: 3, 12: 2, 20: 1}
OK	25144-05-2	C[C@H]1CCC[C@H]1O	{1: 1, 11: 3, 12: 2, 20: 1}
OK	25148-01-0	CCC1=CCC(=C1)C	{1: 2, 2: 1, 11: 1, 14: 2, 15: 2}
OK	25149-46-6	CC(C)(C)N=NC(C)(C)C#N	{1: 5, 34: 2, 4: 2, 37: 1}
OK	25149-47-7	CC(C)(C)N=NC1(CCCCC1)C#N	{1: 3, 34: 2, 4: 1, 37: 1, 11: 5, 13: 1}
OK	25149-50-2	CC(C)(C)N=NC(C)(CCC(=O)O)C#N	{1: 4, 2: 2, 4: 2, 37: 1, 34: 2, 27: 1}
OK	25151-33-1	CC(COC(=O)C=C)OC(=O)C=C	{1: 1, 2: 1, 3: 1, 5: 2, 6: 2, 28: 2}
OK	25152-83-4	CCCCC/C=C\C=C\C=O	{1: 1, 2: 4, 26: 1, 6: 4}
OK	25152-84-5	CCCCC/C=C/C=C/C=O	{1: 1, 2: 4, 26: 1, 6: 4}
OK	25155-29-7	C(N(CO)C(=O)N)O	{24: 1, 33: 1, 2: 2, 20: 2, 30: 1}
OK	2516-33-8	C1CC1CO	{20: 1, 2: 1, 11: 2, 12: 1}
OK	2516-34-9	C1CC(C1)N	{11: 3, 12: 1, 30: 1}
OK	2516-47-4	C1CC1CN	{2: 1, 11: 2, 12: 1, 30: 1}
OK	2516-93-0	CCCCOCC(=O)O	{1: 1, 2: 4, 27: 1, 22: 1}
OK	2516-99-6	C(C(=O)O)C(F)(F)F	{16: 3, 2: 1, 27: 1, 4: 1}
OK	25167-88-8	C(C(Cl)Cl)F	{16: 1, 17: 2, 2: 1, 3: 1}
OK	25168-07-4	C=CC1=CCCCC1	{14: 1, 11: 4, 5: 1, 6: 1, 15: 1}
OK	2517-43-3	CC(CCO)OC	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	25172-06-9	CC(=O)/C=C\CCC=C	{24: 1, 1: 1, 2: 2, 5: 1, 6: 3}
OK	25182-84-7	C(C[N+](=O)[O-])CO	{2: 3, 20: 1, 38: 1}
OK	25184-14-9	C1C(O1)COCC([N+](=O)[O-])([N+](=O)[O-])F	{2: 2, 4: 1, 38: 2, 11: 1, 12: 1, 16: 1, 22: 1, 23: 1}
OK	25190-06-1	CCCCO[C@@H](CC)CO	{1: 2, 2: 5, 3: 1, 20: 1, 22: 1}
OK	25191-16-6	C(C(C(C(C(C=O)O)O)O)O)O	{2: 1, 3: 4, 20: 5, 26: 1}
OK	25201-40-5	CC(CC=C)(CC=C)O	{1: 1, 2: 2, 4: 1, 5: 2, 6: 2, 20: 1}
OK	25209-66-9	C(CO)N(CCO)C=O	{33: 1, 2: 4, 20: 2, 26: 1}
OK	25212-88-8	CCOC(=O)C=C.CC(=C)C(=O)O	{1: 2, 2: 1, 5: 2, 6: 1, 7: 1, 27: 1, 28: 1}
OK	25215-10-5	NC(N)=[NH2+]	{30: 3, 7: 1}
OK	25229-42-9	C/C(=C/C(=O)O)/C1CCCCC1	{1: 1, 6: 1, 7: 1, 11: 5, 12: 1, 27: 1}
OK	25229-97-4	C1COCCN1C=C(C#N)C(=O)N	{33: 1, 37: 1, 6: 1, 7: 1, 11: 4, 23: 1, 24: 1, 30: 1}
OK	2523-55-9	CC1CCC(CC1)N	{1: 1, 11: 4, 12: 2, 30: 1}
OK	25234-25-7	CCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 6, 3: 1}
OK	25234-79-1	CC(C(C)C(=O)C)C(=O)C	{24: 2, 1: 4, 3: 2}
OK	25234-83-7	CC(CC(=O)OC)C(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 28: 1}
OK	25246-71-3	CCCCC(C)OC	{1: 3, 2: 3, 3: 1, 22: 1}
OK	25246-76-8	CCOC(C)C(C)(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 22: 1}
OK	2525-16-8	COC1=NCCCCC1	{1: 1, 11: 5, 35: 1, 22: 1, 15: 1}
OK	2525-62-4	CCCCCCN=C=O	{8: 1, 1: 1, 2: 5, 34: 1, 29: 1}
OK	25254-50-6	CC(CN1CN(CN(C1)CC(C)O)CC(C)O)O	{1: 3, 2: 3, 3: 3, 33: 3, 11: 3, 20: 3}
OK	25260-60-0	CC(=O)OC/C=C\COC(=O)C	{1: 2, 2: 2, 28: 2, 6: 2}
OK	252642-05-0	CCCCCCCCCCC(CCCCCCCC)CC1=CC(=C(C1)CC(CCCCCCCC)CCCCCCCCCC)CC(CCCCCCCC)CCCCCCCCCC	{1: 6, 2: 51, 3: 3, 11: 1, 14: 1, 15: 3}
OK	25265-71-8	CCC(O)OC(O)CC	{1: 2, 2: 2, 3: 2, 20: 2, 22: 1}
OK	25268-73-9	CCCCCCCCCCCC(=O)OCC(CC)(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC	{1: 4, 2: 34, 4: 1, 28: 3}
OK	2527-11-9	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)C3([C@H]2CCC4=CC(=O)CC[C@@]43C)Br)C	{1: 3, 11: 7, 12: 3, 13: 3, 14: 1, 15: 1, 18: 1, 24: 1, 25: 2}
OK	252720-31-3	CC(C)(C)OC(=O)NC1(CCNCC1)C(=O)O	{32: 1, 1: 3, 4: 1, 11: 4, 13: 1, 27: 1, 28: 1, 31: 1}
OK	25275-74-5	C[C@@H]1CC[C@H]([C@@H](C1)N)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 30: 1}
OK	25276-70-4	CCCCCCCCCCCCCCCS	{1: 1, 2: 14, 39: 1}
OK	25276-80-6	CCCCCCCCCC(=O)CC(=O)C	{24: 2, 1: 2, 2: 9}
OK	2528-61-2	CCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 5, 17: 1}
OK	2529-46-6	CC(=C)C[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)O	{1: 2, 2: 1, 5: 1, 7: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	25290-13-5	CC(=O)CC1(CCCCC1)O	{1: 1, 2: 1, 11: 5, 13: 1, 20: 1, 24: 1}
OK	25291-17-2	C=CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 4: 6, 5: 1, 6: 1}
OK	25303-14-4	CCCNCC(=O)O	{1: 1, 2: 3, 27: 1, 31: 1}
OK	2531-80-8	CCOC(=O)C(C)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 28: 1, 38: 1}
OK	2531-81-9	CCC(C(=O)OCC)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 28: 1, 38: 1}
OK	25312-34-9	CC1=CCCC(C1/C=C/C(C)O)(C)C	{1: 4, 3: 1, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	25312-65-6	CC(CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4[C@@]3(CCCC4)C)C	{1: 3, 2: 2, 3: 1, 11: 10, 12: 5, 13: 2, 27: 1}
OK	2532-50-5	C(SSSC(Cl)(Cl)Cl)(Cl)(Cl)Cl	{40: 3, 17: 6, 4: 2}
OK	2532-58-3	C[C@H]1CC[C@@H](C)C1	{1: 2, 11: 3, 12: 2}
OK	25322-69-4	CC(CO)OCC(C)O	{1: 2, 2: 2, 3: 2, 20: 2, 22: 1}
OK	25329-35-5	C1(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl	{17: 5, 12: 1, 15: 4}
OK	2533-69-9	COC(=N)C(Cl)(Cl)Cl	{1: 1, 36: 1, 7: 1, 17: 3, 22: 1, 4: 1}
OK	25333-42-0	C1CN2CCC1[C@H](C2)O	{20: 1, 11: 5, 12: 2, 33: 1}
OK	25336-51-0	C1CCN2CCCCN(C1)C2	{33: 2, 11: 9}
OK	25337-75-1	C1CCN2CCCN(C1)C2	{33: 2, 11: 8}
OK	25339-09-7	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCC(C)C	{1: 3, 2: 29, 3: 1, 28: 1}
OK	25339-17-7	CC(C)CCCCCCCO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	25339-53-1	CCCCCCC/C=C/C	{1: 2, 2: 6, 6: 2}
OK	2534-66-9	CCCCCCCC[N+]1=CC=CC=C1.[Br-]	{1: 1, 2: 7, 18: 1, 14: 5, 33: 1}
OK	2534-77-2	C1CC2CC1CC2Br	{18: 1, 11: 4, 12: 3}
OK	2534-80-7	C1CC2(CCC1C=C2)C(=O)O	{27: 1, 11: 4, 12: 1, 13: 1, 14: 2}
OK	25346-05-8	CN([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 38: 2, 33: 1}
OK	25346-31-0	CCC(C)(CC)Br	{1: 3, 2: 2, 4: 1, 18: 1}
OK	25346-33-2	CCCC(C)CBr	{1: 2, 2: 3, 3: 1, 18: 1}
OK	25352-00-5	C1CC2CC1C(=O)C(=O)C2=O	{25: 3, 11: 3, 12: 2}
OK	25354-92-1	CCCCCCCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 12, 3: 1}
OK	25354-93-2	CCCCCCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 12, 3: 1}
OK	25354-97-6	CCCCCCCCC(CCCCCC)C(=O)O	{27: 1, 1: 2, 2: 12, 3: 1}
OK	25354-98-7	CCCCCCCCCCCCCC(C)CO	{1: 2, 2: 13, 3: 1, 20: 1}
OK	2536-18-7	C1CN(C(=O)N1[N+](=O)[O-])[N+](=O)[O-]	{25: 1, 11: 2, 38: 2, 33: 2}
OK	2536-38-1	C(CCCCCCCCC(=O)O)CCCCCCCCBr	{2: 17, 27: 1, 18: 1}
OK	25360-10-5	CCCCCCC(C)(C)S	{1: 3, 2: 5, 4: 1, 39: 1}
OK	253687-18-2	C(CCC/C=C\CCCCCC(=O)O)CCCC(=O)O	{2: 12, 27: 2, 6: 2}
OK	253687-28-4	C(CCC/C=C\CCCCCCC(=O)O)CCCC(=O)O	{2: 13, 27: 2, 6: 2}
OK	253687-69-3	C(CCCC/C=C\CCCCCCCC(=O)O)CCCCC(=O)O	{2: 16, 27: 2, 6: 2}
OK	2537-29-3	CC(CC1(C(=O)NC(=O)NC1=O)CC=C)O	{32: 2, 1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 13: 1, 20: 1, 25: 3}
OK	25377-82-6	CCCCCCCCCC/C=C/C	{1: 2, 2: 9, 6: 2}
OK	2539-75-5	CCCC1=CCCCC1	{1: 1, 2: 2, 11: 4, 14: 1, 15: 1}
OK	25395-31-7	CC(=O)OCC(CO)OC(=O)C	{1: 2, 2: 2, 3: 1, 20: 1, 28: 2}
OK	25398-32-7	C(=C(F)F)(F)F.C(C(F)(F)I)(F)(F)F	{16: 9, 19: 1, 4: 2, 7: 2}
OK	25399-32-0	C1CC12CC3(C2)CC3	{11: 6, 13: 2}
OK	25400-83-3	CC(C)(C#CCN(C)C)O	{1: 4, 2: 1, 4: 1, 33: 1, 10: 2, 20: 1}
OK	25409-39-6	CCOC(=O)C(C)(C(=O)C)OC(=O)C	{24: 1, 1: 4, 2: 1, 4: 1, 28: 2}
OK	2541-61-9	CCCCCC=CCC=CCCCCCCCC=O	{1: 1, 2: 12, 26: 1, 6: 4}
OK	2541-75-5	CCCCCCCCCC(CCCCCCC)O	{1: 2, 2: 14, 3: 1, 20: 1}
OK	25413-02-9	CCOC(=O)CNC(=O)C(C)Br	{1: 2, 2: 2, 3: 1, 18: 1, 24: 1, 28: 1, 31: 1}
OK	25413-64-3	CCCCN(CCC)N=O	{1: 2, 2: 5, 34: 1, 29: 1, 33: 1}
OK	25415-62-7	CCCCCOC(=O)CC(C)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	25415-67-2	CCOC(=O)CCC(C)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	25415-71-8	CCCCCOC(=O)CCC(C)C	{1: 3, 2: 6, 3: 1, 28: 1}
OK	25415-76-3	CCCCCOC(=O)C=CC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	25415-77-4	CC=CC(=O)OCCC(C)C	{1: 3, 2: 2, 3: 1, 28: 1, 6: 2}
OK	25415-84-3	CCCCC(CC)COC(=O)CCC	{1: 3, 2: 7, 3: 1, 28: 1}
OK	25419-06-1	CCCCCNC	{1: 2, 2: 4, 31: 1}
OK	25423-56-7	C1CSCCSCCSCCS1	{41: 4, 11: 8}
OK	25430-48-2	CCCCCCCCCCC(CCCO)O	{1: 1, 2: 12, 3: 1, 20: 2}
OK	25430-52-8	CCCCC(CC)C(C#CC(C(CC)CCCC)O)O	{1: 4, 2: 8, 3: 4, 20: 2, 10: 2}
OK	2544-06-1	COCCC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1}
OK	2545-22-4	CCC=CCC=CCC=CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 13, 3: 2, 6: 6, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	25462-17-3	CCCC(C)(CO)COC(=O)NC(C)C	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1, 28: 1, 31: 1}
OK	25466-50-6	CN(C(=O)N(C)[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 1: 2, 38: 2, 33: 2}
OK	2547-26-4	CC12CCCCC1CCCC2	{1: 1, 11: 8, 12: 1, 13: 1}
OK	2547-92-4	C=CCSC(=N)N.Cl	{2: 1, 36: 1, 5: 1, 6: 1, 7: 1, 40: 1, 17: 1, 30: 1}
OK	25474-92-4	N1=S=NS1	{41: 2, 35: 2}
OK	2548-87-0	CCCCCC=CC=O	{1: 1, 2: 4, 26: 1, 6: 2}
OK	25487-36-9	C1=C/C(=C\[NH+]=O)/N(C=C1)COCN2C=CC(=C[NH+]=O)C=C2.[Cl-].[Cl-]	{33: 2, 2: 2, 6: 2, 14: 8, 15: 2, 17: 2, 22: 1, 29: 2, 31: 2}
OK	25489-02-5	COC12CCC(CC1)C=C2	{1: 1, 11: 4, 12: 1, 13: 1, 14: 2, 22: 1}
OK	2549-51-1	C=COC(=O)CCl	{17: 1, 2: 1, 28: 1, 5: 1, 6: 1}
OK	2549-53-3	CCCCCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 13, 28: 1, 5: 1, 7: 1}
OK	2549-67-9	CCC1CN1	{32: 1, 1: 1, 2: 1, 11: 1, 12: 1}
OK	2549-93-1	C1CC(CCC1CN)CN	{2: 2, 11: 4, 12: 2, 30: 2}
OK	25498-49-1	COCC(C)OCC(C)OCC(C)O	{1: 4, 2: 3, 3: 3, 20: 1, 22: 3}
OK	2550-21-2	CCCC(C)C(=O)C	{24: 1, 1: 3, 2: 2, 3: 1}
OK	2550-28-9	CC(=O)CCC#C	{24: 1, 1: 1, 2: 2, 10: 1, 9: 1}
OK	2550-33-6	CCC(CC)C(=O)OOC(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 22: 1, 28: 1}
OK	2550-36-9	C1CCC(CC1)CBr	{2: 1, 11: 5, 12: 1, 18: 1}
OK	2550-37-0	C1CCC(CC1)CS	{2: 1, 11: 5, 12: 1, 39: 1}
OK	2550-40-5	C1CCC(CC1)SSC2CCCCC2	{40: 2, 11: 10, 12: 2}
OK	2550-52-9	C1CCCCCCCC(=O)CCCCCCC1	{25: 1, 11: 15}
OK	2550-75-6	C(C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)CCl)Cl	{17: 8, 2: 2, 12: 2, 13: 3, 15: 2}
OK	25502-52-7	C1C2C=CC1C3C2C(=O)N(C3=O)CCN4C(=O)C5C6CC(C5C4=O)C=C6	{33: 2, 2: 2, 11: 2, 12: 8, 14: 4, 25: 4}
OK	25503-90-6	CC(=O)N1CCC(CC1)C(=O)O	{1: 1, 33: 1, 11: 4, 12: 1, 24: 1, 27: 1}
OK	25524-95-2	CCC=CCC1CCCC(=O)O1	{1: 1, 2: 2, 6: 2, 11: 3, 12: 1, 28: 1}
OK	25525-60-4	CCCCCCCCC=CCCCCCCCC(=O)O.CC(CN)O	{1: 2, 2: 15, 3: 1, 6: 2, 20: 1, 27: 1, 30: 1}
OK	255391-65-2	CC(CC(C)(C)S)O	{1: 3, 2: 1, 3: 1, 4: 1, 39: 1, 20: 1}
OK	25542-62-5	CCOC(=O)CCCCCBr	{1: 1, 2: 6, 28: 1, 18: 1}
OK	25544-81-4	CCC(C)(C)NN.Cl	{1: 3, 2: 1, 4: 1, 17: 1, 30: 1, 31: 1}
OK	25546-65-0	C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N)O[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)O)N	{2: 2, 11: 1, 12: 14, 20: 6, 22: 2, 23: 2, 30: 4}
OK	25549-16-0	CC(C)CCCCCN(CCCCCC(C)C)CCCCCC(C)C	{1: 6, 2: 15, 3: 3, 33: 1}
OK	25551-49-9	CCC1CCC2CCCCC2C1.CCC1CCCC2C1CCCC2	{1: 2, 2: 2, 11: 14, 12: 6}
OK	25553-97-3	CC(C)CN(CC#N)CC(C)C	{1: 4, 2: 3, 3: 2, 37: 1, 33: 1}
OK	2556-73-2	CN1CCCCCC1=O	{1: 1, 11: 5, 33: 1, 25: 1}
OK	25560-00-3	CC1CCCCN1CCCN	{1: 1, 2: 3, 33: 1, 11: 4, 12: 1, 30: 1}
OK	25564-22-1	CCCCCC1=CCCC1=O	{1: 1, 2: 4, 11: 2, 14: 1, 15: 1, 25: 1}
OK	25566-16-9	CC(=O)C(C(C(=O)C)O)O	{24: 2, 1: 2, 3: 2, 20: 2}
OK	25569-53-3	C(CC(=O)O)C(=O)O.C(CO)O	{2: 4, 27: 2, 20: 2}
OK	25570-03-0	CC[C@H](C)C#N	{1: 2, 2: 1, 3: 1, 37: 1}
OK	25597-16-4	CCOC(=O)/C=C/C(F)(F)F	{1: 1, 2: 1, 4: 1, 6: 2, 16: 3, 28: 1}
OK	25604-63-1	CCOC(OCC)SCC	{40: 1, 1: 3, 2: 3, 3: 1, 22: 2}
OK	25604-70-0	C(#CBr)Cl	{17: 1, 10: 2, 18: 1}
OK	25604-71-1	C(#CI)Cl	{17: 1, 10: 2, 19: 1}
OK	2561-21-9	CCCCCCCCOC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 7, 4: 1, 28: 1}
OK	25610-21-3	C(CCCCC(=O)O)CCCC(=O)O.C(COCCO)O	{2: 12, 27: 2, 20: 2, 22: 1}
OK	25614-78-2	CC/C(=C/C)/C(=O)NC(=O)NC(=O)C	{1: 3, 2: 1, 6: 1, 7: 1, 24: 3, 31: 2}
OK	2562-37-0	C1CCC(=CC1)[N+](=O)[O-]	{11: 4, 38: 1, 14: 1, 15: 1}
OK	2562-38-1	C1CCC(C1)[N+](=O)[O-]	{11: 4, 12: 1, 38: 1}
OK	2562-42-7	C1CC=C(C1)C[N+](=O)[O-]	{2: 1, 11: 3, 38: 1, 14: 1, 15: 1}
OK	25620-58-0	CC(CCCCN)C(C)(C)N	{1: 3, 2: 4, 3: 1, 4: 1, 30: 2}
OK	25637-84-7	CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)O	{1: 2, 2: 30, 3: 1, 6: 4, 20: 1, 28: 2}
OK	2564-95-6	CN(C)C(=O)CCC(=O)O	{24: 1, 1: 2, 2: 2, 27: 1, 33: 1}
OK	2565-21-1	C=CCOCC(COCC=C)OCC=C	{22: 3, 2: 5, 3: 1, 5: 3, 6: 3}
OK	2565-30-2	C(=O)Cl	{17: 1, 26: 1}
OK	2565-39-1	CCC(=O)CCC=C	{24: 1, 1: 1, 2: 3, 5: 1, 6: 1}
OK	2565-43-7	C=CCC1C(=O)NC(=O)NC1=O	{32: 2, 2: 1, 5: 1, 6: 1, 12: 1, 25: 3}
OK	2565-83-5	CC(=CCCC(=CCOC)C)C	{1: 4, 2: 3, 22: 1, 6: 2, 7: 2}
OK	25655-41-8	C=CN1CCCC1=O.II	{33: 1, 5: 1, 6: 1, 11: 3, 19: 2, 25: 1}
OK	25657-08-3	CCC(O)OC(C)COCC(C)OC(CC)O	{1: 4, 2: 4, 3: 4, 20: 2, 22: 3}
OK	25659-22-7	CC=CCC(=O)C	{24: 1, 1: 2, 2: 1, 6: 2}
OK	2566-34-9	CC(C)(C(=O)O)NC	{1: 3, 27: 1, 4: 1, 31: 1}
OK	2566-44-1	C1CC1CCO	{20: 1, 2: 2, 11: 2, 12: 1}
OK	2566-48-5	C1CC2CCC1C2O	{20: 1, 11: 4, 12: 3}
OK	2566-57-6	C1CC2CC2C=C1	{11: 3, 12: 2, 14: 2}
OK	2566-89-4	CCCCCC=CCC=CCC=CCC=CCCCC(=O)OC	{1: 2, 2: 10, 28: 1, 6: 8}
OK	2566-97-4	CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC	{1: 2, 2: 12, 28: 1, 6: 4}
OK	25661-96-5	CCCCCCCCCCCCN=C(N(C)C)N(C)C	{1: 5, 2: 11, 34: 1, 33: 2, 7: 1}
OK	25662-28-6	COC(=O)C1=CCCC1	{1: 1, 11: 3, 28: 1, 14: 1, 15: 1}
OK	2567-14-8	C(C=C(Cl)Cl)Cl	{17: 3, 2: 1, 6: 1, 7: 1}
OK	25677-40-1	CCCC/C=C\1/CCCCC1=O	{1: 1, 2: 3, 6: 1, 11: 4, 15: 1, 25: 1}
OK	2568-17-4	C1CC2CCC(=O)C(C1)C2	{25: 1, 11: 6, 12: 2}
OK	2568-30-1	C1COC(O1)CCl	{17: 1, 2: 1, 11: 2, 12: 1, 23: 2}
OK	2568-33-4	CC(C)(CCO)O	{1: 2, 2: 2, 4: 1, 20: 2}
OK	2568-61-8	CN(CC#C)CC#C	{1: 1, 2: 2, 33: 1, 10: 2, 9: 2}
OK	2568-90-3	CCCCOCOCCCC	{1: 2, 2: 7, 22: 2}
OK	2568-91-4	CC(C)COCOCC(C)C	{1: 4, 2: 3, 3: 2, 22: 2}
OK	2568-92-5	CCC(C)OCOC(C)CC	{1: 4, 2: 3, 3: 2, 22: 2}
OK	2568-96-9	CCC1OCCO1	{1: 1, 2: 1, 11: 2, 12: 1, 23: 2}
OK	25682-07-9	C(CN)N.OCl(=O)(=O)=O	{17: 1, 2: 2, 20: 1, 29: 3, 30: 2}
OK	25683-00-5	CCCCC1(OCCCO1)C	{1: 2, 2: 3, 11: 3, 13: 1, 23: 2}
OK	25684-04-2	CCCC1=C(C(=O)CC1)O	{1: 1, 2: 2, 11: 2, 15: 2, 20: 1, 25: 1}
OK	2570-12-9	CC1=CC=CC=CC=C1	{1: 1, 14: 7, 15: 1}
OK	2570-26-5	CCCCCCCCCCCCCCCN	{1: 1, 2: 14, 30: 1}
OK	2570-81-2	CC1(C(C1(C)C)(C)C)C	{1: 6, 13: 3}
OK	2570-97-0	CCCCC(CC)CC=O	{1: 2, 2: 5, 3: 1, 26: 1}
OK	2571-05-3	CCCCC(CC)CC#N	{1: 2, 2: 5, 3: 1, 37: 1}
OK	2571-22-4	CC(=C)[C@@H]1[C@@H]2[C@H]([C@]3([C@@]4(CO4)[C@H]5[C@@H]([C@]3([C@H]1C(=O)O2)O)O5)C)O	{1: 2, 5: 1, 7: 1, 11: 1, 12: 6, 13: 3, 20: 2, 23: 2, 28: 1}
OK	2571-86-0	CC(=C)[C@H]1[C@H]2C[C@@]3([C@]4(CO4)[C@@H]5[C@H]([C@@]3([C@@H]1C(=O)O2)O)O5)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 5, 13: 3, 20: 1, 23: 2, 28: 1}
OK	25713-24-0	CC1(CC(CC(N1[O])(C)C)NC(=O)CI)C	{1: 4, 2: 1, 33: 1, 11: 2, 12: 1, 13: 2, 19: 1, 24: 1, 29: 1, 31: 1}
OK	25714-71-0	C(CC=O)CO	{2: 3, 20: 1, 26: 1}
OK	25724-33-8	C=CC1CCC(OC1)C=C	{11: 3, 12: 2, 5: 2, 6: 2, 23: 1}
OK	25724-34-9	CCOC1CC(CCO1)C	{1: 2, 2: 1, 11: 3, 12: 2, 22: 1, 23: 1}
OK	25724-60-1	CCC(CC)COCCOC(=O)CCC(=O)OCCOCC(CC)CC	{1: 4, 2: 12, 3: 2, 28: 2, 22: 2}
OK	25726-97-0	C1=CN(N=C1)SC(Cl)(Cl)Cl	{33: 1, 35: 1, 4: 1, 40: 1, 14: 3, 17: 3}
OK	25726-99-2	CCCCN(CCCC)CCC#N	{1: 2, 2: 8, 37: 1, 33: 1}
OK	25727-91-7	CCCCCCCCCCCCCCCCN1CCOCC1	{1: 1, 2: 15, 11: 4, 33: 1, 23: 1}
OK	25727-93-9	CCCCCCCCCCCCCCN1CCOCC1	{1: 1, 2: 13, 11: 4, 33: 1, 23: 1}
OK	2573-03-7	CCCCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 21, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	25735-29-9	CCC(Cl)(Cl)Cl	{1: 1, 2: 1, 4: 1, 17: 3}
OK	25736-79-2	CCCCOCCCOC	{1: 2, 2: 6, 22: 2}
OK	25749-86-4	C=CCCCCCCCCCCCCCCCC1=NCCN1CCN	{33: 1, 2: 17, 35: 1, 5: 1, 6: 1, 11: 2, 15: 1, 30: 1}
OK	2575-07-7	CC(=O)CCCCCCCC(=O)OC	{24: 1, 1: 2, 2: 7, 28: 1}
OK	25756-29-0	CNCC1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1, 31: 1}
OK	2576-47-8	C(CBr)N.Br	{2: 2, 18: 2, 30: 1}
OK	2576-67-2	CC(C)CC(C(=O)NCC(=O)O)NC(=O)CN	{1: 2, 2: 3, 3: 2, 24: 2, 27: 1, 30: 1, 31: 2}
OK	25767-83-3	CC(=C)C(=O)OC.CC(=O)OC=C.C=CC(=O)O	{1: 3, 5: 3, 6: 2, 7: 1, 27: 1, 28: 2}
OK	2578-57-6	C1CC(NC1)C(=O)NCC(=O)O	{32: 1, 2: 1, 11: 3, 12: 1, 24: 1, 27: 1, 31: 1}
OK	2579-20-6	C1CC(CC(C1)CN)CN	{2: 2, 11: 4, 12: 2, 30: 2}
OK	2579-21-7	CC(C)(C)C#CC=O	{1: 3, 10: 2, 4: 1, 26: 1}
OK	25790-55-0	C=C=CCCl	{8: 1, 17: 1, 2: 1, 5: 1, 6: 1}
OK	25791-96-2	C(COC(OCCC(CO)O)OCC(CO)O)C(CO)O	{2: 8, 3: 4, 20: 6, 22: 3}
OK	2580-58-7	C1NC(=O)NCN1CCO	{32: 2, 33: 1, 2: 2, 11: 2, 20: 1, 25: 1}
OK	25808-30-4	CNCC#N.Cl	{1: 1, 2: 1, 31: 1, 37: 1, 17: 1}
OK	2583-25-7	C=CCC(C(=O)O)C(=O)O	{27: 2, 2: 1, 3: 1, 5: 1, 6: 1}
OK	25835-57-8	C1C2C3=CC4=CC=CC=C(C41)C=C2C=CC=C3	{11: 1, 12: 2, 14: 10, 15: 4}
OK	2584-71-6	C1[C@H](CN[C@H]1C(=O)O)O	{27: 1, 20: 1, 11: 2, 12: 2, 32: 1}
OK	25840-11-3	[CH2]CC#N	{2: 1, 5: 1, 37: 1}
OK	25843-45-2	CN=[N+](C)[O-]	{1: 2, 34: 1, 29: 1, 33: 1}
OK	25854-04-0	C=CC(=C(Cl)Cl)Cl	{17: 3, 5: 1, 6: 1, 7: 2}
OK	25859-51-2	CC(C)OC(=O)C=C(C)C	{1: 4, 3: 1, 28: 1, 6: 1, 7: 1}
OK	2586-89-2	CCCC#CCC	{1: 2, 2: 3, 10: 2}
OK	25863-08-5	C1CC2C1C3CCC2N=N3	{35: 2, 11: 4, 12: 4}
OK	25876-07-7	CCCCOC(=O)/C=C\C(=O)OCC1CO1	{1: 1, 2: 4, 6: 2, 11: 1, 12: 1, 23: 1, 28: 2}
OK	25876-34-0	CCCCCC=CCC=CCCCCCCCCN	{1: 1, 2: 13, 30: 1, 6: 4}
OK	25876-47-5	CCOC(=O)/C=C\C(=O)OCC1CO1	{1: 1, 2: 2, 6: 2, 11: 1, 12: 1, 23: 1, 28: 2}
OK	25878-85-7	CCC1C(C2CC3C(=C(C(N3)CC4C(C(C([N-]4)CC5C(=C(C(N5)CC1[N-]2)C)CC)CC)C)C)CC)C	{32: 2, 1: 8, 2: 4, 35: 2, 11: 4, 12: 12, 15: 4}
OK	25905-14-0	CC(=CCC(COC(=O)C)C(=C)C)C	{1: 4, 2: 2, 3: 1, 5: 1, 6: 1, 7: 2, 28: 1}
OK	25905-16-2	CC(CCC(=C(C)C)C)CCO	{1: 4, 2: 4, 3: 1, 20: 1, 7: 2}
OK	2591-86-8	C1CCN(CC1)C=O	{33: 1, 26: 1, 11: 5}
OK	2592-18-9	CC(C(C(=O)O)NC(=O)OC(C)(C)C)O	{1: 4, 3: 2, 4: 1, 20: 1, 27: 1, 28: 1, 31: 1}
OK	2592-62-3	CC1OCC2C(CO1)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{1: 1, 11: 2, 12: 3, 13: 3, 15: 2, 17: 6, 23: 2}
OK	25924-90-7	CCC1COC(OC1)C	{1: 2, 2: 1, 11: 2, 12: 2, 23: 2}
OK	25925-01-3	CC(C)C1COC(OC1)C(C)C	{11: 2, 1: 4, 3: 2, 12: 2, 23: 2}
OK	25926-96-9	C1CC2CCC1N=[N+]2[O-]	{33: 1, 11: 4, 12: 2, 29: 1, 35: 1}
OK	25926-97-0	C1CCC2CCC(C1)N=[N+]2[O-]	{33: 1, 11: 6, 12: 2, 29: 1, 35: 1}
OK	25926-99-2	C1CC2C3CC3C1N=[N+]2[O-]	{33: 1, 11: 3, 12: 4, 29: 1, 35: 1}
OK	25928-94-3	C1C(O1)CCl.C(COCCO)O	{2: 5, 11: 1, 12: 1, 17: 1, 20: 2, 22: 1, 23: 1}
OK	2594-20-9	CCOC(=O)NC(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 31: 1}
OK	2594-21-0	CCCCNC(=O)OC	{1: 2, 2: 3, 28: 1, 31: 1}
OK	25948-33-8	C=CC(=O)O.C=C(CC(=O)O)C(=O)O	{2: 1, 27: 3, 5: 2, 6: 1, 7: 1}
OK	2595-05-3	CC1(OC[C@@H](O1)[C@@H]2[C@H]([C@@H]3[C@H](O2)OC(O3)(C)C)O)C	{1: 4, 11: 1, 12: 5, 13: 2, 20: 1, 23: 5}
OK	25952-53-8	CCN=C=NCCCN(C)C.Cl	{1: 3, 2: 4, 33: 1, 8: 1, 34: 2, 17: 1}
OK	25961-87-9	CCCCCCCOCCOCCO	{1: 1, 2: 10, 20: 1, 22: 2}
OK	25961-89-1	CCCCCCOCCOCCOCCO	{1: 1, 2: 11, 20: 1, 22: 3}
OK	25965-81-5	C=CC[N+]1=CC=CC=C1.[Cl-]	{33: 1, 2: 1, 5: 1, 6: 1, 14: 5, 17: 1}
OK	25966-39-6	CC1CC(C(=O)O1)Br	{1: 1, 18: 1, 11: 1, 12: 2, 28: 1}
OK	2597-43-5	[CH2]O	{20: 1, 5: 1}
OK	2597-49-1	C=CC1CCC1	{11: 3, 12: 1, 5: 1, 6: 1}
OK	2597-54-8	CCOC(=O)NC(=O)C	{24: 1, 1: 2, 2: 1, 28: 1, 31: 1}
OK	25988-63-0	C(CCN)C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)N	{2: 12, 3: 3, 24: 2, 27: 1, 30: 4, 31: 2}
OK	25990-60-7	O=C[C@H](O)[C@@H](O)[C@H](O)CO	{2: 1, 3: 3, 20: 4, 26: 1}
OK	26000-17-9	CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)CO	{1: 5, 2: 2, 33: 1, 11: 5, 12: 9, 13: 4, 20: 3, 22: 4}
OK	2601-13-0	CCCCCC(=O)OCC(C)CC	{1: 3, 2: 6, 3: 1, 28: 1}
OK	2601-89-0	C(C(C#N)Cl)Cl	{17: 2, 2: 1, 3: 1, 37: 1}
OK	26038-69-7	C1CC(CCC1C(=O)O)C(=O)O.C(CCCN)CCN	{27: 2, 2: 6, 11: 4, 12: 2, 30: 2}
OK	26050-79-3	C1CC2=CCC(=CC2)CCC3=CCC1=CC3	{11: 8, 14: 4, 15: 4}
OK	26054-46-6	C1C=C[C@H]2[C@@H]1OC(=O)C2	{28: 1, 11: 2, 12: 2, 14: 2}
OK	26059-43-8	CCCC#CC(=O)C	{24: 1, 1: 2, 2: 2, 10: 2}
OK	2607-14-9	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]4(C)O)C	{1: 3, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 20: 1, 25: 1}
OK	26072-78-6	C=CCNNCC=C.Cl.Cl	{17: 2, 2: 2, 5: 2, 6: 2, 31: 2}
OK	26081-83-4	C1CC2CCC(C1)[N+](=N2)[O-]	{33: 1, 11: 5, 12: 2, 29: 1, 35: 1}
OK	2609-23-6	CC=C(C)CCC=C(C)C	{1: 4, 2: 2, 6: 2, 7: 2}
OK	26090-94-8	CC(C)CC(C(=O)NC)NC(=O)C	{24: 2, 1: 4, 2: 1, 3: 2, 31: 2}
OK	26093-63-0	CC1CCCOC1	{1: 1, 11: 4, 12: 1, 23: 1}
OK	26094-11-1	CC(=O)CC(C)(C)SC#N	{1: 3, 2: 1, 4: 1, 37: 1, 40: 1, 24: 1}
OK	26094-13-3	CCCCCCCCC=CCCCCCCCC(=O)O.CCCCN	{1: 2, 2: 17, 27: 1, 30: 1, 6: 2}
OK	26098-04-4	C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H](CC[C@H](O3)CN)N)N)N)O	{1: 2, 2: 1, 11: 4, 12: 11, 13: 1, 20: 3, 22: 2, 23: 2, 30: 4, 31: 1}
OK	26106-63-8	C1(C(C(OC1C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 12: 4, 23: 1}
OK	26116-12-1	CCN1CCCC1CN	{1: 1, 2: 2, 33: 1, 11: 3, 12: 1, 30: 1}
OK	261165-05-3	CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](C1)C(=O)O	{1: 3, 4: 1, 11: 3, 12: 2, 27: 1, 28: 1, 31: 1}
OK	26118-38-7	CCCC(C)(C)C(=O)C	{24: 1, 1: 4, 2: 2, 4: 1}
OK	26118-61-6	CC(=O)OCCCCCCCCCCOC(=O)C	{1: 2, 2: 10, 28: 2}
OK	2612-27-3	CC(C)C(CO)CO	{1: 2, 2: 2, 3: 2, 20: 2}
OK	2612-28-4	CCCC(CO)CO	{1: 1, 2: 4, 3: 1, 20: 2}
OK	2612-29-5	CCC(CO)CO	{1: 1, 2: 3, 3: 1, 20: 2}
OK	2612-46-6	C=CC=CC=C	{5: 2, 6: 4}
OK	26120-52-5	CC1=CC=C(CC1)C	{1: 2, 11: 2, 14: 2, 15: 2}
OK	2613-61-8	CC(C)CC(C)CC(C)C	{1: 5, 2: 2, 3: 3}
OK	26131-32-8	COC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F	{16: 17, 1: 1, 4: 8, 22: 2, 28: 1}
OK	2614-76-8	CC(C)(OO)OO	{1: 2, 4: 1, 22: 2, 20: 2}
OK	2614-88-2	CC=CC=CC(=O)Cl	{24: 1, 1: 1, 6: 4, 17: 1}
OK	26143-08-8	CCCCCCCC=CI	{1: 1, 2: 6, 19: 1, 6: 2}
OK	2615-15-8	C(COCCOCCOCCOCCOCCO)O	{2: 12, 20: 2, 22: 5}
OK	2615-25-0	C1CC(CCC1N)N	{11: 4, 12: 2, 30: 2}
OK	26153-91-3	CC(C)(C)CNC	{1: 4, 2: 1, 4: 1, 31: 1}
OK	26158-99-6	CCCCCSCC	{40: 1, 1: 2, 2: 5}
OK	2616-71-9	C[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)OC(=O)C)C)OC(=O)C)C	{1: 6, 2: 2, 3: 1, 11: 8, 12: 7, 13: 2, 28: 3}
OK	26160-83-8	C1CC2C3CC(C2C1CO)CC3CO	{20: 2, 2: 2, 11: 4, 12: 6}
OK	26163-36-0	CN1CC=CCN1C	{1: 2, 11: 2, 14: 2, 33: 2}
OK	26163-37-1	CN1CCCCN1C	{1: 2, 11: 4, 33: 2}
OK	26165-45-7	C1CCN(C1)CCC#N	{33: 1, 2: 2, 11: 4, 37: 1}
OK	26166-37-0	CCN1CC2(CCCC34[C@@H]2C[C@@H]([C@H]31)[C@]56[C@H]4[C@H]([C@H](CC5)C(=C)[C@H]6O)O)C	{1: 2, 2: 1, 5: 1, 33: 1, 11: 7, 12: 7, 13: 3, 15: 1, 20: 2}
OK	26171-64-2	CC1CCC(N(N1C)C)C	{1: 4, 11: 2, 12: 2, 33: 2}
OK	2618-47-5	CC(C)C(=O)C=CN1CCOCC1	{1: 2, 3: 1, 6: 2, 33: 1, 11: 4, 23: 1, 24: 1}
OK	26184-88-3	CC1=CCC(CC1)C2(CCC(O2)C(C)(C)O)C	{1: 4, 4: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 1, 20: 1, 23: 1}
OK	26186-00-5	CCCCCCCCCCCCCCCC#C	{1: 1, 2: 14, 10: 1, 9: 1}
OK	26186-02-7	CCCCCCCCCCCC#C	{1: 1, 2: 10, 10: 1, 9: 1}
OK	26189-59-3	CC(=C(N(C)C)Cl)C	{1: 4, 17: 1, 33: 1, 7: 2}
OK	2619-34-3	C1CCC(C1)CC2CCCC2	{2: 1, 11: 8, 12: 2}
OK	26196-04-3	CC1(C(O1)OC)C	{1: 3, 12: 1, 13: 1, 22: 1, 23: 1}
OK	262-38-4	C1N2COOCN2CN3N1COOC3	{33: 4, 11: 6, 23: 4}
OK	2620-27-1	CNCCOCCNC	{1: 2, 2: 4, 22: 1, 31: 2}
OK	2620-63-5	CC(=O)NCC(=O)N	{24: 2, 1: 1, 2: 1, 30: 1, 31: 1}
OK	26215-90-7	CCCCCCCCCC(=O)CCC	{24: 1, 1: 2, 2: 10}
OK	26215-92-9	CCCCCCCCCC(CCC)O	{1: 2, 2: 10, 3: 1, 20: 1}
OK	26227-54-3	C1CCC(CC1)N.Br	{18: 1, 11: 5, 12: 1, 30: 1}
OK	262280-14-8	CC(C)(C)OC(=O)N[C@H]1C[C@H](C[C@@H]1O)C(=O)OC	{1: 4, 4: 1, 11: 2, 12: 3, 20: 1, 28: 2, 31: 1}
OK	2623-22-5	CC1=C[C@@H]2[C@](CC1)(C3([C@@H]([C@H]([C@H](C34CO4)O2)O)O)C)COC(=O)C	{1: 3, 2: 1, 11: 3, 12: 4, 13: 3, 14: 1, 15: 1, 20: 2, 23: 2, 28: 1}
OK	2623-82-7	CCCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 5, 3: 1, 18: 1}
OK	2623-83-8	CCCCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 6, 3: 1, 18: 1}
OK	2623-84-9	CCCCCCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 8, 3: 1, 18: 1}
OK	2623-86-1	CC(CC(=O)O)Br	{27: 1, 1: 1, 2: 1, 3: 1, 18: 1}
OK	2623-87-2	C(CC(=O)O)CBr	{2: 3, 27: 1, 18: 1}
OK	2623-91-8	CC[C@H](C(=O)O)N	{27: 1, 1: 1, 2: 1, 3: 1, 30: 1}
OK	2623-95-2	CCCCCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 7, 3: 1, 18: 1}
OK	26232-98-4	CC=CC(C)(C)C	{1: 4, 4: 1, 6: 2}
OK	26239-55-4	C(C(=O)N)N(CC(=O)O)CC(=O)O	{24: 1, 33: 1, 2: 3, 27: 2, 30: 1}
OK	2624-01-3	CCCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 4, 3: 1, 18: 1}
OK	26245-56-7	CC(C)NCl	{31: 1, 1: 2, 3: 1, 17: 1}
OK	2625-30-1	C1CCC(CC1)C[N+](=O)[O-]	{2: 1, 11: 5, 12: 1, 38: 1}
OK	2625-35-6	CC(C)C(C)[N+](=O)[O-]	{1: 3, 3: 2, 38: 1}
OK	26254-92-2	CCC(C=O)C(C)C	{1: 3, 2: 1, 3: 2, 26: 1}
OK	26256-87-1	COCCOCCOCCOC=C	{1: 1, 2: 6, 22: 4, 5: 1, 6: 1}
OK	26266-68-2	CCC/C=C(/CC)\C=O	{1: 2, 2: 3, 26: 1, 6: 1, 7: 1}
OK	26272-76-4	CCCCCCCCCCCCCCCCCC1=NCCN1CCNC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 35: 1, 33: 1, 11: 2, 15: 1, 24: 1, 31: 1}
OK	26272-90-2	CCCCCCCCCCCCCCCCOC(=O)Cl	{1: 1, 2: 15, 28: 1, 17: 1}
OK	2628-57-1	CC1CC1C=C	{1: 1, 11: 1, 12: 2, 5: 1, 6: 1}
OK	26288-16-4	CCCCCCCCCC(F)(F)F	{16: 3, 1: 1, 2: 8, 4: 1}
OK	26301-79-1	C(C(C1C(C(C(=O)O1)O)O)O)O	{20: 4, 2: 1, 3: 1, 12: 3, 28: 1}
OK	26305-03-3	CC(C)CC(C(CC(=O)O)O)NC(=O)C(C)NC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)O	{1: 11, 2: 5, 3: 12, 20: 2, 24: 5, 27: 1, 31: 5}
OK	26307-01-7	C1CCC(CC1)N(Cl)Cl	{17: 2, 11: 5, 12: 1, 33: 1}
OK	26311-17-1	CCOCCN(C)C	{1: 3, 2: 3, 22: 1, 33: 1}
OK	26327-56-0	CC12CCC(C1)CC2(OC)OC	{1: 3, 11: 4, 12: 1, 13: 2, 22: 2}
OK	2633-95-6	CC(=CCC(CC=C)C(=O)C)C	{1: 3, 2: 2, 3: 1, 5: 1, 6: 2, 7: 1, 24: 1}
OK	26330-51-8	CC(C)C(C(=O)OC)Br	{1: 3, 18: 1, 3: 2, 28: 1}
OK	26330-64-3	CCC(=CCC(C)CCO)CC	{1: 3, 2: 5, 3: 1, 6: 1, 7: 1, 20: 1}
OK	26330-65-4	CCC(=CC)CCC(C)CCO	{1: 3, 2: 5, 3: 1, 6: 1, 7: 1, 20: 1}
OK	26340-89-6	COC(=O)[C@H](CCCN=C(N)N)N.Cl.Cl	{1: 1, 2: 3, 3: 1, 7: 1, 34: 1, 17: 2, 28: 1, 30: 3}
OK	26351-32-6	CCCCCCCCC=CCCCCCCCCNCCC#N	{1: 1, 2: 17, 37: 1, 6: 2, 31: 1}
OK	26355-01-1	CC(=C)C(=O)OC.CC(=C)C(=O)OCCO	{1: 3, 2: 2, 5: 2, 7: 2, 20: 1, 28: 2}
OK	26356-06-9	CC(C(C)(C)C)Br	{1: 4, 18: 1, 3: 1, 4: 1}
OK	26356-10-5	CC(C)C(C)(C)OC	{1: 5, 3: 1, 4: 1, 22: 1}
OK	26370-28-5	CCC=CCCC=CC=O	{1: 1, 2: 3, 26: 1, 6: 4}
OK	26371-07-3	C1CCN(CC1)CCC(=O)O	{27: 1, 33: 1, 2: 2, 11: 5}
OK	2638-94-0	CC(CCC(=O)O)(C#N)N=NC(C)(CCC(=O)O)C#N	{1: 2, 2: 4, 4: 2, 37: 2, 34: 2, 27: 2}
OK	26385-71-7	CC(=O)CC#C	{24: 1, 1: 1, 2: 1, 10: 1, 9: 1}
OK	26385-95-5	CC1=C(C1(C)C)C	{1: 4, 13: 1, 15: 2}
OK	26389-59-3	CCCNC(=O)C1CC1	{1: 1, 2: 2, 11: 2, 12: 1, 24: 1, 31: 1}
OK	26389-60-6	CCCNCC1CC1	{1: 1, 2: 3, 11: 2, 12: 1, 31: 1}
OK	26389-62-8	CC(C)NC(=O)C1CC1	{1: 2, 3: 1, 11: 2, 12: 1, 24: 1, 31: 1}
OK	2639-63-6	CCCCCCOC(=O)CCC	{1: 2, 2: 7, 28: 1}
OK	2639-64-7	CCCCCCCCCOC(=O)CCC	{1: 2, 2: 10, 28: 1}
OK	2639-68-1	CC(C)C(=O)OC(C)(CCC=C(C)CCC=C(C)C)C=C	{1: 6, 2: 4, 3: 1, 4: 1, 5: 1, 6: 3, 7: 2, 28: 1}
OK	26391-16-2	CC(=CBr)Br	{1: 1, 18: 2, 6: 1, 7: 1}
OK	26392-49-4	CCCCC(CC)CN.Cl	{1: 2, 2: 5, 3: 1, 30: 1, 17: 1}
OK	26393-26-0	C1(=C(SC(=C2SC(=C(S2)C(F)(F)F)C(F)(F)F)S1)C(F)(F)F)C(F)(F)F	{16: 12, 41: 4, 4: 4, 15: 6}
OK	26395-29-9	C(#CI)Br	{10: 2, 19: 1, 18: 1}
OK	26399-02-0	CCCCCCCCC=CCCCCCCCC(=O)OCC(CC)CCCC	{1: 3, 2: 19, 3: 1, 28: 1, 6: 2}
OK	2640-94-0	COC(=O)CCCCCCCCCO	{1: 1, 2: 9, 20: 1, 28: 1}
OK	26401-35-4	CC(C)CCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCCC(C)C	{1: 4, 2: 24, 3: 2, 28: 2}
OK	26401-41-2	CC(C)CCCCCCCOC(=O)C1CC2C(O2)CC1C(=O)OCCCCCCCC(C)C	{1: 4, 2: 14, 3: 2, 11: 2, 12: 4, 23: 1, 28: 2}
OK	26402-22-2	CCCCCCCCCC(=O)OCC(CO)O	{1: 1, 2: 10, 3: 1, 20: 2, 28: 1}
OK	26402-26-6	CCCCCCCC(=O)OCC(CO)O	{1: 1, 2: 8, 3: 1, 20: 2, 28: 1}
OK	2641-34-1	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)F	{16: 18, 24: 1, 4: 8, 22: 2}
OK	26419-72-7	CC1(SCCCS1)C=NOC(=O)NC	{1: 2, 34: 1, 6: 1, 41: 2, 11: 3, 13: 1, 28: 1, 31: 1}
OK	26419-73-8	CC1CSC(S1)(C)/C=N/OC(=O)NC	{1: 3, 34: 1, 6: 1, 41: 2, 11: 1, 12: 1, 13: 1, 28: 1, 31: 1}
OK	26423-60-9	CCC(=CC)Cl	{1: 2, 2: 1, 17: 1, 6: 1, 7: 1}
OK	26425-79-6	C(=C(F)F)(OC(F)(F)F)F.C(=C(F)F)(F)F	{16: 10, 4: 1, 22: 1, 7: 4}
OK	26429-11-8	CCCCCCCCCCCCCC(C)CCC	{1: 3, 2: 14, 3: 1}
OK	2644-70-4	NN.Cl	{17: 1, 30: 2}
OK	26446-35-5	CC(=O)OCC(CO)O	{1: 1, 2: 2, 3: 1, 20: 2, 28: 1}
OK	26447-22-3	C1CCC(CC1)C2(CCCCC2)C3CCCC3	{11: 14, 12: 2, 13: 1}
OK	26448-91-9	CCOCCCC(=O)OCC	{1: 2, 2: 5, 28: 1, 22: 1}
OK	26456-63-3	C=CC(C=C)C=C	{3: 1, 5: 3, 6: 3}
OK	26456-76-8	CC=C(C)CC(C)(C)C	{1: 5, 2: 1, 4: 1, 6: 1, 7: 1}
OK	26457-81-8	C#CCN(CC#C)N=O	{33: 1, 34: 1, 9: 2, 10: 2, 2: 2, 29: 1}
OK	26458-74-2	C1CN2CCC1(CC2)O	{33: 1, 11: 6, 20: 1, 13: 1}
OK	26458-76-4	CC(=O)OC12CCN(CC1)CC2	{1: 1, 11: 6, 28: 1, 13: 1, 33: 1}
OK	26458-78-6	C1CN2CCC1(CC2)C#N	{33: 1, 11: 6, 13: 1, 37: 1}
OK	26459-83-6	CC(CN(CCC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 4: 2, 38: 5, 33: 1, 16: 1}
OK	26459-85-8	CCOC(C)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 4: 1, 38: 3, 22: 1}
OK	26460-67-3	CC(=C)[C@H]1CCC(=CC1)C(=O)OC	{1: 2, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 28: 1}
OK	26460-76-4	CC12CC3CC4C1CC5CC4C(C3)C2C5	{1: 1, 11: 6, 12: 7, 13: 1}
OK	26464-32-4	CCC(C(=O)OC)Cl	{1: 2, 2: 1, 3: 1, 28: 1, 17: 1}
OK	26469-34-1	CCCCOC(=O)C=CC(=O)OCCO	{1: 1, 2: 5, 20: 1, 6: 2, 28: 2}
OK	26472-00-4	CC1C=C2C3C=CC(C3)C2C1C	{1: 2, 11: 1, 12: 5, 14: 3, 15: 1}
OK	26472-41-3	CC(C)CC(=O)C1=C(C(=C([C@](C1=O)(CC=C(C)C)O)O)CC=C(C)C)O	{1: 6, 2: 3, 3: 1, 6: 2, 7: 2, 13: 1, 15: 4, 20: 3, 24: 1, 25: 1}
OK	2648-69-3	CC(=O)C(C)(Br)Br	{24: 1, 1: 2, 18: 2, 4: 1}
OK	2648-71-7	CC(=O)C(C)(C)Br	{24: 1, 1: 3, 18: 1, 4: 1}
OK	26494-10-0	CC1C(=O)C(=C(S1)C)O	{1: 2, 41: 1, 12: 1, 15: 2, 20: 1, 25: 1}
OK	26496-20-8	CCCCCCCCCCC(=O)CCC	{24: 1, 1: 2, 2: 11}
OK	2650-40-0	CC1(CC(CC(C1)(C)C)O)C	{1: 4, 11: 3, 12: 1, 13: 2, 20: 1}
OK	26519-91-5	CC1=CC=CC1	{1: 1, 11: 1, 14: 3, 15: 1}
OK	26523-63-7	C(CC(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{17: 6, 2: 2, 4: 2}
OK	26530-20-1	CCCCCCCCN1C(=O)C=CS1	{1: 1, 2: 7, 33: 1, 41: 1, 14: 2, 25: 1}
OK	26531-85-1	C1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H](C(O2)O)O)O)O)O)O)O	{2: 1, 11: 1, 12: 9, 20: 7, 22: 1, 23: 2}
OK	26532-22-9	CC(=C)C1CCC1(C)CCO	{1: 2, 2: 2, 5: 1, 7: 1, 11: 2, 12: 1, 13: 1, 20: 1}
OK	26532-24-1	CC1(CCCC(=CC=O)C1)C	{1: 2, 6: 1, 11: 4, 13: 1, 15: 1, 26: 1}
OK	26533-31-3	CCCCCC(CC(C)C)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	26533-33-5	CCCCCCC(C(C)C)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	26533-34-6	CCCCCC(C(C)C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	26533-35-7	CCCCC(C(C)CC)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	26533-36-8	CCCCCCCCCCCCCCCCCC(C)O	{1: 2, 2: 16, 3: 1, 20: 1}
OK	26535-68-2	CCCCCCC(C)NCCO	{1: 2, 2: 7, 3: 1, 20: 1, 31: 1}
OK	26536-86-7	CCN(CC)CCOC(=O)C=C.Cl	{1: 2, 2: 4, 5: 1, 6: 1, 33: 1, 17: 1, 28: 1}
OK	26541-51-5	C1CSCCN1N=O	{33: 1, 34: 1, 11: 4, 29: 1, 41: 1}
OK	26543-09-9	C[C@@H]1C(=O)O[C@@]([C@]1(C)O)(C)C(=O)O	{1: 3, 12: 1, 13: 2, 20: 1, 27: 1, 28: 1}
OK	26547-09-1	C(CCC(CCCCCN)N)CCN	{2: 10, 3: 1, 30: 3}
OK	26549-21-3	CN(C)CC(C(CN(C)C)OC)OC	{1: 6, 2: 2, 3: 2, 22: 2, 33: 2}
OK	26549-22-4	CN(C)C[C@H]([C@@H](CN(C)C)OC)OC	{1: 6, 2: 2, 3: 2, 22: 2, 33: 2}
OK	26549-24-6	CCCC[C@@H](C)O	{1: 2, 2: 3, 3: 1, 20: 1}
OK	26549-25-7	CCCC[C@H](CC)O	{1: 2, 2: 4, 3: 1, 20: 1}
OK	26549-65-5	CN(C)C(=O)C(C(C(=O)N(C)C)O)O	{24: 2, 1: 4, 3: 2, 20: 2, 33: 2}
OK	26550-55-0	C[C@@H](COC)O	{1: 2, 2: 1, 3: 1, 20: 1, 22: 1}
OK	26555-40-8	COC(=O)SCl	{40: 1, 1: 1, 28: 1, 17: 1}
OK	26555-56-6	C1CC(C=C1)C#N	{11: 2, 12: 1, 37: 1, 14: 2}
OK	26556-03-6	C(=CCl)C(Cl)Cl	{17: 3, 3: 1, 6: 2}
OK	2656-72-6	CCCCCCCNN	{1: 1, 2: 6, 30: 1, 31: 1}
OK	26560-14-5	CC(=CCC/C(=C/C/C=C(/C)\C=C)/C)C	{1: 4, 2: 3, 5: 1, 6: 4, 7: 3}
OK	26560-94-1	C(COC(=O)C=CC(=O)O)O	{28: 1, 2: 2, 27: 1, 20: 1, 6: 2}
OK	26563-72-4	CC1COC(O1)C(C)(C)C	{1: 4, 11: 1, 4: 1, 12: 2, 23: 2}
OK	26563-78-0	CC1COC(O1)CBr	{1: 1, 2: 1, 11: 1, 12: 2, 18: 1, 23: 2}
OK	26563-82-6	CC1OCC(O1)C(C)(C)C	{1: 4, 11: 1, 4: 1, 12: 2, 23: 2}
OK	26563-86-0	CC(C)(C)C1COC(O1)C(C)(C)C	{1: 6, 11: 1, 4: 2, 12: 2, 23: 2}
OK	26578-81-4	CC(=C(C)OC)C	{1: 4, 22: 1, 7: 2}
OK	2658-24-4	CC1(CN1)C	{32: 1, 1: 2, 11: 1, 13: 1}
OK	26588-90-9	CC(=C)C.C=CC=C	{1: 2, 5: 3, 6: 2, 7: 1}
OK	26604-66-0	CC1CCC2C3CCCC3(CCC2C1(C)CCC(=O)O)C	{1: 3, 2: 2, 11: 7, 12: 4, 13: 2, 27: 1}
OK	26608-58-2	C1CN2CCC1(CC2)CO	{33: 1, 2: 1, 11: 6, 20: 1, 13: 1}
OK	26616-34-2	C1CC2CC1C3C2C4(C(C3)O4)O	{20: 1, 11: 4, 12: 5, 13: 1, 23: 1}
OK	26619-69-2	CC1(CCC2C3(C14CCC(C4)C3(C)C)O2)C	{1: 4, 11: 5, 12: 2, 13: 4, 23: 1}
OK	26620-22-4	CC(=O)O[C@@H]1CCC[C@H]1OC(=O)C	{1: 2, 11: 3, 12: 2, 28: 2}
OK	26629-33-4	CC(C(=O)OC)NC(=O)C	{24: 1, 1: 3, 3: 1, 28: 1, 31: 1}
OK	26637-71-8	C1CC2CCC1C2(Br)Br	{18: 2, 11: 4, 12: 2, 13: 1}
OK	2664-42-8	CCCCCCCC/C=C\CCCCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 14, 6: 2, 33: 1}
OK	2664-55-3	CCCCCCCCCOC(=O)C=C	{1: 1, 2: 8, 28: 1, 5: 1, 6: 1}
OK	2664-61-1	C(CN(CCC(=O)N)CCC(=O)N)C(=O)N	{24: 3, 33: 1, 2: 6, 30: 3}
OK	26644-46-2	C1CN(CCN1C(C(Cl)(Cl)Cl)NC=O)C(C(Cl)(Cl)Cl)NC=O	{33: 2, 3: 2, 4: 2, 11: 4, 17: 6, 26: 2, 31: 2}
OK	26650-09-9	C(CSC#N)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 40: 1, 2: 2, 4: 6, 37: 1}
OK	26650-10-2	C(CSC#N)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 17, 40: 1, 2: 2, 4: 8, 37: 1}
OK	26651-96-7	CCC(=O)C=CC=C(C)CCC=C(C)C	{24: 1, 1: 4, 2: 3, 6: 4, 7: 2}
OK	26654-39-7	CC1(COC(=O)N1)C	{32: 1, 1: 2, 11: 1, 28: 1, 13: 1}
OK	26655-25-4	CC(=C)C(=O)OCCN(C)C.C=CC(=O)O	{1: 3, 2: 2, 5: 2, 6: 1, 7: 1, 33: 1, 27: 1, 28: 1}
OK	26655-40-3	CC(C)CCCCCOC(=O)CCSCCC(=O)OCCCCCC(C)C	{40: 1, 1: 4, 2: 14, 3: 2, 28: 2}
OK	26675-46-7	C(C(F)(F)F)(OC(F)F)Cl	{16: 5, 17: 1, 3: 2, 4: 1, 22: 1}
OK	26685-83-6	C1CC[C@H]([C@@H](C1)C(=O)O)N	{27: 1, 11: 4, 12: 2, 30: 1}
OK	26690-80-2	CC(C)(C)OC(=O)NCCO	{1: 3, 2: 2, 4: 1, 20: 1, 28: 1, 31: 1}
OK	26692-50-2	CC(C=O)C#N	{1: 1, 26: 1, 3: 1, 37: 1}
OK	26698-66-8	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)OC(=O)C45CC6CC(C4)CC(C6)C5)CCC7=C/C(=N/O)/CC[C@H]37	{1: 1, 34: 1, 9: 1, 10: 1, 11: 14, 12: 7, 13: 3, 14: 1, 15: 2, 20: 1, 28: 1}
OK	2670-13-5	[CH](F)F	{16: 2, 6: 1}
OK	2671-68-3	C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2([C@@]1(CCC3=C2CCC4[C@@]3(CC[C@@H](C4(C)C)OC(=O)C)C)C)C	{1: 9, 2: 2, 3: 1, 6: 1, 7: 1, 11: 8, 12: 3, 13: 4, 15: 2, 28: 1}
OK	26717-67-9	CCC(C(=O)OC)C(=O)OC	{1: 3, 2: 1, 3: 1, 28: 2}
OK	26718-91-2	CCCCCCCCCCCCCCCCCCCC(=O)OCCCC	{1: 2, 2: 21, 28: 1}
OK	26718-96-7	CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCC	{1: 2, 2: 23, 28: 1}
OK	26719-40-4	CCCCCCCCCCCCCOC(=O)CCCCCCCC(=O)OCCCCCCCCCCCCC	{1: 2, 2: 31, 28: 2}
OK	26719-47-1	CCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCCCC	{1: 2, 2: 34, 28: 2}
OK	26719-48-2	CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCCCCCC	{1: 2, 2: 38, 28: 2}
OK	26719-58-4	CCCCCCCCCCCCCC(=O)OCCCCOC(=O)CCCCCCCCCCCCC	{1: 2, 2: 28, 28: 2}
OK	26719-99-3	CCCCCCCCCCCCOC(=O)CCCCCCCC(=O)OCCCCCCCCCCCC	{1: 2, 2: 29, 28: 2}
OK	2672-01-7	CCCC[CH2]	{1: 1, 2: 3, 5: 1}
OK	2672-88-0	C(CN)C(=O)NCC(=O)O	{24: 1, 2: 3, 27: 1, 30: 1, 31: 1}
OK	26720-12-7	CCCCCCCCCCCCCCCCCCOC(=O)CCC(=O)OCCCCCCCCCCCCCCCCCC	{1: 2, 2: 36, 28: 2}
OK	26720-19-4	CCCCCCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCCCCCC	{1: 2, 2: 30, 28: 2}
OK	26720-20-7	CCCCCCCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCCCCCCC	{1: 2, 2: 32, 28: 2}
OK	2673-15-6	CC(C)(C(C(C(C(F)F)(F)F)(F)F)(F)F)O	{16: 8, 1: 2, 3: 1, 4: 4, 20: 1}
OK	26730-12-1	CCCCCCCCCC(C)CCC	{1: 3, 2: 10, 3: 1}
OK	26730-14-3	CCCCCCC(C)CCCCCC	{1: 3, 2: 10, 3: 1}
OK	26730-20-1	CCCCCCCCCC(C)CCCCCC	{1: 3, 2: 13, 3: 1}
OK	26730-92-7	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 38, 28: 2}
OK	26733-24-4	CC(C)C1SCCS1	{11: 2, 1: 2, 3: 1, 12: 1, 41: 2}
OK	26733-25-5	CCC1(SCCS1)CC	{1: 2, 2: 2, 11: 2, 13: 1, 41: 2}
OK	26734-09-8	CC(C)(CN)CO	{1: 2, 2: 2, 4: 1, 30: 1, 20: 1}
OK	26741-24-2	C=CCCCCCC(C)C	{1: 2, 2: 5, 3: 1, 5: 1, 6: 1}
OK	26745-88-0	C(CCCCC(=O)O)CCCC(=O)O.C(CCCO)CCO	{2: 14, 27: 2, 20: 2}
OK	26748-38-9	CC(C)(C)CCC(=O)OOC(C)(C)C	{1: 6, 2: 2, 4: 2, 22: 1, 28: 1}
OK	2675-88-9	CC(C)C(=O)NC	{24: 1, 1: 3, 3: 1, 31: 1}
OK	26760-99-6	C(CCCC(=O)O)CCCC(=O)O.C(CO)O	{2: 9, 27: 2, 20: 2}
OK	26761-50-2	CCCCCCCCC=CCCCCCCCC(=O)OCCCCCC(C)C	{1: 3, 2: 19, 3: 1, 28: 1, 6: 2}
OK	2677-33-0	C(CC=C(Cl)Cl)CCl	{17: 3, 2: 3, 6: 1, 7: 1}
OK	26774-88-9	C1C=CCC(=C1)[C@H](C(=O)O)N	{3: 1, 11: 2, 14: 3, 15: 1, 27: 1, 30: 1}
OK	2678-54-8	CCOC(=C)OCC	{1: 2, 2: 2, 5: 1, 22: 2, 7: 1}
OK	26782-75-2	CC(C)[C@@H](C(=O)O)Br	{27: 1, 1: 2, 18: 1, 3: 2}
OK	2679-13-2	CN1CCC1=O	{1: 1, 11: 2, 33: 1, 25: 1}
OK	2679-29-0	CCCCC[CH2]	{1: 1, 2: 4, 5: 1}
OK	2679-87-0	CCC(C)OCC	{1: 3, 2: 2, 3: 1, 22: 1}
OK	2680-03-7	CN(C)C(=O)C=C	{24: 1, 1: 2, 5: 1, 6: 1, 33: 1}
OK	26817-65-2	CCCCCC#CCCCCl	{1: 1, 2: 7, 10: 2, 17: 1}
OK	2682-20-4	CN1C(=O)C=CS1	{1: 1, 41: 1, 33: 1, 14: 2, 25: 1}
OK	2682-49-7	C1CSC(=O)N1	{32: 1, 25: 1, 11: 2, 41: 1}
OK	26825-18-3	CC1(CSCC(C#C1)(C)C)C	{1: 4, 10: 2, 11: 2, 13: 2, 41: 1}
OK	26825-94-5	COC(=O)CCCCCCCCCBr	{1: 1, 2: 9, 28: 1, 18: 1}
OK	26826-40-4	CC(C#C)OC(C)(C)C	{1: 4, 3: 1, 4: 1, 9: 1, 10: 1, 22: 1}
OK	26828-48-8	CC1(C(=O)CCC1=O)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 11: 2, 13: 1, 25: 2}
OK	2683-57-0	CCN(CC)CCCCCO	{1: 2, 2: 7, 20: 1, 33: 1}
OK	26842-43-3	CC(C)CC(C)(C#N)N	{1: 3, 2: 1, 3: 1, 4: 1, 37: 1, 30: 1}
OK	26842-75-1	CCOC=C=C=C	{1: 1, 2: 1, 5: 1, 6: 1, 8: 2, 22: 1}
OK	26850-24-8	CC1(C(=O)N(C(=O)N1CCO)CCO)C	{1: 2, 2: 4, 33: 2, 13: 1, 20: 2, 25: 2}
OK	26851-79-6	CC(C)CC1=NCCS1	{1: 2, 2: 1, 3: 1, 41: 1, 11: 2, 15: 1, 35: 1}
OK	26856-69-9	CC(C#N)OC	{1: 2, 3: 1, 37: 1, 22: 1}
OK	2687-91-4	CCN1CCCC1=O	{1: 1, 2: 1, 11: 3, 33: 1, 25: 1}
OK	2687-94-7	CCCCCCCCN1CCCC1=O	{1: 1, 2: 7, 11: 3, 33: 1, 25: 1}
OK	2687-96-9	CCCCCCCCCCCCN1CCCC1=O	{1: 1, 2: 11, 11: 3, 33: 1, 25: 1}
OK	2689-68-1	COC(=O)C1CSCC1=O	{1: 1, 41: 1, 11: 2, 12: 1, 25: 1, 28: 1}
OK	2689-88-5	CCOC(=O)C(CC#C)(CC#C)C(=O)OCC	{1: 2, 2: 4, 4: 1, 9: 2, 10: 2, 28: 2}
OK	26896-18-4	CC(C)CCCCCC(=O)O	{27: 1, 1: 2, 2: 5, 3: 1}
OK	26896-20-8	CC(C)(C)CCCCCC(=O)O	{1: 3, 2: 5, 27: 1, 4: 1}
OK	2690-08-6	CCCCCCCCSCCCCCCCC	{40: 1, 1: 2, 2: 14}
OK	2690-15-5	C1CCC(CC1)C2CCC=C2	{11: 7, 12: 2, 14: 2}
OK	2690-17-7	C1CCC(C1)C2CCC=C2	{11: 6, 12: 2, 14: 2}
OK	26901-97-3	CCCCCCCSCCO	{40: 1, 1: 1, 2: 8, 20: 1}
OK	26902-55-6	C1CC1C(C2CC2)(C3CC3)C(C4CC4)(C5CC5)C6CC6	{12: 6, 11: 12, 4: 2}
OK	26906-26-3	CCCC#CCCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 10: 2}
OK	26909-37-5	CC1=C(C(=O)C2=C(C1=O)N3C[C@@H]4[C@H]([C@]3([C@@H]2CO)OC)N4)N	{32: 1, 1: 2, 2: 1, 33: 1, 11: 1, 12: 3, 13: 1, 15: 4, 20: 1, 22: 1, 25: 2, 30: 1}
OK	2691-41-0	C1N(CN(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 4, 11: 4, 38: 4}
OK	26914-40-9	CC(S)S	{1: 1, 3: 1, 39: 2}
OK	26921-68-6	CN(CCO)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 20: 1, 29: 1}
OK	26934-29-2	CC1=[N+](CCS1)C.[I-]	{1: 2, 33: 1, 41: 1, 11: 2, 15: 1, 19: 1}
OK	26934-61-2	C1=CC2C3C4C1C5C2C5C43	{12: 8, 14: 2}
OK	26934-87-2	CC1=C[C@H]2[C@@](C[C@H]1OC(=O)CC(C)C)([C@@]3([C@@H]([C@H]([C@@H]([C@]34CO4)O2)O)O)C)COC(=O)C	{1: 5, 2: 2, 3: 1, 11: 2, 12: 5, 13: 3, 14: 1, 15: 1, 20: 2, 23: 2, 28: 2}
OK	26939-18-4	CC1CC(N=C(O1)C)(C)C	{1: 4, 35: 1, 11: 1, 12: 1, 13: 1, 15: 1, 23: 1}
OK	26942-95-0	CC(C)CCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCC(C)C	{1: 6, 2: 44, 3: 4, 28: 3}
OK	26946-68-9	CC(=C)C1CCC(CC1)(C)OC	{1: 3, 5: 1, 7: 1, 11: 4, 12: 1, 13: 1, 22: 1}
OK	2695-47-8	C=CCCCCBr	{2: 4, 18: 1, 5: 1, 6: 1}
OK	2695-48-9	C=CCCCCCCBr	{2: 6, 18: 1, 5: 1, 6: 1}
OK	26952-13-6	CCCCCCCCCCCC=CC	{1: 2, 2: 10, 6: 2}
OK	2696-30-2	C/C=C/C#CN(C)C	{1: 3, 10: 2, 6: 2, 33: 1}
OK	2696-43-7	CCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 8, 28: 1, 5: 1, 7: 1}
OK	2696-92-6	N(=O)Cl	{17: 1, 34: 1, 29: 1}
OK	26964-53-4	CC1=NN(CC1)CC(C)C	{1: 3, 2: 1, 3: 1, 33: 1, 11: 2, 15: 1, 35: 1}
OK	2697-95-2	CCCC(=O)OOC(=O)CCC	{1: 2, 2: 4, 28: 2}
OK	26981-81-7	CCCCCCCN(CC)CC	{1: 3, 2: 8, 33: 1}
OK	26981-93-1	CN=N	{1: 1, 34: 1, 36: 1}
OK	26981-98-6	CCCC(CCC(C)CC)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	2699-13-0	COC1CCCC=C1	{1: 1, 11: 3, 12: 1, 22: 1, 14: 2}
OK	2700-30-3	CC(C)N(C=O)C(C)C	{1: 4, 26: 1, 3: 2, 33: 1}
OK	27013-91-8	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2O[C@H]3CC[C@]4([C@H]([C@]3(C)CO)CC[C@@]5([C@@H]4CC=C6[C@]5(CC[C@@]7([C@H]6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O)O	{1: 7, 2: 1, 11: 11, 12: 13, 13: 6, 14: 1, 15: 1, 20: 6, 22: 2, 23: 2, 27: 1}
OK	27014-42-2	C(CN(CCOCCO)CCOCCO)N(CCOCCO)CCOCCO	{33: 2, 2: 18, 20: 4, 22: 4}
OK	27025-41-8	C(CC(=O)N[C@@H](CSSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)C(=O)NCC(=O)O)[C@@H](C(=O)O)N	{2: 8, 3: 4, 40: 2, 24: 4, 27: 4, 30: 2, 31: 4}
OK	27029-05-6	CC=C.C(=C(F)F)(F)F	{16: 4, 1: 1, 5: 1, 6: 1, 7: 2}
OK	27041-32-3	C=C=C1C=CC=C1	{8: 1, 5: 1, 14: 4, 15: 1}
OK	27048-01-7	CC1(CC(C(N1[O])(C)C)NC(=O)CI)C	{1: 4, 2: 1, 33: 1, 11: 1, 12: 1, 13: 2, 19: 1, 24: 1, 29: 1, 31: 1}
OK	2705-87-5	C=CCOC(=O)CCC1CCCCC1	{2: 3, 5: 1, 6: 1, 11: 5, 12: 1, 28: 1}
OK	27059-94-5	CC(=O)NI	{24: 1, 1: 1, 19: 1, 31: 1}
OK	2706-90-3	C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)O	{16: 9, 27: 1, 4: 4}
OK	27063-48-5	C1C2CC(C1C=C2)C(=O)Cl	{24: 1, 17: 1, 11: 2, 12: 3, 14: 2}
OK	27070-20-8	C1CCC(CC1)(C2CCOCC2)O	{20: 1, 11: 9, 12: 1, 13: 1, 23: 1}
OK	27070-59-3	C1CCCC=CC=CC=CCC1	{11: 6, 14: 6}
OK	27071-80-3	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC(=O)C)O[C@H]7C[C@@H]([C@@H](C(O7)C)O[C@H]8C[C@@H]([C@@H]([C@H](O8)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 10, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 1, 22: 3, 23: 3, 28: 6}
OK	27072-47-5	CCC(Br)Br	{1: 1, 2: 1, 3: 1, 18: 2}
OK	27076-30-8	C(CNCCO)C(=O)N	{24: 1, 2: 4, 20: 1, 30: 1, 31: 1}
OK	27090-62-6	CCCN(CCC)CCCCCCN(CCC)CCC	{1: 4, 2: 14, 33: 2}
OK	27090-63-7	CCCCN(CCCC)CCCCCCN(CCCC)CCCC	{1: 4, 2: 18, 33: 2}
OK	2710-89-6	CCCCCCCOC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 6, 4: 1, 28: 1}
OK	27120-63-4	C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F	{16: 53, 3: 1, 4: 25, 22: 8}
OK	27132-23-6	CCC(CC)(C(=O)OC)C(=O)OC	{1: 4, 2: 2, 4: 1, 28: 2}
OK	27136-79-4	CC(C)CCCCCCCOC(OCCCCCCCC(C)C)OCCCCCCCC(C)C	{1: 6, 2: 21, 3: 4, 22: 3}
OK	27137-30-0	CC1(CCCCC1)OO	{1: 1, 11: 5, 20: 1, 13: 1, 22: 1}
OK	27144-09-8	CCCCCCC(N(F)F)N(F)F	{16: 4, 1: 1, 2: 5, 3: 1, 33: 2}
OK	27147-71-3	CCCCCCCCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 13, 3: 1}
OK	2716-23-6	C1CC2CCC1CC2=O	{25: 1, 11: 5, 12: 2}
OK	27174-71-6	COC(=O)CC12CC3CC(C1)CC(C3)C2	{1: 1, 2: 1, 11: 6, 12: 3, 13: 1, 28: 1}
OK	27177-85-1	CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)C)O	{1: 2, 2: 18, 3: 1, 20: 1, 28: 2}
OK	27178-16-1	CC(C)CCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC(C)C	{1: 4, 2: 18, 3: 2, 28: 2}
OK	27185-77-9	CC1=C(C(CCC1=O)(C)C)C=CC(=O)C	{1: 4, 6: 2, 11: 2, 13: 1, 15: 2, 24: 1, 25: 1}
OK	2719-27-9	C1CCC(CC1)C(=O)Cl	{24: 1, 17: 1, 11: 5, 12: 1}
OK	27193-30-2	CC(C)(C)C1CCCC2C1CCCC2	{1: 3, 11: 7, 4: 1, 12: 3}
OK	27197-30-4	C1C2C1C3C4CC4C2C5C3C5	{11: 3, 12: 8}
OK	27205-24-9	CCSC(C)CC=O	{40: 1, 1: 2, 2: 2, 3: 1, 26: 1}
OK	2721-22-4	CCCCCCCCCC1CCCC(=O)O1	{1: 1, 2: 8, 11: 3, 12: 1, 28: 1}
OK	2721-31-5	CC1(CC(N=N1)(C)C)C	{1: 4, 11: 1, 13: 2, 35: 2}
OK	2721-32-6	C1CC2CC1N=N2	{35: 2, 11: 3, 12: 2}
OK	2721-38-2	CCC1(CCCC1)CC	{1: 2, 2: 2, 11: 4, 13: 1}
OK	27213-61-2	C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 15, 3: 1, 4: 6}
OK	27215-25-4	CC(C)CCCCCOCCCNCCCN	{1: 2, 2: 11, 3: 1, 22: 1, 30: 1, 31: 1}
OK	27216-48-4	CCCCOC(=O)CC(=C)C(=O)O	{1: 1, 2: 4, 5: 1, 7: 1, 27: 1, 28: 1}
OK	27218-16-2	O=Cl(=O)(=O)OCl	{17: 2, 29: 3, 22: 1}
OK	27219-07-4	CC(C)(C)OC(=O)NCCCCC(=O)O	{1: 3, 2: 4, 4: 1, 27: 1, 28: 1, 31: 1}
OK	27237-73-6	CC(=C1C2C=CC1C3C2C=C3)C	{1: 2, 15: 1, 12: 4, 14: 4, 7: 1}
OK	2724-56-3	CC(C)CCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 8, 3: 1}
OK	2724-57-4	CC(C)CCCCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 10, 3: 1}
OK	2724-58-5	CC(C)CCCCCCCCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 14, 3: 1}
OK	2724-59-6	CC(C)CCCCCCCCCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 15, 3: 1}
OK	2730-67-8	CNCC(F)(F)F	{16: 3, 1: 1, 2: 1, 4: 1, 31: 1}
OK	27300-27-2	CC(=O)C1=NCCCC1	{24: 1, 1: 1, 11: 4, 35: 1, 15: 1}
OK	27301-54-8	CC#CC(C)O	{1: 2, 10: 2, 3: 1, 20: 1}
OK	27304-13-8	C12C(C(C3(C1O3)Cl)Cl)C4(C(=C(C2(C4(Cl)Cl)Cl)Cl)Cl)Cl	{17: 8, 23: 1, 12: 4, 13: 4, 15: 2}
OK	2731-73-9	C([C@@H](C(=O)O)N)Cl	{27: 1, 17: 1, 2: 1, 3: 1, 30: 1}
OK	27310-21-0	C/C=C/C=C/COCCO	{1: 1, 2: 3, 20: 1, 22: 1, 6: 4}
OK	27317-59-5	CCOC(=N)CC(=O)OCC	{1: 2, 2: 3, 36: 1, 7: 1, 22: 1, 28: 1}
OK	2733-88-2	CCCCCCCCC=CCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 20, 28: 1, 6: 2}
OK	27336-61-4	CC1(CC(=CC(=O)C1)NC(C)(C)C)C	{1: 5, 4: 1, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1, 31: 1}
OK	2736-37-0	CC(C)C(=O)Br	{24: 1, 1: 2, 18: 1, 3: 1}
OK	2736-40-5	CCC(CC)C(=O)Cl	{24: 1, 1: 2, 2: 2, 3: 1, 17: 1}
OK	2736-73-4	C(/C(=C/Cl)/Cl)O	{17: 2, 2: 1, 20: 1, 6: 1, 7: 1}
OK	2736-80-3	C(C(CO)([N+](=O)[O-])[N+](=O)[O-])O	{20: 2, 2: 2, 4: 1, 38: 2}
OK	27361-14-4	CCCCN1C=CC=CC1=O	{1: 1, 2: 3, 33: 1, 14: 4, 25: 1}
OK	27372-42-5	CCCCCCCCCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 16}
OK	2738-06-9	CCNC(C)C(C)C	{1: 4, 2: 1, 3: 2, 31: 1}
OK	2738-18-3	CC(C)CC=CC(C)C	{1: 4, 2: 1, 3: 2, 6: 2}
OK	2738-19-4	CCCC=C(C)C	{1: 3, 2: 2, 6: 1, 7: 1}
OK	27387-79-7	CCCCOC(=O)CCCl	{1: 1, 2: 5, 28: 1, 17: 1}
OK	27400-79-9	CCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 18, 5: 1, 6: 1}
OK	27417-37-4	CC(=O)C=CC1C(=C)CCCC1(C)C	{1: 3, 5: 1, 6: 2, 11: 3, 12: 1, 13: 1, 15: 1, 24: 1}
OK	2743-60-4	CCOC(=O)[C@H](CC(C)C)N	{1: 3, 2: 2, 3: 2, 28: 1, 30: 1}
OK	27447-53-6	CCCCOCCOC(=O)CS	{1: 1, 2: 6, 28: 1, 22: 1, 39: 1}
OK	27451-36-1	C=CC(CC#N)O	{2: 1, 3: 1, 5: 1, 6: 1, 20: 1, 37: 1}
OK	27458-93-1	CC(C)CCCCCCCCCCCCCCCO	{1: 2, 2: 15, 3: 1, 20: 1}
OK	2746-14-7	CC1(CC1)CO	{1: 1, 2: 1, 11: 2, 20: 1, 13: 1}
OK	27476-93-3	CCCCCCCCCCCC=CCCCCC1NC=CN1CCN	{32: 1, 1: 1, 2: 16, 6: 2, 33: 1, 12: 1, 14: 2, 30: 1}
OK	27489-62-9	C1CC(CCC1N)O	{20: 1, 11: 4, 12: 2, 30: 1}
OK	2749-11-3	C[C@@H](CO)N	{1: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	2749-79-3	C=C=CC#CCO	{2: 1, 5: 1, 6: 1, 8: 1, 10: 2, 20: 1}
OK	27493-61-4	C[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)N	{1: 3, 3: 3, 24: 1, 27: 1, 30: 1, 31: 1}
OK	2750-71-2	CCC(=CC#C)CC	{1: 2, 2: 2, 6: 1, 7: 1, 9: 1, 10: 1}
OK	27519-02-4	CCCCCCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 19, 6: 2}
OK	2752-17-2	C(COCCN)N	{2: 4, 30: 2, 22: 1}
OK	2752-99-0	CCCCCCCCC=CCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCCCCCC=CCCCCCCCC	{1: 3, 2: 56, 3: 1, 28: 3, 6: 6}
OK	27522-11-8	CCCC(CC)CO	{1: 2, 2: 4, 3: 1, 20: 1}
OK	2753-03-9	CC(=CCC(CC=C(C)C)C(=O)C)C	{1: 5, 2: 2, 3: 1, 6: 2, 7: 2, 24: 1}
OK	27530-63-8	CC(=O)OCC=C1C2CCC3C2C(CCCC31C)(C)C	{1: 4, 2: 1, 6: 1, 11: 5, 12: 3, 13: 2, 15: 1, 28: 1}
OK	27538-09-6	CCC1=C(C(=O)C(O1)C)O	{1: 2, 2: 1, 12: 1, 15: 2, 20: 1, 23: 1, 25: 1}
OK	27538-10-9	CCC1C(=O)C(=C(O1)C)O	{1: 2, 2: 1, 12: 1, 15: 2, 20: 1, 23: 1, 25: 1}
OK	27538-13-2	C=C1CC=C1	{11: 1, 5: 1, 14: 2, 15: 1}
OK	27538-47-2	CC1(C2CCC1(C(=C)C2)C)C	{1: 3, 5: 1, 11: 3, 12: 1, 13: 2, 15: 1}
OK	2755-07-9	CCCCCCC(CC)(CCC)CCCC	{1: 4, 2: 11, 4: 1}
OK	2756-85-6	C1CCC(CC1)(C(=O)O)N	{27: 1, 11: 5, 13: 1, 30: 1}
OK	27563-67-3	CCCCCCCCCCCC(=O)NC	{24: 1, 1: 2, 2: 10, 31: 1}
OK	27563-68-4	CCCCCCCCCCCCCCCCSC	{40: 1, 1: 2, 2: 15}
OK	27564-01-8	CCCCCCCCCCCCCCCCCC(=O)OCCS	{1: 1, 2: 18, 28: 1, 39: 1}
OK	27567-82-4	C1CC1=C2CC2	{11: 4, 15: 2}
OK	2757-23-5	C(=O)(SCl)Cl	{24: 1, 17: 2, 40: 1}
OK	27574-98-7	CC(C)C(C)C(C)C(C)C(C)C	{1: 7, 3: 5}
OK	27578-60-5	C1CCN(CC1)CCN	{33: 1, 2: 2, 11: 5, 30: 1}
OK	2758-18-1	CC1=CC(=O)CC1	{1: 1, 11: 2, 25: 1, 14: 1, 15: 1}
OK	27583-37-5	CC1CCC(C1O)O	{1: 1, 11: 2, 12: 3, 20: 2}
OK	2761-09-3	CC(=C)C(=O)OCCCO	{1: 1, 2: 3, 5: 1, 7: 1, 20: 1, 28: 1}
OK	27610-92-0	CCCCCCC(CCCC)C(=O)O	{27: 1, 1: 2, 2: 8, 3: 1}
OK	27614-26-2	C1CC2CC1C3C2C(=O)C=C3	{25: 1, 11: 3, 12: 4, 14: 2}
OK	27625-35-0	CCC(C)C(=O)OCCC(C)C	{1: 4, 2: 3, 3: 2, 28: 1}
OK	2763-67-9	CCCCC(=O)NCCCC	{24: 1, 1: 2, 2: 6, 31: 1}
OK	2763-77-1	CC(C)N1C(O1)(C)C	{1: 4, 33: 1, 3: 1, 13: 1, 23: 1}
OK	27637-03-2	C(CCO)CO.C(CO)O	{2: 6, 20: 4}
OK	27639-98-1	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)F	{16: 24, 24: 1, 4: 11, 22: 3}
OK	27644-04-8	CC(=CC(C(C)(C)C=C)O)C	{1: 4, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	27644-49-1	CCCCCC(C)C(C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	2765-04-0	CC1SC(SC(S1)C)C	{1: 3, 12: 3, 41: 3}
OK	2765-11-9	CCCCCCCCCCCCCCC=O	{1: 1, 2: 13, 26: 1}
OK	27656-49-1	C/C(=C\C(C)(C)C)CC(C)(C)C	{1: 7, 2: 1, 4: 2, 6: 1, 7: 1}
OK	27656-50-4	C/C(=C/C(C)(C)C)/CC(C)(C)C	{1: 7, 2: 1, 4: 2, 6: 1, 7: 1}
OK	27659-36-5	C1C=CC=C1C#N	{11: 1, 37: 1, 14: 3, 15: 1}
OK	2767-99-9	C=CCOC(=O)CC(=C)C(=O)OCC=C	{2: 3, 28: 2, 5: 3, 6: 2, 7: 1}
OK	2768-07-2	CC(CCOC(=O)C=C)OC	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 22: 1, 28: 1}
OK	2768-15-2	CCCCC(CCCC)CO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	2768-16-3	CCCCC(C)CCCCO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	2768-18-5	CC(C)(C)CCCCO	{1: 3, 2: 4, 4: 1, 20: 1}
OK	2768-41-4	CC#CCOC	{1: 2, 2: 1, 10: 2, 22: 1}
OK	277-05-4	C1CC2CC2C3C1C3	{11: 4, 12: 4}
OK	277-06-5	C1CC2C(O2)C3C1O3	{11: 2, 12: 4, 23: 2}
OK	277-10-1	C12C3C4C1C5C2C3C45	{12: 8}
OK	277-87-2	C1CC2C1CC3CCC3C2	{11: 6, 12: 4}
OK	27701-90-2	C1CN2CCC1(CC2)I	{19: 1, 33: 1, 11: 6, 13: 1}
OK	27705-21-1	CC(C)(C)C(C)(C)OC	{1: 6, 4: 2, 22: 1}
OK	27714-83-6	C1C=CCC23C1(C2)CC=CC3	{11: 5, 13: 2, 14: 4}
OK	27719-14-8	CC=NC(C)C	{1: 3, 34: 1, 3: 1, 6: 1}
OK	27720-84-9	CC(=C(C1CC1)C2CC2)C	{1: 2, 11: 4, 12: 2, 7: 2}
OK	2773-58-2	COC1=CC(=C)CCC1	{1: 1, 5: 1, 11: 3, 14: 1, 15: 2, 22: 1}
OK	2774-84-7	C#CCCCCCCCCCO	{9: 1, 2: 9, 20: 1, 10: 1}
OK	27745-90-0	C1C2CC3C4CC56CC7CC8C9CC(C2)(C(C14)C85)C3C6C9C7	{11: 8, 12: 12, 13: 2}
OK	27761-61-1	CC12COC(OC1)(OC2)C	{1: 2, 11: 3, 13: 2, 23: 3}
OK	2777-58-4	CCCCCCCCCCC/C=C/CCCCC(=O)OC	{1: 2, 2: 14, 28: 1, 6: 2}
OK	2777-65-3	C#CCCCCCCCCC(=O)O	{9: 1, 2: 8, 27: 1, 10: 1}
OK	2777-66-4	COC(=O)CCCCCCCCC#C	{1: 1, 2: 8, 28: 1, 10: 1, 9: 1}
OK	27775-00-4	CC(C)CCCCCCN	{1: 2, 2: 6, 3: 1, 30: 1}
OK	27776-21-2	CC(C)(C1=NCCN1)N=NC(C)(C)C2=NCCN2.Cl.Cl	{32: 2, 1: 4, 34: 2, 35: 2, 4: 2, 11: 4, 15: 2, 17: 2}
OK	27779-29-9	CC1C2CC(C2(C)C)CC1O	{1: 3, 11: 2, 12: 4, 13: 1, 20: 1}
OK	2778-68-9	C[C@H]1CC[C@@H]2[C@H](C1)C2(C)C	{1: 3, 11: 3, 12: 3, 13: 1}
OK	278-06-8	C1C2C3C2C4C1C34	{11: 1, 12: 6}
OK	278-07-9	C1CC2CCC2C1	{11: 5, 12: 2}
OK	278-30-8	C1CCC2CCC2C1	{11: 6, 12: 2}
OK	278-74-0	C1CC2CC1C3C2O3	{11: 3, 12: 4, 23: 1}
OK	278-80-8	C1CC2CCC1C3C2C3	{11: 5, 12: 4}
OK	27802-85-3	CCC(C)CCC(C)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	27807-62-1	COCCN(CCCl)CCCl.Cl	{1: 1, 2: 6, 33: 1, 22: 1, 17: 3}
OK	27809-79-6	CN1C2CCC1CC(C2)Br	{1: 1, 18: 1, 11: 4, 12: 3, 33: 1}
OK	2781-85-3	C1C=C1	{11: 1, 14: 2}
OK	27813-02-1	CC(COC(=O)C(=C)C)O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 20: 1, 28: 1}
OK	27816-36-0	CC(C(=O)N)Cl	{24: 1, 1: 1, 3: 1, 30: 1, 17: 1}
OK	27817-67-0	CCCSCC=C	{40: 1, 1: 1, 2: 3, 5: 1, 6: 1}
OK	27819-06-3	CCC(=O)O.C=CCCO	{1: 1, 2: 3, 5: 1, 6: 1, 20: 1, 27: 1}
OK	2782-09-4	C([C@@H]1[C@H]([C@@H](C(=O)O1)O)O)O	{20: 3, 2: 1, 12: 3, 28: 1}
OK	2782-57-2	C1(=O)NC(=O)N(C(=O)N1Cl)Cl	{32: 1, 17: 2, 33: 2, 25: 3}
OK	27827-83-4	C(C#N)C(=O)OCC(F)(F)F	{16: 3, 28: 1, 2: 2, 4: 1, 37: 1}
OK	27827-87-8	CC(=O)OC(C)(C#N)C(F)(F)F	{16: 3, 1: 2, 4: 2, 37: 1, 28: 1}
OK	27829-70-5	CCOC(=O)C/C=C/C	{1: 2, 2: 2, 28: 1, 6: 2}
OK	27829-72-7	CCCC=CC(=O)OCC	{1: 2, 2: 3, 28: 1, 6: 2}
OK	2783-10-0	CC(C)C=CC=C	{1: 2, 3: 1, 5: 1, 6: 3}
OK	2783-12-2	CCC(=C)[N+](=O)[O-]	{1: 1, 2: 1, 5: 1, 38: 1, 7: 1}
OK	2783-17-7	C(CCCCCCN)CCCCCN	{2: 12, 30: 2}
OK	27841-06-1	CCCCCCCCCC(=O)OCC(C)(C)COC(=O)CCCCCCCCC	{1: 4, 2: 18, 4: 1, 28: 2}
OK	27846-30-6	C#CCS	{9: 1, 2: 1, 10: 1, 39: 1}
OK	2785-54-8	CCCCCCCCCCCCCC[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 13, 33: 1, 14: 5, 17: 1}
OK	27867-36-3	CC1CC2C(C2(C)C)C3C1O3	{1: 3, 11: 1, 12: 5, 13: 1, 23: 1}
OK	2787-43-1	CC=C(C)C=C	{1: 2, 5: 1, 6: 2, 7: 1}
OK	2787-45-3	C/C=C(/C)\C=C	{1: 2, 5: 1, 6: 2, 7: 1}
OK	27871-49-4	C[C@@H](C(=O)OC)O	{1: 2, 3: 1, 20: 1, 28: 1}
OK	27876-94-4	C/C(=C\C=C\C=C(\C=C\C=C(\C(=O)O)/C)/C)/C=C/C=C(/C(=O)O)\C	{1: 4, 27: 2, 6: 10, 7: 4}
OK	27886-67-5	CC(C)CC1(C(=O)NC(=O)N1)C	{32: 2, 1: 3, 2: 1, 3: 1, 13: 1, 25: 2}
OK	27890-67-1	C=C1C=CC(=O)C=C1	{25: 1, 5: 1, 14: 4, 15: 1}
OK	279-18-5	C1CC2C3C2C1C3	{11: 3, 12: 4}
OK	279-19-6	C1C2CC3C1C3C2	{11: 3, 12: 4}
OK	279-23-2	C1CC2CCC1C2	{11: 5, 12: 2}
OK	279-24-3	C1CC2CC1CN2	{32: 1, 11: 4, 12: 2}
OK	279-35-6	C1CC2CC1OO2	{11: 3, 12: 2, 23: 2}
OK	279-40-3	C1CC2CCC1N2	{32: 1, 11: 4, 12: 2}
OK	279-49-2	C1CC2CCC1O2	{11: 4, 12: 2, 23: 1}
OK	279-59-4	C1CC2CCC1S2	{41: 1, 11: 4, 12: 2}
OK	27902-24-5	CCCCCCC(CC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC(CCCCCC)O)O)O	{1: 2, 2: 28, 3: 3, 6: 4, 20: 3, 28: 2}
OK	27905-45-9	C=CC(=O)OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 8, 5: 1, 6: 1, 16: 17, 28: 1}
OK	2791-29-9	CCCCCCCCCCCCCCCC(OC)OC	{1: 3, 2: 14, 3: 1, 22: 2}
OK	27911-72-4	CCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)CCCCCCCCCCCCCC	{1: 3, 2: 39, 33: 1}
OK	2792-39-4	C/C=C(\C)/CCC=C(C)C	{1: 4, 2: 2, 6: 2, 7: 2}
OK	2792-42-9	CC1(C2CCC1(C(=NO)C2)C)C	{1: 3, 34: 1, 11: 3, 12: 1, 13: 2, 15: 1, 20: 1}
OK	27943-47-1	C1C2CC(=O)C1CC2=O	{25: 2, 11: 3, 12: 2}
OK	27953-64-6	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]4(C(=O)COC(=O)CI)O)C	{1: 2, 2: 2, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 19: 1, 20: 1, 24: 1, 25: 1, 28: 1}
OK	27970-32-7	CN1CCOC1	{1: 1, 11: 3, 33: 1, 23: 1}
OK	2798-73-4	COC=CC#C	{1: 1, 10: 1, 22: 1, 6: 2, 9: 1}
OK	2799-16-8	C[C@H](CN)O	{1: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	2799-17-9	C[C@@H](CN)O	{1: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	2799-21-5	C1CNC[C@@H]1O	{32: 1, 20: 1, 11: 3, 12: 1}
OK	2799-44-2	CC(=C1C(=C(C)C)C1=C(C)C)C	{1: 6, 15: 3, 7: 3}
OK	280-05-7	C1CC2CCC(C1)N2	{32: 1, 11: 5, 12: 2}
OK	280-21-7	C1CC2OC(C1)OO2	{11: 3, 12: 2, 23: 3}
OK	280-28-4	C1CN2CCN(C1)C2	{33: 2, 11: 6}
OK	280-33-1	C1CC2CCC1CC2	{11: 6, 12: 2}
OK	280-38-6	C1CC2CCC1CN2	{32: 1, 11: 5, 12: 2}
OK	280-53-5	C1CC2CCC1OO2	{11: 4, 12: 2, 23: 2}
OK	280-57-9	C1CN2CCN1CC2	{33: 2, 11: 6}
OK	280-65-9	C1CC2CCCC(C1)C2	{11: 7, 12: 2}
OK	2800-87-5	CC1(CSCC(C(=O)C1=O)(C)C)C	{1: 4, 41: 1, 11: 2, 13: 2, 25: 2}
OK	2801-84-5	CCCCCCC(C)CC(C)C	{1: 4, 2: 6, 3: 2}
OK	2801-86-7	CCCCCCC(C)C(C)CCCCCC	{1: 4, 2: 10, 3: 2}
OK	2801-87-8	CCCCCCCCCCCC(C)CCC	{1: 3, 2: 12, 3: 1}
OK	2802-06-4	C(C(=O)O)NCC(=O)O.Cl	{17: 1, 2: 2, 27: 2, 31: 1}
OK	2802-08-6	CC(=O)/C=C/N(C)C	{24: 1, 1: 3, 6: 2, 33: 1}
OK	28022-11-9	CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)O)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O[C@H]4C[C@H]([C@H]([C@@H](O4)C)O)N(C)C)C)C)O)(C)O	{1: 15, 2: 1, 33: 2, 11: 4, 12: 19, 13: 3, 20: 6, 22: 3, 23: 3, 25: 1, 28: 1}
OK	28037-21-0	C1CCC2(CC1)N=NC3(S2)CCCCC3	{35: 2, 11: 10, 13: 2, 41: 1}
OK	2804-50-4	C(=C(F)F)(C(F)(F)F)Cl	{16: 5, 17: 1, 4: 1, 7: 2}
OK	2805-22-3	C#CCF	{16: 1, 9: 1, 2: 1, 10: 1}
OK	28051-67-4	C=CC=NO	{34: 1, 20: 1, 5: 1, 6: 2}
OK	28056-54-4	CC1CC(=O)C(C1)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 25: 1}
OK	28056-59-9	CC(=O)CC(C)(C)OO	{1: 3, 2: 1, 4: 1, 20: 1, 22: 1, 24: 1}
OK	2806-41-9	CCO/C=C/C#C	{1: 1, 2: 1, 6: 2, 9: 1, 10: 1, 22: 1}
OK	2806-45-3	C#CC=C1CCCCC1	{9: 1, 10: 1, 11: 5, 6: 1, 15: 1}
OK	2806-84-0	COCCC=O	{1: 1, 2: 2, 26: 1, 22: 1}
OK	2806-85-1	CCOCCC=O	{1: 1, 2: 3, 26: 1, 22: 1}
OK	2806-97-5	CCOC(C#CC)OCC	{1: 3, 2: 2, 3: 1, 10: 2, 22: 2}
OK	28068-45-3	C1CC2C3C4CC(C3C1C2O)C=C4	{20: 1, 11: 3, 12: 7, 14: 2}
OK	28069-72-9	CCC=CCCC=CCO	{1: 1, 2: 4, 20: 1, 6: 4}
OK	28069-74-1	CCC=CCCOC(C)OCC	{1: 3, 2: 4, 3: 1, 22: 2, 6: 2}
OK	2807-09-2	CCC=CC#C	{1: 1, 2: 1, 10: 1, 6: 2, 9: 1}
OK	2807-10-5	CCCCCCC=CC#C	{1: 1, 2: 5, 10: 1, 6: 2, 9: 1}
OK	2807-30-9	CCCOCCO	{1: 1, 2: 4, 20: 1, 22: 1}
OK	28079-04-1	CCC/C=C\CCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 2}
OK	2808-38-0	C1CC2C3CCC(C2C=C1)C=C3	{11: 4, 12: 4, 14: 4}
OK	2808-71-1	CCC1CCCC=C1	{1: 1, 2: 1, 11: 3, 12: 1, 14: 2}
OK	2808-75-5	CC1CCCCC1=C	{1: 1, 11: 4, 12: 1, 5: 1, 15: 1}
OK	2808-76-6	CC1CCCC(=C1)C	{1: 2, 11: 3, 12: 1, 14: 1, 15: 1}
OK	2808-80-2	CC1CCC(=C)CC1	{1: 1, 11: 4, 12: 1, 5: 1, 15: 1}
OK	2809-67-8	CCCCCC#CC	{1: 2, 2: 4, 10: 2}
OK	2809-69-0	CC#CC#CC	{1: 2, 10: 4}
OK	2809-78-1	C#CC1(CCCCCC1)O	{9: 1, 10: 1, 11: 6, 20: 1, 13: 1}
OK	281-05-0	C1CC2CCCC(C1)O2	{11: 6, 12: 2, 23: 1}
OK	281-15-2	C1CC2CCCC(C1)S2	{41: 1, 11: 6, 12: 2}
OK	281-17-4	C1CN2CCCN(C1)C2	{33: 2, 11: 7}
OK	281-23-2	C1C2CC3CC1CC(C2)C3	{11: 6, 12: 4}
OK	281-25-4	C1C2CC3CC1CC(C2)S3	{41: 1, 11: 5, 12: 4}
OK	281-27-6	C1C2CC3CC1CN(C2)C3	{33: 1, 11: 6, 12: 3}
OK	281-29-8	C1C2CN3CC1CN(C2)C3	{33: 2, 11: 6, 12: 2}
OK	281-32-3	C1C2CC3CC1OC(O2)O3	{11: 3, 12: 4, 23: 3}
OK	281-84-5	C1CC2CC1CC3CCC(C3)C2	{11: 8, 12: 4}
OK	28102-61-6	C1CC2C1C3C2C3	{11: 3, 12: 4}
OK	28103-68-6	CC(=C(C)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 2, 7: 2}
OK	2812-72-8	CSC(=O)Cl	{24: 1, 1: 1, 40: 1, 17: 1}
OK	28123-68-4	CCCCCCC(CC)Cl	{1: 2, 2: 6, 3: 1, 17: 1}
OK	28127-58-4	CCC(C)OC(=O)C(=CC)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1, 28: 1}
OK	28137-64-6	CCCCCCCCCCCCCCCCCCN(CC(C)O)CC(C)O	{1: 3, 2: 19, 3: 2, 20: 2, 33: 1}
OK	28148-04-1	CC(CBr)CBr	{1: 1, 2: 2, 3: 1, 18: 2}
OK	2815-34-1	C[C@@H]1CN[C@H](CN1)C	{32: 2, 1: 2, 11: 2, 12: 2}
OK	2815-57-8	CC1CCC(C1C)C	{1: 3, 11: 2, 12: 3}
OK	28152-96-7	CC=C(C)C(=O)OC12CC(C3(C(C1C2(C)C)C=C(CC4(C3C=C(C4=O)C)O)CO)O)C	{1: 6, 2: 1, 6: 1, 7: 1, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 1}
OK	28152-97-8	CCC(C)C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C	{1: 6, 2: 2, 3: 1, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 1}
OK	2816-25-3	C1CC2C=CC1C3C2C(=O)C=CC3=O	{25: 2, 11: 2, 12: 4, 14: 4}
OK	2816-57-1	CC1CCCC(C1=O)C	{1: 2, 11: 3, 12: 2, 25: 1}
OK	28164-92-3	CCN(CC)CC.CCN(CC)CC.C(=C/C(=O)O)\C(=O)O	{1: 6, 2: 6, 27: 2, 6: 2, 33: 2}
OK	2817-71-2	CCN1C=CC=N1	{1: 1, 2: 1, 35: 1, 14: 3, 33: 1}
OK	2819-48-9	C=C1CCCCC1=C	{11: 4, 5: 2, 15: 2}
OK	2819-57-0	COC(=O)C1CC(=O)OC12CCCCC2	{1: 1, 11: 6, 12: 1, 13: 1, 28: 2}
OK	28219-61-6	CCC(=CCC1CC=C(C1(C)C)C)CO	{1: 4, 2: 3, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	28219-62-7	CC1=CCC(C1(C)C)CC=CC(C)O	{1: 4, 2: 1, 3: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	28221-20-7	C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)CC(C)C)C(C)C	{1: 5, 2: 1, 3: 2, 11: 3, 12: 3, 28: 1}
OK	28221-34-3	CCCCC1=NCCS1	{1: 1, 2: 3, 35: 1, 41: 1, 11: 2, 15: 1}
OK	28231-03-0	CC1CCC2C13CC(C2(C)C)C(=C)C(C3)O	{1: 3, 5: 1, 11: 4, 12: 4, 13: 2, 15: 1, 20: 1}
OK	2825-60-7	CC(=O)OCC(=O)[C@@]12[C@@H](C[C@@H]3[C@@]1(C[C@@H]([C@]4([C@H]3CC(=C5[C@@]4(CCC(=C5)OCCCl)C)C=O)F)O)C)OC(O2)(C)C	{1: 5, 2: 3, 11: 5, 12: 4, 13: 5, 14: 1, 15: 3, 16: 1, 17: 1, 20: 1, 22: 1, 23: 2, 24: 1, 26: 1, 28: 1}
OK	28255-97-2	C1CC2C3=CC=CC=C2C=C4C1C(=C3)C=CC=C4	{11: 2, 12: 2, 14: 10, 15: 4}
OK	2826-19-9	C1CC2C(C1)C3CC2C=C3	{11: 4, 12: 4, 14: 2}
OK	28267-29-0	CCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 12, 28: 1}
OK	28267-32-5	CCCCCCCCC(=O)OC(C)C	{1: 3, 2: 7, 3: 1, 28: 1}
OK	28286-88-6	CC1=CC(=C(C#N)C#N)C=C(O1)C	{1: 2, 37: 2, 7: 1, 14: 2, 15: 3, 23: 1}
OK	28290-41-7	CC(=CCCC(=CCCC(=CCBr)C)C)C	{1: 4, 2: 5, 18: 1, 6: 3, 7: 3}
OK	28292-42-4	CCCCC(CC)N	{1: 2, 2: 4, 3: 1, 30: 1}
OK	28292-43-5	CC(C)CCC(C)N	{1: 3, 2: 2, 3: 2, 30: 1}
OK	283-19-2	C1CC2CCC(C1)CC2	{11: 7, 12: 2}
OK	283-24-9	C1CC2CCC1CNC2	{32: 1, 11: 6, 12: 2}
OK	283-27-2	C1CC2CCC1COC2	{11: 6, 12: 2, 23: 1}
OK	283-35-2	C1CC2CCC(C1)OO2	{11: 5, 12: 2, 23: 2}
OK	283-47-6	C1CN2CCN(C1)CC2	{33: 2, 11: 7}
OK	283-49-8	C1CC2C3C2CCC1CC3	{11: 6, 12: 4}
OK	283-50-1	C1CC2CCCC(C1)CC2	{11: 8, 12: 2}
OK	283-58-9	C1CN2CCCN(C1)CCC2	{33: 2, 11: 9}
OK	283-66-9	C1N2COOCN(COO1)COOC2	{33: 2, 11: 6, 23: 6}
OK	283-68-1	C1CC2CCC1CCC3CCC(CC3)CC2	{11: 12, 12: 4}
OK	2832-10-2	CCOC(=O)CCC(C(=O)C)C(=O)C	{24: 2, 1: 3, 2: 3, 3: 1, 28: 1}
OK	2832-19-1	C(C(=O)NCO)Cl	{24: 1, 17: 1, 2: 2, 20: 1, 31: 1}
OK	28320-88-9	CCCCCC(C)(CC)Cl	{1: 3, 2: 5, 4: 1, 17: 1}
OK	28324-52-9	CC1CC(C2CC1C2(C)C)OO	{1: 3, 11: 2, 12: 4, 13: 1, 20: 1, 22: 1}
OK	2833-21-8	CC(=O)C=CC(=O)O	{24: 1, 1: 1, 27: 1, 6: 2}
OK	28338-70-7	C[C@H](CCCC(C)C)C1CC[C@@H]2C1(CC[C@H]3C2C=CC4C3(CCCC4)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 2}
OK	28339-41-5	C1CC2C3C4C1C5C2C5C43	{11: 2, 12: 8}
OK	2834-05-1	C(CCCCCBr)CCCCC(=O)O	{2: 10, 27: 1, 18: 1}
OK	28349-72-6	C=CC=O.C=CC(=O)O	{26: 1, 27: 1, 5: 2, 6: 2}
OK	2835-39-4	CC(C)CC(=O)OCC=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 28: 1}
OK	2835-81-6	CCC(C(=O)O)N	{27: 1, 1: 1, 2: 1, 3: 1, 30: 1}
OK	28353-00-6	CC#N.CC(=O)C1CCC1(C)C	{1: 4, 37: 1, 11: 2, 12: 1, 13: 1, 24: 1}
OK	2837-89-0	C(C(F)(F)F)(F)Cl	{16: 4, 17: 1, 3: 1, 4: 1}
OK	28375-86-2	CC1C2CC3C4CC5CC3C1C(C5)C4C2	{1: 1, 11: 5, 12: 9}
OK	28387-44-2	CC1=CCCC(=CCC(CC1)C(=C)C)C	{1: 3, 5: 1, 7: 1, 11: 5, 12: 1, 14: 2, 15: 2}
OK	28399-17-9	CC1=CCC[C@]2([C@H]1C[C@@H](CC2)C(=C)C(=O)O)C	{1: 2, 5: 1, 7: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 1, 27: 1}
OK	284-18-4	C1CCC2CCC(C1)N2	{32: 1, 11: 6, 12: 2}
OK	284-20-8	C1CCC2CCC(C1)O2	{11: 6, 12: 2, 23: 1}
OK	284-22-0	C1CCC2OC(C1)OO2	{11: 4, 12: 2, 23: 3}
OK	28419-86-5	CCC(=CC(C)C)C=O	{1: 3, 2: 1, 3: 1, 6: 1, 7: 1, 26: 1}
OK	2842-38-8	C1CCC(CC1)NCCO	{20: 1, 2: 2, 11: 5, 12: 1, 31: 1}
OK	28435-84-9	CC(=O)O[C@H]1C[C@@H]2[C@@H](C2(C)C)C[C@]1(C)O	{1: 4, 11: 2, 12: 3, 13: 2, 20: 1, 28: 1}
OK	28438-32-6	CC(=C=C1CC1(C)C)C	{1: 4, 7: 1, 8: 1, 11: 1, 13: 1, 15: 1}
OK	28450-02-4	CC1=CCCC(O1)C(=O)C	{1: 2, 11: 2, 12: 1, 14: 1, 15: 1, 23: 1, 24: 1}
OK	28454-70-8	CC(C)CCCCCCNCCCCCCC(C)C	{1: 4, 2: 12, 3: 2, 31: 1}
OK	28456-82-8	CCCCCCOC(=O)C(C)Br	{1: 2, 2: 5, 3: 1, 28: 1, 18: 1}
OK	28464-24-6	CC(CN(CC(C)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 2, 4: 2, 38: 5, 33: 1}
OK	28464-26-8	CC(CN(CC(C)([N+](=O)[O-])[N+](=O)[O-])N=O)([N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 2, 4: 2, 38: 4, 33: 1, 34: 1, 29: 1}
OK	28467-71-2	CCCCCCCCC(CBr)Br	{1: 1, 2: 8, 3: 1, 18: 2}
OK	28467-75-6	CCCCCCCCCCC#CC	{1: 2, 2: 9, 10: 2}
OK	2847-00-9	CC1(OCC(O1)C2C(=O)C3C(O2)OC(O3)(C)C)C	{1: 4, 11: 1, 12: 4, 13: 2, 23: 5, 25: 1}
OK	2847-72-5	CCCCCCC(C)CCC	{1: 3, 2: 7, 3: 1}
OK	28472-18-6	CC(CCC(=O)O)C(C)(C)C(=O)O	{27: 2, 1: 3, 2: 2, 3: 1, 4: 1}
OK	28482-15-7	CCCCCCCCN(CC(C)O)CC(C)O	{1: 3, 2: 9, 3: 2, 20: 2, 33: 1}
OK	28484-49-3	C(CCBr)CC1C(=O)NC(=O)N1	{32: 2, 25: 2, 2: 4, 12: 1, 18: 1}
OK	2849-98-1	CCCCCOC(=O)C(=C)C	{1: 2, 2: 4, 28: 1, 5: 1, 7: 1}
OK	28495-27-4	CC(C)OC1=CCC=CC1	{1: 2, 3: 1, 11: 2, 14: 3, 15: 1, 22: 1}
OK	285-50-7	C1C2CC2CC3C1C3	{11: 4, 12: 4}
OK	285-58-5	C1CC2CC2C1	{11: 4, 12: 2}
OK	285-67-6	C1CC2C(C1)O2	{11: 3, 12: 2, 23: 1}
OK	285-69-8	C1C2C(O2)CO1	{11: 2, 12: 2, 23: 2}
OK	285-76-7	C1CC2CN2C1	{33: 1, 11: 4, 12: 1}
OK	285-86-9	C1CC2CC1C2	{11: 4, 12: 2}
OK	28506-33-4	CC(=C)C(=O)SCCC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 9, 5: 1, 7: 1, 40: 1, 16: 19, 24: 1}
OK	28522-33-0	CCCCCCCCCCCC(=O)N(CCC)CCC	{24: 1, 1: 3, 2: 14, 33: 1}
OK	28523-86-6	C(OC(C(F)(F)F)C(F)(F)F)F	{16: 7, 2: 1, 3: 1, 4: 2, 22: 1}
OK	28538-70-7	CCCCCCNCN=O	{1: 1, 2: 6, 34: 1, 29: 1, 31: 1}
OK	2854-16-2	CC(C)(CN)O	{1: 2, 2: 1, 4: 1, 30: 1, 20: 1}
OK	2855-08-5	CC(C)(C)CCCl	{1: 3, 2: 2, 4: 1, 17: 1}
OK	2855-13-2	CC1(CC(CC(C1)(C)CN)N)C	{1: 3, 2: 1, 11: 3, 12: 1, 13: 2, 30: 2}
OK	2855-19-8	CCCCCCCCCCC1CO1	{1: 1, 2: 9, 11: 1, 12: 1, 23: 1}
OK	2855-27-8	C=CC1CCC(C(C1)C=C)C=C	{11: 3, 12: 3, 5: 3, 6: 3}
OK	28562-53-0	CC(=O)OC1CC(=O)N1	{32: 1, 1: 1, 11: 1, 12: 1, 25: 1, 28: 1}
OK	28577-62-0	C=CC=C(Cl)Cl	{17: 2, 5: 1, 6: 2, 7: 1}
OK	28598-81-4	CCOC(=O)CCCCCCCCBr	{1: 1, 2: 9, 28: 1, 18: 1}
OK	286-08-8	C1CCC2CC2C1	{11: 5, 12: 2}
OK	286-18-0	C1CCC2C(C1)N2	{32: 1, 11: 4, 12: 2}
OK	286-20-4	C1CCC2C(C1)O2	{11: 4, 12: 2, 23: 1}
OK	286-28-2	C1CCC2C(C1)S2	{41: 1, 11: 4, 12: 2}
OK	286-43-1	C1CCC2CC2CC1	{11: 6, 12: 2}
OK	286-45-3	C1CCC2C(O2)CC1	{11: 5, 12: 2, 23: 1}
OK	286-60-2	C1CCCC2CC2CC1	{11: 7, 12: 2}
OK	286-62-4	C1CCCC2C(O2)CC1	{11: 6, 12: 2, 23: 1}
OK	286-73-7	C1CC2CC2CCC3C1C3	{11: 6, 12: 4}
OK	286-75-9	C1CC2C(O2)CCC3C1O3	{11: 4, 12: 4, 23: 2}
OK	286-99-7	C1CCCCCC2C(O2)CCCC1	{11: 10, 12: 2, 23: 1}
OK	28623-46-3	CCCCCCCCCCCCCCCCCCC#N	{1: 1, 2: 17, 37: 1}
OK	28638-29-1	CC(C)C(C)(C(C)C=C)O	{1: 4, 3: 2, 4: 1, 5: 1, 6: 1, 20: 1}
OK	28643-80-3	CC1CCC(OC1C(C)C(=O)O)CC2CC(C(C3(O2)C(CC(O3)(C)C4CCC(O4)(C)C5C(CC(O5)C6C(CC(C(O6)(CO)O)C)C)C)C)C)OC	{1: 10, 2: 2, 3: 1, 11: 8, 12: 14, 13: 4, 20: 2, 22: 1, 23: 6, 27: 1}
OK	28664-03-1	CCOC(=O)CC1CC(C1(C)C)C(=O)OCC	{1: 4, 2: 3, 11: 1, 12: 2, 13: 1, 28: 2}
OK	28664-35-9	CC1C(=C(C(=O)O1)O)C	{1: 2, 12: 1, 28: 1, 20: 1, 15: 2}
OK	28664-37-1	CCCC1C(=C(C(=O)O1)O)C	{1: 2, 2: 2, 12: 1, 15: 2, 20: 1, 28: 1}
OK	2867-05-2	CC1=CCC2(C1C2)C(C)C	{1: 3, 3: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1}
OK	2867-20-1	CC(C(=O)NC(C)C(=O)O)N	{1: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	2867-47-2	CC(=C)C(=O)OCCN(C)C	{1: 3, 2: 2, 5: 1, 33: 1, 7: 1, 28: 1}
OK	2867-59-6	CC(CCO)N	{1: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	2867-93-8	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@@]45[C@@]3(CC[C@@H]4C5)C)OC)C	{1: 6, 2: 3, 3: 2, 11: 8, 12: 6, 13: 3, 22: 1}
OK	28670-60-2	CCC(C)(C)N(C(C)(C)C)[O]	{1: 6, 2: 1, 4: 2, 29: 1, 33: 1}
OK	28675-80-1	CC(C)CCCCCOC(=O)C(=C)C	{1: 3, 2: 5, 3: 1, 5: 1, 7: 1, 28: 1}
OK	2868-37-3	COC(=O)C1CC1	{1: 1, 11: 2, 12: 1, 28: 1}
OK	28680-45-7	C1=C(C2(C(C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 12: 2, 13: 3, 14: 1, 15: 1}
OK	2869-34-3	CCCCCCCCCCCCCN	{1: 1, 2: 12, 30: 1}
OK	28693-00-7	C1C2CC(C1C=C2)COC(=O)CCl	{2: 2, 11: 2, 12: 3, 14: 2, 17: 1, 28: 1}
OK	28697-53-2	C1[C@H]([C@H]([C@@H](C(O1)O)O)O)O	{20: 4, 11: 1, 12: 4, 23: 1}
OK	287-12-7	C1CC2C3C1C23	{11: 2, 12: 4}
OK	287-13-8	C1CC2C3C2C3C1	{11: 3, 12: 4}
OK	287-23-0	C1CCC1	{11: 4}
OK	287-27-4	C1CSC1	{41: 1, 11: 3}
OK	287-50-3	C1OCO1	{11: 2, 23: 2}
OK	287-53-6	C1SCS1	{41: 2, 11: 2}
OK	287-92-3	C1CCCC1	{11: 5}
OK	2873-12-3	CC(C)OC(C(Cl)(Cl)Cl)O	{1: 2, 3: 2, 4: 1, 17: 3, 20: 1, 22: 1}
OK	2873-29-2	CC(=O)OC[C@@H]1[C@H]([C@@H](C=CO1)OC(=O)C)OC(=O)C	{1: 3, 2: 1, 12: 3, 14: 2, 23: 1, 28: 3}
OK	2873-50-9	C=C=C=C	{8: 2, 5: 2}
OK	2873-74-7	C(CC(=O)Cl)CC(=O)Cl	{24: 2, 17: 2, 2: 3}
OK	2873-97-4	CC(=O)CC(C)(C)NC(=O)C=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 24: 2, 31: 1}
OK	2874-74-0	CCCCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 9, 3: 1}
OK	2874-75-1	CCCCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 10, 3: 1}
OK	2874-76-2	CCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 8, 3: 1}
OK	2878-14-0	CC(=C)CN	{1: 1, 2: 1, 5: 1, 30: 1, 7: 1}
OK	28786-71-2	CC(C)(C)C1=CC(=O)C=C1C(C)(C)C	{1: 6, 4: 2, 25: 1, 14: 2, 15: 2}
OK	28787-21-5	C(=NNC(=O)N[N+](=O)[O-])(N)N	{34: 1, 38: 1, 7: 1, 24: 1, 30: 2, 31: 2}
OK	288-13-1	C1=CNN=C1	{32: 1, 35: 1, 14: 3}
OK	288-14-2	C1=CON=C1	{35: 1, 14: 3, 23: 1}
OK	288-16-4	C1=CSN=C1	{41: 1, 35: 1, 14: 3}
OK	288-32-4	C1=CN=CN1	{32: 1, 35: 1, 14: 3}
OK	288-36-8	C1=NNN=C1	{32: 1, 35: 2, 14: 2}
OK	288-37-9	C1=NON=C1	{35: 2, 14: 2, 23: 1}
OK	288-39-1	C1=NSN=C1	{41: 1, 35: 2, 14: 2}
OK	288-42-6	C1=COC=N1	{35: 1, 14: 3, 23: 1}
OK	288-47-1	C1=CSC=N1	{41: 1, 35: 1, 14: 3}
OK	288-88-0	C1=NC=NN1	{32: 1, 35: 2, 14: 2}
OK	288-92-6	C1=NSC=N1	{41: 1, 35: 2, 14: 2}
OK	288-94-8	C1=NNN=N1	{32: 1, 35: 3, 14: 1}
OK	288-99-3	C1=NN=CO1	{35: 2, 14: 2, 23: 1}
OK	2880-58-2	COC1=CC(=O)C=CC1=O	{1: 1, 25: 2, 22: 1, 14: 3, 15: 1}
OK	28801-70-9	CC(C)CCCCCCCOC(=O)CCC(=O)OCCCCCCCC(C)C	{1: 4, 2: 16, 3: 2, 28: 2}
OK	2882-96-4	CCCCCCCCCCCCC(C)CC	{1: 3, 2: 12, 3: 1}
OK	2882-98-6	CCCCCCCCCC1CCCC1	{1: 1, 2: 8, 11: 4, 12: 1}
OK	28820-56-6	C(CN(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])N(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-]	{16: 2, 33: 2, 2: 4, 4: 2, 38: 6}
OK	28823-41-8	CC=CC=C(C)C	{1: 3, 6: 3, 7: 1}
OK	28823-42-9	CC=CC(=CC)C	{1: 3, 6: 3, 7: 1}
OK	2883-02-5	CCCCCCCCCC1CCCCC1	{1: 1, 2: 8, 11: 5, 12: 1}
OK	2883-07-0	C1CCC(CC1)CCCC2CCCC2	{2: 3, 11: 9, 12: 2}
OK	2883-08-1	CC(CC1CCCCC1)CC2CCCCC2	{11: 10, 1: 1, 2: 2, 3: 1, 12: 2}
OK	2883-45-6	C=CCC(CC=C)O	{2: 2, 3: 1, 20: 1, 5: 2, 6: 2}
OK	28834-17-5	CC1(CC2C1CCC(C(CCC2=C)[N+](=O)[O-])(C)N=O)C	{1: 3, 34: 1, 5: 1, 38: 1, 11: 5, 12: 3, 13: 2, 15: 1, 29: 1}
OK	28839-49-8	CN1C(=O)C2=C(C1=O)CCCC2	{1: 1, 11: 4, 25: 2, 33: 1, 15: 2}
OK	2884-06-2	CCCCCCC(C)C(C)C	{1: 4, 2: 5, 3: 2}
OK	2884-67-5	CCC(=CC)C(=O)NC(=O)N	{1: 2, 2: 1, 6: 1, 7: 1, 24: 2, 30: 1, 31: 1}
OK	28843-34-7	C=CCNC(=O)C(C(C(=O)NCC=C)O)O	{2: 2, 3: 2, 5: 2, 6: 2, 20: 2, 24: 2, 31: 2}
OK	2885-00-9	CCCCCCCCCCCCCCCCCCS	{1: 1, 2: 17, 39: 1}
OK	2886-59-1	COC1=CCC=CC1	{1: 1, 11: 2, 22: 1, 14: 3, 15: 1}
OK	2886-87-5	C=CC1CC2CC1C3C2O3	{11: 2, 12: 5, 5: 1, 6: 1, 23: 1}
OK	2886-89-7	C1C2CC3C(C2CC4C1O4)O3	{11: 3, 12: 6, 23: 2}
OK	28861-48-5	C=CCCC=CC1CC2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl	{2: 2, 5: 1, 6: 3, 11: 1, 12: 1, 13: 3, 15: 2, 17: 6}
OK	28868-76-0	COC(=O)C(C(=O)OC)Cl	{1: 2, 3: 1, 28: 2, 17: 1}
OK	28873-61-2	CC1(N=NC(=O)O1)C	{1: 2, 35: 2, 28: 1, 13: 1}
OK	28875-17-4	C[C@@H](C(=O)OC)NC(=O)OC(C)(C)C	{1: 5, 3: 1, 4: 1, 28: 2, 31: 1}
OK	28882-09-9	[C](F)(F)Br	{16: 2, 18: 1, 7: 1}
OK	28886-71-7	C(COCCO)NC(=O)OCCO	{28: 1, 2: 6, 20: 2, 22: 1, 31: 1}
OK	28886-72-8	CC(COC(=O)NCCO)O	{1: 1, 2: 3, 3: 1, 20: 2, 28: 1, 31: 1}
OK	28892-21-9	CC(C)C12CCC(=O)C1C2	{1: 2, 3: 1, 11: 3, 12: 1, 13: 1, 25: 1}
OK	28895-09-2	CC[C@@H](CO)N.Cl	{1: 1, 2: 2, 3: 1, 17: 1, 20: 1, 30: 1}
OK	28895-91-2	CC(=O)NC(=O)N(C)N=O	{1: 2, 34: 1, 33: 1, 24: 2, 29: 1, 31: 1}
OK	28897-58-7	CCCC=C(C)C(=O)O	{1: 2, 2: 2, 27: 1, 6: 1, 7: 1}
OK	289-06-5	C1=NN=CS1	{41: 1, 35: 2, 14: 2}
OK	289-14-5	C1OCOO1	{11: 2, 23: 3}
OK	289-16-7	C1SCSS1	{41: 3, 11: 2}
OK	289-65-6	C1C=COC=C1	{11: 1, 14: 4, 23: 1}
OK	289-70-3	C1C=CSC=C1	{41: 1, 11: 1, 14: 4}
OK	289-80-5	C1=CC=NN=C1	{35: 2, 14: 4}
OK	289-95-2	C1=CN=CN=C1	{35: 2, 14: 4}
OK	289-96-3	C1=CN=NN=C1	{35: 3, 14: 3}
OK	2890-62-2	CC(=O)C1(CCCCC1)C	{24: 1, 1: 2, 11: 5, 13: 1}
OK	28916-23-6	CCC=NC(C)C	{1: 3, 2: 1, 3: 1, 34: 1, 6: 1}
OK	28923-90-2	CC(C)(C)C=C(C(C)(C)C)C(C)(C)C	{1: 9, 4: 3, 6: 1, 7: 1}
OK	28925-00-0	CC(=O)C1CCCCCCCCCCC1	{24: 1, 1: 1, 11: 11, 12: 1}
OK	28933-84-8	C1=C[CH]1	{14: 3}
OK	28942-55-4	CCN(CC)C1=NC1(C)C	{1: 4, 2: 2, 35: 1, 33: 1, 13: 1, 15: 1}
OK	28947-77-5	CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC	{1: 3, 2: 45, 33: 1}
OK	28950-34-7	N1=S=NSN=S=NS1	{41: 4, 35: 4}
OK	28953-96-0	CC1CCC(C(C1)Cl)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 17: 1}
OK	28954-12-3	C[C@@H]([C@@H](C(=O)O)N)O	{27: 1, 1: 1, 3: 2, 20: 1, 30: 1}
OK	28961-43-5	CCC(COCCOC(=O)C=C)(COCCOC(=O)C=C)COCCOC(=O)C=C	{1: 1, 2: 10, 4: 1, 5: 3, 6: 3, 22: 3, 28: 3}
OK	28964-24-1	C(CCCCCC(=O)O)CCCCCC(=O)O.C(CO)O	{2: 13, 27: 2, 20: 2}
OK	28982-37-8	C=CCCCCCCCCCCCCO	{2: 12, 20: 1, 5: 1, 6: 1}
OK	28983-37-1	CCCCCCCCCCCC(C)(C)S	{1: 3, 2: 10, 4: 1, 39: 1}
OK	2899-37-8	CSCC[C@@H](CO)N	{1: 1, 2: 3, 3: 1, 40: 1, 20: 1, 30: 1}
OK	2899-90-3	CCCC(CO)[N+](=O)[O-]	{1: 1, 2: 3, 3: 1, 20: 1, 38: 1}
OK	290-37-9	C1=CN=CC=N1	{35: 2, 14: 4}
OK	290-38-0	C1=CN=NC=N1	{35: 3, 14: 3}
OK	290-67-5	C1=COC=CO1	{14: 4, 23: 2}
OK	290-79-9	C1=CSC=CS1	{41: 2, 14: 4}
OK	290-87-9	C1=NC=NC=N1	{35: 3, 14: 3}
OK	290-96-0	C1=NN=CN=N1	{35: 4, 14: 2}
OK	29003-73-4	CCCCOC(=O)C(Cl)Cl	{1: 1, 2: 3, 3: 1, 28: 1, 17: 2}
OK	29006-01-7	COCCCC(=O)OC	{1: 2, 2: 3, 28: 1, 22: 1}
OK	29018-19-7	CCC(=O)OCCN(C)C	{1: 3, 2: 3, 28: 1, 33: 1}
OK	2902-96-7	CC(CO)[N+](=O)[O-]	{1: 1, 2: 1, 3: 1, 20: 1, 38: 1}
OK	29022-31-9	CCCCC#CC(C)(C)CC	{1: 4, 2: 4, 4: 1, 10: 2}
OK	2903-12-0	C1CCC(CC1)C2(CCCCC2)O	{20: 1, 11: 10, 12: 1, 13: 1}
OK	29030-81-7	CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 25, 28: 1}
OK	29030-84-0	C(=C(Cl)Cl)(C(C(C(=C(Cl)Cl)Cl)(Cl)Cl)(Cl)Cl)Cl	{17: 10, 4: 2, 7: 4}
OK	2904-41-8	C(CN1C(=O)N(C(=O)N(C1=O)CCC(=O)O)CCC(=O)O)C(=O)O	{25: 3, 2: 6, 27: 3, 33: 3}
OK	29043-93-4	C#CCCCCCCCCCCl	{9: 1, 2: 9, 10: 1, 17: 1}
OK	29044-06-2	CC(CCC(C)(C)O)O	{1: 3, 2: 2, 3: 1, 4: 1, 20: 2}
OK	29050-33-7	CC1CC2C(C2(C)C)C=C1	{1: 3, 11: 1, 12: 3, 13: 1, 14: 2}
OK	2906-12-9	CC(C)OCCCN	{1: 2, 2: 3, 3: 1, 30: 1, 22: 1}
OK	2906-55-0	CCCCCCCCCCCCCCCC(=O)OCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 29, 28: 1, 6: 2}
OK	2906-60-7	C(CC(=O)O)CSSCCCC(=O)O	{40: 2, 2: 6, 27: 2}
OK	29071-93-0	CC1(C(=O)N(C(=O)N1)CCO)C	{32: 1, 1: 2, 2: 2, 33: 1, 13: 1, 20: 1, 25: 2}
OK	29072-93-3	CCCOC(C)(C)C	{1: 4, 2: 2, 4: 1, 22: 1}
OK	291-21-4	C1SCSCS1	{41: 3, 11: 3}
OK	291-22-5	C1SSCSS1	{41: 4, 11: 2}
OK	291-64-5	C1CCCCCC1	{11: 7}
OK	291-70-3	C1=CC=COC=C1	{14: 6, 23: 1}
OK	291-92-9	C1OC=CC=CO1	{11: 1, 14: 4, 23: 2}
OK	29106-32-9	C1CC(C=C1)CCCCCCCCCCCCC(=O)O	{27: 1, 2: 12, 11: 2, 12: 1, 14: 2}
OK	29118-24-9	F/C=C/C(F)(F)F	{16: 4, 4: 1, 6: 2}
OK	29118-61-4	C1C[C@H](N(C1)CC(=O)[C@H]([C@@H]([C@@H](CO)O)O)O)C(=O)O	{33: 1, 2: 2, 3: 3, 11: 3, 12: 1, 20: 4, 24: 1, 27: 1}
OK	29119-58-2	CC(C)N=C(Cl)Cl	{1: 2, 34: 1, 3: 1, 17: 2, 7: 1}
OK	29134-29-0	C1CCN(C1)CC#N	{33: 1, 2: 1, 11: 4, 37: 1}
OK	2914-29-6	CN(C)C=O.C1N(CN(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 26: 1, 11: 4, 38: 4, 33: 5}
OK	2914-69-4	C[C@@H](C#C)O	{1: 1, 10: 1, 3: 1, 20: 1, 9: 1}
OK	2915-49-3	CCCCC(CC)COC(=O)C1CC=CCC1C(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 11: 2, 12: 2, 14: 2, 28: 2}
OK	2915-53-9	CCCCCCCCOC(=O)/C=C\C(=O)OCCCCCCCC	{1: 2, 2: 14, 28: 2, 6: 2}
OK	2915-57-3	CCCCC(CC)COC(=O)CCC(=O)OCC(CC)CCCC	{1: 4, 2: 12, 3: 2, 28: 2}
OK	2915-90-4	CCCCCCCCCCCCN(C)CCCCCCCCCCCC	{1: 3, 2: 22, 33: 1}
OK	2916-14-5	C=CCOC(=O)CCl	{17: 1, 2: 2, 28: 1, 5: 1, 6: 1}
OK	2916-24-7	C1CC(CCC1COC(=O)Cl)COC(=O)Cl	{17: 2, 2: 2, 11: 4, 12: 2, 28: 2}
OK	2916-31-6	CC1(OCCO1)C	{1: 2, 11: 2, 13: 1, 23: 2}
OK	29166-71-0	CC(C)N=C(N(C)C)N(C)C	{1: 6, 34: 1, 3: 1, 33: 2, 7: 1}
OK	2917-26-2	CCCCCCCCCCCCCCCCS	{1: 1, 2: 15, 39: 1}
OK	2917-73-9	CCCCOC(=O)CCCCCCCC(=O)OCCCC	{1: 2, 2: 13, 28: 2}
OK	2917-91-1	CCN(CC)CC1CO1	{1: 2, 2: 3, 33: 1, 11: 1, 12: 1, 23: 1}
OK	2917-98-8	C1CN(CCN1CC2CO2)CC3CO3	{33: 2, 2: 2, 11: 6, 12: 2, 23: 2}
OK	29171-20-8	CC(=CCCC(C)(C#C)O)C	{1: 3, 2: 2, 4: 1, 6: 1, 7: 1, 9: 1, 10: 1, 20: 1}
OK	29171-23-1	CC(C)CCCC(C)CCCC(C)CCCC(C)(C#C)O	{1: 5, 2: 9, 3: 3, 4: 1, 9: 1, 10: 1, 20: 1}
OK	2918-13-0	CCCCC(=O)C=C	{24: 1, 1: 1, 2: 3, 5: 1, 6: 1}
OK	2919-05-3	C=CC#CCO	{2: 1, 10: 2, 20: 1, 5: 1, 6: 1}
OK	2919-23-5	C1CC(C1)O	{20: 1, 11: 3, 12: 1}
OK	2919-66-6	CC1=CC2C(CCC3(C2CC(=C)C3(C(=O)C)OC(=O)C)C)C4(C1=CC(=O)CC4)C	{1: 5, 5: 1, 11: 5, 12: 3, 13: 3, 14: 2, 15: 3, 24: 1, 25: 1, 28: 1}
OK	292-45-5	C1SCSSCS1	{41: 4, 11: 3}
OK	292-46-6	C1SSCSSS1	{41: 5, 11: 2}
OK	292-64-8	C1CCCCCCC1	{11: 8}
OK	2920-86-7	CC12CC(C3C(C1CCC2(C(=O)COC(=O)CCC(=O)O)O)CCC4=CC(=O)C=CC34C)O	{1: 2, 2: 3, 11: 5, 12: 4, 13: 3, 14: 3, 15: 1, 20: 2, 24: 1, 25: 1, 27: 1, 28: 1}
OK	29210-77-3	CC(C)(CCCC(C)(C=C)O)O	{1: 3, 2: 3, 4: 2, 5: 1, 6: 1, 20: 2}
OK	29211-68-5	CC(C)(C)C1=NNC(=O)C1	{32: 1, 1: 3, 35: 1, 4: 1, 11: 1, 15: 1, 25: 1}
OK	29211-70-9	CCCC1=NNC(=O)C1	{32: 1, 1: 1, 2: 2, 35: 1, 11: 1, 15: 1, 25: 1}
OK	29214-57-1	CC(=O)CCC(C(=O)C)C(=O)C	{24: 3, 1: 3, 2: 2, 3: 1}
OK	29214-60-6	CCCCCCC(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 6, 3: 1, 28: 1}
OK	2922-51-2	CCCCCCCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 14}
OK	2923-68-4	C(=O)(C(C(C(C(C(C(C(F)(F)Cl)(F)Cl)(F)F)(F)Cl)(F)F)(F)Cl)(F)F)O	{16: 11, 17: 4, 27: 1, 4: 7}
OK	29237-78-3	CCC(C(=O)OCC)(C(=O)OCC)Br	{1: 3, 2: 3, 4: 1, 18: 1, 28: 2}
OK	29240-17-3	CCC(C)(C)OOC(=O)C(C)(C)C	{1: 6, 2: 1, 4: 2, 22: 1, 28: 1}
OK	2925-25-9	C(=O)(C(F)(F)F)S	{16: 3, 24: 1, 4: 1, 39: 1}
OK	29262-58-6	CNC(=O)C(=O)O	{24: 1, 1: 1, 27: 1, 31: 1}
OK	29263-94-3	CCOC(=O)C(C)(C(=O)OCC)Br	{1: 3, 2: 2, 4: 1, 18: 1, 28: 2}
OK	29269-20-3	CC(C)(C)OOC(=O)CCC(=O)OC	{1: 4, 2: 2, 4: 1, 22: 1, 28: 2}
OK	2927-83-5	C(=O)(C(C(F)(F)F)(OC(F)(F)F)F)F	{16: 8, 24: 1, 4: 3, 22: 1}
OK	29279-66-1	C=C1CC1CO	{2: 1, 5: 1, 11: 1, 12: 1, 15: 1, 20: 1}
OK	29281-39-8	CCC(C)(C)OC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 22: 1}
OK	29284-59-1	C(#N)SBr	{40: 1, 18: 1, 37: 1}
OK	293-30-1	C1OCOCOCO1	{11: 4, 23: 4}
OK	293-55-0	C1CCCCCCCC1	{11: 9}
OK	293-96-9	C1CCCCCCCCC1	{11: 10}
OK	29304-70-9	CC1(C=CC(=C)C=C1)C	{1: 2, 15: 1, 5: 1, 14: 4, 13: 1}
OK	2932-82-3	[CH2]C#N	{5: 1, 37: 1}
OK	29342-44-7	CC(C)CCC(C)(C)Cl	{1: 4, 2: 2, 3: 1, 4: 1, 17: 1}
OK	29342-53-8	C1CC2CC1CC2Cl	{17: 1, 11: 4, 12: 3}
OK	29343-52-0	CCCCCC(C=CC=O)O	{1: 1, 2: 4, 3: 1, 6: 2, 20: 1, 26: 1}
OK	2935-07-1	C1CC2CCCC3C2C(C1)CCC3	{11: 9, 12: 4}
OK	2935-44-6	CC(CCC(C)O)O	{1: 2, 2: 2, 3: 2, 20: 2}
OK	2935-90-2	COC(=O)CCS	{1: 1, 2: 2, 28: 1, 39: 1}
OK	29362-48-9	C[C@@H]1[C@H]([C@H](C[C@H](O1)O[C@H]2C[C@H](O[C@@H]([C@H]2O[C@@H]3C[C@@H]([C@@H]([C@H](O3)C)O)O)C)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7(C6(C[C@H]([C@@H]7C8=CC(=O)OC8)OC(=O)C)O)C)C)O)O	{1: 6, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 5, 22: 3, 23: 3, 28: 2}
OK	29365-79-5	C1CC2CCC(=O)C2C1	{25: 1, 11: 5, 12: 2}
OK	29366-78-7	C1=C/C(=C\2/NC(=NC(=N2)N)N)/C(=O)C=C1	{32: 1, 35: 2, 14: 4, 15: 4, 25: 1, 30: 2}
OK	29369-63-9	CCCCCCCCCCCCCCNC	{1: 2, 2: 13, 31: 1}
OK	2937-50-0	C=CCOC(=O)Cl	{17: 1, 2: 1, 28: 1, 5: 1, 6: 1}
OK	29379-41-7	CCCCCCCCOCCC	{1: 2, 2: 9, 22: 1}
OK	2938-69-4	CCC(CC)(CCC#N)C=O	{1: 2, 2: 4, 4: 1, 26: 1, 37: 1}
OK	2938-98-9	CC(CCO)CO	{1: 1, 2: 3, 3: 1, 20: 2}
OK	29382-82-9	CCCCCCCCCCCCCCCC(=O)CC(=O)CC(=O)CC(=O)CC(=O)CC(=O)CC(=O)CC(=O)CC(=O)CC/C=C/CCOC(=O)/C=C/C(=O)NC1=C(CCC1=O)O	{1: 1, 2: 26, 6: 4, 11: 2, 15: 2, 20: 1, 24: 10, 25: 1, 28: 1, 31: 1}
OK	294-41-7	C1CCCCCCCCCC1	{11: 11}
OK	294-59-7	C1COCCOCOCCO1	{11: 7, 23: 4}
OK	294-62-2	C1CCCCCCCCCCC1	{11: 12}
OK	294-80-4	C1CNCCCNCCCNC1	{32: 3, 11: 9}
OK	294-90-6	C1CNCCNCCNCCN1	{32: 4, 11: 8}
OK	294-92-8	C1COCCNCCOCCN1	{32: 2, 11: 8, 23: 2}
OK	294-93-9	C1COCCOCCOCCO1	{11: 8, 23: 4}
OK	294-95-1	C1CSCCOCCSCCO1	{41: 2, 11: 8, 23: 2}
OK	2940-98-9	CC1(CN2CC(CN2C1)(C)C)C	{1: 4, 11: 4, 13: 2, 33: 2}
OK	29400-42-8	C[C@H]1[C@@H]2[C@@H](C(=O)[C@]3([C@H]([C@]2(C=CC1=O)C)CC[C@@H]\4[C@@]3(C[C@@H](/C4=C(/CCC=C(C)C)\C(=O)O)OC(=O)C)C)C)OC(=O)C	{1: 8, 2: 2, 6: 1, 7: 2, 11: 3, 12: 6, 13: 3, 14: 2, 15: 1, 25: 2, 27: 1, 28: 2}
OK	29403-23-4	CCOCCOC(=O)C(=C)C.CC(=C)C(=O)OCCO	{1: 3, 2: 5, 5: 2, 7: 2, 20: 1, 22: 1, 28: 2}
OK	29403-24-5	CC(=C)C(=O)OCCO.CC(=C)C(=O)OCCOC	{1: 3, 2: 4, 5: 2, 7: 2, 20: 1, 22: 1, 28: 2}
OK	29405-51-4	CCCCOC(=O)C=C.CC(=C)C(=O)OC.C=CC(=O)N	{1: 3, 2: 3, 5: 3, 6: 2, 7: 1, 24: 1, 28: 2, 30: 1}
OK	2941-45-9	CC(C)(CCCC(C)(C)C(=O)O)C(=O)O	{1: 4, 2: 3, 27: 2, 4: 2}
OK	2941-51-7	C1CC2(CCC1(C2)Cl)Cl	{17: 2, 11: 5, 13: 2}
OK	2941-55-1	CCN(CC)C(=O)SCC	{24: 1, 1: 3, 2: 3, 40: 1, 33: 1}
OK	2941-64-2	CCSC(=O)Cl	{24: 1, 1: 1, 2: 1, 40: 1, 17: 1}
OK	29412-62-2	COC(=O)C12C3C4C1C5C2C3C45C(=O)OC	{1: 2, 12: 6, 13: 2, 28: 2}
OK	29414-46-8	C(C([N+](=O)[O-])([N+](=O)[O-])F)N(COCN(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])[N+](=O)[O-]	{33: 2, 2: 4, 4: 2, 38: 6, 16: 2, 22: 1}
OK	29414-47-9	CSCS	{40: 1, 1: 1, 2: 1, 39: 1}
OK	29414-55-9	CC1(C(O1)CCC(=C)C=C)C	{1: 2, 2: 2, 5: 2, 6: 1, 7: 1, 12: 1, 13: 1, 23: 1}
OK	29415-95-0	C1CC2CCCC(C1)CCC2	{11: 9, 12: 2}
OK	29425-97-6	CCCCCCCCCC(=O)O.CCCCNCCCC	{1: 3, 2: 14, 27: 1, 31: 1}
OK	29431-28-5	C1C=CSCC1=O	{25: 1, 11: 2, 14: 2, 41: 1}
OK	29456-04-0	CC(=C)O	{1: 1, 20: 1, 5: 1, 7: 1}
OK	2949-22-6	CCOC(=O)CN=C=O	{1: 1, 2: 2, 8: 1, 34: 1, 28: 1, 29: 1}
OK	29493-00-3	CCCCCC=CCCCCC	{1: 2, 2: 8, 6: 2}
OK	295-02-3	C1CCCCCCCCCCCC1	{11: 13}
OK	295-03-4	C1CCCCCCNCCCCC1	{32: 1, 11: 12}
OK	295-17-0	C1CCCCCCCCCCCCC1	{11: 14}
OK	295-37-4	C1CNCCNCCCNCCNC1	{32: 4, 11: 10}
OK	295-42-1	C1COCCOCOCCOCCO1	{11: 9, 23: 5}
OK	295-48-7	C1CCCCCCCCCCCCCC1	{11: 15}
OK	295-65-8	C1CCCCCCCCCCCCCCC1	{11: 16}
OK	295-97-6	C1CCCCCCCCCCCCCCCC1	{11: 17}
OK	29504-89-0	CCCCCCCCNCCC#N	{1: 1, 2: 9, 37: 1, 31: 1}
OK	29518-02-3	C1CCCCCC(CCCC1)CO	{20: 1, 2: 1, 11: 10, 12: 1}
OK	2952-70-7	C[C@H](CCCC(CO)CO)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C	{1: 3, 2: 5, 3: 2, 11: 7, 12: 8, 13: 2, 20: 5}
OK	29542-62-9	C1C2CC3CC1CC(C2)C3C4C5CC6CC(C5)CC4C6	{11: 10, 12: 10}
OK	29548-13-8	C=C1CCC(CC1)C(=C)CO	{2: 1, 5: 2, 7: 1, 11: 4, 12: 1, 15: 1, 20: 1}
OK	29548-14-9	CC1=CCC(CC1)C(C)C=O	{1: 2, 3: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	29548-30-9	CC(=CCC/C(=C/CC/C(=C/COC(=O)C)/C)/C)C	{1: 5, 2: 5, 28: 1, 6: 3, 7: 3}
OK	29549-78-8	CC(=O)C1(CC(=O)C(O1)(C)O)C	{1: 3, 11: 1, 13: 2, 20: 1, 23: 1, 24: 1, 25: 1}
OK	2955-56-8	CCCCCCCCCCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 17}
OK	2955-65-9	CCC(=O)CCC(=O)CC	{24: 2, 1: 2, 2: 4}
OK	2955-67-1	CCCCNC(=O)CC	{24: 1, 1: 2, 2: 4, 31: 1}
OK	2955-88-6	C1CCN(C1)CCO	{33: 1, 2: 2, 11: 4, 20: 1}
OK	29553-26-2	CC(C)(C(C(F)F)(F)F)O	{16: 4, 1: 2, 3: 1, 4: 2, 20: 1}
OK	29555-02-0	CC1CC1C(=O)O	{27: 1, 1: 1, 11: 1, 12: 2}
OK	29559-52-2	CC(C)(C(Cl)Cl)Cl	{1: 2, 3: 1, 4: 1, 17: 3}
OK	29559-54-4	CC(C)(C)C(Cl)Cl	{1: 3, 3: 1, 4: 1, 17: 2}
OK	29559-55-5	CC(C)(CCl)CCl	{1: 2, 2: 2, 4: 1, 17: 2}
OK	2956-58-3	C=CC(=O)NCCNC(=O)C=C	{24: 2, 2: 2, 5: 2, 6: 2, 31: 2}
OK	29560-84-7	C(C=CCl)O	{17: 1, 2: 1, 20: 1, 6: 2}
OK	2957-06-4	CC(=O)C=CC=C	{24: 1, 1: 1, 5: 1, 6: 3}
OK	2958-72-7	C1C2C3C4C1C5C2C(=O)C3C4C5=O	{25: 2, 11: 1, 12: 8}
OK	2958-75-0	CC1CCCC2C1CCCC2	{1: 1, 11: 7, 12: 3}
OK	2958-89-6	C1COCCN1SCl	{40: 1, 17: 1, 11: 4, 33: 1, 23: 1}
OK	29590-42-9	CC(C)CCCCCOC(=O)C=C	{1: 2, 2: 5, 3: 1, 5: 1, 6: 1, 28: 1}
OK	296-18-4	C1CCCCCCCCCCCCCCCCC1	{11: 18}
OK	296-39-9	C1COCCSCCOCCOCCSCCO1	{41: 2, 11: 12, 23: 4}
OK	296-40-2	C1CSCCSCCOCCSCCSCCO1	{41: 4, 11: 12, 23: 2}
OK	296-56-0	C1CCCCCCCCCCCCCCCCCCC1	{11: 20}
OK	296-78-6	C1CCCCCCCCCCCCCCCCCCCC1	{11: 21}
OK	296-86-6	C1CCCCCCCCCCCCCCCCCCCCC1	{11: 22}
OK	29602-44-6	C(CCCC(=O)OCCO)CCCC(=O)OCCO	{28: 2, 2: 11, 20: 2}
OK	29605-88-7	CC1=C(C(=O)CC1O)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 11: 1, 12: 1, 15: 2, 20: 1, 25: 1}
OK	29606-79-9	CC1CCC(C(=O)C1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 2, 25: 1}
OK	2961-80-0	C1=CC1=O	{25: 1, 14: 2}
OK	29617-66-1	C[C@@H](C(=O)O)Cl	{27: 1, 1: 1, 3: 1, 17: 1}
OK	29619-64-5	CCCCCCCCC(C)C(=O)OC	{1: 3, 2: 7, 3: 1, 28: 1}
OK	29624-17-7	C1C[C@@H](C[C@H](C1)Br)Br	{18: 2, 11: 4, 12: 2}
OK	2964-06-9	CCC1(C(=O)NC(=O)NC1=O)C(C)CC(C)C	{32: 2, 1: 4, 2: 2, 3: 2, 13: 1, 25: 3}
OK	29653-30-3	COC(=O)C(C(=O)OC)(Cl)Cl	{1: 2, 4: 1, 28: 2, 17: 2}
OK	29655-34-3	CN(C(=O)NCCCl)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 17: 1, 24: 1, 29: 1, 31: 1}
OK	29662-90-6	CCCCCCC(C)(C)C(=O)O	{1: 3, 2: 5, 27: 1, 4: 1}
OK	29664-53-7	CCCCCCCCCCCCCCCNC	{1: 2, 2: 14, 31: 1}
OK	29668-65-3	C=CCCCON=O	{34: 1, 5: 1, 6: 1, 2: 3, 22: 1, 29: 1}
OK	29671-92-9	C(=N)(N)Cl.Cl	{17: 2, 36: 1, 30: 1, 7: 1}
OK	29674-47-3	CCC(C(=O)OC)O	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	29686-12-2	C(CCO)CC(=O)N	{24: 1, 2: 4, 20: 1, 30: 1}
OK	2969-81-5	CCOC(=O)CCCBr	{1: 1, 2: 4, 28: 1, 18: 1}
OK	2969-87-1	COC(=O)CCCCC(=O)OC=C	{1: 1, 2: 4, 28: 2, 5: 1, 6: 1}
OK	297-03-0	C1CCCCCCCCCCCCCCCCCCCCCCC1	{11: 24}
OK	297-16-5	C1CCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 26}
OK	297-23-4	C1CCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 27}
OK	297-24-5	C1CCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 28}
OK	297-35-8	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 30}
OK	297-39-2	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 32}
OK	297-50-7	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 36}
OK	297-54-1	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 40}
OK	297-58-5	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 42}
OK	297-60-9	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 45}
OK	297-63-2	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 54}
OK	297-76-7	CC(=O)O[C@H]1CC[C@@H]2[C@H]3CC[C@]4([C@H]([C@@H]3CCC2=C1)CC[C@]4(C#C)OC(=O)C)C	{1: 3, 9: 1, 10: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 2}
OK	297-78-9	C12C(C(OC1Cl)Cl)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{17: 8, 23: 1, 12: 4, 13: 3, 15: 2}
OK	29709-05-5	CCC(C)CCCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 10, 3: 1}
OK	29709-08-8	CCC(C)CCCCCCCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 14, 3: 1}
OK	2971-79-1	COC(=O)C1CCNCC1	{32: 1, 1: 1, 11: 4, 12: 1, 28: 1}
OK	29710-31-4	CCCCCCCCCCCCCCCCOC(=O)CCCCCCC	{1: 2, 2: 21, 28: 1}
OK	29710-34-7	CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC	{1: 2, 2: 23, 28: 1}
OK	29714-87-2	CC(C)/C=C/C=C(\C)/C=C	{1: 3, 3: 1, 5: 1, 6: 4, 7: 1}
OK	2972-20-5	C=C1CC2CCC1CC2	{11: 5, 12: 2, 5: 1, 15: 1}
OK	2972-95-4	CC([N+](=O)[O-])([N+](=O)[O-])Cl	{1: 1, 4: 1, 38: 2, 17: 1}
OK	2973-00-4	C([N+](=O)[O-])([N+](=O)[O-])(Br)Br	{18: 2, 4: 1, 38: 2}
OK	29733-18-4	CC(C)CCCCCCCOC(=O)CCCC(=O)OCCCCCCCC(C)C	{1: 4, 2: 17, 3: 2, 28: 2}
OK	29733-86-6	C(CO)C=CO	{2: 2, 20: 2, 6: 2}
OK	29752-80-5	CCCCCC(=O)N(CCO)CCO	{24: 1, 1: 1, 2: 8, 20: 2, 33: 1}
OK	29759-77-1	C1CC=C=C=CCC1.C1/C=C\C=C/C=C\C1.C/1/C=C\C=C/C/C=C1	{8: 2, 11: 8, 14: 14}
OK	29764-08-7	C=CCOCC(CO)OCC=C	{2: 4, 3: 1, 5: 2, 6: 2, 20: 1, 22: 2}
OK	29765-76-2	CC(=C)CC(CC(=C)C)O	{1: 2, 2: 2, 3: 1, 5: 2, 7: 2, 20: 1}
OK	29772-40-5	CCCCC(C)(C(C)(C)C)O	{1: 5, 2: 3, 4: 2, 20: 1}
OK	29776-96-3	C=C=CC=C=C	{8: 2, 5: 2, 6: 2}
OK	2978-35-0	C(#N)N=C(N)N=C(N)N	{34: 2, 37: 1, 30: 3, 7: 2}
OK	2978-58-7	CC(C)(C#C)N	{1: 2, 10: 1, 4: 1, 30: 1, 9: 1}
OK	2978-60-1	CC(C)(C=C)N	{1: 2, 30: 1, 4: 1, 5: 1, 6: 1}
OK	29780-00-5	COC(=O)CCCCCCCCCCC=C	{1: 1, 2: 10, 28: 1, 5: 1, 6: 1}
OK	29782-65-8	CC(C)C(C)C1(CC1C(C)C2CCC3C2(CCC4C3CC=C5C4(CCC(C5)O)C)C)C	{1: 7, 3: 3, 11: 9, 12: 6, 13: 3, 14: 1, 15: 1, 20: 1}
OK	2979-19-3	CC1(CCCC(=O)C1)C	{1: 2, 11: 4, 13: 1, 25: 1}
OK	2979-24-0	COC1CCCCC1O	{1: 1, 11: 4, 12: 2, 22: 1, 20: 1}
OK	29791-12-6	C[C](C)C=C	{1: 2, 5: 1, 6: 1, 7: 1}
OK	29798-87-6	C1C2C1C(=O)CC2=O	{25: 2, 11: 2, 12: 2}
OK	298-12-4	C(=O)C(=O)O	{26: 1, 27: 1}
OK	2980-69-0	CCCCCCCC(C)CCC	{1: 3, 2: 8, 3: 1}
OK	2980-71-4	CCCCCCCC(=C)C	{1: 2, 2: 6, 5: 1, 7: 1}
OK	29804-22-6	CCCCCCCCCC[C@@H]1[C@@H](O1)CCCCC(C)C	{1: 3, 2: 13, 3: 1, 12: 2, 23: 1}
OK	29804-89-5	C(=C=O)Cl	{8: 1, 17: 1, 29: 1, 6: 1}
OK	29806-73-3	CCCCCCCCCCCCCCCC(=O)OCC(CC)CCCC	{1: 3, 2: 19, 3: 1, 28: 1}
OK	29809-34-5	C(C(C(C(C(C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 41, 19: 1, 4: 20}
OK	2981-10-4	C1CCN(CC1)C2=CCCCC2	{33: 1, 11: 9, 14: 1, 15: 1}
OK	29811-50-5	CCCCCCCCOC(=O)C(C)CC	{1: 3, 2: 8, 3: 1, 28: 1}
OK	29812-79-1	CCCCCCCCCCON	{1: 1, 2: 9, 30: 1, 22: 1}
OK	29817-35-4	CC(=O)NNC	{24: 1, 1: 2, 31: 2}
OK	29823-16-3	CCOC(=O)C(CCCBr)Br	{1: 1, 2: 4, 3: 1, 28: 1, 18: 2}
OK	29823-18-5	CCOC(=O)CCCCCCBr	{1: 1, 2: 7, 28: 1, 18: 1}
OK	2983-37-1	CCCCC(CC)C(=O)OCC	{1: 3, 2: 5, 3: 1, 28: 1}
OK	2983-38-2	CCC(CC)C(=O)OCC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	29833-69-0	CCCCCCCCCCCCCC(=C)C	{1: 2, 2: 12, 5: 1, 7: 1}
OK	29836-26-8	CCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O	{1: 1, 2: 8, 12: 5, 20: 4, 22: 1, 23: 1}
OK	29837-12-5	C12C3C4C1=C5C2C3=C45	{12: 4, 15: 4}
OK	29837-19-2	CCC=CCC=CC=CC=C	{1: 1, 2: 2, 5: 1, 6: 7}
OK	2984-50-1	CCCCCCC1CO1	{1: 1, 2: 5, 11: 1, 12: 1, 23: 1}
OK	2984-55-6	CCCCCCCCCCC(C(=O)O)O	{27: 1, 1: 1, 2: 9, 3: 1, 20: 1}
OK	29843-58-1	C/C(=C\CCl)/CCl	{1: 1, 2: 2, 17: 2, 6: 1, 7: 1}
OK	29843-62-7	CCCCC(CCC(C)C)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	29847-17-4	CN(C(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC)CO)O)O)N=O	{1: 2, 2: 1, 33: 1, 12: 5, 34: 1, 20: 3, 22: 1, 23: 1, 24: 1, 29: 1, 31: 1}
OK	29855-05-8	CC/1C/C=C\C(C(C2C(O2)CC/C=C1)C)C	{1: 3, 11: 3, 12: 5, 14: 4, 23: 1}
OK	2986-50-7	CC(C)COC1CCCCCCCCCCC1	{1: 2, 2: 1, 3: 1, 11: 11, 12: 1, 22: 1}
OK	2986-54-1	COC1CCCCCCCCCCC1	{1: 1, 11: 11, 12: 1, 22: 1}
OK	29868-01-7	C(CO)N.C(C(C(=O)O)O)C(=O)O	{27: 2, 2: 3, 3: 1, 20: 2, 30: 1}
OK	29868-02-8	C(CO)N(CCO)CCO.C(C(C(=O)O)O)C(=O)O	{27: 2, 33: 1, 2: 7, 3: 1, 20: 4}
OK	2987-16-8	CC(C)(C)CC=O	{1: 3, 2: 1, 4: 1, 26: 1}
OK	2987-17-9	C1CC(C1)C=O	{26: 1, 11: 3, 12: 1}
OK	29870-28-8	CN(C)CCO.C(C(C(=O)O)O)(C(=O)O)O	{1: 2, 2: 2, 3: 2, 33: 1, 20: 3, 27: 2}
OK	29873-33-4	CCCCCCCCCCCCSCCCN	{40: 1, 1: 1, 2: 14, 30: 1}
OK	29882-56-2	CC[C@H](C)I	{19: 1, 1: 2, 2: 1, 3: 1}
OK	29887-11-4	CCC(CO)C(CC)O	{1: 2, 2: 3, 3: 2, 20: 2}
OK	29887-56-7	COC1CCCC1OC	{1: 2, 11: 3, 12: 2, 22: 2}
OK	29887-60-3	COC1CCCCC1OC	{1: 2, 11: 4, 12: 2, 22: 2}
OK	29893-12-7	CC1=CC(=NCCN1)C.OCl(=O)(=O)=O	{32: 1, 1: 2, 35: 1, 11: 2, 14: 1, 15: 2, 17: 1, 20: 1, 29: 3}
OK	299-70-7	C([C@@H]([C@H](CBr)O)O)Br	{2: 2, 3: 2, 20: 2, 18: 2}
OK	29910-43-8	C1CCC2CC(C(CC2C1)N)O	{20: 1, 11: 6, 12: 4, 30: 1}
OK	29911-27-1	CCCOCC(C)OCC(C)O	{1: 3, 2: 4, 3: 2, 20: 1, 22: 2}
OK	29911-28-2	CCCCOCC(C)OCC(C)O	{1: 3, 2: 5, 3: 2, 20: 1, 22: 2}
OK	29914-92-9	CCCOOCCC	{1: 2, 2: 4, 22: 2}
OK	29916-45-8	CC(C)C(C)(CBr)Br	{1: 3, 2: 1, 3: 1, 4: 1, 18: 2}
OK	29921-57-1	CC(C)OC(=O)CBr	{1: 2, 2: 1, 3: 1, 28: 1, 18: 1}
OK	29926-41-8	CC(=O)C1=NCCS1	{1: 1, 35: 1, 41: 1, 11: 2, 15: 1, 24: 1}
OK	2993-85-3	C=CC(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 3: 1, 4: 5, 5: 1, 6: 1, 16: 12, 28: 1}
OK	2994-16-3	CCCCCCCCCCOC(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 1: 1, 2: 9, 4: 3, 28: 1}
OK	2994-71-0	C1(C(C(C1(F)F)(F)F)(C(F)(F)F)F)(C(F)(F)F)F	{16: 12, 4: 2, 13: 4}
OK	29941-82-0	CCOC1=CCCCC1=O	{1: 1, 2: 1, 11: 3, 14: 1, 15: 1, 22: 1, 25: 1}
OK	29943-42-8	C1COCCC1=O	{25: 1, 11: 4, 23: 1}
OK	29964-84-9	CC(C)CCCCCCCOC(=O)C(=C)C	{1: 3, 2: 7, 3: 1, 5: 1, 7: 1, 28: 1}
OK	2997-01-5	C(CN)COCCOCCCN	{2: 8, 30: 2, 22: 2}
OK	2997-85-5	CCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCC	{1: 2, 2: 14, 28: 2, 6: 2}
OK	2997-92-4	CC(C)(C(=N)N)N=NC(C)(C)C(=N)N.Cl.Cl	{1: 4, 34: 2, 4: 2, 7: 2, 17: 2, 36: 2, 30: 2}
OK	29972-79-0	COC(=O)CCCCCCCCCC=C	{1: 1, 2: 9, 28: 1, 5: 1, 6: 1}
OK	29974-68-3	C1CCC(C(CC1)Br)Br	{18: 2, 11: 5, 12: 2}
OK	29974-69-4	C1CCCC(C(CC1)Br)Br	{18: 2, 11: 6, 12: 2}
OK	29976-53-2	CCOC(=O)N1CCC(=O)CC1	{1: 1, 2: 1, 33: 1, 11: 4, 25: 1, 28: 1}
OK	29978-55-0	CC12CC1(C(=O)CC2=O)C	{1: 2, 11: 2, 13: 2, 25: 2}
OK	2998-04-1	C=CCOC(=O)CCCCC(=O)OCC=C	{2: 6, 28: 2, 5: 2, 6: 2}
OK	2998-08-5	CCC(C)OC(=O)C=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 28: 1}
OK	2998-18-7	CCC(C)OC(=O)C(=C)C	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1, 28: 1}
OK	2998-23-4	CCCCCOC(=O)C=C	{1: 1, 2: 4, 28: 1, 5: 1, 6: 1}
OK	300-08-3	CN1CCC=C(C1)C(=O)OC.Br	{1: 2, 33: 1, 11: 3, 14: 1, 15: 1, 18: 1, 28: 1}
OK	300-68-5	C1CCN(C1)CC#CCN2CCCC2.Cl.Cl	{17: 2, 2: 2, 11: 8, 10: 2, 33: 2}
OK	300-85-6	CC(CC(=O)O)O	{27: 1, 1: 1, 2: 1, 3: 1, 20: 1}
OK	3000-39-3	CC(=O)O[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@H]3CCC(=C4)OC5CCCC5)C)C#C	{1: 2, 9: 1, 10: 1, 11: 11, 12: 5, 13: 2, 14: 2, 15: 2, 22: 1, 28: 1}
OK	30007-47-7	C1C(COCO1)([N+](=O)[O-])Br	{18: 1, 11: 3, 13: 1, 38: 1, 23: 2}
OK	3001-65-8	CC(CO)SC(C)CO	{40: 1, 1: 2, 2: 2, 3: 2, 20: 2}
OK	3001-66-9	CCCCCCC(C)S	{1: 2, 2: 5, 3: 1, 39: 1}
OK	3001-72-7	C1CC2=NCCCN2C1	{33: 1, 11: 6, 35: 1, 15: 1}
OK	30015-57-7	CC1(CC2CCN1C(C2)(C)C)C.Br	{1: 4, 33: 1, 11: 4, 12: 1, 13: 2, 18: 1}
OK	3002-18-4	CC(=O)OCCN(CCOC(=O)C)CCOC(=O)C	{1: 3, 2: 6, 28: 3, 33: 1}
OK	3002-20-8	CCCCCCCCCCCC(=O)OCCN(CCOC(=O)CCCCCCCCCCC)CCOC(=O)CCCCCCCCCCC	{1: 3, 2: 36, 28: 3, 33: 1}
OK	3002-22-0	CCCCCCCCCCCCCCCCCC(=O)OCCN(CCOC(=O)CCCCCCCCCCCCCCCCC)CCOC(=O)CCCCCCCCCCCCCCCCC	{1: 3, 2: 54, 28: 3, 33: 1}
OK	3002-23-1	CC(C)CC(=O)CC(=O)C	{24: 2, 1: 3, 2: 2, 3: 1}
OK	3002-24-2	CCC(=O)CC(=O)C	{24: 2, 1: 2, 2: 2}
OK	3002-57-1	CCCCCCCCCCCCCCCCCN(C)C	{1: 3, 2: 16, 33: 1}
OK	30025-38-8	CCOC(C)COCC(C)O.CCOCC(C)OCC(C)O	{1: 6, 2: 6, 3: 4, 20: 2, 22: 4}
OK	3003-84-7	C1CC(OC1)CCl	{17: 1, 2: 1, 11: 3, 12: 1, 23: 1}
OK	30031-64-2	C1[C@H](O1)[C@@H]2CO2	{11: 2, 12: 2, 23: 2}
OK	3004-93-1	CCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 5, 3: 1}
OK	30046-31-2	C(CI)C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 25, 2: 2, 19: 1, 4: 12}
OK	3005-27-4	CN1C(=O)C(=C(C1=O)Br)Br	{1: 1, 18: 2, 25: 2, 33: 1, 15: 2}
OK	3007-19-0	CC(C)(C)C1CCC(CC1)(OOC(C)(C)C)OOC(C)(C)C	{1: 9, 4: 3, 11: 4, 12: 1, 13: 1, 22: 4}
OK	3007-31-6	CCCCCCCCCCCCNCCCCCCCCCCCC	{1: 2, 2: 22, 31: 1}
OK	3007-53-2	CCCCCCCCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 10, 33: 1}
OK	300711-92-6	CCCCCCCCCCCCCCCCCC(=O)OC.CC1(CC(CC(N1OCC(C)(C)O)(C)C)O)C	{1: 8, 2: 17, 4: 1, 33: 1, 11: 2, 12: 1, 13: 2, 20: 2, 22: 1, 28: 1}
OK	3008-39-7	C1CCC(=O)C(=O)CC1	{25: 2, 11: 5}
OK	3008-42-2	CC1CCC(=O)C(=O)C1	{1: 1, 11: 3, 12: 1, 25: 2}
OK	30086-02-3	CCC=CC=CC(=O)C	{24: 1, 1: 2, 2: 1, 6: 4}
OK	3009-34-5	C1C(=O)C=CC(=O)C1=N	{25: 2, 11: 1, 36: 1, 14: 2, 15: 1}
OK	30093-91-5	CCCCCCCCCCCCCCCC(=O)OCCS	{1: 1, 2: 16, 28: 1, 39: 1}
OK	30093-99-3	CC1(COC=N1)C	{1: 2, 35: 1, 11: 1, 13: 1, 14: 1, 23: 1}
OK	30095-63-7	CCC1(CO1)C	{1: 2, 2: 1, 11: 1, 13: 1, 23: 1}
OK	301-00-8	CCC=CCC=CCC=CCCCCCCCC(=O)OC	{1: 2, 2: 10, 28: 1, 6: 6}
OK	301-02-0	CCCCCCCC/C=C\CCCCCCCC(=O)N	{24: 1, 1: 1, 2: 14, 30: 1, 6: 2}
OK	301-11-1	CCCCCCCCCCCC(=O)OCCSC#N	{40: 1, 1: 1, 2: 12, 28: 1, 37: 1}
OK	3010-02-4	CCN(CC)CC#N	{1: 2, 2: 3, 37: 1, 33: 1}
OK	3010-03-5	C1CCN(CC1)CC#N	{33: 1, 2: 1, 11: 5, 37: 1}
OK	3010-04-6	CCCCNCC#N	{1: 1, 2: 4, 37: 1, 31: 1}
OK	3010-23-9	CCCCCCCCCCCCCCCCCC1=NCCN1CCN	{1: 1, 2: 18, 35: 1, 33: 1, 11: 2, 15: 1, 30: 1}
OK	3010-96-6	CC1(C(C(C1O)(C)C)O)C	{1: 4, 12: 2, 13: 2, 20: 2}
OK	30113-45-2	CC(C)CCCCCCCOCCCN	{1: 2, 2: 10, 3: 1, 30: 1, 22: 1}
OK	3012-69-9	CCCCCC1C(O1)CC2C(O2)CCCCCCCC(=O)O	{1: 1, 2: 12, 27: 1, 12: 4, 23: 2}
OK	30121-98-3	C(=NC(Cl)(Cl)Cl)=O	{8: 1, 17: 3, 34: 1, 4: 1, 29: 1}
OK	30122-12-4	CCC(CCCl)Cl	{1: 1, 2: 3, 3: 1, 17: 2}
OK	30136-13-1	CCCOCCCO	{1: 1, 2: 5, 20: 1, 22: 1}
OK	30137-97-4	CC(C)CCCCCOC(=O)C=CC(=O)O	{1: 2, 2: 5, 3: 1, 6: 2, 27: 1, 28: 1}
OK	30145-51-8	CC(C)(COC(=O)C=C)COC(=O)C(C)(C)COC(=O)C=C	{1: 4, 2: 3, 4: 2, 5: 2, 6: 2, 28: 3}
OK	3015-65-4	CCCCCCCCCCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 12, 33: 1}
OK	30154-99-5	C1CC=C=CCCC=C=C1	{8: 2, 11: 4, 14: 4}
OK	3016-19-1	C/C=C(\C)/C=C/C=C(C)C	{1: 4, 6: 4, 7: 2}
OK	30168-23-1	C1CC2C(C1)C3CC2CC3=CCCC=O	{2: 2, 6: 1, 11: 5, 12: 4, 15: 1, 26: 1}
OK	30168-50-4	CC1(CCCC1)[N+](=O)[O-]	{1: 1, 11: 4, 13: 1, 38: 1}
OK	3017-67-2	CCCCCCCCC(=C)Br	{1: 1, 2: 7, 18: 1, 5: 1, 7: 1}
OK	3017-69-4	CC(=CBr)C	{1: 2, 18: 1, 6: 1, 7: 1}
OK	3017-70-7	CC(=C(C)Br)C	{1: 3, 18: 1, 7: 2}
OK	3017-71-8	C/C=C(\C)/Br	{1: 2, 18: 1, 6: 1, 7: 1}
OK	3017-95-6	CC(CCl)Br	{1: 1, 2: 1, 3: 1, 18: 1, 17: 1}
OK	3017-96-7	CC(CBr)Cl	{1: 1, 2: 1, 3: 1, 18: 1, 17: 1}
OK	3018-09-5	C(=CBr)Cl	{17: 1, 18: 1, 6: 2}
OK	3018-12-0	C(#N)C(Cl)Cl	{17: 2, 3: 1, 37: 1}
OK	30188-50-2	CCCCC1NCCS1	{32: 1, 1: 1, 2: 3, 41: 1, 11: 2, 12: 1}
OK	3019-04-3	CC(=O)CI	{24: 1, 1: 1, 2: 1, 19: 1}
OK	3019-25-8	CC(=O)C1CCC1	{24: 1, 1: 1, 11: 3, 12: 1}
OK	3019-71-4	C(=NC(=O)C(Cl)(Cl)Cl)=O	{34: 1, 4: 1, 8: 1, 17: 3, 24: 1, 29: 1}
OK	302-01-2	NN	{30: 2}
OK	302-17-0	C(C(Cl)(Cl)Cl)(O)O	{17: 3, 3: 1, 4: 1, 20: 2}
OK	302-22-7	CC(=O)C1(CCC2C1(CCC3C2C=C(C4=CC(=O)CCC34C)Cl)C)OC(=O)C	{1: 4, 11: 6, 12: 3, 13: 3, 14: 2, 15: 2, 17: 1, 24: 1, 25: 1, 28: 1}
OK	302-23-8	CC(=O)[C@]1(CC[C@@H]2C1(CC[C@H]3C2CCC4=CC(=O)CCC34C)C)OC(=O)C	{1: 4, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 24: 1, 25: 1, 28: 1}
OK	302-66-9	CCC(C)(C#C)OC(=O)N	{1: 2, 2: 1, 4: 1, 9: 1, 10: 1, 28: 1, 30: 1}
OK	302-72-7	CC(C(=O)O)N	{27: 1, 1: 1, 3: 1, 30: 1}
OK	302-79-4	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)O)/C)/C	{1: 5, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 27: 1}
OK	302-84-1	C(C(C(=O)O)N)O	{27: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	3021-63-4	C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 22, 4: 10}
OK	3021-73-6	C1CCC2(CCCCC2C1)C(=O)O	{27: 1, 11: 8, 12: 1, 13: 1}
OK	3021-89-4	CCCCCCC=C(CCCCC)C=O	{1: 2, 2: 9, 26: 1, 6: 1, 7: 1}
OK	30218-85-0	CC1=C(C2(CC2C3C1O3)C(=O)OC)C(=O)OC	{1: 3, 11: 1, 12: 3, 13: 1, 15: 2, 23: 1, 28: 2}
OK	3022-41-1	C1CCCCC#CCCC1	{10: 2, 11: 8}
OK	30232-11-2	CC(=O)OC1(CCCCC1)C	{1: 2, 11: 5, 28: 1, 13: 1}
OK	30242-05-8	C(CO)COCCCOCCCOCCCO	{2: 12, 20: 2, 22: 3}
OK	3025-30-7	CCCCC/C=C\C=C\C(=O)OCC	{1: 2, 2: 5, 28: 1, 6: 4}
OK	3025-88-5	CC(C)(CCC(C)(C)OO)OO	{1: 4, 2: 2, 4: 2, 22: 2, 20: 2}
OK	3025-96-5	CC(=O)NCCCC(=O)O	{24: 1, 1: 1, 2: 3, 27: 1, 31: 1}
OK	30259-83-7	CC(C)CCCCCOC(=O)CSCC(=O)OCCCCCC(C)C	{40: 1, 1: 4, 2: 12, 3: 2, 28: 2}
OK	30290-64-3	C(C([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F	{16: 2, 2: 2, 4: 2, 38: 4, 22: 1}
OK	302911-94-0	CC(C)[C@@H]1CO[C@@]2(N1C(=O)C=C2)C	{1: 3, 3: 1, 33: 1, 11: 1, 12: 1, 13: 1, 14: 2, 23: 1, 25: 1}
OK	30293-86-8	CC(C)C(C(=O)OC)N=C=O	{1: 3, 34: 1, 3: 2, 8: 1, 28: 1, 29: 1}
OK	30294-54-3	C1CC2=CC=CC2=C1	{11: 2, 14: 4, 15: 2}
OK	30297-14-4	CC1CC2CCCCC2=CC1=O	{1: 1, 11: 5, 12: 2, 14: 1, 15: 1, 25: 1}
OK	303-04-8	C(=C(C(F)(F)F)Cl)(C(F)(F)F)Cl	{16: 6, 17: 2, 4: 2, 7: 2}
OK	303-33-3	CC(C)C(C(C)OC)(C(=O)OCC1=CCN2C1C(CC2)O)O	{1: 4, 2: 1, 3: 2, 4: 1, 33: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 2, 22: 1, 28: 1}
OK	303-34-4	CC=C(C)C(=O)OC1CCN2C1C(=CC2)COC(=O)C(C(C)OC)(C(C)(C)O)O	{1: 6, 2: 1, 3: 1, 4: 2, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 2, 22: 1, 28: 2}
OK	303-43-5	CCCCCCCCC=CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C	{1: 6, 2: 17, 3: 2, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	303-98-0	CC1=C(C(=O)C(=C(C1=O)OC)OC)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C	{1: 14, 2: 19, 6: 10, 7: 10, 15: 4, 22: 2, 25: 2}
OK	3030-47-5	CN(C)CCN(C)CCN(C)C	{1: 5, 2: 4, 33: 3}
OK	3031-66-1	CC(C#CC(C)O)O	{1: 2, 10: 2, 3: 2, 20: 2}
OK	3031-68-3	C(C#CC#CCO)O	{2: 2, 20: 2, 10: 4}
OK	3031-73-0	COO	{1: 1, 20: 1, 22: 1}
OK	3031-74-1	CCOO	{1: 1, 2: 1, 20: 1, 22: 1}
OK	3031-75-2	CC(C)OO	{1: 2, 3: 1, 20: 1, 22: 1}
OK	3031-98-9	COC(=O)C(=O)[C@H]([C@@H]([C@H](CO)O)O)O	{1: 1, 2: 1, 3: 3, 20: 4, 24: 1, 28: 1}
OK	30310-22-6	CC(C)CC(C)Br	{1: 3, 2: 1, 3: 2, 18: 1}
OK	30310-80-6	C1[C@H](CN([C@@H]1C(=O)O)N=O)O	{33: 1, 34: 1, 11: 2, 12: 2, 20: 1, 27: 1, 29: 1}
OK	30315-46-9	CC(C)(C)NC[C@@H](CO)O	{1: 3, 2: 2, 3: 1, 4: 1, 20: 2, 31: 1}
OK	30320-26-4	C(=C(C(F)(F)F)C(F)(F)F)(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(F)F	{16: 18, 4: 7, 7: 2}
OK	3033-62-3	CN(C)CCOCCN(C)C	{1: 4, 2: 4, 22: 1, 33: 2}
OK	30334-71-5	CCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCC	{1: 2, 2: 30, 3: 1, 20: 1, 28: 2}
OK	30346-23-7	CC1(CCCC(=CC(=O)OC)C1)C	{1: 3, 6: 1, 11: 4, 13: 1, 15: 1, 28: 1}
OK	3035-75-4	CC(CCC(CCC(C)CC(C)(C)C)CCC(C)CC(C)(C)C)CC(C)(C)C	{1: 12, 2: 9, 3: 4, 4: 3}
OK	30353-70-9	C1CC12C=CC=CC23CC3	{11: 4, 13: 2, 14: 4}
OK	30358-36-2	C1C2C=CC1C3C2C4C3C4	{11: 2, 12: 6, 14: 2}
OK	3036-66-6	COC=CC=C	{1: 1, 22: 1, 5: 1, 6: 3}
OK	30361-28-5	CCC/C=C/C=C/C=O	{1: 1, 2: 2, 26: 1, 6: 4}
OK	30361-29-6	CCCCCCC=CC=CC=O	{1: 1, 2: 5, 26: 1, 6: 4}
OK	30361-33-2	CCCCCC=CC=CC(=O)O	{1: 1, 2: 4, 27: 1, 6: 4}
OK	30389-18-5	C#CC1(CCCCC1)N	{9: 1, 10: 1, 11: 5, 13: 1, 30: 1}
OK	30389-25-4	C=CC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 21, 4: 10, 5: 1, 6: 1}
OK	3039-55-2	C(C=C(Cl)Cl)O	{17: 2, 2: 1, 20: 1, 6: 1, 7: 1}
OK	30398-61-9	CCCCCCCCCCOC(=O)C(=C)C.CC(C)N(CCOC(=O)C(=C)C)C(C)C	{1: 7, 2: 11, 3: 2, 5: 2, 7: 2, 33: 1, 28: 2}
OK	3040-44-6	C1CCN(CC1)CCO	{33: 1, 2: 2, 11: 5, 20: 1}
OK	30406-18-9	CCCCCCC(=O)NO	{24: 1, 1: 1, 2: 5, 20: 1, 31: 1}
OK	3041-16-5	C1COC(=O)CO1	{11: 3, 28: 1, 23: 1}
OK	30414-53-0	CCC(=O)CC(=O)OC	{24: 1, 1: 2, 2: 2, 28: 1}
OK	30418-89-4	CCCCCCC=CCOC(=O)C	{1: 2, 2: 6, 28: 1, 6: 2}
OK	30427-51-1	CCCCCCCCCCCCCCCCCCN(CC)CC	{1: 3, 2: 19, 33: 1}
OK	3043-33-2	CC=C=C(C)C	{8: 1, 1: 3, 6: 1, 7: 1}
OK	30432-16-7	C(C(=C(CBr)CBr)CBr)Br	{2: 4, 18: 4, 7: 2}
OK	30434-54-9	CC(C)COC(=O)C=C(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1, 28: 1}
OK	30434-65-2	CC1=CC(=O)CC1(C)C	{1: 3, 11: 1, 13: 1, 14: 1, 15: 1, 25: 1}
OK	3044-06-2	CCOC(=C(C(=O)OCC)C(=O)OCC)C	{1: 4, 2: 3, 28: 2, 22: 1, 7: 2}
OK	30442-79-6	CC(=O)C(C)(C)N([N+](=O)C(C)(C)C(=O)C)[O-]	{24: 2, 1: 6, 4: 2, 29: 2, 33: 2}
OK	30453-31-7	CCCSSCC	{40: 2, 1: 2, 2: 3}
OK	30453-93-1	CCCCN1C(=O)C(C(=O)NC1=O)(CC=C)CC=C	{32: 1, 1: 1, 2: 5, 5: 2, 6: 2, 33: 1, 13: 1, 25: 3}
OK	30460-34-5	CC(=O)O[C@@H]1CC23C[C@@](C([C@@H]2OC(=O)C)CC[C@H]3[C@@]([C@H]4[C@]1(C([C@H](C4)O)(C)C)O)(C)O)(C)O	{1: 6, 11: 5, 12: 6, 13: 5, 20: 4, 28: 2}
OK	30460-36-7	CC1=CC23C[C@H]([C@]4([C@@H](C[C@@H](C4(C)C)O)[C@]([C@@H]2CCC1[C@@H]3O)(C)O)O)O	{1: 4, 11: 4, 12: 6, 13: 4, 14: 1, 15: 1, 20: 5}
OK	30460-92-5	CC1(C2CC1C(=C)C(=O)C2)C	{1: 2, 5: 1, 11: 2, 12: 2, 13: 1, 15: 1, 25: 1}
OK	30467-62-0	CC1(C(=O)C(N=N1)(C)C)C	{1: 4, 35: 2, 13: 2, 25: 1}
OK	3047-32-3	CCC1(COC1)CO	{1: 1, 2: 2, 11: 2, 13: 1, 20: 1, 23: 1}
OK	3047-38-9	C1CC=C(C1)C#N	{11: 3, 37: 1, 14: 1, 15: 1}
OK	3048-64-4	C=CC1CC2CC1C=C2	{14: 2, 11: 2, 12: 3, 5: 1, 6: 1}
OK	3048-65-5	C1C=CCC2C1CC=C2	{11: 3, 12: 2, 14: 4}
OK	30485-71-3	C1CC(CCC1O)Cl	{17: 1, 11: 4, 12: 2, 20: 1}
OK	30496-78-7	CC1C(C2CC1C3C2CCC3)C	{1: 2, 11: 4, 12: 6}
OK	30498-63-6	CC1CCCCC1(C)C	{1: 3, 11: 4, 12: 1, 13: 1}
OK	305-62-4	C(CN)C(C(=O)O)N	{27: 1, 2: 2, 3: 1, 30: 2}
OK	30502-73-9	CC(=O)CCCCCC(=O)C	{24: 2, 1: 2, 2: 5}
OK	30507-70-1	CC=CCC=CCCCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 4}
OK	30515-28-7	C(CCCBr)CCC(=O)O	{2: 6, 27: 1, 18: 1}
OK	30538-80-8	CCCCCCCCCN1CCCCC1	{1: 1, 2: 8, 11: 5, 33: 1}
OK	3054-63-5	CCCC(CCC)CCCCC(CCC)CCC	{1: 4, 2: 12, 3: 2}
OK	3054-92-0	CC(C)C(C)(C(C)C)O	{1: 5, 3: 2, 4: 1, 20: 1}
OK	3054-95-3	CCOC(C=C)OCC	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 22: 2}
OK	30540-31-9	CC(C)C(C)CBr	{1: 3, 2: 1, 3: 2, 18: 1}
OK	30541-56-1	C1C2CC3CC1CC(C2)C3=C4C5CC6CC(C5)CC4C6	{11: 10, 12: 8, 15: 2}
OK	30545-14-3	C1C2CC3C4C1C5CC(C4)CC3(C5C2)O	{20: 1, 11: 6, 12: 7, 13: 1}
OK	30545-23-4	C1C2CC3C4C1C5CC(C4)C(=O)C3C5C2	{25: 1, 11: 5, 12: 8}
OK	30545-24-5	C1C2CC3C4C1C5CC(C4)C(C3C5C2)O	{20: 1, 11: 5, 12: 9}
OK	3055-93-4	CCCCCCCCCCCCOCCOCCO	{1: 1, 2: 15, 20: 1, 22: 2}
OK	3055-94-5	CCCCCCCCCCCCOCCOCCOCCO	{1: 1, 2: 17, 20: 1, 22: 3}
OK	3055-95-6	CCCCCCCCCCCCOCCOCCOCCOCCOCCO	{1: 1, 2: 21, 20: 1, 22: 5}
OK	3055-97-8	CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCO	{1: 1, 2: 25, 20: 1, 22: 7}
OK	30558-43-1	CN(C)C(=O)/C(=N/O)/SC	{1: 3, 34: 1, 33: 1, 40: 1, 7: 1, 20: 1, 24: 1}
OK	30558-50-0	CN(C)C(=O)C(=NO)Cl	{1: 2, 34: 1, 33: 1, 7: 1, 17: 1, 20: 1, 24: 1}
OK	30562-34-6	CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)OC)C)OC)OC(=O)N)C)C)O)OC	{32: 1, 1: 7, 11: 2, 12: 6, 14: 5, 15: 5, 20: 1, 22: 3, 25: 3, 28: 1, 30: 1}
OK	30563-30-5	CCC(=O)O.C=CCCCO	{1: 1, 2: 4, 5: 1, 6: 1, 20: 1, 27: 1}
OK	30572-96-4	C1CCCCC(C(CCC1)O)O	{20: 2, 11: 8, 12: 2}
OK	30574-44-8	CC(CCC=C(C)COC(=O)C)C=C	{1: 3, 2: 3, 3: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	30574-97-1	CC=C(C)C#N	{1: 2, 37: 1, 6: 1, 7: 1}
OK	3058-01-3	CC(CCC(=O)O)CC(=O)O	{27: 2, 1: 1, 2: 3, 3: 1}
OK	3058-04-6	C1C2(COC(O1)CCC#N)COC(OC2)CCC#N	{2: 4, 37: 2, 11: 4, 12: 2, 13: 1, 23: 4}
OK	30582-73-1	CCCCOC(=O)/C=C\C(=O)OCCCC.CC(=C)C(=O)OCC1CO1.CC(=O)OC=C.C=CC(=O)O	{1: 4, 2: 7, 5: 3, 6: 4, 7: 1, 11: 1, 12: 1, 23: 1, 27: 1, 28: 4}
OK	30586-18-6	CCCCCC(C)(C)C(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	306-37-6	CNNC.Cl.Cl	{1: 2, 31: 2, 17: 2}
OK	306-67-2	C(CCNCCCN)CNCCCN.Cl.Cl.Cl.Cl	{17: 4, 2: 10, 30: 2, 31: 2}
OK	306-83-2	C(C(F)(F)F)(Cl)Cl	{16: 3, 17: 2, 3: 1, 4: 1}
OK	306-91-2	C12(C3(C(C(C(C1(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)(F)F)(F)F)(C(C(C(C3(F)F)(F)F)(F)F)(F)F)F)F)F	{16: 24, 13: 14}
OK	306-92-3	C12(C(C(C(C(C1(C(F)(F)F)F)(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F	{16: 20, 4: 1, 13: 10}
OK	306-94-5	C12(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F	{16: 18, 13: 10}
OK	306-98-9	C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F)(C(F)(F)F)F	{16: 16, 4: 2, 13: 6}
OK	3061-65-2	CC(=O)OC(=C)C#N	{1: 1, 37: 1, 28: 1, 5: 1, 7: 1}
OK	30618-84-9	C(C(COC(=O)CS)O)O	{28: 1, 2: 3, 3: 1, 20: 2, 39: 1}
OK	3062-07-5	CC(C)[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)N	{1: 2, 2: 2, 3: 3, 24: 1, 27: 2, 30: 1, 31: 1}
OK	3063-04-5	C(C(C1C(C(C(C(=O)O1)O)O)O)O)O	{20: 5, 2: 1, 3: 1, 12: 4, 28: 1}
OK	3063-94-3	CC(=C)C(=O)OC(C(F)(F)F)C(F)(F)F	{1: 1, 3: 1, 4: 2, 5: 1, 7: 1, 16: 6, 28: 1}
OK	30630-16-1	CC(C)[C@H]1CC[C@@](C=C1)(C)O	{1: 3, 3: 1, 11: 2, 12: 1, 13: 1, 14: 2, 20: 1}
OK	3064-61-7	CC(COC(=O)C=C)OC(=O)CC(=O)C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 24: 1, 28: 2}
OK	3065-46-1	CN(C)CCOCCOCCN(C)C	{1: 4, 2: 6, 22: 2, 33: 2}
OK	3065-71-2	CCN1CCSC1=CC=CC2=[N+](CCS2)CC.[I-]	{1: 2, 2: 2, 6: 3, 33: 2, 41: 2, 11: 4, 15: 2, 19: 1}
OK	30651-03-7	C1C2CC3C4C1C5CC(C4)(CC3C5C2)O	{20: 1, 11: 6, 12: 7, 13: 1}
OK	3066-65-7	CCOC(=O)NCCCCCCNC(=O)OCC	{1: 2, 2: 8, 28: 2, 31: 2}
OK	3066-71-5	C=CC(=O)OC1CCCCC1	{28: 1, 11: 5, 12: 1, 5: 1, 6: 1}
OK	3066-72-6	C=CC(=O)NC1CCCCC1	{5: 1, 6: 1, 11: 5, 12: 1, 24: 1, 31: 1}
OK	30667-81-3	CC(C)(C)CC(CC(C)(C)C)C(=O)O	{27: 1, 1: 6, 2: 2, 3: 1, 4: 2}
OK	30673-36-0	CCCCCCCCCC(=O)OCCCC	{1: 2, 2: 11, 28: 1}
OK	30673-38-2	CCCCCCCCCC(=O)OCC(C)C	{1: 3, 2: 9, 3: 1, 28: 1}
OK	30673-60-0	CCCCCCCCCC(=O)OCCC	{1: 2, 2: 10, 28: 1}
OK	30674-80-7	CC(=C)C(=O)OCCN=C=O	{1: 1, 2: 2, 5: 1, 7: 1, 8: 1, 34: 1, 28: 1, 29: 1}
OK	3068-00-6	C(CO)C(CO)O	{2: 3, 3: 1, 20: 3}
OK	3068-32-4	CC(=O)OCC1C(C(C(C(O1)Br)OC(=O)C)OC(=O)C)OC(=O)C	{1: 4, 2: 1, 12: 5, 18: 1, 23: 1, 28: 4}
OK	3068-88-0	CC1CC(=O)O1	{1: 1, 11: 1, 12: 1, 28: 1}
OK	30680-84-3	CC1(CCCC1=O)C(=O)OC	{1: 2, 11: 3, 28: 1, 13: 1, 25: 1}
OK	30685-43-9	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5C[C@H]([C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)O)C)C)C)O)OC	{1: 6, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 5, 22: 4, 23: 3, 28: 1}
OK	30692-16-1	CCCCCCCCC(=O)CCCC	{24: 1, 1: 2, 2: 10}
OK	307-24-4	C(=O)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 11, 27: 1, 4: 5}
OK	307-26-6	C(C(C(C(F)(Cl)Cl)(F)F)(F)Cl)(C(C(F)(F)Cl)(F)Cl)(F)F	{16: 9, 17: 5, 4: 6}
OK	307-29-9	C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N	{16: 15, 2: 1, 4: 7, 30: 1}
OK	307-30-2	C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 15, 20: 1, 2: 1, 4: 7}
OK	307-34-6	C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 18, 4: 8}
OK	307-37-9	C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 19, 20: 1, 2: 1, 4: 9}
OK	307-45-9	C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 22, 4: 10}
OK	307-46-0	C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 21, 20: 1, 2: 1, 4: 10}
OK	307-55-1	C(=O)(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 23, 27: 1, 4: 11}
OK	307-59-5	C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 26, 4: 12}
OK	307-60-8	C(C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 25, 19: 1, 4: 12}
OK	307-62-0	C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 30, 4: 14}
OK	307-63-1	C(C(C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 29, 19: 1, 4: 14}
OK	307-70-0	C(C(C(C(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 20, 20: 1, 2: 1, 3: 1, 4: 9}
OK	307-78-8	C(=O)(C(C(C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 16, 27: 2, 4: 8}
OK	307-79-9	COC(=O)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 19, 1: 1, 4: 9, 28: 1}
OK	307-98-2	C=CC(=O)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 7, 5: 1, 6: 1, 16: 15, 28: 1}
OK	3070-53-9	C=CCCCC=C	{2: 3, 5: 2, 6: 2}
OK	30718-63-9	CC(=C1CCCCCCC1)C	{15: 1, 1: 2, 11: 7, 7: 1}
OK	30719-18-7	CC(C(=O)C)I	{19: 1, 1: 2, 3: 1, 24: 1}
OK	3072-02-4	CCCCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCCCC	{1: 2, 2: 26, 28: 2}
OK	3072-03-5	CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCC	{1: 2, 2: 42, 28: 2}
OK	3072-13-7	CCCCCC=CCC=CCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 12, 30: 1, 6: 4}
OK	30725-00-9	CC1(O[C@@H]2[C@H](OC(=O)[C@@H]2O1)CO)C	{1: 2, 2: 1, 12: 3, 13: 1, 20: 1, 23: 2, 28: 1}
OK	30727-14-1	CCN1CCC(C1)O	{1: 1, 2: 1, 33: 1, 11: 3, 12: 1, 20: 1}
OK	30727-18-5	CCOC(=O)C1CCCCN1C	{1: 2, 2: 1, 33: 1, 11: 4, 12: 1, 28: 1}
OK	30727-29-8	CN(C)C1CCCCC1O	{1: 2, 11: 4, 12: 2, 20: 1, 33: 1}
OK	3073-56-1	CC(CNC(=O)C)NC(=O)C	{24: 2, 1: 3, 2: 1, 3: 1, 31: 2}
OK	3073-59-4	CC(=O)NCCCCCCNC(=O)C	{24: 2, 1: 2, 2: 6, 31: 2}
OK	3073-66-3	CC1CCCC(C1)(C)C	{1: 3, 11: 4, 12: 1, 13: 1}
OK	3073-92-5	CCCCOCCC	{1: 2, 2: 5, 22: 1}
OK	30734-81-7	CCC(N)N(C)C	{1: 3, 2: 1, 3: 1, 30: 1, 33: 1}
OK	3074-61-1	CCCC1=CCCC1	{1: 1, 2: 2, 11: 3, 14: 1, 15: 1}
OK	3074-64-4	CCCCC(=C(C)C)C	{1: 4, 2: 3, 7: 2}
OK	3074-67-7	CCC/C(=C(\C)/CC)/C	{1: 4, 2: 3, 7: 2}
OK	3074-71-3	CCCCC(C)C(C)C	{1: 4, 2: 3, 3: 2}
OK	3074-75-7	CCC(CC)CC(C)C	{1: 4, 2: 3, 3: 2}
OK	3074-76-8	CCCC(C)(CC)CC	{1: 4, 2: 4, 4: 1}
OK	3074-77-9	CCC(C)C(CC)CC	{1: 4, 2: 3, 3: 2}
OK	3074-78-0	CC(C)CCCC(=C)C	{1: 3, 2: 3, 3: 1, 5: 1, 7: 1}
OK	30753-73-2	CC(C)CCCCCOC(=O)CCl	{1: 2, 2: 6, 3: 1, 28: 1, 17: 1}
OK	3076-04-8	CCCCCCCCCCCCCOC(=O)C=C	{1: 1, 2: 12, 28: 1, 5: 1, 6: 1}
OK	30769-88-1	CC(=C)C(=O)SCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 11, 5: 1, 7: 1, 40: 1, 16: 23, 24: 1}
OK	30769-91-6	CC(=C)C(=O)SCCC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 7, 5: 1, 7: 1, 40: 1, 16: 15, 24: 1}
OK	3077-27-8	CCCCCCCCCCCCCCCCCCNC(=O)C=CC(=O)O	{1: 1, 2: 17, 6: 2, 24: 1, 27: 1, 31: 1}
OK	3077-37-0	CCCCCCCCC(=O)N(CCO)CCO	{24: 1, 1: 1, 2: 11, 20: 2, 33: 1}
OK	30772-72-6	C1CC2CC1C3C2C(CC3)C(=O)O	{27: 1, 11: 5, 12: 5}
OK	30788-35-3	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OCCO)C)C	{1: 5, 2: 5, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 22: 1}
OK	30798-32-4	CC(CN)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 1, 2: 3, 3: 1, 4: 1, 20: 2, 27: 3, 30: 1}
OK	308-24-7	C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 11, 12: 1, 13: 5}
OK	308-48-5	C(C(C(F)(F)F)(F)F)(C(OC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 18, 4: 8, 22: 1}
OK	3080-69-1	CCCCCCC1OCCC(O1)C	{1: 2, 2: 5, 11: 2, 12: 2, 23: 2}
OK	3083-10-1	CN(C)CCN(C)CCN(C)CCN(C)C	{1: 6, 2: 6, 33: 4}
OK	3083-23-6	C1C(O1)C(Cl)(Cl)Cl	{23: 1, 12: 1, 11: 1, 4: 1, 17: 3}
OK	3083-25-8	C1C(O1)CC(Cl)(Cl)Cl	{2: 1, 4: 1, 11: 1, 12: 1, 17: 3, 23: 1}
OK	30830-20-7	C1CC2=C1CC2	{11: 4, 15: 2}
OK	30834-47-0	C1CC2(CCC(=O)C=C2)CC=C1	{25: 1, 11: 5, 13: 1, 14: 4}
OK	30834-51-6	C1CC2(CC3CC2C=C3)C=CC1=O	{25: 1, 11: 4, 12: 2, 13: 1, 14: 4}
OK	3085-36-7	CC(C)COCO	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	3085-76-5	CC(C)N(C#N)C(C)C	{1: 4, 3: 2, 37: 1, 33: 1}
OK	30860-22-1	C1CC2CC1C(C2=O)Cl	{17: 1, 11: 3, 12: 3, 25: 1}
OK	3088-41-3	C1CCN(CC1)CCC#N	{33: 1, 2: 2, 11: 5, 37: 1}
OK	3088-42-4	C(CNCC(=O)O)C#N	{2: 3, 27: 1, 37: 1, 31: 1}
OK	3088-44-6	C=CCOCCC#N	{2: 3, 22: 1, 5: 1, 6: 1, 37: 1}
OK	3089-24-5	CC(CCO)CC(C)(C)CO	{1: 3, 2: 4, 3: 1, 4: 1, 20: 2}
OK	3089-25-6	CC(CC(C)(C)CCO)CO	{1: 3, 2: 4, 3: 1, 4: 1, 20: 2}
OK	30893-52-8	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OCOCC([N+](=O)[O-])([N+](=O)[O-])F	{16: 1, 2: 3, 4: 2, 38: 5, 22: 2}
OK	30895-77-3	C=CCOC(=O)C(Cl)Cl	{2: 1, 3: 1, 5: 1, 6: 1, 17: 2, 28: 1}
OK	30897-75-7	CC1(C2CC=C(C1C2)CC=O)C	{1: 2, 2: 1, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 26: 1}
OK	30899-62-8	CCCCCCCCCCCC(=O)OCC(COC(=O)C)OC(=O)C	{1: 3, 2: 12, 3: 1, 28: 3}
OK	309-00-2	C1[C@@H]2C=C[C@H]1[C@H]3[C@@H]2[C@]4(C(=C([C@@]3(C4(Cl)Cl)Cl)Cl)Cl)Cl	{11: 1, 12: 4, 13: 3, 14: 2, 15: 2, 17: 6}
OK	3090-56-0	C=CSCCO	{40: 1, 2: 2, 20: 1, 5: 1, 6: 1}
OK	3093-35-4	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3C[C@@H]5[C@]4(OC(O5)(C)C)C(=O)CCl)C)O)F	{1: 4, 2: 1, 11: 6, 12: 4, 13: 5, 14: 1, 15: 1, 16: 1, 17: 1, 20: 1, 23: 2, 24: 1, 25: 1}
OK	30950-27-7	CC(=C)C1CCC(=CC1)/C=N/O	{1: 1, 34: 1, 5: 1, 6: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	30951-88-3	CCCCCCCCCCCCCCCCN(CC)CC	{1: 3, 2: 17, 33: 1}
OK	30951-95-2	CC/C(=C(\C)/CC)/C	{1: 4, 2: 2, 7: 2}
OK	30956-28-6	C(C(=O)NN)Cl	{24: 1, 17: 1, 2: 1, 30: 1, 31: 1}
OK	30956-43-5	CCCCCC(C)OC(=O)CC(C)O	{1: 3, 2: 5, 3: 2, 20: 1, 28: 1}
OK	30964-00-2	C#CCCCCC(=O)O	{9: 1, 2: 4, 27: 1, 10: 1}
OK	30964-01-3	C#CCCCCCCC(=O)O	{9: 1, 2: 6, 27: 1, 10: 1}
OK	30967-37-4	C1CC2CC1C[CH]2	{11: 4, 12: 2, 14: 1}
OK	3097-63-0	C1CC2C1C=C2	{11: 2, 12: 2, 14: 2}
OK	30979-68-1	COC1=CCCC=C1	{1: 1, 11: 2, 22: 1, 14: 3, 15: 1}
OK	30980-11-1	C1CCC(CC1)N=S=O	{40: 1, 34: 1, 11: 5, 12: 1, 29: 1}
OK	30982-03-7	CCCCCCCCC(=O)OCC(C)C	{1: 3, 2: 8, 3: 1, 28: 1}
OK	30983-85-8	C1CC2CC1CC2I	{19: 1, 11: 4, 12: 3}
OK	30984-28-2	CC(C)C(=O)CC(=O)C(F)(F)F	{1: 2, 2: 1, 3: 1, 4: 1, 16: 3, 24: 2}
OK	30992-29-1	CC(C)(C)OC(=O)NC(C)(C)C(=O)O	{1: 5, 27: 1, 4: 2, 28: 1, 31: 1}
OK	310-71-4	CCOC(C(F)Cl)(F)F	{1: 1, 2: 1, 3: 1, 4: 1, 16: 3, 17: 1, 22: 1}
OK	3100-04-7	CC1=CC1	{1: 1, 11: 1, 14: 1, 15: 1}
OK	3100-36-5	C1CCCC=CCCCCCCC(=O)CCC1	{25: 1, 11: 13, 14: 2}
OK	31014-51-4	CCN(CC)CCNC(=O)C=C	{1: 2, 2: 4, 5: 1, 6: 1, 33: 1, 24: 1, 31: 1}
OK	31018-29-8	CC(C)(C#N)N([N+](=O)C(C)(C)C#N)[O-]	{1: 4, 37: 2, 4: 2, 29: 2, 33: 2}
OK	3102-57-6	CCCCCCCCCCCCCC=C[C@H]([C@H](CO)NC(=O)C)O	{1: 2, 2: 13, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	31023-92-4	C1CC2CCCN(C1)CCC2	{33: 1, 11: 9, 12: 1}
OK	3103-38-6	CC(=O)CC(=O)NCC(=O)O	{24: 2, 1: 1, 2: 2, 27: 1, 31: 1}
OK	31039-88-0	CC1(CC(=CC(=O)C1)N(C)C)C	{1: 4, 33: 1, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	3105-29-1	C1C2C3C2CC4C1C4C3	{11: 3, 12: 6}
OK	3105-95-1	C1CCN[C@@H](C1)C(=O)O	{27: 1, 32: 1, 11: 4, 12: 1}
OK	3108-24-5	CCOC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 15, 1: 1, 2: 1, 4: 7, 28: 1}
OK	31080-39-4	CCCCCC(CCC)C(=O)O	{27: 1, 1: 2, 2: 6, 3: 1}
OK	31081-16-0	CNC(=NC)N(C)C	{1: 4, 34: 1, 31: 1, 33: 1, 7: 1}
OK	31081-18-2	CCCCC(CCC)CC(C)CC	{1: 4, 2: 7, 3: 2}
OK	31081-41-1	CN=C(N)N(C)C	{1: 3, 34: 1, 33: 1, 30: 1, 7: 1}
OK	31083-44-0	C1CCC2CC2C3CC3C1	{11: 6, 12: 4}
OK	31087-44-2	CCC[C@@H](C)O	{1: 2, 2: 2, 3: 1, 20: 1}
OK	31089-24-4	CC1=C(C(=O)CC1)C(C)C	{11: 2, 1: 3, 3: 1, 25: 1, 15: 2}
OK	311-75-1	C1C2CC1C2	{11: 3, 12: 2}
OK	311-89-7	C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 27, 33: 1, 4: 12}
OK	31107-44-5	C12C3C(C4(C(=C(C3(C4(Cl)Cl)Cl)Cl)Cl)Cl)OC1C5(C(=C(C2(C5(Cl)Cl)Cl)Cl)Cl)Cl	{17: 12, 23: 1, 12: 4, 13: 6, 15: 4}
OK	31110-30-2	CC=CC(=O)N	{24: 1, 1: 1, 30: 1, 6: 2}
OK	3113-98-2	C[C@@H](C1CCCCC1)O	{11: 5, 1: 1, 3: 1, 12: 1, 20: 1}
OK	3114-46-3	C(#CBr)C#N	{10: 2, 18: 1, 37: 1}
OK	31147-36-1	CC(=CCCC(=CCOCC=C(C)CCC=C(C)C)C)C	{1: 6, 2: 6, 22: 1, 6: 4, 7: 4}
OK	31147-56-5	C[C@@H]1CC[C@@](C1(C)C)(C)C(=O)O	{27: 1, 1: 4, 11: 2, 12: 1, 13: 2}
OK	3115-28-4	CCCCC(CCCC)C(=O)O	{27: 1, 1: 2, 2: 6, 3: 1}
OK	31158-92-6	CCCCCCCCCCCCCCCCCC(=O)OC(C)(C)C	{1: 4, 2: 16, 4: 1, 28: 1}
OK	3116-33-4	CCCC(CCC)C(=O)N1CCCCC1	{1: 2, 2: 4, 3: 1, 33: 1, 11: 5, 24: 1}
OK	31167-90-5	C1COC(=O)C1Cl	{17: 1, 11: 2, 12: 1, 28: 1}
OK	31180-77-5	CCOC(C)OC(C)(CCC=C(C)C)C#C	{1: 5, 2: 3, 3: 1, 4: 1, 6: 1, 7: 1, 9: 1, 10: 1, 22: 2}
OK	31180-93-5	CC(=CCCC(=CCC1OCCO1)C)C	{1: 3, 2: 3, 6: 2, 7: 2, 11: 2, 12: 1, 23: 2}
OK	31185-56-5	CC1CNC(O1)C(F)(F)F	{32: 1, 1: 1, 4: 1, 11: 1, 12: 2, 16: 3, 23: 1}
OK	312-84-5	C([C@H](C(=O)O)N)O	{27: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	31207-65-5	CC(=O)OC1(CCC2C(CCCC2(C1CC(=O)O)C)(C)C)C	{1: 5, 2: 1, 11: 5, 12: 2, 13: 3, 27: 1, 28: 1}
OK	3121-61-7	COCCOC(=O)C=C	{1: 1, 2: 2, 5: 1, 6: 1, 22: 1, 28: 1}
OK	3121-79-7	CC(C)(C)CCCO	{1: 3, 2: 3, 4: 1, 20: 1}
OK	3121-82-2	CC(C)(CCCO)CO	{1: 2, 2: 4, 4: 1, 20: 2}
OK	31211-08-2	CC1(C2CC(C1=O)(CC2=O)C)C	{1: 3, 11: 2, 12: 1, 13: 2, 25: 2}
OK	31217-72-8	CCN1C(=O)C=C(C1=O)C	{1: 2, 2: 1, 33: 1, 14: 1, 15: 1, 25: 2}
OK	3123-93-1	CCC=CC(C)(C)C	{1: 4, 2: 1, 4: 1, 6: 2}
OK	3123-97-5	CC1(CCC(=O)O1)C	{1: 2, 11: 2, 28: 1, 13: 1}
OK	3124-93-4	C[C@]12CCC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@]2(C#CCl)O	{1: 1, 10: 2, 11: 8, 12: 2, 13: 2, 14: 1, 15: 3, 17: 1, 20: 1, 25: 1}
OK	31249-95-3	C1COCCNCCOCCOCCN1	{32: 2, 11: 10, 23: 3}
OK	31250-06-3	C1COCCN2CCOCCN1CCOCCOCC2	{33: 2, 11: 14, 23: 4}
OK	31253-02-8	CCOCCOC(=O)C(=C)C#N	{1: 1, 2: 3, 5: 1, 7: 1, 22: 1, 28: 1, 37: 1}
OK	3126-63-4	C1C(O1)COCC(COCC2CO2)(COCC3CO3)COCC4CO4	{2: 8, 4: 1, 11: 4, 12: 4, 22: 4, 23: 4}
OK	3126-95-2	CCCOCC1CO1	{1: 1, 2: 3, 11: 1, 12: 1, 22: 1, 23: 1}
OK	3127-13-7	C(CO)C(CO)(Cl)Cl	{17: 2, 2: 3, 4: 1, 20: 2}
OK	3127-74-0	CC1CCC(C(C1)O)C(C)(C)C	{1: 4, 11: 3, 4: 1, 12: 3, 20: 1}
OK	31272-04-5	CCCC1=NN(C(=O)C1)C	{1: 2, 2: 2, 35: 1, 33: 1, 11: 1, 15: 1, 25: 1}
OK	3128-06-1	CC(=O)CCCC(=O)O	{24: 1, 1: 1, 2: 3, 27: 1}
OK	3128-07-2	CC(=O)CCCCC(=O)O	{24: 1, 1: 1, 2: 4, 27: 1}
OK	31282-04-9	CNC1CC(C(C(C1O)OC2C3C(C(C(O2)CO)O)OC4(O3)C(C(C(C(O4)C(CO)N)O)O)O)O)N	{1: 1, 2: 2, 3: 1, 11: 1, 12: 14, 13: 1, 20: 8, 22: 1, 23: 4, 30: 2, 31: 1}
OK	31282-95-8	C1CC(=O)N(C1)CCl	{17: 1, 2: 1, 11: 3, 33: 1, 25: 1}
OK	31283-43-9	CCCCCCC(=C)Cl	{1: 1, 2: 5, 17: 1, 5: 1, 7: 1}
OK	31294-91-4	CCCC(CC)I	{19: 1, 1: 2, 2: 3, 3: 1}
OK	31294-92-5	CCCCC(CC)I	{19: 1, 1: 2, 2: 4, 3: 1}
OK	31294-93-6	CCCC(CCC)I	{19: 1, 1: 2, 2: 4, 3: 1}
OK	31294-95-8	CCCC(C)(C)I	{1: 3, 2: 2, 19: 1, 4: 1}
OK	31295-56-4	CC(C)CCCCC(C)CCCC(C)C	{1: 5, 2: 7, 3: 3}
OK	3130-19-6	C1CC2C(O2)CC1COC(=O)CCCCC(=O)OCC3CCC4C(C3)O4	{28: 2, 2: 6, 11: 6, 12: 6, 23: 2}
OK	3130-87-8	C(C(C(=O)O)N)C(=O)N	{24: 1, 27: 1, 2: 1, 3: 1, 30: 2}
OK	3131-54-2	CC1=CC(=O)C(=O)C=C1	{1: 1, 25: 2, 14: 3, 15: 1}
OK	3132-64-7	C1C(O1)CBr	{2: 1, 11: 1, 12: 1, 18: 1, 23: 1}
OK	31323-50-9	CCC[C@H]1CCC(=C2C(=O)CCC2=O)O1	{1: 1, 2: 2, 11: 4, 12: 1, 15: 2, 23: 1, 25: 2}
OK	3133-01-5	CCCCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 22, 20: 1}
OK	31330-22-0	CCCCC/C(=N/F)/N(F)F	{1: 1, 2: 4, 33: 1, 7: 1, 34: 1, 16: 3}
OK	31330-63-9	C1(=NNN(C(=N)N)N)N=NN=N1	{33: 1, 34: 1, 35: 4, 36: 1, 7: 1, 15: 1, 30: 2, 31: 1}
OK	31333-13-8	CCCCCC#CCCO	{1: 1, 2: 6, 20: 1, 10: 2}
OK	31334-80-2	CC(C)(C)CCCC(C)(C)CCCO	{1: 5, 2: 6, 4: 2, 20: 1}
OK	31335-74-7	CCCCCCCC(=O)OCC(C)(C)COC(=O)CCCCCCC	{1: 4, 2: 14, 4: 1, 28: 2}
OK	31340-44-0	CC(C(Cl)Cl)(C(=O)O)O	{1: 1, 3: 1, 4: 1, 17: 2, 20: 1, 27: 1}
OK	31357-24-1	CCC=CC=CC	{1: 2, 2: 1, 6: 4}
OK	31357-71-8	C1CC2(C1C2)C#N	{11: 3, 12: 1, 13: 1, 37: 1}
OK	31357-72-9	C1CC2CC2(C1)C#N	{11: 4, 12: 1, 13: 1, 37: 1}
OK	31364-42-8	C1COCCN2CCOCCOCCN1CCOCCOCC2	{33: 2, 11: 16, 23: 5}
OK	31364-57-5	CN([C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)N=O	{1: 1, 2: 1, 33: 1, 12: 5, 34: 1, 20: 4, 23: 1, 29: 1}
OK	31366-25-3	C1=CSC(=C2SC=CS2)S1	{41: 4, 14: 4, 15: 2}
OK	31367-46-1	CCCCC(C)C(C)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	3137-00-6	C=CCOC(=O)CCCCCCCCC(=O)OCC=C	{2: 10, 28: 2, 5: 2, 6: 2}
OK	31375-17-4	CCC(=O)C1CC(CC=C1C)C(C)C	{1: 4, 2: 1, 3: 1, 11: 2, 12: 2, 14: 1, 15: 1, 24: 1}
OK	31376-98-4	CCCC=NOC	{1: 2, 2: 2, 34: 1, 22: 1, 6: 1}
OK	3139-91-1	CC(=C)C(=O)OCC1CS1	{1: 1, 2: 1, 5: 1, 7: 1, 41: 1, 11: 1, 12: 1, 28: 1}
OK	31410-01-2	C=CCN1C=CN=C1	{33: 1, 2: 1, 35: 1, 5: 1, 6: 1, 14: 3}
OK	3142-58-3	CC(=O)C(C)(C)C(=O)C	{24: 2, 1: 4, 4: 1}
OK	3142-66-3	CCC(C(=O)C)O	{24: 1, 1: 2, 2: 1, 3: 1, 20: 1}
OK	3142-72-1	CCC=C(C)C(=O)O	{1: 2, 2: 1, 27: 1, 6: 1, 7: 1}
OK	31423-92-4	C(CCl)C=CCl	{17: 2, 2: 2, 6: 2}
OK	3143-02-0	CC1(COC1)CO	{1: 1, 2: 1, 11: 2, 13: 1, 20: 1, 23: 1}
OK	31442-54-3	CN(C)CCOC=C	{1: 2, 2: 2, 5: 1, 6: 1, 33: 1, 22: 1}
OK	31452-80-9	C1C(O1)COCC2CO2.C(C(CO)(CBr)CBr)O	{2: 6, 4: 1, 11: 2, 12: 2, 18: 2, 20: 2, 22: 1, 23: 2}
OK	3146-40-5	C[C@@H](C(=O)NCC(=O)NCC(=O)O)N	{1: 1, 2: 2, 3: 1, 24: 2, 27: 1, 30: 1, 31: 2}
OK	3146-66-5	CCCCC1(C(=O)NC(=O)NC1=O)CC=C	{32: 2, 1: 1, 2: 4, 5: 1, 6: 1, 13: 1, 25: 3}
OK	31463-35-1	C=C1C2CCC1CC2	{11: 4, 12: 2, 5: 1, 15: 1}
OK	31478-84-9	CC(C)CCCCCCCCCCCCCCC(=O)OC(C)C	{1: 4, 2: 14, 3: 2, 28: 1}
OK	3148-09-2	C[C@@H]1CCOC(=O)/C=C/C=C\C(=O)O[C@@H]2C[C@@H]3[C@]4([C@]2([C@]5(CCC(=C[C@H]5O3)C)COC(=O)[C@H]1O)C)CO4	{1: 3, 11: 7, 12: 5, 13: 3, 14: 5, 15: 1, 20: 1, 23: 2, 28: 3}
OK	3148-72-9	C(C(CN(CC(=O)O)CC(=O)O)O)N(CC(=O)O)CC(=O)O	{27: 4, 33: 2, 2: 6, 3: 1, 20: 1}
OK	3148-73-0	CC(=O)NNC(=O)C	{24: 2, 1: 2, 31: 2}
OK	3149-68-6	COC1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O	{1: 1, 2: 1, 12: 5, 20: 4, 22: 1, 23: 1}
OK	31499-72-6	CC1=CCCC(C1CCC(=O)C)(C)C	{1: 4, 2: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	315-22-0	CC1C(=O)OC2CCN3C2C(=CC3)COC(=O)C(C1(C)O)(C)O	{1: 3, 33: 1, 11: 4, 12: 3, 13: 2, 14: 1, 15: 1, 20: 2, 28: 2}
OK	315-37-7	CCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C	{1: 3, 2: 5, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	31501-11-8	CCCCCC(=O)OCCC=CCC	{1: 2, 2: 7, 28: 1, 6: 2}
OK	31502-19-9	CCC=CCCCCCO	{1: 1, 2: 6, 20: 1, 6: 2}
OK	31506-43-1	CN(C)CCCNC(=O)N	{1: 2, 2: 3, 33: 1, 24: 1, 30: 1, 31: 1}
OK	31508-12-0	CCCCC#CCC=C	{1: 1, 2: 4, 10: 2, 5: 1, 6: 1}
OK	3151-59-5	CCCCCCCCCCCCCCCCN.F	{16: 1, 1: 1, 2: 15, 30: 1}
OK	31516-63-9	CC=CCC#C	{1: 1, 2: 1, 10: 1, 6: 2, 9: 1}
OK	31517-61-0	CC1=CC(=O)C2CC1C(=O)C=C2C	{1: 2, 11: 1, 12: 2, 14: 2, 15: 2, 25: 2}
OK	3153-33-1	CCCCOC(=O)CCCCl	{1: 1, 2: 6, 28: 1, 17: 1}
OK	3153-36-4	CCOC(=O)CCCCl	{1: 1, 2: 4, 28: 1, 17: 1}
OK	3153-37-5	COC(=O)CCCCl	{1: 1, 2: 3, 28: 1, 17: 1}
OK	3155-43-9	C(CCCCCCCCCO)CCCCCCCCO	{2: 18, 20: 2}
OK	31556-45-3	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCC	{1: 2, 2: 28, 28: 1}
OK	3156-70-5	CC=C[N+](=O)[O-]	{1: 1, 38: 1, 6: 2}
OK	3156-73-8	CC(C[N+](=O)[O-])O	{1: 1, 2: 1, 3: 1, 20: 1, 38: 1}
OK	3156-74-9	CCC(C[N+](=O)[O-])O	{1: 1, 2: 2, 3: 1, 20: 1, 38: 1}
OK	31561-59-8	C1CC12C3(C24CC4)CC3	{11: 6, 13: 3}
OK	31563-51-6	CCCCCCCC1COCCC1Cl	{1: 1, 2: 6, 11: 3, 12: 2, 17: 1, 23: 1}
OK	31563-52-7	CCCC1COCCC1Cl	{1: 1, 2: 2, 11: 3, 12: 2, 17: 1, 23: 1}
OK	31565-19-2	CC(C)CCCCCOC(=O)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	31570-39-5	C/C/1=C\CC/C(=C/C[C@@H](CC/C(=C/CC1)/C)C(=C)C)/C	{1: 4, 5: 1, 7: 1, 11: 7, 12: 1, 14: 3, 15: 3}
OK	31576-51-9	COCCOCCN	{1: 1, 2: 4, 30: 1, 22: 2}
OK	3158-26-7	CCCCCCCCN=C=O	{8: 1, 1: 1, 2: 7, 34: 1, 29: 1}
OK	31586-84-2	C1[CH]O1	{11: 1, 14: 1, 23: 1}
OK	31604-55-4	CCCCCCCCCCCCCCCCCC(C)N	{1: 2, 2: 16, 3: 1, 30: 1}
OK	3161-99-7	C#CC#CC#C	{9: 2, 10: 4}
OK	31616-72-5	CC1=CC(=O)C2CC1C(=CC2=O)C	{1: 2, 11: 1, 12: 2, 14: 2, 15: 2, 25: 2}
OK	316186-17-1	CC(C1(C=CC(O1)OC)OC)O	{1: 3, 3: 1, 12: 1, 13: 1, 14: 2, 20: 1, 22: 2, 23: 1}
OK	3162-62-7	CCCCCCCCCC(Cl)Cl	{1: 1, 2: 8, 3: 1, 17: 2}
OK	31635-40-2	CC(=O)N(C12CC3CC(C1)CC(C3)C2)OCCN(C)C.Cl	{1: 3, 2: 2, 33: 2, 11: 6, 12: 3, 13: 1, 17: 1, 22: 1, 24: 1}
OK	3164-73-6	C1CCC(CC1)(C[N+](=O)[O-])O	{2: 1, 11: 5, 20: 1, 13: 1, 38: 1}
OK	31642-67-8	C=CCCCCCCC(=O)O	{2: 6, 27: 1, 5: 1, 6: 1}
OK	31678-74-7	C1CC2C=CC3C2C1C=C3	{11: 2, 12: 4, 14: 4}
OK	3168-90-9	CC1=C(CCC1)C(=O)C	{24: 1, 1: 2, 11: 3, 15: 2}
OK	31685-31-1	[N+](F)F	{16: 2, 34: 1}
OK	3169-10-6	C1CCC(=O)C1.C1N(CN(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{25: 1, 11: 8, 38: 4, 33: 4}
OK	31699-35-1	CC#CCCCC#CC	{1: 2, 2: 3, 10: 4}
OK	31699-38-4	CC#CCCCCCCC#CC	{1: 2, 2: 6, 10: 4}
OK	3170-58-9	C1CC[CH]CC1	{11: 5, 14: 1}
OK	3170-79-4	[C](C(C(F)(F)F)(F)F)(F)F	{16: 7, 4: 2, 7: 1}
OK	3170-83-0	O[O-]	{20: 1, 29: 1}
OK	31702-33-7	CC(=C(Cl)Cl)CCl	{1: 1, 2: 1, 17: 3, 7: 2}
OK	31717-87-0	CC1CN(CC(O1)C)C2CCCCCCCCCCC2.CC(=O)O	{1: 3, 33: 1, 11: 13, 12: 3, 23: 1, 27: 1}
OK	3173-53-3	C1CCC(CC1)N=C=O	{8: 1, 34: 1, 11: 5, 12: 1, 29: 1}
OK	3173-79-3	CC(=C1C(C(=O)O1)(C)C)C	{1: 4, 15: 1, 28: 1, 13: 1, 7: 1}
OK	3174-67-2	CCC(CCO)O	{1: 1, 2: 3, 3: 1, 20: 2}
OK	3174-74-1	C1COCC=C1	{11: 3, 14: 2, 23: 1}
OK	3175-23-3	CC(CCl)(Cl)Cl	{1: 1, 2: 1, 4: 1, 17: 3}
OK	31756-97-5	CCCCCCCCCCCCCC(=O)O.C(CO)N	{1: 1, 2: 14, 27: 1, 20: 1, 30: 1}
OK	3177-74-0	CCC(C)(C)CC(=O)O	{1: 3, 2: 2, 27: 1, 4: 1}
OK	31772-05-1	C(CCCCCCBr)CCCCCCBr	{2: 13, 18: 2}
OK	31778-15-1	CCCCCCCCCCCCCCCCCCOC(=O)CCS	{1: 1, 2: 19, 28: 1, 39: 1}
OK	3178-22-1	CC(C)(C)C1CCCCC1	{1: 3, 11: 5, 4: 1, 12: 1}
OK	3178-23-2	C1CCC(CC1)CC2CCCCC2	{2: 1, 11: 10, 12: 2}
OK	3178-24-3	C1CCC(CC1)CCCC2CCCCC2	{2: 3, 11: 10, 12: 2}
OK	3178-29-8	CCCC(CCC)CCC	{1: 3, 2: 6, 3: 1}
OK	3179-47-3	CCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 9, 28: 1, 5: 1, 7: 1}
OK	3179-63-3	CN(C)CCCO	{1: 2, 2: 3, 20: 1, 33: 1}
OK	31795-37-6	CCCCCCC(C=C)OC(=O)C	{1: 2, 2: 5, 3: 1, 5: 1, 6: 1, 28: 1}
OK	31797-64-5	CCC(C)(C)C1CCCCC1	{1: 3, 2: 1, 11: 5, 4: 1, 12: 1}
OK	31805-83-1	CSCC(CSC)O	{40: 2, 1: 2, 2: 2, 3: 1, 20: 1}
OK	31805-84-2	COC(CSC)CSC	{40: 2, 1: 3, 2: 2, 3: 1, 22: 1}
OK	31814-59-2	CCCCC(CC)C(C(=O)C(CC)CCCC)O	{24: 1, 1: 4, 2: 8, 3: 3, 20: 1}
OK	3182-26-1	C(C(Cl)(Cl)Cl)(C(Cl)(Cl)Cl)(F)F	{16: 2, 17: 6, 4: 3}
OK	3182-75-0	CCCCN[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 31: 1}
OK	31827-03-9	CCCCCCNC(=O)CCCCCCCCC(=O)NCCCCCC	{24: 2, 1: 2, 2: 18, 31: 2}
OK	3183-08-2	C([C@@H](C(=O)O)N)SC[C@@H](C(=O)O)N	{27: 2, 40: 1, 2: 2, 3: 2, 30: 2}
OK	3184-13-2	C(C[C@@H](C(=O)O)N)CN.Cl	{27: 1, 17: 1, 2: 3, 3: 1, 30: 2}
OK	31841-77-7	CC(CCC(C)(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	31844-95-8	CCCC(=C)Br	{1: 1, 2: 2, 18: 1, 5: 1, 7: 1}
OK	31844-96-9	CC(C)C(=C)Br	{1: 2, 18: 1, 3: 1, 5: 1, 7: 1}
OK	31844-98-1	CCC=CBr	{1: 1, 2: 1, 18: 1, 6: 2}
OK	31857-89-3	CCCCCCCCCC(=O)CCCC	{24: 1, 1: 2, 2: 11}
OK	3187-27-7	C1CCC(CC1)(CCO)CCO	{2: 4, 11: 5, 20: 2, 13: 1}
OK	3188-00-9	CC1C(=O)CCO1	{1: 1, 11: 2, 12: 1, 25: 1, 23: 1}
OK	3188-13-4	CCOCCl	{1: 1, 2: 2, 22: 1, 17: 1}
OK	31883-98-4	CC1=CCCC(=O)C1	{1: 1, 11: 3, 25: 1, 14: 1, 15: 1}
OK	31895-22-4	CN(C)C1CSSSC1.C(=O)(C(=O)O)O	{1: 2, 33: 1, 41: 3, 11: 2, 12: 1, 27: 2}
OK	31897-92-4	CC(CC12CC3CC(C1)CC(C3)C2Br)NC.Cl	{1: 2, 2: 1, 3: 1, 11: 5, 12: 4, 13: 1, 17: 1, 18: 1, 31: 1}
OK	31897-98-0	C1C2CC3CC1CC(C2)(C3)CCCN.Cl	{2: 3, 11: 6, 12: 3, 13: 1, 17: 1, 30: 1}
OK	31898-11-0	CC(CC12CC3CC(C1)CC(C3)(C2)Br)NC.Cl	{1: 2, 2: 1, 3: 1, 11: 6, 12: 2, 13: 2, 17: 1, 18: 1, 31: 1}
OK	319-78-8	CC[C@@H](C)[C@H](C(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	319-89-1	C1(=C(C(=O)C(=C(C1=O)O)O)O)O	{25: 2, 20: 4, 15: 4}
OK	31906-04-4	CC(C)(CCCC1=CCC(CC1)C=O)O	{1: 2, 2: 3, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1, 26: 1}
OK	31915-75-0	CC[C@@H]1C[C@@H]1CO	{1: 1, 2: 2, 11: 1, 12: 2, 20: 1}
OK	31915-76-1	CC(C)/C=C/OC	{1: 3, 3: 1, 22: 1, 6: 2}
OK	31915-82-9	CC(=O)/C=N\O	{24: 1, 1: 1, 34: 1, 20: 1, 6: 1}
OK	31922-49-3	C=CC(=C)[CH2]	{5: 3, 6: 1, 7: 1}
OK	31930-37-7	CCOC(=O)/C=C/I	{1: 1, 2: 1, 19: 1, 28: 1, 6: 2}
OK	3194-43-2	C1CCCN(CC1)CCCC#N	{33: 1, 2: 3, 11: 6, 37: 1}
OK	3194-57-8	C1CC(C(CCC(C1Br)Br)Br)Br	{18: 4, 11: 4, 12: 4}
OK	31945-18-3	CC(=C)CCC=C(C)CC#N	{1: 2, 2: 3, 37: 1, 6: 1, 7: 2, 5: 1}
OK	3195-24-2	CCOC(=O)C(CC=C)(CC=C)C(=O)OCC	{1: 2, 2: 4, 4: 1, 5: 2, 6: 2, 28: 2}
OK	3195-78-6	CC(=O)N(C)C=C	{24: 1, 1: 2, 5: 1, 6: 1, 33: 1}
OK	3195-79-7	CCN(C=C)C(=O)C	{1: 2, 2: 1, 5: 1, 6: 1, 33: 1, 24: 1}
OK	3195-86-6	CCC1CS1	{1: 1, 2: 1, 11: 1, 12: 1, 41: 1}
OK	31950-56-8	CC(CC=C)Br	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 18: 1}
OK	31954-27-5	CC(C)(C)OC(=O)NCC(=O)OC	{1: 4, 2: 1, 4: 1, 28: 2, 31: 1}
OK	3196-15-4	CCC(C(=O)OC)Br	{1: 2, 2: 1, 3: 1, 28: 1, 18: 1}
OK	3196-23-4	COC(=O)C1(CCCCC1)Br	{1: 1, 18: 1, 11: 5, 28: 1, 13: 1}
OK	3197-42-0	C[C@H]1CCCCN1	{32: 1, 1: 1, 11: 4, 12: 1}
OK	31991-53-4	C1C2CC3C1C3(C2)Br	{18: 1, 11: 3, 12: 3, 13: 1}
OK	320-77-4	C(C(C(C(=O)O)O)C(=O)O)C(=O)O	{27: 3, 2: 1, 3: 2, 20: 1}
OK	3200-96-2	C1(=C(C(C1=O)(Cl)Cl)Cl)Cl	{17: 4, 25: 1, 13: 1, 15: 2}
OK	32001-55-1	C1=CC=NC=C1.F	{16: 1, 35: 1, 14: 5}
OK	32002-24-7	CCOC(=CC(=O)OCC)OCC	{1: 3, 2: 3, 6: 1, 7: 1, 22: 2, 28: 1}
OK	32013-83-5	CCCCCCCCCCCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 16, 3: 1}
OK	3203-99-4	CC[C@H]1[C@H](O1)C	{1: 2, 2: 1, 12: 2, 23: 1}
OK	32038-79-2	C#CO	{9: 1, 10: 1, 20: 1}
OK	32038-83-8	C(#CF)C#N	{16: 1, 10: 2, 37: 1}
OK	3204-37-3	CC1(C(=O)N(C(=O)N1)SC(Cl)(Cl)Cl)C	{32: 1, 1: 2, 4: 1, 33: 1, 40: 1, 13: 1, 17: 3, 25: 2}
OK	3205-11-6	CN(C)CCOCC=C	{1: 2, 2: 3, 5: 1, 6: 1, 33: 1, 22: 1}
OK	32059-15-7	C1CCCNC(CC1)CN=C(N)N	{32: 1, 2: 1, 7: 1, 11: 6, 12: 1, 34: 1, 30: 2}
OK	32064-64-5	CNN.C(=O)(C(=O)O)O	{1: 1, 27: 2, 30: 1, 31: 1}
OK	32064-67-8	CC(C)(C)NN	{1: 3, 4: 1, 30: 1, 31: 1}
OK	32064-72-5	CCCCCC(=O)/C=C/C	{24: 1, 1: 2, 2: 4, 6: 2}
OK	32064-75-8	CCCCCC(=O)C=CC(C)C	{24: 1, 1: 3, 2: 4, 3: 1, 6: 2}
OK	32064-78-1	CCCC(=O)C=CC(C)C	{24: 1, 1: 3, 2: 2, 3: 1, 6: 2}
OK	3207-50-9	CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC1CCCCC1	{1: 1, 2: 12, 6: 4, 11: 5, 12: 1, 24: 1, 31: 1}
OK	32101-29-4	C1CCN2C[C@H]3C[C@H]([C@@H]2C1)CN4C3=CCCC4=O	{33: 2, 11: 9, 12: 3, 14: 1, 15: 1, 25: 1}
OK	3212-15-5	CC1(CC2CCC1C2)O	{1: 1, 11: 4, 12: 2, 13: 1, 20: 1}
OK	3212-60-0	C1CC(C=C1)O	{20: 1, 11: 2, 12: 1, 14: 2}
OK	3212-75-7	C1CC/C=C\C(CC1)O	{20: 1, 11: 5, 12: 1, 14: 2}
OK	3214-41-3	CCCC(=O)CCC(=O)C	{24: 2, 1: 2, 2: 4}
OK	32150-24-6	CC(C)N=CN(C)C	{1: 4, 34: 1, 3: 1, 6: 1, 33: 1}
OK	32150-27-9	CN(C)C=NN(C)C	{1: 4, 34: 1, 6: 1, 33: 2}
OK	3216-98-6	C(CNCCNCCNCCNCCNCCC#N)C#N	{2: 12, 37: 2, 31: 5}
OK	32161-06-1	CC(=O)N1CCC(=O)CC1	{24: 1, 1: 1, 11: 4, 33: 1, 25: 1}
OK	3217-00-3	C(CNCCNCCC#N)C#N	{2: 6, 37: 2, 31: 2}
OK	3217-52-5	C1CCC(=O)N(CC1)C(=O)CCCCC(=O)N2CCCCCC2=O	{24: 2, 25: 2, 2: 4, 11: 10, 33: 2}
OK	3217-86-5	CCCNC(=O)CC	{24: 1, 1: 2, 2: 3, 31: 1}
OK	3217-87-6	C=C1C=CCC=C1	{11: 1, 5: 1, 14: 4, 15: 1}
OK	321744-14-3	CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C[C@@H]1O)C(=O)OC	{1: 4, 4: 1, 11: 2, 12: 3, 20: 1, 28: 2, 31: 1}
OK	321744-16-5	CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C[C@H]1O)C(=O)OC	{1: 4, 4: 1, 11: 2, 12: 3, 20: 1, 28: 2, 31: 1}
OK	321744-17-6	CC(C)(C)OC(=O)N[C@@H]1C[C@H](C[C@@H]1O)C(=O)OC	{1: 4, 4: 1, 11: 2, 12: 3, 20: 1, 28: 2, 31: 1}
OK	321744-18-7	CC(C)(C)OC(=O)N[C@@H]1C[C@H](C[C@H]1O)C(=O)OC	{1: 4, 4: 1, 11: 2, 12: 3, 20: 1, 28: 2, 31: 1}
OK	321744-19-8	CC(C)(C)OC(=O)N[C@H]1C[C@@H](C[C@@H]1O)C(=O)OC	{1: 4, 4: 1, 11: 2, 12: 3, 20: 1, 28: 2, 31: 1}
OK	321744-21-2	CC(C)(C)OC(=O)N[C@H]1C[C@@H](C[C@H]1O)C(=O)OC	{1: 4, 4: 1, 11: 2, 12: 3, 20: 1, 28: 2, 31: 1}
OK	321744-23-4	CC(C)(C)OC(=O)N[C@H]1C[C@H](C[C@H]1O)C(=O)OC	{1: 4, 4: 1, 11: 2, 12: 3, 20: 1, 28: 2, 31: 1}
OK	321744-26-7	CC(C)(C)OC(=O)N1CC[C@@H](C[C@@H]1C(=O)OC)O	{1: 4, 4: 1, 33: 1, 11: 3, 12: 2, 20: 1, 28: 2}
OK	3218-02-8	C1CCC(CC1)CN	{2: 1, 11: 5, 12: 1, 30: 1}
OK	3221-15-6	C1C(S1)CCl	{17: 1, 2: 1, 11: 1, 12: 1, 41: 1}
OK	3221-61-2	CCCCCCC(C)C	{1: 3, 2: 5, 3: 1}
OK	3221-64-5	C1=C/C(=C\NCC(CN/C=C\2/C(=O)C=CC=C2)(CN/C=C\3/C(=O)C=CC=C3)CN/C=C\4/C(=O)C=CC=C4)/C(=O)C=C1	{2: 4, 4: 1, 6: 4, 14: 16, 15: 4, 25: 4, 31: 4}
OK	32210-23-4	CC(=O)OC1CCC(CC1)C(C)(C)C	{1: 4, 11: 4, 4: 1, 12: 2, 28: 1}
OK	32213-88-0	CC(=O)OC1CC(C23CCC(C2)C(C3=C1)(C)C)(C)C	{1: 5, 11: 4, 12: 2, 13: 3, 14: 1, 15: 1, 28: 1}
OK	32214-88-3	CC1=CCC2C(CC2(C)C)C(=C)CCC1O	{1: 3, 5: 1, 11: 4, 12: 3, 13: 1, 14: 1, 15: 2, 20: 1}
OK	32214-91-8	CC1=CCC2C(CC2(C)C)C(=C)CCC1OC(=O)C	{1: 4, 5: 1, 11: 4, 12: 3, 13: 1, 14: 1, 15: 2, 28: 1}
OK	3222-05-7	COC(=O)C(Br)(Br)Br	{1: 1, 18: 3, 4: 1, 28: 1}
OK	32222-06-3	C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C	{1: 4, 2: 3, 3: 1, 4: 1, 5: 1, 6: 2, 11: 7, 12: 4, 13: 1, 15: 3, 20: 3}
OK	32226-54-3	CC1=CCC(C[C@@H]1O)C(C)(C)O	{1: 3, 4: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 2}
OK	3223-70-9	C=C=CCl	{8: 1, 17: 1, 5: 1, 6: 1}
OK	32233-40-2	C1[C@H]([C@@H]([C@@H]2[C@H]1OC(=O)C2)CO)O	{20: 2, 2: 1, 11: 2, 12: 4, 28: 1}
OK	3225-31-8	C[C](C)C#N	{1: 2, 37: 1, 7: 1}
OK	32264-87-2	C1C=CC1=O	{25: 1, 11: 1, 14: 2}
OK	3227-17-6	C[C@](CC(=O)O)(C(=O)O)N	{1: 1, 2: 1, 27: 2, 4: 1, 30: 1}
OK	3227-90-5	C=C1C(=C)C1=C	{5: 3, 15: 3}
OK	3227-91-6	C=C1C(=C)C(=C)C1=C	{5: 4, 15: 4}
OK	3228-31-7	CCOC(=O)C(C)C(CCC#N)(C(=O)OCC)C(=O)OCC	{1: 4, 2: 5, 3: 1, 4: 1, 37: 1, 28: 3}
OK	3228-99-7	C(C(CCl)(CCl)CCl)Cl	{17: 4, 2: 4, 4: 1}
OK	3229-00-3	C(C(CBr)(CBr)CBr)Br	{2: 4, 4: 1, 18: 4}
OK	32296-45-0	CCC1(CCCCC1C)O	{1: 2, 2: 1, 11: 4, 12: 1, 13: 1, 20: 1}
OK	3230-23-7	CCC1CCNCC1	{32: 1, 1: 1, 2: 1, 11: 4, 12: 1}
OK	3230-69-1	CC(C=C)(C#C)O	{1: 1, 4: 1, 5: 1, 6: 1, 9: 1, 10: 1, 20: 1}
OK	3230-76-0	CC1=C(C(CCC1)(C)C)CC=C(C)C(C=CC(=CCO)C)O	{1: 5, 2: 2, 3: 1, 6: 4, 7: 2, 11: 3, 13: 1, 15: 2, 20: 2}
OK	32317-47-8	CCC(=CC)N(C)C	{1: 4, 2: 1, 33: 1, 6: 1, 7: 1}
OK	3232-39-1	CC(=O)SC(=O)C	{24: 2, 1: 2, 40: 1}
OK	3232-62-0	C=CCOC(=O)C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)OCC=C	{2: 2, 5: 2, 6: 2, 12: 2, 13: 3, 15: 2, 17: 6, 28: 2}
OK	3232-84-6	C1(=O)NC(=O)NN1	{32: 3, 25: 2}
OK	32322-73-9	CCC(C)NC(=O)CCl	{1: 2, 2: 2, 3: 1, 17: 1, 24: 1, 31: 1}
OK	32328-03-3	CCOC(=O)CC(CC(=O)OCC)O	{1: 2, 2: 4, 3: 1, 20: 1, 28: 2}
OK	32338-77-5	CCCCOCC1CS1	{1: 1, 2: 4, 41: 1, 11: 1, 12: 1, 22: 1}
OK	3234-02-4	C(C(=C(CO)Br)Br)O	{2: 2, 20: 2, 18: 2, 7: 2}
OK	3234-28-4	CCCCCCCCCCCCC1CO1	{1: 1, 2: 11, 11: 1, 12: 1, 23: 1}
OK	3234-49-9	CCCC(CBr)Br	{1: 1, 2: 3, 3: 1, 18: 2}
OK	3234-54-6	CC=CC(=O)OC=C	{1: 1, 28: 1, 5: 1, 6: 3}
OK	3234-64-8	CCC(CC)(C#C)N	{1: 2, 2: 2, 4: 1, 9: 1, 10: 1, 30: 1}
OK	3234-85-3	CCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCC	{1: 2, 2: 25, 28: 1}
OK	32348-63-3	CC12C3C1C2CCC3	{1: 1, 11: 3, 12: 3, 13: 1}
OK	3235-51-6	COCCN(CCOC)CCOC	{1: 3, 2: 6, 22: 3, 33: 1}
OK	32350-50-8	CC(=O)OC1C2CCC1C3C2C3	{1: 1, 11: 3, 12: 5, 28: 1}
OK	32357-83-8	CCCCCCOCCCCC	{1: 2, 2: 9, 22: 1}
OK	32360-05-7	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 17, 28: 1, 5: 1, 7: 1}
OK	32362-64-4	CC(C)C1(OCC(CO1)(C)C)C	{11: 2, 1: 5, 3: 1, 13: 2, 23: 2}
OK	32362-65-5	CC1(COC(OC1)(C)C(C)(C)C)C	{1: 6, 11: 2, 4: 1, 13: 2, 23: 2}
OK	3237-50-1	C1(=O)C(C(=O)NC(=O)N1)(O)O	{32: 2, 25: 3, 20: 2, 13: 1}
OK	32379-37-6	CC(=O)OC1(CCCCC1)C#N	{1: 1, 11: 5, 28: 1, 13: 1, 37: 1}
OK	3238-60-6	CCCC1CCCCN1	{32: 1, 1: 1, 2: 2, 11: 4, 12: 1}
OK	3238-75-3	CCCN(CCC)CCO	{1: 2, 2: 6, 20: 1, 33: 1}
OK	32388-56-0	CC(=O)C1=C2CC3(CCC2(CC3)C(CC1)(C)C)C	{24: 1, 1: 4, 11: 7, 13: 3, 15: 2}
OK	32398-69-9	CCC#CC(CC)O	{1: 2, 2: 2, 3: 1, 20: 1, 10: 2}
OK	3240-09-3	CC(=C)CCC(=O)C	{24: 1, 1: 2, 2: 2, 5: 1, 7: 1}
OK	3240-94-6	C1COCCN1CCCl	{17: 1, 2: 2, 11: 4, 33: 1, 23: 1}
OK	3241-23-4	CCCCCCCCCC(CCCCCCCCC)N	{1: 2, 2: 16, 3: 1, 30: 1}
OK	32410-24-5	CC(C)CC(=O)OCC1=CO[C@H]([C@H]2C1=C[C@@H]([C@]23CO3)OC(=O)C)OC(=O)CC(C)C	{1: 5, 2: 3, 3: 2, 11: 1, 12: 3, 13: 1, 14: 2, 15: 2, 23: 2, 28: 3}
OK	32429-42-8	CCCCCCCCCCCCCC(=O)OC(C)(C)C	{1: 4, 2: 12, 4: 1, 28: 1}
OK	32444-34-1	CCC(CO)C(C)C	{1: 3, 2: 2, 3: 2, 20: 1}
OK	32446-40-5	CCCCCSC#N	{40: 1, 1: 1, 2: 4, 37: 1}
OK	32451-95-9	CCCCCCCCC=CCCO	{1: 1, 2: 9, 20: 1, 6: 2}
OK	3246-27-3	CC=CC(=O)OC(C)(C)C	{1: 4, 4: 1, 6: 2, 28: 1}
OK	32477-35-3	C1=CN(C=N1)C(=O)C(C(C(F)(F)F)(F)F)(F)F	{33: 1, 35: 1, 4: 3, 14: 3, 16: 7, 24: 1}
OK	3248-28-0	CCC(=O)OOC(=O)CC	{1: 2, 2: 2, 28: 2}
OK	3248-58-6	[CH2]C(F)(F)F	{16: 3, 4: 1, 5: 1}
OK	3248-61-1	C(C(C(C(C(C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 27, 19: 1, 4: 13}
OK	3248-63-3	C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 31, 19: 1, 4: 15}
OK	32480-16-3	CCCCCCCCCCCC(C)CO	{1: 2, 2: 11, 3: 1, 20: 1}
OK	32483-15-1	CC(C)C[C@@H](C(=O)NC)NC(=O)C	{24: 2, 1: 4, 2: 1, 3: 2, 31: 2}
OK	32483-16-2	CC[C@H](C)[C@@H](C(=O)NC)NC(=O)C	{24: 2, 1: 4, 2: 1, 3: 2, 31: 2}
OK	3249-46-5	CCC(C)(C)OC(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 22: 1}
OK	3249-68-1	CCCC(=O)CC(=O)OCC	{24: 1, 1: 2, 2: 4, 28: 1}
OK	32499-64-2	CCOC(=O)N1C2CCC1CC(=O)C2	{1: 1, 2: 1, 33: 1, 11: 4, 12: 2, 25: 1, 28: 1}
OK	32509-55-0	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCC	{1: 2, 2: 25, 28: 1}
OK	3251-07-8	COC(=O)CCCN	{1: 1, 2: 3, 28: 1, 30: 1}
OK	3251-08-9	C(CC(=O)N)CN	{24: 1, 2: 3, 30: 2}
OK	32516-05-5	CC(=O)N1CN2CN(C1)CN(C2)C(=O)C	{24: 2, 1: 2, 11: 5, 33: 4}
OK	3252-43-5	C(#N)C(Br)Br	{18: 2, 3: 1, 37: 1}
OK	3253-62-1	CC1[C@H](C(C([C@H](O1)O[C@H]2CC[C@@]3(C4CC[C@@]5([C@H](CC[C@@]5(C4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)CO)O)O)O	{1: 2, 2: 1, 11: 10, 12: 9, 13: 4, 14: 1, 15: 1, 20: 6, 22: 1, 23: 1, 28: 1}
OK	32556-70-0	CCCCC[C@H](C#C)O	{1: 1, 2: 4, 3: 1, 9: 1, 10: 1, 20: 1}
OK	32556-71-1	CCCCC[C@@H](C#C)O	{1: 1, 2: 4, 3: 1, 9: 1, 10: 1, 20: 1}
OK	32568-89-1	CC(CN1C(=O)C(N(C1=O)CC2CO2)(C)C)OCC3CO3	{1: 3, 2: 3, 3: 1, 33: 2, 11: 2, 12: 2, 13: 1, 22: 1, 23: 2, 25: 2}
OK	32579-76-3	CC1(CCCC(N1Cl)(C)C)C	{1: 4, 33: 1, 11: 3, 13: 2, 17: 1}
OK	32582-32-4	CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)CO	{1: 2, 2: 29, 3: 1, 20: 1}
OK	32582-63-1	CCCCCCCCNCCO	{1: 1, 2: 9, 20: 1, 31: 1}
OK	32597-32-3	C#CC#CC#CC#CC#C	{9: 2, 10: 8}
OK	32597-33-4	C#CC#CC#CC#CC#CC#C	{9: 2, 10: 10}
OK	32597-34-5	C1=C/C(=C\NO)/N=C1	{35: 1, 6: 1, 14: 3, 15: 1, 20: 1, 31: 1}
OK	32617-26-8	CC(CCC=C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 5, 2: 2, 3: 1, 6: 1, 7: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	32620-11-4	COC[C@@H](C(=O)O)N	{1: 1, 2: 1, 3: 1, 22: 1, 27: 1, 30: 1}
OK	32634-64-3	C1CCC2CCC(C1)N=N2	{35: 2, 11: 6, 12: 2}
OK	3264-99-1	C[CH]C#N	{1: 1, 37: 1, 6: 1}
OK	32644-15-8	C[C@@H](C(=O)O)Br	{27: 1, 1: 1, 18: 1, 3: 1}
OK	32648-01-4	CCCC(=O)OCC(COC(=O)CCC)O	{1: 2, 2: 6, 3: 1, 20: 1, 28: 2}
OK	32659-21-5	CCOC(=O)C=C(C)CCC=C(C)C	{1: 4, 2: 3, 28: 1, 6: 2, 7: 2}
OK	3266-23-7	CC1C(O1)C	{1: 2, 12: 2, 23: 1}
OK	3266-39-5	C(C(=C(Cl)Cl)Cl)O	{17: 3, 2: 1, 20: 1, 7: 2}
OK	32665-23-9	CC(C)CC(=O)OC(C)C	{1: 4, 2: 1, 3: 2, 28: 1}
OK	32669-86-6	C1CCC(CC1)C2CC2	{11: 7, 12: 2}
OK	3268-49-3	CSCCC=O	{40: 1, 1: 1, 2: 2, 26: 1}
OK	3268-79-9	C(SC#N)Cl	{40: 1, 17: 1, 2: 1, 37: 1}
OK	3269-90-7	CC1=CCC(CC1)C(=C)CO	{1: 1, 2: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	327-56-0	CCCC[C@H](C(=O)O)N	{27: 1, 1: 1, 2: 3, 3: 1, 30: 1}
OK	327-57-1	CCCC[C@@H](C(=O)O)N	{27: 1, 1: 1, 2: 3, 3: 1, 30: 1}
OK	327-69-5	CC(C)CCOC(=O)C(F)(F)F	{1: 2, 2: 2, 3: 1, 4: 1, 16: 3, 28: 1}
OK	327-70-8	CCCCCOC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 4, 4: 1, 28: 1}
OK	3270-73-3	CC(CNCCNCC(C)O)O	{1: 2, 2: 4, 3: 2, 20: 2, 31: 2}
OK	3270-74-4	C1CN(C(=O)N(C1)CO)CO	{25: 1, 2: 2, 11: 3, 20: 2, 33: 2}
OK	3272-27-3	CONC(=O)N	{24: 1, 1: 1, 30: 1, 22: 1, 31: 1}
OK	3272-96-6	C(C(=NO)N)Cl	{2: 1, 7: 1, 34: 1, 17: 1, 20: 1, 30: 1}
OK	32728-78-2	C/C=C(/C)\C(=O)O[C@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@]([C@H](C)O)(C(C)(C)O)O	{1: 5, 2: 1, 3: 1, 4: 2, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 3, 28: 2}
OK	32730-85-1	C1CCCC(CC1)C#N	{11: 6, 12: 1, 37: 1}
OK	32734-93-3	CCCCCCCCCCC=CCl	{1: 1, 2: 9, 6: 2, 17: 1}
OK	3274-28-0	CCCCC(CCC)C(=O)O	{27: 1, 1: 2, 2: 5, 3: 1}
OK	3274-29-1	CCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 5, 3: 1}
OK	32749-94-3	CCC(C)C(C)C=O	{1: 3, 2: 1, 3: 2, 26: 1}
OK	3275-58-9	CC12CCC(=O)CC1CCC3C2CCC4(C3CCC4(C)O)C	{1: 3, 11: 9, 12: 4, 13: 3, 20: 1, 25: 1}
OK	3275-64-7	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(CC=CC4)C	{1: 3, 11: 8, 12: 4, 13: 3, 14: 2, 20: 1}
OK	3276-41-3	C1C=CCON1N=O	{33: 1, 34: 1, 11: 2, 14: 2, 23: 1, 29: 1}
OK	32764-34-4	CCC(CCC(C)C)OC(=O)C	{1: 4, 2: 3, 3: 2, 28: 1}
OK	32764-43-5	C(C(C1C(=C(C(=O)O1)N)O)O)O	{2: 1, 3: 1, 12: 1, 15: 2, 20: 3, 28: 1, 30: 1}
OK	32767-68-3	CC(C)COC1CCCCO1	{1: 2, 2: 1, 3: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	32777-26-7	CCOC(=O)C1CCCCCC1	{1: 1, 2: 1, 11: 6, 12: 1, 28: 1}
OK	32779-58-1	CC(=C)CCCC(C)(C)O	{1: 3, 2: 3, 4: 1, 5: 1, 7: 1, 20: 1}
OK	3278-46-4	C(C(C(=O)O)(Cl)Cl)Cl	{17: 3, 2: 1, 27: 1, 4: 1}
OK	3278-94-2	CC1(C2CCC1(C(=O)CC2=O)C)C	{1: 3, 11: 3, 12: 1, 13: 2, 25: 2}
OK	32780-06-6	C1CC(=O)O[C@@H]1CO	{20: 1, 2: 1, 11: 2, 12: 1, 28: 1}
OK	32787-97-6	CCC1CC2CC1C3C2CCC3	{1: 1, 2: 1, 11: 5, 12: 5}
OK	3279-95-6	C(CON)O	{2: 2, 20: 1, 30: 1, 22: 1}
OK	328-38-1	CC(C)C[C@H](C(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	328-39-2	CC(C)CC(C(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	328-42-7	C(C(=O)C(=O)O)C(=O)O	{24: 1, 2: 1, 27: 2}
OK	328-50-7	C(CC(=O)O)C(=O)C(=O)O	{24: 1, 2: 2, 27: 2}
OK	32804-79-8	CC(COC)OC(=O)CC#N	{1: 2, 2: 2, 3: 1, 37: 1, 22: 1, 28: 1}
OK	32807-28-6	COC(=O)CC(=O)CCl	{24: 1, 1: 1, 2: 2, 28: 1, 17: 1}
OK	32811-75-9	COC(=O)C1CCC(=O)C1	{1: 1, 11: 3, 12: 1, 28: 1, 25: 1}
OK	32812-23-0	CC(C)(CCO)CO	{1: 2, 2: 3, 4: 1, 20: 2}
OK	32815-70-6	CC(C)C(CC=C)O	{1: 2, 2: 1, 3: 2, 5: 1, 6: 1, 20: 1}
OK	32818-94-3	CC(C)CC(=NNC(C)(C)C)C	{1: 6, 2: 1, 3: 1, 4: 1, 7: 1, 34: 1, 31: 1}
OK	32818-96-5	CC(=NNC(C)(C)C)CC(C)(C)OC	{1: 7, 2: 1, 4: 2, 7: 1, 34: 1, 22: 1, 31: 1}
OK	3282-30-2	CC(C)(C)C(=O)Cl	{24: 1, 1: 3, 4: 1, 17: 1}
OK	3282-53-9	CCCCC1=CCCCC1	{1: 1, 2: 3, 11: 4, 14: 1, 15: 1}
OK	3282-54-0	C1CCC(CC1)C2=CCCCC2	{11: 9, 12: 1, 14: 1, 15: 1}
OK	3282-75-5	CCCCCCCCC=CCCCCCCCC(=O)OCCN	{1: 1, 2: 16, 28: 1, 30: 1, 6: 2}
OK	32830-97-0	CCC(=O)CCCl	{24: 1, 1: 1, 2: 3, 17: 1}
OK	32833-80-0	CC(CN(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 2, 4: 2, 38: 5, 33: 1, 16: 1}
OK	32838-28-1	CCCCC(CC)CNC(=O)CC(C)OC(=O)CCC(=O)O	{1: 3, 2: 8, 3: 2, 24: 1, 27: 1, 28: 1, 31: 1}
OK	3284-85-3	CC1C2CC2(CC1O)C(C)C	{1: 3, 3: 1, 11: 2, 12: 3, 13: 1, 20: 1}
OK	32844-67-0	CC(C)CCCCCCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 12, 3: 1}
OK	32864-38-3	CCOC(=O)CC(=O)OC(C)(C)C	{1: 4, 2: 2, 4: 1, 28: 2}
OK	3287-12-5	CCCCCCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCCCCCC	{40: 1, 1: 2, 2: 34, 28: 2}
OK	3288-52-6	CC(=O)C(C#N)C(=O)OC	{24: 1, 1: 2, 3: 1, 28: 1, 37: 1}
OK	32887-03-9	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)N=CN3CCCCCC3)C(=O)OCOC(=O)C(C)(C)C)C.Cl	{1: 5, 2: 1, 34: 1, 4: 1, 6: 1, 33: 2, 41: 1, 11: 6, 12: 3, 13: 1, 17: 1, 25: 1, 28: 2}
OK	3289-28-9	CCOC(=O)C1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1, 28: 1}
OK	329-94-2	C1CN2CCC1CN2	{32: 1, 33: 1, 11: 5, 12: 1}
OK	3290-70-8	C(C(CO)Cl)C(Cl)(Cl)Cl	{17: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	3290-92-4	CCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C	{1: 4, 2: 4, 4: 1, 5: 3, 7: 3, 28: 3}
OK	3291-00-7	C1=C/C(=C/NN)/C(=O)C=C1	{6: 1, 14: 4, 15: 1, 25: 1, 30: 1, 31: 1}
OK	32936-74-6	C1=CC(=O)C1=O	{25: 2, 14: 2}
OK	32936-99-5	C12=C(C3=C(C4=C(C5=C1C(C(C5(F)F)(F)F)(F)F)C(C(C4(F)F)(F)F)(F)F)C(C(C3(F)F)(F)F)(F)F)C(C(C2(F)F)(F)F)(F)F	{16: 24, 13: 12, 15: 8}
OK	3295-97-4	CCCCCCCCOCC=C	{1: 1, 2: 8, 22: 1, 5: 1, 6: 1}
OK	32953-65-4	CCCCCCCCC=CCCCCCCCC(=O)OCCCCCCCC	{1: 2, 2: 21, 28: 1, 6: 2}
OK	3296-43-3	CCCCCCCCCCCC=CCCCCC(=O)OCC(COC(=O)CCCCC=CCCCCCCCCCCC)OC(=O)CCCCC=CCCCCCCCCCCC	{1: 3, 2: 44, 3: 1, 28: 3, 6: 6}
OK	3296-90-0	C(C(CO)(CBr)CBr)O	{20: 2, 2: 4, 4: 1, 18: 2}
OK	32970-45-9	CCC(C)OC(C)(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 22: 1}
OK	32976-88-8	CCN(C(=O)NC(=O)N)N=O	{1: 1, 2: 1, 33: 1, 34: 1, 24: 2, 29: 1, 30: 1, 31: 1}
OK	32986-56-4	C1C(C(C(C(C1N)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(CC(C(O3)CN)O)N)N	{2: 2, 11: 2, 12: 14, 20: 5, 22: 2, 23: 2, 30: 5}
OK	32988-50-4	C1[C@@H](NC(=N[C@H]1O)N)[C@H]2C(=O)NC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N/C(=C\NC(=O)N)/C(=O)N2)CO)CO)NC(=O)C[C@H](CCCN)N	{32: 6, 2: 6, 3: 1, 6: 1, 11: 2, 12: 6, 15: 2, 35: 1, 20: 3, 24: 2, 25: 5, 30: 4, 31: 2}
OK	3299-38-5	CCN(CC)CCC(=O)C	{24: 1, 1: 3, 2: 4, 33: 1}
OK	3299-64-7	C1CCC(CC1)NC(=O)C(=O)NC2CCCCC2	{24: 2, 11: 10, 12: 2, 31: 2}
OK	329910-39-6	CC(C)(C)OC(=O)N[C@H]1CC[C@@H](C1)C(=O)OC	{1: 4, 4: 1, 11: 3, 12: 2, 28: 2, 31: 1}
OK	3301-90-4	CCC1CCCC(=O)O1	{1: 1, 2: 1, 11: 3, 12: 1, 28: 1}
OK	3301-94-8	CCCCC1CCCC(=O)O1	{1: 1, 2: 3, 11: 3, 12: 1, 28: 1}
OK	33017-08-2	C(C(=O)OC(F)(F)F)OO	{2: 1, 4: 1, 16: 3, 20: 1, 22: 1, 28: 1}
OK	33018-91-6	CCOC(=O)CCCCCC(=O)O	{1: 1, 2: 6, 27: 1, 28: 1}
OK	33019-03-3	CCOC(=O)[C@H]1CCC(=O)O1	{1: 1, 2: 1, 11: 2, 12: 1, 28: 2}
OK	3302-10-1	CC(CC(=O)O)CC(C)(C)C	{27: 1, 1: 4, 2: 2, 3: 1, 4: 1}
OK	3302-16-7	CC(C)(C)CC#N	{1: 3, 2: 1, 4: 1, 37: 1}
OK	33021-02-2	CC(C)COC(C)(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 22: 1}
OK	33021-59-9	CC12CC3(CC(C1)(CC(C2)(C3)NC(=O)NCCCl)C)C	{1: 3, 2: 2, 11: 6, 13: 4, 17: 1, 24: 1, 31: 2}
OK	33021-92-0	C(CF)NC(=O)N[N+](=O)[O-]	{16: 1, 24: 1, 2: 2, 38: 1, 31: 2}
OK	33021-99-7	CC12CC3(CC(C1)(CC(C2)(C3)NC(=O)N(CCCl)N=O)C)C	{1: 3, 2: 2, 34: 1, 33: 1, 11: 6, 13: 4, 17: 1, 24: 1, 29: 1, 31: 1}
OK	3303-45-5	C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)O)N	{1: 3, 3: 3, 24: 1, 27: 1, 30: 1, 31: 1}
OK	33036-62-3	C(CCBr)CO	{2: 4, 20: 1, 18: 1}
OK	33037-40-0	CCC(=NNC(C)(C)C)C	{1: 5, 2: 1, 4: 1, 7: 1, 34: 1, 31: 1}
OK	33053-07-5	CCCCC(C(CCCC)C(=O)O)C(=O)O	{27: 2, 1: 2, 2: 6, 3: 2}
OK	3306-69-2	C1CC2CCC1C(=O)N2	{32: 1, 25: 1, 11: 4, 12: 2}
OK	33060-69-4	CC(C)(C#C)OC(=O)N	{1: 2, 4: 1, 9: 1, 10: 1, 28: 1, 30: 1}
OK	33079-56-0	CC1C(=O)C(=O)CC1(C)C	{1: 3, 11: 1, 12: 1, 13: 1, 25: 2}
OK	33082-85-8	CC(C)(C)C1CCCC(C1)NC(=O)NCCCl	{1: 3, 2: 2, 4: 1, 11: 4, 12: 2, 17: 1, 24: 1, 31: 2}
OK	33083-83-9	CCCCCCC(=O)CCCC	{24: 1, 1: 2, 2: 8}
OK	33089-37-1	C1COCCOCCOCCOCCOCCOCCOCCO1	{11: 16, 23: 8}
OK	331-87-3	CCCCC(CC)COC(=O)CF	{16: 1, 1: 2, 2: 6, 3: 1, 28: 1}
OK	3310-62-1	C1CC2CCC1N=N2	{35: 2, 11: 4, 12: 2}
OK	3310-97-2	CC(=C1CC[C@H]2C(=C1)CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)OC)C)C	{1: 5, 7: 1, 11: 7, 12: 2, 13: 2, 14: 1, 15: 2, 28: 1}
OK	33100-27-5	C1COCCOCCOCCOCCO1	{11: 10, 23: 5}
OK	33105-81-6	CC(C)(C)C(C(=O)O)N	{27: 1, 1: 3, 3: 1, 4: 1, 30: 1}
OK	3312-58-1	C1CN(CCN1CO)CO	{33: 2, 2: 2, 11: 4, 20: 2}
OK	3312-60-5	C1CCC(CC1)NCCCN	{2: 3, 11: 5, 12: 1, 30: 1, 31: 1}
OK	33142-15-3	C=C=CCC#C	{2: 1, 5: 1, 6: 1, 8: 1, 9: 1, 10: 1}
OK	3315-42-2	C[CH]C#C	{1: 1, 10: 1, 6: 1, 9: 1}
OK	33163-94-9	C1C2CC(=O)C1C3C2C4CC3C=C4	{25: 1, 11: 3, 12: 6, 14: 2}
OK	3317-61-1	CC1(CCC=[N+]1[O-])C	{1: 2, 33: 1, 11: 2, 13: 1, 14: 1, 29: 1}
OK	33175-59-6	CC(=C(C)CC(C)(C)C)C	{1: 6, 2: 1, 4: 1, 7: 2}
OK	33189-72-9	CC/C=C/CCCCCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 6: 2}
OK	3319-01-5	C1CCC(CC1)N2CCCCC2	{33: 1, 11: 10, 12: 1}
OK	33190-16-8	CCOC(=O)C1(CCCC(C1)C)NC(=O)NCCCl	{1: 2, 2: 3, 11: 4, 12: 1, 13: 1, 17: 1, 24: 1, 28: 1, 31: 2}
OK	332-77-4	COC1C=CC(O1)OC	{1: 2, 12: 2, 22: 2, 14: 2, 23: 1}
OK	332-97-8	CCOC(=O)CCCCCCCF	{16: 1, 1: 1, 2: 8, 28: 1}
OK	3320-90-9	CCOC1CCC(O1)OCC	{1: 2, 2: 2, 11: 2, 12: 2, 22: 2, 23: 1}
OK	33204-74-9	CC(=C)C1CC2C(O2)(C(=O)C1)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 2, 13: 1, 23: 1, 25: 1}
OK	3321-50-4	C1CCC(CC1)CCC2CCCCC2	{2: 2, 11: 10, 12: 2}
OK	3322-93-8	C1CC(C(CC1C(CBr)Br)Br)Br	{11: 3, 2: 1, 3: 1, 12: 3, 18: 4}
OK	33229-89-9	CCOC(=O)CN(C)C	{1: 3, 2: 2, 28: 1, 33: 1}
OK	3323-53-3	C(CCCN)CCN.C(CCC(=O)O)CC(=O)O	{2: 10, 27: 2, 30: 2}
OK	33234-93-4	CCC(C)CCCCCCO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	33240-56-1	CC(C)CCCCCl	{1: 2, 2: 4, 3: 1, 17: 1}
OK	3326-89-4	C1CSC(=O)O1	{41: 1, 11: 2, 28: 1}
OK	3326-90-7	C=CC(=O)OCC(CCl)O	{2: 2, 3: 1, 5: 1, 6: 1, 17: 1, 20: 1, 28: 1}
OK	3326-96-3	C[C@H]1C[C@@](C[C@H](C1=O)[C@@H](CC2CC(=O)NC(=O)C2)O)(C)OC(=O)C	{32: 1, 1: 3, 2: 1, 3: 1, 11: 4, 12: 3, 13: 1, 20: 1, 25: 3, 28: 1}
OK	33266-07-8	CC(=O)C1(SCCS1)C	{24: 1, 1: 2, 11: 2, 13: 1, 41: 2}
OK	33272-71-8	[CH](F)Cl	{16: 1, 17: 1, 6: 1}
OK	3328-84-5	CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@@H]([C@@H](C31)[C@]5(CC[C@H]6C[C@@H]4[C@@H]5C(=O)O6)O)O)OC)C	{1: 3, 2: 1, 33: 1, 11: 6, 12: 8, 13: 3, 20: 2, 22: 1, 28: 1}
OK	33284-11-6	C1C=C2CC=CC2=C1	{11: 2, 14: 4, 15: 2}
OK	3329-30-4	CN[C@@H](C=O)[C@H]([C@@H]([C@@H](CO)O)O)O	{1: 1, 2: 1, 3: 4, 20: 4, 26: 1, 31: 1}
OK	3329-48-4	CC(C)CC(C)(C=C)O	{1: 3, 2: 1, 3: 1, 4: 1, 5: 1, 6: 1, 20: 1}
OK	3329-56-4	CCCCOC#C	{1: 1, 2: 3, 10: 1, 22: 1, 9: 1}
OK	33298-50-9	C1C2CC3C1C3C2NC(=O)NCCCl	{2: 2, 11: 2, 12: 5, 17: 1, 24: 1, 31: 2}
OK	333-18-6	C(CN)N.Cl.Cl	{17: 2, 2: 2, 30: 2}
OK	333-36-8	C(C(F)(F)F)OCC(F)(F)F	{16: 6, 2: 2, 4: 2, 22: 1}
OK	333-93-7	C(CCN)CN.Cl.Cl	{17: 2, 2: 4, 30: 2}
OK	3330-14-1	C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F	{16: 17, 3: 1, 4: 7, 22: 2}
OK	3330-15-2	C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F	{16: 11, 3: 1, 4: 4, 22: 1}
OK	3330-16-3	C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F	{16: 23, 3: 1, 4: 10, 22: 3}
OK	33312-01-5	CCCCCCCCNC(=O)CCSSCCC(=O)NCCCCCCCC	{24: 2, 1: 2, 2: 18, 40: 2, 31: 2}
OK	3332-08-9	CC(C)N=C(C)C	{1: 4, 34: 1, 3: 1, 7: 1}
OK	3332-29-4	CCON.Cl	{1: 1, 2: 1, 30: 1, 22: 1, 17: 1}
OK	3332-38-5	C\1=C/C=C\C=C\C=C/C=C/C=C\C=C\C=C1	{14: 16}
OK	33325-40-5	CC(CSC(=O)C)C(=O)O	{1: 2, 2: 1, 3: 1, 40: 1, 24: 1, 27: 1}
OK	3333-52-6	CC(C)(C#N)C(C)(C)C#N	{1: 4, 4: 2, 37: 2}
OK	33364-51-1	CC(C(=NF)C=C)(N(F)F)N(F)F	{1: 1, 34: 1, 4: 1, 5: 1, 6: 1, 7: 1, 16: 5, 33: 2}
OK	3337-17-5	C1C=CNC=C1	{32: 1, 11: 1, 14: 4}
OK	33371-97-0	CCOC1CCCCC1=O	{1: 1, 2: 1, 11: 4, 12: 1, 22: 1, 25: 1}
OK	33373-80-7	C1COC(N1)C(Cl)(Cl)Cl	{32: 1, 4: 1, 11: 2, 12: 1, 17: 3, 23: 1}
OK	3338-55-4	CC(=CC/C=C(/C)\C=C)C	{1: 3, 2: 1, 5: 1, 6: 3, 7: 2}
OK	334-22-5	C(CCl)NCCCl	{17: 2, 2: 4, 31: 1}
OK	334-25-8	C(CCC(=O)O)CC(=O)N	{24: 1, 2: 4, 27: 1, 30: 1}
OK	334-28-1	C(CCCF)CCC(=O)O	{16: 1, 2: 6, 27: 1}
OK	334-43-0	C(CCCF)CCCCl	{16: 1, 17: 1, 2: 7}
OK	334-44-1	C(CCCF)CCC#N	{16: 1, 2: 6, 37: 1}
OK	334-48-5	CCCCCCCCCC(=O)O	{1: 1, 2: 8, 27: 1}
OK	334-49-6	CCCCCCC/C=C/C(=O)O	{1: 1, 2: 6, 27: 1, 6: 2}
OK	334-50-9	C(CCNCCCN)CN.Cl.Cl.Cl	{17: 3, 2: 7, 30: 2, 31: 1}
OK	334-56-5	CCCCCCCCCCF	{16: 1, 1: 1, 2: 9}
OK	334-59-8	C(CCCCC(=O)O)CCCCF	{16: 1, 2: 9, 27: 1}
OK	334-61-2	C(CCCCCBr)CCCCF	{16: 1, 2: 10, 18: 1}
OK	334-62-3	C(CCCCCCl)CCCCF	{16: 1, 17: 1, 2: 10}
OK	334-64-5	C(CCCCCF)CCCCO	{16: 1, 2: 10, 20: 1}
OK	334-68-9	CCCCCCCCCCCCF	{16: 1, 1: 1, 2: 11}
OK	334-71-4	C(CCCCCC#N)CCCCCF	{16: 1, 2: 11, 37: 1}
OK	334-99-6	C(N=O)(F)(F)F	{16: 3, 34: 1, 4: 1, 29: 1}
OK	33415-52-0	CC(C)(C)OOCC1CO1	{1: 3, 2: 1, 4: 1, 11: 1, 12: 1, 22: 2, 23: 1}
OK	33422-32-1	CC(=CC1CC1(C)C)C	{1: 4, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1}
OK	3344-70-5	C(CCCCCCBr)CCCCCBr	{2: 12, 18: 2}
OK	3344-77-2	C(CCCCCCBr)CCCCCO	{2: 12, 20: 1, 18: 1}
OK	33445-03-3	CC\1C2C(CC/C1=C\C(=O)OCCN(C)C)C3(CCC(C(C3CC2=O)(C)C)O)C.Cl	{1: 6, 2: 2, 6: 1, 33: 1, 11: 5, 12: 5, 13: 2, 15: 1, 17: 1, 20: 1, 25: 1, 28: 1}
OK	33445-07-7	CC(C)OCC(=O)O	{27: 1, 1: 2, 2: 1, 3: 1, 22: 1}
OK	33449-52-4	C1CC(CC(=O)C1)S	{25: 1, 11: 4, 12: 1, 39: 1}
OK	33467-74-2	CC/C=C\CCOC(=O)CC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	33467-79-7	CCC=CC=CCO	{1: 1, 2: 2, 20: 1, 6: 4}
OK	33470-40-5	CC1(CCCC(C#C1)(C)C)C	{1: 4, 10: 2, 11: 3, 13: 2}
OK	33475-22-8	C1CC12CC23CC3	{11: 5, 13: 2}
OK	33478-30-7	C1CCC(CC1)COC(=O)CCCCC(=O)OCC2CCCCC2	{28: 2, 2: 6, 11: 10, 12: 2}
OK	33498-40-7	CCC=CC(OCC)OCC	{1: 3, 2: 3, 3: 1, 22: 2, 6: 2}
OK	335-01-3	C(N(F)F)(F)(F)F	{16: 5, 33: 1, 4: 1}
OK	335-08-0	CC(C#N)(C(F)(F)F)O	{16: 3, 1: 1, 4: 2, 37: 1, 20: 1}
OK	335-21-7	C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)F	{16: 16, 4: 2, 13: 6}
OK	335-27-3	C1(C(C(C(C(C1(F)F)(F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F	{16: 16, 4: 2, 13: 6}
OK	335-36-4	C1(C(C(OC1(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F)(F)F)(F)F)(F)F	{16: 16, 4: 4, 13: 4, 23: 1}
OK	335-42-2	C(=O)(C(C(C(F)(F)F)(F)F)(F)F)F	{16: 8, 24: 1, 4: 3}
OK	335-44-4	C(C(C(F)(F)F)(Cl)Cl)(C(F)(F)F)(F)Cl	{16: 7, 17: 3, 4: 4}
OK	335-48-8	C(C(C(F)(F)Br)(F)F)(C(F)(F)Br)(F)F	{16: 8, 18: 2, 4: 4}
OK	335-56-8	C(C(C(C(F)(F)Br)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 13, 18: 1, 4: 6}
OK	335-57-9	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 16, 4: 7}
OK	335-58-0	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)I)(F)F)(F)F)(F)F	{16: 15, 19: 1, 4: 7}
OK	335-64-8	C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cl	{16: 15, 17: 1, 4: 7, 24: 1}
OK	335-65-9	C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 17, 3: 1, 4: 7}
OK	335-66-0	C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 16, 24: 1, 4: 7}
OK	335-67-1	C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 15, 27: 1, 4: 7}
OK	335-68-2	C(C(C(C(C(F)(F)Cl)(F)Cl)(F)F)(F)Cl)(C(C(C(F)(Cl)Cl)(F)F)(F)Cl)(F)F	{16: 12, 17: 6, 4: 8}
OK	335-70-6	C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(C(C(C(F)(F)I)(F)F)(F)F)(F)F	{16: 16, 19: 2, 4: 8}
OK	335-74-0	C(=O)(C(C(C(C(C(C(C(C(C(F)(F)Cl)(F)Cl)(F)F)(F)Cl)(F)F)(F)Cl)(F)F)(F)Cl)(F)F)O	{16: 14, 17: 5, 27: 1, 4: 9}
OK	335-76-2	C(=O)(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 19, 27: 1, 4: 9}
OK	335-99-9	C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 12, 20: 1, 2: 1, 3: 1, 4: 5}
OK	3350-02-5	CC12C3C1(C2C3=O)C	{1: 2, 12: 2, 13: 2, 25: 1}
OK	3350-30-9	C1CCCCC(=O)CCC1	{25: 1, 11: 8}
OK	3350-78-5	CC(=CC(=O)Cl)C	{24: 1, 1: 2, 17: 1, 6: 1, 7: 1}
OK	3351-86-8	C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C(=O)C[C@]12[C@](O1)(C[C@H](CC2(C)C)O)C)/C=C/C=C(\C)/C=C=C3[C@](C[C@H](CC3(C)C)OC(=O)C)(C)O	{1: 11, 2: 1, 6: 11, 7: 4, 8: 1, 11: 4, 12: 2, 13: 5, 15: 1, 20: 2, 23: 1, 24: 1, 28: 1}
OK	33512-45-7	CC(C)(C)C(=C=C=C(C(C)(C)C)C(C)(C)C)C(C)(C)C	{8: 2, 1: 12, 4: 4, 7: 2}
OK	3352-87-2	CCCCCCCCCCCC(=O)N(CC)CC	{24: 1, 1: 3, 2: 12, 33: 1}
OK	33527-91-2	CN(C)CCN(CCN(C)C)CCN(C)C	{1: 6, 2: 6, 33: 4}
OK	3354-32-3	C1C=CC(=O)S1	{25: 1, 11: 1, 14: 2, 41: 1}
OK	3354-91-4	CC(=O)N(C)C.C1N(CN(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{24: 1, 1: 3, 11: 4, 38: 4, 33: 5}
OK	3355-17-7	CC#CCCl	{1: 1, 2: 1, 10: 2, 17: 1}
OK	3355-28-0	CC#CCBr	{1: 1, 2: 1, 18: 1, 10: 2}
OK	33553-93-4	CC(C)(CC(C)(C)Cl)Cl	{1: 4, 2: 1, 4: 2, 17: 2}
OK	3356-67-0	CCCCCC[CH2]	{1: 1, 2: 5, 5: 1}
OK	3356-88-5	C1COC(=O)N1CCO	{28: 1, 2: 2, 11: 2, 20: 1, 33: 1}
OK	33560-15-5	CC(C)COC(=O)C(Cl)(Cl)Cl	{1: 2, 2: 1, 3: 1, 4: 1, 17: 3, 28: 1}
OK	33560-17-7	C(COC(=O)C(Cl)(Cl)Cl)O	{17: 3, 2: 2, 4: 1, 20: 1, 28: 1}
OK	33563-54-1	CNCCCCCCCCNC	{1: 2, 2: 8, 31: 2}
OK	33564-31-7	C[C@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COC(=O)C)OC(=O)C)C)O)F)C)F	{1: 5, 2: 1, 11: 3, 12: 5, 13: 4, 14: 3, 15: 1, 16: 2, 20: 1, 24: 1, 25: 1, 28: 2}
OK	3357-16-2	CC1(CC(=CC(=O)C1)N2CCCC2)C	{1: 2, 33: 1, 11: 6, 13: 1, 14: 1, 15: 1, 25: 1}
OK	3358-28-9	CC1(CC(OC1)(C)C)C	{1: 4, 11: 2, 13: 2, 23: 1}
OK	33587-21-2	CCCCCCCCCCCCCCCCCC(=O)OCCCCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 36, 28: 2}
OK	336-08-3	C(=O)(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)O	{16: 8, 27: 2, 4: 4}
OK	336-19-6	C1(=C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)Cl)Cl	{16: 8, 17: 2, 13: 4, 15: 2}
OK	336-34-5	COC1=C(C(C(C1(F)F)(F)F)(F)F)Cl	{1: 1, 13: 3, 15: 2, 16: 6, 17: 1, 22: 1}
OK	336-50-5	C1(C(C(C1(Cl)Cl)(Cl)Cl)(F)F)(F)F	{16: 4, 17: 4, 13: 4}
OK	336-62-9	CCOC(=O)CC(=O)C(C(C(F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 3, 16: 7, 24: 1, 28: 1}
OK	3360-16-5	CC(C)NCCCN	{1: 2, 2: 3, 3: 1, 30: 1, 31: 1}
OK	33611-43-7	COC(=O)CCN1CCOCC1	{1: 1, 2: 2, 33: 1, 11: 4, 23: 1, 28: 1}
OK	336111-20-7	C[C@@H](C(=O)N)OC	{24: 1, 1: 2, 3: 1, 30: 1, 22: 1}
OK	33622-26-3	CCCCCCC#CC=C	{1: 1, 2: 5, 10: 2, 5: 1, 6: 1}
OK	33631-41-3	CCNC(=O)/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(CCCC1(C)C)C	{1: 6, 2: 1, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 24: 1, 31: 1}
OK	33631-47-9	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)NCCO)/C)/C	{1: 5, 2: 2, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 20: 1, 24: 1, 31: 1}
OK	33639-45-1	COC(CC#C)OC	{1: 2, 2: 1, 3: 1, 9: 1, 10: 1, 22: 2}
OK	33647-67-5	C[C@@H]([C@@]1(C=C[C@@H](O1)OC)OC)O	{1: 3, 3: 1, 12: 1, 13: 1, 14: 2, 20: 1, 22: 2, 23: 1}
OK	33657-49-7	CCCC(=O)OCCl	{1: 1, 2: 3, 28: 1, 17: 1}
OK	33666-44-3	CN1C=CCC=C1	{1: 1, 11: 1, 14: 4, 33: 1}
OK	33669-76-0	CC(C)C1CCC(C(C1)O)(C)O	{1: 3, 3: 1, 11: 3, 12: 2, 13: 1, 20: 2}
OK	3367-95-1	CCN(CC)C(=O)C1CCCNC1	{32: 1, 1: 2, 2: 2, 33: 1, 11: 4, 12: 1, 24: 1}
OK	33672-51-4	CCCSSC(C)C	{40: 2, 1: 3, 2: 2, 3: 1}
OK	33673-01-7	CCC(C)C(CO)CO	{1: 2, 2: 3, 3: 2, 20: 2}
OK	33673-34-6	C1C2CC3CC1CC(C2)C3(N=O)Cl	{34: 1, 11: 5, 12: 4, 13: 1, 17: 1, 29: 1}
OK	33673-71-1	CC=CC(=O)C1CCC(C=C1C)(C)C	{1: 4, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	33686-17-8	CC1CC(=C(C1=O)O)N2CCCCC2	{1: 1, 33: 1, 11: 6, 12: 1, 15: 2, 20: 1, 25: 1}
OK	33687-82-0	CC1(C=CSC1=O)C	{1: 2, 41: 1, 13: 1, 14: 2, 25: 1}
OK	33687-83-1	CC1=CC(C(=O)S1)(C)C	{1: 3, 41: 1, 13: 1, 14: 1, 15: 1, 25: 1}
OK	33687-84-2	CC1C=C(C(=O)S1)C	{1: 2, 41: 1, 12: 1, 14: 1, 15: 1, 25: 1}
OK	33687-85-3	CC1C=CSC1=O	{1: 1, 12: 1, 41: 1, 14: 2, 25: 1}
OK	33689-28-0	C1CC(=O)C1=O	{25: 2, 11: 2}
OK	3369-48-0	[C](C(F)(F)F)(F)F	{16: 5, 4: 1, 7: 1}
OK	3369-52-6	C1C2C(CO1)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{11: 2, 12: 2, 13: 3, 15: 2, 17: 6, 23: 1}
OK	33693-67-3	CC1(CCOC1=O)Br	{1: 1, 18: 1, 11: 2, 28: 1, 13: 1}
OK	33693-78-6	CC(C)C(Br)Br	{1: 2, 18: 2, 3: 2}
OK	337-28-0	CCOC(C(C(F)(F)F)(F)F)O	{1: 1, 2: 1, 3: 1, 4: 2, 16: 5, 20: 1, 22: 1}
OK	3370-35-2	CCCCCCCCCCCCCCCCCC(=O)NCO	{24: 1, 1: 1, 2: 17, 20: 1, 31: 1}
OK	3370-81-8	CO[C@H]1[C@@H]([C@H](OC([C@@H]1O)O)CO)O	{1: 1, 2: 1, 12: 5, 20: 4, 22: 1, 23: 1}
OK	33701-58-5	CC(=C1C2C=CC1C3C2C3)C	{1: 2, 7: 1, 11: 1, 12: 4, 14: 2, 15: 1}
OK	33703-08-1	CC(C)CCCCCCOC(=O)CCCCC(=O)OCCCCCCC(C)C	{1: 4, 2: 16, 3: 2, 28: 2}
OK	33707-76-5	CCCCCCCCCCCCCCCCCC(=O)N1CCCC1	{24: 1, 1: 1, 2: 16, 11: 4, 33: 1}
OK	33709-65-8	CC1(N(CCN1C)C)C	{1: 4, 11: 2, 13: 1, 33: 2}
OK	33733-90-3	C=COC#C	{9: 1, 10: 1, 22: 1, 5: 1, 6: 1}
OK	3374-04-7	CC(C(=O)O)N(CCCl)CCCl.Cl	{1: 1, 2: 4, 3: 1, 33: 1, 17: 3, 27: 1}
OK	3374-22-9	C(C(C(=O)O)N)S	{27: 1, 2: 1, 3: 1, 30: 1, 39: 1}
OK	3374-41-2	C[C@H](CCCC(C)C)[C@H]1CC[C@@]2([C@@]1(CC=C3[C@H]2CCC4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C	{1: 8, 2: 3, 3: 2, 11: 7, 12: 4, 13: 4, 14: 1, 15: 1, 20: 1}
OK	33742-81-3	C1CC(C1)(Br)Br	{18: 2, 11: 3, 13: 1}
OK	33744-35-3	CCCNCCS.Cl	{1: 1, 2: 4, 31: 1, 39: 1, 17: 1}
OK	3375-22-2	C/C(=C\Cl)/CCl	{1: 1, 2: 1, 17: 2, 6: 1, 7: 1}
OK	3375-84-6	CC1CN(C(=O)O1)CC(C)O	{1: 2, 2: 1, 3: 1, 33: 1, 11: 1, 12: 1, 20: 1, 28: 1}
OK	33755-46-3	CCCCC(=O)O[C@@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)C(=O)CO	{1: 4, 2: 4, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	33755-64-5	CC=C=CC=C	{8: 1, 1: 1, 5: 1, 6: 3}
OK	33758-16-6	CCCCCCCC[C@H](C)O	{1: 2, 2: 7, 3: 1, 20: 1}
OK	33758-34-8	CCCCCCCOC(=O)Cl	{1: 1, 2: 6, 28: 1, 17: 1}
OK	3376-35-0	CC(=NOC)C	{1: 3, 34: 1, 22: 1, 7: 1}
OK	3376-48-5	CCCCCCCCCC(=O)OC(CO)CO	{1: 1, 2: 10, 3: 1, 20: 2, 28: 1}
OK	33765-68-3	CC[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]2([C@H]1O)C	{1: 2, 2: 1, 11: 7, 12: 6, 13: 1, 14: 1, 15: 1, 20: 1, 25: 1}
OK	33765-80-9	CC[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]2([C@H]1OC(=O)C)C	{1: 3, 2: 1, 11: 7, 12: 6, 13: 1, 14: 1, 15: 1, 25: 1, 28: 1}
OK	3377-24-0	CC(C)(C1CCC(CC1)N)C2CCC(CC2)N	{1: 2, 11: 8, 4: 1, 30: 2, 12: 4}
OK	3377-86-4	CCCCC(C)Br	{1: 2, 2: 3, 3: 1, 18: 1}
OK	3377-87-5	CCCC(CC)Br	{1: 2, 2: 3, 3: 1, 18: 1}
OK	3377-92-2	CC(C)(C)C(=O)OC=C	{1: 3, 4: 1, 5: 1, 6: 1, 28: 1}
OK	3378-20-9	CC(C)(C)C(=C)C(=C)C(C)(C)C	{1: 6, 4: 2, 5: 2, 7: 2}
OK	3378-45-8	C1CCC(CC1)N([N+](=O)C2CCCCC2)[O-]	{33: 2, 11: 10, 12: 2, 29: 2}
OK	3378-71-0	CC1CCC(N1)C	{32: 1, 1: 2, 11: 2, 12: 2}
OK	33788-00-0	CCCCCC(CCCCC)N	{1: 2, 2: 8, 3: 1, 30: 1}
OK	338-03-4	CC(CC(=O)O)(C(F)(F)F)O	{1: 1, 2: 1, 4: 2, 16: 3, 20: 1, 27: 1}
OK	338-23-8	C(C(CF)(CF)CF)F	{16: 4, 2: 4, 4: 1}
OK	338-65-8	C(C(F)F)Cl	{16: 2, 17: 1, 2: 1, 3: 1}
OK	338-66-9	C(=NF)(F)F	{16: 3, 34: 1, 7: 1}
OK	338-69-2	C[C@H](C(=O)O)N	{27: 1, 1: 1, 3: 1, 30: 1}
OK	338-75-0	C(C(C(F)(F)F)Cl)Cl	{16: 3, 17: 2, 2: 1, 3: 1, 4: 1}
OK	338-83-0	C(C(N(C(C(C(F)(F)F)(F)F)(F)F)C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(F)F	{16: 21, 33: 1, 4: 9}
OK	338-84-1	C(C(C(N(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 33, 33: 1, 4: 15}
OK	33800-90-7	C1CC/C/2=C/C=C\C=C(/C=C2)\CC1	{11: 5, 14: 6, 15: 2}
OK	3381-26-8	CCCCCCCCCCC(CCCCCCCCCC)O	{1: 2, 2: 18, 3: 1, 20: 1}
OK	33821-94-2	C1CCOC(C1)OCCCBr	{2: 3, 11: 4, 12: 1, 18: 1, 22: 1, 23: 1}
OK	33826-92-5	CCCCCCCCNCCNCCNCCCCCCCC	{1: 2, 2: 18, 31: 3}
OK	33829-48-0	C([N+](=O)[O-])([N+](=O)[O-])(Cl)Br	{17: 1, 18: 1, 4: 1, 38: 2}
OK	3383-21-9	CC(C)(C)C1=CC(=O)C(=O)C(=C1)C(C)(C)C	{1: 6, 4: 2, 25: 2, 14: 2, 15: 2}
OK	3383-83-3	CC(C)CCCC(C)CCBr	{1: 3, 2: 5, 3: 2, 18: 1}
OK	33840-23-2	C12C3C4C3C5C1C5C6C2C46	{12: 10}
OK	33842-02-3	C[N+](=C(Cl)Cl)C.[Cl-]	{1: 2, 17: 3, 33: 1, 7: 1}
OK	3385-03-3	C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CO)C[C@@H](C5=CC(=O)C=C[C@]35C)F)O	{1: 4, 2: 1, 11: 3, 12: 6, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 23: 2, 24: 1, 25: 1}
OK	3385-21-5	C1CC(CC(C1)N)N	{11: 4, 12: 2, 30: 2}
OK	3386-33-2	CCCCCCCCCCCCCCCCCCCl	{1: 1, 2: 17, 17: 1}
OK	3386-87-6	C(COCCOCCC#N)C#N	{2: 6, 37: 2, 22: 2}
OK	33868-17-6	CN(C#N)N=O	{1: 1, 34: 1, 37: 1, 29: 1, 33: 1}
OK	3387-41-5	CC(C)C12CCC(=C)C1C2	{1: 2, 3: 1, 5: 1, 11: 3, 12: 1, 13: 1, 15: 1}
OK	33879-04-8	C[C@]12CCC(=O)C[C@]1(CCC2=O)O	{1: 1, 11: 5, 20: 1, 13: 2, 25: 2}
OK	33879-72-0	CCC(C)(CCO)O	{1: 2, 2: 3, 4: 1, 20: 2}
OK	3388-72-5	CCCCCCCCC=CCCCCCCCC1=NCCN1CCO.CC(=O)O	{1: 2, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 20: 1, 27: 1}
OK	3388-79-2	C1CNC(CN1)CCO	{32: 2, 20: 1, 2: 2, 11: 3, 12: 1}
OK	33881-78-6	CC(C)CCCCCOC(=O)CCSSCCC(=O)OCCCCCC(C)C	{40: 2, 1: 4, 2: 14, 3: 2, 28: 2}
OK	33884-43-4	C1COC(OC1)CCBr	{2: 2, 11: 3, 12: 1, 18: 1, 23: 2}
OK	3389-71-7	C1=CC2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 13: 3, 14: 2, 15: 2}
OK	33898-53-2	C1C(N1)C#N	{32: 1, 11: 1, 12: 1, 37: 1}
OK	339-16-2	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)OC)/C)/C	{1: 6, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 28: 1}
OK	339-72-0	C1[C@@H](C(=O)NO1)N	{32: 1, 11: 1, 12: 1, 23: 1, 25: 1, 30: 1}
OK	339-98-0	C[C@@H]1CC(=O)C([C@H]2C1[C@H]3CC[C@@H]4[C@H]5[C@H]6C(CCC5(CC[C@]4([C@@]3(CC2)C)C)CO6)(C)C)(C)C	{1: 7, 11: 10, 12: 7, 13: 5, 23: 1, 25: 1}
OK	3390-12-3	CC1COC(O1)C	{1: 2, 11: 1, 12: 2, 23: 2}
OK	3390-13-4	CCCC1OCCO1	{1: 1, 2: 2, 11: 2, 12: 1, 23: 2}
OK	33907-46-9	CCCCCCCCCCCCCCCCC(C(=O)OC(C)O)O	{1: 2, 2: 15, 3: 2, 20: 2, 28: 1}
OK	3391-07-9	CC(C)(C)OC1C2CCC1CC2	{1: 3, 11: 4, 4: 1, 22: 1, 12: 3}
OK	3391-83-1	C1CCCCC(=O)OCCCCCOCCCC1	{11: 14, 28: 1, 23: 1}
OK	3391-86-4	CCCCCC(C=C)O	{1: 1, 2: 4, 3: 1, 5: 1, 6: 1, 20: 1}
OK	3391-90-0	C[C@H]1CCC(=C(C)C)C(=O)C1	{1: 3, 7: 1, 11: 3, 12: 1, 15: 1, 25: 1}
OK	339152-94-2	C1(=C(C(=O)NC1=O)Cl)C(Cl)Cl	{32: 1, 17: 3, 3: 1, 25: 2, 15: 2}
OK	339152-95-3	C(C1=C(C(=O)NC1=O)Cl)Cl	{32: 1, 17: 2, 2: 1, 25: 2, 15: 2}
OK	339152-96-4	C(C1=C(C(=O)NC1=O)Cl)Br	{32: 1, 2: 1, 15: 2, 17: 1, 18: 1, 25: 2}
OK	33922-66-6	CCCCCCC1C(=O)C=C(O1)C	{1: 2, 2: 5, 12: 1, 14: 1, 15: 1, 23: 1, 25: 1}
OK	33922-75-7	CC1=C(C(=O)SC1)C	{1: 2, 11: 1, 25: 1, 41: 1, 15: 2}
OK	33922-80-4	CC=CSC=CC	{40: 1, 1: 2, 6: 4}
OK	33925-62-1	CCCOCCCCCCCCCCO	{1: 1, 2: 12, 20: 1, 22: 1}
OK	33925-73-4	CCC#CCCCCCCCCCCO	{1: 1, 2: 11, 20: 1, 10: 2}
OK	33925-75-6	CC#CCCCCCCCCCCO	{1: 1, 2: 10, 20: 1, 10: 2}
OK	3393-34-8	C/C=C/1\CCC(=O)O1	{1: 1, 11: 2, 28: 1, 6: 1, 15: 1}
OK	3393-45-1	C1COC(=O)C=C1	{11: 2, 28: 1, 14: 2}
OK	3393-64-4	CC(CO)C(=O)C	{24: 1, 1: 2, 2: 1, 3: 1, 20: 1}
OK	33930-87-9	C1CCC23CCC2(C1)C=CC=C3	{11: 6, 13: 2, 14: 4}
OK	33931-44-1	CCN(CC)C(=O)C(C)C	{24: 1, 1: 4, 2: 2, 3: 1, 33: 1}
OK	33933-77-6	CCCC(CCC(C)C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	33933-78-7	CCCCC(C)(CCCC)O	{1: 3, 2: 6, 4: 1, 20: 1}
OK	33933-79-8	CCCCC(C)(CC(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	33939-64-9	CCCCCCCCCCCCOCCOCC(=O)O	{1: 1, 2: 14, 27: 1, 22: 2}
OK	33941-15-0	C1COCCOCCOCCOCCOCCN1	{32: 1, 11: 12, 23: 5}
OK	33943-21-4	CCC(CC)C(C(C)C)O	{1: 4, 2: 2, 3: 3, 20: 1}
OK	3395-91-3	COC(=O)CCBr	{1: 1, 2: 2, 28: 1, 18: 1}
OK	33956-49-9	CC=CC=CCCCCCCCO	{1: 1, 2: 7, 20: 1, 6: 4}
OK	3396-02-9	CCCCCCCCC(C)(C)O	{1: 3, 2: 7, 4: 1, 20: 1}
OK	3396-14-3	C1CC(C1C(=O)O)C(=O)O	{27: 2, 11: 2, 12: 2}
OK	3396-17-6	C1CC(C1C#N)C#N	{11: 2, 12: 2, 37: 2}
OK	3396-20-1	COC(=O)C1CCC1C(=O)OC	{1: 2, 11: 2, 12: 2, 28: 2}
OK	3396-99-4	CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O	{1: 1, 2: 1, 12: 5, 20: 4, 22: 1, 23: 1}
OK	33965-80-9	C(C(C#N)O)Cl	{17: 1, 2: 1, 3: 1, 20: 1, 37: 1}
OK	33968-47-7	CCCCCCCCCCCCCC(CO)O	{1: 1, 2: 13, 3: 1, 20: 2}
OK	33972-81-5	CCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 4, 4: 1, 28: 1, 17: 3}
OK	33973-59-0	CC1(CC(=O)CC(N1)(C)C)C.Cl	{32: 1, 1: 4, 11: 2, 13: 2, 17: 1, 25: 1}
OK	33978-70-0	CCC(C)C1CCC(O1)(C)C	{1: 4, 2: 1, 3: 1, 11: 2, 12: 1, 13: 1, 23: 1}
OK	33978-71-1	CCCCCCC(CCC(C)C)O	{1: 3, 2: 7, 3: 2, 20: 1}
OK	3398-69-4	CCN(C(C)(C)C)N=O	{1: 4, 2: 1, 4: 1, 33: 1, 34: 1, 29: 1}
OK	3399-22-2	COC(=O)C1CCC(CC1)C(=O)OC	{1: 2, 11: 4, 12: 2, 28: 2}
OK	3399-73-3	C1CCC(=CC1)CCN	{2: 2, 11: 4, 30: 1, 14: 1, 15: 1}
OK	33996-33-7	CC(=O)N1C[C@@H](C[C@H]1C(=O)O)O	{1: 1, 33: 1, 11: 2, 12: 2, 20: 1, 24: 1, 27: 1}
OK	3400-09-7	N(Cl)Cl	{17: 2, 31: 1}
OK	3400-13-3	CN1C2(O1)CCCCC2	{1: 1, 33: 1, 11: 5, 13: 1, 23: 1}
OK	3400-45-1	C1CCC(C1)C(=O)O	{27: 1, 11: 4, 12: 1}
OK	34001-52-0	CC(C)(C)COC(=O)CCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 3, 2: 3, 4: 2, 38: 3, 28: 1}
OK	34003-72-0	CC1CC(=O)CO1	{1: 1, 11: 2, 12: 1, 25: 1, 23: 1}
OK	34006-60-5	CCOC(C(=O)OCC)Cl	{1: 2, 2: 2, 3: 1, 17: 1, 22: 1, 28: 1}
OK	3401-01-2	CC(C)C1C(=O)CCCC1=O	{11: 3, 1: 2, 3: 1, 12: 1, 25: 2}
OK	34010-15-6	CCC=CCCCCCCCCCCO	{1: 1, 2: 11, 20: 1, 6: 2}
OK	34010-21-4	CCCC/C=C\CCCCCCCCCCOC(=O)C	{1: 2, 2: 13, 28: 1, 6: 2}
OK	34013-88-2	C=CCOCC(COCCO)O	{2: 5, 3: 1, 5: 1, 6: 1, 20: 2, 22: 2}
OK	34036-26-5	C(C([N+](=O)[O-])([N+](=O)[O-])F)OC(=O)C(=O)OCC([N+](=O)[O-])([N+](=O)[O-])F	{16: 2, 28: 2, 2: 2, 4: 2, 38: 4}
OK	34039-83-3	C1CCCCCC(CCCCC1)Cl	{17: 1, 11: 11, 12: 1}
OK	3404-55-5	CCC(C)C=CC	{1: 3, 2: 1, 3: 1, 6: 2}
OK	3404-56-6	CCCC(C)C=CC	{1: 3, 2: 2, 3: 1, 6: 2}
OK	3404-57-7	CCC=CCC(C)C	{1: 3, 2: 2, 3: 1, 6: 2}
OK	3404-58-8	CCCC(CC)C=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1}
OK	3404-61-3	CCCC(C)C=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1}
OK	3404-62-4	CC=CCC(C)C	{1: 3, 2: 1, 3: 1, 6: 2}
OK	3404-63-5	CCC(=C)C=C	{1: 1, 2: 1, 5: 2, 6: 1, 7: 1}
OK	3404-67-9	CCC(C)C(=C)CC	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1}
OK	3404-71-5	CCCC(=C)CC	{1: 2, 2: 3, 5: 1, 7: 1}
OK	3404-72-6	CCC(C)C(=C)C	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1}
OK	3404-73-7	CCC(C)(C)C=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1}
OK	3404-75-9	CCCCC(=CC)C	{1: 3, 2: 3, 6: 1, 7: 1}
OK	3404-77-1	CCCC(C)(C)C=C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 1}
OK	3404-78-2	CC(C)CC=C(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1}
OK	3404-80-6	CCC(=C)CC(C)C	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1}
OK	34047-39-7	CC(=O)CCSC	{24: 1, 1: 2, 2: 2, 40: 1}
OK	3405-32-1	C(C(C(CCl)Cl)Cl)Cl	{17: 4, 2: 2, 3: 2}
OK	3405-42-3	CCCN(C)CCC	{1: 3, 2: 4, 33: 1}
OK	3405-45-6	CCCCN(C)CCCC	{1: 3, 2: 6, 33: 1}
OK	3405-48-9	C1C2CC3CC1CC(C2)(C3)NC=O	{26: 1, 11: 6, 12: 3, 13: 1, 31: 1}
OK	34067-75-9	CCCC1CCC=C1	{1: 1, 2: 2, 11: 2, 12: 1, 14: 2}
OK	34069-94-8	C(=O)(C(Cl)(Cl)Cl)Br	{24: 1, 17: 3, 18: 1, 4: 1}
OK	34101-24-1	CC12C(=C)C(=C)C1(C3(C2(C(=C)C3=C)C)C)C	{1: 4, 15: 4, 5: 4, 13: 4}
OK	34102-49-3	C1CCC2C(C1)C(=O)N2	{32: 1, 25: 1, 11: 4, 12: 2}
OK	34105-76-5	CC(C)(C)C1=CC=C(C(=O)C1=O)C(C)(C)C	{1: 6, 4: 2, 25: 2, 14: 2, 15: 2}
OK	34106-16-6	CC12C(=C)C(=C)C3(C1(C3(C(=C)C2=C)C)C)C	{1: 4, 15: 4, 5: 4, 13: 4}
OK	34114-98-2	CC1=C[C@@H]2[C@](C[C@@H]1OC(=O)CC(C)C)([C@]3([C@@H]([C@H]([C@H](C34CO4)O2)O)O)C)CO	{1: 4, 2: 2, 3: 1, 11: 2, 12: 5, 13: 3, 14: 1, 15: 1, 20: 3, 23: 2, 28: 1}
OK	34122-40-2	CC1(C2CCC(CC2)(N([N+]1=O)[O-])C)C	{1: 3, 33: 2, 11: 4, 12: 1, 13: 2, 29: 2}
OK	34122-54-8	C12C3C1C4C2C3N=N4	{35: 2, 12: 6}
OK	3413-72-7	CNN/N=C/1\C(=NC=N1)C(=O)N	{1: 1, 34: 1, 35: 2, 14: 1, 15: 2, 24: 1, 30: 1, 31: 2}
OK	3413-73-8	CCNN/N=C/1\C(=NC=N1)C(=O)N	{1: 1, 2: 1, 35: 2, 34: 1, 14: 1, 15: 2, 24: 1, 30: 1, 31: 2}
OK	3413-78-3	CCOC(=O)CNNN=C1C(=NC=N1)C(=O)N	{1: 1, 2: 2, 35: 2, 34: 1, 14: 1, 15: 2, 24: 1, 28: 1, 30: 1, 31: 2}
OK	34131-96-9	CC(C)C1CCC2=CC(=O)CCC2C1	{1: 2, 3: 1, 11: 5, 12: 2, 14: 1, 15: 1, 25: 1}
OK	34131-99-2	CC(C)C1CCC2CC(CCC2C1)O	{11: 6, 1: 2, 3: 1, 12: 4, 20: 1}
OK	34135-85-8	CSSSCC=C	{40: 3, 1: 1, 2: 1, 5: 1, 6: 1}
OK	3415-90-5	CC12CCC3C(C1CCC2(C)O)CCC4=C(C(=O)CCC34)Cl	{1: 2, 11: 8, 12: 4, 13: 2, 15: 2, 17: 1, 20: 1, 25: 1}
OK	34150-35-1	CC(C)COCCCO	{1: 2, 2: 4, 3: 1, 20: 1, 22: 1}
OK	34155-34-5	CCCN(CCC)CC(C)N	{1: 3, 2: 5, 3: 1, 30: 1, 33: 1}
OK	3416-74-8	CCCCC#CCCCCl	{1: 1, 2: 6, 10: 2, 17: 1}
OK	3418-05-1	CCCCCC(=O)NC	{24: 1, 1: 2, 2: 4, 31: 1}
OK	34180-11-5	CC(C)COCCl	{1: 2, 2: 2, 3: 1, 22: 1, 17: 1}
OK	3419-32-7	CCOC(=O)C1C(CC=CC1=O)C	{1: 2, 2: 1, 11: 1, 12: 2, 14: 2, 25: 1, 28: 1}
OK	3419-66-7	CC(C)(C)C1=CCCCC1	{1: 3, 11: 4, 4: 1, 14: 1, 15: 1}
OK	3419-71-4	CC1=CCC(CC1)(C)C	{1: 3, 11: 3, 13: 1, 14: 1, 15: 1}
OK	3420-36-8	CCCCCCCC[C@@H]1[C@@H](O1)CCCCCCCCCCCC(=O)O	{1: 1, 2: 18, 27: 1, 12: 2, 23: 1}
OK	34200-96-9	CCCC(CCC(=C1C(=O)CCC1=O)O)O	{1: 1, 2: 4, 3: 1, 7: 1, 11: 2, 15: 1, 20: 2, 25: 2}
OK	34211-26-2	C1=C/C(=C\[NH+]=O)/N(C=C1)COCN2/C(=C/[NH+]=O)/C=CC=C2.[Cl-].[Cl-]	{33: 2, 2: 2, 6: 2, 14: 8, 15: 2, 17: 2, 22: 1, 29: 2, 31: 2}
OK	34212-59-4	C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)CCC(=O)O[C@@H]2C[C@@H](CC[C@H]2C(C)C)C)C(C)C	{1: 6, 2: 2, 3: 2, 11: 6, 12: 6, 28: 2}
OK	34216-34-7	CC1(CCCCC1(C)N)C	{1: 3, 11: 4, 13: 2, 30: 1}
OK	3422-07-9	CC(=C)C1(CC1)C	{1: 2, 11: 2, 13: 1, 5: 1, 7: 1}
OK	34227-72-0	CCCCCCCCCCCCCC=C[C@H]([C@H](CO)NC(=O)CCCCCCCCCCCCC)O	{1: 2, 2: 25, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	3423-26-5	CC(=O)OC1CC2CCC(C1)N2C	{1: 2, 11: 4, 12: 3, 28: 1, 33: 1}
OK	3424-05-3	C1(=C(C(C(=C(Cl)Cl)C1(Cl)Cl)(Cl)Cl)Cl)Cl	{17: 8, 15: 3, 13: 2, 7: 1}
OK	34240-76-1	CC(C)CCNCCO	{1: 2, 2: 4, 3: 1, 20: 1, 31: 1}
OK	3425-61-4	CCC(C)(C)OO	{1: 3, 2: 1, 4: 1, 22: 1, 20: 1}
OK	34257-95-9	C[C@@H]1C[C@@H]2[C@@H]([C@@H](C(=O)O2)C)[C@@H]([C@]3([C@H]1C=CC3=O)C)O	{1: 3, 11: 1, 12: 6, 13: 1, 14: 2, 20: 1, 25: 1, 28: 1}
OK	34263-68-8	CCC(C)CCCN	{1: 2, 2: 4, 3: 1, 30: 1}
OK	34266-16-5	CCCCC=CC=CC	{1: 2, 2: 3, 6: 4}
OK	34272-83-8	CC1(CC(C(N1O)(C)C)N)C	{1: 4, 33: 1, 11: 1, 12: 1, 13: 2, 20: 1, 30: 1}
OK	34289-89-9	CC(CCCC1(C2CCC(C2)C1=C)C)CO	{1: 2, 2: 4, 3: 1, 5: 1, 11: 3, 12: 2, 13: 1, 15: 1, 20: 1}
OK	34291-02-6	C1C(C(C(C(C1NC(=O)C(CCN)O)O)OC2C(C(C(O2)CO)O)O)OC3C(C(C(C(O3)CN)O)O)N)N	{2: 4, 3: 1, 11: 1, 12: 14, 20: 7, 22: 2, 23: 2, 24: 1, 30: 4, 31: 1}
OK	34295-85-7	C1=C/C(=C\NCCC(=O)O)/C(=O)C=C1	{2: 2, 6: 1, 14: 4, 15: 1, 25: 1, 27: 1, 31: 1}
OK	34300-94-2	CC(C)(CCO)S	{1: 2, 2: 2, 4: 1, 20: 1, 39: 1}
OK	34301-54-7	C1C2CC3CC1CC(C2)(C3)S	{11: 6, 12: 3, 13: 1, 39: 1}
OK	34303-81-6	CCCCCCCCCCCCC=CCC	{1: 2, 2: 12, 6: 2}
OK	34312-70-4	C1=CN(C=CC1=C[NH+]=O)CCCCCCN2C=CC(=C[NH+]=O)C=C2.[Br-].[Br-]	{33: 2, 2: 6, 6: 2, 14: 8, 15: 2, 18: 2, 29: 2, 31: 2}
OK	34314-83-5	CC1=COCC1	{23: 1, 1: 1, 11: 2, 14: 1, 15: 1}
OK	34316-64-8	CCCCCCCCCCCC(=O)OCCCCCC	{1: 2, 2: 15, 28: 1}
OK	34317-39-0	CC(C)C(C)NC	{1: 4, 3: 2, 31: 1}
OK	34322-87-7	CC(C(=O)O)NC(=O)CCN	{1: 1, 2: 2, 3: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	34324-40-8	C1=CC2C3C=CC4C1C2C43	{12: 6, 14: 4}
OK	3433-34-9	CCN1CCCC1CO	{1: 1, 2: 2, 33: 1, 11: 3, 12: 1, 20: 1}
OK	3433-37-2	C1CCNC(C1)CO	{32: 1, 20: 1, 2: 1, 11: 4, 12: 1}
OK	34331-58-3	CCCCNC(=NCCCC)N	{1: 2, 2: 6, 7: 1, 34: 1, 30: 1, 31: 1}
OK	34338-96-0	C[C@@H](CC[C@H](C)O)O	{1: 2, 2: 2, 3: 2, 20: 2}
OK	34359-77-8	COCC(OC)(OC)OC	{1: 4, 2: 1, 4: 1, 22: 4}
OK	34362-49-7	C=CC(=O)OCCC(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 14, 5: 1, 6: 1, 16: 29, 28: 1}
OK	3437-30-7	CC1(CCNC1)C	{32: 1, 1: 2, 11: 3, 13: 1}
OK	3437-84-1	CC(C)C(=O)OOC(=O)C(C)C	{1: 4, 3: 2, 28: 2}
OK	34375-39-8	CC(=O)NNC(=O)CCCCC(=O)NNC(=O)C	{24: 4, 1: 2, 2: 4, 31: 4}
OK	34375-89-8	CC1CCNC1	{32: 1, 1: 1, 11: 3, 12: 1}
OK	34381-71-0	CN1CCC[C@H]1CO	{1: 1, 2: 1, 33: 1, 11: 3, 12: 1, 20: 1}
OK	34395-24-9	C=CC(=O)OCCC(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 12, 5: 1, 6: 1, 16: 25, 28: 1}
OK	34399-67-2	CCOC(C)OCCCBr	{1: 2, 2: 4, 3: 1, 18: 1, 22: 2}
OK	344-25-2	C1C[C@@H](NC1)C(=O)O	{27: 1, 32: 1, 11: 3, 12: 1}
OK	34403-14-0	CC(C)(C)C1=CC(=O)C(=C(C1=O)Cl)Cl	{1: 3, 4: 1, 14: 1, 15: 3, 17: 2, 25: 2}
OK	34419-05-1	CN1C(=O)C2=C(C1=O)SCCS2	{1: 1, 33: 1, 41: 2, 11: 2, 15: 2, 25: 2}
OK	34424-57-2	C[C@H]1CC23CC[C@H]4[C@]([C@@H]2CC[C@H]1C3)(C=CCC4(C)C)C	{1: 4, 11: 7, 12: 4, 13: 3, 14: 2}
OK	3443-83-2	CCCCCCCCCCCCCC(=O)OC(CO)CO	{1: 1, 2: 14, 3: 1, 20: 2, 28: 1}
OK	3445-11-2	C1CC(=O)N(C1)CCO	{25: 1, 2: 2, 11: 3, 20: 1, 33: 1}
OK	3445-84-9	C(CN(CCC#N)C=O)C#N	{33: 1, 2: 4, 26: 1, 37: 2}
OK	34450-62-9	CCOC(=O)C=C(C)I	{1: 2, 2: 1, 6: 1, 7: 1, 19: 1, 28: 1}
OK	34451-18-8	CCCCOC(=O)[C@@H](C)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1}
OK	34451-19-9	CCCCOC(=O)[C@H](C)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1}
OK	34454-77-8	CC(=CCOC(C)(C)C=C)C	{1: 4, 2: 1, 4: 1, 5: 1, 6: 2, 7: 1, 22: 1}
OK	34454-78-9	CC(=C(C)O)C	{1: 3, 20: 1, 7: 2}
OK	34458-54-3	C1CCCCCC/C=C\CCCCCC1	{11: 13, 14: 2}
OK	3446-98-8	CCCCC1CCCN1	{32: 1, 1: 1, 2: 3, 11: 3, 12: 1}
OK	3448-56-4	CS/C=C/C#C	{40: 1, 1: 1, 10: 1, 6: 2, 9: 1}
OK	34490-86-3	COC(=N)CCCCCCC(=N)OC.Cl.Cl	{1: 2, 2: 6, 36: 2, 7: 2, 17: 2, 22: 2}
OK	34493-89-5	CC1(C([N+](=O)N1[O-])(C)C)C	{1: 4, 33: 2, 13: 2, 29: 2}
OK	34493-98-6	C1C[C@H]([C@H](O[C@@H]1CN)O[C@@H]2[C@H](C[C@H]([C@@H]([C@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)O)N)N)N	{2: 2, 11: 3, 12: 13, 20: 4, 22: 2, 23: 2, 30: 5}
OK	34511-01-8	CCCC=C=CCC	{8: 1, 1: 2, 2: 3, 6: 2}
OK	34511-84-7	C1CC2C3CCC4C1C2C43	{11: 4, 12: 6}
OK	3452-07-1	CCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 17, 5: 1, 6: 1}
OK	3452-09-3	CCCCCCCC#C	{1: 1, 2: 6, 10: 1, 9: 1}
OK	3452-97-9	CC(CCO)CC(C)(C)C	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	34520-27-9	C(CCCl)COCOCCCCCl	{17: 2, 2: 9, 22: 2}
OK	34522-32-2	CC(C(=O)O)NC(CCCN=C(N)N)C(=O)O	{1: 1, 2: 3, 3: 2, 7: 1, 34: 1, 27: 2, 30: 2, 31: 1}
OK	34523-34-7	CC(=C1C=CC(=O)C=C1)NO	{1: 1, 7: 1, 14: 4, 15: 1, 20: 1, 25: 1, 31: 1}
OK	3453-99-4	CCC(C)(OC)OC	{1: 4, 2: 1, 4: 1, 22: 2}
OK	34560-78-6	CC1CC(SC(O1)(C)C)C	{1: 4, 41: 1, 11: 1, 12: 2, 13: 1, 23: 1}
OK	34562-99-7	CCCCCCCCCCCCCCCCOC(=O)CCCN	{1: 1, 2: 18, 28: 1, 30: 1}
OK	34566-04-6	CCCCCC[C@H](C)N	{1: 2, 2: 5, 3: 1, 30: 1}
OK	34566-05-7	CCCCCC[C@@H](C)N	{1: 2, 2: 5, 3: 1, 30: 1}
OK	3457-57-6	CCC(C)C[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 38: 1}
OK	34570-59-7	CC(C(Br)Br)(Br)Br	{1: 1, 18: 4, 3: 1, 4: 1}
OK	34579-77-6	CCC(CC)(CC)C#N	{1: 3, 2: 3, 4: 1, 37: 1}
OK	3458-28-4	O=C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO	{2: 1, 3: 4, 20: 5, 26: 1}
OK	34581-76-5	C(C(C(Br)Br)Br)Br	{2: 1, 3: 2, 18: 4}
OK	34589-22-5	CCCCCCCOC(=O)CCl	{1: 1, 2: 7, 28: 1, 17: 1}
OK	3459-83-4	CCOCCCOCC	{1: 2, 2: 5, 22: 2}
OK	34590-94-8	COC(C)COC(C)CO	{1: 3, 2: 2, 3: 2, 20: 1, 22: 2}
OK	34592-47-7	C1[C@H](NCS1)C(=O)O	{27: 1, 32: 1, 11: 2, 12: 1, 41: 1}
OK	3460-37-5	CCCCCCCCCCCCCCCCCC(=O)OCCCCCC	{1: 2, 2: 21, 28: 1}
OK	34612-38-9	C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)O)CO)CO)CO)O)O)O)O	{20: 14, 2: 4, 12: 20, 22: 3, 23: 4}
OK	34620-77-4	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](OC([C@@H]([C@H]6O)O)O)CO)CO)CO)CO)CO)O)O)O)O	{20: 20, 2: 6, 12: 30, 22: 5, 23: 6}
OK	34626-51-2	C(CCO)CCBr	{2: 5, 20: 1, 18: 1}
OK	3463-81-8	C1CC23CC2(C1)C=CC=C3	{11: 4, 13: 2, 14: 4}
OK	3463-92-1	CC1C2CCC(N1)CCCCCCCC(=O)OC3CCC(CCCCCCCC(=O)O2)NC3C	{32: 2, 1: 2, 11: 18, 12: 6, 28: 2}
OK	3464-50-4	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)CCl)C)C	{1: 5, 2: 4, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 17: 1, 28: 1}
OK	34640-76-1	CC(=O)OC1CC2CCC1C2	{1: 1, 11: 4, 12: 3, 28: 1}
OK	34675-24-6	CC1CCC(C(C1)OC(=O)C=CC(=O)OC2CC(CCC2C(C)C)C)C(C)C	{1: 6, 3: 2, 6: 2, 11: 6, 12: 6, 28: 2}
OK	34678-40-5	CCCC/C=C/C1(CCCCC1)O	{1: 1, 2: 3, 6: 2, 11: 5, 13: 1, 20: 1}
OK	34681-10-2	CC(C(=NOC(=O)NC)C)SC	{1: 4, 34: 1, 3: 1, 7: 1, 40: 1, 28: 1, 31: 1}
OK	34683-73-3	C(CCCI)CCCl	{17: 1, 2: 6, 19: 1}
OK	34686-67-4	CCCC=CCC1CCCC1O	{1: 1, 2: 3, 6: 2, 11: 3, 12: 2, 20: 1}
OK	34687-35-9	CCCN(CCC)/N=C/CC	{1: 3, 2: 5, 34: 1, 6: 1, 33: 1}
OK	34687-46-2	CCCC=CCC1CCCC1=O	{1: 1, 2: 3, 6: 2, 11: 3, 12: 1, 25: 1}
OK	34689-06-0	CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCC	{1: 2, 2: 25, 28: 1}
OK	3470-96-0	CCCCN1C(=O)CCC1=O	{1: 1, 2: 3, 11: 2, 33: 1, 25: 2}
OK	3470-98-2	CCCCN1CCCC1=O	{1: 1, 2: 3, 11: 3, 33: 1, 25: 1}
OK	3471-13-4	CC1(CC(=CC(=O)C1)O)C	{1: 2, 11: 2, 13: 1, 14: 1, 15: 1, 20: 1, 25: 1}
OK	34715-98-5	CC(C)(C)C[N+](=O)[O-]	{1: 3, 2: 1, 4: 1, 38: 1}
OK	34719-63-6	CCCCCCCCCCCCCCCC(CO)O	{1: 1, 2: 15, 3: 1, 20: 2}
OK	34723-82-5	C1CCOC(C1)CBr	{2: 1, 11: 4, 12: 1, 18: 1, 23: 1}
OK	3473-11-8	C=NO.Cl	{17: 1, 34: 1, 20: 1, 5: 1}
OK	34733-74-9	C1=CC2C=CC(C2=O)C=C1	{25: 1, 12: 2, 14: 6}
OK	3474-12-2	[CH](Cl)Cl	{17: 2, 6: 1}
OK	3474-30-4	CCCCC[CH]C	{1: 2, 2: 4, 6: 1}
OK	34748-63-5	CCOCC1(CC2CC1C3C2CCC3)O	{1: 1, 2: 2, 11: 5, 12: 4, 13: 1, 20: 1, 22: 1}
OK	3475-63-6	CN(C)C(=O)N(C)N=O	{24: 1, 1: 3, 34: 1, 29: 1, 33: 2}
OK	34760-60-6	C(C(C(=O)O)N)SSCC(C(=O)O)N.Cl	{2: 2, 3: 2, 40: 2, 17: 1, 27: 2, 30: 2}
OK	34761-47-2	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)F	{16: 30, 24: 1, 4: 14, 22: 4}
OK	3479-85-4	C(CC(C(=O)O)Br)C(C(=O)O)Br	{27: 2, 2: 2, 3: 2, 18: 2}
OK	348-66-3	C(C[C@H](C(=O)O)N)CN	{27: 1, 2: 3, 3: 1, 30: 2}
OK	348-67-4	CSCC[C@H](C(=O)O)N	{1: 1, 2: 2, 3: 1, 40: 1, 27: 1, 30: 1}
OK	348-75-4	CC(CC(=O)O)C(F)(F)F	{1: 1, 2: 1, 3: 1, 4: 1, 16: 3, 27: 1}
OK	34819-86-8	CC1C(C(C=CO1)OC(=O)C)OC(=O)C	{1: 3, 12: 3, 28: 2, 14: 2, 23: 1}
OK	3482-63-1	CCCCCCCCCCCCOC	{1: 2, 2: 11, 22: 1}
OK	3483-12-3	C(C(C(CS)O)O)S	{2: 2, 3: 2, 20: 2, 39: 2}
OK	34839-13-9	C([C@@H](CCl)O)N.Cl	{17: 2, 2: 2, 3: 1, 20: 1, 30: 1}
OK	3484-68-2	C1[C@H]([C@@H]2[C@@H](C(=O)N1)N=C(N2)N[C@H]3[C@@H]([C@@H]([C@H]([C@H](O3)CO)OC(=O)N)O)NC(=O)C[C@H](CCCNC(=O)C[C@H](CCCNC(=O)C[C@H](CCCNC(=O)C[C@H](CCCNC(=O)C[C@H](CCCN)N)N)N)N)N)O	{32: 2, 2: 21, 3: 5, 11: 1, 12: 8, 15: 1, 35: 1, 20: 3, 23: 1, 24: 5, 25: 1, 28: 1, 30: 7, 31: 6}
OK	34846-90-7	COC=CC(=O)OC	{1: 2, 28: 1, 22: 1, 6: 2}
OK	3485-14-1	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C3(CCCCC3)N)C(=O)O)C	{1: 2, 33: 1, 41: 1, 11: 5, 12: 3, 13: 2, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
OK	34859-74-0	C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)O	{27: 1, 17: 1, 11: 6, 12: 2, 13: 2}
OK	34859-98-8	CCCC(C)(C)OC(=O)C	{1: 4, 2: 2, 4: 1, 28: 1}
OK	3486-08-6	C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 15, 19: 1, 4: 7}
OK	34879-70-4	CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C(=C4C=C(C(=O)C(=C4)C(C)(C)C)C(C)(C)C)C2=C5C=C(C(=O)C(=C5)C(C)(C)C)C(C)(C)C)C=C(C1=O)C(C)(C)C	{1: 24, 4: 8, 25: 4, 14: 8, 15: 16}
OK	34880-53-0	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])NCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{2: 2, 4: 2, 38: 6, 31: 1}
OK	34882-70-7	C(C([N+](=O)[O-])([N+](=O)[O-])F)N(CC([N+](=O)[O-])([N+](=O)[O-])F)N=O	{33: 1, 2: 2, 4: 2, 38: 4, 34: 1, 16: 2, 29: 1}
OK	34882-73-0	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])N(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])N=O	{33: 1, 2: 2, 4: 2, 38: 6, 34: 1, 29: 1}
OK	34884-20-3	CC1CCC(CC1)C(C)O	{11: 4, 1: 2, 3: 1, 12: 2, 20: 1}
OK	34885-03-5	CC1CCC(CC1)CO	{1: 1, 2: 1, 11: 4, 12: 2, 20: 1}
OK	34887-14-4	CCCC(C)(Cl)Cl	{1: 2, 2: 2, 4: 1, 17: 2}
OK	3489-28-9	C(CCCCS)CCCCS	{2: 9, 39: 2}
OK	34893-50-0	CC1CCC(NC1)C	{32: 1, 1: 2, 11: 3, 12: 2}
OK	34894-60-5	CC1CCCCCCCCCCCC(=O)CC1	{1: 1, 11: 13, 12: 1, 25: 1}
OK	34895-45-9	C1C2CC3CC1CC(C2)(C3)SSC45CC6CC(C4)CC(C6)C5	{40: 2, 11: 12, 12: 6, 13: 2}
OK	34901-14-9	C(CN)CO.C(CO)O	{2: 5, 20: 3, 30: 1}
OK	34902-22-2	[C](Cl)(Br)Br	{17: 1, 18: 2, 7: 1}
OK	3491-36-9	CC(C)(C#CC(C)(C)OO)OO	{1: 4, 10: 2, 4: 2, 22: 2, 20: 2}
OK	3492-47-5	CCN(CC)CC(CN(CC)CC)O	{1: 4, 2: 6, 3: 1, 20: 1, 33: 2}
OK	3494-76-6	CC(C)C1C(COC(O1)C(C)C)(C)C	{1: 6, 3: 2, 11: 1, 12: 2, 13: 1, 23: 2}
OK	34941-69-0	C1=CC=[N+](C=C1)CCO.[Cl-]	{17: 1, 2: 2, 20: 1, 14: 5, 33: 1}
OK	34942-43-3	CCCCCCCCCCCCC(C)Cl	{1: 2, 2: 11, 3: 1, 17: 1}
OK	34946-78-6	CCC(C)(C)N=O	{1: 3, 2: 1, 34: 1, 4: 1, 29: 1}
OK	34949-22-9	CCC(=O)OC(C)(C)CC	{1: 4, 2: 2, 4: 1, 28: 1}
OK	3495-46-3	CCC(C)(CC)N	{1: 3, 2: 2, 4: 1, 30: 1}
OK	34970-00-8	C(Cl)(Br)I	{19: 1, 17: 1, 18: 1, 3: 1}
OK	34970-18-8	CC1(CC(C1)C(=O)O)C	{27: 1, 1: 2, 11: 2, 12: 1, 13: 1}
OK	34973-41-6	C(C(Cl)Cl)(C(C(Cl)Cl)(Cl)Cl)Cl	{17: 7, 3: 3, 4: 1}
OK	34985-37-0	CC[C@H](C)CN	{1: 2, 2: 2, 3: 1, 30: 1}
OK	34994-81-5	CCCCCCCCCCCCCCCCCCCCI	{1: 1, 2: 19, 19: 1}
OK	34997-46-1	CCCCCCC(=O)OC(C)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	35018-15-6	CC1(CCCN1)C	{32: 1, 1: 2, 11: 3, 13: 1}
OK	3504-13-0	C(CC(=O)OO)C(=O)O	{28: 1, 2: 2, 27: 1, 20: 1}
OK	35044-68-9	CC=CC(=O)C1=C(CCCC1(C)C)C	{1: 4, 6: 2, 11: 3, 13: 1, 15: 2, 24: 1}
OK	3505-67-7	C1CC2(CCC(=O)O2)OC1=O	{11: 4, 28: 2, 13: 1}
OK	35076-92-7	C1CC(CCC1Br)Br	{18: 2, 11: 4, 12: 2}
OK	35079-50-6	CC1(CCN(C=C1)C)C	{1: 3, 11: 2, 13: 1, 14: 2, 33: 1}
OK	3508-00-7	CCCCCCCCCCCCCCCCCBr	{1: 1, 2: 16, 18: 1}
OK	3508-78-9	CC(=O)C(CC=C)C(=O)C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 24: 2}
OK	35087-20-8	CCCCCCC#CCCCCCl	{1: 1, 2: 9, 10: 2, 17: 1}
OK	35089-70-4	CCCCCCN(C(=N[N+](=O)[O-])N)N=O	{1: 1, 2: 5, 38: 1, 33: 1, 7: 1, 34: 2, 29: 1, 30: 1}
OK	3509-46-4	C1C2CC3C1C3C2Cl	{17: 1, 11: 2, 12: 5}
OK	35091-64-6	CCCN=C(N)N[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 7: 1, 34: 1, 30: 1, 31: 1}
OK	35092-73-0	CCOC(=O)/C(=C\1/C=CC(=O)C=C1O)/N.Cl	{1: 1, 2: 1, 7: 1, 14: 3, 15: 2, 17: 1, 20: 1, 25: 1, 28: 1, 30: 1}
OK	3511-19-1	C1COC(C1Cl)Cl	{17: 2, 11: 2, 12: 2, 23: 1}
OK	35120-10-6	CSCC#N	{40: 1, 1: 1, 2: 1, 37: 1}
OK	35120-18-4	CCOC(=O)C1(CCC1)Br	{1: 1, 2: 1, 11: 3, 13: 1, 18: 1, 28: 1}
OK	3513-81-3	C=C(CO)CO	{2: 2, 20: 2, 5: 1, 7: 1}
OK	35138-79-5	CC1(C2CCC(C2)C1C=CC3C4CCC(C4)C3(C)C)C	{1: 4, 11: 6, 12: 6, 13: 2, 6: 2}
OK	35143-56-7	CC1=S=C2C=CC=CN2C1=O	{1: 1, 33: 1, 41: 1, 14: 4, 15: 2, 25: 1}
OK	35148-18-6	CCC=CCCCCCCCCO	{1: 1, 2: 9, 20: 1, 6: 2}
OK	35148-19-7	CCC=CCCCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 2}
OK	3515-93-3	C(CC#N)C=O	{2: 2, 26: 1, 37: 1}
OK	35153-09-4	CC=CCCCCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 2}
OK	35153-10-7	CC(=O)OCCCCCCCCCCC=C	{1: 1, 2: 10, 28: 1, 5: 1, 6: 1}
OK	35153-15-2	CCCCC=CCCCCCCCCO	{1: 1, 2: 11, 20: 1, 6: 2}
OK	35153-16-3	CCCC=CCCCCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 6: 2}
OK	35153-21-0	CC=CCCCCCCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 6: 2}
OK	35154-45-1	CCC=CCCOC(=O)CC(C)C	{1: 3, 2: 4, 3: 1, 28: 1, 6: 2}
OK	35158-25-9	CC(C)CC=C(C=O)C(C)C	{1: 4, 2: 1, 3: 2, 6: 1, 7: 1, 26: 1}
OK	35161-67-2	CCCCCNCCO	{1: 1, 2: 6, 20: 1, 31: 1}
OK	35161-70-7	CCCCCCNC	{1: 2, 2: 5, 31: 1}
OK	35161-71-8	CNCC#C	{1: 1, 2: 1, 31: 1, 10: 1, 9: 1}
OK	35166-82-6	CC(C)(C)SSC	{40: 2, 1: 4, 4: 1}
OK	35175-75-8	C1COCCN1.OCl(=O)(=O)=O	{32: 1, 11: 4, 17: 1, 20: 1, 23: 1, 29: 3}
OK	35178-55-3	CC(=C1CCC2(C(C1=O)O2)C)C	{1: 3, 7: 1, 11: 2, 12: 1, 13: 1, 15: 1, 23: 1, 25: 1}
OK	3518-83-0	CCN1CCC(CC1)O	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 20: 1}
OK	35186-00-6	CN(C)/C(=C\C(F)(F)F)/C(F)(F)F	{1: 2, 4: 2, 6: 1, 33: 1, 7: 1, 16: 6}
OK	35192-73-5	CCCCCC(CC=C)O	{1: 1, 2: 5, 3: 1, 5: 1, 6: 1, 20: 1}
OK	35194-37-7	CCC=CCCC(=O)O	{1: 1, 2: 3, 27: 1, 6: 2}
OK	35194-55-9	CCC1OCC(CO1)C	{1: 2, 2: 1, 11: 2, 12: 2, 23: 2}
OK	352-23-8	CCOC(=O)CC(F)(F)F	{16: 3, 1: 1, 2: 2, 4: 1, 28: 1}
OK	352-24-9	CCOC(=O)CC(=O)C(F)F	{1: 1, 2: 2, 3: 1, 16: 2, 24: 1, 28: 1}
OK	352-28-3	C(C(F)(F)F)OC(=O)C=CC(=O)OCC(F)(F)F	{16: 6, 28: 2, 2: 2, 4: 2, 6: 2}
OK	352-87-4	CC(=C)C(=O)OCC(F)(F)F	{1: 1, 2: 1, 4: 1, 5: 1, 7: 1, 16: 3, 28: 1}
OK	352-91-0	C(CF)CBr	{16: 1, 2: 3, 18: 1}
OK	352-93-2	CCSCC	{40: 1, 1: 2, 2: 2}
OK	352-97-6	C(C(=O)O)N=C(N)N	{2: 1, 27: 1, 34: 1, 30: 2, 7: 1}
OK	35202-90-5	C1CC2CC1CC2C(=O)Cl	{24: 1, 17: 1, 11: 4, 12: 3}
OK	35203-44-2	CCCN1C=CN=C1	{1: 1, 2: 2, 35: 1, 14: 3, 33: 1}
OK	35205-79-9	CCCCCCC(C)CC(=O)O	{27: 1, 1: 2, 2: 6, 3: 1}
OK	3521-91-3	CCCC(CC=C)O	{1: 1, 2: 3, 3: 1, 5: 1, 6: 1, 20: 1}
OK	35216-11-6	CCCCCCC#CCCCCCC	{1: 2, 2: 10, 10: 2}
OK	35217-21-1	CC(=CC(=O)OC)OC	{1: 3, 28: 1, 22: 1, 6: 1, 7: 1}
OK	35219-73-9	CC(C)(OCC=C)OCC=C	{1: 2, 2: 2, 4: 1, 5: 2, 6: 2, 22: 2}
OK	3522-94-9	CC(C)CCC(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1}
OK	35223-80-4	CCCOC(=O)CBr	{1: 1, 2: 3, 28: 1, 18: 1}
OK	35234-16-3	CCCC/C=C/CC(=O)OC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	35234-22-1	CC(CCCC(=O)OC)OC(=O)C	{1: 3, 2: 3, 3: 1, 28: 2}
OK	35234-23-2	CCCC(CCCC(=O)OC)OC(=O)C	{1: 3, 2: 5, 3: 1, 28: 2}
OK	35234-25-4	CCCC(CCCC(=O)OCC)OC(=O)C	{1: 3, 2: 6, 3: 1, 28: 2}
OK	352356-38-8	CC(C)(C)OC(=O)N[C@H]1CCCC[C@H]1C(=O)O	{1: 3, 4: 1, 11: 4, 12: 2, 27: 1, 28: 1, 31: 1}
OK	35237-64-0	CCC=CCCCCCCCCCC=O	{1: 1, 2: 10, 26: 1, 6: 2}
OK	35239-21-5	CCCCOC(=O)C=C.C=CC(=O)NCO.C=CC(=O)O.C=CCl	{1: 1, 2: 4, 5: 4, 6: 4, 17: 1, 20: 1, 24: 1, 27: 1, 28: 1, 31: 1}
OK	3524-68-3	C=CC(=O)OCC(CO)(COC(=O)C=C)COC(=O)C=C	{2: 4, 4: 1, 5: 3, 6: 3, 20: 1, 28: 3}
OK	3524-70-7	C1COC(=O)C(=O)O1	{11: 2, 28: 2}
OK	3524-73-0	CC(C)CCC=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1}
OK	3524-75-2	C=CCC1CCCC1	{2: 1, 11: 4, 12: 1, 5: 1, 6: 1}
OK	35242-05-8	CCCC[C@@H]1CCCC[C@H]1O	{1: 1, 2: 3, 11: 4, 12: 2, 20: 1}
OK	35242-17-2	C1CC2CC1CC(=C2)Cl	{17: 1, 11: 4, 12: 2, 14: 1, 15: 1}
OK	35243-89-1	CC(C(OCC1CO1)Br)Br	{1: 1, 2: 1, 3: 2, 11: 1, 12: 1, 18: 2, 22: 1, 23: 1}
OK	3525-25-5	CCCCC(CC)CCO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	35270-62-3	CCCCC1(CCCO1)C	{1: 2, 2: 3, 11: 3, 13: 1, 23: 1}
OK	35274-05-6	CCCCCCCCCCCCCCCCOC(=O)C(C)O	{1: 2, 2: 15, 3: 1, 20: 1, 28: 1}
OK	3528-64-1	CCCCCCCCC=CCCCCCCCC1=NCCN1CCNCCN	{1: 1, 2: 18, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 30: 1, 31: 1}
OK	3528-65-2	CCCCCCCCC=CCCCCCCCC1=NCCN1CCNCCNCCN	{1: 1, 2: 20, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 30: 1, 31: 2}
OK	3528-66-3	CCCCCCCCC=CCCCCCCCC1=NCCN1CCN2CCN=C2CCCCCCCC=CCCCCCCCC	{1: 2, 2: 30, 35: 2, 6: 4, 33: 2, 11: 4, 15: 2}
OK	35280-53-6	C(COC(=O)CCl)O	{17: 1, 2: 3, 20: 1, 28: 1}
OK	35289-31-7	C=CCCCCCCCCCCO	{2: 10, 20: 1, 5: 1, 6: 1}
OK	3529-09-7	CCCCN(CCCC)CCN	{1: 2, 2: 8, 30: 1, 33: 1}
OK	35295-57-9	C#CC1CC1C#C	{9: 2, 10: 2, 11: 1, 12: 2}
OK	35295-58-0	C1C=C2C=CC2=C1	{11: 1, 14: 4, 15: 2}
OK	353-03-7	CCOC(=O)CCCCCCCCCF	{16: 1, 1: 1, 2: 10, 28: 1}
OK	353-07-1	C(CNN)C#N	{2: 2, 37: 1, 30: 1, 31: 1}
OK	353-13-9	C(CCF)CC#N	{16: 1, 2: 4, 37: 1}
OK	353-17-3	C(CCSC#N)CF	{16: 1, 40: 1, 2: 4, 37: 1}
OK	353-18-4	C(COCCF)C#N	{16: 1, 2: 4, 37: 1, 22: 1}
OK	353-21-9	C(CCCN)CCCF	{16: 1, 2: 7, 30: 1}
OK	353-25-3	C(CCCC(=O)O)CCCF	{16: 1, 2: 7, 27: 1}
OK	353-29-7	C(CCCCCCBr)CCCCCF	{16: 1, 2: 12, 18: 1}
OK	353-36-6	CCF	{16: 1, 1: 1, 2: 1}
OK	353-49-1	C(=O)(F)Cl	{16: 1, 17: 1, 24: 1}
OK	353-50-4	C(=O)(F)F	{16: 2, 24: 1}
OK	353-54-8	C(F)(Br)(Br)Br	{16: 1, 18: 3, 4: 1}
OK	353-55-9	C(F)(Cl)(Br)Br	{16: 1, 17: 1, 18: 2, 4: 1}
OK	353-58-2	C(F)(Cl)(Cl)Br	{16: 1, 17: 2, 18: 1, 4: 1}
OK	353-59-3	C(F)(F)(Cl)Br	{16: 2, 17: 1, 18: 1, 4: 1}
OK	353-61-7	CC(C)(C)F	{16: 1, 1: 3, 4: 1}
OK	353-81-1	CCC(C)(F)F	{16: 2, 1: 2, 2: 1, 4: 1}
OK	353-83-3	C(C(F)(F)F)I	{16: 3, 2: 1, 19: 1, 4: 1}
OK	353-85-5	C(#N)C(F)(F)F	{16: 3, 4: 1, 37: 1}
OK	353-99-1	C(=O)(C(F)(Br)Br)O	{16: 1, 18: 2, 27: 1, 4: 1}
OK	3530-11-8	CCCCNN	{1: 1, 2: 3, 30: 1, 31: 1}
OK	3530-13-0	CC(=O)N(C)N	{24: 1, 1: 2, 30: 1, 33: 1}
OK	35305-10-3	CCC1(C(=O)NC(=O)NC1=O)C2=CC(=O)CCC2	{32: 2, 1: 1, 2: 1, 11: 3, 13: 1, 14: 1, 15: 1, 25: 4}
OK	3531-64-4	CN1CCCC1=O.C1N(CN(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 1, 11: 7, 33: 5, 38: 4, 25: 1}
OK	35320-23-1	C[C@H](CO)N	{1: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	35321-46-1	C1=C[N+](=CN1O)[O-]	{33: 2, 21: 1, 14: 3, 29: 1}
OK	35329-42-1	CCCCCCCCC(C=C)O	{1: 1, 2: 7, 3: 1, 5: 1, 6: 1, 20: 1}
OK	3533-69-5	COC(=O)C(=CCl)Cl	{1: 1, 17: 2, 28: 1, 6: 1, 7: 1}
OK	35354-37-1	CC(C)CCCCBr	{1: 2, 2: 4, 3: 1, 18: 1}
OK	35354-38-2	CCCCCCCCCCC#CCCCCC(C)C	{1: 3, 2: 13, 3: 1, 10: 2}
OK	35354-39-3	CCCCCCCCCCC=CCCCCC(C)C	{1: 3, 2: 13, 3: 1, 6: 2}
OK	35356-70-8	CC(=O)NC(=C)C(=O)OC	{1: 2, 5: 1, 7: 1, 24: 1, 28: 1, 31: 1}
OK	35357-77-8	COC(=O)C(CC=C)(CC=C)C(=O)OC	{1: 2, 2: 2, 4: 1, 5: 2, 6: 2, 28: 2}
OK	3536-54-7	CC(C)C12CC1C(=C)C(C2)OC(=O)C	{1: 3, 3: 1, 5: 1, 11: 2, 12: 2, 13: 1, 15: 1, 28: 1}
OK	35365-52-7	CCCCCCC1=C(C1)CCCCCC	{1: 2, 2: 10, 11: 1, 15: 2}
OK	35365-59-4	CCCCCCCCC#CCCCCCCCC	{1: 2, 2: 14, 10: 2}
OK	3537-83-5	C1CCCCCCC(=O)OCCCCCC1	{11: 13, 28: 1}
OK	35375-29-2	C[C@H]1/C=C/C=C/C=C/C=C/C=C/C=C/C=C/[C@@H](C[C@H]2[C@@H]([C@H](C[C@](O2)(C[C@H](C[C@H]([C@@H](CC[C@H](C[C@H](CC(=O)O[C@H]([C@@H]([C@@H]1O)C)C)O)O)O)O)O)O)O)C(=O)OC)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O)N)O.Cl	{1: 5, 11: 8, 12: 18, 13: 1, 14: 14, 17: 1, 20: 10, 22: 1, 23: 2, 28: 2, 30: 1}
OK	35376-40-0	CC(C)(C)C1CCC(C=C1)O	{1: 3, 4: 1, 11: 2, 12: 2, 14: 2, 20: 1}
OK	3538-65-6	CCCC(=O)NN	{24: 1, 1: 1, 2: 2, 30: 1, 31: 1}
OK	35383-51-8	C/C(=C\Cl)/C=C	{1: 1, 17: 1, 5: 1, 6: 2, 7: 1}
OK	35383-59-6	CC(C)C(C(=O)Cl)Cl	{24: 1, 1: 2, 3: 2, 17: 2}
OK	35387-63-4	CC(=CCC(C)(C)C=C)C	{1: 4, 2: 1, 4: 1, 5: 1, 6: 2, 7: 1}
OK	3539-38-6	CCCCCCCCCCCCCC(=O)OCC(C)O	{1: 2, 2: 13, 3: 1, 20: 1, 28: 1}
OK	35399-81-6	CCC(C)C(C)N	{1: 3, 2: 1, 3: 2, 30: 1}
OK	354-04-1	C(C(F)(F)Br)(F)Br	{16: 3, 18: 2, 3: 1, 4: 1}
OK	354-06-3	C(C(F)(F)Br)(F)Cl	{16: 3, 17: 1, 18: 1, 3: 1, 4: 1}
OK	354-07-4	C(C(F)(F)Br)(F)F	{16: 4, 18: 1, 3: 1, 4: 1}
OK	354-09-6	CC(C)C(C)(C)F	{16: 1, 1: 4, 3: 1, 4: 1}
OK	354-11-0	C(C(Cl)(Cl)Cl)(F)Cl	{16: 1, 17: 4, 3: 1, 4: 1}
OK	354-12-1	C(C(Cl)(Cl)Cl)(F)F	{16: 2, 17: 3, 3: 1, 4: 1}
OK	354-13-2	C(=O)(C(Cl)(Cl)Cl)F	{16: 1, 17: 3, 4: 1, 24: 1}
OK	354-14-3	C(C(F)(Cl)Cl)(Cl)Cl	{16: 1, 17: 4, 3: 1, 4: 1}
OK	354-15-4	C(C(F)(Cl)Cl)(F)Cl	{16: 2, 17: 3, 3: 1, 4: 1}
OK	354-21-2	C(C(F)(F)Cl)(Cl)Cl	{16: 2, 17: 3, 3: 1, 4: 1}
OK	354-23-4	C(C(F)(F)Cl)(F)Cl	{16: 3, 17: 2, 3: 1, 4: 1}
OK	354-24-5	C(=O)(C(F)(F)Cl)Cl	{16: 2, 17: 2, 4: 1, 24: 1}
OK	354-25-6	C(C(F)(F)Cl)(F)F	{16: 4, 17: 1, 3: 1, 4: 1}
OK	354-26-7	C(C(F)(F)Cl)(F)I	{16: 3, 17: 1, 3: 1, 4: 1, 19: 1}
OK	354-27-8	C(=O)(C(F)(F)Cl)F	{16: 3, 17: 1, 4: 1, 24: 1}
OK	354-28-9	C(=O)(C(F)(F)Cl)N	{16: 2, 17: 1, 4: 1, 30: 1, 24: 1}
OK	354-32-5	C(=O)(C(F)(F)F)Cl	{16: 3, 17: 1, 4: 1, 24: 1}
OK	354-33-6	C(C(F)(F)F)(F)F	{16: 5, 3: 1, 4: 1}
OK	354-34-7	C(=O)(C(F)(F)F)F	{16: 4, 24: 1, 4: 1}
OK	354-38-1	C(=O)(C(F)(F)F)N	{16: 3, 24: 1, 4: 1, 30: 1}
OK	354-41-6	C(C(F)(F)I)(F)F	{16: 4, 19: 1, 3: 1, 4: 1}
OK	354-48-3	C(C(Br)(Br)Br)(F)(F)F	{16: 3, 18: 3, 4: 2}
OK	354-51-8	C(C(F)(Cl)Br)(F)(F)Br	{16: 3, 17: 1, 18: 2, 4: 2}
OK	354-55-2	C(C(F)(F)Br)(F)(F)F	{16: 5, 18: 1, 4: 2}
OK	354-56-3	C(C(Cl)(Cl)Cl)(F)(Cl)Cl	{16: 1, 17: 5, 4: 2}
OK	354-58-5	C(C(Cl)(Cl)Cl)(F)(F)F	{16: 3, 17: 3, 4: 2}
OK	354-61-0	C(C(F)(Cl)I)(F)(F)Cl	{16: 3, 17: 2, 19: 1, 4: 2}
OK	354-64-3	C(C(F)(F)I)(F)(F)F	{16: 5, 19: 1, 4: 2}
OK	354-65-4	C(C(F)(F)I)(F)(F)I	{16: 4, 19: 2, 4: 2}
OK	354-69-8	C(C(C(F)(F)F)(F)F)I	{16: 5, 2: 1, 19: 1, 4: 2}
OK	354-76-7	C(=O)(C(C(F)(F)F)(F)F)N	{16: 5, 24: 1, 4: 2, 30: 1}
OK	354-80-3	C(C(F)(F)F)(N(F)F)(F)F	{16: 7, 33: 1, 4: 2}
OK	354-92-7	C(C(F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 10, 4: 4}
OK	354-96-1	C(C(C(F)(F)F)(C(F)(F)F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 14, 4: 6}
OK	3540-84-9	C1CC(CC=C1)Br	{18: 1, 11: 3, 12: 1, 14: 2}
OK	35403-67-9	CC(C)(C)N1C(=O)NNC1=O	{32: 2, 1: 3, 4: 1, 33: 1, 25: 2}
OK	35411-32-6	CC(=C)C(=O)OCCSCCOC(=O)C(=C)C	{1: 2, 2: 4, 5: 2, 7: 2, 40: 1, 28: 2}
OK	35430-17-2	[CH2]N	{5: 1, 30: 1}
OK	35436-83-0	CC(C)CC(C(=O)NC(C(C)C)C(=O)O)N	{1: 4, 2: 1, 3: 4, 24: 1, 27: 1, 30: 1, 31: 1}
OK	35438-35-8	C1=CC2C3C2C3C=C1	{12: 4, 14: 4}
OK	35447-68-8	CC(C)CC(=O)Br	{24: 1, 1: 2, 2: 1, 3: 1, 18: 1}
OK	35448-31-8	CC(C)CCN=CCC(C)C	{1: 4, 2: 3, 3: 2, 34: 1, 6: 1}
OK	35449-34-4	COCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 2, 4: 1, 17: 3, 22: 1, 28: 1}
OK	35449-36-6	CC(C)(CCCCCCC(C)(C)CO)CO	{1: 4, 2: 8, 4: 2, 20: 2}
OK	35457-80-8	CCC(=O)OC1CC(=O)OC(CC=CC=CC(C(CC(C(C1OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)OC(=O)CC)(C)O)N(C)C)O)CC=O)C)O)C	{1: 10, 2: 3, 33: 1, 11: 4, 12: 15, 13: 1, 14: 4, 20: 3, 22: 3, 23: 2, 26: 1, 28: 3}
OK	35466-89-8	CC1CCNCC(C1)(C)C	{32: 1, 1: 3, 11: 4, 12: 1, 13: 1}
OK	35466-90-1	CC1CC(CCNC1)(C)C	{32: 1, 1: 3, 11: 4, 12: 1, 13: 1}
OK	35468-97-4	CCCCCC=COC(=O)C	{1: 2, 2: 4, 28: 1, 6: 2}
OK	3547-33-9	CCCCCCCCSCCO	{40: 1, 1: 1, 2: 9, 20: 1}
OK	35470-57-6	CC(=C1C=CC(O1)(C)C)C2CCC(O2)(C)C=C	{1: 4, 5: 1, 6: 1, 7: 1, 11: 2, 12: 1, 13: 2, 14: 2, 15: 1, 23: 2}
OK	35490-05-2	CCOC(=O)C(CCC(=O)C)C(=O)C	{24: 2, 1: 3, 2: 3, 3: 1, 28: 1}
OK	35493-46-0	CCCCCCCCCCCCC1CCC1=O	{1: 1, 2: 11, 11: 2, 12: 1, 25: 1}
OK	355-02-2	C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	{16: 14, 4: 1, 13: 6}
OK	355-04-4	C(C(C(C(F)(F)F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 14, 4: 6}
OK	355-08-8	C=CC(C(C(F)(F)F)(F)F)(F)F	{16: 7, 4: 3, 5: 1, 6: 1}
OK	355-17-9	CC(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 1: 1, 4: 3, 24: 1}
OK	355-20-4	C(C(C(F)(F)F)(F)Cl)(C(F)(F)F)(F)Cl	{16: 8, 17: 2, 4: 4}
OK	355-25-9	C(C(C(F)(F)F)(F)F)(C(F)(F)F)(F)F	{16: 10, 4: 4}
OK	355-37-3	C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 3: 1, 4: 5}
OK	355-38-4	C(=O)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 12, 24: 1, 4: 5}
OK	355-42-0	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 14, 4: 6}
OK	355-43-1	C(C(C(C(F)(F)I)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 13, 19: 1, 4: 6}
OK	355-49-7	C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 34, 4: 16}
OK	355-50-0	C(C(C(C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 33, 19: 1, 4: 16}
OK	355-63-5	C(=C(F)F)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 14, 4: 5, 7: 2}
OK	355-66-8	C(=O)(C(C(C(C(C(=O)N)(F)F)(F)F)(F)F)(F)F)N	{16: 8, 24: 2, 4: 4, 30: 2}
OK	355-68-0	C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 12, 13: 6}
OK	355-74-8	C(C(C(C(C(CO)(F)F)(F)F)(F)F)(F)F)O	{16: 8, 20: 2, 2: 2, 4: 4}
OK	355-75-9	C1(=C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)F)F	{16: 10, 13: 4, 15: 2}
OK	355-80-6	C(C(C(C(C(F)F)(F)F)(F)F)(F)F)O	{16: 8, 20: 1, 2: 1, 3: 1, 4: 3}
OK	355-93-1	CC(=C)C(=O)OCC(C(C(C(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 1, 3: 1, 4: 3, 5: 1, 7: 1, 16: 8, 28: 1}
OK	35502-06-8	COC(CCCl)OC	{1: 2, 2: 2, 3: 1, 22: 2, 17: 1}
OK	3551-27-7	C1=CC=C[CH]C=C1	{14: 7}
OK	35513-87-2	C(CCNCCN)CN	{2: 6, 30: 2, 31: 1}
OK	3552-01-0	CC(C)C1(CCCCC1)O	{11: 5, 1: 2, 3: 1, 20: 1, 13: 1}
OK	35520-41-3	CN(C)/C=C/C#N	{1: 2, 37: 1, 6: 2, 33: 1}
OK	35520-81-1	COC(=O)C1CC2CCC1C2	{1: 1, 11: 4, 12: 3, 28: 1}
OK	35523-89-8	C1CN2C(=N[C@H]([C@H]3[C@]2(C1(O)O)N=C(N3)N)COC(=O)N)N	{32: 1, 33: 1, 2: 1, 35: 2, 11: 2, 12: 2, 13: 2, 15: 2, 20: 2, 28: 1, 30: 3}
OK	3553-80-8	CCN(CC)C(=O)OCC	{1: 3, 2: 3, 28: 1, 33: 1}
OK	3554-74-3	CN1CCCC(C1)O	{1: 1, 11: 4, 12: 1, 20: 1, 33: 1}
OK	35543-25-0	C1CCN(C1)CCCC#N	{33: 1, 2: 3, 11: 4, 37: 1}
OK	3555-94-0	C=CN=C=O	{8: 1, 34: 1, 5: 1, 6: 1, 29: 1}
OK	35554-08-6	C1CN2C(=N[C@H]([C@H]3[C@]2(C1(O)O)N=C(N3)N)COC(=O)N)N.Cl.Cl	{32: 1, 33: 1, 2: 1, 35: 2, 11: 2, 12: 2, 13: 2, 15: 2, 17: 2, 20: 2, 28: 1, 30: 3}
OK	35567-30-7	CCCCCCCCCCCCCCCCCC(=O)NCCCN	{24: 1, 1: 1, 2: 19, 30: 1, 31: 1}
OK	35573-93-4	CCOC(CCCl)OCC	{1: 2, 2: 4, 3: 1, 22: 2, 17: 1}
OK	35576-88-6	C(=O)(O)F	{16: 1, 27: 1}
OK	35576-91-1	NN=O	{34: 1, 29: 1, 30: 1}
OK	3558-32-5	CC(C)CCC(C(=O)O)N	{27: 1, 1: 2, 2: 2, 3: 2, 30: 1}
OK	35599-77-0	CCCCCCCCCCCCCI	{1: 1, 2: 12, 19: 1}
OK	35599-82-7	CCCCCCCCCCCSCCCCCCCCCCC	{40: 1, 1: 2, 2: 20}
OK	356-12-7	CC(=O)OCC(=O)[C@@]12[C@@H](C[C@@H]3[C@@]1(C[C@@H]([C@]4([C@H]3C[C@@H](C5=CC(=O)C=C[C@@]54C)F)F)O)C)OC(O2)(C)C	{1: 5, 2: 1, 11: 3, 12: 5, 13: 5, 14: 3, 15: 1, 16: 2, 20: 1, 23: 2, 24: 1, 25: 1, 28: 1}
OK	356-15-0	C(=O)(C(C(C(=O)Cl)(F)F)(F)F)Cl	{16: 4, 17: 2, 4: 2, 24: 2}
OK	356-18-3	C1(C(C(C1(F)Cl)(F)Cl)(F)F)(F)F	{16: 6, 17: 2, 13: 4}
OK	356-19-4	C1(C(C(C1(F)Cl)(F)F)(F)Cl)(F)F	{16: 6, 17: 2, 13: 4}
OK	356-24-1	COC(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 1: 1, 4: 3, 28: 1}
OK	356-26-3	CCOC(C(C(C(F)(F)F)(F)F)(F)F)O	{1: 1, 2: 1, 3: 1, 4: 3, 16: 7, 20: 1, 22: 1}
OK	356-27-4	CCOC(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 1: 1, 2: 1, 4: 3, 28: 1}
OK	356-28-5	C=COC(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 28: 1, 4: 3, 5: 1, 6: 1}
OK	356-45-6	C(=O)(C(C(F)(F)F)(F)F)OOC(=O)C(C(F)(F)F)(F)F	{16: 10, 28: 2, 4: 4}
OK	356-69-4	COC(=O)C(C(OC(F)(F)F)(F)F)(F)F	{16: 7, 1: 1, 4: 3, 22: 1, 28: 1}
OK	356-80-9	C1C(C(C1(F)F)(F)F)CCl	{2: 1, 11: 1, 12: 1, 13: 2, 16: 4, 17: 1}
OK	356-86-5	C=CC(=O)OCC(C(F)(F)F)(F)F	{2: 1, 4: 2, 5: 1, 6: 1, 16: 5, 28: 1}
OK	35602-69-8	CCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 19, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	35618-58-7	C1C=CC2C3C1C23	{11: 1, 12: 4, 14: 2}
OK	35627-29-3	C1CN(COC1)N=O	{33: 1, 34: 1, 11: 4, 29: 1, 23: 1}
OK	35627-96-4	CCCCCCCCCCCCCCCCCC(=O)NCC(C)O	{1: 2, 2: 17, 3: 1, 20: 1, 24: 1, 31: 1}
OK	35628-05-8	CC(C)CC(CC(=C)C=C)O	{1: 2, 2: 2, 3: 2, 5: 2, 6: 1, 7: 1, 20: 1}
OK	3563-36-8	C(CSCCCl)SCCCl	{40: 2, 17: 2, 2: 6}
OK	35631-27-7	CC1CN(CO1)N=O	{1: 1, 34: 1, 33: 1, 11: 2, 12: 1, 23: 1, 29: 1}
OK	35633-50-2	COCCOCCC#N	{1: 1, 2: 4, 37: 1, 22: 2}
OK	35634-10-7	C1C23C1(C2)C3	{11: 3, 13: 2}
OK	35660-96-9	CC(C)(C)C(C(C)(C)C)C(C)(C)C	{1: 9, 3: 1, 4: 3}
OK	35663-85-5	C1CC(=NC1)/C=C/C(=O)N	{35: 1, 6: 2, 11: 3, 15: 1, 24: 1, 30: 1}
OK	3568-29-4	C1C(O1)COCC(COCC2CO2)O	{2: 4, 3: 1, 11: 2, 12: 2, 20: 1, 22: 2, 23: 2}
OK	35686-13-6	CC/C=C/SCC	{40: 1, 1: 2, 2: 2, 6: 2}
OK	35688-04-1	CC(=C)C(=O)OCCN(C)C.N(=O)O	{1: 3, 2: 2, 5: 1, 7: 1, 34: 1, 20: 1, 33: 1, 28: 1, 29: 1}
OK	3569-10-6	C[C@@H]1CC[C@H](C2=C(CC[C@H]12)C)C=C(C)C(=O)O	{1: 3, 6: 1, 7: 1, 11: 4, 12: 3, 15: 2, 27: 1}
OK	35691-65-7	C(CC(CBr)(C#N)Br)C#N	{2: 3, 4: 1, 18: 2, 37: 2}
OK	35695-72-8	CCC(C(C(Cl)(Cl)Cl)O)N	{1: 1, 2: 1, 3: 2, 4: 1, 17: 3, 20: 1, 30: 1}
OK	357-09-5	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4(C3CCC4=O)C)O)F	{1: 2, 11: 7, 12: 3, 13: 3, 14: 1, 15: 1, 16: 1, 20: 1, 25: 2}
OK	3570-10-3	C[C@]12CCC(=O)C=C1C[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C	{1: 3, 11: 7, 12: 3, 13: 3, 14: 1, 15: 1, 20: 1, 25: 1}
OK	3570-21-6	CCC(C)C[C@@H](C(=O)O)N	{27: 1, 1: 2, 2: 2, 3: 2, 30: 1}
OK	3570-55-6	C(CSCCS)S	{40: 1, 2: 4, 39: 2}
OK	3570-93-2	C1CC(=C(/C(=N\O)/C1)N=O)NO	{34: 2, 11: 3, 15: 3, 20: 2, 29: 1, 31: 1}
OK	35700-21-1	CCCCC[C@@](C)(/C=C/[C@H]1[C@@H](C[C@@H]([C@@H]1C/C=C\CCCC(=O)OC)O)O)O	{1: 3, 2: 8, 4: 1, 6: 4, 11: 1, 12: 4, 20: 3, 28: 1}
OK	35700-23-3	CCCCC[C@@](C)(/C=C/[C@H]1[C@@H](C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O)O	{1: 2, 2: 8, 4: 1, 6: 4, 11: 1, 12: 4, 20: 3, 27: 1}
OK	35700-27-7	CCCCC[C@@](C)(C=C[C@H]1[C@@H](CC(=O)[C@@H]1CC=CCCCC(=O)O)O)O	{1: 2, 2: 8, 4: 1, 6: 4, 11: 1, 12: 3, 20: 2, 25: 1, 27: 1}
OK	3571-74-2	C=CCSC1=NCCS1	{2: 1, 35: 1, 5: 1, 6: 1, 40: 1, 41: 1, 11: 2, 15: 1}
OK	35718-08-2	C#CCOC(=O)Cl	{9: 1, 2: 1, 28: 1, 10: 1, 17: 1}
OK	357188-74-0	CC(F)(F)Br	{16: 2, 1: 1, 18: 1, 4: 1}
OK	35723-81-0	CC(C)CCCCCCCCCCN	{1: 2, 2: 10, 3: 1, 30: 1}
OK	3574-40-1	C=C/C(=C/Cl)/Cl	{17: 2, 5: 1, 6: 2, 7: 1}
OK	35778-39-3	CCCCCC(=O)C(C)CC	{24: 1, 1: 3, 2: 5, 3: 1}
OK	3578-07-2	CCCCCCCCCCOC(=O)C(=C)C#N	{1: 1, 2: 9, 37: 1, 7: 1, 28: 1, 5: 1}
OK	35783-97-2	C1=CC2C=CC(S2)C=C1	{41: 1, 12: 2, 14: 6}
OK	35785-35-4	CC(=O)OC1C(C(OC(C1OC(=O)C)OC)C(=O)OC)OC(=O)C	{1: 5, 12: 5, 28: 4, 22: 1, 23: 1}
OK	35794-11-7	CC1CC(CNC1)C	{32: 1, 1: 2, 11: 3, 12: 2}
OK	35799-05-4	CCCCCCCCCCCCCCCCCCCCC(C)CCCCCCCCCC	{1: 3, 2: 28, 3: 1}
OK	358-03-2	CCC(CC)(F)F	{16: 2, 1: 2, 2: 2, 4: 1}
OK	358-21-4	C(C(F)(F)F)(OC(C(F)(F)F)(F)F)(F)F	{16: 10, 4: 4, 22: 1}
OK	358-37-2	CCCCOC(C(F)F)(F)F	{1: 1, 2: 3, 3: 1, 4: 1, 16: 4, 22: 1}
OK	358-52-1	C#CCC1(CCCCC1)OC(=O)N	{2: 1, 9: 1, 10: 1, 11: 5, 13: 1, 28: 1, 30: 1}
OK	358-97-4	C(C(F)Br)Br	{16: 1, 2: 1, 3: 1, 18: 2}
OK	358-99-6	C(=C(F)Br)F	{16: 2, 18: 1, 6: 1, 7: 1}
OK	35822-49-2	CS/C=C\C=C/SC	{40: 2, 1: 2, 6: 4}
OK	35823-05-3	CN(CCCCCCN(C)[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 6, 38: 2, 33: 2}
OK	3583-47-9	C(C1C(O1)CCl)Cl	{17: 2, 2: 2, 12: 2, 23: 1}
OK	35834-26-5	CCC1C(C2C(O2)(/C=C/C(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC3C(C(CC(O3)C)N(C)C)O)CC=O)C)C)C	{1: 8, 2: 2, 33: 1, 11: 3, 12: 12, 13: 1, 14: 2, 20: 2, 22: 1, 23: 2, 25: 1, 26: 1, 28: 1}
OK	35838-12-1	CC(=C)C(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C(=C)C)CCOC(=O)C(=C)C	{1: 3, 2: 6, 5: 3, 7: 3, 25: 3, 33: 3, 28: 3}
OK	3585-32-8	CNN=NC	{1: 2, 34: 2, 31: 1}
OK	35852-46-1	CCCCC(=O)OCCC=CCC	{1: 2, 2: 6, 28: 1, 6: 2}
OK	35855-10-8	COC(=O)CN1CCOCC1	{1: 1, 2: 1, 33: 1, 11: 4, 23: 1, 28: 1}
OK	35856-82-7	CC1(C(OO1)(C)C)C	{1: 4, 13: 2, 23: 2}
OK	3586-39-8	CC(CC(=O)O)CC(C)(C)C(=O)O	{27: 2, 1: 3, 2: 2, 3: 1, 4: 1}
OK	3586-58-1	CCC(=C)C(=O)O	{1: 1, 2: 1, 27: 1, 5: 1, 7: 1}
OK	35865-33-9	CC1CC(C(OC1C2CC(C3(O2)C(C(CC(O3)C4(CCC5(O4)CC(C(C(O5)C(C)/C=C(\C)/C(=O)C(C)CC(C)C(=O)O)C)O)C)OC6CCC(C(O6)C)OC)C)C)(CO)O)C	{1: 12, 2: 2, 3: 3, 6: 1, 7: 1, 11: 8, 12: 14, 13: 4, 20: 3, 22: 2, 23: 6, 24: 1, 27: 1}
OK	35866-89-8	CC(C)CC(CC(C)C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	35866-96-7	CC(C)CCC(C)(C)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	3587-57-3	CCCOCCl	{1: 1, 2: 3, 22: 1, 17: 1}
OK	35878-49-0	C1CN(C(=N1)N[N+](=O)[O-])N=O	{33: 1, 34: 1, 35: 1, 38: 1, 11: 2, 15: 1, 29: 1, 31: 1}
OK	3588-13-4	C(=CCl)C=CCl	{17: 2, 6: 4}
OK	3588-17-8	C(=CC(=O)O)C=CC(=O)O	{27: 2, 6: 4}
OK	3588-30-5	COC(=C)C=C	{1: 1, 22: 1, 5: 2, 6: 1, 7: 1}
OK	3588-31-6	COC(=C)C(=C)OC	{1: 2, 5: 2, 22: 2, 7: 2}
OK	35884-42-5	CCCCOCCCOC(CC)O	{1: 2, 2: 7, 3: 1, 20: 1, 22: 2}
OK	35890-38-1	CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C=O)O)O)CO)O)O	{1: 1, 2: 3, 3: 6, 11: 1, 12: 8, 13: 1, 20: 11, 22: 2, 23: 2, 24: 1, 26: 1, 27: 1, 31: 1}
OK	35891-69-1	CCCCCCC(=O)CCCCCC/C=C/C[C@@H]1[C@@H]([C@](C(=O)O1)(CO)N)O	{1: 1, 2: 13, 6: 2, 12: 2, 13: 1, 20: 2, 24: 1, 28: 1, 30: 1}
OK	35897-16-6	CCC(C(C)C)OC(=O)C	{1: 4, 2: 1, 3: 2, 28: 1}
OK	359-01-3	CCC(C)F	{16: 1, 1: 2, 2: 1, 3: 1}
OK	359-02-4	C(=C(Cl)Cl)F	{16: 1, 17: 2, 6: 1, 7: 1}
OK	359-04-6	C(=C(\F)/Cl)\F	{16: 2, 17: 1, 6: 1, 7: 1}
OK	359-06-8	C(C(=O)Cl)F	{16: 1, 17: 1, 2: 1, 24: 1}
OK	359-07-9	C(C(F)F)Br	{16: 2, 2: 1, 3: 1, 18: 1}
OK	359-08-0	C(=C(F)F)Br	{16: 2, 18: 1, 6: 1, 7: 1}
OK	359-10-4	C(=C(F)F)Cl	{16: 2, 17: 1, 6: 1, 7: 1}
OK	359-11-5	C(=C(F)F)F	{16: 3, 6: 1, 7: 1}
OK	359-13-7	C(C(F)F)O	{16: 2, 2: 1, 3: 1, 20: 1}
OK	359-15-9	COC(F)F	{16: 2, 1: 1, 3: 1, 22: 1}
OK	359-25-1	C(C(=O)O)(F)Br	{16: 1, 27: 1, 18: 1, 3: 1}
OK	359-28-4	C(C(Cl)Cl)(F)Cl	{16: 1, 17: 3, 3: 2}
OK	359-29-5	C(=C(Cl)Cl)(F)Cl	{16: 1, 17: 3, 7: 2}
OK	359-32-0	C(C(=O)Cl)(F)Cl	{16: 1, 17: 2, 3: 1, 24: 1}
OK	359-35-3	C(C(F)F)(F)F	{16: 4, 3: 2}
OK	359-37-5	C(=C(F)I)(F)F	{16: 3, 19: 1, 7: 2}
OK	359-38-6	C(C(=O)N)(F)F	{16: 2, 24: 1, 3: 1, 30: 1}
OK	359-40-0	C(=O)(C(=O)F)F	{16: 2, 24: 2}
OK	359-41-1	C1C(O1)C(F)(F)F	{16: 3, 12: 1, 11: 1, 4: 1, 23: 1}
OK	359-58-0	C(C(F)(F)F)(C(F)(F)Cl)F	{16: 6, 17: 1, 3: 1, 4: 2}
OK	359-62-6	C[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2C[C@H]3CC[C@@H]4[C@@H]([C@]3([C@@H](C2)O)C)CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O	{1: 4, 2: 1, 11: 9, 12: 16, 13: 3, 14: 1, 15: 1, 20: 7, 22: 3, 23: 2, 28: 1}
OK	359-70-6	C(C(F)(F)F)(N(C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F)(F)F	{16: 15, 33: 1, 4: 6}
OK	3590-07-6	CCN(CCCl)CCCl.Cl	{1: 1, 2: 5, 33: 1, 17: 3}
OK	3590-70-3	CC(C)CCCOC	{1: 3, 2: 3, 3: 1, 22: 1}
OK	35900-26-6	CCCCC(=O)C(C)CCC	{24: 1, 1: 3, 2: 5, 3: 1}
OK	35911-17-2	CC(=CBr)CBr	{1: 1, 2: 1, 18: 2, 6: 1, 7: 1}
OK	35911-93-4	C(O)(Cl)Cl	{17: 2, 3: 1, 20: 1}
OK	3592-19-6	CCC(=CC=O)C	{1: 2, 2: 1, 26: 1, 6: 1, 7: 1}
OK	35926-04-6	CCCC(C=C)OC(=O)C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 28: 1}
OK	35926-06-8	CCCCC(C=C)OC(=O)C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 28: 1}
OK	3593-00-8	CC=CCCCC(=O)O	{1: 1, 2: 3, 27: 1, 6: 2}
OK	35951-33-8	CC(C)CC(C)(C)Cl	{1: 4, 2: 1, 3: 1, 4: 1, 17: 1}
OK	35951-36-1	CC(C)(CCCC(C)(C)Cl)Cl	{1: 4, 2: 3, 4: 2, 17: 2}
OK	35983-73-4	CC1=CC(C(=O)O1)(C)C	{1: 3, 28: 1, 13: 1, 14: 1, 15: 1}
OK	35983-76-7	CC1C(=CC(=O)S1)C	{1: 2, 41: 1, 12: 1, 14: 1, 15: 1, 25: 1}
OK	360-52-1	C(C(=O)C(F)F)(F)F	{16: 4, 24: 1, 3: 2}
OK	360-53-2	COC(=C(C(F)(F)F)C(F)(F)F)F	{16: 7, 1: 1, 4: 2, 22: 1, 7: 2}
OK	360-54-3	COC(=O)C(C(F)(F)F)C(F)(F)F	{16: 6, 1: 1, 3: 1, 4: 2, 28: 1}
OK	360-68-9	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 6, 13: 2, 20: 1}
OK	360-70-3	CCCCCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C	{1: 2, 2: 8, 11: 8, 12: 5, 13: 1, 14: 1, 15: 1, 25: 1, 28: 1}
OK	360-89-4	FC(=C(F)C(F)(F)F)C(F)(F)F	{16: 8, 4: 2, 7: 2}
OK	360-92-9	CCN(CC)C(=O)C(F)(F)F	{1: 2, 2: 2, 4: 1, 33: 1, 16: 3, 24: 1}
OK	3600-24-6	CCSSSCC	{40: 3, 1: 2, 2: 2}
OK	3601-67-0	CCC(C)(C#CC(=C)C)O	{1: 3, 2: 1, 4: 1, 5: 1, 7: 1, 10: 2, 20: 1}
OK	36016-38-3	CC(C)(C)OC(=O)NO	{1: 3, 31: 1, 4: 1, 20: 1, 28: 1}
OK	3603-45-0	C1COCCN1CCOCCO	{33: 1, 2: 4, 11: 4, 20: 1, 22: 1, 23: 1}
OK	3603-99-4	C1CCCCCCC(=O)CCCCCC1	{25: 1, 11: 13}
OK	36033-37-1	CCC(C)CC1(C(=O)NC(=O)N1)CC	{32: 2, 1: 3, 2: 3, 3: 1, 13: 1, 25: 2}
OK	36038-53-6	C(=C(Cl)Cl)C=C(Cl)Cl	{17: 4, 6: 2, 7: 2}
OK	3604-36-2	COC(=O)C1=CC2CC1C=C2	{1: 1, 11: 1, 12: 2, 14: 3, 15: 1, 28: 1}
OK	3604-87-3	C[C@@H]([C@H]1CC[C@@]2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)C)O)[C@@H](CCC(C)(C)O)O	{1: 5, 2: 2, 3: 2, 4: 1, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 20: 5, 25: 1}
OK	3604-90-8	CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC(=O)C)C)C	{1: 8, 6: 14, 7: 4, 11: 3, 13: 1, 15: 2, 24: 1}
OK	36043-12-6	C(C(CO)(CO)COCl)O	{17: 1, 2: 4, 4: 1, 22: 1, 20: 3}
OK	36043-13-7	C(C(CO)(CO)COF)O	{16: 1, 20: 3, 2: 4, 4: 1, 22: 1}
OK	36043-16-0	C(C(CO)(CO)C(N)ON)O	{2: 3, 3: 1, 4: 1, 20: 3, 22: 1, 30: 2}
OK	36043-80-8	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)OC(=O)Cl)C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 6, 13: 2, 17: 1, 28: 1}
OK	36045-56-4	CC(CCC(=O)OC)C(=O)C	{24: 1, 1: 3, 2: 2, 3: 1, 28: 1}
OK	3605-77-4	CCCCCCCCCCCCCCCCOCCC#N	{1: 1, 2: 17, 37: 1, 22: 1}
OK	36060-61-4	CCCCCCCC1=NCCN1CCO	{1: 1, 2: 8, 35: 1, 33: 1, 11: 2, 15: 1, 20: 1}
OK	36062-19-8	C(=NN)(N)NN.Cl	{17: 1, 34: 1, 31: 1, 30: 3, 7: 1}
OK	36069-05-3	CC1C[C@@H]2[C@H](C([C@]3(O2)CCC4C5CC=C6C[C@H](CCC6(C5C(=O)C4=C3C)C)O[C@H]7C(C([C@@H](C(O7)CO)O)O)O)C)NC1	{32: 1, 1: 4, 2: 1, 11: 8, 12: 13, 13: 2, 14: 1, 15: 3, 20: 4, 22: 1, 23: 2, 25: 1}
OK	36069-45-1	C[C@H]1CC[C@H](NC1)[C@@H](C)[C@H]2[C@@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4(CC[C@@H](C5)O)C)C)OC(=O)C	{32: 1, 1: 5, 3: 1, 11: 10, 12: 8, 13: 2, 14: 1, 15: 1, 20: 1, 28: 1}
OK	3607-48-5	C(=NI)=O	{8: 1, 34: 1, 19: 1, 29: 1}
OK	3607-78-1	C(C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{17: 6, 2: 1, 4: 2}
OK	36078-10-1	CCCCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 25, 28: 1, 6: 2}
OK	3610-27-3	CC(=O)OCCOCCOCCOC	{1: 2, 2: 6, 28: 1, 22: 3}
OK	3612-18-8	CCN1CCC(=O)CC1	{1: 1, 2: 1, 11: 4, 33: 1, 25: 1}
OK	3613-30-7	CC(CCCC(C)(C)OC)CC=O	{1: 4, 2: 4, 3: 1, 4: 1, 22: 1, 26: 1}
OK	3613-82-9	C1=CN(C=CC1=C[NH+]=O)CCCN2C=CC(=C[NH+]=O)C=C2.[Cl-].[Cl-]	{33: 2, 2: 3, 6: 2, 14: 8, 15: 2, 17: 2, 29: 2, 31: 2}
OK	36137-85-6	CN(CCO)N/N=C\1/C(=NC=N1)C(=O)OC	{1: 2, 2: 2, 35: 2, 33: 1, 34: 1, 14: 1, 15: 2, 20: 1, 28: 1, 31: 1}
OK	36137-87-8	CCOC(=O)C\1=NC=N/C1=N/NN(C)C2CCCCC2	{1: 2, 2: 1, 35: 2, 33: 1, 11: 5, 12: 1, 34: 1, 14: 1, 15: 2, 28: 1, 31: 1}
OK	36137-94-7	CNNN=C1C(=NC=N1)C(=O)OC	{1: 2, 34: 1, 35: 2, 14: 1, 15: 2, 28: 1, 31: 2}
OK	36137-96-9	CCCCCCCCN(C)N/N=C\1/C(=NC=N1)C(=O)OCC	{1: 3, 2: 8, 35: 2, 33: 1, 34: 1, 14: 1, 15: 2, 28: 1, 31: 1}
OK	36142-60-6	CCN(CC)CCOC(=O)C\1=NC=N/C1=N/NN(C)C2CCCCC2	{1: 3, 2: 4, 35: 2, 33: 2, 11: 5, 12: 1, 34: 1, 14: 1, 15: 2, 28: 1, 31: 1}
OK	3615-41-6	C[C@@H]([C@@H]([C@H]([C@H](C=O)O)O)O)O	{1: 1, 26: 1, 3: 4, 20: 4}
OK	3615-44-9	C(C(C(C(C(C(=O)CO)O)O)O)O)O	{24: 1, 2: 2, 3: 4, 20: 6}
OK	36151-02-7	CC1=CC(=O)CC(C1CCC(C)O)(C)C	{1: 4, 2: 2, 3: 1, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1, 25: 1}
OK	36159-49-6	CCCCC1CCCCC1O	{1: 1, 2: 3, 11: 4, 12: 2, 20: 1}
OK	3616-56-6	CCOC(CN(C)C)OCC	{1: 4, 2: 3, 3: 1, 22: 2, 33: 1}
OK	3616-57-7	CCN(CC)CC(OCC)OCC	{1: 4, 2: 5, 3: 1, 22: 2, 33: 1}
OK	3616-58-8	CCOC(CN1CCCCC1)OCC	{1: 2, 2: 3, 3: 1, 33: 1, 11: 5, 22: 2}
OK	36166-75-3	CN1CCC(=CC1)CO	{1: 1, 2: 1, 33: 1, 11: 3, 14: 1, 15: 1, 20: 1}
OK	3618-05-1	N=N	{36: 2}
OK	3618-11-9	C1CCCC=CCCC1	{11: 7, 14: 2}
OK	3618-18-6	C=C1CCCCCCC1	{11: 7, 5: 1, 15: 1}
OK	36182-49-7	CCCCCCCCCC(Br)Br	{1: 1, 2: 8, 3: 1, 18: 2}
OK	3619-34-9	CC(=NC)OC	{1: 3, 34: 1, 22: 1, 7: 1}
OK	36196-44-8	C(CS)C(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)CCS)CCOC(=O)CCS	{25: 3, 2: 12, 39: 3, 28: 3, 33: 3}
OK	36197-12-3	COC1C2CCC1CC2	{1: 1, 11: 4, 12: 3, 22: 1}
OK	36197-16-7	C1CC2CC1C3C2C4CCC3C4O	{20: 1, 11: 5, 12: 7}
OK	36197-31-6	C1CC2CC1C3C2C4CCC3C4=O	{25: 1, 11: 5, 12: 6}
OK	362-43-6	CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)N3C=CC(=O)NC3=O)CO)C	{32: 1, 1: 2, 2: 1, 33: 1, 12: 4, 13: 1, 14: 2, 20: 1, 23: 3, 25: 2}
OK	36204-31-6	C1CC2C3C4CC(C3C1C2=O)C=C4	{25: 1, 11: 3, 12: 6, 14: 2}
OK	36212-74-5	CCC(C(=O)NO)N	{1: 1, 2: 1, 3: 1, 20: 1, 24: 1, 30: 1, 31: 1}
OK	36215-07-3	COCCCCl	{1: 1, 2: 3, 22: 1, 17: 1}
OK	3623-51-6	C[C@@H]1CC[C@@H](C(C1)O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 20: 1}
OK	36231-13-7	C1CCC2=C(C1)CC=CC2	{11: 6, 14: 2, 15: 2}
OK	36236-73-4	CCCCCC1(OCC(O1)CCl)C	{1: 2, 2: 5, 11: 1, 12: 1, 13: 1, 17: 1, 23: 2}
OK	36239-09-5	CCOC(=O)CC(=O)Cl	{24: 1, 1: 1, 2: 2, 28: 1, 17: 1}
OK	3625-18-1	CCC1(C(=O)NC(=O)NC1=O)C(C)C=C(C)C	{32: 2, 1: 4, 2: 1, 3: 1, 6: 1, 7: 1, 13: 1, 25: 3}
OK	3625-25-0	CCC1(C(=O)NC(=O)NC1=O)C2=CC3CCC(C3)C2	{32: 2, 1: 1, 2: 1, 11: 4, 12: 2, 13: 1, 14: 1, 15: 1, 25: 3}
OK	3625-52-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 30, 27: 1}
OK	36255-44-4	COC(CCBr)OC	{1: 2, 2: 2, 3: 1, 18: 1, 22: 2}
OK	3626-69-5	CC=CC(=O)N1CCCCC1	{24: 1, 1: 1, 11: 5, 6: 2, 33: 1}
OK	36262-33-6	C1CC12C=CC3(CC3)C=C2	{11: 4, 13: 2, 14: 4}
OK	36272-22-7	CC[C@@H](C)CN	{1: 2, 2: 2, 3: 1, 30: 1}
OK	36278-22-5	C1CCC(=CC1)C(=O)Cl	{24: 1, 17: 1, 11: 4, 14: 1, 15: 1}
OK	36295-91-7	CCCCN(CCCC)N/N=C\1/C(=NC=N1)C(=O)OC	{1: 3, 2: 6, 35: 2, 33: 1, 34: 1, 14: 1, 15: 2, 28: 1, 31: 1}
OK	363-24-6	CCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O)O	{1: 1, 2: 8, 3: 1, 6: 4, 11: 1, 12: 3, 20: 2, 25: 1, 27: 1}
OK	36306-87-3	CCOC(=C)C1C(CC(=O)CC1(C)C)(C)C	{1: 5, 2: 1, 5: 1, 7: 1, 11: 2, 12: 1, 13: 2, 22: 1, 25: 1}
OK	36319-88-7	CC(C)(C)C1=CC=C(C1=O)C(C)(C)C	{1: 6, 4: 2, 25: 1, 14: 2, 15: 2}
OK	36320-14-6	CC(C)(C)/C=C/C=C	{1: 3, 4: 1, 5: 1, 6: 3}
OK	36328-29-7	C1CCC2C3C2C3C1	{11: 4, 12: 4}
OK	36333-41-2	C(#CBr)C#CBr	{10: 4, 18: 2}
OK	36336-08-0	COF	{16: 1, 1: 1, 22: 1}
OK	3634-92-2	CCCCCCCCCCCCCCCCCC(=O)OCCC	{1: 2, 2: 18, 28: 1}
OK	3634-94-4	CCCCCCCCCCOC(=O)CCCC(=O)OCCCCCCCCCC	{1: 2, 2: 21, 28: 2}
OK	36343-05-2	CCCCCCCNC	{1: 2, 2: 6, 31: 1}
OK	3635-94-7	C1C2C=CC1C3C2C3	{11: 2, 12: 4, 14: 2}
OK	36354-96-8	CCCCCCCCCCCCCCCCCC(=O)NCCNCCNC(=O)CCCCCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 36, 31: 3}
OK	36355-90-5	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 48}
OK	36362-09-1	CCCCCCCCCCSCCN.Cl	{40: 1, 1: 1, 2: 11, 30: 1, 17: 1}
OK	36369-40-1	C(CNCCNC(=O)O)N	{2: 4, 27: 1, 30: 1, 31: 2}
OK	3637-11-4	CC1(CC(=O)CC(N1O)(C)C)C	{1: 4, 33: 1, 11: 2, 13: 2, 20: 1, 25: 1}
OK	3637-61-4	C1CCC(C1)CO	{20: 1, 2: 1, 11: 4, 12: 1}
OK	3637-63-6	C1CCCC(CCC1)CO	{20: 1, 2: 1, 11: 7, 12: 1}
OK	36375-30-1	CC(=O)OCCN(C)CCCl	{1: 2, 2: 4, 28: 1, 33: 1, 17: 1}
OK	3638-35-5	CC(C)C1CC1	{11: 2, 1: 2, 3: 1, 12: 1}
OK	3638-64-0	C=C[N+](=O)[O-]	{38: 1, 5: 1, 6: 1}
OK	36380-97-9	CC1=CC(=O)/C(=C(\C)/NO)/C=C1	{1: 2, 7: 1, 14: 3, 15: 2, 20: 1, 25: 1, 31: 1}
OK	36382-10-2	CC=CCC(C)(C)C	{1: 4, 2: 1, 4: 1, 6: 2}
OK	3639-21-2	CCC(CC)(C(=O)O)O	{1: 2, 2: 2, 27: 1, 4: 1, 20: 1}
OK	36394-75-9	C[C@@H](C(=O)Cl)OC(=O)C	{24: 1, 1: 2, 3: 1, 28: 1, 17: 1}
OK	36398-89-7	C(C(COCC([N+](=O)[O-])([N+](=O)[O-])F)O)OCC([N+](=O)[O-])([N+](=O)[O-])F	{2: 4, 3: 1, 4: 2, 38: 4, 16: 2, 20: 1, 22: 2}
OK	36399-21-0	C=CCC1(CCCC1)O	{2: 1, 5: 1, 6: 1, 11: 4, 13: 1, 20: 1}
OK	36405-47-7	CC(=C)C(=O)OCC(C(C(F)(F)F)F)(F)F	{1: 1, 2: 1, 3: 1, 4: 2, 5: 1, 7: 1, 16: 6, 28: 1}
OK	3642-10-2	C=C=CCCC=C=C	{8: 2, 2: 2, 5: 2, 6: 2}
OK	3642-21-5	C=CC(=C)C(=C)C=C	{5: 4, 6: 2, 7: 2}
OK	3643-64-9	CC1CC(C=C(C1)C)C	{1: 3, 11: 2, 12: 2, 14: 1, 15: 1}
OK	36437-19-1	C(=O)C(C=O)Cl	{17: 1, 26: 2, 3: 1}
OK	36439-78-8	C=C1C2CCC(C2)C1=C	{11: 3, 12: 2, 5: 2, 15: 2}
OK	36439-79-9	C=C1C2CCC(C1=C)CC2	{11: 4, 12: 2, 5: 2, 15: 2}
OK	36439-83-5	CC(=C1C2C=CC1C(=C)C2=C)C	{1: 2, 5: 2, 7: 1, 12: 2, 14: 2, 15: 3}
OK	36439-89-1	C=C1C2C=CC(C1=C)C3C2C3	{11: 1, 12: 4, 5: 2, 14: 2, 15: 2}
OK	36439-90-4	C=C1C2CCC(C1=C)C3C2C3	{11: 3, 12: 4, 5: 2, 15: 2}
OK	36439-92-6	C=C1C2C3CCC(C2C1=C)CC3	{11: 4, 12: 4, 5: 2, 15: 2}
OK	3644-11-9	COCNC(=O)C=C	{1: 1, 2: 1, 5: 1, 6: 1, 22: 1, 24: 1, 31: 1}
OK	3644-72-2	C(=NBr)=O	{8: 1, 18: 1, 34: 1, 29: 1}
OK	36456-22-1	CC(=C1C2C=CC1C=C2)C	{1: 2, 15: 1, 12: 2, 14: 4, 7: 1}
OK	3646-68-2	C([C@H]([C@H]([C@@H]([C@H](C(=O)O)N)O)O)O)O	{27: 1, 2: 1, 3: 4, 20: 4, 30: 1}
OK	3646-73-9	C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O	{20: 5, 2: 1, 12: 5, 23: 1}
OK	3647-69-6	C1COCCN1CCCl.Cl	{17: 2, 2: 2, 11: 4, 33: 1, 23: 1}
OK	3647-74-3	C1C2C=CC1C3C2C(=O)NC3=O	{32: 1, 25: 2, 11: 1, 12: 4, 14: 2}
OK	36476-78-5	C1C(CN1)C(=O)O	{27: 1, 32: 1, 11: 2, 12: 1}
OK	36479-80-8	C1CC2CCC1N([N+]2=O)[O-]	{33: 2, 11: 4, 12: 2, 29: 2}
OK	36489-03-9	CCSCCN	{40: 1, 1: 1, 2: 3, 30: 1}
OK	36518-76-0	C1C(=NC(=N)S1)N.Cl	{35: 1, 36: 1, 41: 1, 11: 1, 15: 2, 17: 1, 30: 1}
OK	36520-41-9	C1CCCNCCC1.Cl	{32: 1, 17: 1, 11: 7}
OK	36520-42-0	CN1CCCC1.Cl	{1: 1, 11: 4, 33: 1, 17: 1}
OK	36521-89-8	CCCCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](COC1[C@@H](CO)OC(=O)CCCCCCCCCCCCCCCCC)O	{1: 2, 2: 33, 3: 1, 11: 1, 12: 3, 20: 2, 23: 1, 28: 2}
OK	36528-28-6	CCCCCCCCCCCC(=O)OCCCCCCCCCC	{1: 2, 2: 19, 28: 1}
OK	36528-62-8	C=C1C2CCC(C1=C)C=C2	{11: 2, 12: 2, 5: 2, 14: 2, 15: 2}
OK	3653-19-8	CCN=CC=CC	{1: 2, 2: 1, 34: 1, 6: 3}
OK	3653-34-7	CC(C)CC(CC(=O)O)N	{27: 1, 1: 2, 2: 2, 3: 2, 30: 1}
OK	36542-63-9	CCCCCC(Cl)Cl	{1: 1, 2: 4, 3: 1, 17: 2}
OK	36555-73-4	CCCCCCCCCCCCCCCN(CC)CC	{1: 3, 2: 16, 33: 1}
OK	36563-79-8	CCCCCCCCCCCCCCCCCC(=O)OCC1(COCC(C1O)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)/C=C\C(=O)OCC2(COCC(C2O)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC	{1: 6, 2: 104, 6: 2, 11: 4, 12: 2, 13: 4, 20: 2, 23: 2, 28: 8}
OK	36566-74-2	CCCC=NNCC=CC	{1: 2, 2: 3, 34: 1, 6: 3, 31: 1}
OK	36566-80-0	CCC#CC(C)C	{1: 3, 2: 1, 3: 1, 10: 2}
OK	36567-29-0	C(C(F)(Br)Br)(C(F)(Br)Br)(F)F	{16: 4, 18: 4, 4: 3}
OK	3657-07-6	CCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 3, 4: 1, 28: 1, 17: 3}
OK	3657-41-8	CCCC1(CO1)C	{1: 2, 2: 2, 11: 1, 13: 1, 23: 1}
OK	36573-63-4	CC1CC(C2(C(O1)OC3CC4CCC5C(C4(CC3O2)C=O)CCC6(C5(CCC6C7=CC(=O)OC7)O)C)O)OC(=O)C	{1: 3, 11: 10, 12: 9, 13: 4, 14: 1, 15: 1, 20: 2, 23: 3, 26: 1, 28: 2}
OK	3658-77-3	CC1C(=O)C(=C(O1)C)O	{1: 2, 12: 1, 15: 2, 20: 1, 23: 1, 25: 1}
OK	3658-79-5	CCCCC(OCC)OCC	{1: 3, 2: 5, 3: 1, 22: 2}
OK	3658-80-8	CSSSC	{40: 3, 1: 2}
OK	3658-95-5	CCCC(OCC)OCC	{1: 3, 2: 4, 3: 1, 22: 2}
OK	3659-97-0	CN1C(=O)C(=O)NC1=O	{32: 1, 1: 1, 33: 1, 25: 3}
OK	3661-15-2	C1CCN2CCCCN2C1	{33: 2, 11: 8}
OK	3661-77-6	C1CCCCCCCCC(=O)CCCCCCC1	{25: 1, 11: 16}
OK	36613-93-1	CCC(C1CCCCC1)C(=O)OC	{1: 2, 2: 1, 3: 1, 11: 5, 12: 1, 28: 1}
OK	3664-56-0	CC1=CC1(C)C	{1: 3, 13: 1, 14: 1, 15: 1}
OK	3664-60-6	CC(=O)CCCCC=C	{24: 1, 1: 1, 2: 4, 5: 1, 6: 1}
OK	36652-42-3	C1CCONC1	{32: 1, 11: 4, 23: 1}
OK	36653-82-4	CCCCCCCCCCCCCCCCO	{1: 1, 2: 15, 20: 1}
OK	36668-55-0	CCC(=CBr)C	{1: 2, 2: 1, 18: 1, 6: 1, 7: 1}
OK	36675-34-0	C([C@@H](COC[C@@H](COC[C@H](COC[C@H](COC[C@H](COC[C@H](CO)O)O)O)O)O)O)O	{2: 12, 3: 6, 20: 8, 22: 5}
OK	36678-45-2	C(C(=C(C(Br)Br)Br)Br)(Br)Br	{18: 6, 3: 2, 7: 2}
OK	36678-65-6	CC(CN)NCCNC(C)CN	{1: 2, 2: 4, 3: 2, 30: 2, 31: 2}
OK	3669-80-5	C(CCCCCO)CCCCC(=O)O	{2: 10, 27: 1, 20: 1}
OK	36691-77-7	CCCCCCCCCC(CC(C)C)O	{1: 3, 2: 9, 3: 2, 20: 1}
OK	367-28-2	C1=CC(=O)C(=CC1=O)F	{16: 1, 25: 2, 14: 3, 15: 1}
OK	367-57-7	CC(=O)CC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 1, 4: 1, 24: 2}
OK	367-64-6	CCCCOC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 3, 4: 1, 28: 1}
OK	367-93-1	CC(C)S[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O	{1: 2, 2: 1, 3: 1, 40: 1, 12: 5, 20: 4, 23: 1}
OK	36727-29-4	CC(CC(=O)Cl)CC(C)(C)C	{1: 4, 2: 2, 3: 1, 4: 1, 17: 1, 24: 1}
OK	36727-72-7	C(CSCOCSCCO)O	{40: 2, 2: 6, 20: 2, 22: 1}
OK	3673-79-8	CC(CBr)(C(=O)OC)Br	{1: 2, 2: 1, 4: 1, 18: 2, 28: 1}
OK	36731-15-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 37, 5: 1, 6: 1}
OK	3674-07-5	CCCCCCCCCCCCOC(=O)CBr	{1: 1, 2: 12, 28: 1, 18: 1}
OK	3674-09-7	COC(=O)C(CCl)Cl	{1: 1, 2: 1, 3: 1, 28: 1, 17: 2}
OK	3674-10-0	CC(=O)OC(CCl)CCl	{1: 1, 2: 2, 3: 1, 28: 1, 17: 2}
OK	3674-13-3	CCOC(=O)C(CBr)Br	{1: 1, 2: 2, 3: 1, 28: 1, 18: 2}
OK	36749-13-0	CCC(CC)OCC	{1: 3, 2: 3, 3: 1, 22: 1}
OK	3675-13-6	C(=C/C=O)\C=O	{26: 2, 6: 2}
OK	3675-68-1	CCC(C(Br)Br)Br	{1: 1, 2: 1, 3: 2, 18: 3}
OK	3675-69-2	CCC(CBr)(Br)Br	{1: 1, 2: 2, 4: 1, 18: 3}
OK	36755-25-6	CCOC(=O)N1CCN(CC1)C2=CC(=C)CC(C2)(C)C	{1: 3, 2: 1, 5: 1, 33: 2, 11: 6, 13: 1, 14: 1, 15: 2, 28: 1}
OK	36768-62-4	CC1(CC(CC(N1)(C)C)N)C	{32: 1, 1: 4, 11: 2, 12: 1, 13: 2, 30: 1}
OK	36775-23-2	CC1(CC(CC(N1O)(C)C)NC(=O)CCl)C	{1: 4, 2: 1, 33: 1, 11: 2, 12: 1, 13: 2, 17: 1, 20: 1, 24: 1, 31: 1}
OK	36779-84-7	CC(C)C1CCC(CC1)CC(C)C(=O)C	{1: 4, 2: 1, 3: 2, 11: 4, 12: 2, 24: 1}
OK	36781-65-4	CC#CCC(=O)O	{1: 1, 2: 1, 27: 1, 10: 2}
OK	36781-83-6	CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCC(CCCCCC)O	{1: 2, 2: 36, 3: 1, 20: 1, 28: 1}
OK	36794-64-6	CC(CO)C(C)(C)C	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1}
OK	368-34-3	CCCCOC(=O)C(F)Cl	{1: 1, 2: 3, 3: 1, 16: 1, 17: 1, 28: 1}
OK	36805-97-7	CC(C)(C)OC(N(C)C)OC(C)(C)C	{1: 8, 3: 1, 4: 2, 22: 2, 33: 1}
OK	3681-71-8	CCC=CCCOC(=O)C	{1: 2, 2: 3, 28: 1, 6: 2}
OK	3681-78-5	CCCCCCCCCCCC(=O)OCCC	{1: 2, 2: 12, 28: 1}
OK	3682-91-5	CC(C)(CC(=O)CC(C)(C)O)O	{24: 1, 1: 4, 2: 2, 4: 2, 20: 2}
OK	36826-83-2	CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC(CCCCCC)O	{1: 2, 2: 32, 3: 1, 20: 1, 28: 1}
OK	3683-22-5	CCC(C)/C=C/C	{1: 3, 2: 1, 3: 1, 6: 2}
OK	36837-80-6	CCCCCCCCCCCCCCCCCCNC(=O)N(CCO)CCO	{1: 1, 2: 21, 33: 1, 20: 2, 24: 1, 31: 1}
OK	36839-67-5	CCC(CC)OC	{1: 3, 2: 2, 3: 1, 22: 1}
OK	3684-97-7	CN(CC#N)N=O	{1: 1, 2: 1, 37: 1, 33: 1, 34: 1, 29: 1}
OK	36847-51-5	CCOC(=O)C(CCBr)Br	{1: 1, 2: 3, 3: 1, 28: 1, 18: 2}
OK	3685-01-6	C[C@@H]1CC=CC[C@H]1C	{1: 2, 11: 2, 12: 2, 14: 2}
OK	36865-38-0	CCOCCCCl	{1: 1, 2: 4, 22: 1, 17: 1}
OK	36865-40-4	CCOCCCBr	{1: 1, 2: 4, 18: 1, 22: 1}
OK	36865-41-5	COCCCBr	{1: 1, 2: 3, 18: 1, 22: 1}
OK	36865-43-7	CCOCCCCCl	{1: 1, 2: 5, 22: 1, 17: 1}
OK	3687-46-5	CCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 23, 28: 1, 6: 2}
OK	3687-48-7	CCCCC[C@H](C=C)O	{1: 1, 2: 4, 3: 1, 5: 1, 6: 1, 20: 1}
OK	36871-95-1	CC(=O)[C@@H]([C@@H](C(=O)C)O)O	{24: 2, 1: 2, 3: 2, 20: 2}
OK	36874-77-8	CCCCN(CCC)CCCC	{1: 3, 2: 8, 33: 1}
OK	36897-94-6	COC(=O)C1C2CC(C1C(=O)O)C=C2	{1: 1, 11: 1, 12: 4, 14: 2, 27: 1, 28: 1}
OK	3690-50-4	CC=C1C=CC(=O)O1	{1: 1, 28: 1, 14: 2, 6: 1, 15: 1}
OK	36901-84-5	C/C=C\CCC/C=C\C	{1: 2, 2: 3, 6: 4}
OK	36903-89-6	CCCCC(C)(CCC)Cl	{1: 3, 2: 5, 4: 1, 17: 1}
OK	36903-95-4	CCC=CC(=CCC)C	{1: 3, 2: 2, 6: 3, 7: 1}
OK	3691-11-0	C[C@H]1CCC2=C(CC[C@H](C[C@@H]12)C(=C)C)C	{1: 3, 5: 1, 7: 1, 11: 5, 12: 3, 15: 2}
OK	3691-12-1	CC1CCC(CC2=C1CCC2C)C(=C)C	{1: 3, 5: 1, 7: 1, 11: 5, 12: 3, 15: 2}
OK	3691-16-5	C=CC(CN1CC1)O	{33: 1, 2: 1, 3: 1, 5: 1, 6: 1, 11: 2, 20: 1}
OK	3693-53-6	CCOC(=O)NCNC(=O)OCC	{1: 2, 2: 3, 28: 2, 31: 2}
OK	3693-58-1	C1CC2C=CC1CN2	{32: 1, 11: 3, 12: 2, 14: 2}
OK	3693-61-6	CN1CC2CCC1C=C2	{1: 1, 11: 3, 12: 2, 14: 2, 33: 1}
OK	3693-69-4	CCOC(=O)N1CC2CCC1C=C2	{1: 1, 2: 1, 33: 1, 11: 3, 12: 2, 14: 2, 28: 1}
OK	369403-08-7	CC(C)(C)OC(=O)NC1(CCC(CC1)O)C(=O)O	{1: 3, 4: 1, 11: 4, 12: 1, 13: 1, 20: 1, 27: 1, 28: 1, 31: 1}
OK	36950-85-3	CCCCCCCC(C=C[C@H]1C(CC(C1CC=CCCCC(=O)O)O)O)O	{1: 1, 2: 10, 3: 1, 6: 4, 11: 1, 12: 4, 20: 3, 27: 1}
OK	3698-89-3	CCCCCCCCCCCCSC	{40: 1, 1: 2, 2: 11}
OK	3698-93-9	CCCCCCCCSCCC	{40: 1, 1: 2, 2: 9}
OK	3698-94-0	CCCCCCCCSCC	{40: 1, 1: 2, 2: 8}
OK	3698-95-1	CCCCCCCCSC	{40: 1, 1: 2, 2: 7}
OK	3699-54-5	C1CN(C(=O)N1)CCO	{32: 1, 33: 1, 2: 2, 11: 2, 20: 1, 25: 1}
OK	36996-87-9	CN(C)CCOCOCCN(C)C	{1: 4, 2: 5, 22: 2, 33: 2}
OK	36997-05-4	CCOC(=O)C(=C)OC	{1: 2, 2: 1, 5: 1, 7: 1, 22: 1, 28: 1}
OK	36998-21-7	C1=CC1C=O	{26: 1, 12: 1, 14: 2}
OK	370-81-0	C1CCC(=NNC(=O)C(=O)NN=C2CCCCC2)CC1	{24: 2, 31: 2, 34: 2, 11: 10, 15: 2}
OK	37006-36-3	C[C@](CCl)(C(=O)O[C@H]1CC(=C)[C@@H]2C[C@@H]([C@@]([C@@H]2C3[C@@H]1C(=C)C(=O)O3)(CCl)O)O)O	{1: 1, 2: 2, 4: 1, 5: 2, 11: 2, 12: 6, 13: 1, 15: 2, 17: 2, 20: 3, 28: 2}
OK	37008-82-5	CCCCCN(CCCCC)C#N	{1: 2, 2: 8, 37: 1, 33: 1}
OK	37031-29-1	CC1(O[C@H]([C@@H](O1)C(=O)OC)C(=O)OC)C	{1: 4, 12: 2, 13: 1, 28: 2, 23: 2}
OK	37031-30-4	CC1(OC(C(O1)C(=O)OC)C(=O)OC)C	{1: 4, 12: 2, 13: 1, 28: 2, 23: 2}
OK	3704-09-4	C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@@H]3[C@@H]1[C@@H]4CC[C@]([C@]4(CC3)C)(C)O	{1: 3, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	37043-64-4	CCC(C(=O)OCC)N(CC)CC	{1: 4, 2: 4, 3: 1, 28: 1, 33: 1}
OK	37050-04-7	CCCCCC=C=CCC	{8: 1, 1: 2, 2: 5, 6: 2}
OK	37050-05-8	CCC=C=CCC(C)C	{8: 1, 1: 3, 2: 2, 3: 1, 6: 2}
OK	37050-06-9	CCC#CCCC(C)C	{1: 3, 2: 3, 3: 1, 10: 2}
OK	37064-20-3	CCCOC(=O)C(C)CC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	37079-03-1	CCCCCOC(=O)C(Cl)Cl	{1: 1, 2: 4, 3: 1, 28: 1, 17: 2}
OK	37079-04-2	CCCCCCOC(=O)C(Cl)Cl	{1: 1, 2: 5, 3: 1, 28: 1, 17: 2}
OK	37079-08-6	CC(C)COC(=O)C(Cl)Cl	{1: 2, 2: 1, 3: 2, 28: 1, 17: 2}
OK	3709-08-8	CC1(CCOC1=O)C	{1: 2, 11: 2, 28: 1, 13: 1}
OK	3709-18-0	CC1C(=O)OC(OC1=O)(C)C	{1: 3, 12: 1, 13: 1, 28: 2}
OK	371-26-6	CCOC(=O)CCC(F)(F)F	{16: 3, 1: 1, 2: 3, 4: 1, 28: 1}
OK	371-27-7	CCCC(=O)OCC(F)(F)F	{16: 3, 1: 1, 2: 3, 4: 1, 28: 1}
OK	371-29-9	C(CC(=O)OCCF)CF	{16: 2, 2: 5, 28: 1}
OK	371-62-0	C(CF)O	{16: 1, 2: 2, 20: 1}
OK	371-65-3	CCCC(C)(F)F	{16: 2, 1: 2, 2: 2, 4: 1}
OK	371-77-7	C(NC(F)(F)F)(F)(F)F	{16: 6, 4: 2, 31: 1}
OK	371-78-8	C(F)(F)(F)SC(F)(F)F	{16: 6, 40: 1, 4: 2}
OK	371-91-5	CCCCC(C)(F)F	{16: 2, 1: 2, 2: 3, 4: 1}
OK	3710-30-3	C=CCCCCC=C	{2: 4, 5: 2, 6: 2}
OK	3710-31-4	CCCCCC(CO)O	{1: 1, 2: 5, 3: 1, 20: 2}
OK	3710-41-6	CC=CCCCC=C	{1: 1, 2: 3, 5: 1, 6: 3}
OK	3710-42-7	C(CCCO)CCC(=O)O	{2: 6, 27: 1, 20: 1}
OK	3710-84-7	CCN(CC)O	{1: 2, 2: 2, 20: 1, 33: 1}
OK	3711-13-5	CCC(=O)OCC(C)(C)COC(=O)CC	{1: 4, 2: 4, 4: 1, 28: 2}
OK	3711-34-0	CC(C)NNC(C)C	{1: 4, 3: 2, 31: 2}
OK	3711-37-3	CC(C)CNNCC(C)C	{1: 4, 2: 2, 3: 2, 31: 2}
OK	3711-49-7	C(N=O)(Cl)(Cl)Cl	{17: 3, 34: 1, 4: 1, 29: 1}
OK	37136-24-6	C(C(F)(Cl)Cl)(OC(F)(F)Cl)(F)F	{16: 5, 17: 3, 4: 3, 22: 1}
OK	37143-54-7	CC(COC)N	{1: 2, 2: 1, 3: 1, 30: 1, 22: 1}
OK	3715-67-1	CN(C)C(=O)N1CC1	{24: 1, 1: 2, 11: 2, 33: 2}
OK	37165-53-0	C=CC1(CC2CC1C=C2)O	{5: 1, 6: 1, 11: 2, 12: 2, 13: 1, 14: 2, 20: 1}
OK	37167-59-2	COC(=O)C(C(=O)OC)(Br)Br	{1: 2, 18: 2, 4: 1, 28: 2}
OK	3717-38-2	CNC12CC3CC(C1)CC(C3)C2	{1: 1, 11: 6, 12: 3, 13: 1, 31: 1}
OK	3717-40-6	CN(C)C12CC3CC(C1)CC(C3)C2	{1: 2, 11: 6, 12: 3, 13: 1, 33: 1}
OK	37172-05-7	CCC(C)C1CCCCC1(C#C)OC(=O)C	{1: 3, 2: 1, 3: 1, 9: 1, 10: 1, 11: 4, 12: 1, 13: 1, 28: 1}
OK	37172-32-0	CC(=CCCC1(C2CCC(C2)C1=C)C)CO	{1: 2, 2: 3, 5: 1, 6: 1, 7: 1, 11: 3, 12: 2, 13: 1, 15: 1, 20: 1}
OK	37172-52-4	CCCCCC[C@H]1[C@@H](CCC1=O)C(=O)O	{1: 1, 2: 5, 11: 2, 12: 2, 25: 1, 27: 1}
OK	37172-54-6	CCCCCCC1C(CCC1=O)C(=O)OCC	{1: 2, 2: 6, 11: 2, 12: 2, 25: 1, 28: 1}
OK	37172-89-7	CCC(C)C1CCCCC1(C#C)O	{1: 2, 2: 1, 3: 1, 9: 1, 10: 1, 11: 4, 12: 1, 13: 1, 20: 1}
OK	37187-22-7	CC(=O)C(C(=O)C)OOC(C(=O)C)C(=O)C	{24: 4, 1: 4, 3: 2, 22: 2}
OK	372-06-5	C(F)(F)(F)SSSC(F)(F)F	{16: 6, 40: 3, 4: 2}
OK	372-07-6	C(F)(F)(F)SSSSC(F)(F)F	{16: 6, 40: 4, 4: 2}
OK	372-09-8	C(C#N)C(=O)O	{2: 1, 27: 1, 37: 1}
OK	372-25-8	CC(=CC(=O)C(F)(F)F)C(F)(F)F	{1: 1, 4: 2, 6: 1, 7: 1, 16: 6, 24: 1}
OK	372-29-2	CCOC(=O)C=C(C(F)(F)F)N	{1: 1, 2: 1, 4: 1, 6: 1, 7: 1, 16: 3, 28: 1, 30: 1}
OK	372-30-5	CCOC(=O)CC(C(F)(F)F)O	{1: 1, 2: 2, 3: 1, 4: 1, 16: 3, 20: 1, 28: 1}
OK	372-31-6	CCOC(=O)CC(=O)C(F)(F)F	{1: 1, 2: 2, 4: 1, 16: 3, 24: 1, 28: 1}
OK	372-46-3	C1CCC(CC1)F	{16: 1, 11: 5, 12: 1}
OK	372-54-3	CCCCC(C)F	{16: 1, 1: 2, 2: 3, 3: 1}
OK	372-63-4	C(N=NC(F)(F)F)(F)(F)F	{16: 6, 34: 2, 4: 2}
OK	372-64-5	C(F)(F)(F)SSC(F)(F)F	{16: 6, 40: 2, 4: 2}
OK	372-66-7	CC(CCCC(C)(C)O)N	{1: 3, 2: 3, 3: 1, 4: 1, 20: 1, 30: 1}
OK	372-75-8	C(C[C@@H](C(=O)O)N)CNC(=O)N	{2: 3, 3: 1, 24: 1, 27: 1, 30: 2, 31: 1}
OK	372-80-5	CCCCCC(=O)F	{16: 1, 1: 1, 2: 4, 24: 1}
OK	372-90-7	C(CCF)CF	{16: 2, 2: 4}
OK	372-91-8	C(CCI)CF	{16: 1, 2: 4, 19: 1}
OK	372-93-0	C(CCF)CO	{16: 1, 2: 4, 20: 1}
OK	3720-20-5	CC1CC(OC(=O)C1)C	{1: 2, 11: 2, 12: 2, 28: 1}
OK	3721-19-5	C1C2CC(C1C=C2)Cl	{17: 1, 11: 2, 12: 3, 14: 2}
OK	3721-64-0	C=C1C2C3C2C4C1C4C3	{11: 1, 12: 6, 5: 1, 15: 1}
OK	3721-95-7	C1CC(C1)C(=O)O	{27: 1, 11: 3, 12: 1}
OK	37224-10-5	CCCCCCCCCCCCCCCCCCN(CO)C(=O)N(CO)CO	{24: 1, 1: 1, 2: 20, 20: 3, 33: 2}
OK	3724-43-4	C[N+](=CCl)C.[Cl-]	{1: 2, 33: 1, 6: 1, 17: 2}
OK	3724-52-5	C1C(C(C(C1C(=O)O)C(=O)O)C(=O)O)C(=O)O	{27: 4, 11: 1, 12: 4}
OK	3724-55-8	COC(=O)CC=C	{1: 1, 2: 1, 28: 1, 5: 1, 6: 1}
OK	3724-61-6	CCCCCCCCCCCCOC(=O)CCC	{1: 2, 2: 13, 28: 1}
OK	3724-66-1	CCOC(=O)CC=CC	{1: 2, 2: 2, 28: 1, 6: 2}
OK	37244-00-1	CC(=O)CC1CCC(=O)/C=C\C(=O)OC(CCC(=O)/C=C/C(=O)O1)CC(=O)C	{1: 2, 2: 2, 11: 4, 12: 2, 14: 4, 24: 2, 25: 2, 28: 2}
OK	3725-05-1	CC(=C)C#CC(=C)C	{1: 2, 10: 2, 5: 2, 7: 2}
OK	3725-07-3	CC=C(C)C#CC(=CC)C	{1: 4, 10: 2, 6: 2, 7: 2}
OK	3725-20-0	C1C=CC2CC2C=C1	{11: 2, 12: 2, 14: 4}
OK	3725-28-8	C1CC2C1C=CC=C2	{11: 2, 12: 2, 14: 4}
OK	3725-30-2	C/1/C=C\C=C/C/C=C1	{11: 2, 14: 6}
OK	3725-33-5	C1CC2C3C2C1C=C3	{11: 2, 12: 4, 14: 2}
OK	3726-36-1	CC1CC(C(C(C1)C)C)C	{1: 4, 11: 2, 12: 4}
OK	3726-45-2	CC1CCC(C(C1C)C)C	{1: 4, 11: 2, 12: 4}
OK	3726-46-3	CCC1CCCC1C	{1: 2, 2: 1, 11: 3, 12: 2}
OK	3726-47-4	CCC1CCC(C1)C	{1: 2, 2: 1, 11: 3, 12: 2}
OK	3727-31-9	CC1=CCC=C1	{1: 1, 11: 1, 14: 3, 15: 1}
OK	37275-47-1	CCC(CO)(COC(=O)C=C)COC(=O)C=C	{1: 1, 2: 4, 4: 1, 5: 2, 6: 2, 20: 1, 28: 2}
OK	3728-54-9	CCC1CCCCC1C	{1: 2, 2: 1, 11: 4, 12: 2}
OK	3728-55-0	CCC1CCCC(C1)C	{1: 2, 2: 1, 11: 4, 12: 2}
OK	3728-56-1	CCC1CCC(CC1)C	{1: 2, 2: 1, 11: 4, 12: 2}
OK	373-04-6	C(CCC(=O)N)CCN	{24: 1, 2: 5, 30: 2}
OK	373-05-7	C(CCC(=O)O)CCF	{16: 1, 2: 5, 27: 1}
OK	373-14-8	CCCCCCF	{16: 1, 1: 1, 2: 5}
OK	373-17-1	C(CCF)CCF	{16: 2, 2: 5}
OK	373-28-4	C(CCCBr)CCF	{16: 1, 2: 6, 18: 1}
OK	373-32-0	C(CCCF)CCO	{16: 1, 2: 6, 20: 1}
OK	373-44-4	C(CCCCN)CCCN	{2: 8, 30: 2}
OK	373-52-4	C(F)Br	{16: 1, 2: 1, 18: 1}
OK	373-53-5	C(F)I	{16: 1, 2: 1, 19: 1}
OK	373-88-6	C(C(F)(F)F)N.Cl	{16: 3, 17: 1, 2: 1, 4: 1, 30: 1}
OK	373-91-1	C(OF)(F)(F)F	{16: 4, 4: 1, 22: 1}
OK	3730-08-3	CCCCCCCC#CCCCCC	{1: 2, 2: 10, 10: 2}
OK	3730-56-1	C[C@]12CCC[C@@](C1CCC3=CC(CCC23)(C)C=C)(C)C(=O)OC	{1: 4, 5: 1, 6: 1, 11: 7, 12: 2, 13: 3, 14: 1, 15: 1, 28: 1}
OK	3730-60-7	CC(C)CCC(C)(C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	3731-16-6	CCOC(=O)C1CCCNC1=O	{32: 1, 1: 1, 2: 1, 11: 3, 12: 1, 25: 1, 28: 1}
OK	3731-38-2	C1CN2CCC1C(=O)C2	{25: 1, 11: 5, 12: 1, 33: 1}
OK	3732-31-8	C1C2CC3CC1CC(C2)(C3)C45CC6CC(C4)CC(C6)C5	{11: 12, 12: 6, 13: 2}
OK	3732-56-7	CN1CCSC1=N	{1: 1, 36: 1, 33: 1, 41: 1, 11: 2, 15: 1}
OK	3732-61-4	CC(C)(C)C(C)(C=C)O	{1: 4, 4: 2, 5: 1, 6: 1, 20: 1}
OK	37321-09-8	CN[C@H]1[C@H]([C@@H]2[C@H](C[C@H](C(O2)O[C@@H]3[C@H](C[C@H]([C@@H]([C@H]3O)O)N)N)N)O[C@@H]1O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)N)O)O)O	{1: 1, 2: 1, 11: 2, 12: 17, 20: 6, 22: 2, 23: 3, 30: 4, 31: 1}
OK	37339-90-5	C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)O)O)O)O)O)O	{20: 23, 2: 7, 12: 35, 22: 6, 23: 7}
OK	3734-48-3	C1C=CC2C1C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{11: 1, 12: 2, 13: 3, 14: 2, 15: 2, 17: 6}
OK	3734-60-9	C=CC1=CC(OC1=O)O	{5: 1, 6: 1, 12: 1, 14: 1, 15: 1, 20: 1, 28: 1}
OK	37349-04-5	CC(C)CCCCCCCCCCCCCCC1=NCCN1CCN	{1: 2, 2: 16, 3: 1, 33: 1, 11: 2, 15: 1, 35: 1, 30: 1}
OK	3736-26-3	C=CC1(CCC=CC1)OO	{5: 1, 6: 1, 11: 3, 13: 1, 14: 2, 20: 1, 22: 1}
OK	37368-20-0	CCCCC=CCl	{1: 1, 2: 3, 6: 2, 17: 1}
OK	3737-00-6	C(C=CCl)Br	{17: 1, 2: 1, 18: 1, 6: 2}
OK	3739-30-8	CCC(C)(C(=O)O)O	{1: 2, 2: 1, 27: 1, 4: 1, 20: 1}
OK	3739-64-8	CCCCOCC=C	{1: 1, 2: 4, 22: 1, 5: 1, 6: 1}
OK	3739-81-9	CN1C=CC=NC1=O	{1: 1, 35: 1, 33: 1, 14: 3, 25: 1}
OK	37394-32-4	CCCCCCCCCCCC(=O)O[C@@]12[C@@H](C1(C)C)[C@@H]3C=C(C[C@]4([C@H]([C@]3([C@@H](C2OC(=O)/C(=C/C)/C)C)O)C=C(C4=O)C)O)CO	{1: 7, 2: 11, 6: 1, 7: 1, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	374-00-5	CC(=C)C(F)(F)F	{16: 3, 1: 1, 4: 1, 5: 1, 7: 1}
OK	374-01-6	CC(C(F)(F)F)O	{16: 3, 1: 1, 3: 1, 4: 1, 20: 1}
OK	374-07-2	C(C(F)(Cl)Cl)(F)(F)F	{16: 4, 17: 2, 4: 2}
OK	374-18-5	CC(CCl)(C(F)(F)F)Cl	{16: 3, 1: 1, 2: 1, 4: 2, 17: 2}
OK	374-25-4	C=CC(C(F)(F)Br)(F)Cl	{4: 2, 5: 1, 6: 1, 16: 3, 17: 1, 18: 1}
OK	374-27-6	C=CC(C(F)(F)F)(F)F	{16: 5, 4: 2, 5: 1, 6: 1}
OK	374-40-3	CC(C(C(F)(F)F)(F)F)O	{16: 5, 1: 1, 3: 1, 4: 2, 20: 1}
OK	374-77-6	C1(C(C(C(C(C1(F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(C(F)(F)F)F	{16: 16, 4: 2, 13: 6}
OK	374-80-1	C12(C(C(C(C1(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F	{16: 16, 13: 9}
OK	374-97-0	C(C(C(C(F)(F)F)(F)F)(F)F)Cl	{16: 7, 17: 1, 2: 1, 4: 3}
OK	374-98-1	C(C(C(C(F)(F)F)(F)F)(F)F)I	{16: 7, 2: 1, 19: 1, 4: 3}
OK	374-99-2	C(C(C(C(F)(F)F)(F)F)(F)F)N	{16: 7, 2: 1, 4: 3, 30: 1}
OK	3740-59-8	CC1=CCCC(=O)O1	{1: 1, 11: 2, 28: 1, 14: 1, 15: 1}
OK	3741-00-2	CCCCCC1CCCC1	{1: 1, 2: 4, 11: 4, 12: 1}
OK	3741-24-0	C1CC(=O)N(C1=O)N2C(=O)CCC2=O	{25: 4, 11: 4, 33: 2}
OK	37415-55-7	CCCC(=O)OC12C([C@H]([C@]3([C@H](C1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C)OC(=O)/C(=C/C)/C	{1: 7, 2: 3, 6: 1, 7: 1, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	37415-56-8	CCCCCCCCCCCC(=O)O[C@@]12[C@@H](C1(C)C)[C@@H]3C=C(C[C@]4([C@H]([C@]3([C@@H]([C@H]2OC(=O)CCC)C)O)C=C(C4=O)C)O)CO	{1: 6, 2: 13, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	3742-34-5	C=CC1CCCC1	{11: 4, 12: 1, 5: 1, 6: 1}
OK	3742-42-5	CCC1CCC=CC1	{1: 1, 2: 1, 11: 3, 12: 1, 14: 2}
OK	37426-22-5	CC(C)(C)NN=C1CCCCC1	{1: 3, 34: 1, 4: 1, 11: 5, 15: 1, 31: 1}
OK	37434-57-4	C[C@H]1N([C@@H](SC(S1)C)C)C	{1: 4, 12: 3, 41: 2, 33: 1}
OK	37435-26-0	CC(C)(C)C1C(=O)CCCC1=O	{1: 3, 11: 3, 4: 1, 12: 1, 25: 2}
OK	37436-17-2	C1CC2C=CC1N=[N+]2[O-]	{33: 1, 35: 1, 11: 2, 12: 2, 14: 2, 29: 1}
OK	37437-17-5	CNC(=O)N(CCO)CCO	{1: 1, 2: 4, 33: 1, 20: 2, 24: 1, 31: 1}
OK	3744-02-3	CC(=C)CC(=O)C	{24: 1, 1: 2, 2: 1, 5: 1, 7: 1}
OK	3744-07-8	[N](F)F	{16: 2, 34: 1}
OK	3744-21-6	CC(C)(C)[CH2]	{1: 3, 4: 1, 5: 1}
OK	37454-64-1	CC1N=NC(N=N1)C	{1: 2, 35: 4, 12: 2}
OK	3746-39-2	CCCCCCCCCCCCOC(=O)CS	{1: 1, 2: 12, 28: 1, 39: 1}
OK	3746-40-5	CCCCCCCCCOC(=O)CS	{1: 1, 2: 9, 28: 1, 39: 1}
OK	37478-68-5	CCCCCCCCCC1=NCCN1CCO	{1: 1, 2: 10, 35: 1, 33: 1, 11: 2, 15: 1, 20: 1}
OK	37484-68-7	CCC(=O)C(C)C(=O)C(C)C	{24: 2, 1: 4, 2: 1, 3: 2}
OK	37486-69-4	C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F	{16: 35, 3: 1, 4: 16, 22: 5}
OK	37492-43-6	CCCCCCC1C(CCC1=O)C(=O)CC	{1: 2, 2: 6, 11: 2, 12: 2, 24: 1, 25: 1}
OK	37493-14-4	C[C@H](CO)Cl	{1: 1, 2: 1, 3: 1, 20: 1, 17: 1}
OK	37493-70-2	CCCCCCC(CCCC)O	{1: 2, 2: 8, 3: 1, 20: 1}
OK	375-00-8	C(#N)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 4: 3, 37: 1}
OK	375-01-9	C(C(C(C(F)(F)F)(F)F)(F)F)O	{16: 7, 20: 1, 2: 1, 4: 3}
OK	375-02-0	C(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 26: 1, 4: 3}
OK	375-03-1	COC(C(C(F)(F)F)(F)F)(F)F	{16: 7, 1: 1, 4: 3, 22: 1}
OK	375-07-5	C(=O)(C(C(C(F)(F)Cl)(F)Cl)(F)F)O	{16: 5, 17: 2, 27: 1, 4: 3}
OK	375-14-4	CC(C(C(C(F)(F)F)(F)F)(F)F)O	{16: 7, 1: 1, 3: 1, 4: 3, 20: 1}
OK	375-16-6	C(=O)(C(C(C(F)(F)F)(F)F)(F)F)Cl	{16: 7, 17: 1, 4: 3, 24: 1}
OK	375-17-7	C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 9, 3: 1, 4: 3}
OK	375-22-4	C(=O)(C(C(C(F)(F)F)(F)F)(F)F)O	{16: 7, 27: 1, 4: 3}
OK	375-34-8	C(C(C(F)(F)F)(Cl)Cl)(C(F)(F)F)(Cl)Cl	{16: 6, 17: 4, 4: 4}
OK	375-42-8	C(C(C(F)(F)Br)(F)Cl)(C(F)(F)Br)(F)Cl	{16: 6, 17: 2, 18: 2, 4: 4}
OK	375-50-8	C(C(C(F)(F)I)(F)F)(C(F)(F)I)(F)F	{16: 8, 19: 2, 4: 4}
OK	375-61-1	C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 11, 3: 1, 4: 4}
OK	375-62-2	C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F	{16: 10, 24: 1, 4: 4}
OK	375-80-4	C(C(C(C(F)(F)I)(F)F)(F)F)(C(C(F)(F)I)(F)F)(F)F	{16: 12, 19: 2, 4: 6}
OK	375-84-8	C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 14, 24: 1, 4: 6}
OK	375-85-9	C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 13, 27: 1, 4: 6}
OK	375-88-2	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)Br)(F)F)(F)F)(F)F	{16: 15, 18: 1, 4: 7}
OK	375-95-1	C(=O)(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 17, 27: 1, 4: 8}
OK	375-96-2	C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 20, 4: 9}
OK	375-97-3	C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 21, 3: 1, 4: 9}
OK	3750-26-3	CC(=O)NC(=C)C(=O)CCC(=O)N	{1: 1, 2: 2, 5: 1, 7: 1, 24: 3, 30: 1, 31: 1}
OK	37514-30-0	CC1(CCCCCCCCCCC1)OC	{1: 2, 11: 11, 13: 1, 22: 1}
OK	37517-28-5	C1C(C(C(C(C1NC(=O)C(CCN)O)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(C(C(C(O3)CN)O)O)O)N	{2: 4, 3: 1, 11: 1, 12: 15, 20: 8, 22: 2, 23: 2, 24: 1, 30: 4, 31: 1}
OK	37517-81-0	COC(=O)CC(=O)Cl	{24: 1, 1: 1, 2: 1, 28: 1, 17: 1}
OK	37519-97-4	CC(CC/C=C(\C)/CCC=C(C)C)CCO	{1: 4, 2: 6, 3: 1, 6: 2, 7: 2, 20: 1}
OK	3752-92-9	C1CCC(C1)C(C2CCCC2)C3CCCC3	{11: 12, 3: 1, 12: 3}
OK	37520-11-9	C1CC1CCC2CC2	{2: 2, 11: 4, 12: 2}
OK	37523-44-7	CC(C)(C)C1CS1	{1: 3, 11: 1, 4: 1, 12: 1, 41: 1}
OK	37549-89-6	CCC(=CC(C)C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1}
OK	37558-16-0	CCCC(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)O)CO)[C@H]4[C@@]1(C4(C)C)OC(=O)CCC)O)C	{1: 6, 2: 5, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	37558-17-1	CCCCCC(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)O)CO)[C@H]4[C@@]1(C4(C)C)OC(=O)CCCCC)O)C	{1: 6, 2: 9, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	37558-19-3	CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)O)CO)[C@H]4[C@@]1(C4(C)C)OC(=O)CCCCCCCCCCCCC)O)C	{1: 6, 2: 25, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	37558-29-5	CC1(C=C(C(N1O)(C)C)C(=O)ON2C(=O)CCC2=O)C	{1: 4, 33: 2, 11: 2, 13: 2, 14: 1, 15: 1, 20: 1, 25: 2, 28: 1}
OK	3756-30-7	CC(=C)CI	{1: 1, 2: 1, 19: 1, 5: 1, 7: 1}
OK	3757-32-2	CC(C)COC(=O)CCC(=O)C	{24: 1, 1: 3, 2: 3, 3: 1, 28: 1}
OK	37587-81-8	CCCOC(=O)C(Cl)Cl	{1: 1, 2: 2, 3: 1, 28: 1, 17: 2}
OK	37587-83-0	CC(C)CCOC(=O)C(Cl)Cl	{1: 2, 2: 2, 3: 2, 28: 1, 17: 2}
OK	37587-86-3	CCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 5, 4: 1, 28: 1, 17: 3}
OK	37589-57-4	C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 42, 4: 20}
OK	3759-56-6	CCCCC([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 3: 1, 38: 2}
OK	37599-16-9	CCCCCCCCC=CCCCCCCCC(=O)OC(C)CN(CCN(CC(C)O)CC(C)O)CC(C)O	{1: 5, 2: 20, 3: 4, 6: 2, 33: 2, 20: 3, 28: 1}
OK	376-03-4	C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 28, 4: 13}
OK	376-06-7	C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 27, 27: 1, 4: 13}
OK	376-18-1	C(C(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 16, 20: 1, 2: 1, 3: 1, 4: 7}
OK	376-22-7	C(=C(F)F)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 18, 4: 7, 7: 2}
OK	376-27-2	COC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 15, 1: 1, 4: 7, 28: 1}
OK	376-50-1	CCOC(=O)C(C(C(C(C(=O)OCC)(F)F)(F)F)(F)F)(F)F	{16: 8, 1: 2, 2: 2, 4: 4, 28: 2}
OK	376-53-4	C(#N)C(C(C(C(C#N)(F)F)(F)F)(F)F)(F)F	{16: 8, 4: 4, 37: 2}
OK	376-73-8	C(=O)(C(C(C(C(=O)O)(F)F)(F)F)(F)F)O	{16: 6, 27: 2, 4: 3}
OK	376-77-2	C1(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F	{16: 10, 13: 5}
OK	376-84-1	C=CC(=O)OCC(C(C(C(F)F)(F)F)(F)F)(F)F	{2: 1, 3: 1, 4: 3, 5: 1, 6: 1, 16: 8, 28: 1}
OK	376-89-6	C(#N)C(C(C(C#N)(F)F)(F)F)(F)F	{16: 6, 4: 3, 37: 2}
OK	376-90-9	C(C(C(C(CO)(F)F)(F)F)(F)F)O	{16: 6, 20: 2, 2: 2, 4: 3}
OK	3760-11-0	CCCCCCC=CC(=O)O	{1: 1, 2: 5, 27: 1, 6: 2}
OK	3760-14-3	CC1=CCCC(=CCC1)C	{1: 2, 11: 4, 14: 2, 15: 2}
OK	3760-20-1	CCC1CCCCC1O	{1: 1, 2: 1, 11: 4, 12: 2, 20: 1}
OK	3760-54-1	C1CCN(C1)C=O	{33: 1, 26: 1, 11: 4}
OK	3760-59-6	CC1C(=O)C=C(S1)C	{1: 2, 41: 1, 12: 1, 14: 1, 15: 1, 25: 1}
OK	37608-02-9	CC1(CCCC(CCC(=O)CC1)(C)C)C	{1: 4, 11: 7, 13: 2, 25: 1}
OK	3761-94-2	CC1(CCCCCC1)O	{1: 1, 11: 6, 20: 1, 13: 1}
OK	37615-53-5	CCCCCCN(C)CCCCCC	{1: 3, 2: 10, 33: 1}
OK	37621-85-5	C1CCC(CC1)CC2CCC(CC2)N	{2: 1, 11: 9, 12: 3, 30: 1}
OK	3763-55-1	CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/CCC=C(C)C)/C)/C	{1: 10, 2: 2, 6: 16, 7: 6, 11: 2, 12: 1, 13: 1, 15: 2, 20: 1}
OK	37636-51-4	C1C(C(C(C(C1N)OC2C(CC(C(O2)CO)O)N)OC3C(C(C(O3)CO)OC4C(C(C(C(O4)CN)O)O)N)O)O)N	{2: 3, 11: 2, 12: 18, 20: 7, 22: 3, 23: 3, 30: 5}
OK	37674-63-8	CC=CC(C)C(=O)O	{27: 1, 1: 2, 3: 1, 6: 2}
OK	37677-09-1	CC1(C(O1)CCC2=CCC(CC2)C=O)C	{1: 2, 2: 2, 11: 3, 12: 2, 13: 1, 14: 1, 15: 1, 23: 1, 26: 1}
OK	37677-10-4	CC1(C(O1)CCC2=CCCC(C2)C=O)C	{1: 2, 2: 2, 11: 3, 12: 2, 13: 1, 14: 1, 15: 1, 23: 1, 26: 1}
OK	37677-14-8	CC(=CCCC1=CCC(CC1)C=O)C	{1: 2, 2: 2, 6: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	3768-43-2	CC1CCCNC1=O	{32: 1, 1: 1, 11: 3, 12: 1, 25: 1}
OK	37688-96-3	C(CCCCCCCBr)CCCCCCBr	{2: 14, 18: 2}
OK	37689-12-6	CC(C)CC1CCC=C1	{1: 2, 2: 1, 3: 1, 11: 2, 12: 1, 14: 2}
OK	37689-14-8	CCCCCC1CCC=C1	{1: 1, 2: 4, 11: 2, 12: 1, 14: 2}
OK	37689-15-9	CC(C)CCC1=CCCC1	{1: 2, 2: 2, 3: 1, 11: 3, 14: 1, 15: 1}
OK	37689-16-0	CC(C)CCC1CCC=C1	{1: 2, 2: 2, 3: 1, 11: 2, 12: 1, 14: 2}
OK	37689-18-2	CCCCCCC1CCC=C1	{1: 1, 2: 5, 11: 2, 12: 1, 14: 2}
OK	37689-19-3	C=CCC1=CCCC1	{2: 1, 5: 1, 6: 1, 11: 3, 14: 1, 15: 1}
OK	3769-23-1	CCC(C)CC=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1}
OK	37693-18-8	C(CCCl)COC(=O)Cl	{17: 2, 2: 4, 28: 1}
OK	377-36-6	C(C(C(C(F)F)(F)F)(F)F)(F)F	{16: 8, 3: 2, 4: 2}
OK	377-37-7	C(=O)(C(C(C(=O)N)(F)F)(F)F)N	{16: 4, 24: 2, 4: 2, 30: 2}
OK	377-38-8	C(=O)(C(C(C(=O)O)(F)F)(F)F)O	{16: 4, 27: 2, 4: 2}
OK	377-41-3	C1(C(C(C1(F)F)(F)Cl)(F)F)(F)F	{16: 7, 17: 1, 13: 4}
OK	377-70-8	C1(=C(C(C(C(=C1F)F)(F)F)(F)F)F)F	{16: 8, 13: 2, 15: 4}
OK	377-71-9	CCOC(=O)C(C(C(=O)OCC)(F)F)(F)F	{16: 4, 1: 2, 2: 2, 4: 2, 28: 2}
OK	377-93-5	C1(=C(C(C1(F)F)(F)F)Cl)Cl	{16: 4, 17: 2, 13: 2, 15: 2}
OK	37706-26-6	C1CCC23CCC2(C1)C=C3	{11: 6, 13: 2, 14: 2}
OK	3772-13-2	CC1(CS1)C	{1: 2, 11: 1, 13: 1, 41: 1}
OK	3772-26-7	CC(C)N1CCCC1=O	{11: 3, 1: 2, 3: 1, 33: 1, 25: 1}
OK	37722-77-3	CCOC(=O)C=C1CCCC(C1)(C)C	{1: 3, 2: 1, 6: 1, 11: 4, 13: 1, 15: 1, 28: 1}
OK	37727-90-5	CCN1CCCC(=O)CCC1	{1: 1, 2: 1, 11: 6, 33: 1, 25: 1}
OK	3773-93-1	CC1OCC(O1)CO	{1: 1, 2: 1, 11: 1, 12: 2, 20: 1, 23: 2}
OK	37732-87-9	C=CCN1CCNC1=O	{32: 1, 33: 1, 2: 1, 5: 1, 6: 1, 11: 2, 25: 1}
OK	37746-78-4	CCOC(=O)/C=C/CBr	{1: 1, 2: 2, 28: 1, 18: 1, 6: 2}
OK	3775-51-7	CCCCCCCCCCCC(=O)N(CC(=O)O)CC(=O)O	{24: 1, 1: 1, 2: 12, 27: 2, 33: 1}
OK	3775-85-7	CC1(CO1)COCCOCC2(CO2)C	{1: 2, 2: 4, 11: 2, 13: 2, 22: 2, 23: 2}
OK	3775-90-4	CC(=C)C(=O)OCCNC(C)(C)C	{1: 4, 2: 2, 4: 1, 5: 1, 7: 1, 28: 1, 31: 1}
OK	37764-25-3	C=CCN(CC=C)C(=O)C(Cl)Cl	{33: 1, 2: 2, 3: 1, 5: 2, 6: 2, 17: 2, 24: 1}
OK	37765-15-4	CN([N+](=O)C)[O-]	{1: 2, 29: 2, 33: 2}
OK	37769-62-3	CC(C)CC(C)(C)COC=C	{1: 4, 2: 2, 3: 1, 4: 1, 5: 1, 6: 1, 22: 1}
OK	37778-51-1	CCOC(=O)N1CC2CCC1CC2=O	{1: 1, 2: 1, 33: 1, 11: 4, 12: 2, 25: 1, 28: 1}
OK	37784-17-1	CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)O	{1: 3, 4: 1, 33: 1, 11: 3, 12: 1, 27: 1, 28: 1}
OK	37788-55-9	CC(CN1C=CN=C1)O	{1: 1, 2: 1, 3: 1, 33: 1, 14: 3, 35: 1, 20: 1}
OK	3779-29-1	CCOC(=O)C1(CCC1)C(=O)OCC	{1: 2, 2: 2, 11: 3, 28: 2, 13: 1}
OK	37793-22-9	CN(C(=O)N[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)N=O	{1: 1, 2: 1, 33: 1, 12: 5, 34: 1, 20: 4, 23: 1, 24: 1, 29: 1, 31: 1}
OK	378-13-2	C(CBr)C(C(F)(F)Br)(F)Cl	{16: 3, 17: 1, 2: 2, 4: 2, 18: 2}
OK	378-17-6	C1C(C(C1(F)F)(F)F)CO	{2: 1, 11: 1, 12: 1, 13: 2, 16: 4, 20: 1}
OK	378-44-9	C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C	{1: 3, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 3, 24: 1, 25: 1}
OK	378-75-6	COC(=O)C(C(F)(F)F)(F)F	{16: 5, 1: 1, 4: 2, 28: 1}
OK	3780-58-3	CCCC(C)CC(=O)O	{27: 1, 1: 2, 2: 3, 3: 1}
OK	37817-36-0	CC1C(C1=C=C(C)C)C	{8: 1, 1: 4, 15: 1, 12: 2, 7: 1}
OK	37819-05-9	C1CC2N3C(CCC=N3)N4C(N2N=C1)CCC=N4	{33: 3, 11: 6, 12: 3, 14: 3, 35: 3}
OK	37831-90-6	C1C2C1C3CC3C4C2C4	{11: 3, 12: 6}
OK	37846-63-2	C=C1C2C=CC1C=C2	{12: 2, 5: 1, 14: 4, 15: 1}
OK	37846-64-3	CC(=C1C2CCC1C3C2C3)C	{15: 1, 1: 2, 11: 3, 12: 4, 7: 1}
OK	3785-34-0	C(COC(=O)CBr)OC(=O)CBr	{2: 4, 28: 2, 18: 2}
OK	37850-75-2	CC(C)(C)SCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 40: 1}
OK	37851-04-0	CCSCC(=C)C	{40: 1, 1: 2, 2: 2, 5: 1, 7: 1}
OK	3786-76-3	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(CC[C@H]7C8CC(=O)OC8)O)C)C)C)C)O)O	{1: 5, 11: 14, 12: 18, 13: 3, 20: 5, 22: 3, 23: 3, 28: 1}
OK	37866-06-1	CC(=C(C)CCl)C	{1: 3, 2: 1, 17: 1, 7: 2}
OK	3787-28-8	C(=O)C(=C(Cl)Cl)Cl	{17: 3, 26: 1, 7: 2}
OK	3788-32-7	CC(C)CC1CCCC1	{11: 4, 1: 2, 2: 1, 3: 1, 12: 1}
OK	3788-56-5	C(CCCCO)CCCC(=O)O	{2: 8, 27: 1, 20: 1}
OK	37881-62-2	C(=O)(C(C(C(C(C(=O)F)(F)F)(F)F)(F)F)(F)F)F	{16: 10, 24: 2, 4: 4}
OK	37882-31-8	CC(C)CCCC(C)CC=CC(=CC(=O)OCC#C)C	{1: 4, 2: 5, 3: 2, 6: 3, 7: 1, 9: 1, 10: 1, 28: 1}
OK	37882-55-6	CCC1CC1CO	{1: 1, 2: 2, 11: 1, 12: 2, 20: 1}
OK	37882-92-1	C1CN2CN3CCCN3CN2C1	{33: 4, 11: 8}
OK	37882-93-2	C1C=CCN2N1CN3CC=CCN3C2	{33: 4, 11: 6, 14: 4}
OK	3790-71-4	CC(=CCC/C(=C/CC/C(=C\CO)/C)/C)C	{1: 4, 2: 5, 20: 1, 6: 3, 7: 3}
OK	37910-77-3	CCCCCCCCC=CCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 19, 28: 1, 6: 2}
OK	37933-88-3	CC(C)C(C(=O)N)NC(=O)C	{24: 2, 1: 3, 3: 2, 30: 1, 31: 1}
OK	37935-49-2	C/C=C/C=C/CCCCCCCO[C@@H]1CCCCO1	{1: 1, 2: 7, 6: 4, 11: 4, 12: 1, 22: 1, 23: 1}
OK	37946-57-9	CC1=CC2[C@@](C[C@H]1O)([C@@]3([C@H]([C@@H]([C@@H]([C@]34CO4)O2)O)OC(=O)C)C)COC(=O)C	{1: 4, 2: 1, 11: 2, 12: 5, 13: 3, 14: 1, 15: 1, 20: 2, 23: 2, 28: 2}
OK	3796-70-1	CC(=CCC/C(=C/CCC(=O)C)/C)C	{24: 1, 1: 4, 2: 4, 6: 2, 7: 2}
OK	37973-84-5	C/C=C/CCCCCCCC(=O)O	{1: 1, 2: 7, 27: 1, 6: 2}
OK	37974-23-5	CCCC(C)(CC)C(=O)OC	{1: 4, 2: 3, 4: 1, 28: 1}
OK	37981-36-5	C/C=C\S/C=C\C	{40: 1, 1: 2, 6: 4}
OK	37981-37-6	C/C=C/S/C=C\C	{40: 1, 1: 2, 6: 4}
OK	37985-18-5	CC(C)(C)SC#N	{40: 1, 1: 3, 4: 1, 37: 1}
OK	37994-62-0	CC(=O)C1CN(CCC1(C)O)C	{1: 3, 33: 1, 11: 3, 12: 1, 13: 1, 20: 1, 24: 1}
OK	380-78-9	CCOC(C(F)Br)(F)F	{1: 1, 2: 1, 3: 1, 4: 1, 16: 3, 18: 1, 22: 1}
OK	38049-26-2	C[C@@H]1CCC(C[C@H]1O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 3, 20: 1}
OK	38049-29-5	CC1(C2CC=C(C1C2)CCCC(=O)OC)C	{1: 3, 2: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 28: 1}
OK	3806-60-8	C\1C/C=C\CC/C=C1	{11: 4, 14: 4}
OK	3806-82-4	C1CCC2C=CC2C1	{11: 4, 12: 2, 14: 2}
OK	3808-42-2	C1[C@H]([C@@H]2[C@@H](C(=O)N1)N=C(N2)N[C@H]3[C@@H]([C@@H]([C@H]([C@H](O3)CO)OC(=O)N)O)NC(=O)C[C@H](CCCN)N)O	{32: 2, 2: 5, 3: 1, 11: 1, 12: 8, 15: 1, 35: 1, 20: 3, 23: 1, 24: 1, 25: 1, 28: 1, 30: 3, 31: 2}
OK	3809-32-3	CC1CCC(C(C1)O)C	{1: 2, 11: 3, 12: 3, 20: 1}
OK	38092-76-1	C(CO)N.OCl(=O)(=O)=O	{17: 1, 2: 2, 20: 2, 29: 3, 30: 1}
OK	381-73-7	C(C(=O)O)(F)F	{16: 2, 27: 1, 3: 1}
OK	381-83-9	C=C(CCl)C(F)(F)F	{2: 1, 4: 1, 5: 1, 7: 1, 16: 3, 17: 1}
OK	381-98-6	C=C(C(=O)O)C(F)(F)F	{16: 3, 27: 1, 4: 1, 5: 1, 7: 1}
OK	3811-68-5	CCCCCCCCC=CCCCCCCCCN.CC(=O)O	{1: 2, 2: 15, 27: 1, 30: 1, 6: 2}
OK	38126-74-8	CCCCNN=CCCC	{1: 2, 2: 5, 34: 1, 6: 1, 31: 1}
OK	3813-52-3	C1C2C=CC1C(C2C(=O)O)C(=O)O	{27: 2, 11: 1, 12: 4, 14: 2}
OK	38134-58-6	C(CC(=O)N[C@@H](CSC(=O)NCCCl)C(=O)NCC(=O)O)[C@@H](C(=O)O)N	{2: 6, 3: 2, 40: 1, 17: 1, 24: 3, 27: 2, 30: 1, 31: 3}
OK	38136-29-7	CC(C)CCC(=O)Cl	{24: 1, 1: 2, 2: 2, 3: 1, 17: 1}
OK	3814-34-4	CCC(CC)CBr	{1: 2, 2: 3, 3: 1, 18: 1}
OK	3814-55-9	CC(C)COCC1CO1	{1: 2, 2: 2, 3: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	38146-95-1	CCCCCCCCC(CCCO)O	{1: 1, 2: 10, 3: 1, 20: 2}
OK	3815-86-9	C(C(=O)NN)C(=O)NN	{24: 2, 2: 1, 30: 2, 31: 2}
OK	38167-15-6	CCC(CN(CCC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 4, 4: 2, 38: 5, 33: 1, 16: 1}
OK	3817-11-6	CCCCN(CCCCO)N=O	{1: 1, 2: 7, 33: 1, 34: 1, 20: 1, 29: 1}
OK	3817-57-0	C=C1CCCCCCCCC1	{11: 9, 5: 1, 15: 1}
OK	382-21-8	C(=C(F)F)(C(F)(F)F)C(F)(F)F	{16: 8, 4: 2, 7: 2}
OK	382-24-1	C(C(F)(F)F)(C(F)(F)F)C(F)(F)F	{16: 9, 3: 1, 4: 3}
OK	382-28-5	C1(C(OC(C(N1C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 11, 33: 1, 4: 1, 13: 4, 23: 1}
OK	382-31-0	C(C(C(C(F)(F)F)F)(F)F)O	{16: 6, 20: 1, 2: 1, 3: 1, 4: 2}
OK	382-44-5	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CCC4=O)C)O	{1: 2, 11: 7, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 2}
OK	382-45-6	CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4=O)C	{1: 2, 11: 7, 12: 3, 13: 2, 14: 1, 15: 1, 25: 3}
OK	382-67-2	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@H]1C(=O)CO)C)O)F)C	{1: 3, 2: 1, 11: 4, 12: 5, 13: 3, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1}
OK	382-93-4	COC(=O)C(C(F)(F)F)F	{16: 4, 1: 1, 3: 1, 4: 1, 28: 1}
OK	38215-33-7	CCCCCCCCCCCCCCCCCC(=O)OCC1(COCC(C1O)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)CO	{1: 3, 2: 52, 11: 2, 12: 1, 13: 2, 20: 2, 23: 1, 28: 3}
OK	3822-68-2	C(OC(F)(F)F)(F)F	{16: 5, 3: 1, 4: 1, 22: 1}
OK	38222-35-4	CC1(CC(=C(C1=O)O)N(C)C)O	{1: 3, 33: 1, 11: 1, 13: 1, 15: 2, 20: 2, 25: 1}
OK	38229-26-4	C/C/1=C\CCCCCC1	{1: 1, 11: 6, 14: 1, 15: 1}
OK	3823-94-7	C(=C(OC(=C(C(F)(F)F)F)F)F)(C(F)(F)F)F	{16: 10, 4: 2, 22: 1, 7: 4}
OK	38230-32-9	C[C@H]1CC/C=C(\CC(=O)C(=C(C)C)CC1=O)/C	{1: 4, 7: 1, 11: 4, 12: 1, 14: 1, 15: 2, 25: 2}
OK	38232-01-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 29, 27: 1}
OK	38232-04-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 32, 27: 1}
OK	38235-68-6	CC1([C@H]2CC[C@H]([C@@H]1C2)CN)C	{1: 2, 2: 1, 11: 3, 12: 3, 13: 1, 30: 1}
OK	38237-36-4	CC(=CCCC(=CC=CC(=O)C)C)C	{24: 1, 1: 4, 2: 2, 6: 4, 7: 2}
OK	38239-27-9	C=CN=C	{34: 1, 5: 2, 6: 1}
OK	38252-74-3	CCCCN(CCCC(=O)O)N=O	{1: 1, 34: 1, 33: 1, 2: 6, 27: 1, 29: 1}
OK	38252-75-4	CCCCN(CC(CC(=O)O)O)N=O	{1: 1, 2: 5, 3: 1, 33: 1, 34: 1, 20: 1, 27: 1, 29: 1}
OK	38255-97-9	C1CC2C3CCC(C2C1)CC3	{11: 7, 12: 4}
OK	38256-94-9	CCOCCNC	{1: 2, 2: 3, 22: 1, 31: 1}
OK	38256-95-0	CCNCCOCC	{1: 2, 2: 4, 22: 1, 31: 1}
OK	38258-92-3	COC12CCC(CC1C#N)C=C2	{1: 1, 37: 1, 11: 3, 12: 2, 13: 1, 14: 2, 22: 1}
OK	38258-93-4	C1CC2C=CC1CC2C#N	{11: 3, 12: 3, 37: 1, 14: 2}
OK	38274-01-0	CC(=O)/C=C/C12C(CC(CC1(O2)C)O)(C)C	{1: 4, 6: 2, 11: 2, 12: 1, 13: 3, 20: 1, 23: 1, 24: 1}
OK	38284-27-4	CC/C=C/C=C/C(=O)C	{24: 1, 1: 2, 2: 1, 6: 4}
OK	38284-42-3	CC(=CC1CC2CC1C=C2)C=O	{1: 1, 6: 1, 7: 1, 11: 2, 12: 3, 14: 2, 26: 1}
OK	38285-49-3	CCCCC1COCC(C1OC(=O)C)C	{1: 3, 2: 3, 11: 2, 12: 3, 23: 1, 28: 1}
OK	38289-29-1	CCCCCC1CCC(CC1)C(=O)O	{27: 1, 1: 1, 2: 4, 11: 4, 12: 2}
OK	38291-82-6	CCCCC(=O)NN	{24: 1, 1: 1, 2: 3, 30: 1, 31: 1}
OK	383-62-0	CCOC(=O)C(F)(F)Cl	{1: 1, 2: 1, 4: 1, 16: 2, 17: 1, 28: 1}
OK	383-63-1	CCOC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 1, 4: 1, 28: 1}
OK	383-64-2	CCSC(=O)C(F)(F)F	{1: 1, 2: 1, 4: 1, 40: 1, 16: 3, 24: 1}
OK	383-66-4	CCCOC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 2, 4: 1, 28: 1}
OK	383-67-5	C=CCOC(=O)C(F)(F)F	{2: 1, 4: 1, 5: 1, 6: 1, 16: 3, 28: 1}
OK	383-70-0	C(C(=O)O)NC(=O)C(F)(F)F	{2: 1, 4: 1, 16: 3, 24: 1, 27: 1, 31: 1}
OK	383-72-2	COC(=O)CNC(=O)C(F)(F)F	{1: 1, 2: 1, 4: 1, 16: 3, 24: 1, 28: 1, 31: 1}
OK	38300-49-1	C1CCCC(=O)CCCCCCC(=O)CC1	{25: 2, 11: 12}
OK	38300-67-3	C(CBr)C(CBr)Br	{2: 3, 3: 1, 18: 3}
OK	38302-26-0	CC1(C(CC2C(=C)C3CCC4C(C3(CC4(C)O)CC2(C1O)O)O)O)C	{1: 3, 5: 1, 11: 5, 12: 6, 13: 4, 15: 1, 20: 5}
OK	38304-52-8	CC1(C(=O)N(C(=O)N1CC2CO2)CC(CN3C(=O)C(N(C3=O)CC4CO4)(C)C)OCC5CO5)C	{1: 4, 2: 5, 3: 1, 33: 4, 11: 3, 12: 3, 13: 2, 22: 1, 23: 3, 25: 4}
OK	38310-32-6	C1C=CCC23C1(C=CC=C2)C=C3	{11: 2, 13: 2, 14: 8}
OK	38310-40-6	C1=CC=C2C=CC3C2C(=C1)C=C3	{12: 2, 14: 8, 15: 2}
OK	38310-48-4	C=C1C2CCC1C3C2C3	{11: 3, 12: 4, 5: 1, 15: 1}
OK	3832-48-2	C(=O)(C(F)(F)Br)Cl	{16: 2, 17: 1, 18: 1, 4: 1, 24: 1}
OK	38348-25-3	CC[C@@H]1S[C@@H](SS1)CC	{1: 2, 2: 2, 12: 2, 41: 3}
OK	38348-26-4	CC[C@@H]1S[C@H](SS1)CC	{1: 2, 2: 2, 12: 2, 41: 3}
OK	38348-31-1	CC1(SC(SS1)(C)C)C	{1: 4, 13: 2, 41: 3}
OK	38348-51-5	CC1COC(S1)C	{1: 2, 11: 1, 12: 2, 41: 1, 23: 1}
OK	38348-53-7	CCC1OCC(S1)C	{1: 2, 2: 1, 41: 1, 11: 1, 12: 2, 23: 1}
OK	38353-09-2	C1=CNC(=O)N=C1.Cl	{32: 1, 17: 1, 35: 1, 14: 3, 25: 1}
OK	3836-23-5	CCCCCCC(=O)O[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)C#C	{1: 2, 2: 5, 9: 1, 10: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	38363-23-4	CCCCCCCCCC=CCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 2}
OK	38363-29-0	CCCC=CCCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 2}
OK	38376-28-2	CC(CCCC(C)(C)OC)CCO	{1: 4, 2: 5, 3: 1, 4: 1, 20: 1, 22: 1}
OK	38384-05-3	CCC(C(C)C)Cl	{1: 3, 2: 1, 3: 2, 17: 1}
OK	38384-67-7	CC1COC(S1)C(C)C	{1: 3, 3: 1, 41: 1, 11: 1, 12: 2, 23: 1}
OK	3839-50-7	CC=C1C=CC=C1	{1: 1, 14: 4, 6: 1, 15: 1}
OK	38395-42-5	CCCCC(CC)(CCC)O	{1: 3, 2: 6, 4: 1, 20: 1}
OK	384-04-3	C(=C(F)F)(C(=C(F)F)F)C(F)(F)F	{16: 8, 4: 1, 7: 4}
OK	38410-80-9	C[C@@H]1[C@H](OC(O1)(C)C)C(=O)OC	{1: 4, 12: 2, 13: 1, 28: 1, 23: 2}
OK	3842-03-3	CCOC(CC(C)C)OCC	{1: 4, 2: 3, 3: 2, 22: 2}
OK	38421-90-8	CCCCC=CCCCCOC(=O)C	{1: 2, 2: 7, 28: 1, 6: 2}
OK	38433-74-8	CCCC(CC=O)SC	{40: 1, 1: 2, 2: 3, 3: 1, 26: 1}
OK	38433-80-6	CC(CO)C=O	{1: 1, 2: 1, 3: 1, 20: 1, 26: 1}
OK	38434-77-4	CCN(C#N)N=O	{1: 1, 2: 1, 37: 1, 33: 1, 34: 1, 29: 1}
OK	3844-60-8	CN(C(=O)NNC(=O)N(C)N=O)N=O	{1: 2, 34: 2, 33: 2, 24: 2, 29: 2, 31: 2}
OK	38447-22-2	CCC(C)OC(=O)CCCCC(=O)OC(C)CC	{1: 4, 2: 6, 3: 2, 28: 2}
OK	38460-95-6	C=CCCCCCCCCC(=O)Cl	{24: 1, 17: 1, 2: 8, 5: 1, 6: 1}
OK	38462-22-5	CC1CCC(C(=O)C1)C(C)(C)S	{1: 3, 4: 1, 39: 1, 11: 3, 12: 2, 25: 1}
OK	38463-54-6	CCN1C(CC(C2C1CCCC2)(C#C)O)C	{1: 2, 2: 1, 33: 1, 9: 1, 10: 1, 11: 5, 12: 3, 13: 1, 20: 1}
OK	38463-57-9	CCN1C(CC(C2C1CCCC2)(C=C)O)C	{1: 2, 2: 1, 5: 1, 6: 1, 33: 1, 11: 5, 12: 3, 13: 1, 20: 1}
OK	38463-60-4	CCC1(CC(N(C2C1CCCC2)CC)C)O	{1: 3, 2: 2, 33: 1, 11: 5, 12: 3, 13: 1, 20: 1}
OK	38471-49-7	CCCCCCCCCCCCCOCCO	{1: 1, 2: 14, 20: 1, 22: 1}
OK	38476-45-8	CC1(CC2CC1C(=O)C2)C	{1: 2, 11: 3, 12: 2, 13: 1, 25: 1}
OK	38476-46-9	CC1(C2CC(C1=O)CC2=O)C	{1: 2, 11: 2, 12: 2, 13: 1, 25: 2}
OK	3848-12-2	C(CCl)OC(=O)CCl	{17: 2, 2: 3, 28: 1}
OK	3848-24-6	CCCC(=O)C(=O)C	{24: 2, 1: 2, 2: 2}
OK	3849-21-6	CCOC(=O)C(=NO)C#N	{1: 1, 2: 1, 37: 1, 7: 1, 34: 1, 20: 1, 28: 1}
OK	3849-33-0	C(C(Cl)(Cl)Cl)(C(Cl)(Cl)Cl)Cl	{17: 7, 3: 1, 4: 2}
OK	3849-34-1	CCCCOOCCCC	{1: 2, 2: 6, 22: 2}
OK	38490-33-4	CC1(CC(CC(C1)(C)O)(C)C)C	{1: 5, 11: 3, 20: 1, 13: 3}
OK	38495-33-9	CCCCCCCCCCOC(=O)C[C@H](C)CC(C)(C)C(=O)OCCCCCCCC	{1: 5, 2: 18, 3: 1, 4: 1, 28: 2}
OK	3850-30-4	CC(C(C)(C)C)N	{1: 4, 3: 1, 4: 1, 30: 1}
OK	38514-02-2	CCCCCC(C)CCO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	38514-03-3	CCCCC(C)CCCO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	38514-04-4	CCCC(C)CCCCO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	38514-05-5	CCC(C)CCCCCO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	38514-15-7	CCCCC(CCO)C(C)C	{1: 3, 2: 5, 3: 2, 20: 1}
OK	3852-09-3	COCCC(=O)OC	{1: 2, 2: 2, 28: 1, 22: 1}
OK	3852-72-0	C1=CN(C=CC1=C[NH+]=O)CCOCCN2C=CC(=C[NH+]=O)C=C2.[Br-].[Br-]	{33: 2, 2: 4, 6: 2, 14: 8, 15: 2, 18: 2, 22: 1, 29: 2, 31: 2}
OK	38521-66-3	CCCN(CCCl)CCCl.Cl	{1: 1, 2: 6, 33: 1, 17: 3}
OK	3853-06-3	CN(C)CCC(=O)OC	{1: 3, 2: 2, 28: 1, 33: 1}
OK	3853-27-8	CC1=C(C(=CC1)C)C	{1: 3, 11: 1, 14: 1, 15: 3}
OK	3853-83-6	CC1=C[C@H]2[C@@H](CC1)C(=C)CCCC2(C)C	{1: 3, 5: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 2}
OK	3854-14-6	CN(C)CC#CCC1CCCC1=O.Cl	{1: 2, 2: 2, 33: 1, 10: 2, 11: 3, 12: 1, 17: 1, 25: 1}
OK	3854-96-4	CC1=C(C(=O)C(C(=C1C)C)(C)C)C	{1: 6, 25: 1, 13: 1, 15: 4}
OK	3856-25-5	CC1=CCC2C3C1C2(CCC3C(C)C)C	{1: 4, 3: 1, 11: 3, 12: 4, 13: 1, 14: 1, 15: 1}
OK	38562-01-5	CCCCC[C@@H](/C=C/[C@H]1[C@@H](C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O)O.C(C(CO)(CO)N)O	{1: 1, 2: 11, 3: 1, 4: 1, 6: 4, 11: 1, 12: 4, 20: 6, 27: 1, 30: 1}
OK	38565-52-5	C1C(O1)CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 6, 11: 1, 12: 1, 16: 13, 23: 1}
OK	38565-53-6	C1C(O1)CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 8, 11: 1, 12: 1, 16: 17, 23: 1}
OK	38565-54-7	C1C(O1)CC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 10, 11: 1, 12: 1, 16: 21, 23: 1}
OK	3857-17-8	CCCC1CCCCO1	{1: 1, 2: 2, 11: 4, 12: 1, 23: 1}
OK	38571-73-2	C(C(COCCl)OCCl)OCCl	{17: 3, 2: 5, 3: 1, 22: 3}
OK	38577-26-3	CC1=C[C@H](OC1=O)C[C@@H](C)[C@H]2CC[C@@]3([C@@]2(CC[C@@H]4C3=CC[C@@H]5[C@@]4(CC[C@H](C5(C)C)OC)C)C)C	{1: 8, 2: 1, 3: 1, 11: 7, 12: 5, 13: 4, 14: 2, 15: 2, 22: 1, 28: 1}
OK	38578-20-0	CC(C)(C)OOCC(COC)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1, 22: 3}
OK	38578-21-1	CCOCC(COOC(C)(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1, 22: 3}
OK	38578-22-2	CCCOCC(COOC(C)(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1, 22: 3}
OK	38578-23-3	CCCCOC(C(C)O)OOC(C)(C)C	{1: 5, 2: 3, 3: 2, 4: 1, 20: 1, 22: 3}
OK	38578-50-6	CC(C)(C)OOCC(CO)O	{1: 3, 2: 2, 3: 1, 4: 1, 20: 2, 22: 2}
OK	38578-71-1	CCCCCOCC(COOC(C)(C)C)O	{1: 4, 2: 6, 3: 1, 4: 1, 20: 1, 22: 3}
OK	3858-78-4	CCCCN.Cl	{1: 1, 2: 3, 30: 1, 17: 1}
OK	38584-87-1	CCCCC(CC)C(=O)O.C(CO)N(CCO)CCO	{1: 2, 2: 10, 3: 1, 33: 1, 20: 3, 27: 1}
OK	3859-41-4	C1CC(=O)CC1=O	{25: 2, 11: 3}
OK	38595-73-2	CC(CNCCNCCN)O	{1: 1, 2: 5, 3: 1, 20: 1, 30: 1, 31: 2}
OK	38602-81-2	C1=CN(C=C1)N2C=CC=C2	{33: 2, 14: 8}
OK	38614-09-4	CCC1=CCCO1	{1: 1, 2: 1, 11: 2, 14: 1, 15: 1, 23: 1}
OK	38614-12-9	C/C=C\1/CCCO1	{23: 1, 1: 1, 11: 3, 6: 1, 15: 1}
OK	38614-13-0	C/C=C/1\CCCO1	{23: 1, 1: 1, 11: 3, 6: 1, 15: 1}
OK	38614-14-1	CC(=C1CCCO1)C	{15: 1, 1: 2, 11: 3, 23: 1, 7: 1}
OK	38615-43-9	CCCCNCCCCCCN	{1: 1, 2: 9, 30: 1, 31: 1}
OK	38618-12-1	CCCCCCCCC=CCCCCCCCC(=O)O.CC(CNCC(C)O)O	{1: 3, 2: 16, 3: 2, 6: 2, 20: 2, 27: 1, 31: 1}
OK	38624-62-3	CCOC(=O)C=C(C)Cl	{1: 2, 2: 1, 6: 1, 7: 1, 17: 1, 28: 1}
OK	38628-39-6	C#CCCCCCCCCCC#C	{9: 2, 2: 9, 10: 2}
OK	38661-72-2	C1CC(CC(C1)CN=C=O)CN=C=O	{34: 2, 8: 2, 11: 4, 12: 2, 2: 2, 29: 2}
OK	38667-10-6	CC1(CC(C=C1)(C)C)C	{1: 4, 11: 1, 13: 2, 14: 2}
OK	3867-15-0	C1CCC(CC1)(C#N)N2CCCCC2	{33: 1, 11: 10, 13: 1, 37: 1}
OK	38674-98-5	CCCCCCCCOC(=O)CBr	{1: 1, 2: 8, 28: 1, 18: 1}
OK	38674-99-6	CCCCCCCOC(=O)C(C)Br	{1: 2, 2: 6, 3: 1, 28: 1, 18: 1}
OK	3868-61-9	C1C2C(C(=O)O1)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{11: 1, 12: 2, 13: 3, 15: 2, 17: 6, 28: 1}
OK	38680-06-7	C=C1C2CCC(C1=C)C2=O	{25: 1, 11: 2, 12: 2, 5: 2, 15: 2}
OK	38683-48-6	C(=C(F)F)([C](F)F)F	{16: 5, 7: 3}
OK	38697-07-3	CC(=N)C	{1: 2, 36: 1, 7: 1}
OK	38704-36-8	C/C=C\1/C=CC2C13C(O3)CCN2	{32: 1, 1: 1, 6: 1, 11: 2, 12: 2, 13: 1, 14: 2, 15: 1, 23: 1}
OK	38704-87-9	CC(C)N1CCCN1C(C)C	{11: 3, 1: 4, 3: 2, 33: 2}
OK	38704-89-1	CN1CCCN1C	{1: 2, 11: 3, 33: 2}
OK	38704-92-6	CC1CCCN(N1C)C	{1: 3, 11: 3, 12: 1, 33: 2}
OK	38704-94-8	CC1C=CCN(N1C)C	{1: 3, 11: 1, 12: 1, 14: 2, 33: 2}
OK	38705-10-1	CC12CN3CN(C1)CN(C2)C3	{1: 1, 11: 6, 13: 1, 33: 3}
OK	38711-20-5	CN(C)CC(OC)OC	{1: 4, 2: 1, 3: 1, 22: 2, 33: 1}
OK	38713-13-2	CC(C)CCCC(C)CCCC(C)O	{1: 4, 2: 6, 3: 3, 20: 1}
OK	38732-22-8	C(CC(=O)O)[C@@H](C(=O)O)N.C(CO)N(CCO)CCO	{33: 1, 2: 8, 3: 1, 20: 3, 27: 2, 30: 1}
OK	38734-05-3	C1CCC(=O)CCCCC(=O)C1	{25: 2, 11: 8}
OK	38734-12-2	C1CCCC2(CCCCCCCC3(CCC1)OCCO3)OCCO2	{11: 18, 13: 2, 23: 4}
OK	38738-60-2	CC1=CC(CCC1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	38748-32-2	CC(C)C12C(O1)C3C4(O3)C5(CCC6=C(C5CC7C4(C2O)O7)COC6=O)C	{1: 3, 3: 1, 11: 4, 12: 5, 13: 4, 15: 2, 20: 1, 23: 3, 28: 1}
OK	38748-97-9	CC1(C2C1CC(CC2)(C)O)C	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	3875-51-2	CC(C)C1CCCC1	{11: 4, 1: 2, 3: 1, 12: 1}
OK	38765-94-5	C1=CC=C2C=C3C=CC=CC4=CC(=C1)C2C43	{12: 2, 14: 10, 15: 4}
OK	3877-15-4	CCCSC	{40: 1, 1: 2, 2: 2}
OK	3877-86-9	C[C@@]12C[C@H]([C@@H]([C@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O)C)C)[C@](C)(C(=O)/C=C/C(C)(C)O)O)O	{1: 8, 4: 2, 6: 2, 11: 4, 12: 5, 13: 4, 14: 1, 15: 1, 20: 4, 24: 1, 25: 2}
OK	38772-53-1	CCCC(C)(C)OC	{1: 4, 2: 2, 4: 1, 22: 1}
OK	38775-37-0	C(CCCC(=O)O)CCCC(=O)O.C(CCCN)CCN	{2: 13, 27: 2, 30: 2}
OK	3878-55-5	COC(=O)CCC(=O)O	{1: 1, 2: 2, 27: 1, 28: 1}
OK	38786-33-3	CC(C)(C)N1COCN1C(C)(C)C	{1: 6, 11: 2, 4: 2, 33: 2, 23: 1}
OK	38795-15-2	C1CCC2=CC=CC=C(C1)C2	{11: 5, 14: 4, 15: 2}
OK	38801-41-1	C1C23C14C5=CC=CC=C4C=C2C=CC=CC3=C5	{11: 1, 13: 2, 14: 10, 15: 4}
OK	3882-98-2	C1CSC(=N1)N.Cl	{35: 1, 41: 1, 11: 2, 15: 1, 17: 1, 30: 1}
OK	38821-53-3	CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CCC=CC3)N)SC1)C(=O)O	{1: 1, 3: 1, 33: 1, 41: 1, 11: 3, 12: 2, 14: 3, 15: 3, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
OK	38829-21-9	CCCCO[C@@H](C)OCCC	{1: 3, 2: 5, 3: 1, 22: 2}
OK	3883-58-7	CC1(C(=O)CCC1=O)C	{1: 2, 11: 2, 13: 1, 25: 2}
OK	38836-21-4	CC(C)C(CC(=O)C)O	{24: 1, 1: 3, 2: 1, 3: 2, 20: 1}
OK	3884-71-7	CC(=O)CCCBr	{24: 1, 1: 1, 2: 3, 18: 1}
OK	3886-40-6	C1CSSCCO1	{41: 2, 11: 4, 23: 1}
OK	3886-78-0	CC(=C)[C@H]1CC[C@@](C=C1)(C)O	{1: 2, 5: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 2, 20: 1}
OK	3886-80-4	CCCCCCCCCCCCNC(=O)C	{24: 1, 1: 2, 2: 11, 31: 1}
OK	3886-90-6	CCCCCCCCCCCCCCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 16, 33: 1}
OK	3886-91-7	CCCCCCCCCCCCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 14, 33: 1}
OK	38862-24-7	C=CC(=O)ON1C(=O)CCC1=O	{33: 1, 5: 1, 6: 1, 11: 2, 25: 2, 28: 1}
OK	38867-17-3	C=CCC/C=C/C(=O)O	{2: 2, 27: 1, 5: 1, 6: 3}
OK	3887-13-6	C(C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)O)N	{24: 5, 2: 6, 27: 1, 30: 1, 31: 5}
OK	38870-72-3	C/C(=N/O)/C(C)(C)N	{1: 3, 34: 1, 4: 1, 7: 1, 20: 1, 30: 1}
OK	38870-89-2	COCC(=O)Cl	{24: 1, 1: 1, 2: 1, 22: 1, 17: 1}
OK	38872-36-5	CCCCCC[C@@H](CC(OCC)OCC)OCC	{1: 4, 2: 9, 3: 2, 22: 3}
OK	3889-74-5	C1CC[CH]C1	{11: 4, 14: 1}
OK	38898-39-4	C=C1C2C=CC=CC1C=C2	{12: 2, 5: 1, 14: 6, 15: 1}
OK	38898-42-9	C=C1C2C3C2C4C3C41	{12: 6, 5: 1, 15: 1}
OK	389-36-6	C1(C(C(=O)OC1C(C(=O)O)O)O)O	{27: 1, 20: 3, 3: 1, 12: 3, 28: 1}
OK	3891-29-0	CCCCCCCCCCCCCCCCCCNC(=O)N1CC1	{1: 1, 2: 17, 33: 1, 11: 2, 24: 1, 31: 1}
OK	3891-30-3	CCCCCCCCCCCCCCCCCC(=O)N1CC1	{24: 1, 1: 1, 2: 16, 11: 2, 33: 1}
OK	3891-33-6	C=COCCCCOC=C	{2: 4, 22: 2, 5: 2, 6: 2}
OK	3891-98-3	CCC(C)CCCC(C)CCCC(C)C	{1: 5, 2: 7, 3: 3}
OK	38911-59-0	CC(=C)CCC/C(=C/CC/C(=C/CC(=O)O[C@H]1CCC2C1(CCC3C2CCC4=CC(=O)CCC34)C)/C)/C	{1: 4, 2: 6, 5: 1, 6: 2, 7: 3, 11: 8, 12: 5, 13: 1, 14: 1, 15: 1, 25: 1, 28: 1}
OK	38917-61-2	CC1CN=C2C=CC=C2N1C	{1: 2, 35: 1, 33: 1, 11: 1, 12: 1, 14: 3, 15: 2}
OK	3892-00-0	CCCCCC(C)CCCC(C)CCCC(C)C	{1: 5, 2: 10, 3: 3}
OK	38923-57-8	CC(=O)C(C)(C)C(=O)OC	{24: 1, 1: 4, 4: 1, 28: 1}
OK	38951-66-5	CC(C)C1(C(=O)N(C1=O)C)C(C)C	{1: 5, 33: 1, 3: 2, 13: 1, 25: 2}
OK	38951-83-6	CC1(CC(=O)CC(N1Cl)(C)C)C	{1: 4, 33: 1, 11: 2, 13: 2, 17: 1, 25: 1}
OK	38951-85-8	CC1(C(=O)NC(N1Cl)(C)C)C	{32: 1, 1: 4, 33: 1, 13: 2, 17: 1, 25: 1}
OK	38954-75-5	CCCCCCCCCCCCCCOCC1CO1	{1: 1, 2: 14, 11: 1, 12: 1, 22: 1, 23: 1}
OK	3896-19-3	CC(C)CN=NCC(C)C	{1: 4, 2: 2, 3: 2, 34: 2}
OK	38966-21-1	CC12CCC(C(C1CCC3C24CCC(C(C3)C4)(CO)O)(C)CO)O	{1: 2, 2: 2, 11: 8, 12: 4, 13: 4, 20: 4}
OK	3897-04-9	CC(=O)C(CC=C)C(=O)OC	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 24: 1, 28: 1}
OK	38970-72-8	CC(CC(C)(C)C1CCCCC1)C2CCCCC2	{1: 3, 2: 1, 3: 1, 4: 1, 11: 10, 12: 2}
OK	3899-34-1	C/C=C/C(C)O	{1: 2, 3: 1, 20: 1, 6: 2}
OK	3899-36-3	CC/C=C(\C)/CC	{1: 3, 2: 2, 6: 1, 7: 1}
OK	3899-71-6	C1C(C1(F)F)(F)F	{16: 4, 11: 1, 13: 2}
OK	38992-78-8	C1CCC23CCCCC2(C1)C=C3	{11: 8, 13: 2, 14: 2}
OK	39026-94-3	CCCCCC(C)OC(=O)CCC	{1: 3, 2: 6, 3: 1, 28: 1}
OK	39066-37-0	C1C2C=CC1SC=C2	{41: 1, 11: 1, 12: 2, 14: 4}
OK	39067-39-5	CCCC1C2CC(C1C=O)C=C2	{1: 1, 2: 2, 11: 1, 12: 4, 14: 2, 26: 1}
OK	3907-06-0	CC1(C=C1)C	{1: 2, 13: 1, 14: 2}
OK	39071-30-2	C/C=C(\C)/C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1[C@@]2(C)COC(=O)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C	{1: 6, 2: 2, 6: 1, 7: 1, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	39076-02-3	CCC(C)NC(=O)OC	{1: 3, 2: 1, 3: 1, 28: 1, 31: 1}
OK	39081-91-9	CC(C(=O)C(=O)C(C)Br)Br	{24: 2, 1: 2, 18: 2, 3: 2}
OK	39083-38-0	CC=C(C)C(C)C(C)(C)C	{1: 6, 3: 1, 4: 1, 6: 1, 7: 1}
OK	39083-40-4	CCC(C)(C)CC(=CC)C	{1: 5, 2: 2, 4: 1, 6: 1, 7: 1}
OK	39087-21-3	CCCCC1COC(OC1)C	{1: 2, 2: 3, 11: 2, 12: 2, 23: 2}
OK	39093-27-1	CCCCCCCCCNC	{1: 2, 2: 8, 31: 1}
OK	39098-75-4	C1CCC(CC1)CCC(=O)Cl	{24: 1, 17: 1, 2: 2, 11: 5, 12: 1}
OK	39099-23-5	CCCCNC(C)C	{1: 3, 2: 3, 3: 1, 31: 1}
OK	3910-40-5	CCCCCCC#CC(=O)N	{24: 1, 1: 1, 2: 5, 10: 2, 30: 1}
OK	3910-88-1	CC(=O)CCC1C2(CCCC(C2CCC13CO3)(C)C)C	{1: 4, 2: 2, 11: 6, 12: 2, 13: 3, 23: 1, 24: 1}
OK	39121-37-4	CCC(=O)CC(C)(CC)O	{24: 1, 1: 3, 2: 3, 4: 1, 20: 1}
OK	3913-02-8	CCCCCCC(CCCC)CO	{1: 2, 2: 9, 3: 1, 20: 1}
OK	3913-67-5	C[C@@H](C(=O)O)NC	{27: 1, 1: 2, 3: 1, 31: 1}
OK	3913-81-3	CCCCCCCC=CC=O	{1: 1, 2: 6, 26: 1, 6: 2}
OK	3913-85-7	CCCCCCCC=CC(=O)O	{1: 1, 2: 6, 27: 1, 6: 2}
OK	39130-85-3	C(#CI)C(F)(F)F	{16: 3, 10: 2, 19: 1, 4: 1}
OK	39135-39-2	CC1CCCC(N1N)C	{1: 2, 11: 3, 12: 2, 30: 1, 33: 1}
OK	3915-83-1	CC(C)CC(=O)OC/C=C(\C)/CCC=C(C)C	{1: 5, 2: 4, 3: 1, 6: 2, 7: 2, 28: 1}
OK	3916-64-1	CC=CC=CC(=O)C	{24: 1, 1: 2, 6: 4}
OK	39161-19-8	CC=CCCO	{1: 1, 2: 2, 20: 1, 6: 2}
OK	39168-01-9	C[C@@H]1C[C@@H](OC1)C	{1: 2, 11: 2, 12: 2, 23: 1}
OK	3917-15-5	C=CCOC=C	{2: 1, 22: 1, 5: 2, 6: 2}
OK	3918-94-3	CC(C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)O)N	{1: 4, 3: 4, 24: 1, 27: 1, 30: 1, 31: 1}
OK	39187-47-8	COC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F	{16: 23, 1: 1, 4: 11, 22: 3, 28: 1}
OK	39190-66-4	CCCNCC(C)C	{1: 3, 2: 3, 3: 1, 31: 1}
OK	39190-88-0	CCC(C)NCC(C)C	{1: 4, 2: 2, 3: 2, 31: 1}
OK	39195-82-9	CC(C)(C)C(=NO)CSC	{1: 4, 2: 1, 4: 1, 7: 1, 40: 1, 34: 1, 20: 1}
OK	39196-18-4	CC(C)(C)C(=NOC(=O)NC)CSC	{1: 5, 2: 1, 4: 1, 7: 1, 40: 1, 34: 1, 28: 1, 31: 1}
OK	39197-62-1	CCN=C(N)N[N+](=O)[O-]	{1: 1, 2: 1, 38: 1, 7: 1, 34: 1, 30: 1, 31: 1}
OK	39198-07-7	CCN(C)C(C)C	{1: 4, 2: 1, 3: 1, 33: 1}
OK	39198-34-0	CC(C)(C)CC(C)(C)N=NC(C)(C)CC(C)(C)C	{1: 10, 2: 2, 4: 4, 34: 2}
OK	39198-81-7	CC(C)CN1CCCC1	{11: 4, 1: 2, 2: 1, 3: 1, 33: 1}
OK	39199-12-7	CC(C)(C)C(=O)CSC	{24: 1, 1: 4, 2: 1, 4: 1, 40: 1}
OK	39199-87-6	C1[C@H]([C@@H]1Cl)Cl	{17: 2, 11: 1, 12: 2}
OK	392-63-2	CCN(CC)C(=O)C(C(F)(F)F)F	{1: 2, 2: 2, 3: 1, 4: 1, 33: 1, 16: 4, 24: 1}
OK	3920-12-5	C(C(CCl)O)N	{17: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	3920-53-4	C(CC(CCCO)O)CO	{2: 6, 3: 1, 20: 3}
OK	39201-33-7	C(CC#N)CC(=O)O	{2: 3, 27: 1, 37: 1}
OK	3921-96-8	C1CCN(C1)CCCCN2CCCC2=O.C(=O)(C(=O)O)O	{27: 2, 25: 1, 2: 4, 11: 7, 33: 2}
OK	3921-98-0	CCOCC#CCN1CCCC1	{1: 1, 2: 3, 33: 1, 10: 2, 11: 4, 22: 1}
OK	3921-99-1	CCCN(CCC)CC#CCN1CCCC1=O	{33: 2, 2: 6, 1: 2, 10: 2, 11: 3, 25: 1}
OK	3922-00-7	C1CCN(C1)C/C=C\CN2CCCC2=O	{25: 1, 2: 2, 11: 7, 6: 2, 33: 2}
OK	3922-26-7	CCCCCCC(Cl)(Cl)Cl	{1: 1, 2: 5, 4: 1, 17: 3}
OK	3922-28-9	C(CCCCCCCl)CCCCCCl	{17: 2, 2: 12}
OK	3922-90-5	CC1CC(C(C(O1)OC2C(CC3(CO3)C(=O)C(C(C(C(OC(=O)C(C(C2C)OC4CC(C(C(O4)C)O)OC)C)C)C)O)C)C)O)N(C)C	{1: 11, 33: 1, 11: 4, 12: 17, 13: 1, 20: 3, 22: 3, 23: 3, 25: 1, 28: 1}
OK	39236-46-9	C(NC(=O)NC1C(=O)NC(=O)N1CO)NC(=O)NC2C(=O)NC(=O)N2CO	{32: 2, 33: 2, 2: 3, 12: 2, 20: 2, 24: 2, 25: 4, 31: 4}
OK	39239-93-5	C1COC(OC1)CO	{20: 1, 2: 1, 11: 3, 12: 1, 23: 2}
OK	39239-96-8	CC1(OCCCO1)C(C)(C)O	{1: 3, 4: 1, 11: 3, 13: 1, 20: 1, 23: 2}
OK	39255-32-8	CCCC(C)C(=O)OCC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	39273-81-9	CC(C)C=CCC(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 6: 2}
OK	3934-23-4	CC(=C)C(=O)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 1, 4: 7, 5: 1, 7: 1, 16: 15, 28: 1}
OK	3937-45-9	C[C@H]1CCCC[C@H]1CO	{1: 1, 2: 1, 11: 4, 12: 2, 20: 1}
OK	3937-46-0	C[C@@H]1CCCC[C@H]1CO	{1: 1, 2: 1, 11: 4, 12: 2, 20: 1}
OK	3937-56-2	C(CCCCO)CCCCO	{2: 9, 20: 2}
OK	3937-59-5	CC(CC(C)(C)CC(=O)O)C(=O)O	{27: 2, 1: 3, 2: 2, 3: 1, 4: 1}
OK	3938-95-2	CCOC(=O)C(C)(C)C	{1: 4, 2: 1, 4: 1, 28: 1}
OK	3938-96-3	CCOC(=O)COC	{1: 2, 2: 2, 28: 1, 22: 1}
OK	39432-25-2	[O+](F)F	{16: 2, 22: 1}
OK	39432-81-0	C(F)(F)Cl.C(C(F)(F)Cl)(F)(F)F	{16: 7, 17: 2, 3: 1, 4: 2}
OK	3944-36-3	CC(C)OCC(C)O	{1: 3, 2: 1, 3: 2, 20: 1, 22: 1}
OK	3946-32-5	COC(=O)CCCCCCC(=O)O	{1: 1, 2: 6, 27: 1, 28: 1}
OK	3947-65-7	C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)N)O)O)N	{2: 1, 11: 1, 12: 10, 20: 4, 22: 1, 23: 1, 30: 4}
OK	39473-62-6	C1=CC=CC(C=C1)C2C=CC=CC=C2	{12: 2, 14: 12}
OK	39487-08-6	CCCCCCCCCCCCCC#CCCCCCCCC	{1: 2, 2: 19, 10: 2}
OK	39516-24-0	CCCCCCCCCC(CCO)O	{1: 1, 2: 10, 3: 1, 20: 2}
OK	39516-27-3	CCC(CCCCCCCCCO)O	{1: 1, 2: 10, 3: 1, 20: 2}
OK	39520-24-6	CC(C)CC(C(=O)OC)C(=O)OC	{1: 4, 2: 1, 3: 2, 28: 2}
OK	3953-10-4	CCC(CC)COC(=O)C=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 28: 1}
OK	39536-61-3	CCCCCNCCCC	{1: 2, 2: 7, 31: 1}
OK	3954-13-0	CCCCCN=C=O	{8: 1, 1: 1, 2: 4, 34: 1, 29: 1}
OK	39546-32-2	C1CNCCC1C(=O)N	{24: 1, 32: 1, 11: 4, 12: 1, 30: 1}
OK	39546-80-0	CC(C)(C)C=C1CCCCC1	{1: 3, 11: 5, 4: 1, 6: 1, 15: 1}
OK	39556-37-1	CCCC(=O)OCC(C)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1}
OK	39557-65-8	CCCCNC(=O)CN(CC(=O)NCCCC)CC(=O)NCCCC	{24: 3, 1: 3, 2: 12, 33: 1, 31: 3}
OK	39563-53-6	CCCCCCCCC(C)Br	{1: 2, 2: 7, 3: 1, 18: 1}
OK	39563-54-7	CCCCCCCCCC(C)Br	{1: 2, 2: 8, 3: 1, 18: 1}
OK	39575-21-8	C1CC(C1(F)F)(F)F	{16: 4, 11: 2, 13: 2}
OK	39575-65-0	CC1CC(N=C(O1)C(=C)C)(C)C	{1: 4, 35: 1, 5: 1, 7: 1, 11: 1, 12: 1, 13: 1, 15: 1, 23: 1}
OK	3958-38-1	C1CCC/C=C/CCC1	{11: 7, 14: 2}
OK	3958-66-5	CC(C)[O]	{1: 2, 3: 1, 29: 1}
OK	39583-10-3	CCCCCCCOC(=O)CS	{1: 1, 2: 7, 28: 1, 39: 1}
OK	39594-91-7	SSCl	{40: 1, 17: 1, 39: 1}
OK	39595-61-4	CCC(CC(OCC)OCC)OCC	{1: 4, 2: 5, 3: 2, 22: 3}
OK	39603-53-7	CCCN(CC(C)O)N=O	{1: 2, 2: 3, 3: 1, 33: 1, 34: 1, 20: 1, 29: 1}
OK	39603-54-8	CCCN(CC(=O)C)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 24: 1, 29: 1}
OK	39615-79-7	CNC(=O)N(C)C(=O)CC#N	{1: 2, 2: 1, 37: 1, 33: 1, 24: 2, 31: 1}
OK	39622-53-2	COC(=O)C1=CC2C(O2)C3C1(C3)C(=O)OC	{1: 2, 11: 1, 12: 3, 13: 1, 14: 1, 15: 1, 23: 1, 28: 2}
OK	39633-82-4	C1CCN(CC1)C2(CCNCC2)C(=O)N	{32: 1, 33: 1, 11: 9, 13: 1, 24: 1, 30: 1}
OK	39638-32-9	CC(C)(OC(C)(C)Cl)Cl	{1: 4, 4: 2, 22: 1, 17: 2}
OK	39638-67-0	CCCC[C@@H]1[C@H](CC(=O)O1)C	{1: 2, 2: 3, 11: 1, 12: 2, 28: 1}
OK	3964-18-9	CC(C)(C(C)(C)[N+](=O)[O-])[N+](=O)[O-]	{1: 4, 4: 2, 38: 2}
OK	3964-66-7	CCCCCCC1=CCCCC1	{1: 1, 2: 5, 11: 4, 14: 1, 15: 1}
OK	3965-59-1	CCC(C)CC(C)CO	{1: 3, 2: 3, 3: 2, 20: 1}
OK	39664-33-0	CC(=C)C(=O)OC1CCC(CC1)C(C)(C)C2CCC(CC2)OC(=O)C(=C)C	{1: 4, 4: 1, 5: 2, 7: 2, 11: 8, 12: 4, 28: 2}
OK	39668-82-1	CC1CCC(C(C1)C(=O)NC(C)(C)C)C(C)C	{1: 6, 3: 1, 4: 1, 11: 3, 12: 3, 24: 1, 31: 1}
OK	39668-87-6	CC1CCC(C(C1)C(=O)Cl)C(C)C	{1: 3, 3: 1, 11: 3, 12: 3, 17: 1, 24: 1}
OK	3969-84-4	CC1(O[C@@H]([C@H](O1)[C@@H](CO)O)[C@@H](CO)O)C	{1: 2, 2: 2, 3: 2, 12: 2, 13: 1, 20: 4, 23: 2}
OK	3970-21-6	COCCOCCl	{1: 1, 2: 3, 22: 2, 17: 1}
OK	3970-59-0	CCC(C(C)C)(C(C)C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	3970-60-3	CC(C)CC(C(C)(C)C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	3970-62-5	CCC(C(C)(C)C)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1}
OK	39707-47-6	CC(=CCCC(C)(C=C)S)C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 2, 7: 1, 39: 1}
OK	3971-28-6	C1CC(CC(C1)CO)CO	{20: 2, 2: 2, 11: 4, 12: 2}
OK	3971-31-1	C1CC(CC(C1)C(=O)O)C(=O)O	{27: 2, 11: 4, 12: 2}
OK	3971-33-3	CCC(CCCCCC(=O)O)C(=O)O	{27: 2, 1: 1, 2: 6, 3: 1}
OK	39711-79-0	CCNC(=O)C1CC(CCC1C(C)C)C	{1: 4, 2: 1, 3: 1, 11: 3, 12: 3, 24: 1, 31: 1}
OK	39716-58-0	C=CCCC(=O)Cl	{24: 1, 17: 1, 2: 2, 5: 1, 6: 1}
OK	3973-70-4	C1CN(CCN1CCO)N	{33: 2, 2: 2, 11: 4, 20: 1, 30: 1}
OK	3974-36-5	CCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 5, 3: 1}
OK	3974-99-0	CC(C)OC(=O)C(Cl)(Cl)Cl	{1: 2, 3: 1, 4: 1, 28: 1, 17: 3}
OK	3975-08-4	CCOC(C#CC(OCC)OCC)OCC	{1: 4, 2: 4, 3: 2, 10: 2, 22: 4}
OK	3975-10-8	CCOC(C=CC=CC(OCC)OCC)OCC	{1: 4, 2: 4, 3: 2, 22: 4, 6: 4}
OK	39751-07-0	C1C2CC3CC(C2=O)CC1C3=O	{25: 2, 11: 4, 12: 4}
OK	39753-73-6	CC1=NC(N(C1(C)C)O)(C)C	{1: 5, 35: 1, 33: 1, 13: 2, 15: 1, 20: 1}
OK	39753-74-7	CC1C(N(C(N1)(C)C)O)(C)C	{32: 1, 1: 5, 33: 1, 12: 1, 13: 2, 20: 1}
OK	3976-69-0	C[C@H](CC(=O)OC)O	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	39761-64-3	C/C=C(/C)\C(C)(C)C	{1: 5, 4: 1, 6: 1, 7: 1}
OK	39761-68-7	CC(=CC(C)(C)CC(C)(C)C)C	{1: 7, 2: 1, 4: 2, 6: 1, 7: 1}
OK	39765-80-5	[C@@H]12[C@@H]([C@H](C([C@H]1Cl)Cl)Cl)[C@]3(C(=C([C@@]2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{17: 9, 12: 5, 13: 3, 15: 2}
OK	39781-76-5	C1CC2C1C3C2C=C3	{11: 2, 12: 4, 14: 2}
OK	39782-38-2	CC(C)CCOC=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 22: 1}
OK	39801-14-4	C12C3(C4(C5(C3(C(C1(C5(C2(C4(Cl)Cl)Cl)Cl)Cl)(Cl)Cl)Cl)Cl)Cl)Cl	{17: 11, 12: 1, 13: 9}
OK	39819-74-4	COC1CCC=C1	{1: 1, 11: 2, 12: 1, 22: 1, 14: 2}
OK	39825-93-9	CCCCCCCCCCCCCCCCCCC(CO)O	{1: 1, 2: 18, 3: 1, 20: 2}
OK	3983-03-7	CC(C)CC1=CCCCC1	{1: 2, 2: 1, 3: 1, 11: 4, 14: 1, 15: 1}
OK	3983-06-0	CCCC1CCCC=C1	{1: 1, 2: 2, 11: 3, 12: 1, 14: 2}
OK	3983-07-1	CCCCC1CCCC=C1	{1: 1, 2: 3, 11: 3, 12: 1, 14: 2}
OK	3984-22-3	C=CC1OCCO1	{11: 2, 12: 1, 5: 1, 6: 1, 23: 2}
OK	39846-66-7	CCCCCC(COC(=O)C)O	{1: 2, 2: 5, 3: 1, 20: 1, 28: 1}
OK	39848-57-2	COCC1C(C(C(O1)N2C=CC(=O)NC2=O)OC)OC	{32: 1, 1: 3, 2: 1, 33: 1, 12: 4, 14: 2, 22: 3, 23: 1, 25: 2}
OK	39863-20-2	C1C2C=CC1C(=C2)C#N	{11: 1, 12: 2, 37: 1, 14: 3, 15: 1}
OK	39874-62-9	CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)(COC(=O)CCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCCC	{1: 3, 2: 46, 4: 1, 6: 6, 20: 1, 28: 3}
OK	39884-48-5	CC(CCN)O	{1: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	39884-52-1	C1COCN1N=O	{33: 1, 34: 1, 11: 3, 29: 1, 23: 1}
OK	39884-53-2	CC1N(CCO1)N=O	{1: 1, 34: 1, 33: 1, 11: 2, 12: 1, 23: 1, 29: 1}
OK	39885-14-8	CN(COC)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 22: 1, 29: 1}
OK	3989-97-7	CC(C)C[C@@H](C(=O)O)NC(=O)[C@@H](C(C)C)N	{1: 4, 2: 1, 3: 4, 24: 1, 27: 1, 30: 1, 31: 1}
OK	39890-42-1	CC(C)NC(=O)CN1CCNCC1	{32: 1, 1: 2, 2: 1, 3: 1, 33: 1, 11: 4, 24: 1, 31: 1}
OK	39896-06-5	C1CN2CCC1CC2.Cl	{17: 1, 11: 6, 12: 1, 33: 1}
OK	399-92-8	CCOC(=O)C(C(F)(F)F)F	{1: 1, 2: 1, 3: 1, 4: 1, 16: 4, 28: 1}
OK	3990-03-2	CCOC(=O)/C=C\C(=O)O	{1: 1, 2: 1, 27: 1, 28: 1, 6: 2}
OK	39900-18-0	C/C=C/C(=O)[C@@H]1[C@@H](CCCC1(C)C)C	{1: 4, 6: 2, 11: 3, 12: 2, 13: 1, 24: 1}
OK	39920-56-4	CCCCC(CCOC(=O)C)O	{1: 2, 2: 5, 3: 1, 20: 1, 28: 1}
OK	39924-52-2	CCC=CCC1C(CCC1=O)CC(=O)OC	{1: 2, 2: 3, 6: 2, 11: 2, 12: 2, 25: 1, 28: 1}
OK	39926-11-9	CCOC(=O)C1CC2CCN1CC2	{1: 1, 2: 1, 33: 1, 11: 5, 12: 2, 28: 1}
OK	39928-72-8	C1CC(=O)OC1CCl	{17: 1, 2: 1, 11: 2, 12: 1, 28: 1}
OK	3993-62-2	C1CC2(CCC1(N=N2)Cl)Cl	{17: 2, 11: 4, 13: 2, 35: 2}
OK	39968-66-6	CC(=C)C(=C=C)C	{8: 1, 1: 2, 5: 2, 7: 2}
OK	39972-78-6	CC(C)(C)OOCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 22: 2}
OK	39979-46-9	CC(CCN1C(=O)C=CC1=O)CC(C)(C)CN2C(=O)C=CC2=O	{1: 3, 2: 4, 3: 1, 4: 1, 33: 2, 14: 4, 25: 4}
OK	39986-37-3	CC1=NC(CO1)(C)CO	{1: 2, 2: 1, 35: 1, 11: 1, 13: 1, 15: 1, 20: 1, 23: 1}
OK	3999-55-1	CCOC(=O)[C@@H]1C[C@H]1C(=O)OCC	{1: 2, 2: 2, 11: 1, 12: 2, 28: 2}
OK	39992-90-0	C[C@@]1(C[C@@H](CC(C1)(C)C)NC(=O)N(C)C)CNC(=O)N(C)C	{1: 7, 2: 1, 33: 2, 11: 3, 12: 1, 13: 2, 24: 2, 31: 2}
OK	39998-21-5	CN\1C=CC=C/C1=C\C(=O)OC	{1: 2, 6: 1, 33: 1, 14: 4, 15: 1, 28: 1}
OK	39998-22-6	CN1C=CC(=CC(=O)OC)C=C1	{1: 2, 6: 1, 33: 1, 14: 4, 15: 1, 28: 1}
OK	39998-23-7	CN1C=CCC(=C1)CC(=O)OC	{1: 2, 2: 1, 33: 1, 11: 1, 14: 3, 15: 1, 28: 1}
OK	400-38-4	CC(C)OC(=O)C(F)(F)F	{16: 3, 1: 2, 3: 1, 4: 1, 28: 1}
OK	400-44-2	C(=C(C(F)(F)F)Cl)C(F)(F)F	{16: 6, 17: 1, 4: 2, 6: 1, 7: 1}
OK	400-52-2	CC(C)(C)OC(=O)C(F)(F)F	{16: 3, 1: 3, 4: 2, 28: 1}
OK	400-54-4	CCC(=O)CC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 2, 4: 1, 24: 2}
OK	400-57-7	CCCCCCCCCCCCCCCCCCOC(=O)C(C(C(F)(F)F)(F)F)(F)F	{16: 7, 1: 1, 2: 17, 4: 3, 28: 1}
OK	400-58-8	C(C(=O)NCC(=O)O)NC(=O)C(F)(F)F	{2: 2, 4: 1, 16: 3, 24: 2, 27: 1, 31: 2}
OK	400-59-9	CCCCNC(=O)C(F)(F)F	{1: 1, 2: 3, 4: 1, 16: 3, 24: 1, 31: 1}
OK	40006-83-5	C/C(=C\C(=[NH+]CC[NH+]=C(/C=C(/S)\C)C)C)/S	{1: 4, 2: 2, 6: 2, 39: 2, 7: 4, 31: 2}
OK	40010-99-9	CCCCC1CC(C(=O)O1)C(=O)C	{1: 2, 2: 3, 11: 1, 12: 2, 24: 1, 28: 1}
OK	40015-15-4	COC(CSC)OC	{40: 1, 1: 3, 2: 1, 3: 1, 22: 2}
OK	40018-26-6	C1C(SCC(S1)O)O	{20: 2, 11: 2, 12: 2, 41: 2}
OK	40020-13-1	C#CC1C(O1)C#C	{9: 2, 10: 2, 12: 2, 23: 1}
OK	40027-38-1	CCCCCCCCC=CCCCCCCCCNCCCN.CCCCCCCCC=CCCCCCCCC(=O)O	{1: 2, 2: 32, 6: 4, 27: 1, 30: 1, 31: 1}
OK	40031-31-0	C(C(C(=O)CO)O)O	{24: 1, 2: 2, 3: 1, 20: 3}
OK	40052-13-9	CC(C)(C)OC(=O)CC(=O)O	{1: 3, 2: 1, 27: 1, 4: 1, 28: 1}
OK	40058-87-5	CC(C)OC(=O)C(C)Cl	{1: 3, 3: 2, 28: 1, 17: 1}
OK	40071-70-3	C[C@H](CCCC(C)C)[C@H]1CC[C@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C	{1: 5, 2: 3, 3: 2, 11: 10, 12: 5, 13: 2}
OK	40079-14-9	C=C1CO1	{23: 1, 11: 1, 5: 1, 15: 1}
OK	401-55-8	CCOC(=O)C(F)Br	{1: 1, 2: 1, 3: 1, 16: 1, 18: 1, 28: 1}
OK	401-56-9	CCOC(=O)C(F)Cl	{1: 1, 2: 1, 3: 1, 16: 1, 17: 1, 28: 1}
OK	401-75-2	C1CCC(CC1)C(F)(F)F	{16: 3, 12: 1, 11: 5, 4: 1}
OK	40100-16-1	C=S=O	{40: 1, 5: 1, 29: 1}
OK	40117-13-3	C=C1C2CCC2C1=C	{11: 2, 12: 2, 5: 2, 15: 2}
OK	40117-45-1	CC(C)(C)CCCC(C)(C)C	{1: 6, 2: 3, 4: 2}
OK	4013-94-9	CC(C)NCCNC(C)C	{1: 4, 2: 2, 3: 2, 31: 2}
OK	4013-95-0	CCCCNCCNCCCC	{1: 2, 2: 8, 31: 2}
OK	40137-02-8	CC(C)(C)NC(C)(C)C=C	{1: 5, 4: 2, 5: 1, 6: 1, 31: 1}
OK	40137-22-2	CNCC(CO)O	{1: 1, 2: 2, 3: 1, 20: 2, 31: 1}
OK	40137-60-8	CC(C)COCC(C)OC(=O)CCl	{1: 3, 2: 3, 3: 2, 17: 1, 22: 1, 28: 1}
OK	40149-67-5	COC(=O)CC(C(=O)OC)N	{1: 2, 2: 1, 3: 1, 28: 2, 30: 1}
OK	4015-18-3	CC(=O)[C@H]1C[C@H](C1(C)C)CC#N	{1: 3, 2: 1, 37: 1, 11: 1, 12: 2, 13: 1, 24: 1}
OK	4016-11-9	CCOCC1CO1	{1: 1, 2: 2, 11: 1, 12: 1, 22: 1, 23: 1}
OK	4016-14-2	CC(C)OCC1CO1	{1: 2, 2: 1, 3: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	40164-27-0	C1CC2CC=CC(C1)O2	{11: 4, 12: 2, 14: 2, 23: 1}
OK	4017-56-5	CCOC(=O)C1CCCCCCC1=O	{1: 1, 2: 1, 11: 6, 12: 1, 25: 1, 28: 1}
OK	4017-64-5	CC1(C2CCC(C2)(C1=C)Cl)C	{1: 2, 5: 1, 11: 3, 12: 1, 13: 2, 15: 1, 17: 1}
OK	40175-06-2	CCOC(=O)C1=CCN(CC1)C	{1: 2, 2: 1, 33: 1, 11: 3, 14: 1, 15: 1, 28: 1}
OK	40200-18-8	CC(=O)OCCCCCCCl	{1: 1, 2: 6, 28: 1, 17: 1}
OK	40201-91-0	CC#CC#CI	{1: 1, 10: 4, 19: 1}
OK	40201-94-3	CC#CC#CBr	{1: 1, 10: 4, 18: 1}
OK	40203-74-5	COC(=O)C=C1CCCCC1	{1: 1, 11: 5, 28: 1, 6: 1, 15: 1}
OK	4021-75-4	CC(C(CO)Br)Br	{1: 1, 2: 1, 3: 2, 20: 1, 18: 2}
OK	40219-42-9	CC1(CC2=C(CC(S1)(C)C)C3=C2CC(SC(C3)(C)C)(C)C)C	{1: 8, 41: 2, 11: 4, 13: 4, 15: 4}
OK	40220-08-4	C=CC(=O)OCCN1C(=O)N(C(=O)N(C1=O)CCOC(=O)C=C)CCOC(=O)C=C	{33: 3, 2: 6, 5: 3, 6: 3, 25: 3, 28: 3}
OK	40225-75-0	CCC(C)CCC(CC)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	4023-34-1	C1CC1C(=O)Cl	{24: 1, 17: 1, 11: 2, 12: 1}
OK	4023-65-8	C(C(=CC(=O)O)C(=O)O)C(=O)O	{2: 1, 27: 3, 6: 1, 7: 1}
OK	40235-68-5	CC(=O)OCC(=O)CCl	{24: 1, 1: 1, 2: 2, 28: 1, 17: 1}
OK	40238-93-5	CCC(CC)CCC(=O)C	{24: 1, 1: 3, 2: 4, 3: 1}
OK	40239-35-8	CCCCCCCCCCC(=O)C(C)C	{24: 1, 1: 3, 2: 9, 3: 1}
OK	4024-81-1	C1(=C(C(C(C(C1=O)(Cl)Cl)(Cl)Cl)(Cl)Cl)Cl)Cl	{17: 8, 25: 1, 13: 3, 15: 2}
OK	40248-63-3	CC1CCC(C(C1)OCC(=O)O)C(C)C	{1: 3, 2: 1, 3: 1, 11: 3, 12: 3, 22: 1, 27: 1}
OK	4026-18-0	CC(C)C(C(=O)O)O	{27: 1, 1: 2, 3: 2, 20: 1}
OK	4026-20-4	CC(C)(C)C(C(=O)O)O	{27: 1, 1: 3, 3: 1, 4: 1, 20: 1}
OK	40267-53-6	CCN(CC)CC=C(C)CCC=C(C)C	{1: 5, 2: 5, 33: 1, 6: 2, 7: 2}
OK	40267-72-9	CCOCC=C(C)CCC=C(C)C	{1: 4, 2: 4, 22: 1, 6: 2, 7: 2}
OK	40276-93-5	CCCC(C)C#C	{1: 2, 2: 2, 3: 1, 10: 1, 9: 1}
OK	4028-15-3	C1CCC(CC1)([N+](=O)[O-])[N+](=O)[O-]	{11: 5, 13: 1, 38: 2}
OK	40283-91-8	C[C@@H]1CC2C3CCC4=CC(=O)C=CC4([C@]3(C(CC2(C1C(=O)CO)C)O)F)C	{1: 3, 2: 1, 11: 4, 12: 5, 13: 3, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1}
OK	40284-08-0	C1C2CC3CC1CC(C2)C3N=C(CS)N.Cl	{2: 1, 7: 1, 11: 5, 12: 5, 34: 1, 17: 1, 39: 1, 30: 1}
OK	40284-10-4	C1C2CC3CC1CC(C2)(C3)CCCN=C(CS)N.Cl	{2: 4, 34: 1, 7: 1, 11: 6, 12: 3, 13: 1, 17: 1, 39: 1, 30: 1}
OK	40289-98-3	CCCCCCCCCCCCCCCCCCSC	{40: 1, 1: 2, 2: 17}
OK	4030-18-6	CC(=O)N1CCCC1	{24: 1, 1: 1, 11: 4, 33: 1}
OK	40317-63-3	COC(=O)C12C3C4C1C5C2C3C5C4	{1: 1, 11: 1, 12: 7, 13: 1, 28: 1}
OK	40319-81-1	C1CC2CCC1CC=C2	{11: 5, 12: 2, 14: 2}
OK	4032-86-4	CCCCC(C)(C)CC	{1: 4, 2: 4, 4: 1}
OK	4032-92-2	CCCC(C)(C)CC(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	4032-93-3	CC(C)CCC(C)C(C)C	{1: 5, 2: 2, 3: 3}
OK	4032-94-4	CCCCC(C)CC(C)C	{1: 4, 2: 4, 3: 2}
OK	40325-00-6	C(C([N+](=O)[O-])([N+](=O)[O-])F)N(CC([N+](=O)[O-])([N+](=O)[O-])F)C(=O)OCC([N+](=O)[O-])([N+](=O)[O-])F	{33: 1, 2: 3, 4: 3, 38: 6, 16: 3, 28: 1}
OK	40327-96-6	CC1(CC(CC(N1C)(C)C)N)C	{1: 5, 33: 1, 11: 2, 12: 1, 13: 2, 30: 1}
OK	4033-46-9	C(CSC[C@@H](C(=O)O)N)C(=O)O	{27: 2, 40: 1, 2: 3, 3: 1, 30: 1}
OK	40331-44-0	CC#CC#CCl	{1: 1, 10: 4, 17: 1}
OK	40348-72-9	CC(C)CC(C(=O)OC)O	{1: 3, 2: 1, 3: 2, 20: 1, 28: 1}
OK	4035-89-6	C(CCCN=C=O)CCNC(=O)N(CCCCCCN=C=O)C(=O)NCCCCCCN=C=O	{33: 1, 2: 18, 8: 3, 34: 3, 24: 2, 29: 3, 31: 2}
OK	40364-80-5	C(C(CO)C=O)O	{2: 2, 3: 1, 20: 2, 26: 1}
OK	40365-61-5	C#CCCOC1CCCCO1	{2: 2, 9: 1, 10: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	40369-62-8	C1=COC=COC=CO1	{14: 6, 23: 3}
OK	40371-51-5	C(CN)[C@@H](C(=O)O)O	{27: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	4038-04-4	CCC(CC)C=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1}
OK	4038-90-8	COC(=O)CCN1CCN(CC1)CCC(=O)OC	{1: 2, 2: 4, 11: 4, 28: 2, 33: 2}
OK	40391-49-9	CC12CCCC3C1C23	{1: 1, 11: 3, 12: 3, 13: 1}
OK	4040-54-4	CCCCCCCCCCCCCCCCCC(=O)NCCNCCNCCNCCN	{24: 1, 1: 1, 2: 24, 30: 1, 31: 4}
OK	4041-09-2	CC1CCC(C1=O)C	{1: 2, 11: 2, 12: 2, 25: 1}
OK	4042-36-8	C1CC(=O)N[C@H]1C(=O)O	{27: 1, 25: 1, 11: 2, 12: 1, 32: 1}
OK	40420-22-2	CCOC(=O)CCCC(=O)CC(=O)OCC	{24: 1, 1: 2, 2: 6, 28: 2}
OK	4043-59-8	CCOCC(COCC)O	{1: 2, 2: 4, 3: 1, 20: 1, 22: 2}
OK	4043-88-3	C1C=C[C@H](N1)C(=O)O	{27: 1, 32: 1, 11: 1, 12: 1, 14: 2}
OK	40430-32-8	CC1=C(C2(CC2(C1=C)C)C)C	{15: 3, 1: 4, 11: 1, 5: 1, 13: 2}
OK	4045-30-1	CC1(CCNCC1)C	{32: 1, 1: 2, 11: 4, 13: 1}
OK	4045-44-7	CC1C(=C(C(=C1C)C)C)C	{1: 5, 12: 1, 15: 4}
OK	40454-19-1	CC(CCCC(C)(C)OC)C1CO1	{1: 4, 2: 3, 3: 1, 4: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	40454-29-3	CCC(=C)C#CC(C)(CC)O	{1: 3, 2: 2, 4: 1, 5: 1, 7: 1, 10: 2, 20: 1}
OK	40469-16-7	CC1C=CCC(C1C(=O)O)C(=O)O	{27: 2, 1: 1, 11: 1, 12: 3, 14: 2}
OK	40479-48-9	CCOC(=O)CN1CCN(CC1)CC(=O)OCC	{1: 2, 2: 4, 11: 4, 28: 2, 33: 2}
OK	4048-32-2	CC(CCC=C)CCO	{1: 1, 2: 4, 3: 1, 5: 1, 6: 1, 20: 1}
OK	4048-33-3	C(CCCO)CCN	{2: 6, 20: 1, 30: 1}
OK	40480-10-2	CCCCCCCCCCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 15, 17: 1}
OK	40481-98-9	C1C[C@H]([C@H](C1)O)C(=O)N	{24: 1, 20: 1, 11: 3, 12: 2, 30: 1}
OK	40488-88-8	C1CC2CC1C3C2C4CC3CC4=O	{25: 1, 11: 5, 12: 6}
OK	40488-97-9	C(C([N+](=O)[O-])([N+](=O)[O-])F)N(CC([N+](=O)[O-])([N+](=O)[O-])F)C(=O)C(=O)N	{33: 1, 2: 2, 4: 2, 38: 4, 16: 2, 24: 2, 30: 1}
OK	4049-81-4	CC(=C)CCC=C	{1: 1, 2: 2, 5: 2, 6: 1, 7: 1}
OK	40499-83-0	C1CNCC1O	{32: 1, 20: 1, 11: 3, 12: 1}
OK	4050-45-7	CCCC=CC	{1: 2, 2: 2, 6: 2}
OK	4051-27-8	C1C(O1)CC2CO2	{2: 1, 11: 2, 12: 2, 23: 2}
OK	40520-10-3	CCCCCCCCCCOC(=O)C(C)(C)C[C@H](C)CC(=O)OCCCCCCCC	{1: 5, 2: 18, 3: 1, 4: 1, 28: 2}
OK	40538-81-6	CN(C)CCNCCN(C)C	{1: 4, 2: 4, 33: 2, 31: 1}
OK	4054-38-0	C1CC=CC=CC1	{11: 3, 14: 4}
OK	40541-41-1	CC(C)CCC1CCOC1=O	{1: 2, 2: 2, 3: 1, 11: 2, 12: 1, 28: 1}
OK	40548-68-3	C1CCON(C1)N=O	{33: 1, 34: 1, 11: 4, 29: 1, 23: 1}
OK	4055-39-4	CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)OC)N4)OC	{32: 1, 1: 3, 2: 1, 33: 1, 11: 1, 12: 3, 13: 1, 15: 4, 22: 2, 25: 2, 28: 1, 30: 1}
OK	4055-40-7	CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@H]2COC(=O)N)O)N4C)OC	{1: 3, 2: 1, 33: 2, 11: 1, 12: 3, 13: 1, 15: 4, 20: 1, 22: 1, 25: 2, 28: 1, 30: 1}
OK	40553-10-4	CCCOC(=O)C=C(C)S	{1: 2, 2: 2, 6: 1, 39: 1, 7: 1, 28: 1}
OK	4056-73-9	CC(=O)C1C(=O)CCCC1=O	{24: 1, 1: 1, 11: 3, 12: 1, 25: 2}
OK	4056-78-4	C1CC(CC1C(=O)O)C(=O)O	{27: 2, 11: 3, 12: 2}
OK	40560-29-0	CC[C@H](C)CCl	{1: 2, 2: 2, 3: 1, 17: 1}
OK	40564-00-9	CCCCCCC=CC(OCC)OCC	{1: 3, 2: 7, 3: 1, 22: 2, 6: 2}
OK	4057-42-5	CCC(C)CCC=C(C)C	{1: 4, 2: 3, 3: 1, 6: 1, 7: 1}
OK	40571-45-7	CC1(CCCC1)N	{1: 1, 11: 4, 13: 1, 30: 1}
OK	40575-41-5	CCCCC(CC(C)C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	40575-42-6	CCCCC(CC=C)O	{1: 1, 2: 4, 3: 1, 5: 1, 6: 1, 20: 1}
OK	40576-21-4	C1CCN(CC1)C(=O)C2CCCNC2	{24: 1, 32: 1, 11: 9, 12: 1, 33: 1}
OK	40576-23-6	CN1CCCC(C1)C(=O)N2CCCCC2	{24: 1, 1: 1, 11: 9, 12: 1, 33: 2}
OK	40580-89-0	C1CCCCCCN(CCCCC1)N=O	{33: 1, 34: 1, 11: 12, 29: 1}
OK	40589-14-8	CCCCCCCC(C)CO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	40589-39-7	C=CC#CI	{10: 2, 19: 1, 5: 1, 6: 1}
OK	40596-44-9	CC(=O)OCCCCI	{1: 1, 2: 4, 19: 1, 28: 1}
OK	40596-46-1	CCCCCCCCCCC(CCCCCCCC)C(=O)O	{27: 1, 1: 2, 2: 16, 3: 1}
OK	40596-69-8	CC(C)OC(=O)C=C(C)C=CCC(C)CCCC(C)(C)OC	{1: 7, 2: 4, 3: 2, 4: 1, 6: 3, 7: 1, 22: 1, 28: 1}
OK	406-11-1	C(C(F)(F)F)NC(=O)NCC(F)(F)F	{16: 6, 24: 1, 2: 2, 4: 2, 31: 2}
OK	406-20-2	COC(=O)CCCF	{16: 1, 1: 1, 2: 3, 28: 1}
OK	406-34-8	C(CF)N	{16: 1, 2: 2, 30: 1}
OK	406-46-2	C(=C(F)F)C(F)(F)Cl	{16: 4, 17: 1, 4: 1, 6: 1, 7: 1}
OK	406-49-5	CC(C)CC(F)(F)F	{16: 3, 1: 2, 2: 1, 3: 1, 4: 1}
OK	406-58-6	CC(CC(F)(F)F)(F)F	{16: 5, 1: 1, 2: 1, 4: 2}
OK	406-81-5	C(CC(F)(F)F)CBr	{16: 3, 2: 3, 4: 1, 18: 1}
OK	406-82-6	CCCCC(F)(F)F	{16: 3, 1: 1, 2: 3, 4: 1}
OK	406-90-6	C=COCC(F)(F)F	{2: 1, 4: 1, 5: 1, 6: 1, 16: 3, 22: 1}
OK	406-93-9	C(CC(F)(F)F)C(=O)O	{16: 3, 2: 2, 27: 1, 4: 1}
OK	406-95-1	CC(=O)OCC(F)(F)F	{16: 3, 1: 1, 2: 1, 4: 1, 28: 1}
OK	40605-42-3	CC(=CCO)Cl	{1: 1, 2: 1, 6: 1, 7: 1, 17: 1, 20: 1}
OK	40613-93-2	CN(C)[NH]	{1: 2, 36: 1, 33: 1}
OK	40619-38-3	CCCC1COCCC1Br	{1: 1, 2: 2, 11: 3, 12: 2, 18: 1, 23: 1}
OK	4062-60-6	CC(C)(C)NCCNC(C)(C)C	{1: 6, 2: 2, 4: 2, 31: 2}
OK	40626-78-6	CCCC[C](C)C	{1: 3, 2: 3, 7: 1}
OK	40630-82-8	CC(C)(C(=O)OCC=C)Br	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 18: 1, 28: 1}
OK	40635-66-3	CC(=O)OC(C)(C)C(=O)Cl	{24: 1, 1: 3, 4: 1, 28: 1, 17: 1}
OK	40635-67-4	CC(=O)OC(C)(C)C(=O)Br	{24: 1, 1: 3, 18: 1, 4: 1, 28: 1}
OK	40637-56-7	COC(=O)C(CC=C)C(=O)OC	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 28: 2}
OK	4064-06-6	CC1(OC2C(OC3C(C2O1)OC(O3)(C)C)CO)C	{1: 4, 2: 1, 12: 5, 13: 2, 20: 1, 23: 5}
OK	40642-38-4	CCCCCCC=CCCCCO	{1: 1, 2: 9, 20: 1, 6: 2}
OK	40642-40-8	CCCC=CCCCCCCCO	{1: 1, 2: 9, 20: 1, 6: 2}
OK	40642-42-0	CCCCCCCCC=CCCCCO	{1: 1, 2: 11, 20: 1, 6: 2}
OK	40645-89-4	C(CCl)C(=O)NC(=O)CCCl	{24: 2, 17: 2, 2: 4, 31: 1}
OK	40648-08-6	CC1=C(CCCC1)I	{19: 1, 1: 1, 11: 4, 15: 2}
OK	40648-10-0	CC1CCCC=C1I	{1: 1, 11: 3, 12: 1, 14: 1, 15: 1, 19: 1}
OK	40649-36-3	CCCC1CCC(=O)CC1	{1: 1, 2: 2, 11: 4, 12: 1, 25: 1}
OK	4065-80-9	C=C1CCCCC1O	{20: 1, 11: 4, 12: 1, 5: 1, 15: 1}
OK	4067-16-7	C(CNCCNCCNCCNCCN)N	{2: 10, 30: 2, 31: 4}
OK	40677-77-8	CCCCCCCCC=CCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 34, 28: 2, 6: 4}
OK	40696-41-1	C(C(=O)COCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F	{2: 4, 4: 2, 38: 4, 16: 2, 22: 2, 24: 1}
OK	407-01-2	C(C(F)(F)F)NCC(F)(F)F	{16: 6, 2: 2, 4: 2, 31: 1}
OK	407-06-7	CC(C)CCF	{16: 1, 1: 2, 2: 2, 3: 1}
OK	407-24-9	C(=O)(C(F)(F)F)NC(=O)C(F)(F)F	{16: 6, 24: 2, 4: 2, 31: 1}
OK	407-38-5	C(C(F)(F)F)OC(=O)C(F)(F)F	{16: 6, 28: 1, 2: 1, 4: 2}
OK	407-47-6	C=CC(=O)OCC(F)(F)F	{2: 1, 4: 1, 5: 1, 6: 1, 16: 3, 28: 1}
OK	407-70-5	C(=C(F)F)C=C(F)F	{16: 4, 6: 2, 7: 2}
OK	407-79-4	C=CCCCF	{16: 1, 2: 3, 5: 1, 6: 1}
OK	407-83-0	C(CC#N)CF	{16: 1, 2: 3, 37: 1}
OK	407-96-5	CCCCCCC(F)F	{16: 2, 1: 1, 2: 5, 3: 1}
OK	407-97-6	C(CCF)CCBr	{16: 1, 2: 5, 18: 1}
OK	407-99-8	C(CN=C=O)CF	{8: 1, 16: 1, 2: 3, 34: 1, 29: 1}
OK	40702-26-9	CC1=C(CC(CC1)(C)C=O)C	{1: 3, 26: 1, 11: 3, 13: 1, 15: 2}
OK	40711-15-7	CC1(NN1C)C	{32: 1, 1: 3, 13: 1, 33: 1}
OK	40711-41-9	CCCCNN.C(=O)(C(=O)O)O	{1: 1, 2: 3, 27: 2, 30: 1, 31: 1}
OK	40713-31-3	C[C@@H]1C[C@@H](C[C@@H](C12CC[C@H](C2)C(=C)C)C=O)O	{1: 2, 5: 1, 7: 1, 11: 5, 12: 4, 13: 1, 20: 1, 26: 1}
OK	40716-31-2	C/C=C/OC=C(C)C	{1: 3, 22: 1, 6: 3, 7: 1}
OK	40716-42-5	CCCCCC[C@H](C/C=C\CCCCCCCC(=O)N(CCO)CCO)O	{1: 1, 2: 17, 3: 1, 6: 2, 33: 1, 20: 3, 24: 1}
OK	40723-63-5	CC(C(F)F)(F)F	{16: 4, 1: 1, 3: 1, 4: 1}
OK	40723-80-6	C(CI)C(C(F)(F)F)(F)F	{16: 5, 2: 2, 19: 1, 4: 2}
OK	4074-24-2	CC[C@H](CC(=O)O)C(=O)O	{27: 2, 1: 1, 2: 2, 3: 1}
OK	4074-88-8	C=CC(=O)OCCOCCOC(=O)C=C	{2: 4, 22: 1, 28: 2, 5: 2, 6: 2}
OK	4074-90-2	C=COC(=O)CCCCC(=O)OC=C	{2: 4, 28: 2, 5: 2, 6: 2}
OK	4077-47-8	CC1C(=O)C(=C(O1)C)OC	{1: 3, 12: 1, 15: 2, 22: 1, 23: 1, 25: 1}
OK	40775-55-1	CON1C=CC=CC1=O	{1: 1, 33: 1, 22: 1, 14: 4, 25: 1}
OK	4078-19-7	CC(CC#N)N1CC1	{1: 1, 2: 1, 3: 1, 37: 1, 33: 1, 11: 2}
OK	40789-98-8	CC(C(=O)C)S	{24: 1, 1: 2, 3: 1, 39: 1}
OK	4079-68-9	CCN(CC)CC#C	{1: 2, 2: 3, 33: 1, 10: 1, 9: 1}
OK	40790-75-8	CCCC(C)C1NCCS1	{32: 1, 1: 2, 2: 2, 3: 1, 41: 1, 11: 2, 12: 1}
OK	40795-82-2	CC(C)COC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCC1CO1.C=CC#N	{1: 5, 2: 2, 3: 1, 5: 4, 6: 2, 7: 2, 11: 1, 12: 1, 23: 1, 28: 3, 37: 1}
OK	40798-45-6	CC(CO)O.C(CCC(=O)O)CC(=O)O.C(COCCO)O.C(=C/C(=O)O)\C(=O)O	{1: 1, 2: 9, 3: 1, 6: 2, 20: 4, 22: 1, 27: 4}
OK	408-16-2	C(CCCO)CCCF	{16: 1, 2: 7, 20: 1}
OK	408-27-5	C(CCCCF)CCCO	{16: 1, 2: 8, 20: 1}
OK	408-38-8	CCCCCCCCCCCCCCCCF	{16: 1, 1: 1, 2: 15}
OK	4080-95-9	C(CCCC(=O)NN)CCCC(=O)NN	{24: 2, 2: 7, 30: 2, 31: 2}
OK	4080-98-2	C(CCCCCC(=O)NN)CCCCC(=O)NN	{24: 2, 2: 10, 30: 2, 31: 2}
OK	40809-94-7	C(Cl)(Br)(I)I	{17: 1, 18: 1, 19: 2, 4: 1}
OK	4081-35-0	C1=C/C(=C\NCCCCCCN/C=C\2/C=CC=CC2=O)/C(=O)C=C1	{2: 6, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
OK	40811-49-2	CC(C)SCCO	{40: 1, 1: 2, 2: 2, 3: 1, 20: 1}
OK	40813-84-1	CCCCCCCSCCCC	{40: 1, 1: 2, 2: 9}
OK	4082-91-1	CC(=O)OCOCOC(=O)C	{1: 2, 2: 2, 28: 2, 22: 1}
OK	40827-29-0	C1CC2CC1C3(C24CC4)CC3	{11: 7, 12: 2, 13: 2}
OK	40827-30-3	C1CC2CCC1C3(C24CC4)CC3	{11: 8, 12: 2, 13: 2}
OK	4083-57-2	CC(C)C(C(C)C)N	{1: 4, 3: 3, 30: 1}
OK	40838-77-5	CC(=O)OC=C.C=C.C=CCOC(=O)NCO.C=CC(=O)N	{1: 1, 2: 2, 5: 5, 6: 3, 20: 1, 24: 1, 28: 2, 30: 1, 31: 1}
OK	4084-27-9	C([C@@H]([C@@H](CO)O)O)C(=O)C=O	{24: 1, 2: 2, 3: 2, 20: 3, 26: 1}
OK	40853-53-0	CC(C)CC=C(CO)C(C)C	{1: 4, 2: 2, 3: 2, 6: 1, 7: 1, 20: 1}
OK	40853-56-3	CC(C)CC=C(COC(=O)C)C(C)C	{1: 5, 2: 2, 3: 2, 6: 1, 7: 1, 28: 1}
OK	40853-87-0	CCCCC=CCCCCCCCCN	{1: 1, 2: 11, 30: 1, 6: 2}
OK	40853-88-1	CCCCCCC=CCCCCCCCCN	{1: 1, 2: 13, 30: 1, 6: 2}
OK	4087-39-2	C[C@@]12CCCCC1=CC(=O)CC2	{1: 1, 11: 6, 13: 1, 14: 1, 15: 1, 25: 1}
OK	4087-50-7	CC1=C(C(C(=C1C)C)(C)C)C	{1: 6, 13: 1, 15: 4}
OK	4087-51-8	CC1=CC2(CC2)C=C1	{1: 1, 11: 2, 13: 1, 14: 3, 15: 1}
OK	4088-22-6	CCCCCCCCCCCCCCCCCCN(C)CCCCCCCCCCCCCCCCCC	{1: 3, 2: 34, 33: 1}
OK	4088-36-2	CCCCCCCCNCC	{1: 2, 2: 8, 31: 1}
OK	4088-54-4	CC=CCSC	{40: 1, 1: 2, 2: 1, 6: 2}
OK	4088-60-2	C/C=C\CO	{1: 1, 2: 1, 20: 1, 6: 2}
OK	40888-97-9	CC(=O)OC(C)(C)/N=N/C(C)(C)OC(=O)C	{1: 6, 34: 2, 4: 2, 28: 2}
OK	40893-50-3	CCOC(=O)C=C.CC(=C)C(=O)N.CC(=C)C(=O)NCO	{1: 3, 2: 2, 5: 3, 6: 1, 7: 2, 20: 1, 24: 2, 28: 1, 30: 1, 31: 1}
OK	40894-00-6	CC(C)(CO)CBr	{1: 2, 2: 2, 4: 1, 18: 1, 20: 1}
OK	40908-37-0	CC(=O)NC1CC(NC(C1)(C)C)(C)C	{32: 1, 1: 5, 11: 2, 12: 1, 13: 2, 24: 1, 31: 1}
OK	4091-39-8	CC(C(=O)C)Cl	{24: 1, 1: 2, 3: 1, 17: 1}
OK	40910-49-4	CCOC(C)OC(C)(CCC=C(C)C)C=C	{1: 5, 2: 3, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 22: 2}
OK	40911-07-7	CCCCN(CCC(C)O)N=O	{1: 2, 2: 5, 3: 1, 33: 1, 34: 1, 20: 1, 29: 1}
OK	40915-96-6	CCCCCCCCCCCCC(=O)OO	{1: 1, 2: 11, 20: 1, 28: 1}
OK	40916-48-1	C=C1C2CCCCC1CC2	{11: 6, 12: 2, 5: 1, 15: 1}
OK	40942-73-2	CCCCCC1C(CCC1=O)CC(=O)C	{1: 2, 2: 5, 11: 2, 12: 2, 24: 1, 25: 1}
OK	40948-33-2	CN(CCCNC=O)CCCNC=O	{1: 1, 2: 6, 33: 1, 26: 2, 31: 2}
OK	4095-06-1	C=C1C=C1	{5: 1, 14: 2, 15: 1}
OK	40950-21-8	C1CC2(CCC1(C2)I)I	{19: 2, 11: 5, 13: 2}
OK	40950-22-9	C1CC2(CCC1(C2)Br)Br	{18: 2, 11: 5, 13: 2}
OK	40955-64-4	COC1CC=CC1	{1: 1, 11: 2, 12: 1, 22: 1, 14: 2}
OK	40959-29-3	C1CCC(=O)NCC1.C(CCCCCC(=O)O)CCCCCN.C(CCCN)CCN.C(CCC(=O)O)CC(=O)O	{32: 1, 2: 21, 11: 5, 25: 1, 27: 3, 30: 3}
OK	4096-34-8	C1CC(=O)CC=C1	{25: 1, 11: 3, 14: 2}
OK	4096-95-1	C1C=CC2CC1C=C2	{11: 2, 12: 2, 14: 4}
OK	4097-89-6	C(CN(CCN)CCN)N	{33: 1, 2: 6, 30: 3}
OK	4098-71-9	CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C	{1: 3, 2: 1, 34: 2, 8: 2, 11: 3, 12: 1, 13: 2, 29: 2}
OK	40989-36-4	C(CCC(=O)O)CC(=O)O.C(CO)NCCO	{2: 8, 27: 2, 20: 2, 31: 1}
OK	4099-07-4	CC1C(CCC1(C)O)C(=C)C	{1: 3, 5: 1, 7: 1, 11: 2, 12: 2, 13: 1, 20: 1}
OK	41004-19-7	CC(=CCI)C	{1: 2, 2: 1, 19: 1, 6: 1, 7: 1}
OK	4101-68-2	C(CCCCCBr)CCCCBr	{2: 10, 18: 2}
OK	41012-82-2	CC(C)(C)[N+](=C)[O-]	{1: 3, 33: 1, 4: 1, 5: 1, 29: 1}
OK	4104-01-2	CCC(C(=C)C)Cl	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 17: 1}
OK	4104-44-3	CC(C)CCNC	{1: 3, 2: 2, 3: 1, 31: 1}
OK	4104-45-4	CSCCCN	{40: 1, 1: 1, 2: 3, 30: 1}
OK	4104-56-7	CC(C)CC1CCCC=C1	{1: 2, 2: 1, 3: 1, 11: 3, 12: 1, 14: 2}
OK	4104-85-2	C(=NN)(NN)NN.OCl(=O)(=O)=O	{34: 1, 7: 1, 17: 1, 20: 1, 29: 3, 30: 3, 31: 2}
OK	41044-63-7	CC=CCCC(=C)C	{1: 2, 2: 2, 5: 1, 6: 2, 7: 1}
OK	41051-15-4	COCC(=O)CC(=O)OC	{24: 1, 1: 2, 2: 2, 28: 1, 22: 1}
OK	41051-20-1	CC(C)OC(=O)CC(=O)CCl	{1: 2, 2: 2, 3: 1, 17: 1, 24: 1, 28: 1}
OK	41051-21-2	CCCCCCCCOC(=O)CC(=O)CCl	{24: 1, 1: 1, 2: 9, 28: 1, 17: 1}
OK	41051-72-3	CCC(C)(CO)O	{1: 2, 2: 2, 4: 1, 20: 2}
OK	41055-92-9	CCCCCC(=O)CCl	{24: 1, 1: 1, 2: 5, 17: 1}
OK	41065-91-2	CCCC(CC)CC(=O)O	{27: 1, 1: 2, 2: 4, 3: 1}
OK	41065-95-6	CCCC(CC)CCO	{1: 2, 2: 5, 3: 1, 20: 1}
OK	4107-62-4	COC(=O)CCC#N	{1: 1, 2: 2, 28: 1, 37: 1}
OK	41078-06-2	CCNC(=O)NC(=O)CC#N	{24: 2, 1: 1, 2: 2, 37: 1, 31: 2}
OK	41078-09-5	CCNC(=O)NC(=O)/C(=N/O)/C#N	{1: 1, 2: 1, 37: 1, 7: 1, 34: 1, 20: 1, 24: 2, 31: 2}
OK	41096-47-3	CCOC(=O)C=C(C)C=CCC(C)CCCC(C)C	{1: 5, 2: 5, 3: 2, 6: 3, 7: 1, 28: 1}
OK	4110-44-5	CCCCCC(C)(C)CC	{1: 4, 2: 5, 4: 1}
OK	4110-50-3	CCCSCC	{40: 1, 1: 2, 2: 3}
OK	41107-82-8	C(C1C(C(C(O1)CO)O)O)O	{20: 4, 2: 2, 12: 4, 23: 1}
OK	41109-80-2	C1C[C@H](NC[C@@H]1Cl)[C@H]2C(=O)N[C@H](C(=O)N2)[C@@H]3CC[C@H](CN3)Cl.Cl.Cl	{32: 4, 17: 4, 11: 6, 12: 6, 25: 2}
OK	4111-08-4	CCC(C)(C#N)O	{1: 2, 2: 1, 4: 1, 37: 1, 20: 1}
OK	4111-60-8	CCC(CC)(C(=O)O)C(CC)(CC)C(=O)O	{1: 4, 2: 4, 27: 2, 4: 2}
OK	41114-00-5	CCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 14, 28: 1}
OK	41117-77-5	CCCC(=O)C(CC(=O)OCC)C(=O)OCC	{24: 1, 1: 3, 2: 5, 3: 1, 28: 2}
OK	4113-12-6	CCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCC	{1: 2, 2: 30, 22: 1}
OK	4114-28-7	CCOC(=O)NNC(=O)OCC	{1: 2, 2: 2, 28: 2, 31: 2}
OK	4114-31-2	CCOC(=O)NN	{1: 1, 2: 1, 28: 1, 30: 1, 31: 1}
OK	41145-84-0	CCCCOC(=O)C(C)Br	{1: 2, 2: 3, 3: 1, 28: 1, 18: 1}
OK	4115-50-8	CCCCCCCCSSSSCCCCCCCC	{40: 4, 1: 2, 2: 14}
OK	41155-82-2	C1COCCN1CCO.Cl	{33: 1, 2: 2, 11: 4, 17: 1, 20: 1, 23: 1}
OK	4116-10-3	CC(=O)C(C(=O)NC)Cl	{24: 2, 1: 2, 3: 1, 31: 1, 17: 1}
OK	4116-93-2	CC#CCCCCC#CC	{1: 2, 2: 4, 10: 4}
OK	41164-14-1	C1C=CC2C1CC=C2	{11: 2, 12: 2, 14: 4}
OK	4117-14-0	CCCCCCCC#CCO	{1: 1, 2: 7, 20: 1, 10: 2}
OK	4117-15-1	C#CCCCCCCCC#C	{9: 2, 2: 7, 10: 2}
OK	41171-74-8	COC(=O)C12CC3CC(C1)CC(C3)C2O	{1: 1, 11: 5, 12: 4, 13: 1, 20: 1, 28: 1}
OK	41178-84-1	CC=C(C)CBr	{1: 2, 2: 1, 18: 1, 6: 1, 7: 1}
OK	41182-83-6	C/C=C/C[CH2]	{1: 1, 2: 1, 5: 1, 6: 2}
OK	4120-02-9	C=C=N	{8: 1, 36: 1, 5: 1}
OK	41203-22-9	CN1CCCN(CCN(CCCN(CC1)C)C)C	{1: 4, 11: 10, 33: 4}
OK	41204-65-3	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CCCC[C@H]34	{1: 1, 11: 9, 12: 5, 13: 1, 14: 1, 15: 1, 20: 1}
OK	41212-96-8	C1CC(=O)N(C1=O)CCCl	{17: 1, 2: 2, 11: 2, 33: 1, 25: 2}
OK	4122-52-5	CCC(=O)N1C=CN=C1	{1: 1, 2: 1, 35: 1, 33: 1, 14: 3, 24: 1}
OK	41223-14-7	CC1CCCC1N	{1: 1, 11: 3, 12: 2, 30: 1}
OK	41227-38-7	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OC	{1: 6, 2: 28, 28: 3, 5: 3, 7: 3}
OK	41233-72-1	CC(=C)/C=C/C=C	{1: 1, 5: 2, 6: 3, 7: 1}
OK	41233-74-3	CC(=C)C=CC(=C)C	{1: 2, 5: 2, 6: 2, 7: 2}
OK	41239-48-9	CCC1CCC(O1)CC	{1: 2, 2: 2, 11: 2, 12: 2, 23: 1}
OK	4124-63-4	C(C=O)S	{2: 1, 26: 1, 39: 1}
OK	4124-88-3	CCCCCC=CCC(=O)O	{1: 1, 2: 5, 27: 1, 6: 2}
OK	41240-18-0	CC(C#N)NCCNCCN	{1: 1, 2: 4, 3: 1, 37: 1, 30: 1, 31: 2}
OK	4125-18-2	CC1(C=CC=C1)C	{1: 2, 13: 1, 14: 4}
OK	41257-75-4	CCOC(=O)C=C.CC(=C)C(=O)O.C=CC#N.C=CC(=O)NCO.C=C(CC(=O)O)C(=O)O	{1: 2, 2: 3, 5: 5, 6: 3, 7: 2, 20: 1, 24: 1, 27: 3, 28: 1, 37: 1, 31: 1}
OK	41258-95-1	C1COCO1.C1C(O1)COCCCCOCC2CO2.C1OCOCO1	{2: 6, 11: 8, 12: 2, 22: 2, 23: 7}
OK	41259-37-4	CCCCOC(=O)C=C.CCOC(=O)C=C.CC(=C)C(=O)OCC1CO1	{1: 3, 2: 5, 5: 3, 6: 2, 7: 1, 11: 1, 12: 1, 23: 1, 28: 3}
OK	4126-78-7	CC1CCCCCC1	{1: 1, 11: 6, 12: 1}
OK	41265-63-8	CCCCCCCCCCCCCCCC(=O)CO	{24: 1, 1: 1, 2: 15, 20: 1}
OK	4127-45-1	CC1CC1(C)C	{1: 3, 11: 1, 12: 1, 13: 1}
OK	4127-47-3	CC1(CC1(C)C)C	{1: 4, 11: 1, 13: 2}
OK	4128-37-4	CC(C)NC(=O)NC(C)C	{24: 1, 1: 4, 3: 2, 31: 2}
OK	4128-83-0	C1CN1CCC(=O)OCCOC(=O)CCN2CC2	{33: 2, 2: 6, 11: 4, 28: 2}
OK	41284-12-2	C(C(Cl)(Cl)Cl)(OC(C(Cl)(Cl)Cl)Cl)Cl	{17: 8, 3: 2, 4: 2, 22: 1}
OK	41294-17-1	CC(=C)[C@@H]1CC[C@]1(C)C=C	{1: 2, 5: 2, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1}
OK	41295-64-1	C(C(=O)CCl)C(=O)Cl	{24: 2, 17: 2, 2: 2}
OK	4130-54-5	CCCCCCCCCCCCCCCCCC(=O)NN	{24: 1, 1: 1, 2: 16, 30: 1, 31: 1}
OK	41302-05-0	C1CCOC(C1)OCCCCCl	{2: 4, 11: 4, 12: 1, 17: 1, 22: 1, 23: 1}
OK	41302-34-5	COC(=O)C1CCCCC1=O	{1: 1, 11: 4, 12: 1, 28: 1, 25: 1}
OK	4131-74-2	COC(=O)CCSCCC(=O)OC	{40: 1, 1: 2, 2: 4, 28: 2}
OK	41329-01-5	CCCCC(CC)C(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 7, 2: 7, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	41344-25-6	CCCCCCCCCCCCCCCCCCOCOCCCCCCCCCCCCCCCCCC	{1: 2, 2: 35, 22: 2}
OK	41365-75-7	CCOC(CCN)OCC	{1: 2, 2: 4, 3: 1, 30: 1, 22: 2}
OK	41366-03-4	CCCCCCCCCOCCO	{1: 1, 2: 10, 20: 1, 22: 1}
OK	4137-10-4	CNC.CN(C)C(=O)O	{1: 4, 27: 1, 33: 1, 31: 1}
OK	41370-29-0	CC1(CCCC(=CCO)C1)C	{1: 2, 2: 1, 6: 1, 11: 4, 13: 1, 15: 1, 20: 1}
OK	4138-26-5	C1CC(CNC1)C(=O)N	{24: 1, 32: 1, 11: 4, 12: 1, 30: 1}
OK	41407-46-9	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])N(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C(=O)N	{33: 1, 2: 2, 4: 2, 38: 6, 24: 1, 30: 1}
OK	4143-41-3	CN=NC	{1: 2, 34: 2}
OK	41430-70-0	CCOC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 1: 1, 2: 1, 4: 6, 28: 1}
OK	41433-81-2	CCCCCCCCCCCCCCCCC(C(=O)OCC)C(=O)OCC	{1: 3, 2: 17, 3: 1, 28: 2}
OK	4144-22-3	CC(C)(C)N1C(=O)C=CC1=O	{1: 3, 4: 1, 33: 1, 14: 2, 25: 2}
OK	41446-53-1	CCCCCCCCC/C=C\CC	{1: 2, 2: 9, 6: 2}
OK	41446-54-2	CCCCCCCC/C=C\CCC	{1: 2, 2: 9, 6: 2}
OK	41446-55-3	CCCCCCCC/C=C/CCC	{1: 2, 2: 9, 6: 2}
OK	41446-57-5	CCCCCCCCCC=CCC	{1: 2, 2: 9, 6: 2}
OK	41446-59-7	CCCCCCCCCCC=CC	{1: 2, 2: 9, 6: 2}
OK	41446-61-1	CCCCCCCC=CCCCCC	{1: 2, 2: 10, 6: 2}
OK	41446-62-2	CCCCCCCC/C=C\CCCC	{1: 2, 2: 10, 6: 2}
OK	41446-64-4	CCCCCCC/C=C/CCCCC	{1: 2, 2: 10, 6: 2}
OK	41446-65-5	CCCCCCCCCC=CCCC	{1: 2, 2: 10, 6: 2}
OK	41446-66-6	CCCCCCCCC=CCCCC	{1: 2, 2: 10, 6: 2}
OK	41446-67-7	CCCCCCCCCC/C=C\CC	{1: 2, 2: 10, 6: 2}
OK	41446-68-8	CCCCCCCCCC/C=C/CC	{1: 2, 2: 10, 6: 2}
OK	41448-29-7	CCC(=CCCC(=CC=O)C)C	{1: 3, 2: 3, 26: 1, 6: 2, 7: 2}
OK	4145-94-2	CC1=NC(CS1)(C)C	{1: 3, 35: 1, 41: 1, 11: 1, 13: 1, 15: 1}
OK	4145-98-6	CC(CS)N.Cl	{1: 1, 2: 1, 3: 1, 39: 1, 17: 1, 30: 1}
OK	41451-75-6	CC1=C(C(=O)CC2(C1CC3C45C2C(C(C(C4C(C(=O)O3)OC(=O)C=C(C)C(C)C)(OC5)C(=O)OC)O)O)C)O	{1: 6, 3: 1, 6: 1, 7: 1, 11: 3, 12: 7, 13: 3, 15: 2, 20: 3, 23: 1, 25: 1, 28: 3}
OK	41459-10-3	CCOC(=O)C\1=NC(=N/C1=N\NN(C)C)C	{1: 4, 2: 1, 35: 2, 33: 1, 34: 1, 15: 3, 28: 1, 31: 1}
OK	41459-42-1	C(C(CBr)C(=O)O)Br	{27: 1, 2: 2, 3: 1, 18: 2}
OK	4146-00-3	CC(C)(CS)N.Cl	{1: 2, 2: 1, 4: 1, 39: 1, 17: 1, 30: 1}
OK	4146-04-7	CCCC(CO)N	{1: 1, 2: 3, 3: 1, 20: 1, 30: 1}
OK	4146-16-1	CC(CN)S.Cl	{1: 1, 2: 1, 3: 1, 39: 1, 17: 1, 30: 1}
OK	4146-19-4	CC1CN=C(S1)C	{1: 2, 35: 1, 41: 1, 11: 1, 12: 1, 15: 1}
OK	4146-21-8	CC1=NC(CS1)C(C)C	{1: 3, 3: 1, 41: 1, 11: 1, 12: 1, 15: 1, 35: 1}
OK	4146-43-4	C(CC(=O)NN)C(=O)NN	{24: 2, 2: 2, 30: 2, 31: 2}
OK	41461-75-0	CC(C)(CCl)C(=O)N	{1: 2, 2: 1, 4: 1, 17: 1, 24: 1, 30: 1}
OK	41488-59-9	C(CCCC(=O)O)CCCC(=O)O.C(COCCO)O.C(C(CO)O)O	{27: 2, 2: 13, 3: 1, 20: 5, 22: 1}
OK	4151-69-3	CCSSC(C)(C)C	{40: 2, 1: 4, 2: 1, 4: 1}
OK	41513-32-0	C1C[C@@H](C=C[C@H]1O)O	{20: 2, 11: 2, 12: 2, 14: 2}
OK	41519-23-7	CCC=CCCOC(=O)C(C)C	{1: 3, 2: 3, 3: 1, 28: 1, 6: 2}
OK	41530-82-9	C[C@@]12CCCC([C@@H]3[C@H]1CC[C@@H]3[C@]24CO4)(C)C	{1: 3, 11: 6, 12: 3, 13: 3, 23: 1}
OK	4159-11-9	C1CN(CCN1CCC#N)CCC#N	{33: 2, 2: 4, 11: 4, 37: 2}
OK	41591-55-3	NO.Br	{18: 1, 20: 1, 30: 1}
OK	41598-07-6	CCCCCC(C=CC1C(C(CC1=O)O)CC=CCCCC(=O)O)O	{1: 1, 2: 8, 3: 1, 6: 4, 11: 1, 12: 3, 20: 2, 25: 1, 27: 1}
OK	4161-60-8	CC(CC(=O)C)O	{24: 1, 1: 2, 2: 1, 3: 1, 20: 1}
OK	4161-65-3	CC(=C)CC(=C)C	{1: 2, 2: 1, 5: 2, 7: 2}
OK	41622-39-3	CCCCCCCCCCCCCCCCSCCC(=O)O	{40: 1, 1: 1, 2: 17, 27: 1}
OK	4163-60-4	CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 5, 2: 1, 12: 5, 28: 5, 23: 1}
OK	41630-20-0	C=CCOCC1CO1.C(CO)O	{2: 4, 5: 1, 6: 1, 11: 1, 12: 1, 20: 2, 22: 1, 23: 1}
OK	41632-89-7	CC(C)C(OC)OC	{1: 4, 3: 2, 22: 2}
OK	4164-28-7	CN(C)[N+](=O)[O-]	{1: 2, 38: 1, 33: 1}
OK	4164-29-8	CCCN(CCC)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 33: 1}
OK	4164-31-2	CCCCN(CCCC)[N+](=O)[O-]	{1: 2, 2: 6, 38: 1, 33: 1}
OK	4164-32-3	C1COCCN1[N+](=O)[O-]	{33: 1, 11: 4, 38: 1, 23: 1}
OK	4164-33-4	C(CN(CCC#N)[N+](=O)[O-])C#N	{33: 1, 2: 4, 37: 2, 38: 1}
OK	4164-37-8	C1CN(CCN1[N+](=O)[O-])[N+](=O)[O-]	{33: 2, 11: 4, 38: 2}
OK	4164-39-0	C1CN(CCN1C=O)C=O	{33: 2, 26: 2, 11: 4}
OK	4165-98-4	CCCC(CC(=O)O)CC(=O)O	{27: 2, 1: 1, 2: 4, 3: 1}
OK	41653-96-7	CC(C)C/C=C/C(=O)O	{27: 1, 1: 2, 2: 1, 3: 1, 6: 2}
OK	41654-19-7	CCC(C)C(C(=O)OC)O	{1: 3, 2: 1, 3: 2, 20: 1, 28: 1}
OK	41654-27-7	CC1=C(C(=O)CC(C1=O)(C)C)OC	{1: 4, 11: 1, 13: 1, 15: 2, 22: 1, 25: 2}
OK	41658-69-9	CC(C)(C#N)Br	{1: 2, 18: 1, 4: 1, 37: 1}
OK	4166-20-5	CC1C(=O)C(=C(O1)C)OC(=O)C	{1: 3, 12: 1, 15: 2, 23: 1, 25: 1, 28: 1}
OK	4166-46-5	CCCC(C)(C(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	4166-67-0	CCNC(=O)C=CC(=O)O	{1: 1, 2: 1, 6: 2, 24: 1, 27: 1, 31: 1}
OK	41669-40-3	CCCCCCCCCCCCCC(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 18, 27: 1, 20: 3, 33: 1}
OK	4167-77-5	CCOC(=O)C1(CCCC1)C(=O)OCC	{1: 2, 2: 2, 11: 4, 28: 2, 13: 1}
OK	41672-81-5	CCCCCCCCCCCCCCCC(=O)N1C[C@@H](C[C@H]1C(=O)O)OC(=O)CCCCCCCCCCCCCCC	{1: 2, 2: 28, 33: 1, 11: 2, 12: 2, 24: 1, 27: 1, 28: 1}
OK	4168-40-5	CCCCCCCCCCCCCC(Cl)Cl	{1: 1, 2: 12, 3: 1, 17: 2}
OK	4168-79-0	CC1(CC(=NO)CC(N1)(C)C)C	{32: 1, 1: 4, 34: 1, 11: 2, 13: 2, 15: 1, 20: 1}
OK	41683-62-9	COC(CCl)Cl	{1: 1, 2: 1, 3: 1, 22: 1, 17: 2}
OK	41692-47-1	CCCC(C)CC(=O)OCC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	41698-59-3	C(CO)O.C(C(CO)(CO)CO)O.C(=C/C(=O)O)\C(=O)O	{20: 6, 2: 6, 27: 2, 4: 1, 6: 2}
OK	4170-24-5	CCC(C(=O)O)Cl	{27: 1, 1: 1, 2: 1, 3: 1, 17: 1}
OK	4170-30-3	C/C=C/C=O	{1: 1, 26: 1, 6: 2}
OK	4171-13-5	CCC(C)C(CC)C(=O)N	{24: 1, 1: 3, 2: 2, 3: 2, 30: 1}
OK	41718-50-7	CCCC(C=O)(Cl)Cl	{1: 1, 2: 2, 4: 1, 26: 1, 17: 2}
OK	41753-43-9	CC(=CCCC(C)([C@H]1CC[C@@]2([C@@H]1[C@@H](C[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)C)O)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)COC8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)O)O)C	{1: 8, 2: 6, 4: 1, 6: 1, 7: 1, 11: 7, 12: 26, 13: 4, 20: 15, 22: 4, 23: 4}
OK	4176-16-3	C[C@@H]1CC[C@H](C2=C(CC[C@H]12)C)/C=C(\C)/C=O	{1: 3, 6: 1, 7: 1, 11: 4, 12: 3, 15: 2, 26: 1}
OK	41760-23-0	CCCCCCCC(=O)NC(CSSCC(C(=O)O)NC(=O)CCCCCCC)C(=O)O	{1: 2, 2: 14, 3: 2, 40: 2, 24: 2, 27: 2, 31: 2}
OK	41767-05-9	CC(C)CCCC(C)CCOCC=O	{1: 3, 2: 6, 3: 2, 26: 1, 22: 1}
OK	41768-20-1	CC(=C)C(=O)OCC1(CO1)C	{1: 2, 2: 1, 5: 1, 7: 1, 11: 1, 13: 1, 23: 1, 28: 1}
OK	4177-72-4	CCC12COC(OC1)(OC2)CC	{1: 2, 2: 2, 11: 3, 13: 2, 23: 3}
OK	41771-35-1	CCOCCOCCCl	{1: 1, 2: 5, 22: 2, 17: 1}
OK	41775-76-2	C1COCCOCCOCCN1	{32: 1, 11: 8, 23: 3}
OK	41787-75-1	C[C@@](CCl)(C(=O)O[C@H]1CC(=C)[C@@H]2C[C@@H]([C@]3([C@@H]2[C@@H]4[C@@H]1C(=C)C(=O)O4)CO3)O)O	{1: 1, 2: 1, 4: 1, 5: 2, 11: 3, 12: 6, 13: 1, 15: 2, 17: 1, 20: 2, 23: 1, 28: 2}
OK	41788-34-5	CCCCN(CCCC)CCCCO	{1: 2, 2: 10, 20: 1, 33: 1}
OK	41793-28-6	C1CC(OCC=C1)O	{20: 1, 11: 3, 12: 1, 14: 2, 23: 1}
OK	4181-95-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 38}
OK	41812-95-7	C1CCC(CC1)(C(=O)Cl)N.Cl	{24: 1, 17: 2, 11: 5, 13: 1, 30: 1}
OK	4182-44-9	CCCCCCCCCCCCN(CCN)CCN	{1: 1, 2: 15, 30: 2, 33: 1}
OK	41824-28-6	CCCCC1OCC(CO1)C	{1: 2, 2: 3, 11: 2, 12: 2, 23: 2}
OK	41824-30-0	CCCCCCC1OCC(CO1)C	{1: 2, 2: 5, 11: 2, 12: 2, 23: 2}
OK	41845-47-0	CCC1CC1(C)C	{1: 3, 2: 1, 11: 1, 12: 1, 13: 1}
OK	41845-48-1	CCCC1CC1(C)C	{1: 3, 2: 2, 11: 1, 12: 1, 13: 1}
OK	41845-49-2	CCCCCCC1CC1(C)C	{1: 3, 2: 5, 11: 1, 12: 1, 13: 1}
OK	41851-34-7	CC(CC1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 1, 3: 1, 12: 2}
OK	41851-35-8	CC(CCC1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 2, 3: 1, 12: 2}
OK	41862-85-5	CCCCCCCCC#CCCCCCC(OC)OC	{1: 3, 2: 12, 3: 1, 10: 2, 22: 2}
OK	41862-94-6	CCCCC#CCCCCCCO	{1: 1, 2: 9, 20: 1, 10: 2}
OK	41865-30-9	CCC(=CCCC(=CCO)C)C	{1: 3, 2: 4, 20: 1, 6: 2, 7: 2}
OK	41869-16-3	CCOC(=O)CCC(C)Cl	{1: 2, 2: 3, 3: 1, 28: 1, 17: 1}
OK	4187-86-4	CCC(C#C)O	{1: 1, 2: 1, 3: 1, 9: 1, 10: 1, 20: 1}
OK	41879-94-1	CSC(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 24: 1, 40: 1}
OK	4188-64-1	CC=COC(C)C	{1: 3, 3: 1, 22: 1, 6: 2}
OK	4188-68-5	CC=COC	{1: 2, 22: 1, 6: 2}
OK	4188-71-0	C/C=C\OC(C)(C)C	{1: 4, 4: 1, 22: 1, 6: 2}
OK	41886-31-1	C(=NO)C(=O)C=NO	{24: 1, 34: 2, 20: 2, 6: 2}
OK	4189-47-3	CC(COC(=O)CBr)O	{1: 1, 2: 2, 3: 1, 18: 1, 20: 1, 28: 1}
OK	41890-92-0	CC(CCCC(C)(C)OC)C(C)O	{1: 5, 2: 3, 3: 2, 4: 1, 20: 1, 22: 1}
OK	41895-46-9	[C](F)(Br)Br	{16: 1, 18: 2, 7: 1}
OK	4190-06-1	CC1=CCC=C(C1)C	{1: 2, 11: 2, 14: 2, 15: 2}
OK	41902-42-5	CC(C)(C)C(C(C)(C)C)(C(C)(C)C)O	{1: 9, 4: 4, 20: 1}
OK	41903-81-5	CCCCCCCCCCCC(=O)CCCC	{24: 1, 1: 2, 2: 13}
OK	41909-29-9	CCC(CC)F	{16: 1, 1: 2, 2: 2, 3: 1}
OK	41925-33-1	C1C(O1)CC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 9, 11: 1, 12: 1, 16: 19, 23: 1}
OK	41927-69-9	CCCCCCCCCCCCCCOC(=O)CCCCCCCCC	{1: 2, 2: 21, 28: 1}
OK	41927-71-3	CCCCCCCCCCCCCC(=O)OCCCCCCCCCC	{1: 2, 2: 21, 28: 1}
OK	41941-50-8	CN(CCCN)CCCN.C1C(O1)CCl	{1: 1, 2: 7, 33: 1, 11: 1, 12: 1, 17: 1, 23: 1, 30: 2}
OK	41947-84-6	CCCCCCCCCCCCCCCCCCSCC	{40: 1, 1: 2, 2: 18}
OK	41956-90-5	CCCCCCSCCCCCN1CCSC1.Cl	{1: 1, 2: 10, 33: 1, 40: 1, 41: 1, 11: 3, 17: 1}
OK	41961-81-3	CCCCCCCCCCCCCCN(C)CCCCCCCCCCCCCC	{1: 3, 2: 26, 33: 1}
OK	420-04-2	C(#N)N	{37: 1, 30: 1}
OK	420-05-3	C(#N)O	{20: 1, 37: 1}
OK	420-12-2	C1CS1	{41: 1, 11: 2}
OK	420-26-8	CC(C)F	{16: 1, 1: 2, 3: 1}
OK	420-44-0	CC(C)(F)Cl	{16: 1, 1: 2, 4: 1, 17: 1}
OK	420-45-1	CC(C)(F)F	{16: 2, 1: 2, 4: 1}
OK	420-46-2	CC(F)(F)F	{16: 3, 1: 1, 4: 1}
OK	420-48-4	C(F)(Cl)(Cl)I	{16: 1, 17: 2, 19: 1, 4: 1}
OK	420-90-6	C=CC(F)(F)Br	{16: 2, 18: 1, 4: 1, 5: 1, 6: 1}
OK	420-97-3	CC(CCl)(F)Cl	{16: 1, 1: 1, 2: 1, 4: 1, 17: 2}
OK	420-99-5	CC(CCl)(F)F	{16: 2, 1: 1, 2: 1, 4: 1, 17: 1}
OK	4200-61-7	CCCCCCCCCCCCSC(C)(CCC(=O)O)SCCCCCCCCCCCC	{40: 2, 1: 3, 2: 24, 27: 1, 4: 1}
OK	4200-95-7	CCCCCCCCCCCCCCCCCN	{1: 1, 2: 16, 30: 1}
OK	42007-73-8	CC(C)CCCCC(C)(C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	4202-38-4	CCCCCCCCCCCCN=C=O	{8: 1, 1: 1, 2: 11, 34: 1, 29: 1}
OK	42027-23-6	CCC(C(C)O)O	{1: 2, 2: 1, 3: 2, 20: 2}
OK	4203-89-8	CC(=C)C(=O)OCCN1CCOC12CCCCC2	{1: 1, 2: 2, 5: 1, 7: 1, 11: 7, 13: 1, 23: 1, 33: 1, 28: 1}
OK	42031-65-2	CC1(COCC(C(=O)C1=O)(C)C)C	{1: 4, 11: 2, 25: 2, 13: 2, 23: 1}
OK	42046-61-7	CCCCCC(C#N)C#N	{1: 1, 2: 4, 3: 1, 37: 2}
OK	4206-61-5	C1C(O1)COCCOCCOCC2CO2	{2: 6, 11: 2, 12: 2, 22: 3, 23: 2}
OK	42066-39-7	CC(C)(C)C=C=CC(C)(C)C	{8: 1, 1: 6, 4: 2, 6: 2}
OK	42068-70-2	CC(=C)COC(=O)Cl	{1: 1, 2: 1, 5: 1, 7: 1, 17: 1, 28: 1}
OK	42075-32-1	C[C@H](C[C@@H](C)O)O	{1: 2, 2: 1, 3: 2, 20: 2}
OK	42080-52-4	CC1CO1.C1CO1.C(CNCCN)N.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O	{1: 1, 2: 7, 11: 3, 12: 9, 13: 1, 20: 8, 22: 1, 23: 4, 30: 2, 31: 1}
OK	4209-90-9	CCCC(C(C)(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	4209-91-0	CCC(C)(CC(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	42091-89-4	CCCC/C=C\C#C	{1: 1, 2: 3, 10: 1, 6: 2, 9: 1}
OK	421-01-2	C(C(F)(F)Cl)Br	{16: 2, 17: 1, 2: 1, 4: 1, 18: 1}
OK	421-04-5	C(C(F)(F)Cl)F	{16: 3, 17: 1, 2: 1, 4: 1}
OK	421-05-6	C(#N)C(F)(F)Cl	{16: 2, 17: 1, 4: 1, 37: 1}
OK	421-06-7	C(C(F)(F)F)Br	{16: 3, 2: 1, 4: 1, 18: 1}
OK	421-07-8	CCC(F)(F)F	{16: 3, 1: 1, 2: 1, 4: 1}
OK	421-13-6	C(N=O)(F)(F)Cl	{16: 2, 17: 1, 34: 1, 4: 1, 29: 1}
OK	421-14-7	COC(F)(F)F	{16: 3, 1: 1, 4: 1, 22: 1}
OK	421-16-9	CSC(F)(F)F	{16: 3, 1: 1, 4: 1, 40: 1}
OK	421-17-0	C(F)(F)(F)SCl	{16: 3, 17: 1, 4: 1, 40: 1}
OK	421-48-7	CC(C(F)(F)F)F	{16: 4, 1: 1, 3: 1, 4: 1}
OK	421-50-1	CC(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 24: 1}
OK	421-70-5	C(C(F)(F)I)(F)(F)Br	{16: 4, 18: 1, 19: 1, 4: 2}
OK	421-78-3	C(C(F)(F)I)(F)(F)Cl	{16: 4, 17: 1, 19: 1, 4: 2}
OK	4210-60-0	CC(C)(C)C(C#N)C#N	{1: 3, 3: 1, 4: 1, 37: 2}
OK	42104-03-0	CC1C=CC=CCC1=O	{1: 1, 11: 1, 12: 1, 14: 4, 25: 1}
OK	42104-42-7	CCCCC=CC#C	{1: 1, 2: 3, 10: 1, 6: 2, 9: 1}
OK	42115-48-0	CCCCOC(=O)C(CC)Br	{1: 2, 2: 4, 3: 1, 28: 1, 18: 1}
OK	4212-43-5	CCC(=O)OO	{1: 1, 2: 1, 20: 1, 28: 1}
OK	42123-66-0	CC(C=CC(=C)C)C(=C)C	{1: 3, 3: 1, 5: 2, 6: 2, 7: 2}
OK	42125-46-2	CC(C)(C)C1CCC(CC1)OC(=O)Cl	{1: 3, 4: 1, 11: 4, 12: 2, 17: 1, 28: 1}
OK	42131-85-1	CCCC(=C)Cl	{1: 1, 2: 2, 17: 1, 5: 1, 7: 1}
OK	42131-89-5	CCCCC(C)(Cl)Cl	{1: 2, 2: 3, 4: 1, 17: 2}
OK	42131-98-6	CC/C=C(/C)\Cl	{1: 2, 2: 1, 17: 1, 6: 1, 7: 1}
OK	42149-31-5	CC1(CO1)C#CC2(CO2)C	{1: 2, 10: 2, 11: 2, 13: 2, 23: 2}
OK	42149-74-6	CCCOCCCl	{1: 1, 2: 4, 22: 1, 17: 1}
OK	42152-47-6	CC(=CCCCC=C)C	{1: 2, 2: 3, 5: 1, 6: 2, 7: 1}
OK	42170-25-2	C1CCC(CC1)(CN=C=O)CN=C=O	{34: 2, 8: 2, 11: 5, 2: 2, 13: 1, 29: 2}
OK	42175-34-8	CCCCCCCCCCOC(=O)C(C)O	{1: 2, 2: 9, 3: 1, 20: 1, 28: 1}
OK	42185-47-7	CC1CCC(C(=O)C1C)C	{1: 3, 11: 2, 12: 3, 25: 1}
OK	42186-33-4	CCCC1C(CCC1=O)CC(=O)OC	{1: 2, 2: 3, 11: 2, 12: 2, 25: 1, 28: 1}
OK	4219-48-1	CCCCCCCCCCCC(=O)OCCO	{1: 1, 2: 12, 20: 1, 28: 1}
OK	4219-49-2	CCCCCCCCCCCCCCCC(=O)OCCO	{1: 1, 2: 16, 20: 1, 28: 1}
OK	42195-92-6	CC1CCCC(C1C)N	{1: 2, 11: 3, 12: 3, 30: 1}
OK	422-01-5	C(C(C(F)(F)F)(F)F)Br	{16: 5, 2: 1, 4: 2, 18: 1}
OK	422-02-6	C(C(C(F)(F)F)(F)F)Cl	{16: 5, 17: 1, 2: 1, 4: 2}
OK	422-03-7	C(C(C(F)(F)F)(F)F)N	{16: 5, 2: 1, 4: 2, 30: 1}
OK	422-04-8	C(#N)C(C(F)(F)F)(F)F	{16: 5, 4: 2, 37: 1}
OK	422-05-9	C(C(C(F)(F)F)(F)F)O	{16: 5, 20: 1, 2: 1, 4: 2}
OK	422-06-0	C(=O)C(C(F)(F)F)(F)F	{16: 5, 26: 1, 4: 2}
OK	422-26-4	C(C(C(Cl)(Cl)Cl)(Cl)Cl)(F)Cl	{16: 1, 17: 6, 3: 1, 4: 2}
OK	422-48-0	C(C(C(F)(F)F)(F)Cl)(F)Cl	{16: 5, 17: 2, 3: 1, 4: 2}
OK	422-49-1	C(C(C(Cl)(Cl)Cl)(F)F)(Cl)Cl	{16: 2, 17: 5, 3: 1, 4: 2}
OK	422-52-6	C(C(C(F)(Cl)Cl)(F)F)(Cl)Cl	{16: 3, 17: 4, 3: 1, 4: 2}
OK	422-54-8	C(C(C(F)(F)Cl)(F)F)(Cl)Cl	{16: 4, 17: 3, 3: 1, 4: 2}
OK	422-55-9	C(C(C(F)(F)Cl)(F)F)(F)F	{16: 6, 17: 1, 3: 1, 4: 2}
OK	422-56-0	C(C(C(F)(F)F)(F)F)(Cl)Cl	{16: 5, 17: 2, 3: 1, 4: 2}
OK	422-59-3	C(=O)(C(C(F)(F)F)(F)F)Cl	{16: 5, 17: 1, 4: 2, 24: 1}
OK	422-61-7	C(=O)(C(C(F)(F)F)(F)F)F	{16: 6, 24: 1, 4: 2}
OK	422-64-0	C(=O)(C(C(F)(F)F)(F)F)O	{16: 5, 27: 1, 4: 2}
OK	422-85-5	C(C(F)(F)F)(C(F)(F)Br)(F)F	{16: 7, 18: 1, 4: 3}
OK	422-86-6	C(C(F)(F)F)(C(F)(F)Cl)(F)F	{16: 7, 17: 1, 4: 3}
OK	4220-30-8	C(CN(CCC#N)CC(CO)O)C#N	{33: 1, 2: 6, 3: 1, 20: 2, 37: 2}
OK	42201-32-1	CC(C)(C)[C@@H](CC(=C)CC=C)O	{1: 3, 2: 2, 3: 1, 4: 1, 5: 2, 6: 1, 7: 1, 20: 1}
OK	42205-57-2	COC(=O)C1=CC(=O)CCCC1	{1: 1, 11: 4, 14: 1, 15: 1, 25: 1, 28: 1}
OK	42206-10-0	C1CC=C2CCC2=C1	{11: 4, 14: 2, 15: 2}
OK	42206-11-1	C=CC1=C(CC1)C=C	{11: 2, 5: 2, 6: 2, 15: 2}
OK	4221-03-8	C(CCO)CC=O	{2: 4, 20: 1, 26: 1}
OK	4221-98-1	CC1=CCC(C=C1)C(C)C	{1: 3, 3: 1, 11: 1, 12: 1, 14: 3, 15: 1}
OK	4221-99-2	CC[C@H](C)O	{1: 2, 2: 1, 3: 1, 20: 1}
OK	42216-29-5	CC(=O)NN=C(N)N[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 7: 1, 24: 1, 30: 1, 31: 2}
OK	42217-02-7	CCCCCCCCCCCCCCCCCCCCCl	{1: 1, 2: 19, 17: 1}
OK	42217-03-8	CCCCCCCCCCCCCCCCCCCCCCCl	{1: 1, 2: 21, 17: 1}
OK	4222-21-3	CC1(N=N1)Cl	{1: 1, 35: 2, 13: 1, 17: 1}
OK	4222-23-5	CC1(N=N1)Br	{1: 1, 18: 1, 35: 2, 13: 1}
OK	4222-27-9	COC1(N=N1)Cl	{1: 1, 35: 2, 13: 1, 22: 1, 17: 1}
OK	42222-06-0	CC(=O)CC(=O)NC(C)(C)C	{24: 2, 1: 4, 2: 1, 4: 1, 31: 1}
OK	4223-03-4	CC(C)(C)CC(C)(C)NC(=O)C=C	{1: 5, 2: 1, 4: 2, 5: 1, 6: 1, 24: 1, 31: 1}
OK	4223-10-3	C1CCC2(C(C1)O2)C3CO3	{11: 5, 12: 2, 13: 1, 23: 2}
OK	4223-11-4	CCCCOCCOC=C	{1: 1, 2: 5, 22: 2, 5: 1, 6: 1}
OK	42231-50-5	CCCCCCCCCCCCOC(=O)CCCCCCCCC	{1: 2, 2: 19, 28: 1}
OK	42231-99-2	CCCCCCCCCCCCCC(=O)OCCCCCC	{1: 2, 2: 17, 28: 1}
OK	42232-25-7	CCCCCCCCCCCCCCCC(=O)OCCCCCC	{1: 2, 2: 19, 28: 1}
OK	42232-27-9	CCCCCCCCCCCCCCCC(=O)OCCCCCCCCCC	{1: 2, 2: 23, 28: 1}
OK	42232-29-1	CCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCC	{1: 2, 2: 25, 28: 1}
OK	42233-11-4	CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCC	{1: 2, 2: 35, 28: 1}
OK	42234-04-8	CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCC	{1: 2, 2: 40, 28: 2}
OK	42235-39-2	CCOC(=O)CCCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 20, 28: 2}
OK	4224-69-5	COC(=O)C(=C)CBr	{1: 1, 2: 1, 5: 1, 7: 1, 18: 1, 28: 1}
OK	4224-70-8	C(CCC(=O)O)CCBr	{2: 5, 27: 1, 18: 1}
OK	42245-37-4	CCC(C)CCN	{1: 2, 2: 3, 3: 1, 30: 1}
OK	42245-84-1	C1C[C@H]2[C@H](CCCC2=O)C(=O)C1	{25: 2, 11: 6, 12: 2}
OK	4226-18-0	CN[C@@H](CC(=O)O)C(=O)O	{27: 2, 1: 1, 2: 1, 3: 1, 31: 1}
OK	42272-70-8	CCCCCCCCCCCCCC/C=C\1/C(C(=O)O1)CCCCCCCCCCCCCC	{1: 2, 2: 26, 6: 1, 12: 1, 15: 1, 28: 1}
OK	42282-85-9	CCC1(C(=O)NC1=O)CC	{32: 1, 1: 2, 2: 2, 13: 1, 25: 2}
OK	4229-44-1	CNO.Cl	{1: 1, 31: 1, 20: 1, 17: 1}
OK	42296-74-2	CCC=CC=C	{1: 1, 2: 1, 5: 1, 6: 3}
OK	423-38-1	C(C(C(F)(F)Cl)(F)Cl)(C(F)(Cl)Cl)(F)F	{16: 6, 17: 4, 4: 4}
OK	423-39-2	C(C(C(F)(F)I)(F)F)(C(F)(F)F)(F)F	{16: 9, 19: 1, 4: 4}
OK	423-55-2	C(C(C(C(C(F)(F)Br)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 17, 18: 1, 4: 8}
OK	423-56-3	C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 17, 20: 1, 2: 1, 4: 8}
OK	423-62-1	C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 21, 19: 1, 4: 10}
OK	4230-97-1	CCCCCCCC(=O)OCC=C	{1: 1, 2: 7, 28: 1, 5: 1, 6: 1}
OK	42301-38-2	C1=CC2C1C3C=CC2C4C3C(=O)C4=O	{25: 2, 12: 6, 14: 4}
OK	4231-35-0	CCN(CC)C#CC	{1: 3, 2: 2, 10: 2, 33: 1}
OK	42328-76-7	CCC(C)CC(C)(C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	4233-18-5	C1CCC(=C2CCCCC2)CC1	{11: 10, 15: 2}
OK	42330-88-1	C1CCOC(C1)OCCCCl	{2: 3, 11: 4, 12: 1, 17: 1, 22: 1, 23: 1}
OK	42332-45-6	C1CN2CCC1C(C2)Cl	{17: 1, 11: 5, 12: 2, 33: 1}
OK	4234-79-1	CCOC(=O)CCC(=O)CC1(C2(C3(C4(C1(C5(C2(C3(C(C45Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)O	{1: 1, 2: 4, 13: 10, 17: 10, 20: 1, 24: 1, 28: 1}
OK	4234-93-9	CC(CCC=C(C)C)CO	{1: 3, 2: 3, 3: 1, 6: 1, 7: 1, 20: 1}
OK	42345-82-4	CCOC(=CCl)Cl	{1: 1, 2: 1, 6: 1, 7: 1, 17: 2, 22: 1}
OK	42347-48-8	C1CCCC(CC1)C2CCCC2	{11: 10, 12: 2}
OK	42348-12-9	CCC1=C(C(=O)CC1C)O	{1: 2, 2: 1, 11: 1, 12: 1, 15: 2, 20: 1, 25: 1}
OK	42355-01-1	CCCC(=O)N[C@@H](CC(=O)O)C(=O)O	{1: 1, 2: 3, 3: 1, 24: 1, 27: 2, 31: 1}
OK	4237-83-6	CC1(CC(OC1=O)(C)C)C	{1: 4, 11: 1, 28: 1, 13: 2}
OK	42370-41-2	CC1=CC[C@H](C[C@@H]1O)C(C)(C)O	{1: 3, 4: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 2}
OK	42371-66-4	CCCCCCC#CCCCCC	{1: 2, 2: 9, 10: 2}
OK	4239-06-9	C1CN1C2=C(C(=O)C(=C(C2=O)N3CC3)N4CC4)N5CC5	{25: 2, 11: 8, 33: 4, 15: 4}
OK	424-40-8	CCOC(=O)C(C(C(C(=O)OCC)(F)F)(F)F)(F)F	{16: 6, 1: 2, 2: 2, 4: 3, 28: 2}
OK	424-64-6	C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F	{2: 1, 4: 3, 5: 1, 6: 1, 16: 7, 28: 1}
OK	4241-40-1	CCC1(C(=O)NC(=O)NC1=O)C(C)CC(C)O	{32: 2, 1: 3, 2: 2, 3: 2, 13: 1, 20: 1, 25: 3}
OK	42426-06-2	CCC(C)(C)OCC1CO1	{1: 3, 2: 2, 4: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	42426-07-3	CCCCC(C)(C)OCC1CO1	{1: 3, 2: 4, 4: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	42448-85-1	CC=CCCCCCCCCCCCCCCCCC	{1: 2, 2: 16, 6: 2}
OK	4245-35-6	CC(C)CCOC(=O)C=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 28: 1}
OK	4245-37-8	CC(=C)C(=O)OC=C	{1: 1, 28: 1, 5: 2, 6: 1, 7: 1}
OK	4245-76-5	CN=C(N)N[N+](=O)[O-]	{1: 1, 34: 1, 38: 1, 7: 1, 30: 1, 31: 1}
OK	4245-77-6	CCN(C(=N[N+](=O)[O-])N)N=O	{1: 1, 2: 1, 38: 1, 33: 1, 7: 1, 34: 2, 29: 1, 30: 1}
OK	4246-51-9	C(CN)COCCOCCOCCCN	{2: 10, 30: 2, 22: 3}
OK	4247-19-2	C1C(O1)CCCC2CO2	{2: 3, 11: 2, 12: 2, 23: 2}
OK	4247-30-7	C1C(OC1=O)C2CO2	{28: 1, 11: 2, 12: 2, 23: 1}
OK	42474-20-4	CCC(CCBr)Br	{1: 1, 2: 3, 3: 1, 18: 2}
OK	42474-21-5	CCCCCC(CBr)Br	{1: 1, 2: 5, 3: 1, 18: 2}
OK	42474-44-2	CSCSSC	{40: 3, 1: 2, 2: 1}
OK	4248-19-5	CC(C)(C)OC(=O)N	{1: 3, 4: 1, 30: 1, 28: 1}
OK	4248-66-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC=C4[C@@]3(C[C@H](C(=O)C4(C)C)C#N)C	{1: 5, 37: 1, 11: 6, 12: 4, 13: 4, 14: 1, 15: 1, 20: 1, 25: 1}
OK	4249-09-6	CC1=CC=CC1(C)C	{1: 3, 13: 1, 14: 3, 15: 1}
OK	4249-10-9	CC1=C(C(=C(C1)C)C)C	{1: 4, 11: 1, 15: 4}
OK	4249-11-0	CC1=CC=C(C1(C)C)C	{1: 4, 13: 1, 14: 2, 15: 2}
OK	425-51-4	CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=CC4=CC(=O)CC[C@]34C)C)OC(=O)C	{1: 4, 11: 6, 12: 3, 13: 3, 14: 3, 15: 1, 24: 1, 25: 1, 28: 1}
OK	425-61-6	C(C(C(CO)(F)F)(F)F)O	{16: 4, 20: 2, 2: 2, 4: 2}
OK	425-82-1	C1(C(OC1(F)F)(F)F)(F)F	{16: 6, 13: 3, 23: 1}
OK	425-87-6	COC(C(F)Cl)(F)F	{1: 1, 3: 1, 4: 1, 16: 3, 17: 1, 22: 1}
OK	4250-38-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 27, 27: 1}
OK	42506-58-1	CC1=CC(=C2C=C(OC(=C2)C)C)C=C(O1)C	{1: 4, 23: 2, 14: 4, 15: 6}
OK	42506-61-6	CC1=CC(=C2C=C(SC(=C2)C)C)C=C(S1)C	{1: 4, 41: 2, 14: 4, 15: 6}
OK	42507-55-1	C[C@@H]1C[C@H]([C@@H](C=C1C)C=C(C)C)C=O	{1: 4, 6: 1, 7: 1, 11: 1, 12: 3, 14: 1, 15: 1, 26: 1}
OK	42507-56-2	CC1CC(C(C=C1C)C=C(C)C)C=O	{1: 4, 6: 1, 7: 1, 11: 1, 12: 3, 14: 1, 15: 1, 26: 1}
OK	42507-58-4	C[C@H]1C[C@H]([C@H](C=C1C)C=C(C)C)C=O	{1: 4, 6: 1, 7: 1, 11: 1, 12: 3, 14: 1, 15: 1, 26: 1}
OK	42508-60-1	CC(=O)C[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 1, 33: 1, 14: 5, 17: 1, 24: 1}
OK	42513-36-0	CCCCC#CCCCCCCCl	{1: 1, 2: 9, 10: 2, 17: 1}
OK	42513-39-3	CCCCC=CCCCCCCCl	{1: 1, 2: 9, 6: 2, 17: 1}
OK	42520-97-8	CCCCN(CCCl)CCCl	{1: 1, 2: 7, 33: 1, 17: 2}
OK	42521-44-8	CC=CCC#CCCCCCCCCO	{1: 1, 2: 9, 20: 1, 10: 2, 6: 2}
OK	4253-76-3	CCCCCCCCCCCCCCCCCCNCCCN	{1: 1, 2: 20, 30: 1, 31: 1}
OK	4253-89-8	CC(C)SSC(C)C	{40: 2, 1: 4, 3: 2}
OK	4254-02-8	C1CCC(C1)C#N	{11: 4, 12: 1, 37: 1}
OK	4254-14-2	C[C@H](CO)O	{1: 1, 2: 1, 3: 1, 20: 2}
OK	4254-15-3	C[C@@H](CO)O	{1: 1, 2: 1, 3: 1, 20: 2}
OK	4255-62-3	CC1(CCC(=O)CC1)C	{1: 2, 11: 4, 13: 1, 25: 1}
OK	42551-55-3	CC(C(C)O)N	{1: 2, 3: 2, 20: 1, 30: 1}
OK	42553-65-1	C/C(=C\C=C\C=C(\C=C\C=C(\C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO[C@@H]2O[C@@H]([C@H]([C@@H]([C@H]2O)O)O)CO)/C)/C)/C=C/C=C(/C(=O)O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)CO)\C	{1: 4, 2: 4, 6: 10, 7: 4, 12: 20, 20: 14, 22: 2, 23: 4, 28: 2}
OK	42556-95-6	C1CO1.C1CS1	{41: 1, 11: 4, 23: 1}
OK	42558-01-0	CCCCC(C1CCCC1=O)O	{1: 1, 2: 3, 3: 1, 11: 3, 12: 1, 20: 1, 25: 1}
OK	42579-28-2	C1C(=O)NC(=O)N1N=O	{32: 1, 33: 1, 34: 1, 11: 1, 25: 2, 29: 1}
OK	4258-93-9	CCCC1(CCCCC1)C	{1: 2, 2: 2, 11: 5, 13: 1}
OK	42588-57-8	CCO/C=C(\C)/C=O	{1: 2, 2: 1, 6: 1, 7: 1, 22: 1, 26: 1}
OK	4259-00-1	CC1CCCC1(C)C	{1: 3, 11: 3, 12: 1, 13: 1}
OK	4259-43-2	C(C(F)(F)F)(C(Cl)(Cl)Cl)(F)F	{16: 5, 17: 3, 4: 3}
OK	42599-17-7	CCCCCCC=CI	{1: 1, 2: 5, 19: 1, 6: 2}
OK	426-65-3	CCOC(=O)C(C(F)(F)F)(F)F	{16: 5, 1: 1, 2: 1, 4: 2, 28: 1}
OK	42603-22-5	C1C(O1)CCl.C(CCC(=O)O)CC(=O)O.C(CN)N.C(CNCCN)N	{2: 11, 11: 1, 12: 1, 17: 1, 23: 1, 27: 2, 30: 4, 31: 1}
OK	42604-12-6	COCOC1CCCCCCCCCCC1	{1: 1, 2: 1, 11: 11, 12: 1, 22: 2}
OK	42607-62-5	C=C1C2C3CC4C2C(=C)C5C4C3C51	{11: 1, 12: 8, 5: 2, 15: 2}
OK	42607-64-7	CC1C2C3CC4C2C(=C)C5C1C3C45	{1: 1, 11: 1, 12: 9, 5: 1, 15: 1}
OK	4261-68-1	CC(C)N(CCCl)C(C)C.Cl	{1: 4, 2: 2, 3: 2, 33: 1, 17: 2}
OK	42617-34-5	C[C@H]1C[C@H]([C@@](OC1[C@H]2CC[C@@H](O2)[C@@H]3CCC(O3)[C@@]4([C@@H]([C@H]([C@@]5(O4)[C@@H]([C@@H](C[C@H](O5)C[C@H]6[C@]([C@H]([C@H]([C@](O6)([C@@H](C)C(=O)O)O)C)OC)(C)O[C@H]7CC[C@@H]([C@H](O7)C)OC)OC)C)C)OC)C)(C)O)C	{1: 14, 2: 1, 3: 1, 11: 8, 12: 18, 13: 5, 20: 2, 22: 5, 23: 7, 27: 1}
OK	4265-55-8	C1CCC(CC1)(SCCC(=O)O)SCCC(=O)O	{27: 2, 40: 2, 2: 4, 11: 5, 13: 1}
OK	4265-97-8	CCCCCCCC(=O)OCCCCCCC	{1: 2, 2: 12, 28: 1}
OK	4267-00-9	CCN(CC)N(CC)CC	{1: 4, 2: 4, 33: 2}
OK	4268-36-4	CCCCNC(=O)OCC(C)(CCC)COC(=O)N	{1: 3, 2: 7, 4: 1, 28: 2, 30: 1, 31: 1}
OK	427-30-5	CC1(C(=O)NC(=O)N(C1=O)C)C2=CC(=O)CCC2	{32: 1, 1: 2, 33: 1, 11: 3, 13: 1, 14: 1, 15: 1, 25: 4}
OK	427-51-0	CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=C(C4=CC(=O)[C@@H]5C[C@@H]5[C@]34C)Cl)C)OC(=O)C	{1: 4, 11: 5, 12: 5, 13: 3, 14: 2, 15: 2, 17: 1, 24: 1, 25: 1, 28: 1}
OK	4271-27-6	CCCCCCCCCCCCN(CC)CC	{1: 3, 2: 13, 33: 1}
OK	4271-96-9	CC1=NCCCN1C	{1: 2, 11: 3, 33: 1, 35: 1, 15: 1}
OK	42713-66-6	C(C[C@@H](C(=O)O)N)CN(C(=O)N)N=O	{33: 1, 2: 3, 3: 1, 34: 1, 24: 1, 27: 1, 29: 1, 30: 2}
OK	4272-02-0	CCCCCCCC(CCCO)O	{1: 1, 2: 9, 3: 1, 20: 2}
OK	4272-06-4	CCCCCCCC(CCC)O	{1: 2, 2: 8, 3: 1, 20: 1}
OK	42726-73-8	CC(C)(C)OC(=O)CC(=O)OC	{1: 4, 2: 1, 4: 1, 28: 2}
OK	4275-28-9	CC(=O)OCCSCCOC(=O)C	{40: 1, 1: 2, 2: 4, 28: 2}
OK	4275-31-4	CCCCCCCCCCCC(=O)OCCSCCOC(=O)CCCCCCCCCCC	{40: 1, 1: 2, 2: 24, 28: 2}
OK	4275-32-5	CCCCCCCCCCCCCCCCCC(=O)OCCSCCOC(=O)CCCCCCCCCCCCCCCCC	{40: 1, 1: 2, 2: 36, 28: 2}
OK	42751-81-5	CNC.C1C(O1)CCl.C(CCCN)CCN	{1: 2, 2: 7, 11: 1, 12: 1, 17: 1, 23: 1, 30: 2, 31: 1}
OK	4276-09-9	CC(C)[C@H](CO)N	{1: 2, 2: 1, 3: 2, 20: 1, 30: 1}
OK	4276-45-3	CC(C)C1CCC=C1	{11: 2, 1: 2, 3: 1, 12: 1, 14: 2}
OK	4276-49-7	CCCCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 19, 18: 1}
OK	4276-51-1	CCCCCCCCCCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 25, 18: 1}
OK	4277-63-8	COC(=O)N1C=CC=C1	{1: 1, 28: 1, 14: 4, 33: 1}
OK	42772-51-0	CC(=O)CC(C)(C)N(CO)C(=O)C=C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 1, 33: 1, 20: 1, 24: 2}
OK	4278-87-9	C1CCC(=NN=C2CCCCC2)CC1	{34: 2, 11: 10, 15: 2}
OK	42789-13-9	CCCCCCCC(CO)O	{1: 1, 2: 7, 3: 1, 20: 2}
OK	4279-22-5	CCC(C)(Cl)Cl	{1: 2, 2: 1, 4: 1, 17: 2}
OK	42796-28-1	CC1CCNCC1.Cl	{32: 1, 1: 1, 11: 4, 12: 1, 17: 1}
OK	428-59-1	C1(C(O1)(F)F)(C(F)(F)F)F	{16: 6, 4: 1, 13: 2, 23: 1}
OK	428-75-1	C(C(C(F)(F)F)(O)O)C(C(F)(F)F)(O)O	{16: 6, 20: 4, 2: 1, 4: 4}
OK	42806-77-9	CCC[C@@H]1CCCC[C@H]1C	{1: 2, 2: 2, 11: 4, 12: 2}
OK	4281-04-3	CC1C=CC=CC=C1	{1: 1, 12: 1, 14: 6}
OK	42815-42-9	CCCCC(CC)COC(=O)C=C.CCCCOC(=O)C=C.CCOC(=O)C=C.C=CC(=O)NCO	{1: 4, 2: 10, 3: 1, 5: 4, 6: 4, 20: 1, 24: 1, 28: 3, 31: 1}
OK	4282-40-0	CCCCCCCI	{1: 1, 2: 6, 19: 1}
OK	4282-42-2	CCCCCCCCCI	{1: 1, 2: 8, 19: 1}
OK	4282-44-4	CCCCCCCCCCCI	{1: 1, 2: 10, 19: 1}
OK	42824-62-4	C1CCCCCC2COCC2CCCC1	{11: 12, 12: 2, 23: 1}
OK	4283-80-1	CCCC(C)(C)Br	{1: 3, 2: 2, 4: 1, 18: 1}
OK	42831-64-1	CC(COC(=O)CCl)OC(=O)CCl	{1: 1, 2: 3, 3: 1, 28: 2, 17: 2}
OK	42841-80-5	CCCCCSCCC	{40: 1, 1: 2, 2: 6}
OK	42842-99-9	CC(C)(C)N1C2CCC(C2)N1C	{1: 4, 11: 3, 4: 1, 12: 2, 33: 2}
OK	42846-91-3	CC(C)CC1C(=O)NC(=O)NC1=O	{32: 2, 1: 2, 2: 1, 3: 1, 12: 1, 25: 3}
OK	4285-59-0	CC(C)OC(C)OC(C)C	{1: 5, 3: 3, 22: 2}
OK	42855-50-5	CC1=CCSC1	{1: 1, 11: 2, 41: 1, 14: 1, 15: 1}
OK	42856-62-2	CC(CCCO)CO	{1: 1, 2: 4, 3: 1, 20: 2}
OK	42858-85-5	C12=C(C3=C(C4=C(C5=C1C(C5(F)F)(F)F)C(C4(F)F)(F)F)C(C3(F)F)(F)F)C(C2(F)F)(F)F	{16: 16, 13: 8, 15: 8}
OK	4286-47-9	C(CCC[N+](=O)[O-])CC[N+](=O)[O-]	{2: 6, 38: 2}
OK	4286-49-1	C(CC[N+](=O)[O-])C[N+](=O)[O-]	{2: 4, 38: 2}
OK	4286-55-9	C(CCCBr)CCO	{2: 6, 20: 1, 18: 1}
OK	42865-19-0	C(CBr)N=C=O	{8: 1, 2: 2, 34: 1, 18: 1, 29: 1}
OK	4288-84-0	CC(C)OCC(CCl)O	{1: 2, 2: 2, 3: 2, 17: 1, 20: 1, 22: 1}
OK	42890-76-6	C(CO)[C@@H](CO)O	{2: 3, 3: 1, 20: 3}
OK	42900-28-7	CC1CCC2CCCCC2S1	{1: 1, 11: 6, 12: 3, 41: 1}
OK	4291-80-9	CCCC1CCCC(C1)C	{1: 2, 2: 2, 11: 4, 12: 2}
OK	4291-81-0	CCCC1CCC(CC1)C	{1: 2, 2: 2, 11: 4, 12: 2}
OK	4291-98-9	CCCCCC1=CCCC1	{1: 1, 2: 4, 11: 3, 14: 1, 15: 1}
OK	4291-99-0	CCCCCCC1=CCCC1	{1: 1, 2: 5, 11: 3, 14: 1, 15: 1}
OK	42910-16-7	CCCCCCCCCCCN(CCCCCCCCCCC)CCCCCCCCCCC	{1: 3, 2: 30, 33: 1}
OK	42910-64-5	CCOCC(COC(C)(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1, 22: 2}
OK	42910-65-6	CCCCOCC(COC(C)(C)C)O	{1: 4, 2: 5, 3: 1, 4: 1, 20: 1, 22: 2}
OK	42910-66-7	CCCCCOCC(COC(C)(C)C)O	{1: 4, 2: 6, 3: 1, 4: 1, 20: 1, 22: 2}
OK	4292-00-6	CCCCCCCC1=CCCC1	{1: 1, 2: 6, 11: 3, 14: 1, 15: 1}
OK	4292-04-0	CC(C)C1=CCCCC1	{11: 4, 1: 2, 3: 1, 14: 1, 15: 1}
OK	4292-19-7	CCCCCCCCCCCCI	{1: 1, 2: 11, 19: 1}
OK	4292-75-5	CCCCCCC1CCCCC1	{1: 1, 2: 5, 11: 5, 12: 1}
OK	4292-92-6	CCCCCC1CCCCC1	{1: 1, 2: 4, 11: 5, 12: 1}
OK	4293-61-2	CCC1CSC(=N1)C	{1: 2, 2: 1, 35: 1, 41: 1, 11: 1, 12: 1, 15: 1}
OK	42933-32-4	CC(=C(C)CCC(=CCO)C)C	{1: 4, 2: 3, 20: 1, 6: 1, 7: 3}
OK	42948-91-4	C1CCC2C=CC(C1)C2=O	{25: 1, 11: 4, 12: 2, 14: 2}
OK	42949-22-4	C=C1C2CC3CC1CN(C3)C2	{33: 1, 11: 5, 12: 3, 5: 1, 15: 1}
OK	42949-24-6	C1C2CC3CN(C2)CC1C3=O	{25: 1, 11: 5, 12: 3, 33: 1}
OK	4296-15-5	COCCI	{1: 1, 2: 2, 19: 1, 22: 1}
OK	42965-13-9	CC(=O)N(C1CCCCC1)C(=O)NC2CCCCC2	{1: 1, 33: 1, 11: 10, 12: 2, 24: 2, 31: 1}
OK	42969-65-3	C[C@H](C#C)O	{1: 1, 10: 1, 3: 1, 20: 1, 9: 1}
OK	4297-61-4	CC1=CC2[C@](CC1)([C@]3([C@@H]([C@H]([C@H](C34CO4)O2)OC(=O)C)OC(=O)C)C)COC(=O)C	{1: 5, 2: 1, 11: 3, 12: 4, 13: 3, 14: 1, 15: 1, 23: 2, 28: 3}
OK	4298-08-2	C1CN[C@@H]([C@H]1O)C(=O)O	{27: 1, 20: 1, 11: 2, 12: 2, 32: 1}
OK	42990-24-9	CC(C)CC(C(=O)O)Br	{27: 1, 1: 2, 2: 1, 3: 2, 18: 1}
OK	42991-60-6	CCCOCC(COC(C)(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1, 22: 2}
OK	430-49-9	C(=C/F)\C#N	{16: 1, 37: 1, 6: 2}
OK	430-51-3	CC(=O)CF	{16: 1, 1: 1, 2: 1, 24: 1}
OK	430-57-9	C(C(F)Cl)Cl	{16: 1, 17: 2, 2: 1, 3: 1}
OK	430-58-0	C(=C(F)Cl)Cl	{16: 1, 17: 2, 6: 1, 7: 1}
OK	430-61-5	CCC(F)F	{16: 2, 1: 1, 2: 1, 3: 1}
OK	430-62-6	C=CC(F)F	{16: 2, 3: 1, 5: 1, 6: 1}
OK	430-63-7	CC=C(F)F	{16: 2, 1: 1, 6: 1, 7: 1}
OK	430-64-8	C=C=C(F)F	{8: 1, 16: 2, 5: 1, 7: 1}
OK	430-66-0	C(C(F)F)F	{16: 3, 2: 1, 3: 1}
OK	430-67-1	C(C(F)F)N	{16: 2, 2: 1, 3: 1, 30: 1}
OK	430-71-7	CCC(=O)F	{16: 1, 1: 1, 2: 1, 24: 1}
OK	430-85-3	C(=C(Br)Br)(F)F	{16: 2, 18: 2, 7: 2}
OK	4300-97-4	CC(C)(CCl)C(=O)Cl	{24: 1, 1: 2, 2: 1, 4: 1, 17: 2}
OK	43010-05-5	CCCN(CCC)CCCCCCO	{1: 2, 2: 10, 20: 1, 33: 1}
OK	43022-60-2	CC(C)SSC(C)(C)C	{40: 2, 1: 5, 3: 1, 4: 1}
OK	4303-67-7	CCCCCCCCCCCCN1C=CN=C1	{1: 1, 2: 11, 35: 1, 14: 3, 33: 1}
OK	4303-70-2	CCCCCCCCC=CCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 14, 30: 1, 6: 2}
OK	43034-68-0	CSCI	{40: 1, 1: 1, 2: 1, 19: 1}
OK	43036-06-2	C1=CN(C=C1)CCC#N	{33: 1, 2: 2, 37: 1, 14: 4}
OK	43040-01-3	CC1SCCSS1	{1: 1, 11: 2, 12: 1, 41: 3}
OK	43052-87-5	CC=CC(=O)C1C(=CCCC1(C)C)C	{1: 4, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	4306-65-4	CC1CC(CC(C1)(C)C)C	{1: 4, 11: 3, 12: 2, 13: 1}
OK	43064-52-4	CC(C)C(CC(=O)OC)(C(=O)OC)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1, 28: 2}
OK	4308-80-9	CC1CC12C=CC=C2	{1: 1, 11: 1, 12: 1, 13: 1, 14: 4}
OK	43083-12-1	CCCC(OC)(OC)OC	{1: 4, 2: 2, 4: 1, 22: 3}
OK	431-03-8	CC(=O)C(=O)C	{24: 2, 1: 2}
OK	431-06-1	C(C(F)Cl)(F)Cl	{16: 2, 17: 2, 3: 2}
OK	431-07-2	C(C(F)Cl)(F)F	{16: 3, 17: 1, 3: 2}
OK	431-21-0	C(C(C(F)(F)F)Br)Br	{16: 3, 2: 1, 3: 1, 4: 1, 18: 2}
OK	431-27-6	C(=C(C(F)(F)F)Cl)Cl	{16: 3, 17: 2, 4: 1, 6: 1, 7: 1}
OK	431-31-2	C(C(C(F)(F)F)F)F	{16: 5, 2: 1, 3: 1, 4: 1}
OK	431-32-3	C(#N)C(C(F)(F)F)F	{16: 4, 3: 1, 4: 1, 37: 1}
OK	431-34-5	C(C(C(F)(F)F)O)Br	{2: 1, 3: 1, 4: 1, 16: 3, 18: 1, 20: 1}
OK	431-35-6	C(C(=O)C(F)(F)F)Br	{16: 3, 24: 1, 2: 1, 4: 1, 18: 1}
OK	431-46-9	COC(C(F)(F)F)O	{1: 1, 3: 1, 4: 1, 16: 3, 20: 1, 22: 1}
OK	431-47-0	COC(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 28: 1}
OK	431-50-5	C(=C(Cl)Cl)(C(F)(F)Cl)Cl	{16: 2, 17: 4, 4: 1, 7: 2}
OK	431-51-6	C(C(Cl)Cl)(C(F)(F)F)Cl	{16: 3, 17: 3, 3: 2, 4: 1}
OK	431-52-7	C(=C(Cl)Cl)(C(F)(F)F)Cl	{16: 3, 17: 3, 4: 1, 7: 2}
OK	431-53-8	C(=C(F)Cl)(C(F)(F)F)Cl	{16: 4, 17: 2, 4: 1, 7: 2}
OK	431-63-0	C(C(F)F)(C(F)(F)F)F	{16: 6, 3: 2, 4: 1}
OK	431-71-0	C(C(=O)C(F)(F)F)(F)F	{16: 5, 24: 1, 3: 1, 4: 1}
OK	431-86-7	C(C(F)(F)F)(C(F)(F)Cl)Cl	{16: 5, 17: 2, 3: 1, 4: 2}
OK	431-87-8	C(C(F)(F)F)(C(F)(F)F)Cl	{16: 6, 17: 1, 3: 1, 4: 2}
OK	431-89-0	C(C(F)(F)F)(C(F)(F)F)F	{16: 7, 3: 1, 4: 2}
OK	43101-48-0	CCOC(=O)C[C@@H](C(=O)OCC)N	{1: 2, 2: 3, 3: 1, 28: 2, 30: 1}
OK	43119-28-4	C1C=C[C@@H]2[C@H]1OC(=O)C2	{28: 1, 11: 2, 12: 2, 14: 2}
OK	4312-76-9	CCCCCCOO	{1: 1, 2: 5, 20: 1, 22: 1}
OK	4312-93-0	CCCCCC(=O)NO	{24: 1, 1: 1, 2: 4, 20: 1, 31: 1}
OK	4312-99-6	CCCCCC(=O)C=C	{24: 1, 1: 1, 2: 4, 5: 1, 6: 1}
OK	43127-25-9	CCCCOC(=O)C=C.CCOC(=O)C=C.CC(=C)C(=O)OCCO.C=CC(=O)O	{1: 3, 2: 6, 5: 4, 6: 3, 7: 1, 20: 1, 27: 1, 28: 3}
OK	4313-03-5	CCC=CC=CC=O	{1: 1, 2: 1, 26: 1, 6: 4}
OK	4313-57-9	CC1=CCC=CC1	{1: 1, 11: 2, 14: 3, 15: 1}
OK	4316-42-1	CCCCN1C=CN=C1	{1: 1, 2: 3, 35: 1, 14: 3, 33: 1}
OK	4316-65-8	CC(CC(C)(C)C)C=C	{1: 4, 2: 1, 3: 1, 4: 1, 5: 1, 6: 1}
OK	4318-37-0	CN1CCCNCC1	{32: 1, 1: 1, 11: 5, 33: 1}
OK	4318-42-7	CC(C)N1CCNCC1	{11: 4, 1: 2, 3: 1, 33: 1, 32: 1}
OK	4319-49-7	C1COCCN1N	{33: 1, 11: 4, 30: 1, 23: 1}
OK	43195-77-3	C1CC2CCC(C1)N=N2	{35: 2, 11: 5, 12: 2}
OK	43197-78-0	CCCC(C)(CC)Cl	{1: 3, 2: 3, 4: 1, 17: 1}
OK	432-03-1	C(N(C(F)(F)F)C(F)(F)F)(F)(F)F	{16: 9, 33: 1, 4: 3}
OK	432-08-6	C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(N(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 39, 33: 1, 4: 18}
OK	432-24-6	CC1=CCCC(C1C=O)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 26: 1}
OK	432-25-7	CC1=C(C(CCC1)(C)C)C=O	{1: 3, 26: 1, 11: 3, 13: 1, 15: 2}
OK	432-60-0	CC12CCC3C(C1CCC2(CC=C)O)CCC4=CCCCC34	{1: 1, 2: 1, 5: 1, 6: 1, 11: 9, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1}
OK	4320-30-3	C(CC(C(=O)O)N)CN=C(N)N.C(CC(=O)O)C(C(=O)O)N	{2: 5, 3: 2, 7: 1, 34: 1, 27: 3, 30: 4}
OK	43201-63-4	CC(CNCC(C)O)O.C=CC(=O)O	{1: 2, 2: 2, 3: 2, 5: 1, 6: 1, 20: 2, 27: 1, 31: 1}
OK	43219-68-7	CC1=CCC(CC1)(C)C(=O)C	{1: 3, 11: 3, 13: 1, 14: 1, 15: 1, 24: 1}
OK	4323-21-1	C1=CC(=O)C=CC1O	{20: 1, 12: 1, 14: 4, 25: 1}
OK	4324-38-3	CCOCCC(=O)O	{1: 1, 2: 3, 27: 1, 22: 1}
OK	4325-48-8	CCCC(C)(C)Cl	{1: 3, 2: 2, 4: 1, 17: 1}
OK	4325-49-9	CCCCCC(C)(C)Cl	{1: 3, 2: 4, 4: 1, 17: 1}
OK	4325-50-2	CCCCCCCC(C)(C)Cl	{1: 3, 2: 6, 4: 1, 17: 1}
OK	4325-82-0	CC(C=C(C)C)O	{1: 3, 3: 1, 20: 1, 6: 1, 7: 1}
OK	4325-97-7	C(CCl)S	{17: 1, 2: 2, 39: 1}
OK	433-27-2	CCOC(C(F)(F)F)O	{1: 1, 2: 1, 3: 1, 4: 1, 16: 3, 20: 1, 22: 1}
OK	433-28-3	C=COC(=O)C(F)(F)F	{16: 3, 28: 1, 4: 1, 5: 1, 6: 1}
OK	433-33-0	COC(=O)CNC(=O)CNC(=O)C(F)(F)F	{1: 1, 2: 2, 4: 1, 16: 3, 24: 2, 28: 1, 31: 2}
OK	433-52-3	COC(=O)C(F)Cl	{16: 1, 1: 1, 3: 1, 28: 1, 17: 1}
OK	433-53-4	COC(=O)C(F)F	{16: 2, 1: 1, 3: 1, 28: 1}
OK	4333-56-6	C1CC1Br	{18: 1, 11: 2, 12: 1}
OK	4333-62-4	CN1C=C[N+](=C1)C.[I-]	{1: 2, 19: 1, 14: 3, 33: 2}
OK	4336-19-0	COC(=O)C1=C(CCCC1)C(=O)OC	{1: 2, 11: 4, 28: 2, 15: 2}
OK	4339-05-3	CCCC(C)(C#C)O	{1: 2, 2: 2, 4: 1, 9: 1, 10: 1, 20: 1}
OK	434-03-7	CC12CCC(=O)C=C1CCC3C2CCC4(C3CCC4(C#C)O)C	{1: 2, 9: 1, 10: 1, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 20: 1, 25: 1}
OK	434-05-9	CC1=CC(=O)CC2C1(C3CCC4(C(C3CC2)CCC4OC(=O)C)C)C	{1: 4, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	434-07-1	CC12CCC3C(C1CCC2(C)O)CCC4C3(CC(=CO)C(=O)C4)C	{1: 3, 6: 1, 11: 8, 12: 4, 13: 3, 15: 1, 20: 2, 25: 1}
OK	434-13-9	C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C	{1: 3, 2: 2, 3: 1, 11: 9, 12: 6, 13: 2, 20: 1, 27: 1}
OK	434-16-2	CC(C)CCCC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 20: 1}
OK	434-22-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CC[C@H]34	{1: 1, 11: 8, 12: 5, 13: 1, 14: 1, 15: 1, 20: 1, 25: 1}
OK	4340-76-5	CCCCCCCCCCCCCCCCCCC(C)O	{1: 2, 2: 17, 3: 1, 20: 1}
OK	4341-24-6	CC1CC(=O)CC(=O)C1	{1: 1, 11: 3, 12: 1, 25: 2}
OK	4341-76-8	CCOC(=O)C#CC	{1: 2, 2: 1, 28: 1, 10: 2}
OK	4342-03-4	CN(C)NN=C1C(=NC=N1)C(=O)N	{1: 2, 34: 1, 35: 2, 33: 1, 14: 1, 15: 2, 24: 1, 30: 1, 31: 1}
OK	4342-10-3	CCCCN(CCCC)N/N=C\1/C(=NN=N1)C(=O)N	{1: 2, 2: 6, 35: 3, 33: 1, 34: 1, 15: 2, 24: 1, 30: 1, 31: 1}
OK	4343-68-4	C(#N)N=O	{34: 1, 29: 1, 37: 1}
OK	4348-35-0	CC[C](C)C	{1: 3, 2: 1, 7: 1}
OK	4350-84-9	C1CC2CCC1C(=O)O2	{28: 1, 11: 4, 12: 2}
OK	4351-10-4	CCCCCCC1OCC(O1)C	{1: 2, 2: 5, 11: 1, 12: 2, 23: 2}
OK	4352-42-5	CCCC(C1CCCCC1)O	{1: 1, 2: 2, 3: 1, 11: 5, 12: 1, 20: 1}
OK	4352-44-7	C=CC(C1CCCCC1)O	{3: 1, 5: 1, 6: 1, 11: 5, 12: 1, 20: 1}
OK	4352-99-2	CCCC1OCC(O1)C	{1: 2, 2: 2, 11: 1, 12: 2, 23: 2}
OK	4353-06-4	CCCCCCCCCC1OCCO1	{1: 1, 2: 8, 11: 2, 12: 1, 23: 2}
OK	4353-28-0	CCOCCOCCOCCOCCOCC	{1: 2, 2: 10, 22: 5}
OK	4353-29-1	CCOCCOCCOCCOCCOCCO	{1: 1, 2: 11, 20: 1, 22: 5}
OK	4354-56-7	C1CCC(CC1)CCCCCC(=O)O	{27: 1, 2: 5, 11: 5, 12: 1}
OK	4354-73-8	C1CCC(=C(C#N)C#N)CC1	{15: 1, 11: 5, 37: 2, 7: 1}
OK	4355-11-7	C1CCC(CC1)(CC(=O)O)CC(=O)O	{27: 2, 2: 2, 11: 5, 13: 1}
OK	4356-09-6	C[C@H](CC[C@H](C)C(C)COC(=O)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4[C@@]3(CCCC4)C)C	{1: 6, 2: 3, 3: 3, 11: 10, 12: 5, 13: 2, 28: 1}
OK	4356-60-9	COCN1C(C(N(C1=O)COC)OC)OC	{1: 4, 2: 2, 33: 2, 12: 2, 22: 4, 25: 1}
OK	4358-59-2	CC=CC(=O)OC	{1: 2, 28: 1, 6: 2}
OK	4358-75-2	CC(C)C(C)(C)N	{1: 4, 3: 1, 4: 1, 30: 1}
OK	4359-46-0	CCC1OCC(O1)C	{1: 2, 2: 1, 11: 1, 12: 2, 23: 2}
OK	4359-57-3	CCCCCCCC1OCCO1	{1: 1, 2: 6, 11: 2, 12: 1, 23: 2}
OK	436-40-8	CCCOC1=C(C(=O)C(=C(C1=O)N2CC2)OCCC)N3CC3	{1: 2, 2: 4, 33: 2, 11: 4, 15: 4, 22: 2, 25: 2}
OK	4360-63-8	C1COC(O1)CBr	{2: 1, 11: 2, 12: 1, 18: 1, 23: 2}
OK	4360-76-3	CCCCC1OCCO1	{1: 1, 2: 3, 11: 2, 12: 1, 23: 2}
OK	4361-06-2	CC(C)CC(C(=O)O)C(=O)O	{27: 2, 1: 2, 2: 1, 3: 2}
OK	4361-23-3	CC1CCCC(C1CCC(C)O)(C)C	{1: 4, 2: 2, 3: 1, 11: 3, 12: 2, 13: 1, 20: 1}
OK	4361-28-8	C1CCC(CC1)CCC=O	{2: 2, 11: 5, 12: 1, 26: 1}
OK	4361-47-1	C(=C(C#N)C#N)=O	{8: 1, 37: 2, 29: 1, 7: 1}
OK	4362-05-4	C1COC2C(O1)OCCO2	{11: 4, 12: 2, 23: 4}
OK	4362-13-4	C1COOC1	{11: 3, 23: 2}
OK	4362-24-7	C=C1COCO1	{23: 2, 11: 2, 5: 1, 15: 1}
OK	4362-40-7	CC1(OCC(O1)CCl)C	{1: 2, 2: 1, 11: 1, 12: 1, 13: 1, 17: 1, 23: 2}
OK	4362-68-9	C=C1C(=C)OCO1	{23: 2, 11: 1, 5: 2, 15: 2}
OK	4368-28-9	C(C1([C@@H]2C(C34[C@@H](C(O2)(OC1C3C([NH+]=C(N4)N)O)[O-])O)O)O)O	{32: 2, 2: 1, 12: 6, 13: 3, 15: 1, 20: 5, 23: 2, 29: 1, 30: 1}
OK	43691-07-2	CC=CN	{1: 1, 30: 1, 6: 2}
OK	4370-59-6	C1(=C(C(=O)C(=C(C1=O)Br)O)Br)O	{25: 2, 18: 2, 20: 2, 15: 4}
OK	4371-64-6	CCCCCCCCCCCCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 15, 3: 1}
OK	4371-74-8	CCCCCCCCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 11, 3: 1}
OK	4372-29-6	CCCCCCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 9, 3: 1}
OK	4372-94-5	CC1(CC1=C)C	{15: 1, 1: 2, 11: 1, 5: 1, 13: 1}
OK	43730-26-3	C=NC#N	{34: 1, 5: 1, 37: 1}
OK	4375-11-5	C(=O)(NC(=O)NN)NN	{24: 2, 30: 2, 31: 3}
OK	4375-14-8	C1CCC2C(C1)CCN2	{32: 1, 11: 6, 12: 2}
OK	4375-96-6	CC(=C)I	{1: 1, 19: 1, 5: 1, 7: 1}
OK	4376-23-2	CC/C=C/C(=O)C	{24: 1, 1: 2, 2: 1, 6: 2}
OK	4377-73-5	C1=CC(=N)C=CC1=N	{36: 2, 14: 4, 15: 2}
OK	438-08-4	C[C@]12CCCC[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4C(=O)O)C	{27: 1, 1: 2, 11: 10, 12: 5, 13: 2}
OK	4381-85-5	CC(=NC)C(=NC)C	{1: 4, 34: 2, 7: 2}
OK	4382-76-7	CC(=O)OCOC	{1: 2, 2: 1, 28: 1, 22: 1}
OK	4383-67-9	C(#N)C(C#N)(C#N)C(C#N)(C#N)C#N	{4: 2, 37: 6}
OK	4385-04-0	CCCCCCN(C)C	{1: 3, 2: 5, 33: 1}
OK	4385-05-1	CN(C)CCN1CCOCC1	{1: 2, 2: 2, 11: 4, 33: 2, 23: 1}
OK	4385-91-5	COCCC(C(=O)O)N	{1: 1, 2: 2, 3: 1, 22: 1, 27: 1, 30: 1}
OK	4387-61-5	CC(C)C(=O)C(C)(C)C(=O)OCC(=C)C	{1: 5, 2: 1, 3: 1, 4: 1, 5: 1, 7: 1, 24: 1, 28: 1}
OK	4387-85-3	C=CC(=O)NC(C(=O)O)NC(=O)C=C	{3: 1, 5: 2, 6: 2, 24: 2, 27: 1, 31: 2}
OK	4388-03-8	C1CN1N2CC2	{33: 2, 11: 4}
OK	4388-87-8	CC(C)C(=O)C(=O)C(C)C	{24: 2, 1: 4, 3: 2}
OK	4388-88-9	CC(C)(C)C(=O)C(=O)C(C)(C)C	{24: 2, 1: 6, 4: 2}
OK	4390-04-9	CC(CC(C)(C)C)CC(C)(C)CC(C)(C)C	{1: 9, 2: 3, 3: 1, 4: 3}
OK	4394-85-8	C1COCCN1C=O	{33: 1, 26: 1, 11: 4, 23: 1}
OK	4394-93-8	C(N(F)F)(N(F)F)(F)F	{16: 6, 33: 2, 4: 1}
OK	4395-98-6	C1CNCCC1C#N	{32: 1, 11: 4, 12: 1, 37: 1}
OK	4396-01-4	CC(=O)CC1CCCCN1	{32: 1, 1: 1, 2: 1, 11: 4, 12: 1, 24: 1}
OK	4396-19-4	CCSCSCC	{40: 2, 1: 2, 2: 3}
OK	4398-65-6	CCCCC(C)(C)Cl	{1: 3, 2: 3, 4: 1, 17: 1}
OK	4399-47-7	C1CC(C1)Br	{18: 1, 11: 3, 12: 1}
OK	4402-30-6	CC(CN(C)CC(C)O)O	{1: 3, 2: 2, 3: 2, 20: 2, 33: 1}
OK	4402-32-8	CCN(CC)CC(C)O	{1: 3, 2: 3, 3: 1, 20: 1, 33: 1}
OK	4403-12-7	CCCCCCCCCCCCCOCCOCCOCCO	{1: 1, 2: 18, 20: 1, 22: 3}
OK	4408-64-4	CN(CC(=O)O)CC(=O)O	{1: 1, 2: 2, 27: 2, 33: 1}
OK	4409-99-8	C=COC=C=C	{8: 1, 22: 1, 5: 2, 6: 2}
OK	4411-25-0	C1C2CC3CC1CC(C2)(C3)N=C=O	{34: 1, 8: 1, 11: 6, 12: 3, 13: 1, 29: 1}
OK	4412-09-3	C1(C(=C(C(=O)O1)Cl)Cl)OC2C(=C(C(=O)O2)Cl)Cl	{17: 4, 12: 2, 28: 2, 22: 1, 15: 4}
OK	4412-16-2	CCCCCCCCCC=CC(=O)O	{1: 1, 2: 8, 27: 1, 6: 2}
OK	4413-13-2	CCCCOCCOCC	{1: 2, 2: 6, 22: 2}
OK	4413-21-2	CC(C1CCCC1)C2CCCC2	{11: 8, 1: 1, 3: 1, 12: 2}
OK	4415-82-1	C1CC(C1)CO	{20: 1, 2: 1, 11: 3, 12: 1}
OK	4419-39-0	C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)Cl)C	{1: 3, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 17: 1, 20: 3, 24: 1, 25: 1}
OK	4420-65-9	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)OC(=O)C)OC)O	{1: 5, 11: 10, 12: 10, 13: 3, 14: 1, 15: 1, 20: 2, 22: 2, 23: 1, 28: 2}
OK	4420-67-1	C[C@H]1[C@@H]([C@@H]([C@H](C(O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)OC(=O)C)O)C)C)O)OC)O	{1: 5, 11: 9, 12: 11, 13: 3, 14: 1, 15: 1, 20: 3, 22: 2, 23: 1, 28: 2}
OK	4421-32-3	C1C2C3CC4C1C5C2CC3C45	{11: 3, 12: 8}
OK	4422-06-4	C1CCCCCC(=O)/C(=N\O)/CCCC1	{25: 1, 34: 1, 11: 10, 20: 1, 15: 1}
OK	4423-79-4	C1CCC2(CC1)OCC(=O)O2	{11: 6, 28: 1, 13: 1, 23: 1}
OK	4423-94-3	CCC1CCCCC1=O	{1: 1, 2: 1, 11: 4, 12: 1, 25: 1}
OK	4425-67-6	C1C(=O)NC(=NC1=O)N	{32: 1, 35: 1, 11: 1, 15: 1, 25: 2, 30: 1}
OK	4426-11-3	C1CC(C1)C#N	{11: 3, 12: 1, 37: 1}
OK	4426-46-4	CCCCN=NC	{1: 2, 2: 3, 34: 2}
OK	4426-48-6	CCC(CN)N	{1: 1, 2: 2, 3: 1, 30: 2}
OK	4427-28-5	CC(=C)N	{1: 1, 5: 1, 30: 1, 7: 1}
OK	443-79-8	CCC(C)C(C(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	4430-31-3	C1CCC2C(C1)CCC(=O)O2	{28: 1, 11: 6, 12: 2}
OK	4431-82-7	CCOCOCOCOCC	{1: 2, 2: 5, 22: 4}
OK	4432-77-3	CCNC(C)(C)C	{1: 4, 2: 1, 4: 1, 31: 1}
OK	4434-66-6	CCCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 18, 18: 1}
OK	4435-14-7	C1CCC(CC1)CC#N	{2: 1, 11: 5, 12: 1, 37: 1}
OK	4435-18-1	C1CCC(=CC#N)CC1	{11: 5, 37: 1, 6: 1, 15: 1}
OK	4435-50-1	CC(C(CO)O)O	{1: 1, 2: 1, 3: 2, 20: 3}
OK	4435-53-4	CC(CCOC(=O)C)OC	{1: 3, 2: 2, 3: 1, 28: 1, 22: 1}
OK	4435-58-9	CCC(C)(C1CC1)O	{1: 2, 2: 1, 4: 1, 11: 2, 12: 1, 20: 1}
OK	4436-59-3	CC1CCCC(CC1=O)(C)C	{1: 3, 11: 4, 12: 1, 13: 1, 25: 1}
OK	4436-74-2	C(C=CCC(=O)O)C(=O)O	{2: 2, 27: 2, 6: 2}
OK	4436-75-3	CC(=O)C=CC(=O)C	{24: 2, 1: 2, 6: 2}
OK	4436-81-1	CC(=O)CCC1CC(=O)OC1(C)C	{1: 3, 2: 2, 11: 1, 12: 1, 13: 1, 24: 1, 28: 1}
OK	4436-99-1	CC(C)(C)CC(=O)CC(C)(C)C	{24: 1, 1: 6, 2: 2, 4: 2}
OK	4437-50-7	CC(CC(=O)C)C(=O)C	{24: 2, 1: 3, 2: 1, 3: 1}
OK	4437-51-8	CCC(=O)C(=O)CC	{24: 2, 1: 2, 2: 2}
OK	4439-20-7	C(CNCCO)NCCO	{2: 6, 20: 2, 31: 2}
OK	4439-24-1	CC(C)COCCO	{1: 2, 2: 3, 3: 1, 20: 1, 22: 1}
OK	4439-84-3	C([C@@H](C(=O)O)N)C(=O)CO	{2: 2, 3: 1, 20: 1, 24: 1, 27: 1, 30: 1}
OK	44391-42-6	C[C@H]([C@@H](C)N)N	{1: 2, 3: 2, 30: 2}
OK	444-27-9	C1C(NCS1)C(=O)O	{27: 1, 32: 1, 11: 2, 12: 1, 41: 1}
OK	4440-65-7	CCC=CCC=O	{1: 1, 2: 2, 26: 1, 6: 2}
OK	4441-57-0	C1CCC(CC1)CCCCO	{20: 1, 2: 4, 11: 5, 12: 1}
OK	4441-63-8	C1CCC(CC1)CCCC(=O)O	{27: 1, 2: 3, 11: 5, 12: 1}
OK	4441-66-1	C1CCC(CC1)CCCC#N	{2: 3, 11: 5, 12: 1, 37: 1}
OK	4442-79-9	C1CCC(CC1)CCO	{20: 1, 2: 2, 11: 5, 12: 1}
OK	4442-85-7	C1CCC(CC1)CCN	{2: 2, 11: 5, 12: 1, 30: 1}
OK	4443-48-5	CC1(C2CCC1(C(C2)Br)C)C	{1: 3, 18: 1, 11: 3, 12: 2, 13: 2}
OK	4443-55-4	CCCCCCCCCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 19, 11: 5, 12: 1}
OK	4443-56-5	CCCCCCCCCCCCCCCCCCC(C)C1CCCCC1	{11: 5, 1: 2, 2: 17, 3: 1, 12: 1}
OK	4443-57-6	CCCCCCCCCCCCCCCCCC(CC)C1CCCCC1	{11: 5, 1: 2, 2: 17, 3: 1, 12: 1}
OK	4443-58-7	CCCCCCCCCCCCCCCCC(CCC)C1CCCCC1	{11: 5, 1: 2, 2: 17, 3: 1, 12: 1}
OK	4443-59-8	CCCCCCCCCCCCCCCC(CCCC)C1CCCCC1	{11: 5, 1: 2, 2: 17, 3: 1, 12: 1}
OK	4443-61-2	CCCCCCCCCCCC(CCCCCCCC)C1CCCCC1	{11: 5, 1: 2, 2: 17, 3: 1, 12: 1}
OK	4443-65-6	CCCCCCCCCC(C(=O)CCCCCCCCC)O	{24: 1, 1: 2, 2: 16, 3: 1, 20: 1}
OK	4444-11-5	CCCCCCCC(C(=O)CCCCCCC)O	{24: 1, 1: 2, 2: 12, 3: 1, 20: 1}
OK	4444-12-6	CC=CCCC=CCCC=CCCCCC(=O)O	{1: 1, 2: 8, 27: 1, 6: 6}
OK	4444-68-2	CCCCN(CC)CC	{1: 3, 2: 5, 33: 1}
OK	4444-71-7	CCCCN(CCC)CCC	{1: 3, 2: 7, 33: 1}
OK	4445-06-1	CCCCCCCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 17, 11: 5, 12: 1}
OK	4446-87-1	CC(CCCl)OC	{1: 2, 2: 2, 3: 1, 22: 1, 17: 1}
OK	4447-21-6	CCC#CC#C	{1: 1, 2: 1, 10: 3, 9: 1}
OK	4447-60-3	CC(C)OC(OC(C)C)OC(C)C	{1: 6, 3: 4, 22: 3}
OK	4447-64-7	CCOC(=O)C(C)(C)C(=O)C(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 24: 1, 28: 1}
OK	4448-75-3	C1CCCC(CC1)CO	{20: 1, 2: 1, 11: 6, 12: 1}
OK	4448-77-5	C1CCCC(CC1)CN	{2: 1, 11: 6, 12: 1, 30: 1}
OK	4448-84-4	C1CCCC(CC1)CCN	{2: 2, 11: 6, 12: 1, 30: 1}
OK	4449-51-8	C[C@H]1C[C@@H]2[C@H]([C@H]([C@]3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5CC4=C3C)C)O)C)NC1	{32: 1, 1: 4, 11: 9, 12: 8, 13: 2, 14: 1, 15: 3, 20: 1, 23: 1}
OK	44513-62-4	CC(C)(C#N)N=O	{1: 2, 34: 1, 4: 1, 29: 1, 37: 1}
OK	4452-08-8	C(=C=O)C#N	{8: 1, 29: 1, 6: 1, 37: 1}
OK	44520-55-0	C[C@@H]([C@H](CO)N)O	{1: 1, 2: 1, 3: 2, 20: 2, 30: 1}
OK	4453-82-1	C1CCC(CC1)C(C2CCCCC2)O	{11: 10, 20: 1, 3: 1, 12: 2}
OK	4454-02-8	COC(CCCC(OC)OC)OC	{1: 4, 2: 3, 3: 2, 22: 4}
OK	4454-05-1	COC1CCC=CO1	{1: 1, 11: 2, 12: 1, 14: 2, 22: 1, 23: 1}
OK	4454-18-6	CC(CCC(C)C(=O)O)C(=O)O	{27: 2, 1: 2, 2: 2, 3: 2}
OK	4455-13-4	CCOC(=O)CSC	{40: 1, 1: 2, 2: 2, 28: 1}
OK	4455-26-9	CCCCCCCCN(C)CCCCCCCC	{1: 3, 2: 14, 33: 1}
OK	4457-00-5	CCCCCCC1CCCC1	{1: 1, 2: 5, 11: 4, 12: 1}
OK	4457-67-4	COCCCCBr	{1: 1, 2: 4, 18: 1, 22: 1}
OK	4457-71-0	CC(CCO)CCO	{1: 1, 2: 4, 3: 1, 20: 2}
OK	4457-72-1	CC(CCBr)CCBr	{1: 1, 2: 4, 3: 1, 18: 2}
OK	4458-31-5	CCCN(CC)CC	{1: 3, 2: 4, 33: 1}
OK	4458-32-6	CCCN(C)CC	{1: 3, 2: 3, 33: 1}
OK	4458-33-7	CCCCN(CC)CCCC	{1: 3, 2: 7, 33: 1}
OK	4459-18-1	C(C(F)(F)F)(C(F)(F)F)(C(F)(F)F)I	{16: 9, 19: 1, 4: 4}
OK	446-95-7	C1CCN2C[C@@H]3C[C@H]([C@@H]2C1)CN4[C@H]3CCCC4	{33: 2, 11: 11, 12: 4}
OK	44603-43-2	CCCC=[N+](C)[O-]	{1: 2, 2: 2, 29: 1, 6: 1, 33: 1}
OK	4461-30-7	C(C(=O)N=C=O)Cl	{2: 1, 8: 1, 34: 1, 17: 1, 24: 1, 29: 1}
OK	4461-39-6	C(CN)CNCCO	{2: 5, 20: 1, 30: 1, 31: 1}
OK	4461-42-1	CCC=CCl	{1: 1, 2: 1, 6: 2, 17: 1}
OK	4461-48-7	CC=CC(C)C	{1: 3, 3: 1, 6: 2}
OK	4461-87-4	CCCC(OC)OC	{1: 3, 2: 2, 3: 1, 22: 2}
OK	44657-76-3	CC(C)SC(C)(C)C	{40: 1, 1: 5, 3: 1, 4: 1}
OK	4468-66-0	CCC1C(O1)CC	{1: 2, 2: 2, 12: 2, 23: 1}
OK	4468-93-3	CCC(CC)COCCO	{1: 2, 2: 5, 3: 1, 20: 1, 22: 1}
OK	447-25-6	C([C@H]([C@@H]([C@@H]([C@H](C=O)O)O)O)O)F	{16: 1, 2: 1, 3: 4, 20: 4, 26: 1}
OK	4471-27-6	C1CCCC(=O)OCCOC(=O)CCC1	{11: 9, 28: 2}
OK	4471-47-0	C(=O)C#N	{26: 1, 37: 1}
OK	44745-29-1	CCCCC[C@H](C)N	{1: 2, 2: 4, 3: 1, 30: 1}
OK	4475-04-1	CCCCCCCCCCCCCCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 17, 3: 1}
OK	4475-23-4	CCCCCCCCCCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 13, 3: 1}
OK	4475-27-8	CCCCCCCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 10, 3: 1}
OK	4475-72-3	CC1(SSC(SS1)(C)C)C	{1: 4, 13: 2, 41: 4}
OK	4475-95-0	CCC(C)(C#N)N	{1: 2, 2: 1, 4: 1, 37: 1, 30: 1}
OK	4479-11-2	CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)O	{1: 3, 3: 1, 11: 9, 12: 6, 13: 2, 20: 2}
OK	4479-75-8	CC(=CC(=O)N)C	{24: 1, 1: 2, 30: 1, 6: 1, 7: 1}
OK	4480-98-2	C1CCCC(CC1)CCO	{20: 1, 2: 2, 11: 6, 12: 1}
OK	44804-88-8	CCOC(=O)C(=C)C=C	{1: 1, 2: 1, 5: 2, 6: 1, 7: 1, 28: 1}
OK	4481-88-3	CC1(C2CCC1(C(C2)N)C)C	{1: 3, 11: 3, 12: 2, 13: 2, 30: 1}
OK	44816-46-8	CCC(C)CSC(=N)N	{1: 2, 2: 2, 3: 1, 36: 1, 7: 1, 40: 1, 30: 1}
OK	4482-75-1	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
OK	4484-61-1	COCOCCO	{1: 1, 2: 3, 20: 1, 22: 2}
OK	4484-80-4	CCC(C)OC(=O)C(Cl)(Cl)Cl	{1: 2, 2: 1, 3: 1, 4: 1, 17: 3, 28: 1}
OK	4485-09-0	CCCCCC(=O)CCC	{24: 1, 1: 2, 2: 6}
OK	4485-13-6	CCCC(=CCC)CCC	{1: 3, 2: 5, 6: 1, 7: 1}
OK	4485-16-9	CCCC(=CCC)C	{1: 3, 2: 3, 6: 1, 7: 1}
OK	44860-68-6	C(CSCSCCO)O	{40: 2, 2: 5, 20: 2}
OK	4488-57-7	C1CC2CC1C3C2C=CC3	{11: 4, 12: 4, 14: 2}
OK	44914-03-6	CCC(C)COC(=O)C=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 28: 1}
OK	4492-73-3	C1[C@H]2[C@@H]([C@@H](S1)CCCCC(=O)O)NC(=O)N2.C1(C(=O)NC(=O)N1)NC(=O)N	{32: 4, 2: 4, 41: 1, 11: 1, 12: 4, 24: 1, 25: 3, 27: 1, 30: 1, 31: 1}
OK	4492-74-4	C(CC(=O)O)C(=O)O.C1(C(=O)NC(=O)N1)NC(=O)N	{32: 2, 2: 2, 12: 1, 24: 1, 25: 2, 27: 2, 30: 1, 31: 1}
OK	4493-23-6	C12C3C4C5C1C6C7C2C8C3C9C4C1C5C6C2C7C8C9C12	{12: 20}
OK	4493-42-9	CCCCCC=CC=CC(=O)OC	{1: 2, 2: 4, 28: 1, 6: 4}
OK	44958-25-0	CC(=O)OCCNCCO	{1: 1, 2: 4, 20: 1, 28: 1, 31: 1}
OK	4497-29-4	C(OCBr)Br	{2: 2, 18: 2, 22: 1}
OK	4497-92-1	CC1=C[C@H]2[C@H](C2(C)C)CC1	{1: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1}
OK	44976-81-0	CC(C)CN(C(C)C)C(C)C	{1: 6, 2: 1, 3: 3, 33: 1}
OK	44979-90-0	CCCCCCN(CC)CC	{1: 3, 2: 7, 33: 1}
OK	44987-62-4	CC(CCC(=O)Cl)CC(=O)Cl	{24: 2, 1: 1, 2: 3, 3: 1, 17: 2}
OK	4499-99-4	CCOCCOCCOCCOCC	{1: 2, 2: 8, 22: 4}
OK	4500-12-3	C1C2CC3CC1CC(C2)C3=NO	{20: 1, 34: 1, 11: 5, 12: 4, 15: 1}
OK	4500-29-2	C1CCC(CC1)N(CCO)CCO	{20: 2, 2: 4, 11: 5, 12: 1, 33: 1}
OK	4500-31-6	C1CCC(CC1)N(CCO)C2CCCCC2	{20: 1, 2: 2, 11: 10, 12: 2, 33: 1}
OK	45011-26-5	CC(=C)C(=O)N(CCO)CCO	{1: 1, 2: 4, 5: 1, 7: 1, 20: 2, 24: 1, 33: 1}
OK	45024-21-3	CC(CCCCN)CCCCN	{1: 1, 2: 8, 3: 1, 30: 2}
OK	4505-38-8	C1CC(=O)C=CC1=O	{25: 2, 11: 2, 14: 2}
OK	4509-90-4	C(CCBr)CC(=O)Cl	{24: 1, 17: 1, 2: 4, 18: 1}
OK	45102-52-1	CC(=C)C(=O)OCC(C(F)F)(F)F	{1: 1, 2: 1, 3: 1, 4: 1, 5: 1, 7: 1, 16: 4, 28: 1}
OK	45103-58-0	CC(=C)C(=O)OCCOCCOC	{1: 2, 2: 4, 5: 1, 7: 1, 22: 2, 28: 1}
OK	4511-42-6	C[C@H]1C(=O)O[C@H](C(=O)O1)C	{1: 2, 12: 2, 28: 2}
OK	45115-53-5	CC(=C)C(=O)OCC(C(F)(F)F)(F)F	{1: 1, 2: 1, 4: 2, 5: 1, 7: 1, 16: 5, 28: 1}
OK	45124-35-4	CCCCCCCCCN(CC)CC	{1: 3, 2: 10, 33: 1}
OK	4513-56-8	CC(=C)C(=O)OCCBr	{1: 1, 2: 2, 5: 1, 7: 1, 18: 1, 28: 1}
OK	4513-62-6	CC(CCC(=C)C(=O)OC)C(=O)OC	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1, 28: 2}
OK	4514-69-6	C1=CC=CC#CC=C1	{10: 2, 14: 6}
OK	4515-18-8	C1CCN(C(C1)C(=O)O)N=O	{33: 1, 34: 1, 11: 4, 12: 1, 27: 1, 29: 1}
OK	45158-84-7	CCCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 9, 3: 1}
OK	4516-69-2	CC1CCC(C1)(C)C	{1: 3, 11: 3, 12: 1, 13: 1}
OK	4516-90-9	CC(CO)C=C	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 20: 1}
OK	45163-99-3	CCCCCCCCCCOC(=O)CS	{1: 1, 2: 10, 28: 1, 39: 1}
OK	45165-81-9	CCCCCCCCCCCCCNC	{1: 2, 2: 12, 31: 1}
OK	452-61-9	C1C2C3C4C1C5C2C3C45	{11: 1, 12: 8}
OK	45206-91-5	CCCCCCCCCC(=O)CCCCCC	{24: 1, 1: 2, 2: 13}
OK	45210-10-4	CC(CNCCNCCNCCNCCN)O	{1: 1, 2: 9, 3: 1, 20: 1, 30: 1, 31: 4}
OK	45214-22-0	C(CCN)C[C@@H](C(=O)NCC(=O)O)NC(=O)CN	{2: 6, 3: 1, 24: 2, 27: 1, 30: 2, 31: 2}
OK	45223-18-5	C(CCCCCCCCBr)CCCCCCCBr	{2: 16, 18: 2}
OK	45235-48-1	CCCCCCCCC(CCCCCCCC)CO	{1: 2, 2: 15, 3: 1, 20: 1}
OK	4524-93-0	C1CCC(C1)C(=O)Cl	{24: 1, 17: 1, 11: 4, 12: 1}
OK	4524-95-2	CN1CC2CCC1C2	{1: 1, 11: 4, 12: 2, 33: 1}
OK	45243-86-5	C(CN(CCC#N)CCN(CCC#N)CCC#N)C#N	{33: 2, 2: 10, 37: 4}
OK	4525-25-1	C/C(=C/C(=O)OC)/O	{1: 2, 20: 1, 28: 1, 6: 1, 7: 1}
OK	4525-36-4	CCC(=O)N1C(CN(CC1C)C)C	{1: 4, 2: 1, 33: 2, 11: 2, 12: 2, 24: 1}
OK	45267-19-4	CCCCCCCCCCCCCC(=O)NCCCN(C)C	{24: 1, 1: 3, 2: 15, 33: 1, 31: 1}
OK	45267-68-3	C(CCC/C=C\C/C=C\CCCCC(=O)O)CCCC(=O)O	{2: 12, 27: 2, 6: 4}
OK	45270-09-5	CCCCCCCCCCCCCCCCCCSC(=N)N	{1: 1, 2: 17, 36: 1, 7: 1, 40: 1, 30: 1}
OK	45275-74-9	CCCCCCCCCCCCCCCCCCCCN(C)C	{1: 3, 2: 19, 33: 1}
OK	45296-12-6	CCCCCCCCC=CCCCCCCCC(=O)OCCN(CC)CC	{1: 3, 2: 18, 28: 1, 6: 2, 33: 1}
OK	45298-00-8	CCCCCC=CCC=CCCCCCCCC(=O)OCC(CC)CCCC	{1: 3, 2: 17, 3: 1, 28: 1, 6: 4}
OK	453-13-4	C(C(CF)O)F	{16: 2, 2: 2, 3: 1, 20: 1}
OK	453-14-5	C(C(=O)CF)F	{16: 2, 24: 1, 2: 2}
OK	453-16-7	C(C(CF)O)O	{16: 1, 2: 2, 3: 1, 20: 2}
OK	453-17-8	C([C@H](C=O)O)O	{2: 1, 3: 1, 20: 2, 26: 1}
OK	453-18-9	COC(=O)CF	{16: 1, 1: 1, 2: 1, 28: 1}
OK	453-20-3	C1COCC1O	{20: 1, 11: 3, 12: 1, 23: 1}
OK	453-43-0	CCCCCCC(C(F)(F)F)O	{1: 1, 2: 5, 3: 1, 4: 1, 16: 3, 20: 1}
OK	4530-20-5	CC(C)(C)OC(=O)NCC(=O)O	{1: 3, 2: 1, 4: 1, 27: 1, 28: 1, 31: 1}
OK	45313-33-5	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 35, 30: 1}
OK	45316-02-7	CC(C)CCCC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)CCCC(C)C	{1: 10, 2: 22, 3: 8}
OK	4532-64-3	CC(C(C)S)S	{1: 2, 3: 2, 39: 2}
OK	45320-65-8	CCCCCCCCC=CCCCCCCCC(=O)NCCCN(C)CCCNC(=O)CCCCCCCC=CCCCCCCCC	{1: 3, 2: 34, 6: 4, 33: 1, 24: 2, 31: 2}
OK	45323-23-7	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCO)C(=O)N(CCNC(=O)CCCCCCCCCCCCCCCCC)CCO	{1: 2, 2: 40, 33: 2, 20: 2, 24: 3, 31: 2}
OK	4533-25-9	C1CCC#CCCCCC#CCC1	{10: 4, 11: 9}
OK	4534-74-1	CCC1CCC(CC1)O	{1: 1, 2: 1, 11: 4, 12: 2, 20: 1}
OK	4535-87-9	CCNCCCl.Cl	{1: 1, 2: 3, 31: 1, 17: 2}
OK	4535-90-4	CNCCCl.Cl	{1: 1, 2: 2, 31: 1, 17: 2}
OK	4536-23-6	CCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 3, 3: 1}
OK	4536-26-9	CCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCC	{1: 2, 2: 27, 28: 1}
OK	4536-30-5	CCCCCCCCCCCCOCCO	{1: 1, 2: 13, 20: 1, 22: 1}
OK	4538-37-8	C(CCN=C=O)CN=C=O	{8: 2, 2: 4, 34: 2, 29: 2}
OK	4538-39-0	C(CCCCCN=C=O)CCCCN=C=O	{8: 2, 2: 10, 34: 2, 29: 2}
OK	454-14-8	CN1CCC[C@H]1CC(=O)CC2CCCN2C	{1: 2, 2: 2, 33: 2, 11: 6, 12: 2, 24: 1}
OK	454-29-5	C(CS)C(C(=O)O)N	{27: 1, 2: 2, 3: 1, 30: 1, 39: 1}
OK	454-31-9	CCOC(=O)C(F)F	{16: 2, 1: 1, 2: 1, 3: 1, 28: 1}
OK	4540-44-7	C(C(CBr)O)Cl	{17: 1, 2: 2, 3: 1, 20: 1, 18: 1}
OK	4541-32-6	CC1(CCCC1=O)C	{1: 2, 11: 3, 13: 1, 25: 1}
OK	4541-35-9	CC1(CCC(C1=O)(C)C)C	{1: 4, 11: 2, 13: 2, 25: 1}
OK	4542-46-5	C1COCCN1CCS	{33: 1, 2: 2, 11: 4, 39: 1, 23: 1}
OK	4542-47-6	C1COCCN1CCC#N	{33: 1, 2: 2, 11: 4, 37: 1, 23: 1}
OK	4542-57-8	CCCCCCCCCCCCOCCCCCCCCCCCC	{1: 2, 2: 22, 22: 1}
OK	4543-66-2	C(CCCCCC#N)CCCCC#N	{2: 10, 37: 2}
OK	4543-96-8	CNCCCN(C)C	{1: 3, 2: 3, 33: 1, 31: 1}
OK	4544-26-7	CC(=C=C1C2C1CCCC2)C	{1: 2, 7: 1, 8: 1, 11: 4, 12: 2, 15: 1}
OK	4545-68-0	CC1=CCC[C@]2([C@@]13CCC2C(C3)(C)C)C	{1: 4, 11: 5, 12: 1, 13: 3, 14: 1, 15: 1}
OK	45467-40-1	C([C@@H]1[C@H](O1)CCl)Cl	{17: 2, 2: 2, 12: 2, 23: 1}
OK	4548-06-5	C1C[CH]C1	{11: 3, 14: 1}
OK	4549-31-9	C(CCCBr)CCCBr	{2: 7, 18: 2}
OK	4549-32-0	C(CCCCBr)CCCBr	{2: 8, 18: 2}
OK	4549-33-1	C(CCCCBr)CCCCBr	{2: 9, 18: 2}
OK	4549-40-0	CN(C=C)N=O	{1: 1, 34: 1, 5: 1, 6: 1, 33: 1, 29: 1}
OK	4549-43-3	CN(CC=C)N=O	{1: 1, 2: 1, 5: 1, 6: 1, 33: 1, 34: 1, 29: 1}
OK	4549-44-4	CCCCN(CC)N=O	{1: 2, 2: 4, 34: 1, 29: 1, 33: 1}
OK	4553-62-2	CC(CCC#N)C#N	{1: 1, 2: 2, 3: 1, 37: 2}
OK	4553-64-4	C(=C/SC#N)\SC#N	{40: 2, 37: 2, 6: 2}
OK	4554-00-1	CCCCCCCC(=O)OCCC(C)OC(=O)CCCCCCC	{1: 3, 2: 14, 3: 1, 28: 2}
OK	4554-16-9	C(C(C#N)Br)Br	{2: 1, 3: 1, 18: 2, 37: 1}
OK	4558-27-4	CC(CCC=C)Br	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 18: 1}
OK	4559-86-8	CCCCN(CCCC)C(=O)N(CCCC)CCCC	{24: 1, 1: 4, 2: 12, 33: 2}
OK	4561-75-5	CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4=CC(=C)CCC34C)C	{1: 5, 2: 3, 3: 2, 5: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 2}
OK	4562-27-0	C1=CN=CNC1=O	{32: 1, 25: 1, 35: 1, 14: 3}
OK	4562-36-1	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(C[C@@H]([C@@H]7C8=CC(=O)OC8)O)O)C)C)C)C)O)O	{1: 5, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 6, 22: 3, 23: 3, 28: 1}
OK	4564-87-8	C[C@@H]1C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O[C@@H](C[C@H]2[C@@H](O2)/C=C/C1=O)C)OC(=O)C)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C)O[C@H]4C[C@@]([C@H]([C@@H](O4)C)OC(=O)CC(C)C)(C)O)N(C)C)O)CC=O	{1: 11, 2: 2, 3: 1, 33: 1, 11: 4, 12: 16, 13: 1, 14: 2, 20: 2, 22: 3, 23: 3, 25: 1, 26: 1, 28: 3}
OK	45651-41-0	CC12CCN(CC1)CC2	{1: 1, 11: 6, 13: 1, 33: 1}
OK	4567-22-0	CC1(CCC(N1)(C)C)C	{32: 1, 1: 4, 11: 2, 13: 2}
OK	4567-98-0	COC(=O)CCCCCCCCCC(=O)OC	{1: 2, 2: 9, 28: 2}
OK	45676-04-8	CC(C)(C)N1C=CN=C1	{1: 3, 35: 1, 4: 1, 14: 3, 33: 1}
OK	4572-03-6	CN1CCN(CC1)CCCN	{1: 1, 2: 3, 11: 4, 30: 1, 33: 2}
OK	4572-17-2	C12C3C4C1C5C2C6C3C4C56	{12: 10}
OK	4573-05-1	CC1=CC(=CCC1)C	{1: 2, 11: 2, 14: 2, 15: 2}
OK	4573-09-5	CC1CCC(C1=O)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 25: 1}
OK	45732-65-8	CCC12CCN(CC1)CC2	{1: 1, 2: 1, 11: 6, 13: 1, 33: 1}
OK	45744-18-1	C1=CC(=C(N)N)C(=O)C=C1	{25: 1, 15: 1, 30: 2, 14: 4, 7: 1}
OK	45776-10-1	CCCCCC(=O)N1CC1	{24: 1, 1: 1, 2: 4, 11: 2, 33: 1}
OK	458-88-8	CCC[C@H]1CCCCN1	{32: 1, 1: 1, 2: 2, 11: 4, 12: 1}
OK	4580-43-2	C#CCCCCCC#CCCCCCC#C	{9: 2, 2: 10, 10: 4}
OK	4582-21-2	C1C2C=CC1C(C2C(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 11: 1, 12: 4, 14: 2}
OK	4584-23-0	CC1=CCC2(CC1)C(O2)(C)C	{1: 3, 11: 3, 13: 2, 14: 1, 15: 1, 23: 1}
OK	4584-46-7	CN(C)CCCl.Cl	{1: 2, 2: 2, 33: 1, 17: 2}
OK	4584-49-0	CC(CN(C)C)Cl.Cl	{1: 3, 2: 1, 3: 1, 33: 1, 17: 2}
OK	45842-68-0	CC(C)C12CCN(CC1)CC2	{11: 6, 1: 2, 3: 1, 13: 1, 33: 1}
OK	4586-22-5	CC1(CC2C(C1)C3(CCCC2(C3O)C)C)C	{1: 4, 11: 5, 12: 3, 13: 3, 20: 1}
OK	4588-18-5	CCCCCCC(=C)C	{1: 2, 2: 5, 5: 1, 7: 1}
OK	459-67-6	C1C[C@H](C=C1)CCCCCCCCCCC(=O)O	{27: 1, 2: 10, 11: 2, 12: 1, 14: 2}
OK	459-72-3	CCOC(=O)CF	{16: 1, 1: 1, 2: 2, 28: 1}
OK	459-73-4	CCOC(=O)CN	{1: 1, 2: 2, 28: 1, 30: 1}
OK	459-80-3	CC(=CCCC(=CC(=O)O)C)C	{1: 3, 2: 2, 27: 1, 6: 2, 7: 2}
OK	459-99-4	C(CF)OC(=O)CF	{16: 2, 2: 3, 28: 1}
OK	4591-28-0	C(=C(Cl)Cl)=O	{8: 1, 17: 2, 29: 1, 7: 1}
OK	4592-97-6	CC1=C(C(=O)C(=C(C1=O)Cl)Cl)Cl	{1: 1, 17: 3, 25: 2, 15: 4}
OK	4593-16-2	CC1CCCN(C1)C(=O)C	{24: 1, 1: 2, 11: 4, 12: 1, 33: 1}
OK	4594-78-9	C1CCC(=O)C(C1)CCC#N	{25: 1, 2: 2, 11: 4, 12: 1, 37: 1}
OK	4598-47-4	C1CO[CH]CO1	{11: 3, 14: 1, 23: 2}
OK	45980-26-5	CC(C)(C)C12CCN(CC1)CC2	{1: 3, 11: 6, 4: 1, 13: 1, 33: 1}
OK	460-07-1	CC(=O)N1CC1	{24: 1, 1: 1, 11: 2, 33: 1}
OK	460-12-8	C#CC#C	{9: 2, 10: 2}
OK	460-13-9	CCCF	{16: 1, 1: 1, 2: 2}
OK	460-16-2	C(=CCl)F	{16: 1, 17: 1, 6: 2}
OK	460-19-5	C(#N)C#N	{37: 2}
OK	460-22-0	COCF	{16: 1, 1: 1, 2: 1, 22: 1}
OK	460-32-2	C(CBr)C(F)(F)F	{16: 3, 2: 2, 4: 1, 18: 1}
OK	460-34-4	CCCC(F)(F)F	{16: 3, 1: 1, 2: 2, 4: 1}
OK	460-35-5	C(CCl)C(F)(F)F	{16: 3, 17: 1, 2: 2, 4: 1}
OK	460-36-6	C(CF)C(F)(F)F	{16: 4, 2: 2, 4: 1}
OK	460-37-7	C(CI)C(F)(F)F	{16: 3, 2: 2, 19: 1, 4: 1}
OK	460-39-9	C(CN)C(F)(F)F	{16: 3, 2: 2, 4: 1, 30: 1}
OK	460-40-2	C(C=O)C(F)(F)F	{16: 3, 2: 1, 4: 1, 26: 1}
OK	460-43-5	COCC(F)(F)F	{16: 3, 1: 1, 2: 1, 4: 1, 22: 1}
OK	460-58-2	C(SC(F)(F)F)Cl	{16: 3, 17: 1, 2: 1, 4: 1, 40: 1}
OK	460-69-5	C(C(Cl)Cl)C(F)(F)F	{16: 3, 17: 2, 2: 1, 3: 1, 4: 1}
OK	460-70-8	C(=C(Cl)Cl)C(F)(F)F	{16: 3, 17: 2, 4: 1, 6: 1, 7: 1}
OK	460-71-9	C(=C(F)Cl)C(F)(F)F	{16: 4, 17: 1, 4: 1, 6: 1, 7: 1}
OK	460-73-1	C(C(F)F)C(F)(F)F	{16: 5, 2: 1, 3: 1, 4: 1}
OK	460-92-4	C(C(F)(F)F)C(F)(F)Cl	{16: 5, 17: 1, 2: 1, 4: 2}
OK	46010-98-4	CC1=C(C(=O)C(=C(C1=O)Cl)C)Cl	{1: 2, 17: 2, 25: 2, 15: 4}
OK	4602-83-9	C1CNC=C2C1=CC(=O)C(=C2)O	{32: 1, 11: 2, 14: 3, 15: 3, 20: 1, 25: 1}
OK	4602-84-0	CC(=CCCC(=CCCC(=CCO)C)C)C	{1: 4, 2: 5, 20: 1, 6: 3, 7: 3}
OK	4605-14-5	C(CN)CNCCCNCCCN	{2: 9, 30: 2, 31: 2}
OK	4606-07-9	CCOC(=O)C1CC1	{1: 1, 2: 1, 11: 2, 12: 1, 28: 1}
OK	4606-65-9	C1CC(CNC1)CO	{32: 1, 20: 1, 2: 1, 11: 4, 12: 1}
OK	46061-25-0	CC(C)(C)C1CCN(CC1)N=O	{1: 3, 34: 1, 4: 1, 33: 1, 11: 4, 12: 1, 29: 1}
OK	4609-87-4	CCCCCCCCCC[N+](=O)[O-]	{1: 1, 2: 9, 38: 1}
OK	4609-89-6	CCCC(C)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 38: 1}
OK	461-11-0	CC(=O)CCCC(C)(C)C(=O)O	{24: 1, 1: 3, 2: 3, 27: 1, 4: 1}
OK	461-18-7	C(CC(F)(F)F)CO	{16: 3, 20: 1, 2: 3, 4: 1}
OK	461-24-5	CCOCC(F)(F)F	{16: 3, 1: 1, 2: 2, 4: 1, 22: 1}
OK	461-53-0	CCCC(=O)F	{16: 1, 1: 1, 2: 2, 24: 1}
OK	461-56-3	C(CF)C(=O)O	{16: 1, 2: 2, 27: 1}
OK	461-58-5	C(#N)N=C(N)N	{34: 1, 37: 1, 30: 2, 7: 1}
OK	461-68-7	C(=C(F)F)=C(F)F	{8: 1, 16: 4, 7: 2}
OK	461-72-3	C1C(=O)NC(=O)N1	{32: 2, 25: 2, 11: 1}
OK	461-89-2	C1=NNC(=O)NC1=O	{32: 2, 25: 2, 35: 1, 14: 1}
OK	461-92-7	CC(C)CC(=O)CC(=O)C(F)(F)F	{1: 2, 2: 2, 3: 1, 4: 1, 16: 3, 24: 2}
OK	4611-05-6	CC1CC(OC12CCC3(C2CC=C(C4C(C3)C(CC4=O)(C)O)C=O)C)C=C(C)C	{1: 5, 6: 1, 7: 1, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 20: 1, 23: 1, 25: 1, 26: 1}
OK	4613-38-1	CC(=CCC/C(=C\C(=O)O)/C)C	{1: 3, 2: 2, 27: 1, 6: 2, 7: 2}
OK	4616-73-3	CCCCCCCCCCCCCCCCCCCC#N	{1: 1, 2: 18, 37: 1}
OK	4617-17-8	C(CSC#N)OCCSC#N	{40: 2, 2: 4, 37: 2, 22: 1}
OK	4618-18-2	C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@@]([C@H]2O)(CO)O)CO)O)O)O)O	{2: 3, 12: 8, 13: 1, 20: 8, 22: 1, 23: 2}
OK	4619-66-3	CC(=O)C(C(=O)C)C(=O)OC	{24: 2, 1: 3, 3: 1, 28: 1}
OK	462-18-0	CCCCCCC(=O)CCCCCC	{24: 1, 1: 2, 2: 10}
OK	462-20-4	C(CCC(=O)O)CC(CCS)S	{27: 1, 2: 6, 3: 1, 39: 2}
OK	462-23-7	C(CC(=O)O)CF	{16: 1, 2: 3, 27: 1}
OK	462-26-0	CC(=O)OCCF	{16: 1, 1: 1, 2: 2, 28: 1}
OK	462-27-1	C(CF)OC(=O)Cl	{16: 1, 17: 1, 2: 2, 28: 1}
OK	462-39-5	C(CF)CF	{16: 2, 2: 3}
OK	462-41-9	C(CN)CF	{16: 1, 2: 3, 30: 1}
OK	462-43-1	C(CO)CF	{16: 1, 2: 3, 20: 1}
OK	462-60-2	C(C(=O)O)NC(=O)N	{24: 1, 2: 1, 27: 1, 30: 1, 31: 1}
OK	462-72-6	C(CCBr)CF	{16: 1, 2: 4, 18: 1}
OK	462-73-7	C(CCCl)CF	{16: 1, 17: 1, 2: 4}
OK	462-74-8	C(CC=O)CF	{16: 1, 2: 3, 26: 1}
OK	462-89-5	CCN(CC(F)(F)F)F	{16: 4, 1: 1, 2: 2, 4: 1, 33: 1}
OK	462-94-2	C(CCN)CCN	{2: 5, 30: 2}
OK	462-95-3	CCOCOCC	{1: 2, 2: 3, 22: 2}
OK	4620-70-6	CC(C)(C)NCCO	{1: 3, 2: 2, 4: 1, 20: 1, 31: 1}
OK	4621-04-9	CC(C)C1CCC(CC1)O	{11: 4, 1: 2, 3: 1, 12: 2, 20: 1}
OK	4622-04-2	C1=CC(=O)C(=C(C1=O)C#N)C#N	{25: 2, 37: 2, 14: 2, 15: 2}
OK	4625-24-5	CC12CCCC1C2	{1: 1, 11: 4, 12: 1, 13: 1}
OK	463-04-7	CCCCCON=O	{1: 1, 2: 4, 34: 1, 29: 1, 22: 1}
OK	463-11-6	CCCCCCCCF	{16: 1, 1: 1, 2: 7}
OK	463-17-2	C(CCCCCF)CCCCC(=O)O	{16: 1, 2: 10, 27: 1}
OK	463-18-3	CCCCCCCCCF	{16: 1, 1: 1, 2: 8}
OK	463-23-0	C(CCCCF)CCCCCl	{16: 1, 17: 1, 2: 9}
OK	463-24-1	C(CCCCO)CCCCF	{16: 1, 2: 9, 20: 1}
OK	463-33-2	C(CCCCCF)CCCCCBr	{16: 1, 2: 11, 18: 1}
OK	463-40-1	CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O	{1: 1, 2: 10, 27: 1, 6: 6}
OK	463-49-0	C=C=C	{8: 1, 5: 2}
OK	463-51-4	C=C=O	{8: 1, 5: 1, 29: 1}
OK	463-56-9	C(#N)S	{37: 1, 39: 1}
OK	463-57-0	C(O)O	{2: 1, 20: 2}
OK	463-72-9	N=C(O)Cl	{17: 1, 20: 1, 36: 1, 7: 1}
OK	463-82-1	CC(C)(C)C	{1: 4, 4: 1}
OK	4630-07-3	CC1CCC=C2C1(CC(CC2)C(=C)C)C	{1: 3, 5: 1, 7: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 1}
OK	4630-80-2	COC(=O)C1CCCC1	{1: 1, 11: 4, 12: 1, 28: 1}
OK	4630-82-4	COC(=O)C1CCCCC1	{1: 1, 11: 5, 12: 1, 28: 1}
OK	4630-83-5	CC1(CCCC1)C(=O)OC	{1: 2, 11: 4, 28: 1, 13: 1}
OK	4634-77-9	C1C2CC(C1C=C2)(Cl)Cl	{17: 2, 11: 2, 12: 2, 13: 1, 14: 2}
OK	4635-59-0	C(CC(=O)Cl)CCl	{24: 1, 17: 2, 2: 3}
OK	4635-87-4	CC=CCC#N	{1: 1, 2: 1, 37: 1, 6: 2}
OK	46350-29-2	C[C@H](CN)N1CCN(CC1)[C@@H](C)CN	{1: 2, 2: 2, 3: 2, 33: 2, 11: 4, 30: 2}
OK	4637-24-5	CN(C)C(OC)OC	{1: 4, 3: 1, 22: 2, 33: 1}
OK	4638-03-3	C=CCOCC(CCl)O	{2: 3, 3: 1, 5: 1, 6: 1, 17: 1, 20: 1, 22: 1}
OK	464-06-2	CC(C)C(C)(C)C	{1: 5, 3: 1, 4: 1}
OK	464-07-3	CC(C(C)(C)C)O	{1: 4, 3: 1, 4: 1, 20: 1}
OK	464-10-8	C([N+](=O)[O-])(Br)(Br)Br	{18: 3, 4: 1, 38: 1}
OK	464-15-3	CC1(C2CCC1(CC2)C)C	{1: 3, 11: 4, 12: 1, 13: 2}
OK	464-17-5	CC1(C2CCC1(C=C2)C)C	{1: 3, 11: 2, 12: 1, 13: 2, 14: 2}
OK	464-36-8	C(C(C(OC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 22, 4: 10, 22: 1}
OK	464-41-5	CC1(C2CCC1(C(C2)Cl)C)C	{1: 3, 11: 3, 12: 2, 13: 2, 17: 1}
OK	464-45-9	C[C@]12CC[C@@H](C1(C)C)C[C@H]2O	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	464-88-0	CC1CCC(C1(C)C)(C)C(=O)O	{27: 1, 1: 4, 11: 2, 12: 1, 13: 2}
OK	4641-78-5	C#CCCCCCC#CCCCCCC#CCCCCCC#C	{9: 2, 2: 15, 10: 6}
OK	4643-25-8	CCCC(=O)C=CC	{24: 1, 1: 2, 2: 2, 6: 2}
OK	4643-27-0	CCCCC(=O)C=CC	{24: 1, 1: 2, 2: 3, 6: 2}
OK	4643-94-1	CCCCCCCC=C=CCCCCCCCC(=O)O	{8: 1, 1: 1, 2: 13, 27: 1, 6: 2}
OK	4645-15-2	C1CCC(CC1)OC2CCCCC2	{11: 10, 12: 2, 22: 1}
OK	465-16-7	C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3(C(C2)CCC4C3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)O	{1: 5, 11: 10, 12: 10, 13: 3, 14: 1, 15: 1, 20: 2, 22: 2, 23: 1, 28: 2}
OK	465-28-1	CC1=CCC2(CC[C@@H](C2(CC1)O)C(C)C)C	{1: 4, 3: 1, 11: 5, 12: 1, 13: 2, 14: 1, 15: 1, 20: 1}
OK	465-42-9	CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(=O)[C@@]2(C[C@H](CC2(C)C)O)C)/C)/C	{1: 10, 6: 14, 7: 4, 11: 4, 12: 2, 13: 3, 15: 2, 20: 2, 24: 1}
OK	465-58-7	CCC(C)(C(=O)O)N	{1: 2, 2: 1, 27: 1, 4: 1, 30: 1}
OK	465-69-0	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2(C(=O)C[C@]4([C@H]3CC[C@]4(C)O)C)F	{1: 3, 11: 7, 12: 2, 13: 4, 14: 1, 15: 1, 16: 1, 20: 1, 25: 2}
OK	465-74-7	C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C(=O)O)C(=O)O	{1: 6, 11: 9, 12: 6, 13: 5, 14: 1, 15: 1, 20: 1, 27: 2}
OK	465-99-6	C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)CO)O	{1: 6, 2: 1, 11: 10, 12: 4, 13: 6, 14: 1, 15: 1, 20: 2, 27: 1}
OK	4651-48-3	CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)C(C)C	{1: 7, 2: 1, 3: 3, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	4652-27-1	CC(=O)C=COC	{24: 1, 1: 2, 22: 1, 6: 2}
OK	4655-34-9	CC(C)OC(=O)C(=C)C	{1: 3, 3: 1, 28: 1, 5: 1, 7: 1}
OK	466-81-9	CO[C@@H]1C[C@]23C4=C(CCN2CC=C3C=C1)COC(=O)C4	{1: 1, 33: 1, 11: 6, 12: 1, 13: 1, 14: 3, 15: 3, 22: 1, 28: 1}
OK	4663-22-3	CC(=C)C1CC1	{1: 1, 11: 2, 12: 1, 5: 1, 7: 1}
OK	467-55-0	CC1CCC2(C(C3C(O2)CC4C3(C(=O)CC5C4CCC6C5(CCC(C6)O)C)C)C)OC1	{1: 4, 11: 10, 12: 9, 13: 3, 20: 1, 23: 2, 25: 1}
OK	467-90-3	CCC1(C(=O)C(=CNC1=O)C)CC	{32: 1, 1: 3, 2: 2, 13: 1, 14: 1, 15: 1, 25: 2}
OK	46729-07-1	CC(=C)C(=O)OC1CCC(CC1)C(C)(C)C	{1: 4, 4: 1, 5: 1, 7: 1, 11: 4, 12: 2, 28: 1}
OK	4673-33-0	CCCCCCCCCCCCCCCCOCCCN	{1: 1, 2: 18, 30: 1, 22: 1}
OK	4674-50-4	CC1CC(=O)C=C2C1(CC(CC2)C(=C)C)C	{1: 3, 5: 1, 7: 1, 11: 4, 12: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	4675-87-0	CC=C(C)CO	{1: 2, 2: 1, 20: 1, 6: 1, 7: 1}
OK	4676-51-1	CCOC(=O)CC(C)C(=O)OCC	{1: 3, 2: 3, 3: 1, 28: 2}
OK	4676-82-8	C1CC(OC1)OO	{20: 1, 11: 3, 12: 1, 22: 1, 23: 1}
OK	4678-44-8	C[C@]1(C[C@@]23C[C@H]([C@]4([C@@H](C[C@@H](C4(C)C)O)C(=C)[C@@H]2CC[C@@H]1C3O)O)O)O	{1: 3, 5: 1, 11: 5, 12: 6, 13: 4, 15: 1, 20: 5}
OK	4678-45-9	CC1(C(CC2C1(C(CC34CC(C(C3O)CCC4C2(C)O)(C)O)O)O)O)C	{1: 4, 11: 5, 12: 6, 13: 5, 20: 6}
OK	468-28-0	CC(C)CC(=O)C1=C(C(=C(C(C1=O)(CC=C(C)C)CC=C(C)C)O)CC=C(C)C)O	{1: 8, 2: 4, 3: 1, 6: 3, 7: 3, 13: 1, 15: 4, 20: 2, 24: 1, 25: 1}
OK	468-45-1	C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)CO)C	{1: 3, 2: 1, 33: 1, 11: 10, 12: 9, 13: 2, 14: 1, 15: 1, 20: 2}
OK	468-84-8	CC1(CCCC2(C1CCC3(C2CCC(=O)O3)C)C)C	{1: 4, 11: 7, 12: 2, 13: 3, 28: 1}
OK	4683-45-8	CC1(CC(=CC(=O)C1)OC)C	{1: 3, 11: 2, 13: 1, 14: 1, 15: 1, 22: 1, 25: 1}
OK	4685-12-5	C([C@@H](C(=O)O)NC(=O)CN)C(=O)O	{2: 2, 3: 1, 24: 1, 27: 2, 30: 1, 31: 1}
OK	4687-77-8	CC1C=C(CCC1C=CC(=O)C)C	{1: 3, 6: 2, 11: 2, 12: 2, 14: 1, 15: 1, 24: 1}
OK	4688-60-2	CN(C)CC=CC=C=O	{1: 2, 2: 1, 6: 3, 33: 1, 8: 1, 29: 1}
OK	469-59-0	C[C@H]1C[C@@H]2[C@H]([C@H]([C@]3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5C(=O)C4=C3C)C)O)C)NC1	{32: 1, 1: 4, 11: 8, 12: 8, 13: 2, 14: 1, 15: 3, 20: 1, 23: 1, 25: 1}
OK	469-61-4	C[C@@H]1CC[C@@H]2C13CC=C(C(C3)C2(C)C)C	{1: 4, 11: 4, 12: 3, 13: 2, 14: 1, 15: 1}
OK	469-92-1	C[C@@]12CCC[C@]3(C1)C=CC([C@@H]3CC2)(C)C	{1: 3, 11: 6, 12: 1, 13: 3, 14: 2}
OK	4693-47-4	CC(CCCO)(C#N)N=NC(C)(CCCO)C#N	{1: 2, 2: 6, 4: 2, 37: 2, 34: 2, 20: 2}
OK	4694-12-6	CC1CC(CC1=O)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 25: 1}
OK	4694-17-1	CC1(CC=CC(=O)C1)C	{1: 2, 11: 2, 13: 1, 14: 2, 25: 1}
OK	4695-31-2	CC(C)(C(=O)O)S	{1: 2, 27: 1, 4: 1, 39: 1}
OK	4696-27-9	CC=COC=CC	{1: 2, 22: 1, 6: 4}
OK	4696-28-0	C/C=C/O/C=C/C	{1: 2, 22: 1, 6: 4}
OK	4696-29-1	C/C=C/O/C=C\C	{1: 2, 22: 1, 6: 4}
OK	4696-76-8	C1C(C(C(C(C1N)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(C(C(C(O3)CN)O)O)N)N	{2: 2, 11: 1, 12: 15, 20: 6, 22: 2, 23: 2, 30: 5}
OK	4697-83-0	C1CCN2[C@@H](C1)[C@@H]3C[C@@H](C2=O)[C@@H]4CCCC(=O)N4C3	{25: 2, 11: 9, 12: 4, 33: 2}
OK	470-08-6	C[C@]12CC[C@H](C1)C([C@@H]2O)(C)C	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	470-40-6	CC1=CC[C@@]2(CCCC([C@]23[C@H]1C3)(C)C)C	{1: 4, 11: 5, 12: 1, 13: 3, 14: 1, 15: 1}
OK	470-43-9	CC(C)C1(OCC(O1)CO)C(C)C	{1: 4, 2: 1, 3: 2, 11: 1, 12: 1, 13: 1, 20: 1, 23: 2}
OK	470-44-0	C1(=O)C(NC(=O)N1)(C(=O)O)O	{32: 2, 25: 2, 27: 1, 20: 1, 13: 1}
OK	470-49-5	CC(=O)CC(C)(C)C(=O)O	{24: 1, 1: 3, 2: 1, 27: 1, 4: 1}
OK	470-55-3	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)OC[C@@H]3[C@@H]([C@@H]([C@H]([C@H](O3)O[C@]4([C@H]([C@@H]([C@H](O4)CO)O)O)CO)O)O)O)O)O)O)O)O)O)O	{2: 5, 12: 18, 13: 1, 20: 14, 22: 3, 23: 4}
OK	470-67-7	CC(C)C12CCC(O1)(CC2)C	{11: 4, 1: 3, 3: 1, 13: 2, 23: 1}
OK	470-82-6	CC1(C2CCC(O1)(CC2)C)C	{1: 3, 11: 4, 12: 1, 13: 2, 23: 1}
OK	470-99-5	CC1=CC(CC(C1)(C)C)O	{1: 3, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	4702-32-3	C1C(C(OC1=O)C(=O)O)C(=O)O	{27: 2, 28: 1, 11: 1, 12: 2}
OK	4704-31-8	CCCCCCCCCC(=O)OC=C	{1: 1, 2: 8, 28: 1, 5: 1, 6: 1}
OK	4704-77-2	C(C(CBr)O)O	{2: 2, 3: 1, 20: 2, 18: 1}
OK	4704-94-3	C(C(CO)CO)O	{2: 3, 3: 1, 20: 3}
OK	4706-81-4	CCCCCCCCCCCCC(C)O	{1: 2, 2: 11, 3: 1, 20: 1}
OK	4709-59-5	CCOC(=O)CC1=CCCCC1	{1: 1, 2: 2, 11: 4, 14: 1, 15: 1, 28: 1}
OK	471-04-5	CC(=O)CC(C)(C)CCC(=O)O	{24: 1, 1: 3, 2: 3, 27: 1, 4: 1}
OK	471-05-6	CC1=CCC(C=CC(=O)C(=CCC1)C)(C)C	{1: 4, 11: 3, 13: 1, 14: 4, 15: 2, 25: 1}
OK	471-25-0	C#CC(=O)O	{9: 1, 10: 1, 27: 1}
OK	471-29-4	CN=C(N)N	{1: 1, 34: 1, 30: 2, 7: 1}
OK	471-43-2	C(C(Cl)Cl)(F)F	{16: 2, 17: 2, 3: 2}
OK	471-44-3	C(C(=O)O)(F)Cl	{16: 1, 17: 1, 3: 1, 27: 1}
OK	471-46-5	C(=O)(C(=O)N)N	{24: 2, 30: 2}
OK	471-47-6	C(=O)(C(=O)O)N	{24: 1, 27: 1, 30: 1}
OK	471-53-4	C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)(C)C(=O)O	{1: 7, 11: 9, 12: 4, 13: 6, 14: 1, 15: 1, 20: 1, 25: 1, 27: 1}
OK	471-77-2	CC(=C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C	{1: 4, 7: 1, 11: 7, 12: 2, 13: 2, 14: 1, 15: 2, 27: 1}
OK	471-84-1	CC1(C2CCC1C(=C)C2)C	{1: 2, 5: 1, 11: 3, 12: 2, 13: 1, 15: 1}
OK	4711-95-9	C1C(O1)COCCCCO	{2: 5, 11: 1, 12: 1, 20: 1, 22: 1, 23: 1}
OK	4711-96-0	C1CC(CC=C1)C2CC3CC2C=C3	{11: 5, 12: 4, 14: 4}
OK	4715-23-5	CC(=O)NC1(C2(C3(C4(C1(C5(C2(C3(C(C45Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)O	{1: 1, 13: 10, 17: 10, 20: 1, 24: 1, 31: 1}
OK	4719-04-4	C1N(CN(CN1CCO)CCO)CCO	{33: 3, 2: 6, 11: 3, 20: 3}
OK	472-20-8	CC1=C(C(CCC1)(C)C)CO	{1: 3, 2: 1, 11: 3, 13: 1, 15: 2, 20: 1}
OK	472-54-8	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C	{1: 2, 11: 8, 12: 5, 13: 1, 14: 1, 15: 1, 24: 1, 25: 1}
OK	472-61-7	CC1=C(C(CC(C1=O)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(C(=O)C(CC2(C)C)O)C)C)C	{1: 10, 6: 14, 7: 4, 11: 2, 12: 2, 13: 2, 15: 4, 20: 2, 25: 2}
OK	472-66-2	CC1=C(C(CCC1)(C)C)CC=O	{1: 3, 2: 1, 11: 3, 13: 1, 15: 2, 26: 1}
OK	472-70-8	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C[C@H](CC2(C)C)O)C)/C)/C	{1: 10, 6: 14, 7: 4, 11: 5, 12: 1, 13: 2, 15: 4, 20: 1}
OK	472-86-6	CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=O)C)C	{1: 5, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 26: 1}
OK	472-93-5	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/CCC=C(C)C)/C)/C	{1: 10, 2: 2, 6: 16, 7: 6, 11: 3, 13: 1, 15: 2}
OK	4720-09-6	CC(=O)O[C@@H]1C2CC[C@@H]3C1(C[C@H]([C@]4([C@H]([C@]3(C)O)C[C@@H](C4(C)C)O)O)O)C[C@@]2(C)O	{1: 5, 11: 5, 12: 6, 13: 5, 20: 5, 28: 1}
OK	4722-42-3	C1CCCC#CCCCCCC#CCC1	{10: 4, 11: 11}
OK	4722-68-3	CC1COC2(O1)CCCCC2	{1: 1, 11: 6, 12: 1, 13: 1, 23: 2}
OK	4724-89-4	CC1=CC(=CC(C1)(C)C)C	{1: 4, 11: 1, 13: 1, 14: 2, 15: 2}
OK	4727-17-7	C1CCCCCCCC(CCCCCC1)O	{20: 1, 11: 14, 12: 1}
OK	4727-22-4	C1=CC(=C=O)C=C1	{8: 1, 29: 1, 14: 4, 15: 1}
OK	4728-82-9	C=CCOC(=O)CC1CCCCC1	{2: 2, 5: 1, 6: 1, 11: 5, 12: 1, 28: 1}
OK	4729-06-0	C1C2C=CC1OC=C2	{11: 1, 12: 2, 14: 4, 23: 1}
OK	473-06-3	CC1=CCC2C(=O)C1C2(C)C	{1: 3, 11: 1, 12: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	473-11-0	CC1CCCC2(C1CC(CC2)C(C)C)C	{11: 6, 1: 4, 3: 1, 12: 3, 13: 1}
OK	473-13-2	CC1=CCCC2(C1CC(CC2)C(=C)C)C	{1: 3, 5: 1, 7: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 1}
OK	473-15-4	C[C@]12CCCC(=C)[C@@H]1C[C@@H](CC2)C(C)(C)O	{1: 3, 4: 1, 5: 1, 11: 6, 12: 2, 13: 1, 15: 1, 20: 1}
OK	473-16-5	CC1=CCC[C@]2([C@H]1C[C@@H](CC2)C(C)(C)O)C	{1: 4, 4: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 1, 20: 1}
OK	473-19-8	CC1C2CCC(C2)C1(C)C	{1: 3, 11: 3, 12: 3, 13: 1}
OK	473-54-1	CC1(C2CCC(C1C2)(C)O)C	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	473-55-2	CC1CCC2CC1C2(C)C	{1: 3, 11: 3, 12: 3, 13: 1}
OK	473-62-1	C[C@@H]1[C@H]2C[C@@H](C2(C)C)CC1=O	{1: 3, 11: 2, 12: 3, 13: 1, 25: 1}
OK	473-67-6	CC1=CC(C2CC1C2(C)C)O	{1: 3, 11: 1, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	473-72-3	CC(=O)C1CC(C1(C)C)CC(=O)O	{1: 3, 2: 1, 11: 1, 12: 2, 13: 1, 24: 1, 27: 1}
OK	473-73-4	CC1(C(CC1C(=O)O)CC(=O)O)C	{1: 2, 2: 1, 11: 1, 12: 2, 13: 1, 27: 2}
OK	473-81-4	C(C(C(=O)O)O)O	{27: 1, 2: 1, 3: 1, 20: 2}
OK	473-91-6	CC1CCC(=C1C)C	{1: 3, 11: 2, 12: 1, 15: 2}
OK	473-98-3	CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)CO	{1: 6, 2: 1, 5: 1, 7: 1, 11: 10, 12: 6, 13: 5, 20: 2}
OK	4730-22-7	CC(C)CCCC(C)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	4730-24-9	CC(C)CCCC(C)Br	{1: 3, 2: 3, 3: 2, 18: 1}
OK	4730-54-5	C1CNCCNCCN1	{32: 3, 11: 6}
OK	4732-59-6	C(/C(=C\N=O)/NO)Cl	{2: 1, 6: 1, 7: 1, 34: 1, 17: 1, 20: 1, 29: 1, 31: 1}
OK	4734-90-1	C1CCC(=O)CC=CC1	{25: 1, 11: 5, 14: 2}
OK	4736-71-4	C1CCN(C1)C(=O)N	{24: 1, 33: 1, 11: 4, 30: 1}
OK	4737-41-1	CCC(CC)CCl	{1: 2, 2: 3, 3: 1, 17: 1}
OK	474-20-4	CC(C)CCCC(C)C1CCC2(C1(CCC3C2CCC4C3(CCCC4(C)C)C)C)C	{1: 8, 2: 3, 3: 2, 11: 9, 12: 4, 13: 4}
OK	474-25-9	C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C	{1: 3, 2: 2, 3: 1, 11: 8, 12: 7, 13: 2, 20: 2, 27: 1}
OK	474-40-8	C/C=C(/CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H]([C@H]4C)O)C)C)\C(C)C	{1: 7, 2: 2, 3: 2, 6: 1, 7: 1, 11: 7, 12: 6, 13: 2, 14: 1, 15: 1, 20: 1}
OK	474-62-4	C[C@H](CC[C@@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 6, 2: 2, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	474-63-5	C[C@H](CCC(=C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 5, 2: 2, 3: 2, 5: 1, 7: 1, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	474-67-9	C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 6, 3: 3, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	474-69-1	C[C@H](C=C[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@@H]3C2=CC=C4[C@]3(CC[C@@H](C4)O)C)C	{1: 6, 3: 3, 6: 2, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 20: 1}
OK	474-74-8	C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C	{1: 3, 2: 3, 3: 1, 11: 9, 12: 6, 13: 2, 20: 1, 24: 1, 27: 1, 31: 1}
OK	474-77-1	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@H](C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	474-98-6	CC1(C2CCC1(C(=O)C2C(=O)O)C)C	{1: 3, 11: 2, 12: 2, 13: 2, 25: 1, 27: 1}
OK	4740-00-5	CC1CCSC1	{1: 1, 11: 3, 12: 1, 41: 1}
OK	4740-77-6	CC1CC(OC(O1)C)O	{1: 2, 11: 1, 12: 3, 20: 1, 23: 2}
OK	4740-78-7	C1C(COCO1)O	{20: 1, 11: 3, 12: 1, 23: 2}
OK	4740-81-2	CC(=CCCC(=CC1OCC(CO1)O)C)C	{1: 3, 2: 2, 6: 2, 7: 2, 11: 2, 12: 2, 20: 1, 23: 2}
OK	4741-86-0	CC(=C1CC1)C	{15: 1, 1: 2, 11: 2, 7: 1}
OK	4741-99-5	C(CNCCN)CNCCN	{2: 7, 30: 2, 31: 2}
OK	4744-08-5	CCC(OCC)OCC	{1: 3, 2: 3, 3: 1, 22: 2}
OK	4744-10-9	CCC(OC)OC	{1: 3, 2: 1, 3: 1, 22: 2}
OK	4744-47-2	C1C(C(C(CO1)(CO)CO)O)(CO)CO	{2: 4, 11: 2, 12: 1, 13: 2, 20: 5, 23: 1}
OK	4745-55-5	CC12CCC(C1(C)C=O)CC2=O	{1: 2, 11: 3, 12: 1, 13: 2, 25: 1, 26: 1}
OK	4746-97-8	C1CC2(CCC1=O)OCCO2	{25: 1, 11: 6, 13: 1, 23: 2}
OK	4747-05-1	CCOC(=C)C=C	{1: 1, 2: 1, 5: 2, 6: 1, 7: 1, 22: 1}
OK	4747-07-3	CCCCCCOC	{1: 2, 2: 5, 22: 1}
OK	4747-21-1	CC(C)NC	{1: 3, 3: 1, 31: 1}
OK	4747-81-3	CCCCCCCN=C=O	{8: 1, 1: 1, 2: 6, 34: 1, 29: 1}
OK	4747-90-4	C(N=C=O)N=C=O	{8: 2, 2: 1, 34: 2, 29: 2}
OK	4749-27-3	CC(=C)C(Cl)(Cl)Cl	{1: 1, 17: 3, 4: 1, 5: 1, 7: 1}
OK	4749-28-4	CC(=C)[N+](=O)[O-]	{1: 1, 5: 1, 38: 1, 7: 1}
OK	4749-31-9	CC(CCl)(C(Cl)(Cl)Cl)Cl	{1: 1, 2: 1, 4: 2, 17: 5}
OK	475-08-1	C(#N)C(C(=O)N)[N+](=O)[O-]	{24: 1, 38: 1, 3: 1, 37: 1, 30: 1}
OK	475-20-7	C[C@]12CCCC(C3[C@@H]1CCC3C2=C)(C)C	{1: 3, 5: 1, 11: 5, 12: 3, 13: 2, 15: 1}
OK	475-31-0	C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C	{1: 3, 2: 3, 3: 1, 11: 7, 12: 8, 13: 2, 20: 3, 24: 1, 27: 1, 31: 1}
OK	4753-55-3	C1=CC=C2C=CC=CC(=C1)N2	{32: 1, 14: 8, 15: 2}
OK	4753-59-7	CC(=O)OCCCCBr	{1: 1, 2: 4, 28: 1, 18: 1}
OK	4753-80-4	C1CCCSCC1	{41: 1, 11: 6}
OK	4755-77-5	CCOC(=O)C(=O)Cl	{24: 1, 1: 1, 2: 1, 28: 1, 17: 1}
OK	4755-81-1	CC(=O)C(C(=O)OC)Cl	{24: 1, 1: 2, 3: 1, 28: 1, 17: 1}
OK	4759-11-9	C1=CC=C2C=CC=CC(=C1)O2	{23: 1, 14: 8, 15: 2}
OK	4759-48-2	CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC(=O)O)C)C	{1: 5, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 27: 1}
OK	4762-14-5	CC(C)N=C(N)N=C(N)N	{1: 2, 34: 2, 3: 1, 30: 3, 7: 2}
OK	4763-40-0	CCCCCCCCCCCCNCCC#N	{1: 1, 2: 13, 37: 1, 31: 1}
OK	4764-14-1	CC1(C2CCC(C1C2)C=O)C	{1: 2, 26: 1, 11: 3, 12: 3, 13: 1}
OK	4767-03-7	CC(CO)(CO)C(=O)O	{1: 1, 2: 2, 27: 1, 4: 1, 20: 2}
OK	4771-80-6	C1CC(CC=C1)C(=O)O	{27: 1, 11: 3, 12: 1, 14: 2}
OK	4775-86-4	CC/C(=C(/C)\NO)/N=O	{1: 2, 2: 1, 7: 2, 34: 1, 20: 1, 29: 1, 31: 1}
OK	4784-77-4	CC=CCBr	{1: 1, 2: 1, 18: 1, 6: 2}
OK	4784-86-5	CC1=C(C=CC1)C	{1: 2, 11: 1, 14: 2, 15: 2}
OK	4786-19-0	CC(=C)CC#N	{1: 1, 2: 1, 37: 1, 5: 1, 7: 1}
OK	4786-20-3	CC=CC#N	{1: 1, 37: 1, 6: 2}
OK	4789-34-8	CC(C)(C)C1CCC(CC1)C(C)(C)C	{1: 6, 11: 4, 4: 2, 12: 2}
OK	4789-70-2	CCCCSC=C	{40: 1, 1: 1, 2: 3, 5: 1, 6: 1}
OK	479-22-1	C1(=C(C(=O)C(=C(C1=O)O)[N+](=O)[O-])O)[N+](=O)[O-]	{25: 2, 20: 2, 38: 2, 15: 4}
OK	4792-15-8	C(COCCOCCOCCOCCO)O	{2: 10, 20: 2, 22: 4}
OK	4795-29-3	C1CC(OC1)CN	{2: 1, 11: 3, 12: 1, 30: 1, 23: 1}
OK	4795-86-2	C[C@H]1CC[C@@H]2C[C@H]1C2(C)C	{1: 3, 11: 3, 12: 3, 13: 1}
OK	4798-44-1	CCCC(C=C)O	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 20: 1}
OK	4798-45-2	CC(C)C(C=C)O	{1: 2, 3: 2, 20: 1, 5: 1, 6: 1}
OK	4798-58-7	CCC(C=CC)O	{1: 2, 2: 1, 3: 1, 20: 1, 6: 2}
OK	4798-59-8	CCCC(C=CC)O	{1: 2, 2: 2, 3: 1, 20: 1, 6: 2}
OK	4798-61-2	CCCCC(C=CC)O	{1: 2, 2: 3, 3: 1, 20: 1, 6: 2}
OK	480-54-6	C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(CO)O)C	{1: 2, 2: 1, 6: 1, 33: 1, 11: 5, 12: 3, 13: 1, 14: 1, 15: 2, 20: 2, 28: 2}
OK	480-68-2	C1(C(=O)NC(=O)NC1=O)[N+](=O)[O-]	{32: 2, 25: 3, 12: 1, 38: 1}
OK	480-75-1	C[C@@H]1C[C@@](C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]1(C)O)(C(C)Cl)O	{1: 3, 3: 1, 33: 1, 11: 5, 12: 3, 13: 2, 14: 1, 15: 1, 17: 1, 20: 2, 28: 2}
OK	480-78-4	C/C=C\1/C[C@@H]([C@@](C(=O)OC[C@H]2CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O)C	{1: 3, 6: 1, 33: 1, 11: 6, 12: 4, 13: 1, 15: 1, 20: 1, 28: 2}
OK	480-79-5	C/C=C/1\C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O)C	{1: 3, 6: 1, 33: 1, 11: 5, 12: 3, 13: 1, 14: 1, 15: 2, 20: 1, 28: 2}
OK	480-81-9	C/C=C\1/CC(=C)[C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O	{1: 2, 5: 1, 6: 1, 33: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 3, 20: 1, 28: 2}
OK	480-82-0	C[C@@H]([C@](C(C)C)(C(=O)OCC1=CCN2[C@H]1[C@@H](CC2)O)O)O	{1: 3, 2: 1, 3: 2, 4: 1, 33: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 3, 28: 1}
OK	480-83-1	C[C@@H](C(C(C)C)(C(=O)OCC1=CCN2[C@@H]1[C@H](CC2)O)O)O	{1: 3, 2: 1, 3: 2, 4: 1, 33: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 3, 28: 1}
OK	480-85-3	C1CN2CC=C([C@@H]2[C@@H]1O)CO	{33: 1, 2: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 2}
OK	4801-27-8	C(CBr)OC(=O)Cl	{17: 1, 2: 2, 28: 1, 18: 1}
OK	4801-58-5	C1CCN(CC1)O	{33: 1, 11: 5, 20: 1}
OK	4806-61-5	CCC1CCC1	{1: 1, 2: 1, 11: 3, 12: 1}
OK	4806-62-6	CCCC1CCC1	{1: 1, 2: 2, 11: 3, 12: 1}
OK	4806-74-0	C1CCCCC/C(=N\O)/C(CCCC1)Cl	{34: 1, 11: 10, 12: 1, 15: 1, 17: 1, 20: 1}
OK	48076-38-6	CCCCCCCCCCCCCCCCCCCCOC(=O)C=C	{1: 1, 2: 19, 28: 1, 5: 1, 6: 1}
OK	481-06-1	CC1C2CCC3(C=CC(=O)C(=C3C2OC1=O)C)C	{1: 3, 11: 2, 12: 3, 13: 1, 14: 2, 15: 2, 25: 1, 28: 1}
OK	481-17-4	CC[C@@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	{1: 6, 2: 1, 3: 3, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	481-21-0	CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C	{1: 5, 2: 3, 3: 2, 11: 10, 12: 5, 13: 2}
OK	481-25-4	C[C@@H]1[C@H](CC[C@]2([C@H]1CC=C3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4[C@H](C)CCCC(C)C)C)C)O	{1: 6, 2: 3, 3: 2, 11: 7, 12: 6, 13: 2, 14: 1, 15: 1, 20: 1}
OK	481-26-5	CC[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CCCC4)C)C	{1: 3, 2: 1, 11: 10, 12: 5, 13: 2}
OK	481-29-8	CC12CCC(CC1CCC3C2CCC4(C3CCC4=O)C)O	{1: 2, 11: 9, 12: 5, 13: 2, 20: 1, 25: 1}
OK	481-30-1	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@H]2O)CCC4=CC(=O)CC[C@]34C	{1: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	481-34-5	CC1=C[C@H]2[C@@H](CC[C@@]([C@@H]2CC1)(C)O)C(C)C	{1: 4, 3: 1, 11: 4, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	481-37-8	CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)O)C(=O)O	{1: 1, 33: 1, 11: 3, 12: 4, 20: 1, 27: 1}
OK	4810-09-7	CCCCC(C)C=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1}
OK	4812-17-3	C=CCCCC[N+](=O)[O-]	{2: 4, 38: 1, 5: 1, 6: 1}
OK	4812-22-0	CCC=C(CC)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 6: 1, 7: 1}
OK	4812-23-1	CC=C(C)[N+](=O)[O-]	{1: 2, 38: 1, 6: 1, 7: 1}
OK	4812-25-3	CCCCCCC=C(C)[N+](=O)[O-]	{1: 2, 2: 5, 38: 1, 6: 1, 7: 1}
OK	4813-50-7	CCCCOO	{1: 1, 2: 3, 20: 1, 22: 1}
OK	4813-57-4	CCCCCCCCCCCCCCCCCCOC(=O)C=C	{1: 1, 2: 17, 28: 1, 5: 1, 6: 1}
OK	4813-58-5	CCCCCCCCCCCCCCOCC	{1: 2, 2: 14, 22: 1}
OK	4814-74-8	C1=CC(=O)N(C1=O)O	{25: 2, 20: 1, 14: 2, 33: 1}
OK	4814-79-3	CCC(C)NCCN	{1: 2, 2: 3, 3: 1, 30: 1, 31: 1}
OK	4814-80-6	CC(=O)NCC#N	{24: 1, 1: 1, 2: 1, 37: 1, 31: 1}
OK	48163-10-6	CCCCCCCCCCCC(=O)N1CC1	{24: 1, 1: 1, 2: 10, 11: 2, 33: 1}
OK	4819-75-4	CCOC(COC)OCC	{1: 3, 2: 3, 3: 1, 22: 3}
OK	4819-77-6	CCOCC(OCC)OCC	{1: 3, 2: 4, 3: 1, 22: 3}
OK	4819-82-3	COCCOC1CCCCO1	{1: 1, 2: 2, 11: 4, 12: 1, 22: 2, 23: 1}
OK	4819-83-4	CCOC1CCCCO1	{1: 1, 2: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	482-54-2	C1CCC(C(C1)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O	{27: 4, 33: 2, 2: 4, 11: 4, 12: 2}
OK	4821-04-9	CC1=CCC(CC1)(C(C)C)OC(=O)C	{1: 4, 3: 1, 11: 3, 13: 1, 14: 1, 15: 1, 28: 1}
OK	4823-47-6	C=CC(=O)OCCBr	{2: 2, 18: 1, 28: 1, 5: 1, 6: 1}
OK	4826-62-4	CCCCCCCCC/C=C/C=O	{1: 1, 2: 8, 26: 1, 6: 2}
OK	4826-87-3	CCCCCCCC(=O)OCC(CC)(COC(=O)CCCCCCC)COC(=O)CCCCCCC	{1: 4, 2: 22, 4: 1, 28: 3}
OK	4827-55-8	CCCCC(CC)COC(=O)C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)OCC(CC)CCCC	{1: 4, 2: 10, 3: 2, 12: 2, 13: 3, 15: 2, 17: 6, 28: 2}
OK	4829-04-3	C1CSCS1	{41: 2, 11: 3}
OK	4829-56-5	CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6=O)OC)O)O)OC)OC)COC	{1: 5, 2: 2, 33: 1, 11: 5, 12: 8, 13: 4, 20: 2, 22: 4, 25: 1}
OK	483-76-1	CC1=C[C@H]2[C@@H](CCC(=C2CC1)C)C(C)C	{1: 4, 3: 1, 11: 4, 12: 2, 14: 1, 15: 3}
OK	4831-43-0	CC1(CCNC1=O)C	{32: 1, 1: 2, 11: 2, 13: 1, 25: 1}
OK	4832-16-0	C1CCC2C(C1)CCCC2=O	{25: 1, 11: 7, 12: 2}
OK	4832-17-1	C1CCC2CC(=O)CCC2C1	{25: 1, 11: 7, 12: 2}
OK	4834-98-4	C(CCCCCC(=O)Cl)CCCCC(=O)Cl	{24: 2, 17: 2, 2: 10}
OK	4835-11-4	CCCCNCCCCCCNCCCC	{1: 2, 2: 12, 31: 2}
OK	4835-90-9	CC(C)(CO)C(=O)O	{1: 2, 2: 1, 27: 1, 4: 1, 20: 1}
OK	4836-09-3	CSCCOC(=O)C=C	{1: 1, 2: 2, 5: 1, 6: 1, 40: 1, 28: 1}
OK	4839-46-7	CC(C)(CC(=O)O)CC(=O)O	{1: 2, 2: 2, 27: 2, 4: 1}
OK	484-89-9	CC1=CC(=O)C(=C(C1=O)O)OC	{1: 2, 14: 1, 15: 3, 20: 1, 22: 1, 25: 2}
OK	484-93-5	CN1[C@H]2CC[C@@H]1C(=CC2)C(=O)O	{1: 1, 33: 1, 11: 3, 12: 2, 14: 1, 15: 1, 27: 1}
OK	4840-12-4	CN(C)C1=CCCC1	{1: 2, 11: 3, 33: 1, 14: 1, 15: 1}
OK	4841-84-3	COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)OC	{1: 2, 11: 2, 12: 2, 14: 2, 28: 2}
OK	4842-93-7	CC/C(=C/C=C)/C	{1: 2, 2: 1, 5: 1, 6: 2, 7: 1}
OK	4845-05-0	C1CC=CC(C1)OO	{20: 1, 11: 3, 12: 1, 22: 1, 14: 2}
OK	4845-50-5	C1COC(C(O1)O)O	{20: 2, 11: 2, 12: 2, 23: 2}
OK	4847-93-2	C1CCN(CC1)CC(CO)O	{11: 5, 33: 1, 2: 2, 3: 1, 20: 2}
OK	4850-28-6	C[C@H]1C[C@H](C)[C@H](C)C1	{1: 3, 11: 2, 12: 3}
OK	4853-56-9	CCCCN=CCCC	{1: 2, 2: 5, 34: 1, 6: 1}
OK	4856-87-5	C1=CC(=O)N(C1=O)CCCCCCN2C(=O)C=CC2=O	{25: 4, 2: 6, 14: 4, 33: 2}
OK	4856-88-6	CCCCN(CC1CO1)CC2CO2	{1: 1, 2: 5, 33: 1, 11: 2, 12: 2, 23: 2}
OK	486-70-4	C1CCN2CCC[C@H]([C@H]2C1)CO	{20: 1, 2: 1, 11: 7, 12: 2, 33: 1}
OK	486-87-3	C1CCN2CC3CC(C2C1)CN4C3CCCC4=O	{25: 1, 11: 10, 12: 4, 33: 2}
OK	4860-03-1	CCCCCCCCCCCCCCCCCl	{1: 1, 2: 15, 17: 1}
OK	4862-03-7	CCCCCCCCCCCCCCCCl	{1: 1, 2: 14, 17: 1}
OK	4862-18-4	C(C(=O)N)N(CC(=O)N)CC(=O)N	{24: 3, 33: 1, 2: 3, 30: 3}
OK	4864-61-3	CCCCCC(CC)OC(=O)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	487-27-4	CN1[C@H]2C[C@@H]3C[C@@H]1[C@@H]([C@H]2O)O3	{1: 1, 33: 1, 11: 2, 12: 5, 20: 1, 23: 1}
OK	487-51-4	CCOC(=O)C1CCC(=O)C=C1C	{1: 2, 2: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1, 28: 1}
OK	487-79-6	CC(=C)[C@H]1CN[C@@H]([C@H]1CC(=O)O)C(=O)O	{32: 1, 1: 1, 2: 1, 5: 1, 7: 1, 11: 1, 12: 3, 27: 2}
OK	4877-14-9	CCCCCCCCCCCCCCN=C=O	{8: 1, 1: 1, 2: 13, 34: 1, 29: 1}
OK	4877-39-8	C=C1CC2CCC(C2)C1	{11: 5, 12: 2, 5: 1, 15: 1}
OK	4879-98-5	C(CN)CN(CCCN)CCN(CCCN)CCCN	{33: 2, 2: 14, 30: 4}
OK	488-10-8	CCC=CCC1=C(CCC1=O)C	{1: 2, 2: 2, 6: 2, 11: 2, 15: 2, 25: 1}
OK	488-11-9	C(=O)C(=C(C(=O)O)Br)Br	{18: 2, 27: 1, 26: 1, 7: 2}
OK	488-43-7	C(C(C(C(C(CO)O)O)O)O)N	{2: 2, 3: 4, 20: 5, 30: 1}
OK	488-45-9	C([C@@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O	{2: 2, 3: 4, 20: 6}
OK	488-48-2	C1(=C(C(=O)C(=C(C1=O)Br)Br)Br)Br	{25: 2, 18: 4, 15: 4}
OK	488-73-3	C1[C@H]([C@@H](C([C@H]([C@@H]1O)O)O)O)O	{20: 5, 11: 1, 12: 5}
OK	488-81-3	C(C(C(C(CO)O)O)O)O	{2: 2, 3: 3, 20: 5}
OK	488-82-4	C([C@H](C([C@@H](CO)O)O)O)O	{2: 2, 3: 3, 20: 5}
OK	488-84-6	C(C(C(C(=O)CO)O)O)O	{24: 1, 2: 2, 3: 2, 20: 4}
OK	488-97-1	CC1(C2CC3C1C3(C2)C)C	{1: 3, 11: 2, 12: 3, 13: 2}
OK	4883-67-4	C1CCC(=O)C(C1)[N+](=O)[O-]	{25: 1, 11: 4, 12: 1, 38: 1}
OK	4884-01-9	CC/C=C/OCC	{1: 2, 2: 2, 22: 1, 6: 2}
OK	4884-21-3	C1CCC(C1)C2=CCCC2	{11: 7, 12: 1, 14: 1, 15: 1}
OK	4884-24-6	C1CCC(C1)C2CCCC2=O	{25: 1, 11: 7, 12: 2}
OK	4884-25-7	C1CCC(C1)C2CCCC2O	{20: 1, 11: 7, 12: 3}
OK	4885-02-3	COC(Cl)Cl	{1: 1, 3: 1, 22: 1, 17: 2}
OK	4887-30-3	CCCCCCCCOC(=O)CCCCC	{1: 2, 2: 11, 28: 1}
OK	4887-42-7	C1CCC2=C(C1)C(=O)N(C2=O)CO	{33: 1, 2: 1, 11: 4, 15: 2, 20: 1, 25: 2}
OK	489-39-4	CC1CCC2[C@@H]1[C@H]3[C@H](C3(C)C)CCC2=C	{1: 3, 5: 1, 11: 4, 12: 5, 13: 1, 15: 1}
OK	489-40-7	C[C@@H]1CCC2C(C2(C)C)C3=C(CC[C@H]13)C	{1: 4, 11: 4, 12: 4, 13: 1, 15: 2}
OK	489-72-5	C1CCN2CC3CC(C2C1)C(=O)N4C3CCCC4	{25: 1, 11: 10, 12: 4, 33: 2}
OK	489-86-1	C[C@@H]1CC[C@@H](CC2=C1CC[C@H]2C)C(C)(C)O	{1: 4, 4: 1, 11: 5, 12: 3, 15: 2, 20: 1}
OK	4893-00-9	C1CC2(C1)C(=O)C3(C2=O)CCC3	{25: 2, 11: 6, 13: 2}
OK	4893-13-4	CC1=CC2CCC1CC2	{1: 1, 11: 4, 12: 2, 14: 1, 15: 1}
OK	4894-62-6	CC=CCC(C)C=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 3}
OK	4894-63-7	CC(C=C)C(C)C=C	{1: 2, 3: 2, 5: 2, 6: 2}
OK	489446-85-7	CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C1)C(=O)O	{1: 3, 4: 1, 11: 3, 12: 2, 27: 1, 28: 1, 31: 1}
OK	4897-50-1	C1CCN(CC1)C2CCNCC2	{32: 1, 33: 1, 11: 9, 12: 1}
OK	4897-84-1	COC(=O)CCCBr	{1: 1, 2: 3, 28: 1, 18: 1}
OK	4899-97-2	CCCCCCCCCCCCCCCC(=O)NCCCN	{24: 1, 1: 1, 2: 17, 30: 1, 31: 1}
OK	490-03-9	CC1=C(C(=O)C(CC1)C(C)C)O	{1: 3, 3: 1, 11: 2, 12: 1, 15: 2, 20: 1, 25: 1}
OK	490-10-8	CC1CCC2C1C(=O)OC=C2C	{1: 2, 11: 2, 12: 3, 14: 1, 15: 1, 28: 1}
OK	490-91-5	CC1=CC(=O)C(=CC1=O)C(C)C	{1: 3, 3: 1, 25: 2, 14: 2, 15: 2}
OK	490-99-3	C[C@@H]1CC[C@@H]([C@@H](C1)O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 20: 1}
OK	4900-30-5	C=CCCCCCC=C	{2: 5, 5: 2, 6: 2}
OK	4901-75-1	CCC1(NN1)C	{32: 2, 1: 2, 2: 1, 13: 1}
OK	4901-76-2	CC1(NN1)C	{32: 2, 1: 2, 13: 1}
OK	4906-22-3	CC1=CC(=C2C=C(C(=O)C(=C2)C)C)C=C(C1=O)C	{1: 4, 25: 2, 14: 4, 15: 6}
OK	4906-24-5	CC(C(=O)C)OC(=O)C	{24: 1, 1: 3, 3: 1, 28: 1}
OK	4909-78-8	CC(C)(C)COC(N(C)C)OCC(C)(C)C	{1: 8, 2: 2, 3: 1, 4: 2, 33: 1, 22: 2}
OK	491-04-3	CC1=CC(C(CC1)C(C)C)O	{1: 3, 3: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 1}
OK	491-09-8	CC1=CC(=O)C(=C(C)C)CC1	{1: 3, 7: 1, 11: 2, 14: 1, 15: 2, 25: 1}
OK	491-14-5	CCC(C)C1CC(C(=C1)C(CC(C(C(=O)O)O)O)O)C(C)CC	{1: 4, 2: 3, 3: 5, 11: 1, 12: 2, 14: 1, 15: 1, 20: 3, 27: 1}
OK	491-25-8	CN1C2CCCC1CCC2	{1: 1, 11: 6, 12: 2, 33: 1}
OK	4911-46-0	C(C(C(CCl)Br)Br)Cl	{17: 2, 2: 2, 3: 2, 18: 2}
OK	4911-54-0	CCOC(=O)CCC(=C)C	{1: 2, 2: 3, 28: 1, 5: 1, 7: 1}
OK	4911-55-1	CC#CC#C	{1: 1, 10: 3, 9: 1}
OK	4911-60-8	CCC#CC(C)(C)C	{1: 4, 2: 1, 4: 1, 10: 2}
OK	4911-70-0	CCC(C)C(C)(C)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1}
OK	4913-31-9	COC(=O)N(CO)CO	{1: 1, 2: 2, 20: 2, 28: 1, 33: 1}
OK	4914-89-0	CC/C=C(/C)\CC	{1: 3, 2: 2, 6: 1, 7: 1}
OK	4914-91-4	C/C=C(/C)\C(C)C	{1: 4, 3: 1, 6: 1, 7: 1}
OK	4914-92-5	C/C=C(\C)/C(C)C	{1: 4, 3: 1, 6: 1, 7: 1}
OK	4917-76-4	C(C(C(=O)O)SC(CC(=O)O)C(=O)O)C(=O)O	{27: 4, 40: 1, 2: 2, 3: 2}
OK	492-08-0	C1CCN2C[C@H]3C[C@@H]([C@H]2C1)CN4[C@H]3CCCC4	{33: 2, 11: 11, 12: 4}
OK	492-61-5	C(C1C(C(C(C(O1)O)O)O)O)O	{20: 5, 2: 1, 12: 5, 23: 1}
OK	492-62-6	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O	{20: 5, 2: 1, 12: 5, 23: 1}
OK	492-99-9	C1CCC(=C(C1)NO)N=O	{34: 1, 11: 4, 15: 2, 20: 1, 29: 1, 31: 1}
OK	4923-78-8	CC[C@@H]1CCCC[C@H]1C	{1: 2, 2: 1, 11: 4, 12: 2}
OK	4923-79-9	CN1CCC1	{1: 1, 11: 3, 33: 1}
OK	4926-71-0	CCC[C@H]1CCCC[C@H]1C	{1: 2, 2: 2, 11: 4, 12: 2}
OK	4926-76-5	CC[C@H]1CCC[C@@H](C1)C	{1: 2, 2: 1, 11: 4, 12: 2}
OK	4926-90-3	CCC1(CCCCC1)C	{1: 2, 2: 1, 11: 5, 13: 1}
OK	4927-03-1	C1CC2C=CC2C1	{11: 3, 12: 2, 14: 2}
OK	4927-40-6	CC1CCC(CC1)C(C)(C)CC(C)O	{1: 4, 2: 1, 3: 1, 4: 1, 11: 4, 12: 2, 20: 1}
OK	493-01-6	C1CCC2CCCCC2C1	{11: 8, 12: 2}
OK	493-02-7	C1CC[C@H]2CCCC[C@@H]2C1	{11: 8, 12: 2}
OK	493-03-8	C1CCC2=C(C1)CCCC2	{11: 8, 15: 2}
OK	493-04-9	C1C=CCC2=C1CC=CC2	{11: 4, 14: 4, 15: 2}
OK	493-74-3	COC1=CC(=C2C=C(C(=O)C(=C2)OC)OC)C=C(C1=O)OC	{1: 4, 25: 2, 22: 4, 14: 4, 15: 6}
OK	4931-66-2	COC(=O)[C@@H]1CCC(=O)N1	{32: 1, 1: 1, 11: 2, 12: 1, 25: 1, 28: 1}
OK	4931-68-4	CCCCOC(=O)[C@@H]1CCC(=O)N1	{32: 1, 1: 1, 2: 3, 11: 2, 12: 1, 25: 1, 28: 1}
OK	4934-61-6	C12C(C(C(C1(F)F)(F)F)(C(C2(F)F)(F)F)F)(F)F	{16: 11, 12: 1, 13: 6}
OK	4935-01-7	COC(=O)C12CC1C2	{1: 1, 11: 2, 12: 1, 13: 1, 28: 1}
OK	4938-52-7	CCCCC(C=C)O	{1: 1, 2: 3, 3: 1, 5: 1, 6: 1, 20: 1}
OK	494-15-5	CC(=O)N1CCCC(=C1)C2CCCCN2	{32: 1, 1: 1, 33: 1, 11: 7, 12: 1, 14: 1, 15: 1, 24: 1}
OK	494-72-4	C1=CC(=O)C=CC1=C2C=CC(=O)C=C2	{25: 2, 14: 8, 15: 2}
OK	4942-47-6	C1C2CC3CC1CC(C2)(C3)CC(=O)O	{27: 1, 2: 1, 11: 6, 12: 3, 13: 1}
OK	4945-48-6	CCCCN1CCCCC1	{1: 1, 2: 3, 11: 5, 33: 1}
OK	4949-20-6	C=CC=CCO	{2: 1, 20: 1, 5: 1, 6: 3}
OK	4949-44-4	CCC(=O)CC(=O)OCC	{24: 1, 1: 2, 2: 3, 28: 1}
OK	495-20-5	CCC(C1CCCCN1)O	{32: 1, 1: 1, 2: 1, 3: 1, 11: 4, 12: 1, 20: 1}
OK	495-60-3	CC1=CC[C@@H](C=C1)[C@@H](C)CCC=C(C)C	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 11: 1, 12: 1, 14: 3, 15: 1}
OK	495-61-4	CC1=CC[C@@H](CC1)C(=C)CCC=C(C)C	{1: 3, 2: 2, 5: 1, 6: 1, 7: 2, 11: 3, 12: 1, 14: 1, 15: 1}
OK	495-83-0	C/C=C(\C)/C(=O)OC1CC2CCC(C1)N2C	{1: 3, 33: 1, 6: 1, 7: 1, 11: 4, 12: 3, 28: 1}
OK	4951-40-0	CC1=C(C(CCC1)(C)C)C=CC=O	{1: 3, 6: 2, 11: 3, 13: 1, 15: 2, 26: 1}
OK	4951-48-8	CCC(=O)OC1CC(CCC1C(C)C)C	{1: 4, 2: 1, 3: 1, 11: 3, 12: 3, 28: 1}
OK	4951-97-7	CC[C@H]1C[C@H](C1(C)C)C(=O)C	{1: 4, 2: 1, 11: 1, 12: 2, 13: 1, 24: 1}
OK	49540-32-1	CCNC(=O)N(CC)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 24: 1, 29: 1, 31: 1}
OK	49542-74-7	CC(C)CCCC(C)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	49542-94-1	CCC1=C(C12C=CC=C2)CC	{1: 2, 2: 2, 13: 1, 14: 4, 15: 2}
OK	4955-32-2	CC(=CCC=C(C)C=C)CCC=C(C)C=O	{1: 3, 2: 3, 5: 1, 6: 4, 7: 3, 26: 1}
OK	49553-92-6	C(CN)N.C(CCl)Cl	{17: 2, 2: 4, 30: 2}
OK	49557-09-7	CC(C)CCC(C)CCC(C)C	{1: 5, 2: 4, 3: 3}
OK	49562-27-8	CCCCCCCCCCCCCCCCCCCCCC#N	{1: 1, 2: 20, 37: 1}
OK	49570-30-1	CC12CCC(CC1)(N=N2)C	{1: 2, 11: 4, 13: 2, 35: 2}
OK	49598-54-1	CCCCCCCCCCC(C)(C)C	{1: 4, 2: 9, 4: 1}
OK	496-03-7	CCCC(C(CC)C=O)O	{1: 2, 2: 3, 3: 2, 20: 1, 26: 1}
OK	496-10-6	C1CCC2CCCC2C1	{11: 7, 12: 2}
OK	496-46-8	C12C(NC(=O)N1)NC(=O)N2	{32: 4, 25: 2, 12: 2}
OK	496-49-1	CC(=O)CC1CCCN1C	{1: 2, 2: 1, 33: 1, 11: 3, 12: 1, 24: 1}
OK	496-67-3	CC(C)C(C(=O)NC(=O)N)Br	{1: 2, 3: 2, 18: 1, 24: 2, 30: 1, 31: 1}
OK	496-77-5	CCCC(C(=O)CCC)O	{24: 1, 1: 2, 2: 4, 3: 1, 20: 1}
OK	4961-40-4	C(CNCCNCCN)N.Cl.Cl.Cl.Cl	{17: 4, 2: 6, 30: 2, 31: 2}
OK	49616-12-8	CCOC1=C2C=CC=C2C(=N1)N(C)C	{1: 3, 2: 1, 35: 1, 33: 1, 14: 3, 15: 4, 22: 1}
OK	49623-50-9	CC(CBr)C(C)Br	{1: 2, 2: 1, 3: 2, 18: 2}
OK	49642-07-1	CC(C)C[C@@H]([C@H](CC(=O)O)O)N	{1: 2, 2: 2, 3: 3, 20: 1, 27: 1, 30: 1}
OK	49653-47-6	CC(C)(C)OC(=O)C(Cl)Cl	{1: 3, 3: 1, 4: 1, 28: 1, 17: 2}
OK	49665-74-9	CN1CCCCC1CCl	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 17: 1}
OK	4968-09-6	CC(=O)C12C(CC3C1(CCC4C3CCC5=CC(=O)CCC45C)C)OC(O2)(C)C	{1: 5, 11: 7, 12: 4, 13: 4, 14: 1, 15: 1, 23: 2, 24: 1, 25: 1}
OK	49681-66-5	CC(C)(C)OC(=O)C=CC(=O)OOC	{1: 4, 4: 1, 22: 1, 6: 2, 28: 2}
OK	49681-67-6	CC(C)(C)OC(=O)CCC(=O)OOC	{1: 4, 2: 2, 4: 1, 22: 1, 28: 2}
OK	497-03-0	C/C=C(\C)/C=O	{1: 2, 26: 1, 6: 1, 7: 1}
OK	497-04-1	C(C(CO)Cl)O	{17: 1, 2: 2, 3: 1, 20: 2}
OK	497-06-3	C=CC(CO)O	{2: 1, 3: 1, 20: 2, 5: 1, 6: 1}
OK	497-09-6	C([C@@H](C=O)O)O	{2: 1, 3: 1, 20: 2, 26: 1}
OK	497-15-4	C(=O)C(C=O)O	{26: 2, 3: 1, 20: 1}
OK	497-18-7	C(=O)(NN)NN	{24: 1, 30: 2, 31: 2}
OK	497-20-1	C=C1C=CC=C1	{5: 1, 14: 4, 15: 1}
OK	497-23-4	C1C=CC(=O)O1	{11: 1, 28: 1, 14: 2}
OK	497-25-6	C1COC(=O)N1	{32: 1, 11: 2, 28: 1}
OK	497-26-7	CC1OCCO1	{1: 1, 11: 2, 12: 1, 23: 2}
OK	497-32-5	CC1(CC2CC1CC2=C)C	{1: 2, 5: 1, 11: 3, 12: 2, 13: 1, 15: 1}
OK	497-35-8	C=C1CC2CCC1C2	{11: 4, 12: 2, 5: 1, 15: 1}
OK	497-38-1	C1CC2CC1CC2=O	{25: 1, 11: 4, 12: 2}
OK	4971-18-0	CCC1CCCC1=O	{1: 1, 2: 1, 11: 3, 12: 1, 25: 1}
OK	4971-56-6	C1C(=O)COC1=O	{25: 1, 11: 2, 28: 1}
OK	4974-21-4	C(CCl)OC(=O)C(Cl)(Cl)Cl	{17: 4, 2: 2, 4: 1, 28: 1}
OK	4974-27-0	CC=CCCC=CC	{1: 2, 2: 2, 6: 4}
OK	49761-82-2	CC(C)(C)OC(=O)N1C=CN=C1	{1: 3, 35: 1, 4: 1, 33: 1, 14: 3, 28: 1}
OK	4977-62-2	CCOC(=O)C(C#N)NC(=O)C	{1: 2, 2: 1, 3: 1, 37: 1, 24: 1, 28: 1, 31: 1}
OK	49784-84-1	C[NH]	{1: 1, 36: 1}
OK	49792-84-9	C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)O	{2: 7, 8: 2, 11: 8, 12: 4, 34: 2, 20: 2, 27: 2, 29: 2}
OK	498-07-7	C1[C@@H]2[C@H]([C@@H]([C@H]([C@H](O1)O2)O)O)O	{20: 3, 11: 1, 12: 5, 23: 2}
OK	498-15-7	CC1=CCC2[C@H](C1)C2(C)C	{1: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1}
OK	498-16-8	CC(=CC[C@@H](CO)C(=C)C)C	{1: 3, 2: 2, 3: 1, 5: 1, 6: 1, 7: 2, 20: 1}
OK	498-21-5	CC(CC(=O)O)C(=O)O	{27: 2, 1: 1, 2: 1, 3: 1}
OK	498-23-7	C/C(=C/C(=O)O)C(=O)O	{1: 1, 27: 2, 6: 1, 7: 1}
OK	498-24-8	CC(=CC(=O)O)C(=O)O	{1: 1, 27: 2, 6: 1, 7: 1}
OK	498-36-2	CC(C)CC(C(=O)O)O	{27: 1, 1: 2, 2: 1, 3: 2, 20: 1}
OK	498-59-9	C([C@@H](C(=O)O)N)SCSC[C@@H](C(=O)O)N	{27: 2, 40: 2, 2: 3, 3: 2, 30: 2}
OK	498-66-8	C1CC2CC1C=C2	{11: 3, 12: 2, 14: 2}
OK	498-71-5	CC1=CCC(CC1O)C(C)(C)O	{1: 3, 4: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 2}
OK	498-81-7	CC1CCC(CC1)C(C)(C)O	{1: 3, 11: 4, 4: 1, 12: 2, 20: 1}
OK	498-94-2	C1CNCCC1C(=O)O	{27: 1, 32: 1, 11: 4, 12: 1}
OK	498-95-3	C1CC(CNC1)C(=O)O	{27: 1, 32: 1, 11: 4, 12: 1}
OK	498-96-4	C1CNCC(=C1)C(=O)O	{27: 1, 32: 1, 11: 3, 14: 1, 15: 1}
OK	49805-30-3	C1C2C=CC1NC2=O	{32: 1, 25: 1, 11: 1, 12: 2, 14: 2}
OK	4981-47-9	CCCCOCNC(=O)NCOCCCC	{24: 1, 1: 2, 2: 8, 22: 2, 31: 2}
OK	4982-20-1	C=C1CCC(=C)CC1	{11: 4, 5: 2, 15: 2}
OK	4984-01-4	CC(C)CCCC(C)C=C	{1: 3, 2: 3, 3: 2, 5: 1, 6: 1}
OK	4984-22-9	C[C@H](COC)O	{1: 2, 2: 1, 3: 1, 20: 1, 22: 1}
OK	4984-85-4	CCC(C(=O)CC)O	{24: 1, 1: 2, 2: 2, 3: 1, 20: 1}
OK	49840-60-0	CN(C)N1CCCCC1	{1: 2, 11: 5, 33: 2}
OK	49840-63-3	CC(C)N(C)N(C)C	{1: 5, 3: 1, 33: 2}
OK	49840-64-4	CC(C)N(C)N(C(C)C)C(C)C	{1: 7, 3: 3, 33: 2}
OK	49840-66-6	C1CCN(CC1)N2CCCC2	{33: 2, 11: 9}
OK	49840-68-8	CN1CCCCCN1C	{1: 2, 11: 5, 33: 2}
OK	49840-69-9	C1CCN2CCCN2CC1	{33: 2, 11: 8}
OK	4985-85-7	C(CN)CN(CCO)CCO	{33: 1, 2: 7, 20: 2, 30: 1}
OK	49852-35-9	CC=CC(=O)CC(C)C	{24: 1, 1: 3, 2: 1, 3: 1, 6: 2}
OK	49852-40-6	C1CC#CCCC#C1	{10: 4, 11: 4}
OK	49859-87-2	CCCCCCCCCCCCCCCCCCCN(C)C	{1: 3, 2: 18, 33: 1}
OK	4986-50-9	CCCN(CCC)N	{1: 2, 2: 4, 30: 1, 33: 1}
OK	4987-75-1	CC(C)OC(=O)N(CO)CO	{1: 2, 2: 2, 3: 1, 33: 1, 20: 2, 28: 1}
OK	499-02-5	C=C1C(C1C(=O)O)C(=O)O	{27: 2, 12: 2, 5: 1, 15: 1}
OK	499-04-7	CN1CCC=C(C1)C(=O)O	{1: 1, 33: 1, 11: 3, 14: 1, 15: 1, 27: 1}
OK	499-54-7	CC1CCC(OC(=O)C1)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2, 28: 1}
OK	499-69-4	C[C@@H]1CC[C@H](C[C@H]1O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 3, 20: 1}
OK	499-70-7	CC1CCC(CC1=O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2, 25: 1}
OK	499-71-8	CC1=CC[C@@H](CC1=O)C(C)C	{1: 3, 3: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	499-89-8	CC1(C=CC=C(C=C1)C(=O)O)C	{1: 2, 27: 1, 13: 1, 14: 5, 15: 1}
OK	499-97-8	CC(=C)C1CCC(=C)CC1	{1: 1, 5: 2, 7: 1, 11: 4, 12: 1, 15: 1}
OK	4998-38-3	C=CC(=O)OCC(C(C(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 3: 1, 4: 9, 5: 1, 6: 1, 16: 20, 28: 1}
OK	4998-76-9	C1CCC(CC1)N.Cl	{17: 1, 11: 5, 12: 1, 30: 1}
OK	50-01-1	C(=N)(N)N.Cl	{17: 1, 36: 1, 30: 2, 7: 1}
OK	50-02-2	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C	{1: 3, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 3, 24: 1, 25: 1}
OK	50-03-3	CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)O	{1: 3, 2: 1, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	50-04-4	CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)O	{1: 3, 2: 1, 11: 7, 12: 3, 13: 3, 14: 1, 15: 1, 20: 1, 24: 1, 25: 2, 28: 1}
OK	50-07-7	CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)OC)N4)N	{32: 1, 1: 2, 2: 1, 33: 1, 11: 1, 12: 3, 13: 1, 15: 4, 22: 1, 25: 2, 28: 1, 30: 2}
OK	50-11-3	CCC1(C(=O)NC(=O)N(C1=O)C)CC	{32: 1, 1: 3, 2: 2, 33: 1, 13: 1, 25: 3}
OK	50-14-6	CC(C)C(C)C=CC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C	{1: 5, 3: 3, 5: 1, 6: 4, 11: 8, 12: 3, 13: 1, 15: 3, 20: 1}
OK	50-21-5	CC(C(=O)O)O	{27: 1, 1: 1, 3: 1, 20: 1}
OK	50-22-6	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@H]4C(=O)CO)C)O	{1: 2, 2: 1, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1}
OK	50-23-7	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O	{1: 2, 2: 1, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 3, 24: 1, 25: 1}
OK	50-24-8	CC12CC(C3C(C1CCC2(C(=O)CO)O)CCC4=CC(=O)C=CC34C)O	{1: 2, 2: 1, 11: 5, 12: 4, 13: 3, 14: 3, 15: 1, 20: 3, 24: 1, 25: 1}
OK	50-70-4	C([C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O	{2: 2, 3: 4, 20: 6}
OK	50-71-5	C1(=O)C(=O)NC(=O)NC1=O	{32: 2, 25: 4}
OK	50-81-7	C([C@@H]([C@@H]1C(=C(C(=O)O1)O)O)O)O	{2: 1, 3: 1, 12: 1, 15: 2, 20: 4, 28: 1}
OK	50-99-7	O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO	{2: 1, 3: 4, 20: 5, 26: 1}
OK	500-00-5	CC1CCC(=CC1)C(C)C	{1: 3, 3: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	500-02-7	CC(C)C1CCC(=O)C=C1	{1: 2, 3: 1, 11: 2, 12: 1, 14: 2, 25: 1}
OK	500-23-2	C1CC2C=CC1C=C2	{11: 2, 12: 2, 14: 4}
OK	500-24-3	C1=CC2C=CC1C=C2	{12: 2, 14: 6}
OK	500003-01-0	CCN(C)CCC(C)C	{1: 4, 2: 3, 3: 1, 33: 1}
OK	500005-27-6	CCOCCOC	{1: 2, 2: 3, 22: 2}
OK	500015-53-2	CCCCCCN[N+](=O)[O-]	{1: 1, 2: 5, 38: 1, 31: 1}
OK	500023-95-0	CC(C)OC(=O)F	{16: 1, 1: 2, 3: 1, 28: 1}
OK	500023-96-1	CCCCOC(=O)F	{16: 1, 1: 1, 2: 3, 28: 1}
OK	500033-42-1	CC(=O)OC1CCC1	{1: 1, 11: 3, 12: 1, 28: 1}
OK	5001-36-5	CC(C(=O)O)ON=C(C)C	{1: 3, 34: 1, 3: 1, 7: 1, 22: 1, 27: 1}
OK	5001-37-6	CCC(C(=O)O)ON=C(C)C	{1: 3, 2: 1, 3: 1, 7: 1, 34: 1, 22: 1, 27: 1}
OK	5001-82-1	C(N1C2C(N(C(=O)N2)CO)N(C1=O)CO)O	{32: 1, 33: 3, 2: 3, 12: 2, 20: 3, 25: 2}
OK	500116-88-1	C(C#N)C(=O)OC(C(F)(F)F)C(F)(F)F	{2: 1, 3: 1, 4: 2, 37: 1, 16: 6, 28: 1}
OK	5003-71-4	C(CN)CBr.Br	{2: 3, 18: 2, 30: 1}
OK	5006-22-4	C1CC(C1)C(=O)Cl	{24: 1, 17: 1, 11: 3, 12: 1}
OK	5006-62-2	CCOC(=O)C1CCCNC1	{32: 1, 1: 1, 2: 1, 11: 4, 12: 1, 28: 1}
OK	5008-52-6	CCN1C[C@@]2(CC[C@@H](C34[C@@H]2CC(C31)C56[C@H]4C[C@@H]([C@H](C5)C(=C)[C@H]6O)O)O)C	{1: 2, 2: 1, 5: 1, 33: 1, 11: 6, 12: 8, 13: 3, 15: 1, 20: 3}
OK	5008-69-5	CC(C)CSC	{40: 1, 1: 3, 2: 1, 3: 1}
OK	5008-73-1	CCCSC(C)C	{40: 1, 1: 3, 2: 2, 3: 1}
OK	5009-11-0	CC#CCC=C	{1: 1, 2: 1, 10: 2, 5: 1, 6: 1}
OK	5009-17-6	C1CC(C=C1)C2CCC=C2	{11: 4, 12: 2, 14: 4}
OK	5009-27-8	C1CC1=O	{25: 1, 11: 2}
OK	5009-31-4	CCC=CCCBr	{1: 1, 2: 3, 18: 1, 6: 2}
OK	5009-32-5	CC(=O)CCCCCC=C	{24: 1, 1: 1, 2: 5, 5: 1, 6: 1}
OK	501-22-4	C[C@@H]1[C@@H]2CCC3[C@@H](C2(C[C@H]([C@]4([C@H]1C[C@@H](C4(C)C)O)O)O)C[C@@]3(C)O)O	{1: 4, 11: 5, 12: 7, 13: 4, 20: 5}
OK	5011-61-0	C1CCC2(C1)C(=O)C3(C2=O)CCCC3	{25: 2, 11: 8, 13: 2}
OK	5018-27-9	C(C#N)NC=O	{2: 1, 37: 1, 26: 1, 31: 1}
OK	5018-30-4	COC(C(=O)OC)C(=O)OC	{1: 3, 3: 1, 28: 2, 22: 1}
OK	5019-82-9	C1CC2CC1CCC2=O	{25: 1, 11: 5, 12: 2}
OK	502-26-1	CCCCCCCCCCCCCCC1CCC(=O)O1	{1: 1, 2: 13, 11: 2, 12: 1, 28: 1}
OK	502-37-4	C=C1CC1CC(C(=O)O)NC(=O)CCC(C(=O)O)N	{2: 3, 3: 2, 5: 1, 11: 1, 12: 1, 15: 1, 24: 1, 27: 2, 30: 1, 31: 1}
OK	502-41-0	C1CCCC(CC1)O	{20: 1, 11: 6, 12: 1}
OK	502-42-1	C1CCCC(=O)CC1	{25: 1, 11: 6}
OK	502-44-3	C1CCC(=O)OCC1	{11: 5, 28: 1}
OK	502-47-6	CC(CCC=C(C)C)CC(=O)O	{1: 3, 2: 3, 3: 1, 6: 1, 7: 1, 27: 1}
OK	502-49-8	C1CCCC(=O)CCC1	{25: 1, 11: 7}
OK	502-50-1	C(CC(=O)O)C(=O)CCC(=O)O	{24: 1, 2: 4, 27: 2}
OK	502-52-3	CCCCCCCCCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCCCCCCCCC	{1: 2, 2: 30, 3: 1, 20: 1, 28: 2}
OK	502-56-7	CCCCC(=O)CCCC	{24: 1, 1: 2, 2: 6}
OK	502-59-0	CC(C)CCCC(C)NCCC(C)C	{1: 5, 2: 5, 3: 3, 31: 1}
OK	502-61-4	CC(=CCC/C(=C/C/C=C(\C)/C=C)/C)C	{1: 4, 2: 3, 5: 1, 6: 4, 7: 3}
OK	502-65-8	CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/CCC=C(C)C)\C)\C)\C)/C)/C)/C)C	{1: 10, 2: 4, 6: 18, 7: 8}
OK	502-69-2	CC(C)CCCC(C)CCCC(C)CCCC(=O)C	{24: 1, 1: 5, 2: 9, 3: 3}
OK	502-72-7	C1CCCCCCCC(=O)CCCCCC1	{25: 1, 11: 14}
OK	502-73-8	CCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCC	{24: 1, 1: 2, 2: 28}
OK	502-97-6	C1C(=O)OCC(=O)O1	{11: 2, 28: 2}
OK	502-99-8	CC(=C)CC/C=C(\C)/C=C	{1: 2, 2: 2, 5: 2, 6: 2, 7: 2}
OK	5024-21-5	COC(=O)CCCCCCCCCCCCC(=O)OC	{1: 2, 2: 12, 28: 2}
OK	5025-07-0	C1CC2CC1C(C2=O)CN3CCOCC3	{33: 1, 2: 1, 11: 7, 12: 3, 23: 1, 25: 1}
OK	5025-82-1	CC(=O)N1CSCC1C(=O)O	{1: 1, 33: 1, 41: 1, 11: 2, 12: 1, 24: 1, 27: 1}
OK	5026-76-6	C=CCCCC(C)C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1}
OK	50265-78-6	CC(C)(C)N=NC1(CCCC1)O	{1: 3, 34: 2, 4: 1, 11: 4, 13: 1, 20: 1}
OK	5027-32-7	CC(=O)C(C(C(=O)C)C(=O)C)C(=O)C	{24: 4, 1: 4, 3: 2}
OK	50277-65-1	C#CC(=O)Cl	{24: 1, 9: 1, 10: 1, 17: 1}
OK	50285-70-6	CCN(CC)C(=O)N(CC)N=O	{1: 3, 2: 3, 33: 2, 34: 1, 24: 1, 29: 1}
OK	50285-71-7	CCN(C(=O)N(C)C)N=O	{1: 3, 2: 1, 33: 2, 34: 1, 24: 1, 29: 1}
OK	50285-72-8	CCN(CC)C(=O)N(C)N=O	{1: 3, 2: 2, 33: 2, 34: 1, 24: 1, 29: 1}
OK	5029-21-0	CN(CCC#N)[N+](=O)[O-]	{1: 1, 2: 2, 37: 1, 38: 1, 33: 1}
OK	5029-46-9	C(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C(=O)O	{2: 2, 27: 1, 4: 1, 38: 3}
OK	5029-66-3	COC(=O)CCI	{1: 1, 2: 2, 19: 1, 28: 1}
OK	503-01-5	CC(CCC=C(C)C)NC	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 31: 1}
OK	503-09-3	C1C(O1)CF	{16: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	503-17-3	CC#CC	{1: 2, 10: 2}
OK	503-20-8	C(C#N)F	{16: 1, 2: 1, 37: 1}
OK	503-27-5	C=NN=C	{34: 2, 5: 2}
OK	503-29-7	C1CNC1	{32: 1, 11: 3}
OK	503-30-0	C1COC1	{11: 3, 23: 1}
OK	503-38-8	C(=O)(OC(Cl)(Cl)Cl)Cl	{17: 4, 4: 1, 28: 1}
OK	503-45-7	CC1CC=CC(C1)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 14: 2}
OK	503-46-8	CC1=CCCC(C1)(C)C	{1: 3, 11: 3, 13: 1, 14: 1, 15: 1}
OK	503-49-1	CC(CC(=O)O)(CC(=O)O)O	{1: 1, 2: 2, 27: 2, 4: 1, 20: 1}
OK	503-60-6	CC(=CCCl)C	{1: 2, 2: 1, 17: 1, 6: 1, 7: 1}
OK	503-64-0	CC=CC(=O)O	{1: 1, 27: 1, 6: 2}
OK	503-66-2	C(CO)C(=O)O	{2: 2, 27: 1, 20: 1}
OK	503-74-2	CC(C)CC(=O)O	{27: 1, 1: 2, 2: 1, 3: 1}
OK	503-76-4	CC(C[N+](=O)[O-])Cl	{1: 1, 2: 1, 3: 1, 38: 1, 17: 1}
OK	503-93-5	CC1=CC=CC(CC1=O)(C)C	{1: 3, 11: 1, 13: 1, 14: 3, 15: 1, 25: 1}
OK	50327-77-0	C(CCC(=O)O)CC(=O)O.C(CCN)CN	{2: 8, 27: 2, 30: 2}
OK	50341-35-0	CCC(C)(Br)Br	{1: 2, 2: 1, 4: 1, 18: 2}
OK	50351-47-8	CC(C)CSC#C	{1: 2, 2: 1, 3: 1, 40: 1, 9: 1, 10: 1}
OK	50356-49-5	C1C2C1C=COC=C2	{11: 1, 12: 2, 14: 4, 23: 1}
OK	50356-52-0	CC(C)(C)C1=CC2=C(C=C(C2=C1)C(C)(C)C)C(C)(C)C	{1: 9, 4: 3, 14: 3, 15: 5}
OK	5036-48-6	C1=CN(C=N1)CCCN	{33: 1, 2: 3, 35: 1, 30: 1, 14: 3}
OK	50363-43-4	CC1CSCS1	{1: 1, 11: 2, 12: 1, 41: 2}
OK	5039-61-2	CCCNN	{1: 1, 2: 2, 30: 1, 31: 1}
OK	50398-22-6	C(=O)I	{26: 1, 19: 1}
OK	50398-30-6	C(O)I	{2: 1, 19: 1, 20: 1}
OK	504-01-8	C1CC(CC(C1)O)O	{20: 2, 11: 4, 12: 2}
OK	504-02-9	C1CC(=O)CC(=O)C1	{25: 2, 11: 4}
OK	504-03-0	CC1CCCC(N1)C	{32: 1, 1: 2, 11: 3, 12: 2}
OK	504-07-4	C1CNC(=O)NC1=O	{32: 2, 25: 2, 11: 2}
OK	504-20-1	CC(=CC(=O)C=C(C)C)C	{24: 1, 1: 4, 6: 2, 7: 2}
OK	504-31-4	C1=CC(=O)OC=C1	{28: 1, 14: 4}
OK	504-44-9	CC(C)CCCC(C)CCCCC(C)CCCC(C)C	{1: 6, 2: 10, 3: 4}
OK	504-53-0	CCCCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCCCC	{24: 1, 1: 2, 2: 32}
OK	504-57-4	CCCCCCCCCC(=O)CCCCCCCCC	{24: 1, 1: 2, 2: 16}
OK	504-60-9	C/C=C/C=C	{1: 1, 5: 1, 6: 3}
OK	504-63-2	C(CO)CO	{2: 3, 20: 2}
OK	504-64-3	C(=C=O)=C=O	{8: 3, 29: 2}
OK	504-70-1	C1CNNC1	{32: 2, 11: 3}
OK	504-72-3	C1CNOC1	{32: 1, 11: 3, 23: 1}
OK	504-75-6	C1CN=CN1	{32: 1, 35: 1, 11: 2, 14: 1}
OK	504-78-9	C1CSCN1	{32: 1, 41: 1, 11: 3}
OK	504-88-1	C(C[N+](=O)[O-])C(=O)O	{2: 2, 27: 1, 38: 1}
OK	50409-83-1	C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O)C)C)C	{1: 4, 33: 1, 11: 11, 12: 10, 13: 2, 20: 1}
OK	50415-43-5	C1C2C=CC1C3C2C4CC3C5C4C6CC5C=C6	{11: 3, 12: 10, 14: 4}
OK	5042-30-8	C(C(F)(F)F)NN	{16: 3, 2: 1, 4: 1, 30: 1, 31: 1}
OK	50436-33-4	C1CC2CCC=C(C1)S2	{41: 1, 11: 5, 12: 1, 14: 1, 15: 1}
OK	50461-74-0	CCCC(=O)C(=O)OCC	{24: 1, 1: 2, 2: 3, 28: 1}
OK	50468-22-9	CC(C)C(CO)O	{1: 2, 2: 1, 3: 2, 20: 2}
OK	5048-19-1	C=CCCCC#N	{2: 3, 5: 1, 6: 1, 37: 1}
OK	5048-25-9	C=CCCCCC#N	{2: 4, 5: 1, 6: 1, 37: 1}
OK	5048-26-0	CC(=O)OCCCCC=C	{1: 1, 2: 4, 28: 1, 5: 1, 6: 1}
OK	505-10-2	CSCCCO	{40: 1, 1: 1, 2: 3, 20: 1}
OK	505-14-6	C(#N)SSC#N	{40: 2, 37: 2}
OK	505-18-0	C1CCN=CC1	{35: 1, 11: 4, 14: 1}
OK	505-19-1	C1CCNNC1	{32: 2, 11: 4}
OK	505-20-4	C1CCSSC1	{41: 2, 11: 4}
OK	505-22-6	C1COCOC1	{11: 4, 23: 2}
OK	505-23-7	C1CSCSC1	{41: 2, 11: 4}
OK	505-29-3	C1CSCCS1	{41: 2, 11: 4}
OK	505-32-8	CC(C)CCCC(C)CCCC(C)CCCC(C)(C=C)O	{1: 5, 2: 9, 3: 3, 4: 1, 5: 1, 6: 1, 20: 1}
OK	505-47-5	C(CNCCC(=O)O)C(=O)O	{2: 4, 27: 2, 31: 1}
OK	505-48-6	C(CCCC(=O)O)CCC(=O)O	{2: 6, 27: 2}
OK	505-52-2	C(CCCCCC(=O)O)CCCCCC(=O)O	{2: 11, 27: 2}
OK	505-54-4	C(CCCCCCCC(=O)O)CCCCCCC(=O)O	{2: 14, 27: 2}
OK	505-56-6	C(CCCCCCCCCCC(=O)O)CCCCCCCCCC(=O)O	{2: 20, 27: 2}
OK	505-60-2	C(CCl)SCCCl	{40: 1, 17: 2, 2: 4}
OK	505-63-5	C1CCOOCC1	{11: 5, 23: 2}
OK	505-65-7	C1CCOCOC1	{11: 5, 23: 2}
OK	505-66-8	C1CNCCNC1	{32: 2, 11: 5}
OK	505-71-5	C(CN[N+](=O)[O-])N[N+](=O)[O-]	{2: 2, 38: 2, 31: 2}
OK	505-73-7	C(C(=O)O)SSCC(=O)O	{40: 2, 2: 2, 27: 2}
OK	505-75-9	CCCC(C=CC=CC=CC#CC#CCCCO)O	{1: 1, 2: 5, 3: 1, 6: 6, 10: 4, 20: 2}
OK	505-84-0	CCCOCOCCC	{1: 2, 2: 5, 22: 2}
OK	505-92-0	CCCCCCCC=CCCC(=O)O	{1: 1, 2: 8, 27: 1, 6: 2}
OK	505-95-3	C(CCCCCC(=O)O)CCCCCO	{2: 11, 27: 1, 20: 1}
OK	50512-35-1	CC(C)OC(=O)C(=C1SCCS1)C(=O)OC(C)C	{1: 4, 3: 2, 7: 1, 41: 2, 11: 2, 15: 1, 28: 2}
OK	50515-91-8	C1CCC2(CC1)C3CCCC3C2=O	{25: 1, 11: 8, 12: 2, 13: 1}
OK	50526-52-8	CC1(C2CC3CCCCC3CC2CCO1)C	{1: 2, 11: 8, 12: 4, 13: 1, 23: 1}
OK	50526-53-9	CC1(C2C(CCC3C2CCCC3)CCO1)C	{1: 2, 11: 8, 12: 4, 13: 1, 23: 1}
OK	50530-12-6	C(CCCCC(=O)O)CCCCBr	{2: 9, 27: 1, 18: 1}
OK	50550-56-6	C=C1CCSCC1	{41: 1, 11: 4, 5: 1, 15: 1}
OK	50551-88-7	CC(CCC(=C)C)O	{1: 2, 2: 2, 3: 1, 5: 1, 7: 1, 20: 1}
OK	50555-55-0	C#CC1C(S1)C#C	{9: 2, 10: 2, 12: 2, 41: 1}
OK	5057-98-7	C1C[C@H]([C@H](C1)O)O	{20: 2, 11: 3, 12: 2}
OK	5057-99-8	C1C[C@H]([C@@H](C1)O)O	{20: 2, 11: 3, 12: 2}
OK	50599-41-2	CCN(C)N(C)C	{1: 4, 2: 1, 33: 2}
OK	50599-43-4	CCN(C)N(CC)CC	{1: 4, 2: 3, 33: 2}
OK	506-05-8	CCCCCCCCCCCF	{16: 1, 1: 1, 2: 10}
OK	506-12-7	CCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 15, 27: 1}
OK	506-13-8	C(CCCCCCCC(=O)O)CCCCCCCO	{2: 15, 27: 1, 20: 1}
OK	506-24-1	CCCCCCCCC#CCCCCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 10: 2}
OK	506-30-9	CCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 18, 27: 1}
OK	506-31-0	CCCCCCCCCCC=CCCCCCCCC(=O)O	{1: 1, 2: 16, 27: 1, 6: 2}
OK	506-32-1	CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O	{1: 1, 2: 10, 27: 1, 6: 8}
OK	506-33-2	CCCCCCCC/C=C/CCCCCCCCCCCC(=O)O	{1: 1, 2: 18, 27: 1, 6: 2}
OK	506-37-6	CCCCCCCCC=CCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 20, 27: 1, 6: 2}
OK	506-44-5	CC/C=C\C/C=C\C/C=C\CCCCCCCCO	{1: 1, 2: 11, 20: 1, 6: 6}
OK	506-46-7	CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 24, 27: 1}
OK	506-48-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 26, 27: 1}
OK	506-50-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 28, 27: 1}
OK	506-51-4	CCCCCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 23, 20: 1}
OK	506-52-5	CCCCCCCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 25, 20: 1}
OK	506-59-2	CNC.Cl	{1: 2, 31: 1, 17: 1}
OK	506-68-3	C(#N)Br	{18: 1, 37: 1}
OK	506-77-4	C(#N)Cl	{17: 1, 37: 1}
OK	506-78-5	C(#N)I	{19: 1, 37: 1}
OK	506-89-8	C(=O)(N)N.Cl	{24: 1, 17: 1, 30: 2}
OK	506-96-7	CC(=O)Br	{24: 1, 1: 1, 18: 1}
OK	50601-47-3	CC(=C)C(=O)OCC(Cl)(Cl)Cl	{1: 1, 2: 1, 4: 1, 5: 1, 7: 1, 17: 3, 28: 1}
OK	50606-31-0	COC(=O)N1CCNCC1	{32: 1, 1: 1, 11: 4, 28: 1, 33: 1}
OK	5061-21-2	C1COC(=O)C1Br	{28: 1, 18: 1, 11: 2, 12: 1}
OK	50616-05-2	CCCC[C@@H](CC)CNC[C@@H](CC)CCCC	{1: 4, 2: 10, 3: 2, 31: 1}
OK	50622-09-8	CC1(O[C@H]([C@@H](O1)CO)CO)C	{1: 2, 2: 2, 12: 2, 13: 1, 20: 2, 23: 2}
OK	50623-57-9	CCCCCCCCC(=O)OCCCC	{1: 2, 2: 10, 28: 1}
OK	50627-07-1	CCCCCCCCC(C)[N+](=O)[O-]	{1: 2, 2: 7, 3: 1, 38: 1}
OK	5063-03-6	CC(=O)C1CC2CC1C=C2	{24: 1, 1: 1, 11: 2, 12: 3, 14: 2}
OK	50634-05-4	COC1CC(C(O1)OC)C=O	{1: 2, 11: 1, 12: 3, 22: 2, 23: 1, 26: 1}
OK	50639-00-4	CCCC=C(CC)CO	{1: 2, 2: 4, 20: 1, 6: 1, 7: 1}
OK	50652-79-4	CCC(=CC(=O)OC)C	{1: 3, 2: 1, 28: 1, 6: 1, 7: 1}
OK	50657-29-9	C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O	{1: 7, 2: 3, 11: 10, 12: 19, 13: 6, 14: 1, 15: 1, 20: 10, 22: 3, 23: 3, 27: 1}
OK	50667-69-1	C(NC(=O)C(F)(F)F)O	{2: 1, 4: 1, 16: 3, 20: 1, 24: 1, 31: 1}
OK	50669-04-0	C1CC2C=CC=CC1S2	{41: 1, 11: 2, 12: 2, 14: 4}
OK	50695-43-7	CC1(N(N1C)C)C	{1: 4, 13: 1, 33: 2}
OK	507-02-8	CC(=O)I	{24: 1, 1: 1, 19: 1}
OK	507-09-5	CC(=O)S	{24: 1, 1: 1, 39: 1}
OK	507-19-7	CC(C)(C)Br	{1: 3, 18: 1, 4: 1}
OK	507-20-0	CC(C)(C)Cl	{1: 3, 4: 1, 17: 1}
OK	507-25-5	C(I)(I)(I)I	{19: 4, 4: 1}
OK	507-36-8	CCC(C)(C)Br	{1: 3, 2: 1, 4: 1, 18: 1}
OK	507-40-4	CC(C)(C)OCl	{1: 3, 4: 1, 22: 1, 17: 1}
OK	507-42-6	C(C(Br)(Br)Br)(O)O	{20: 2, 18: 3, 3: 1, 4: 1}
OK	507-45-9	CC(C(C)(C)Cl)Cl	{1: 3, 3: 1, 4: 1, 17: 2}
OK	507-52-8	CC(C)(C(F)(F)F)O	{16: 3, 1: 2, 4: 2, 20: 1}
OK	507-55-1	C(C(C(F)(F)Cl)(F)F)(F)Cl	{16: 5, 17: 2, 3: 1, 4: 2}
OK	507-63-1	C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{16: 17, 19: 1, 4: 8}
OK	507-68-6	C(=O)(C(C(C(C(=O)N)(F)F)(F)F)(F)F)N	{16: 6, 24: 2, 4: 3, 30: 2}
OK	507-70-0	CC1(C2CCC1(C(C2)O)C)C	{1: 3, 11: 3, 12: 2, 13: 2, 20: 1}
OK	50703-46-3	C([C@@H]1[C@@H](O1)CCl)Cl	{17: 2, 2: 2, 12: 2, 23: 1}
OK	50708-37-7	CC1=C(SC(=C2SC(=C(S2)C)C)S1)C	{1: 4, 41: 4, 15: 6}
OK	50722-38-8	CC1=CC2C(C(C1=O)O)(C3(CC(C(C34CO4)O2)OC(=O)C)C)CO	{1: 3, 2: 1, 11: 2, 12: 4, 13: 3, 14: 1, 15: 1, 20: 2, 23: 2, 25: 1, 28: 1}
OK	50727-77-0	CCCCCCCCCCCCCOC(=O)CCS	{1: 1, 2: 14, 28: 1, 39: 1}
OK	50733-60-3	COC(=O)C(C(OCC(=O)OC(F)F)(F)F)(F)F	{1: 1, 2: 1, 3: 1, 4: 2, 16: 6, 22: 1, 28: 2}
OK	50735-74-5	CCCCCCC(C=O)(Cl)Cl	{1: 1, 2: 5, 4: 1, 26: 1, 17: 2}
OK	50745-90-9	CC1CC2C3CCC(C3)C2C1	{1: 1, 11: 5, 12: 5}
OK	50745-92-1	CC1C2CCC1C3C2CCC3	{1: 1, 11: 5, 12: 5}
OK	5075-33-2	CCC#CC(C)(C)O	{1: 3, 2: 1, 4: 1, 10: 2, 20: 1}
OK	5075-92-3	CC1CCC(=O)N1C	{1: 2, 11: 2, 12: 1, 33: 1, 25: 1}
OK	5076-19-7	CC1C(O1)(C)C	{1: 3, 12: 1, 13: 1, 23: 1}
OK	5076-20-0	CC1(C(O1)(C)C)C	{1: 4, 13: 2, 23: 1}
OK	5076-82-4	CN1CC(=O)N(CC1=O)C	{1: 2, 11: 2, 33: 2, 25: 2}
OK	5077-67-8	CCC(=O)CO	{24: 1, 1: 1, 2: 2, 20: 1}
OK	50786-62-4	C#CC1CCC1	{9: 1, 10: 1, 11: 3, 12: 1}
OK	50787-12-7	CC(C)C=C(C(C)(C)C)C(C)(C)C	{1: 8, 3: 1, 4: 2, 6: 1, 7: 1}
OK	50787-13-8	CCC(=C(CC)CC)C	{1: 4, 2: 3, 7: 2}
OK	50787-14-9	CCCC(=C(CC)CC)CC	{1: 4, 2: 5, 7: 2}
OK	50789-30-5	COC(CCCC=O)OC	{1: 2, 2: 3, 3: 1, 26: 1, 22: 2}
OK	508-02-1	C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O	{1: 7, 11: 10, 12: 4, 13: 6, 14: 1, 15: 1, 20: 1, 27: 1}
OK	508-32-7	CC1(C2CC3C1(C3C2)C)C	{1: 3, 11: 2, 12: 3, 13: 2}
OK	508-65-6	CC1CCC2C(C3C(CN2C1)C4CC56C(C4(C(C3O)O)O)C(CC7C5(CCC(C7(O6)O)O)C)O)(C)O	{1: 3, 33: 1, 11: 8, 12: 11, 13: 5, 20: 7, 23: 1}
OK	508-75-8	CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C=O)O)O)O	{1: 2, 11: 10, 12: 9, 13: 4, 14: 1, 15: 1, 20: 5, 22: 1, 23: 1, 26: 1, 28: 1}
OK	508-77-0	CC1C(C(CC(O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O)OC)O	{1: 3, 11: 11, 12: 8, 13: 4, 14: 1, 15: 1, 20: 3, 22: 2, 23: 1, 26: 1, 28: 1}
OK	50807-71-1	CCCCCCCCC=CCCCCCCCCOC(=O)Cl	{1: 1, 2: 15, 28: 1, 6: 2, 17: 1}
OK	50815-73-1	C(F)(F)F.C(F)(F)(F)Cl	{16: 6, 17: 1, 3: 1, 4: 1}
OK	50816-18-7	CC(=O)OCCCCCCCCC=C	{1: 1, 2: 8, 28: 1, 5: 1, 6: 1}
OK	50816-19-8	C(CCCCBr)CCCO	{2: 8, 20: 1, 18: 1}
OK	50816-20-1	C1CCOC(C1)OCCCCCCCCBr	{2: 8, 11: 4, 12: 1, 18: 1, 22: 1, 23: 1}
OK	50816-21-2	CCC#CCCCCCCCCO[C@@H]1CCCCO1	{1: 1, 2: 9, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	50821-47-1	C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CN)N	{2: 3, 8: 2, 11: 13, 12: 4, 34: 2, 28: 1, 29: 2, 30: 2}
OK	5083-34-1	CC12CCC3C(C1CCC2O)CC4(CC4)C5=CC(=O)CCC35C	{1: 2, 11: 9, 12: 4, 13: 3, 14: 1, 15: 1, 20: 1, 25: 1}
OK	50836-65-2	C=CC(=O)OCCC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 7, 5: 1, 6: 1, 16: 15, 28: 1}
OK	50836-66-3	CC(=C)C(=O)OCCC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 7, 5: 1, 7: 1, 16: 15, 28: 1}
OK	50838-22-7	C/C=C/C(=O)N1CCCCC1	{24: 1, 1: 1, 11: 5, 6: 2, 33: 1}
OK	50838-23-8	C/C=C/C(=O)N1CCCC=C1	{1: 1, 6: 2, 33: 1, 11: 3, 14: 2, 24: 1}
OK	50847-92-2	CC1(C(=O)NCCS1)C	{32: 1, 1: 2, 41: 1, 11: 2, 13: 1, 25: 1}
OK	50849-47-3	CCCCCCCCCC1=C/C(=C\NO)/C(=O)C=C1	{1: 1, 2: 8, 6: 1, 14: 3, 15: 2, 20: 1, 25: 1, 31: 1}
OK	50850-26-5	CC(=O)N1CN(CN(CN(C1)[N+](=O)[O-])C(=O)C)[N+](=O)[O-]	{24: 2, 1: 2, 11: 4, 38: 2, 33: 4}
OK	50855-96-4	C=CC=CCl	{17: 1, 5: 1, 6: 3}
OK	50861-26-2	C1C2C1C3C4C2C34	{11: 1, 12: 6}
OK	50862-12-9	CCCCCCCOC(=O)C(C)CC	{1: 3, 2: 7, 3: 1, 28: 1}
OK	50862-66-3	CC(=C)C(=O)OC.CC(=C)C(=O)OCCN(C)C.COC(=O)C=C	{1: 6, 2: 2, 5: 3, 6: 1, 7: 2, 33: 1, 28: 3}
OK	50874-24-3	C1CC12CC23CC34CC4	{11: 6, 13: 3}
OK	50876-31-8	C[C@H]1C[C@@H](CC(C1)(C)C)C	{1: 4, 11: 3, 12: 2, 13: 1}
OK	50876-33-0	CC1(CCC(C1)(C)C)C	{1: 4, 11: 3, 13: 2}
OK	50876-88-5	CCC=CCCOCC(OCC)OCC	{1: 3, 2: 6, 3: 1, 22: 3, 6: 2}
OK	50879-06-6	C1CSC1O	{20: 1, 11: 2, 12: 1, 41: 1}
OK	50880-57-4	C[C@@H]1C=C2CC(=O)CC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@@H]([C@]4(CC3)C)O)C	{1: 3, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	50883-78-8	CN(C)C(=O)OCCOC	{1: 3, 2: 2, 28: 1, 22: 1, 33: 1}
OK	50886-03-8	CC(=O)OC=C.COC(=O)C=C.COC(=O)/C=C\C(=O)O	{1: 3, 27: 1, 28: 3, 5: 2, 6: 4}
OK	50888-73-8	C=CC=C=O	{8: 1, 5: 1, 6: 2, 29: 1}
OK	50893-53-3	CC(OC(=O)Cl)Cl	{1: 1, 3: 1, 28: 1, 17: 2}
OK	50895-59-5	C1C2C1C3C4C3C5C2C5C4	{11: 2, 12: 8}
OK	509-14-8	C([N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{4: 1, 38: 4}
OK	509-20-6	CCN1CC2([C@H]3C(C4[C@@H]1C3([C@@H]5C[C@]6(C([C@@H]5[C@@]4(C(C6OC)O)O)O)O)C(CC2O)OC)OC)COC	{1: 5, 2: 2, 33: 1, 11: 3, 12: 11, 13: 4, 20: 5, 22: 4}
OK	509-86-4	CCC1(C(=O)NC(=O)NC1=O)C2=CCCCCC2	{32: 2, 1: 1, 2: 1, 11: 5, 13: 1, 14: 1, 15: 1, 25: 3}
OK	509-87-5	CCC1(C(=O)NC(=O)NC1=O)N2CCCCC2	{32: 2, 1: 1, 2: 1, 33: 1, 11: 5, 13: 1, 25: 3}
OK	5090-16-4	CCC(C)/C=C/C(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 6: 2}
OK	5090-41-5	CCCCCCCCC=CCCCCCCCC=O	{1: 1, 2: 14, 26: 1, 6: 2}
OK	5090-54-0	CC(C)[C@@H]1CCC2(CCCC(=O)C2(C1)C)C	{1: 4, 3: 1, 11: 6, 12: 1, 13: 2, 25: 1}
OK	50902-82-4	CCCC(C)(CC)CC(=O)O	{1: 3, 2: 4, 27: 1, 4: 1}
OK	50903-99-6	COC(=O)[C@H](CCCN=C(N)N[N+](=O)[O-])N	{1: 1, 2: 3, 3: 1, 38: 1, 7: 1, 34: 1, 28: 1, 30: 2, 31: 1}
OK	50905-10-7	CCCCC(CCCCCC(=O)O)C(=O)O	{27: 2, 1: 1, 2: 8, 3: 1}
OK	50906-77-9	C(CSSCCC(=O)NN)C(=O)NN	{24: 2, 40: 2, 2: 4, 30: 2, 31: 2}
OK	50910-54-8	C1CC(CCC1N)O.Cl	{17: 1, 11: 4, 12: 2, 30: 1, 20: 1}
OK	50915-80-5	CC(CCBr)CC(C)(C)C	{1: 4, 2: 3, 3: 1, 4: 1, 18: 1}
OK	50922-82-2	CC(C)CCCCCOC(=O)C=C.C=CC(=O)N	{1: 2, 2: 5, 3: 1, 5: 2, 6: 2, 24: 1, 28: 1, 30: 1}
OK	50933-33-0	CCCCC=CCCC=CCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 6: 4}
OK	50940-49-3	C=CC(=O)OCCOC(=O)CCC(=O)O	{2: 4, 27: 1, 28: 2, 5: 1, 6: 1}
OK	50975-79-6	C(CO)C1C(=O)NC(C(=O)N1)CCO	{32: 2, 20: 2, 2: 4, 12: 2, 25: 2}
OK	50976-02-8	C=CC(=O)OC1C=CC2C1C3CC2C=C3	{5: 1, 6: 1, 11: 1, 12: 5, 14: 4, 28: 1}
OK	50977-09-8	CC(C)CCCCCOCCCN	{1: 2, 2: 8, 3: 1, 30: 1, 22: 1}
OK	50977-10-1	CC(C)CCCCCCCCCCOCCCN	{1: 2, 2: 13, 3: 1, 30: 1, 22: 1}
OK	50980-84-2	CCCC(=O)OCC(C)OC(=O)CCC	{1: 3, 2: 5, 3: 1, 28: 2}
OK	50985-30-3	C[C@H](CNCCNC[C@H](C)N)N	{1: 2, 2: 4, 3: 2, 30: 2, 31: 2}
OK	50991-12-3	CCC1CCCCC1C2CCCCC2	{1: 1, 2: 1, 11: 9, 12: 3}
OK	50996-72-0	CC(C)SCC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 40: 1}
OK	50998-05-5	CC(CN1CCOCC1)N	{1: 1, 2: 1, 3: 1, 33: 1, 11: 4, 23: 1, 30: 1}
OK	51-15-0	CN\1C=CC=C/C1=C\[NH+]=O.[Cl-]	{1: 1, 6: 1, 33: 1, 14: 4, 15: 1, 17: 1, 29: 1, 31: 1}
OK	51-35-4	C1[C@H](CN[C@@H]1C(=O)O)O	{27: 1, 20: 1, 11: 2, 12: 2, 32: 1}
OK	51-46-7	C1CN2CN3CCN(C2)CN1C3	{33: 4, 11: 8}
OK	51-73-0	C1CCN(C1)CC#CCN2CCCC2	{33: 2, 2: 2, 11: 8, 10: 2}
OK	51-75-2	CN(CCCl)CCCl	{1: 1, 2: 4, 33: 1, 17: 2}
OK	51-77-4	CC(=CCCC(=CCCC(=CCCC(=O)OCC=C(C)CCC=C(C)C)C)C)C	{1: 7, 2: 9, 28: 1, 6: 5, 7: 5}
OK	51-79-6	CCOC(=O)N	{1: 1, 2: 1, 28: 1, 30: 1}
OK	51-80-9	CN(C)CN(C)C	{1: 4, 2: 1, 33: 2}
OK	51-85-4	C(CSSCCN)N	{40: 2, 2: 4, 30: 2}
OK	51-98-9	CC(=O)O[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)C#C	{1: 2, 9: 1, 10: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	510-20-3	CCC(CC)(C(=O)O)C(=O)O	{1: 2, 2: 2, 27: 2, 4: 1}
OK	510-64-5	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CC[C@]34CO	{1: 1, 2: 1, 11: 8, 12: 3, 13: 2, 14: 1, 15: 1, 20: 1, 25: 2}
OK	5100-34-5	CCOC(=O)CCN=C=O	{1: 1, 2: 3, 8: 1, 34: 1, 28: 1, 29: 1}
OK	5100-36-7	CCOC(=O)CCCCCN=C=O	{1: 1, 2: 6, 8: 1, 34: 1, 28: 1, 29: 1}
OK	51000-85-2	C=CCCCCCCCCC(=O)NCCO	{2: 10, 5: 1, 6: 1, 20: 1, 24: 1, 31: 1}
OK	51020-42-9	CC1C(C(CC(O1)O)O)O	{1: 1, 11: 1, 12: 4, 20: 3, 23: 1}
OK	51022-69-6	CC(=O)OCC(=O)C12C(CC3C1(CC(C4(C3CCC5=CC(=O)C=CC54C)F)O)C)OC6(O2)CCCC6	{1: 3, 2: 1, 11: 8, 12: 4, 13: 5, 14: 3, 15: 1, 16: 1, 20: 1, 23: 2, 24: 1, 25: 1, 28: 1}
OK	51023-51-9	C=C.C(=C(F)F)(F)F.C(=O)(C(F)(F)F)C(F)(F)F	{16: 10, 24: 1, 4: 2, 5: 2, 7: 2}
OK	51027-86-2	C1CC2CC(C1)C3C2CCC3	{11: 7, 12: 4}
OK	51028-70-7	CC1=C(C(=O)C(=C(C1=O)C)Cl)C	{1: 3, 17: 1, 25: 2, 15: 4}
OK	5103-73-1	C12C(C(C(C1Cl)Cl)Cl)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{17: 9, 12: 5, 13: 3, 15: 2}
OK	5103-78-6	C1CC23C1(CC=CC2)CC=CC3	{11: 6, 13: 2, 14: 4}
OK	51034-46-9	CC(=C)C=CCl	{1: 1, 17: 1, 5: 1, 6: 2, 7: 1}
OK	5104-27-8	C(#N)C(=C(C#N)C(=C(C#N)C#N)C#N)C#N	{37: 6, 7: 4}
OK	5106-46-7	C(CCC(=O)O)CCOO	{2: 5, 27: 1, 20: 1, 22: 1}
OK	51065-64-6	CC#CCCC(C)C	{1: 3, 2: 2, 3: 1, 10: 2}
OK	51069-42-2	C1CN2CCC1(CC2)[N+](=O)[O-]	{33: 1, 11: 6, 13: 1, 38: 1}
OK	51076-95-0	CCOC(CCl)(OCC)OCC	{1: 3, 2: 4, 4: 1, 22: 3, 17: 1}
OK	51077-14-6	CC(C)(C)OC(=O)N1CC[C@H]1C(=O)O	{1: 3, 4: 1, 33: 1, 11: 2, 12: 1, 27: 1, 28: 1}
OK	51077-50-0	CC1=C(C(CCC1)(C)C)CC/C(=C/C=C/C(=C/C(=O)O)/C)/C	{1: 5, 2: 2, 6: 4, 7: 2, 11: 3, 13: 1, 15: 2, 27: 1}
OK	51079-52-8	CC(C)CC(C)CC(C)O	{1: 4, 2: 2, 3: 3, 20: 1}
OK	51079-79-9	CC(CC(C)O)CC(C)(C)C	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	5108-69-0	CC(OCC(C)([N+](=O)[O-])[N+](=O)[O-])OCC(C)([N+](=O)[O-])[N+](=O)[O-]	{1: 3, 2: 2, 3: 1, 4: 2, 38: 4, 22: 2}
OK	51093-03-9	C=CCN.C=CC(=O)O	{30: 1, 2: 1, 27: 1, 5: 2, 6: 2}
OK	51095-15-9	C#C[O]	{9: 1, 10: 1, 29: 1}
OK	511-20-6	C[C@H](CC[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C	{1: 6, 2: 2, 3: 3, 11: 10, 12: 5, 13: 2}
OK	511-34-2	C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)[C@H]([C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(C[C@H]([C@@H](C6)O)O)C)C)O)C)OC1	{1: 4, 11: 9, 12: 11, 13: 3, 20: 3, 23: 2}
OK	511-59-1	CC(=CCCC1(C2CCC(C2)C1=C)C)C	{1: 3, 2: 2, 5: 1, 6: 1, 7: 1, 11: 3, 12: 2, 13: 1, 15: 1}
OK	511-67-1	C1(=O)C(C(=O)NC(=O)N1)(Br)Br	{32: 2, 25: 3, 18: 2, 13: 1}
OK	511-70-6	CCC(CC)(C(=O)N)Br	{1: 2, 2: 2, 4: 1, 18: 1, 24: 1, 30: 1}
OK	511-96-6	CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CC(C(C6)O)O)C)C)C)OC1	{1: 4, 11: 10, 12: 10, 13: 3, 20: 2, 23: 2}
OK	51102-74-0	CSC(=C)SC	{40: 2, 1: 2, 5: 1, 7: 1}
OK	51105-00-1	CCCCOCCOCCOCCOCCOCCOCCCC	{1: 2, 2: 16, 22: 6}
OK	51108-31-7	CN(C)C(=NC#N)SC	{1: 3, 34: 1, 37: 1, 33: 1, 40: 1, 7: 1}
OK	51115-64-1	CCCC(=O)OCC(C)CC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	51115-67-4	CC(C)C(C)(C(C)C)C(=O)NC	{24: 1, 1: 6, 3: 2, 4: 1, 31: 1}
OK	51115-88-9	CC1(CCC2C3(C14CCC(C3)(CC4)C)O2)C	{1: 3, 11: 7, 12: 1, 13: 4, 23: 1}
OK	51116-73-5	CCC(C)CCBr	{1: 2, 2: 3, 3: 1, 18: 1}
OK	51117-19-2	CCC(C)C(=O)OCC=C(C)CCC=C(C)C	{1: 5, 2: 4, 3: 1, 6: 2, 7: 2, 28: 1}
OK	5113-66-6	CC1CC=C(C(=O)C1)C(C)C	{1: 3, 3: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	5113-87-1	C[C@@H]1CC[C@H](C=C1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 2, 14: 2}
OK	5113-93-9	C[C@@H]1CC[C@H](C=C1)C(C)C	{11: 2, 1: 3, 3: 1, 12: 2, 14: 2}
OK	51148-68-6	C=CCCCCCCCCCC=O	{2: 9, 26: 1, 5: 1, 6: 1}
OK	51152-12-6	CC1([C@@H]2CC[C@H]([C@@H]1C2)CO)C	{1: 2, 2: 1, 11: 3, 12: 3, 13: 1, 20: 1}
OK	51166-71-3	COCC1C2C(C(C(O1)OC3C(OC(C(C3O)OC)OC4C(OC(C(C4O)OC)OC5C(OC(C(C5O)OC)OC6C(OC(C(C6O)OC)OC7C(OC(C(C7O)OC)OC8C(OC(O2)C(C8O)OC)COC)COC)COC)COC)COC)COC)OC)O	{1: 14, 2: 7, 12: 35, 20: 7, 22: 14, 23: 14}
OK	5117-12-4	C=CC(=O)N1CCOCC1	{33: 1, 5: 1, 6: 1, 11: 4, 23: 1, 24: 1}
OK	51174-12-0	CCC(C)(C)CC(=C)C	{1: 4, 2: 2, 4: 1, 5: 1, 7: 1}
OK	51174-44-8	CC(CCO)C=C	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 20: 1}
OK	51175-34-9	C1CCCC(=C2CCCCCC2)CC1	{11: 12, 15: 2}
OK	51182-83-3	CCCCCCCCOC(C)CC	{1: 3, 2: 8, 3: 1, 22: 1}
OK	51193-99-8	CC(CCC=C)(C#C)O	{1: 1, 2: 2, 4: 1, 5: 1, 6: 1, 9: 1, 10: 1, 20: 1}
OK	512-04-9	C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1	{1: 4, 11: 10, 12: 8, 13: 3, 14: 1, 15: 1, 20: 1, 23: 2}
OK	512-12-9	CCCC1(C(=O)NC(=O)O1)CCC	{32: 1, 1: 2, 2: 4, 13: 1, 25: 1, 28: 1}
OK	512-16-3	CCC(C(=O)O)C1(CCCCC1)O	{1: 1, 2: 1, 3: 1, 11: 5, 13: 1, 20: 1, 27: 1}
OK	512-48-1	CCC(CC)(CC=C)C(=O)N	{1: 2, 2: 3, 4: 1, 5: 1, 6: 1, 24: 1, 30: 1}
OK	512-60-7	CC1(C2CC3C1(C3C2)C(=O)O)C	{27: 1, 1: 2, 11: 2, 12: 3, 13: 2}
OK	512-61-8	CC(=CCCC1(C2CC3C1(C3C2)C)C)C	{1: 4, 2: 2, 6: 1, 7: 1, 11: 2, 12: 3, 13: 2}
OK	512-69-6	C([C@@H]1[C@@H]([C@@H]([C@H](C(O1)OC[C@@H]2[C@H]([C@@H]([C@H](C(O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)O)O)CO)O)O)O)O)O)O)O	{2: 4, 12: 13, 13: 1, 20: 11, 22: 2, 23: 3}
OK	512-85-6	CC(C)C12CCC(C=C1)(OO2)C	{1: 3, 3: 1, 11: 2, 13: 2, 14: 2, 23: 2}
OK	51200-80-7	CCC(C)C(CC)(CC)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	51200-81-8	CCCC(C(C)C)(C(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	51200-82-9	CCCC(CCC)(C(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	51200-83-0	CC(C)C(C(C)C)(C(C)C)O	{1: 6, 3: 3, 4: 1, 20: 1}
OK	51200-87-4	CC1(COCN1)C	{32: 1, 1: 2, 11: 2, 13: 1, 23: 1}
OK	51203-11-3	CC(C)CC(C)(N=NC(C)(C)C)OC	{1: 7, 2: 1, 3: 1, 4: 2, 34: 2, 22: 1}
OK	51207-66-0	C1CCN(C1)C[C@@H]2CCCN2	{32: 1, 33: 1, 2: 1, 11: 7, 12: 1}
OK	51209-78-0	CCCCCC(C)C(=O)OC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	51238-63-2	COC1=CCCCCCCCCCC1	{1: 1, 11: 10, 22: 1, 14: 1, 15: 1}
OK	51238-95-0	CCCCCOC(=O)CCCC(=O)OCCCCC	{1: 2, 2: 11, 28: 2}
OK	51247-87-1	CC(COCC(C)OC(=O)C(=C)C)OCC(C)OC(=O)C(=C)C	{1: 5, 2: 3, 3: 3, 5: 2, 7: 2, 22: 2, 28: 2}
OK	51252-88-1	CC(=C)C(=O)OCCOC(=O)C1CCCCC1C(=O)O	{1: 1, 2: 2, 5: 1, 7: 1, 11: 4, 12: 2, 27: 1, 28: 2}
OK	51252-93-8	C1C(O1)CCl.C(CCCN)CCN.C(CCl)Cl	{2: 9, 11: 1, 12: 1, 17: 3, 23: 1, 30: 2}
OK	51255-61-9	CCCCC#CCCC#CCCCC	{1: 2, 2: 8, 10: 4}
OK	51257-84-2	C[C@@H]1CC[C@@H](O[C@@]12[C@H](C[C@@H](O2)[C@@H]3[C@H](C[C@H]([C@@](O3)(CO)O)C)C)C)[C@@]4(CC[C@@]5(O4)[C@@H]([C@@H](C[C@H](O5)[C@@H](C)/C=C(\C)/C(=O)[C@H](C)C[C@H](C)C(=O)O)O[C@H]6CC[C@@H]([C@H](O6)C)OC)C)C	{1: 12, 2: 2, 3: 3, 6: 1, 7: 1, 11: 9, 12: 13, 13: 4, 20: 2, 22: 2, 23: 6, 24: 1, 27: 1}
OK	51268-87-2	CC1(OC[C@@H](O1)CCCO)C	{1: 2, 2: 3, 11: 1, 12: 1, 13: 1, 20: 1, 23: 2}
OK	51272-66-3	C1CC2CC(C1)OO2	{11: 4, 12: 2, 23: 2}
OK	51273-50-8	C1C2CC3C2C1C3	{11: 3, 12: 4}
OK	51274-50-1	C(NC#N)O	{2: 1, 20: 1, 37: 1, 31: 1}
OK	51276-33-6	CC(=C)C(CCC(C)(C=C)O)O	{1: 2, 2: 2, 3: 1, 4: 1, 5: 2, 6: 1, 7: 1, 20: 2}
OK	5129-35-1	CCCOC(=O)C(C)(C)C	{1: 4, 2: 2, 4: 1, 28: 1}
OK	5129-36-2	CC(C)OC(=O)C(C)(C)C	{1: 5, 3: 1, 4: 1, 28: 1}
OK	5129-37-3	CCCCOC(=O)C(C)(C)C	{1: 4, 2: 3, 4: 1, 28: 1}
OK	5129-38-4	CC(C)COC(=O)C(C)(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 28: 1}
OK	5129-47-5	CCC(CC)C(=O)OC(C)C	{1: 4, 2: 2, 3: 2, 28: 1}
OK	5129-48-6	CCCCOC(=O)C(CC)CC	{1: 3, 2: 5, 3: 1, 28: 1}
OK	5129-58-8	CC(C)CCCCCCCCCCC(=O)OC	{1: 3, 2: 10, 3: 1, 28: 1}
OK	5129-60-2	CC(C)CCCCCCCCCCCCC(=O)OC	{1: 3, 2: 12, 3: 1, 28: 1}
OK	5129-61-3	CC(C)CCCCCCCCCCCCCCC(=O)OC	{1: 3, 2: 14, 3: 1, 28: 1}
OK	5129-66-8	CCC(C)CCCCCCCCCCC(=O)OC	{1: 3, 2: 11, 3: 1, 28: 1}
OK	5129-72-6	CCC(=O)NCC	{24: 1, 1: 2, 2: 2, 31: 1}
OK	5129-73-7	CCCC(=O)NCCC	{24: 1, 1: 2, 2: 4, 31: 1}
OK	51293-89-1	CCCCNC(=O)OCCOC(=O)C(=C)C	{1: 2, 2: 5, 5: 1, 7: 1, 28: 2, 31: 1}
OK	513-31-5	C=C(CBr)Br	{2: 1, 18: 2, 5: 1, 7: 1}
OK	513-35-9	CC=C(C)C	{1: 3, 6: 1, 7: 1}
OK	513-36-0	CC(C)CCl	{1: 2, 2: 1, 3: 1, 17: 1}
OK	513-37-1	CC(=CCl)C	{1: 2, 17: 1, 6: 1, 7: 1}
OK	513-38-2	CC(C)CI	{19: 1, 1: 2, 2: 1, 3: 1}
OK	513-42-8	CC(=C)CO	{1: 1, 2: 1, 20: 1, 5: 1, 7: 1}
OK	513-44-0	CC(C)CS	{1: 2, 2: 1, 3: 1, 39: 1}
OK	513-48-4	CCC(C)I	{19: 1, 1: 2, 2: 1, 3: 1}
OK	513-53-1	CCC(C)S	{1: 2, 2: 1, 3: 1, 39: 1}
OK	513-81-5	CC(=C)C(=C)C	{1: 2, 5: 2, 7: 2}
OK	513-85-9	CC(C(C)O)O	{1: 2, 3: 2, 20: 2}
OK	513-86-0	CC(C(=O)C)O	{24: 1, 1: 2, 3: 1, 20: 1}
OK	513-88-2	CC(=O)C(Cl)Cl	{24: 1, 1: 1, 3: 1, 17: 2}
OK	513-92-8	C(=C(I)I)(I)I	{19: 4, 7: 2}
OK	513-96-2	C(#N)C(C(Cl)(Cl)Cl)O	{17: 3, 3: 1, 4: 1, 37: 1, 20: 1}
OK	5130-24-5	C=COC(=O)Cl	{17: 1, 28: 1, 5: 1, 6: 1}
OK	51306-09-3	COCCCCCCCCOC	{1: 2, 2: 8, 22: 2}
OK	51308-99-7	C(CCCCO)CCCCCl	{17: 1, 2: 9, 20: 1}
OK	51309-10-5	C(CCCCCCl)CCCCO	{17: 1, 2: 10, 20: 1}
OK	5131-66-8	CCCCOCC(C)O	{1: 2, 2: 4, 3: 1, 20: 1, 22: 1}
OK	51316-12-2	CCCCOC(=O)C=C.CCCCOC(=O)C(=C)C.C=CC#N	{1: 3, 2: 6, 5: 3, 6: 2, 7: 1, 28: 2, 37: 1}
OK	5132-75-2	CCCCCCCCOC(=O)CCCCCC	{1: 2, 2: 12, 28: 1}
OK	51329-93-2	CCCCOC(=O)C=C.CCOC(=O)C=C.C=CC#N.C=CC(=O)N.C=C(CC(=O)O)C(=O)O	{1: 2, 2: 5, 5: 5, 6: 4, 7: 1, 24: 1, 27: 2, 28: 2, 30: 1, 37: 1}
OK	51333-22-3	CCCC1OC2CC3C4CCC5=CC(=O)C=CC5(C4C(CC3(C2(O1)C(=O)CO)C)O)C	{1: 3, 2: 3, 11: 4, 12: 6, 13: 3, 14: 3, 15: 1, 20: 2, 23: 2, 24: 1, 25: 1}
OK	51333-70-1	CC=CCCCC=CC	{1: 2, 2: 3, 6: 4}
OK	51340-26-2	C[C@H]1C[C@@H]2[C@H]([C@H](C3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5[C@H]([C@@H]4[C@H]3C)O)C)O)C)NC1	{32: 1, 1: 4, 11: 8, 12: 11, 13: 2, 14: 1, 15: 1, 20: 2, 23: 1}
OK	51345-51-8	CC1(CCCC(C1(C)C)(C)C)C	{1: 6, 11: 3, 13: 3}
OK	5135-18-2	COC(=O)C=CCl	{1: 1, 28: 1, 6: 2, 17: 1}
OK	5136-45-8	CCCCCCCCCCCC(=O)NCNC(=O)CCCCCCCCCCC	{24: 2, 1: 2, 2: 21, 31: 2}
OK	5138-86-3	CCC(CC)COC(=O)C(=C)C	{1: 3, 2: 3, 3: 1, 5: 1, 7: 1, 28: 1}
OK	514-10-3	CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)O)C	{1: 4, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 27: 1}
OK	514-14-7	CC1=CC2CCC1C2(C)C	{1: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1}
OK	514-51-2	CC1CCC2=C1CC3CCC2(C3(C)C)C	{1: 4, 11: 5, 12: 2, 13: 2, 15: 2}
OK	514-61-4	C[C@@]1(CCC2C1(CCC3C2CCC4=CC(=O)CCC34)C)O	{1: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	514-78-3	CC1=C(C(CCC1=O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C(=O)CCC2(C)C)C)\C)\C)/C)/C	{1: 10, 6: 14, 7: 4, 11: 4, 13: 2, 15: 4, 25: 2}
OK	514-92-1	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C(=O)O)/C)/C	{1: 9, 6: 18, 7: 6, 11: 3, 13: 1, 15: 2, 27: 1}
OK	514-94-3	CC1C(=CC=CC1(C)C)C	{1: 4, 12: 1, 13: 1, 14: 3, 15: 1}
OK	514-96-5	CC1=C(C(CC=C1)(C)C)C	{1: 4, 11: 1, 13: 1, 14: 2, 15: 2}
OK	5140-07-8	C1CC(C1CO)CO	{20: 2, 2: 2, 11: 2, 12: 2}
OK	5140-42-1	CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6O)OC)O)O)OC)OC)COC	{1: 5, 2: 2, 33: 1, 11: 5, 12: 9, 13: 4, 20: 3, 22: 4}
OK	51422-54-9	CCOCCOC(C)(C)C	{1: 4, 2: 3, 4: 1, 22: 2}
OK	51422-73-2	C1CC(C(C1)Br)F	{16: 1, 18: 1, 11: 3, 12: 2}
OK	51422-74-3	C1CC[C@@H]([C@H](C1)F)Br	{16: 1, 18: 1, 11: 4, 12: 2}
OK	51422-75-4	C1CC[C@H]([C@H](C1)Cl)Br	{17: 1, 18: 1, 11: 4, 12: 2}
OK	5143-30-6	CC(C)CCCOC(=O)C=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 28: 1}
OK	51449-77-5	C1=CC(=C2NNN=N2)C(=O)C=C1	{32: 2, 25: 1, 35: 2, 14: 4, 15: 2}
OK	5145-42-6	C1=CC(=O)C(=C(C1=O)Cl)Cl	{17: 2, 25: 2, 14: 2, 15: 2}
OK	5145-64-2	CCCN1C=CC=C1	{1: 1, 2: 2, 14: 4, 33: 1}
OK	5145-99-3	CCSC(C)C	{40: 1, 1: 3, 2: 1, 3: 1}
OK	51452-08-5	CCC(C)(C)OOCCO	{1: 3, 2: 3, 4: 1, 22: 2, 20: 1}
OK	5146-88-3	CCC1=NC(CO1)(C)C	{1: 3, 2: 1, 35: 1, 11: 1, 13: 1, 15: 1, 23: 1}
OK	51473-24-6	CCCCCCCCCCCCCC(=O)OCCCCCCCC(C)C	{1: 3, 2: 19, 3: 1, 28: 1}
OK	51479-36-8	CCCCCCCCCCCCCC(=O)OCCCl	{1: 1, 2: 14, 28: 1, 17: 1}
OK	51481-10-8	CC1=C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3(C[C@H]([C@H]([C@@]34CO4)O2)O)C)CO	{1: 2, 2: 1, 11: 2, 12: 4, 13: 3, 14: 1, 15: 1, 20: 3, 23: 2, 25: 1}
OK	515-00-4	CC1(C2CC=C(C1C2)CO)C	{1: 2, 2: 1, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 20: 1}
OK	515-03-7	C[C@]12CCCC(C1CC[C@@]([C@@H]2CC[C@](C)(C=C)O)(C)O)(C)C	{1: 5, 2: 2, 4: 1, 5: 1, 6: 1, 11: 5, 12: 2, 13: 3, 20: 2}
OK	515-69-5	CC1=CCC(CC1)C(C)(CCC=C(C)C)O	{1: 4, 2: 2, 4: 1, 6: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	515-81-1	CC(C#C)(C1CCC1)O	{1: 1, 4: 1, 9: 1, 10: 1, 11: 3, 12: 1, 20: 1}
OK	515-82-2	C(=O)NC(C(Cl)(Cl)Cl)O	{3: 1, 4: 1, 17: 3, 20: 1, 26: 1, 31: 1}
OK	515-83-3	CCOC(C(Cl)(Cl)Cl)O	{1: 1, 2: 1, 3: 1, 4: 1, 17: 3, 20: 1, 22: 1}
OK	515-84-4	CCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 1, 4: 1, 28: 1, 17: 3}
OK	515-93-5	CC(C(CO)N)O	{1: 1, 2: 1, 3: 2, 20: 2, 30: 1}
OK	515-94-6	C(C(C(=O)O)N)N	{27: 1, 2: 1, 3: 1, 30: 2}
OK	515-96-8	C(=O)(C(=O)NN)N	{24: 2, 30: 2, 31: 1}
OK	5150-93-6	CCCCOC(=O)CCC(=O)O	{1: 1, 2: 5, 27: 1, 28: 1}
OK	51500-09-5	C=C1C2CC3CN(C2)CN1C3	{33: 2, 11: 5, 12: 2, 5: 1, 15: 1}
OK	51513-58-7	CC(CC/C=C(\C)/CCC=C(C)C)CC=O	{1: 4, 2: 5, 3: 1, 6: 2, 7: 2, 26: 1}
OK	51534-37-3	CCCCCCCCCCCCCCC/C=C/C=O	{1: 1, 2: 14, 26: 1, 6: 2}
OK	51549-86-1	CC(=C=C)C1CC1	{1: 1, 5: 1, 7: 1, 8: 1, 11: 2, 12: 1}
OK	5156-41-2	CCC(C)(C)ON=O	{1: 3, 2: 1, 4: 1, 34: 1, 22: 1, 29: 1}
OK	51566-62-2	CC(CCC=C(C)C)CC#N	{1: 3, 2: 3, 3: 1, 37: 1, 6: 1, 7: 1}
OK	51575-83-8	CCCCCC#CCCl	{1: 1, 2: 5, 10: 2, 17: 1}
OK	51575-85-0	CCC#CCCCCl	{1: 1, 2: 4, 10: 2, 17: 1}
OK	51594-55-9	C1[C@@H](O1)CCl	{17: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	51595-91-6	CC1=C(C(CCC1)(C)C)C=C(C)C(C)O	{1: 5, 3: 1, 6: 1, 7: 1, 11: 3, 13: 1, 15: 2, 20: 1}
OK	516-05-2	CC(C(=O)O)C(=O)O	{27: 2, 1: 1, 3: 1}
OK	516-06-3	CC(C)C(C(=O)O)N	{27: 1, 1: 2, 3: 2, 30: 1}
OK	516-12-1	C1CC(=O)N(C1=O)I	{19: 1, 25: 2, 11: 2, 33: 1}
OK	516-38-1	C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4([C@H](CO)O)O)C)O)O	{1: 2, 2: 1, 3: 1, 11: 8, 12: 6, 13: 3, 20: 5}
OK	516-54-1	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C	{1: 3, 11: 9, 12: 6, 13: 2, 20: 1, 24: 1}
OK	516-55-2	CC(=O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C	{1: 3, 11: 9, 12: 6, 13: 2, 20: 1, 24: 1}
OK	516-58-5	C[C@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C)O	{1: 3, 3: 1, 11: 9, 12: 5, 13: 2, 20: 1, 25: 1}
OK	516-85-8	C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC=C3C2=CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 6, 3: 3, 6: 2, 11: 6, 12: 3, 13: 2, 14: 3, 15: 3, 20: 1}
OK	516-91-6	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)Br)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 18: 1}
OK	516-95-0	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 6, 13: 2, 20: 1}
OK	51601-35-5	CC(C)(CO)CO.C(CCC(=O)O)CC(=O)O.C(COCCO)O	{1: 2, 2: 10, 4: 1, 20: 4, 22: 1, 27: 2}
OK	51608-18-5	CCC=CCC1CCCC1=O	{1: 1, 2: 2, 6: 2, 11: 3, 12: 1, 25: 1}
OK	51609-06-4	CC(C)(C)NC1CCCCC1	{1: 3, 11: 5, 4: 1, 12: 1, 31: 1}
OK	5161-11-5	C[C@@H]1CSC[C@@H]1C	{1: 2, 11: 2, 12: 2, 41: 1}
OK	5161-13-7	C[C@@H]1CC[C@@H](S1)C	{1: 2, 11: 2, 12: 2, 41: 1}
OK	5161-16-0	CC1CCCCS1	{1: 1, 11: 4, 12: 1, 41: 1}
OK	5161-17-1	CC1CCSCC1	{1: 1, 11: 4, 12: 1, 41: 1}
OK	5161-75-1	CC1(CCCS1)C	{1: 2, 11: 3, 13: 1, 41: 1}
OK	5161-76-2	CC1(CCSC1)C	{1: 2, 11: 3, 13: 1, 41: 1}
OK	5161-77-3	C[C@H]1CCS[C@H]1C	{1: 2, 11: 2, 12: 2, 41: 1}
OK	5161-78-4	C[C@@H]1CCS[C@H]1C	{1: 2, 11: 2, 12: 2, 41: 1}
OK	5161-79-5	C[C@@H]1C[C@@H](SC1)C	{1: 2, 11: 2, 12: 2, 41: 1}
OK	5161-80-8	C[C@H]1C[C@@H](SC1)C	{1: 2, 11: 2, 12: 2, 41: 1}
OK	5162-44-7	C=CCCBr	{2: 2, 18: 1, 5: 1, 6: 1}
OK	51621-02-4	C1[C@@H]([C@H](CSS1)O)O	{20: 2, 11: 2, 12: 2, 41: 2}
OK	51627-76-0	C1CN2CCC1C(C2)C#N	{33: 1, 11: 5, 12: 2, 37: 1}
OK	51637-47-9	CCC(CC(=O)O)Cl	{27: 1, 1: 1, 2: 2, 3: 1, 17: 1}
OK	51637-93-5	CCCCCCCCCCCCCCCCCCOC(=O)Cl	{1: 1, 2: 17, 28: 1, 17: 1}
OK	5164-11-4	C=CCN(CC=C)N	{33: 1, 2: 2, 30: 1, 5: 2, 6: 2}
OK	5164-35-2	C1C2C1C=C2	{11: 1, 12: 2, 14: 2}
OK	51652-45-0	CCCCC#CCCCCOC1CCCCO1	{1: 1, 2: 7, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	51652-47-2	CCCCC=CCCCCO	{1: 1, 2: 7, 20: 1, 6: 2}
OK	51655-57-3	CCCCCCCC(CCCC)CO	{1: 2, 2: 10, 3: 1, 20: 1}
OK	51655-65-3	CCCCCCCCC(=C)CCCC	{1: 2, 2: 10, 5: 1, 7: 1}
OK	5166-35-8	CC(C(=C)C)Cl	{1: 2, 3: 1, 17: 1, 5: 1, 7: 1}
OK	5166-53-0	CC(C)C=CC(=O)C	{24: 1, 1: 3, 3: 1, 6: 2}
OK	5166-67-6	CCOC(=O)C1CCCN(C1)C	{1: 2, 2: 1, 33: 1, 11: 4, 12: 1, 28: 1}
OK	51673-64-4	CC(C=O)C(=O)OC	{1: 2, 26: 1, 3: 1, 28: 1}
OK	51673-84-8	COC(C=O)OC	{1: 2, 26: 1, 3: 1, 22: 2}
OK	5168-50-3	CCC(C)(C)OOC(C)(C)CCC(C)(C)OOC(C)(C)CC	{1: 10, 2: 4, 4: 4, 22: 4}
OK	51685-67-7	CC=C[CH]C	{1: 2, 6: 3}
OK	51698-73-8	C=C1C2C=CC(C1=C)C=C2	{12: 2, 5: 2, 14: 4, 15: 2}
OK	51698-77-2	C#CCOC(=O)C(Cl)(Cl)Cl	{2: 1, 4: 1, 9: 1, 10: 1, 17: 3, 28: 1}
OK	517-23-7	CC(=O)C1CCOC1=O	{24: 1, 1: 1, 11: 2, 12: 1, 28: 1}
OK	517-25-9	C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{3: 1, 38: 3}
OK	51703-69-6	CC(CC=CC(=C)C)C=C	{1: 2, 2: 1, 3: 1, 5: 2, 6: 3, 7: 1}
OK	51706-72-0	CC(=C)C(=O)OCCNCCO	{1: 1, 2: 4, 5: 1, 7: 1, 20: 1, 28: 1, 31: 1}
OK	51708-83-9	CC(=C)CCCC(=C)C	{1: 2, 2: 3, 5: 2, 7: 2}
OK	5171-84-6	CCC(C)(C)C(C)(C)CC	{1: 6, 2: 2, 4: 2}
OK	5171-86-8	CCC(CC)(CC)C(CC)(CC)CC	{1: 6, 2: 6, 4: 2}
OK	51716-63-3	C1C2CC(=O)CC2CC1=O	{25: 2, 11: 4, 12: 2}
OK	51721-39-2	CCCCCCC#CCCO	{1: 1, 2: 7, 20: 1, 10: 2}
OK	51729-59-0	CC(C)CCCCCC#N	{1: 2, 2: 5, 3: 1, 37: 1}
OK	5173-74-0	CC12CCCCC1(CCCC2)O	{1: 1, 11: 8, 20: 1, 13: 2}
OK	51750-65-3	CCC(C)(C)CC(C)(C)C	{1: 6, 2: 2, 4: 2}
OK	51755-37-4	CCCCC(CC)COCCCN.CC(=O)O	{1: 3, 2: 8, 3: 1, 22: 1, 27: 1, 30: 1}
OK	51755-66-9	CCCC(CCO)SC	{40: 1, 1: 2, 2: 4, 3: 1, 20: 1}
OK	51755-83-0	CCCC(CCO)S	{1: 1, 2: 4, 3: 1, 20: 1, 39: 1}
OK	51756-08-2	CCC(C(=O)C)C(=O)OC	{24: 1, 1: 3, 2: 1, 3: 1, 28: 1}
OK	51757-86-9	CC1(CC2CC1C=C2)C(=O)N	{1: 1, 11: 2, 12: 2, 13: 1, 14: 2, 24: 1, 30: 1}
OK	5176-27-2	CC(C)(C)OC(=O)N1C=CC=C1	{1: 3, 4: 1, 33: 1, 14: 4, 28: 1}
OK	51760-90-8	CC(C)C(C)C(=O)Cl	{24: 1, 1: 3, 3: 2, 17: 1}
OK	51761-72-9	CC(=NO)C1CC1	{1: 1, 34: 1, 7: 1, 11: 2, 12: 1, 20: 1}
OK	51762-05-1	COC1=C(N2[C@H]([C@H](C2=O)NC(=O)C(C3C=CCC=C3)N)SC1)C(=O)O	{1: 1, 3: 1, 33: 1, 41: 1, 11: 2, 12: 3, 14: 4, 15: 2, 22: 1, 24: 1, 25: 1, 27: 1, 30: 1, 31: 1}
OK	51770-98-0	CCOCC(=O)N	{24: 1, 1: 1, 2: 2, 30: 1, 22: 1}
OK	51775-36-1	C1C2C(C(C(C1(Cl)Cl)(C2(CCl)CCl)CCl)Cl)Cl	{17: 7, 2: 3, 11: 1, 12: 3, 13: 3}
OK	51776-45-5	CC(C)C(=C)OC	{1: 3, 3: 1, 5: 1, 22: 1, 7: 1}
OK	51787-59-8	C1CCC2C=CC(C1)N2	{32: 1, 11: 4, 12: 2, 14: 2}
OK	51795-88-1	C1CCOC(C1)OCCCCCCCCCCBr	{2: 10, 11: 4, 12: 1, 18: 1, 22: 1, 23: 1}
OK	51799-35-0	C(=C=C=O)=C=O	{8: 4, 29: 2}
OK	51799-36-1	C(=C=C=O)=C=C=O	{8: 5, 29: 2}
OK	518-75-2	C[C@@H]1[C@H](OC=C2C1=C(C(=C(C2=O)C(=O)O)O)C)C	{1: 3, 12: 2, 14: 1, 15: 5, 20: 1, 23: 1, 25: 1, 27: 1}
OK	51800-99-8	C[C@@]12CC[C@@H](C1(C)C)C(C2=O)C(=O)C(C(C(F)(F)F)(F)F)(F)F	{1: 3, 4: 3, 11: 2, 12: 2, 13: 2, 16: 7, 24: 1, 25: 1}
OK	51806-20-3	CCOC(CI)OCC	{19: 1, 1: 2, 2: 3, 3: 1, 22: 2}
OK	5181-34-0	C1CC23C1(C=CC=C2)C=CC=C3	{11: 2, 13: 2, 14: 8}
OK	51812-91-0	CCCCC=CCCCCCCCCOC1CCCCO1	{1: 1, 2: 11, 6: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	51822-28-7	C=CC(=O)O.C1COCCN1	{32: 1, 5: 1, 6: 1, 11: 4, 23: 1, 27: 1}
OK	5185-97-7	CC(=O)CCCOC(=O)C	{24: 1, 1: 2, 2: 3, 28: 1}
OK	51851-36-6	CC(COC(=O)CCCCCCCC(=O)OCC(C)O)O	{1: 2, 2: 9, 3: 2, 20: 2, 28: 2}
OK	51857-17-1	CC(C)(C)OC(=O)NCCCCCCN	{1: 3, 2: 6, 4: 1, 28: 1, 30: 1, 31: 1}
OK	5187-23-5	CCC1(COCOC1)CO	{1: 1, 2: 2, 11: 3, 13: 1, 20: 1, 23: 2}
OK	5187-71-3	CC(CC=C)C=O	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 26: 1}
OK	5187-81-5	CC(=C)C#CC#CC(=C)C	{1: 2, 10: 4, 5: 2, 7: 2}
OK	51872-48-1	CC(C(=C)C)Br	{1: 2, 18: 1, 3: 1, 5: 1, 7: 1}
OK	51890-90-5	CC(=C)C(=O)O.COC(=O)C=C.C=CC(=O)N	{1: 2, 5: 3, 6: 2, 7: 1, 24: 1, 27: 1, 28: 1, 30: 1}
OK	51891-58-8	CC(C)C(C)(F)F	{16: 2, 1: 3, 3: 1, 4: 1}
OK	51898-92-1	CC1(C2C1C3C(C3(C)C)C4C2C4(C)C)C	{1: 6, 12: 6, 13: 3}
OK	519-02-8	C1C[C@@H]2[C@H]3CCCN4[C@H]3[C@@H](CCC4)CN2C(=O)C1	{25: 1, 11: 10, 12: 4, 33: 2}
OK	51909-61-6	CC1(COC(C(C1NC)O)OC2C(CC(C(C2O)OC3C(CC=C(O3)CNC)N)N)N)O	{1: 3, 2: 1, 11: 3, 12: 10, 13: 1, 14: 1, 15: 1, 20: 3, 22: 2, 23: 2, 30: 3, 31: 2}
OK	51912-17-5	C1CCC(=O)NCC1.C1CN(CCN1)CCN.C(CCC(=O)O)CC(=O)O	{32: 2, 33: 1, 2: 6, 11: 9, 25: 1, 27: 2, 30: 1}
OK	51916-47-3	CCCCC(CCCO)O	{1: 1, 2: 6, 3: 1, 20: 2}
OK	51933-10-9	C=C(OC)C(C)=O	{24: 1, 1: 2, 5: 1, 22: 1, 7: 1}
OK	51936-55-1	C1CC(C(CCC2C1C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl)Br)Br	{11: 4, 12: 4, 13: 3, 15: 2, 17: 6, 18: 2}
OK	51937-00-9	CC=CCC=CCCCCCCCCO	{1: 1, 2: 9, 20: 1, 6: 4}
OK	51938-12-6	CCCN(CCCCO)N=O	{1: 1, 2: 6, 33: 1, 34: 1, 20: 1, 29: 1}
OK	51938-13-7	CCCCN(CCCO)N=O	{1: 1, 2: 6, 33: 1, 34: 1, 20: 1, 29: 1}
OK	51938-15-9	CCCCN(CC(=O)C)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 24: 1, 29: 1}
OK	51938-16-0	CN(CCCCO)N=O	{1: 1, 2: 4, 33: 1, 34: 1, 20: 1, 29: 1}
OK	51938-44-4	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O.C1[C@@H]([C@H](C(O1)[C@@H](CO)O)O)O.C1[C@@H]([C@H](C(O1)[C@@H](CO)O)O)O.C1[C@@H]([C@H](C(O1)[C@@H](CO)O)O)O	{1: 2, 2: 35, 3: 3, 11: 3, 12: 9, 20: 12, 23: 3, 27: 2}
OK	5194-50-3	C/C=C\C=C\C	{1: 2, 6: 4}
OK	5194-51-4	C/C=C/C=C/C	{1: 2, 6: 4}
OK	51943-33-0	C1CCC(CC1)CN2CCCCC2.Cl	{17: 1, 2: 1, 11: 10, 12: 1, 33: 1}
OK	51944-65-1	C/C=C/C(=O)N1CCCC1	{24: 1, 1: 1, 11: 4, 6: 2, 33: 1}
OK	51944-66-2	C/C=C/C(=O)N1CCOCC1	{1: 1, 6: 2, 33: 1, 11: 4, 23: 1, 24: 1}
OK	51946-06-6	CCCCCCCCCCCCCCCCCC(=O)NCCNCCNCCNCCNC(=O)CCCCCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 40, 31: 5}
OK	51952-42-2	CC=CCCBr	{1: 1, 2: 2, 18: 1, 6: 2}
OK	51953-88-9	C#CCCCCCCCCCOC1CCCCO1	{2: 9, 9: 1, 10: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	51956-42-4	CCCCCCCCCCCCSCC#N	{40: 1, 1: 1, 2: 12, 37: 1}
OK	51961-45-6	C1C(O1)CCl.C(CN)CNCCCN	{2: 7, 11: 1, 12: 1, 17: 1, 23: 1, 30: 2, 31: 1}
OK	51966-13-3	C1CC2CC1C3C2C4C5C3C6C4C6C5	{11: 4, 12: 10}
OK	5197-62-6	C(COCCOCCCl)O	{17: 1, 2: 6, 20: 1, 22: 2}
OK	5197-66-0	C(COCCOCCOCCCl)O	{17: 1, 2: 8, 20: 1, 22: 3}
OK	51978-15-5	CC(=C)C(=O)OCCOC(=O)C=CC(=O)O	{1: 1, 2: 2, 5: 1, 6: 2, 7: 1, 27: 1, 28: 2}
OK	52-01-7	CC(=O)S[C@@H]1CC2=CC(=O)CC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@]5([C@]4(CC3)C)CCC(=O)O5)C	{1: 3, 40: 1, 11: 9, 12: 4, 13: 3, 14: 1, 15: 1, 24: 1, 25: 1, 28: 1}
OK	52-21-1	CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)O	{1: 3, 2: 1, 11: 5, 12: 4, 13: 3, 14: 3, 15: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	52-31-3	CCC1(C(=O)NC(=O)NC1=O)C2=CCCCC2	{32: 2, 1: 1, 2: 1, 11: 4, 13: 1, 14: 1, 15: 1, 25: 3}
OK	52-39-1	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@H]4C(=O)CO)C=O)O	{1: 1, 2: 1, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1, 26: 1}
OK	52-43-7	C=CCC1(C(=O)NC(=O)NC1=O)CC=C	{32: 2, 2: 2, 5: 2, 6: 2, 13: 1, 25: 3}
OK	52-51-7	C(C(CO)([N+](=O)[O-])Br)O	{20: 2, 2: 2, 4: 1, 18: 1, 38: 1}
OK	52-52-8	C1CCC(C1)(C(=O)O)N	{27: 1, 11: 4, 13: 1, 30: 1}
OK	52-66-4	CC(C)(C(C(=O)O)N)S	{1: 2, 3: 1, 4: 1, 39: 1, 27: 1, 30: 1}
OK	52-67-5	CC(C)([C@H](C(=O)O)N)S	{1: 2, 3: 1, 4: 1, 39: 1, 27: 1, 30: 1}
OK	52-76-6	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CCCC[C@H]34	{1: 1, 9: 1, 10: 1, 11: 9, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1}
OK	52-78-8	CC[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)O	{1: 2, 2: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	52-89-1	C([C@@H](C(=O)O)N)S.Cl	{2: 1, 3: 1, 39: 1, 17: 1, 27: 1, 30: 1}
OK	52-90-4	C([C@@H](C(=O)O)N)S	{27: 1, 2: 1, 3: 1, 30: 1, 39: 1}
OK	520-59-2	C/C=C/1\CC(=C)[C@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O	{1: 2, 5: 1, 6: 1, 33: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 3, 20: 1, 28: 2}
OK	520-62-7	C1CN2CC[C@H]([C@H]2[C@H]1CO)O	{20: 2, 2: 1, 11: 4, 12: 3, 33: 1}
OK	520-65-0	CC=C1CC(C(C(=O)OCC2C(CN3C2C(CC3)OC1=O)O)(C)O)C	{1: 3, 6: 1, 33: 1, 11: 5, 12: 5, 13: 1, 15: 1, 20: 2, 28: 2}
OK	520-68-3	C/C=C(/C)\C(=O)O[C@@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@@]([C@H](C)O)(C(C)(C)O)O	{1: 5, 2: 1, 3: 1, 4: 2, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 3, 28: 2}
OK	520-84-3	C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)[C@@H](C[C@]34C)O)O	{1: 2, 2: 1, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 20: 4, 24: 1, 25: 1}
OK	520-85-4	C[C@H]1C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)O)C)[C@@]4(C1=CC(=O)CC4)C	{1: 4, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 1, 24: 1, 25: 1}
OK	52006-45-8	CC(C)CCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCC(C)C	{1: 4, 2: 27, 3: 2, 28: 1}
OK	52007-36-0	CCCCC(CC)COC(=O)C=C.C=CC(=O)O.C=CC(=O)OCCO	{1: 2, 2: 7, 3: 1, 5: 3, 6: 3, 20: 1, 27: 1, 28: 2}
OK	52007-78-0	C(C(CO)O)O.C(=C/C(=O)O)\C(=O)O	{27: 2, 2: 2, 3: 1, 20: 3, 6: 2}
OK	52019-78-0	CCCC[C@H](C)O	{1: 2, 2: 3, 3: 1, 20: 1}
OK	5202-78-8	CC(=O)NC=C	{24: 1, 1: 1, 5: 1, 6: 1, 31: 1}
OK	52034-03-4	CCCCCOC(=O)CBr	{1: 1, 2: 5, 28: 1, 18: 1}
OK	5204-74-0	CCN(CC)CC.CC(=O)O	{1: 4, 2: 3, 27: 1, 33: 1}
OK	5204-80-8	CCC(CC=C)C=O	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 26: 1}
OK	52049-26-0	C1CC(CCC1NC(=O)N(CCCl)N=O)O	{33: 1, 2: 2, 11: 4, 12: 2, 34: 1, 17: 1, 20: 1, 24: 1, 29: 1, 31: 1}
OK	5205-07-2	CC(=C)CCOC(=O)C	{1: 2, 2: 2, 28: 1, 5: 1, 7: 1}
OK	5205-10-7	CCCCCCC(=O)OCC=C(C)C	{1: 3, 2: 6, 28: 1, 6: 1, 7: 1}
OK	5205-34-5	CCCCCC(CCCC)O	{1: 2, 2: 7, 3: 1, 20: 1}
OK	5205-93-6	CC(=C)C(=O)NCCCN(C)C	{1: 3, 2: 3, 5: 1, 7: 1, 24: 1, 33: 1, 31: 1}
OK	52066-33-8	CC#CC(=O)C(C)C	{24: 1, 1: 3, 10: 2, 3: 1}
OK	52067-19-3	C[CH]F	{16: 1, 1: 1, 6: 1}
OK	52078-56-5	CCCCCCCCCCCC=CCCCCCCCCCC	{1: 2, 2: 19, 6: 2}
OK	52079-23-9	C1COC(=O)[C@H]1O	{20: 1, 11: 2, 12: 1, 28: 1}
OK	5208-59-3	CC(C)[C@@H]1CC[C@@]2([C@H]1[C@@H]3[C@H]2CCC3=C)C	{1: 3, 3: 1, 5: 1, 11: 4, 12: 4, 13: 1, 15: 1}
OK	5208-93-5	CC1=C(C(CCC1)(C)C)/C=C/C(C)(C=C)O	{1: 4, 4: 1, 5: 1, 6: 3, 11: 3, 13: 1, 15: 2, 20: 1}
OK	52086-82-5	C=C1CCCC(=C)C1	{11: 4, 5: 2, 15: 2}
OK	52089-54-0	CCC(C(=O)OCC)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 1}
OK	52089-55-1	CCCCC(C(=O)OCC)O	{1: 2, 2: 4, 3: 1, 20: 1, 28: 1}
OK	52093-21-7	C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H](C([C@@H]2O)O[C@@H]3[C@@H](CC[C@H](O3)CNC)N)N)N)O	{1: 3, 2: 1, 11: 4, 12: 11, 13: 1, 20: 3, 22: 2, 23: 2, 30: 3, 31: 2}
OK	52096-16-9	C1=NN=CN1N[N+](=O)[O-]	{33: 1, 35: 2, 38: 1, 14: 2, 31: 1}
OK	52096-24-9	CCCCN1C=CC=N1	{1: 1, 2: 3, 35: 1, 14: 3, 33: 1}
OK	521-03-9	CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	521-04-0	CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 20: 1}
OK	521-10-8	C[C@@]1(CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)O	{1: 3, 11: 8, 12: 4, 13: 3, 14: 1, 15: 1, 20: 2}
OK	521-12-0	CCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(C[C@H](C(=O)C4)C)C)C	{1: 4, 2: 1, 11: 8, 12: 6, 13: 2, 25: 1, 28: 1}
OK	521-13-1	CCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 5, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	521-18-6	CC12CCC(=O)CC1CCC3C2CCC4(C3CCC4O)C	{1: 2, 11: 9, 12: 5, 13: 2, 20: 1, 25: 1}
OK	52112-25-1	CCCCCCCCCCCCC#CC	{1: 2, 2: 11, 10: 2}
OK	52116-07-1	CC(C)(C)N=NC(C)(CC(C)(C)OC)OC	{1: 8, 2: 1, 4: 3, 34: 2, 22: 2}
OK	52132-58-8	CCCCCCCCCCCCCCCCOC(=O)CCl	{1: 1, 2: 16, 28: 1, 17: 1}
OK	52136-47-7	C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O	{2: 1, 8: 2, 11: 13, 12: 4, 34: 2, 28: 1, 29: 2}
OK	52146-32-4	C[C](C)F	{16: 1, 1: 2, 7: 1}
OK	52148-56-8	C1CCC2C=CC(C1)OO2	{11: 4, 12: 2, 14: 2, 23: 2}
OK	52162-18-2	CC(=O)N[C@@H](CCCN(C#N)N=O)C(=O)N	{1: 1, 2: 3, 3: 1, 37: 1, 33: 1, 34: 1, 24: 2, 29: 1, 30: 1, 31: 1}
OK	52176-13-3	C1=NC(=O)C(C(=O)N1)Br	{32: 1, 35: 1, 12: 1, 14: 1, 18: 1, 25: 2}
OK	52182-13-5	CC(CO)O.C(=C/C(=O)O)\C(=O)O.C1(C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C(=O)O	{1: 1, 2: 1, 3: 1, 6: 2, 12: 2, 13: 3, 15: 2, 17: 6, 20: 2, 27: 4}
OK	52185-81-6	C1CCC(CC1)NCl	{17: 1, 11: 5, 12: 1, 31: 1}
OK	52188-20-2	CCOC(C(C)CC1CC2CCC1C2)OCC	{1: 3, 2: 3, 3: 2, 11: 4, 12: 3, 22: 2}
OK	52188-21-3	CC(CC1CC2CCC1C2)C(OC)OC	{1: 3, 2: 1, 3: 2, 11: 4, 12: 3, 22: 2}
OK	52190-35-9	CSC1CCCCC1=O	{40: 1, 1: 1, 11: 4, 12: 1, 25: 1}
OK	52195-93-4	CC(=O)N1CCCC(=C1)C2=NCCCC2	{1: 1, 35: 1, 33: 1, 11: 7, 14: 1, 15: 2, 24: 1}
OK	522-33-8	C1CCN2C3CCCCN3C4CCCCN4C2C1	{33: 3, 11: 12, 12: 3}
OK	52204-65-6	CCCC1CCC(CC1)O	{1: 1, 2: 2, 11: 4, 12: 2, 20: 1}
OK	52207-83-7	C=CCNN.Cl	{2: 1, 5: 1, 6: 1, 17: 1, 30: 1, 31: 1}
OK	5221-17-0	C(C(C=O)Br)Br	{26: 1, 2: 1, 3: 1, 18: 2}
OK	52210-18-1	CC1=CCCC(C1C=CC(C)OC(=O)C)(C)C	{1: 5, 3: 1, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 28: 1}
OK	52215-12-0	C1CC(=O)NC1.C1CC(=O)NC1.C1CC(=O)NC1.Br.BrBr	{32: 3, 25: 3, 18: 3, 11: 9}
OK	52217-47-7	CCN(C(=O)NC(=O)C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 24: 2, 29: 1, 31: 1}
OK	5223-57-4	CC(C)(C)C/C=C\CC(C)(C)C	{1: 6, 2: 2, 4: 2, 6: 2}
OK	5223-58-5	CC(C)(C)C/C=C/CC(C)(C)C	{1: 6, 2: 2, 4: 2, 6: 2}
OK	52234-82-9	CCC(COC(=O)CCN1CC1)(COC(=O)CCN2CC2)COC(=O)CCN3CC3	{1: 1, 2: 10, 4: 1, 33: 3, 11: 6, 28: 3}
OK	52235-20-8	CCC(C)(C#N)N=NC(C)(C)C	{1: 5, 2: 1, 4: 2, 34: 2, 37: 1}
OK	52235-79-7	C(CCCCCN)CCCCCN.C(CCC(=O)O)CC(=O)O	{2: 15, 27: 2, 30: 2}
OK	52254-38-3	CCCCCCCCCCCCC(=C)C	{1: 2, 2: 11, 5: 1, 7: 1}
OK	52254-50-9	CCCCCCCCCCCCCCCCCC(=C)C	{1: 2, 2: 16, 5: 1, 7: 1}
OK	52271-32-6	CCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C.CC(=C)C(=O)OC	{1: 3, 2: 4, 4: 1, 5: 4, 6: 3, 7: 1, 28: 4}
OK	52279-00-2	CC(=CCCC(C)(C)C=O)C	{1: 4, 2: 2, 4: 1, 6: 1, 7: 1, 26: 1}
OK	52279-42-2	C1=C/C(=C\NCCCCCCCN/C=C\2/C(=O)C=CC=C2)/C(=O)C=C1	{2: 7, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
OK	52279-43-3	C1=C/C(=C\NCCCOCCCN/C=C\2/C(=O)C=CC=C2)/C(=O)C=C1	{2: 6, 6: 2, 14: 8, 15: 2, 22: 1, 25: 2, 31: 2}
OK	52279-44-4	C1=C/C(=C/NCCCSCCCN/C=C/2\C(=O)C=CC=C2)/C(=O)C=C1	{2: 6, 6: 2, 40: 1, 14: 8, 15: 2, 25: 2, 31: 2}
OK	52279-45-5	C1=C/C(=C\NCCCNCCCN/C=C\2/C(=O)C=CC=C2)/C(=O)C=C1	{2: 6, 6: 2, 14: 8, 15: 2, 25: 2, 31: 3}
OK	52291-46-0	CC(C)(C)N(C)N(C)C(C)(C)C	{1: 8, 4: 2, 33: 2}
OK	523-47-7	CC1=CC[C@@H]2[C@@H](C1)[C@@H](CC=C2C)C(C)C	{1: 4, 3: 1, 11: 3, 12: 3, 14: 2, 15: 2}
OK	523-86-4	CC1CC(CC(C1=O)C(CC2CC(=O)NC(=O)C2)O)(C)O	{32: 1, 1: 2, 2: 1, 3: 1, 11: 4, 12: 3, 13: 1, 20: 2, 25: 3}
OK	52304-17-3	CC(C)COC(=O)N(CO)CO	{1: 2, 2: 3, 3: 1, 33: 1, 20: 2, 28: 1}
OK	52310-21-1	CCCCCO[O]	{1: 1, 2: 4, 29: 1, 22: 1}
OK	52313-87-8	CC(=CC(=O)OC)CC(=O)OC	{1: 3, 2: 1, 28: 2, 6: 1, 7: 1}
OK	52314-67-7	CC1(C(C1C(=O)Cl)C=C(Cl)Cl)C	{1: 2, 6: 1, 7: 1, 12: 2, 13: 1, 17: 3, 24: 1}
OK	52315-75-0	CCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)O	{1: 1, 2: 14, 3: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	52317-98-3	CCC(CC)NC	{1: 3, 2: 2, 3: 1, 31: 1}
OK	52326-10-0	CC(=C)CSC	{40: 1, 1: 2, 2: 1, 5: 1, 7: 1}
OK	52337-70-9	C(N=C(N)N)O.Cl	{2: 1, 7: 1, 34: 1, 17: 1, 20: 1, 30: 2}
OK	52337-72-1	CC(=O)OCCOCCOCCO	{1: 1, 2: 6, 20: 1, 22: 2, 28: 1}
OK	52338-90-6	C1C(O1)CCCC2C(O2)CC3CO3	{2: 4, 11: 2, 12: 4, 23: 3}
OK	52345-49-0	CC(C)(C)OOC(=O)/C=C/C(=O)OC	{1: 4, 4: 1, 22: 1, 6: 2, 28: 2}
OK	52345-51-4	CC(C)(C)OOC(=O)C=CC(=O)OCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 3, 22: 1, 28: 2}
OK	52345-52-5	CC(C)(C)OOC(=O)CCC(=O)OCC=C	{1: 3, 2: 3, 4: 1, 5: 1, 6: 1, 22: 1, 28: 2}
OK	52363-43-6	CCCCCCCCCCOC(=O)CCCCC	{1: 2, 2: 13, 28: 1}
OK	52373-72-5	CC1(OC[C@@H](O1)C(=O)OC)C	{1: 3, 11: 1, 12: 1, 13: 1, 23: 2, 28: 1}
OK	5238-27-7	CCCC(C)C(=O)Cl	{24: 1, 1: 2, 2: 2, 3: 1, 17: 1}
OK	52387-52-7	CCC1(C(=O)NC(=O)O1)C	{32: 1, 1: 2, 2: 1, 13: 1, 25: 1, 28: 1}
OK	5239-82-7	C1CC1CC(=O)O	{27: 1, 2: 1, 11: 2, 12: 1}
OK	5240-32-4	CC(=O)OC1(CCCCC1)C#C	{1: 1, 9: 1, 10: 1, 11: 5, 13: 1, 28: 1}
OK	5240-72-2	C1CC2CC1CC2CO	{20: 1, 2: 1, 11: 4, 12: 3}
OK	5240-87-9	C1C2C=CC=CC1C=C2	{11: 1, 12: 2, 14: 6}
OK	52404-33-8	C=CC(=O)OCCO.C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O	{2: 3, 5: 1, 6: 1, 8: 2, 11: 13, 12: 4, 34: 2, 20: 1, 28: 2, 29: 2}
OK	52404-84-9	C=C(CC(=O)O)C(=O)O.C1C(O1)CCl.C(CNCCN)N	{2: 6, 5: 1, 7: 1, 11: 1, 12: 1, 17: 1, 23: 1, 27: 2, 30: 2, 31: 1}
OK	52418-81-2	CCCC(CCCl)O	{1: 1, 2: 4, 3: 1, 20: 1, 17: 1}
OK	52433-27-9	CN1CCN1C	{1: 2, 11: 2, 33: 2}
OK	52438-71-8	CCOC1CCC=C(O1)C	{1: 2, 2: 1, 11: 2, 12: 1, 14: 1, 15: 1, 22: 1, 23: 1}
OK	5244-34-8	C(CSCCSCCO)O	{40: 2, 2: 6, 20: 2}
OK	52444-01-6	CC(C)(CCl)SC(C)(C)CCl	{40: 1, 1: 4, 2: 2, 4: 2, 17: 2}
OK	52458-04-5	CC=CCOCCO	{1: 1, 2: 3, 20: 1, 22: 1, 6: 2}
OK	5247-14-3	C=CCC(C#N)(C#N)C#N	{2: 1, 4: 1, 5: 1, 6: 1, 37: 3}
OK	52475-89-5	CC(=CCCC1=CCCC(C1)C=O)C	{1: 2, 2: 2, 6: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	52479-58-0	CC(C)(COCCCO)COCCCO	{1: 2, 2: 8, 4: 1, 22: 2, 20: 2}
OK	52517-67-6	CCCCCCCCCCC(OC)OC	{1: 3, 2: 9, 3: 1, 22: 2}
OK	52519-51-4	CC(=C)C(=O)OCCC(C(F)(F)F)(F)F	{1: 1, 2: 2, 4: 2, 5: 1, 7: 1, 16: 5, 28: 1}
OK	52547-86-1	C#CC12CCN(CC1)CC2	{9: 1, 10: 1, 11: 6, 13: 1, 33: 1}
OK	52557-31-0	C[C@]1(CC23C[C@@H](C(=O)C([C@H](C[C@@H](C(=C)[C@@H]2CC[C@@H]1[C@H]3O)O)O)(C)C)O)O	{1: 3, 5: 1, 11: 5, 12: 6, 13: 3, 15: 1, 20: 5, 25: 1}
OK	52557-98-9	CC1(C2CCC(C2)C1C(=O)O)C	{27: 1, 1: 2, 11: 3, 12: 3, 13: 1}
OK	52558-73-3	CCCCCCCCCCCCCC(=O)N(C)CC(=O)O	{24: 1, 1: 2, 2: 13, 27: 1, 33: 1}
OK	5256-65-5	CC1CCC(C=C1)C(C)C	{11: 2, 1: 3, 3: 1, 12: 2, 14: 2}
OK	5257-20-5	C1CC2C(=O)OC(C1)O2	{28: 1, 11: 3, 12: 2, 23: 1}
OK	52583-02-5	CN(C)CCCC12CC3CC(C1)CC(C3)C2Br.Cl	{1: 2, 2: 3, 33: 1, 11: 5, 12: 4, 13: 1, 17: 1, 18: 1}
OK	52583-06-9	CC(CC12CC3(CC(C1)(CC(C3)(C2Cl)C)C)C)NC.Cl	{1: 5, 2: 1, 3: 1, 11: 5, 12: 1, 13: 4, 17: 2, 31: 1}
OK	5259-31-4	CC1CC=CCC1CO	{1: 1, 2: 1, 11: 2, 12: 2, 14: 2, 20: 1}
OK	5259-50-7	COC(=O)C1CC2CCC1(C=C2)OC	{1: 2, 11: 3, 12: 2, 13: 1, 14: 2, 22: 1, 28: 1}
OK	5259-65-4	CC1=CCC(=O)CC1	{1: 1, 11: 3, 25: 1, 14: 1, 15: 1}
OK	5259-97-2	C1CNC(=O)OC1	{32: 1, 11: 3, 28: 1}
OK	5259-98-3	C(CCO)CCCl	{17: 1, 2: 5, 20: 1}
OK	52598-09-1	CCCN(CCC)N(CC)CC	{1: 4, 2: 6, 33: 2}
OK	52598-10-4	CCCCN(C)N(C)C	{1: 4, 2: 3, 33: 2}
OK	526-35-2	CC1C(=O)N(C(=O)O1)CC=C	{1: 1, 2: 1, 5: 1, 6: 1, 33: 1, 12: 1, 25: 1, 28: 1}
OK	526-62-5	C1CN1C2=CC(=O)C(=CC2=O)N3CC3	{25: 2, 11: 4, 33: 2, 14: 2, 15: 2}
OK	526-78-3	C(C(C(=O)O)Br)(C(=O)O)Br	{27: 2, 18: 2, 3: 2}
OK	526-84-1	C(=C(\C(=O)O)/O)(\C(=O)O)/O	{27: 2, 20: 2, 7: 2}
OK	526-86-3	CC1=C(C(=O)C=CC1=O)C	{1: 2, 25: 2, 14: 2, 15: 2}
OK	526-87-4	C1=CC(C(C(C1O)O)O)O	{20: 4, 12: 4, 14: 2}
OK	526-95-4	C(C(C(C(C(C(=O)O)O)O)O)O)O	{27: 1, 2: 1, 3: 4, 20: 5}
OK	526-99-8	C(C(C(C(=O)O)O)O)(C(C(=O)O)O)O	{27: 2, 3: 4, 20: 4}
OK	52607-81-5	CNC(=O)OCCOC(=O)C=C	{1: 1, 2: 2, 5: 1, 6: 1, 28: 2, 31: 1}
OK	5261-65-4	CC1CC2CCN1CC2	{1: 1, 11: 5, 12: 2, 33: 1}
OK	52611-78-6	C[C@]1(CC23C[C@H](C(=O)C([C@H](C[C@@H](C(=C)[C@@H]2CC[C@@H]1[C@H]3O)O)O)(C)C)O)O	{1: 3, 5: 1, 11: 5, 12: 6, 13: 3, 15: 1, 20: 5, 25: 1}
OK	52612-42-7	C[C@@H]1CCCC([C@@H]1C(=O)C)(C)C	{24: 1, 1: 4, 11: 3, 12: 2, 13: 1}
OK	52627-55-1	C(CCC(=O)O)CC(=O)O.C(C(CO)(CO)CO)O	{20: 4, 2: 8, 27: 2, 4: 1}
OK	52632-06-1	CCOC(=O)C(CCSC)N=C=O	{1: 2, 2: 3, 3: 1, 8: 1, 34: 1, 40: 1, 28: 1, 29: 1}
OK	52637-01-1	C(COCCOC(=O)CCl)O	{17: 1, 2: 5, 20: 1, 22: 1, 28: 1}
OK	5264-35-7	COC1=NCCC1	{1: 1, 11: 3, 35: 1, 22: 1, 15: 1}
OK	52648-04-1	CC(C)CCCCCBr	{1: 2, 2: 5, 3: 1, 18: 1}
OK	52655-10-4	CC(C)CCCCCCCCCCCCCCCCCO	{1: 2, 2: 17, 3: 1, 20: 1}
OK	52663-48-6	CCCCCCCCCCCCCCCCCCOC(=O)CC	{1: 2, 2: 18, 28: 1}
OK	52664-82-1	CC(=C)C(=O)O.CC(=C)C(=O)OC.C=CC(=O)OCC(CBr)Br	{1: 3, 2: 2, 3: 1, 5: 3, 6: 1, 7: 2, 18: 2, 27: 1, 28: 2}
OK	52670-32-3	CC(C)C(C)CC(C)C(C)C	{1: 6, 2: 1, 3: 4}
OK	52670-33-4	CC(C)C(C)C(C)(C)C(C)C	{1: 7, 3: 3, 4: 1}
OK	52670-35-6	CC(C)C(C)CC(C)(C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	52670-36-7	CC(C)C(C)(C)C(C)(C)C(C)C	{1: 8, 3: 2, 4: 2}
OK	52673-65-1	CN(C)CCC12CC3CC(C1)CC(C3)(C2)CCN(C)C.Cl.Cl	{1: 4, 2: 4, 33: 2, 11: 6, 12: 2, 13: 2, 17: 2}
OK	52673-66-2	CC(CC12CC3CC(C1)CC(C3)(C2)CC(C)N(C)C)N(C)C.Cl.Cl	{1: 6, 2: 2, 3: 2, 33: 2, 11: 6, 12: 2, 13: 2, 17: 2}
OK	52687-98-6	CCCSSSSCCC	{40: 4, 1: 2, 2: 4}
OK	52688-04-7	CCCC(C)OC(=O)CC#N	{1: 2, 2: 3, 3: 1, 28: 1, 37: 1}
OK	52688-05-8	CC(C)CC(C)OC(=O)CC#N	{1: 3, 2: 2, 3: 2, 28: 1, 37: 1}
OK	52688-06-9	CC(C)CCC(C)OC(=O)CC#N	{1: 3, 2: 3, 3: 2, 28: 1, 37: 1}
OK	52688-08-1	CCCCCCC(C)OC(=O)CC#N	{1: 2, 2: 6, 3: 1, 28: 1, 37: 1}
OK	52688-11-6	C1CCC(CC1)OC(=O)CC#N	{28: 1, 2: 1, 11: 5, 12: 1, 37: 1}
OK	52688-75-2	CCCC(CC)F	{16: 1, 1: 2, 2: 3, 3: 1}
OK	52696-91-0	CCCCNC(=O)N(C)C	{24: 1, 1: 3, 2: 3, 33: 1, 31: 1}
OK	52698-46-1	CC(C)C(OC)(OC)OC	{1: 5, 3: 1, 4: 1, 22: 3}
OK	527-17-3	CC1=C(C(=O)C(=C(C1=O)C)C)C	{1: 4, 25: 2, 15: 4}
OK	527-21-9	C1(=C(C(=O)C(=C(C1=O)F)F)F)F	{16: 4, 25: 2, 15: 4}
OK	527-61-7	CC1=CC(=O)C=C(C1=O)C	{1: 2, 25: 2, 14: 2, 15: 2}
OK	527-89-9	C1=CC(=C(S)S)C(=O)C=C1	{25: 1, 15: 1, 39: 2, 14: 4, 7: 1}
OK	52708-22-2	CC1(CC(C1)C=C)C	{1: 2, 5: 1, 6: 1, 11: 2, 12: 1, 13: 1}
OK	52708-23-3	C1CC2(CC2)C=C1	{11: 4, 13: 1, 14: 2}
OK	5271-38-5	CSCCO	{40: 1, 1: 1, 2: 2, 20: 1}
OK	52713-63-0	CC(CC=C)CC=C	{1: 1, 2: 2, 3: 1, 5: 2, 6: 2}
OK	52713-81-2	CCC(C)CC#C	{1: 2, 2: 2, 3: 1, 10: 1, 9: 1}
OK	52715-93-2	CSCCC(C(=O)NC(CCSC)C(=O)O)N	{1: 2, 2: 4, 3: 2, 40: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	52716-12-8	CN(C)C(=O)N(C)OC(=O)Cl	{24: 1, 1: 3, 28: 1, 33: 2, 17: 1}
OK	52718-96-4	COC=CC=C(C#N)C#N	{1: 1, 37: 2, 22: 1, 6: 3, 7: 1}
OK	5272-02-6	CCCCC(C)(CC)Cl	{1: 3, 2: 4, 4: 1, 17: 1}
OK	52722-86-8	CC1(CC(CC(N1CCO)(C)C)O)C	{1: 4, 2: 2, 33: 1, 11: 2, 12: 1, 13: 2, 20: 2}
OK	52731-39-2	CCCCN(CCCCOC(=O)C)N=O	{1: 2, 2: 7, 33: 1, 34: 1, 28: 1, 29: 1}
OK	52734-17-5	C1CC(CCC1C(=O)O)C(=O)O.C(CCCCCN)CCCCCN	{27: 2, 2: 11, 11: 4, 12: 2, 30: 2}
OK	52735-49-6	CCSC1=CC(=O)CC(C1)(C)C	{1: 3, 2: 1, 40: 1, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	52736-62-6	CC1CCCCC1C(=O)N2CCCCCC2	{24: 1, 1: 1, 11: 10, 12: 2, 33: 1}
OK	5274-68-0	CCCCCCCCCCCCOCCOCCOCCOCCO	{1: 1, 2: 19, 20: 1, 22: 4}
OK	5275-46-7	CC(C)(N=O)[N+](=O)[O-]	{1: 2, 34: 1, 4: 1, 29: 1, 38: 1}
OK	52750-56-8	CCOC(=O)CC#CC	{1: 2, 2: 2, 28: 1, 10: 2}
OK	52752-16-6	CCC(C)(OCC)OCC	{1: 4, 2: 3, 4: 1, 22: 2}
OK	52761-86-1	CC(C)(C)C(C)(N=O)Br	{1: 4, 18: 1, 34: 1, 4: 2, 29: 1}
OK	5277-11-2	CCCCCCCN(C)C	{1: 3, 2: 6, 33: 1}
OK	52775-76-5	C[C@]12[C@@H](C(=C)C(=O)[C@]1(O2)C)C(=O)O	{1: 2, 5: 1, 12: 1, 13: 2, 15: 1, 23: 1, 25: 1, 27: 1}
OK	52777-39-6	CNCCCC12CC3CC(C1)CC(C3)C2O.Cl	{1: 1, 2: 3, 11: 5, 12: 4, 13: 1, 17: 1, 20: 1, 31: 1}
OK	52783-93-4	C1=CC=C=CC=C1	{8: 1, 14: 6}
OK	52784-32-4	COC(=O)C1CCCCCC1=O	{1: 1, 11: 5, 12: 1, 28: 1, 25: 1}
OK	52788-78-0	CCCCOCCOCCOC(C)(C)C	{1: 4, 2: 7, 4: 1, 22: 3}
OK	52788-80-4	CCOCCOCCOC(C)(C)C	{1: 4, 2: 5, 4: 1, 22: 3}
OK	52794-33-9	C1CC2CC1C3C2C4CC3CC4CN	{2: 1, 11: 5, 12: 7, 30: 1}
OK	52794-34-0	C1CC2CC1C3C2C4CC3C5C4C6CC5CC6CN	{2: 1, 11: 6, 12: 11, 30: 1}
OK	52794-80-6	CC(C)(COCCOCCOCCOCCO)OC(C)(C)C(C)(C)O	{1: 6, 2: 9, 4: 3, 22: 5, 20: 2}
OK	528-50-7	O=C[C@H](O)[C@@H](O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO	{2: 2, 3: 4, 12: 5, 20: 8, 22: 1, 23: 1, 26: 1}
OK	528-81-4	C[C@@H]([C@@H]1C(=C(C(=O)O1)O)O)O	{1: 1, 3: 1, 12: 1, 15: 2, 20: 3, 28: 1}
OK	528-92-7	CC(C)C(CC=C)C(=O)NC(=O)N	{1: 2, 2: 1, 3: 2, 5: 1, 6: 1, 24: 2, 30: 1, 31: 1}
OK	52802-07-0	CCCCC(CCl)O	{1: 1, 2: 4, 3: 1, 20: 1, 17: 1}
OK	52808-36-3	COCCOCCCl	{1: 1, 2: 4, 22: 2, 17: 1}
OK	52809-07-1	C(C(C(=O)O)N)N1C(=O)NC(=O)O1	{32: 1, 33: 1, 2: 1, 3: 1, 25: 1, 27: 1, 28: 1, 30: 1}
OK	5281-76-5	CC(CC=O)OC	{1: 2, 2: 1, 3: 1, 26: 1, 22: 1}
OK	52813-63-5	C1CC(=O)O[C@H]1CO	{20: 1, 2: 1, 11: 2, 12: 1, 28: 1}
OK	52829-98-8	CC(C1CCCC1)O	{11: 4, 1: 1, 3: 1, 12: 1, 20: 1}
OK	52836-31-4	CC1CN(C(O1)(C)C)C(=O)C(Cl)Cl	{1: 3, 3: 1, 33: 1, 11: 1, 12: 1, 13: 1, 17: 2, 23: 1, 24: 1}
OK	52837-54-4	CC1CNC(O1)(C)C	{32: 1, 1: 3, 11: 1, 12: 1, 13: 1, 23: 1}
OK	52841-28-8	CCN(C)C(C)(C)C	{1: 5, 2: 1, 4: 1, 33: 1}
OK	52842-33-8	C[C@@H]1CCCC([C@H]1C(=O)C)(C)C	{24: 1, 1: 4, 11: 3, 12: 2, 13: 1}
OK	52844-23-2	C#CCC=O	{9: 1, 2: 1, 26: 1, 10: 1}
OK	5286-38-4	CC(C)C1CCC2(C(C1=O)O2)C	{1: 3, 3: 1, 11: 2, 12: 2, 13: 1, 23: 1, 25: 1}
OK	5287-45-6	CC(=CCS)C	{1: 2, 2: 1, 39: 1, 6: 1, 7: 1}
OK	52879-54-6	C1CCC2(CC2)C3(CC1)CC3	{11: 9, 13: 2}
OK	52884-63-6	CC1CCSCS1	{1: 1, 11: 3, 12: 1, 41: 2}
OK	5289-74-7	C[C@]12CC[C@H]3C(=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)[C@@]1(CC[C@@H]2[C@](C)([C@@H](CCC(C)(C)O)O)O)O	{1: 5, 2: 2, 3: 1, 4: 2, 11: 6, 12: 5, 13: 3, 14: 1, 15: 1, 20: 6, 25: 1}
OK	52892-97-4	CC(=C)C(=O)OCC1CCC(CC1)COC(=O)C(=C)C	{1: 2, 2: 2, 5: 2, 7: 2, 11: 4, 12: 2, 28: 2}
OK	52892-98-5	CC(=C)C(=O)OC1C(C(C1(C)C)OC(=O)C(=C)C)(C)C	{1: 6, 5: 2, 7: 2, 12: 2, 13: 2, 28: 2}
OK	52896-87-4	CCCC(CCC)C(C)C	{1: 4, 2: 4, 3: 2}
OK	52896-88-5	CCCC(CC)CC(C)C	{1: 4, 2: 4, 3: 2}
OK	52896-89-6	CCCC(CC)C(C)CC	{1: 4, 2: 4, 3: 2}
OK	52896-91-0	CCCC(C)C(CC)CC	{1: 4, 2: 4, 3: 2}
OK	52896-92-1	CCCCC(C)C(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	52896-93-2	CCCCC(C)(C)C(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	52896-95-4	CCCC(C)C(C)C(C)C	{1: 5, 2: 2, 3: 3}
OK	52896-99-8	CCC(CC)CC(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	52897-00-4	CCCC(C)(CC)C(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	52897-01-5	CCC(CC)C(C)C(C)C	{1: 5, 2: 2, 3: 3}
OK	52897-03-7	CCC(C)(CC)CC(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	52897-04-8	CCC(CC(C)C)C(C)C	{1: 5, 2: 2, 3: 3}
OK	52897-05-9	CCC(CC)C(C)(C)CC	{1: 5, 2: 3, 3: 1, 4: 1}
OK	52897-06-0	CCC(C)C(C)(CC)CC	{1: 5, 2: 3, 3: 1, 4: 1}
OK	52897-08-2	CCC(C)C(C)C(C)(C)C	{1: 6, 2: 1, 3: 2, 4: 1}
OK	52897-09-3	CC(C)CC(C)C(C)(C)C	{1: 6, 2: 1, 3: 2, 4: 1}
OK	52897-10-6	CCC(C)C(C)(C)C(C)C	{1: 6, 2: 1, 3: 2, 4: 1}
OK	52897-11-7	CC(C)CC(C)(C)C(C)C	{1: 6, 2: 1, 3: 2, 4: 1}
OK	52897-12-8	CCC(C)(C)C(C)C(C)C	{1: 6, 2: 1, 3: 2, 4: 1}
OK	52897-15-1	CC(C)C(C)C(C)C(C)C	{1: 6, 3: 4}
OK	52897-16-2	CCC(CC)(CC)C(C)C	{1: 5, 2: 3, 3: 1, 4: 1}
OK	52897-17-3	CCC(C)(CC)C(C)(C)C	{1: 6, 2: 2, 4: 2}
OK	52897-18-4	CCC(C(C)C)C(C)(C)C	{1: 6, 2: 1, 3: 2, 4: 1}
OK	52897-19-5	CCC(C)(C(C)C)C(C)C	{1: 6, 2: 1, 3: 2, 4: 1}
OK	52898-42-7	CC([CH2])C=C	{1: 1, 3: 1, 5: 2, 6: 1}
OK	52899-09-9	CC(C)C(C(=O)O)NC(=O)C1CCCN1	{32: 1, 1: 2, 3: 2, 11: 3, 12: 1, 24: 1, 27: 1, 31: 1}
OK	529-01-1	CC1=CC(=O)C(CC1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	529-16-8	CC1=C(C2CCC1C2)C	{1: 2, 11: 3, 12: 2, 15: 2}
OK	529-17-9	CN1C2CCCC1CC2	{1: 1, 11: 5, 12: 2, 33: 1}
OK	529-32-8	CC(=C)C(C)(C#C)O	{1: 2, 4: 1, 5: 1, 7: 1, 9: 1, 10: 1, 20: 1}
OK	52908-35-7	CC(C)(C)[C@H]1C(S1)C(C)(C)C	{1: 6, 4: 2, 12: 2, 41: 1}
OK	5291-90-7	C=C1C=CC1=C	{5: 2, 14: 2, 15: 2}
OK	52914-63-3	C(CCCC(=O)N(CCO)CCO)CCCC(=O)N(CCO)CCO	{24: 2, 33: 2, 2: 15, 20: 4}
OK	52914-66-6	CC1CCCCCCCCCCCCCC1=O	{1: 1, 11: 13, 12: 1, 25: 1}
OK	5292-21-7	C1CCC(CC1)CC(=O)O	{27: 1, 2: 1, 11: 5, 12: 1}
OK	5292-43-3	CC(C)(C)OC(=O)CBr	{1: 3, 2: 1, 4: 1, 18: 1, 28: 1}
OK	52937-36-7	CCCC/C=C/C(C)C	{1: 3, 2: 3, 3: 1, 6: 2}
OK	52939-61-4	CCCC(CC=C)(CC=C)O	{1: 1, 2: 4, 4: 1, 5: 2, 6: 2, 20: 1}
OK	52943-99-4	C=C1CC(=C)C2CCC1C2	{11: 4, 12: 2, 5: 2, 15: 2}
OK	52955-40-5	COC=C(C=O)Br	{1: 1, 6: 1, 7: 1, 18: 1, 22: 1, 26: 1}
OK	52955-41-6	C(CC(CC(=O)NCCCC(CC(=O)NC(=NC1C(C(OC(C1O)OC2C(C(C(C(C2O)OC(=O)N)O)OC(=O)N)O)CO)O)N)N)N)CN	{2: 9, 3: 2, 7: 1, 12: 11, 34: 1, 20: 6, 22: 1, 23: 1, 24: 2, 28: 2, 30: 6, 31: 2}
OK	5296-48-0	C1C=CCC1(Cl)Cl	{17: 2, 11: 2, 13: 1, 14: 2}
OK	5296-62-8	CCSCC=C	{40: 1, 1: 1, 2: 2, 5: 1, 6: 1}
OK	5296-70-8	CCC(C)(CC)C(=O)OC	{1: 4, 2: 2, 4: 1, 28: 1}
OK	52965-57-8	C1CCC2CCC(C1)OO2	{11: 6, 12: 2, 23: 2}
OK	52972-16-4	CCCCCCCC(C)(OC)OC	{1: 4, 2: 6, 4: 1, 22: 2}
OK	52977-61-4	CN(CCC(=O)OC[C@@H](C(=O)O)N)N=O	{1: 1, 2: 3, 3: 1, 33: 1, 34: 1, 27: 1, 28: 1, 29: 1, 30: 1}
OK	5299-54-7	CCCCCCCCCCCCCCCCCC(=O)N1CCOCC1	{1: 1, 2: 16, 33: 1, 11: 4, 23: 1, 24: 1}
OK	5299-60-5	CCOC(=O)CCCCCO	{1: 1, 2: 6, 20: 1, 28: 1}
OK	5299-64-9	CCCCCCCCC(=O)N1CCOCC1	{1: 1, 2: 7, 33: 1, 11: 4, 23: 1, 24: 1}
OK	5299-65-0	CCCCCCCCCC(=O)N1CCOCC1	{1: 1, 2: 8, 33: 1, 11: 4, 23: 1, 24: 1}
OK	52993-54-1	CC(C)C1(CCCCC1)C	{11: 5, 1: 3, 3: 1, 13: 1}
OK	53-02-1	C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O)O	{1: 2, 2: 1, 11: 8, 12: 6, 13: 3, 20: 4, 24: 1}
OK	53-03-2	C[C@]12CC(=O)[C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)C=C[C@]34C	{1: 2, 2: 1, 11: 5, 12: 3, 13: 3, 14: 3, 15: 1, 20: 2, 24: 1, 25: 2}
OK	53-05-4	C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O	{1: 2, 2: 1, 11: 8, 12: 5, 13: 3, 20: 3, 24: 1, 25: 1}
OK	53-06-5	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C	{1: 2, 2: 1, 11: 7, 12: 3, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 25: 2}
OK	53-36-1	C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)COC(=O)C)O	{1: 4, 2: 1, 11: 4, 12: 5, 13: 3, 14: 3, 15: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	53-38-3	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CC[C@@H]4[C@@]3(C[C@](C4)(C)O)C	{1: 3, 9: 1, 10: 1, 11: 8, 12: 4, 13: 4, 20: 2}
OK	53-39-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(COC(=O)C4)C	{1: 3, 11: 8, 12: 4, 13: 3, 20: 1, 28: 1}
OK	53-43-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC=C4[C@@]3(CC[C@@H](C4)O)C	{1: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	530-55-2	COC1=CC(=O)C=C(C1=O)OC	{1: 2, 25: 2, 22: 2, 14: 2, 15: 2}
OK	530-62-1	C1=CN(C=N1)C(=O)N2C=CN=C2	{24: 1, 33: 2, 35: 2, 14: 6}
OK	53003-10-4	CC[C@H]([C@@H]1[C@H](C[C@H]([C@@]2(O1)C=C[C@H]([C@]3(O2)CC[C@@](O3)(C)[C@H]4CC[C@@]([C@@H](O4)C)(CC)O)O)C)C)C(=O)[C@@H](C)[C@H]([C@H](C)[C@H]5[C@H](CCC(O5)[C@@H](CC)C(=O)O)C)O	{1: 10, 2: 3, 3: 5, 11: 7, 12: 9, 13: 4, 14: 2, 20: 3, 23: 5, 24: 1, 27: 1}
OK	53011-95-3	C=C1C2CCC(C1=C)O2	{23: 1, 11: 2, 12: 2, 5: 2, 15: 2}
OK	53011-99-7	C=C1C2C(=C)C(=C)C(C1=C)O2	{23: 1, 12: 2, 5: 4, 15: 4}
OK	53023-60-2	CC(CCCC(C)(C)OC)CC=C(C(=CC(=O)O)C)C(=O)O	{1: 5, 2: 4, 3: 1, 4: 1, 6: 2, 7: 2, 22: 1, 27: 2}
OK	53023-67-9	CC(C)CCCC(C)CC=CC(=CC(=O)O)C	{1: 4, 2: 4, 3: 2, 6: 3, 7: 1, 27: 1}
OK	53026-67-8	COC1[C@@H]([C@H]([C@@H]([C@H](O1)COCCOCCO)OCCOCCO)OCCOCCO)OCCOCCO	{1: 1, 2: 17, 12: 5, 20: 4, 22: 9, 23: 1}
OK	5303-25-3	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCC	{1: 2, 2: 27, 28: 1}
OK	5303-65-1	CCOC(=O)CC(C)N	{1: 2, 2: 2, 3: 1, 28: 1, 30: 1}
OK	53037-34-6	C(=O)C=O.C(=O)(N)N	{24: 1, 26: 2, 30: 2}
OK	53042-78-7	CCCCC=CCCC#CCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 10: 2, 6: 2}
OK	53043-29-1	C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O[C@H]8[C@@H]([C@H]([C@H]([C@H](O8)CO)O)O)O)O	{1: 7, 2: 3, 11: 10, 12: 19, 13: 6, 14: 1, 15: 1, 20: 10, 22: 3, 23: 3, 27: 1}
OK	53045-71-9	CCC(C=C)Br	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 18: 1}
OK	53046-97-2	CC/C=C\C/C=C\CCO	{1: 1, 2: 4, 20: 1, 6: 4}
OK	53051-16-4	CN(CC(=O)OC[C@@H](C(=O)O)N)N=O	{1: 1, 2: 2, 3: 1, 33: 1, 34: 1, 27: 1, 28: 1, 29: 1, 30: 1}
OK	53057-53-7	C=CCCCCCCCCCCCCCCCCCCC=C	{2: 18, 5: 2, 6: 2}
OK	5306-85-4	CO[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2OC	{1: 2, 11: 2, 12: 4, 22: 2, 23: 2}
OK	53067-27-9	CCC(COCCC#N)(COCCC#N)COCCC#N	{1: 1, 2: 10, 4: 1, 37: 3, 22: 3}
OK	5307-99-3	C1C=CC2C1C(=O)C2(Cl)Cl	{11: 1, 12: 2, 13: 1, 14: 2, 17: 2, 25: 1}
OK	53074-96-7	CCOC(=O)C(=O)N1CCCCC1	{1: 1, 2: 1, 33: 1, 11: 5, 24: 1, 28: 1}
OK	53075-46-0	CC(=O)OCC1CC2CCC1C2	{1: 1, 2: 1, 11: 4, 12: 3, 28: 1}
OK	5308-25-8	CCN1CCNCC1	{32: 1, 1: 1, 2: 1, 11: 4, 33: 1}
OK	53082-57-8	CCCOC(=O)C(=CC)C	{1: 3, 2: 2, 28: 1, 6: 1, 7: 1}
OK	53093-41-7	CC(=O)OC1CCCC1Br	{1: 1, 18: 1, 11: 3, 12: 2, 28: 1}
OK	53098-47-8	CC(C)CC1=CCCC1	{1: 2, 2: 1, 3: 1, 11: 3, 14: 1, 15: 1}
OK	53100-44-0	CC(C)(C)OC(=O)N1[C@@H](CCC1=O)C(=O)O	{1: 3, 4: 1, 33: 1, 11: 2, 12: 1, 25: 1, 27: 1, 28: 1}
OK	53109-18-5	CCC(C)C1CC(C(=C1)C(CC(=O)CC(=O)O)O)C(C)CC	{1: 4, 2: 4, 3: 3, 11: 1, 12: 2, 14: 1, 15: 1, 20: 1, 24: 1, 27: 1}
OK	53119-70-3	CCCC(=C)OC	{1: 2, 2: 2, 5: 1, 22: 1, 7: 1}
OK	53119-71-4	CC(C)CC(=C)OC	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1, 22: 1}
OK	53119-72-5	CC(C)/C=C(\C)/OC	{1: 4, 3: 1, 22: 1, 6: 1, 7: 1}
OK	53120-74-4	CC(C)(CCO)CCO	{1: 2, 2: 4, 4: 1, 20: 2}
OK	53123-88-9	CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)O)C)C)O)OC)C)C)C)OC	{1: 10, 2: 1, 3: 1, 33: 1, 11: 12, 12: 13, 13: 1, 14: 6, 15: 2, 20: 3, 22: 3, 23: 1, 25: 4, 28: 1}
OK	5314-31-8	CCCCCC(=NO)C	{1: 2, 2: 4, 20: 1, 34: 1, 7: 1}
OK	53143-64-9	C1CC12CC=CC=C2	{11: 3, 13: 1, 14: 4}
OK	53143-76-3	C1CC2(CC2)C3(CC3)C=C1	{11: 6, 13: 2, 14: 2}
OK	53143-77-4	CC1C(C1(Cl)Cl)C	{1: 2, 12: 2, 13: 1, 17: 2}
OK	53153-66-5	CCCCCCC(=CC#N)C	{1: 2, 2: 5, 37: 1, 6: 1, 7: 1}
OK	53155-10-5	CCCCC=CCCBr	{1: 1, 2: 5, 18: 1, 6: 2}
OK	53161-46-9	CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)(CO)CO	{1: 1, 2: 24, 4: 1, 20: 3, 28: 1}
OK	53161-72-1	CCC(CI)I	{19: 2, 1: 1, 2: 2, 3: 1}
OK	53175-28-3	C/C=C(/C=O)\Cl	{1: 1, 26: 1, 17: 1, 6: 1, 7: 1}
OK	53179-09-2	CC1(COC(C(C1NC)O)OC2C(CC(C(C2O)OC3C(CC=C(O3)CN)N)N)N)O	{1: 2, 2: 1, 11: 3, 12: 10, 13: 1, 14: 1, 15: 1, 20: 3, 22: 2, 23: 2, 30: 4, 31: 1}
OK	53184-67-1	CCCCCCCCCOC(=O)CC	{1: 2, 2: 9, 28: 1}
OK	53185-52-7	CN(C)C(=O)CCOC	{24: 1, 1: 3, 2: 2, 22: 1, 33: 1}
OK	53188-23-1	C([C@H]([C@H]([C@@H](C(=O)CO)O)O)O)O	{24: 1, 2: 2, 3: 3, 20: 5}
OK	53192-46-4	CCCCOC(=O)C=C.CC(=C)C(=O)O.CC(=C)C(=O)OC.COC(=O)C=C	{1: 5, 2: 3, 5: 4, 6: 2, 7: 2, 27: 1, 28: 3}
OK	53193-22-9	CCCCCCCCCCCCCCCCCS	{1: 1, 2: 16, 39: 1}
OK	53193-23-0	CCCCCCCCCCCCCCCCCCCS	{1: 1, 2: 18, 39: 1}
OK	53198-41-7	CCCN(C(CC)OC(=O)C)N=O	{1: 3, 2: 3, 3: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	532-24-1	CN1C2CCC1CC(=O)C2	{1: 1, 11: 4, 12: 2, 33: 1, 25: 1}
OK	532-34-3	CCCCOC(=O)C1=CC(=O)CC(O1)(C)C	{1: 3, 2: 3, 11: 1, 13: 1, 14: 1, 15: 1, 23: 1, 25: 1, 28: 1}
OK	53201-66-4	CCC(=O)NCCCN(C)C	{24: 1, 1: 3, 2: 4, 33: 1, 31: 1}
OK	53202-98-5	CCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)O)CO)[C@H]4C1([C@]4(C)CO)OC(=O)C)O)C	{1: 5, 2: 16, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 4, 25: 1, 28: 2}
OK	53214-97-4	C(#CI)C#CI	{10: 4, 19: 2}
OK	5323-60-4	C(CO)CSCCO	{40: 1, 2: 5, 20: 2}
OK	5323-87-5	CCOC1=CC(=O)CCC1	{1: 1, 2: 1, 11: 3, 14: 1, 15: 1, 22: 1, 25: 1}
OK	53230-00-5	CCCN(C(CC)OC)N=O	{1: 3, 2: 3, 3: 1, 33: 1, 34: 1, 22: 1, 29: 1}
OK	53233-92-4	CN1CN2CC=CCN2CN1C	{1: 2, 11: 4, 14: 2, 33: 4}
OK	5324-72-1	CC(C)(C(C)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 3, 4: 2, 38: 3}
OK	5325-60-0	CCOC(=O)NCC=C	{1: 1, 2: 2, 5: 1, 6: 1, 28: 1, 31: 1}
OK	5325-94-0	CCOC(=O)N1CCCCC1	{1: 1, 2: 1, 11: 5, 28: 1, 33: 1}
OK	53252-21-4	CC=C(C)C(C)C(=O)C	{24: 1, 1: 4, 3: 1, 6: 1, 7: 1}
OK	5326-81-8	CCCCCCNC(=O)CCl	{24: 1, 1: 1, 2: 6, 31: 1, 17: 1}
OK	5326-92-1	CC(C)CCOC(=O)CCl	{1: 2, 2: 3, 3: 1, 28: 1, 17: 1}
OK	5326-93-2	CC(C)N(C(C)C)C(=O)C(Cl)Cl	{24: 1, 1: 4, 3: 3, 33: 1, 17: 2}
OK	53260-03-0	CC/C(=C\C)/OC	{1: 3, 2: 1, 22: 1, 6: 1, 7: 1}
OK	53263-55-1	CC1(CC=C(C1=O)O)C	{1: 2, 11: 1, 13: 1, 14: 1, 15: 1, 20: 1, 25: 1}
OK	53263-58-4	CCC1CC(=C(C1=O)O)C	{1: 2, 2: 1, 11: 1, 12: 1, 15: 2, 20: 1, 25: 1}
OK	53268-66-9	CCCCCC=CCl	{1: 1, 2: 4, 6: 2, 17: 1}
OK	53268-92-1	C=C=CC=O	{8: 1, 26: 1, 5: 1, 6: 1}
OK	53273-16-8	CCC(C)(CC)OC	{1: 4, 2: 2, 4: 1, 22: 1}
OK	5329-29-3	C(=NN)(NN)NN.Cl	{17: 1, 34: 1, 31: 2, 30: 3, 7: 1}
OK	5329-79-3	CCCCC(C)N	{1: 2, 2: 3, 3: 1, 30: 1}
OK	53293-00-8	C#CCCCC(=O)O	{9: 1, 2: 3, 27: 1, 10: 1}
OK	533-32-4	CCN(CC)C(=O)CC(C)C	{24: 1, 1: 4, 2: 3, 3: 1, 33: 1}
OK	533-49-3	C([C@@H]([C@@H](C=O)O)O)O	{2: 1, 3: 2, 20: 3, 26: 1}
OK	533-60-8	C1CCC(=O)C(C1)O	{20: 1, 11: 4, 12: 1, 25: 1}
OK	533-67-5	C(C=O)C(C(CO)O)O	{2: 2, 3: 2, 20: 3, 26: 1}
OK	533-68-6	CCC(C(=O)OCC)Br	{1: 2, 2: 2, 3: 1, 28: 1, 18: 1}
OK	533-87-9	C(CCCC(C(CCCCCCO)O)O)CCCC(=O)O	{27: 1, 2: 13, 3: 2, 20: 3}
OK	533-98-2	CCC(CBr)Br	{1: 1, 2: 2, 3: 1, 18: 2}
OK	5330-17-6	CCCCOCCOC(=O)CCl	{1: 1, 2: 6, 28: 1, 22: 1, 17: 1}
OK	5330-61-0	C1CCC(=CC1)C[N+](=O)[O-]	{2: 1, 11: 4, 38: 1, 14: 1, 15: 1}
OK	53308-83-1	CC(=O)O.CN=C(N)NCCC[C@@H](C(=O)O)N	{1: 2, 2: 3, 3: 1, 7: 1, 34: 1, 27: 2, 30: 2, 31: 1}
OK	53308-95-5	CCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 4, 2: 2, 3: 1, 4: 1, 27: 1, 28: 1, 31: 1}
OK	5331-32-8	CC1(C2CCC1(C(C2)OC)C)C	{1: 4, 11: 3, 12: 2, 13: 2, 22: 1}
OK	5331-48-6	CCCNC(=O)C	{24: 1, 1: 2, 2: 2, 31: 1}
OK	53310-02-4	CCCC(C)(C)N	{1: 3, 2: 2, 4: 1, 30: 1}
OK	53312-70-2	CCCCCCCCCCCCCCCCOC(=O)CCCl	{1: 1, 2: 17, 28: 1, 17: 1}
OK	53313-55-6	CC(C)(C)CCCOC	{1: 4, 2: 3, 4: 1, 22: 1}
OK	5332-06-9	C(CC#N)CBr	{2: 3, 18: 1, 37: 1}
OK	5332-35-4	CCCCCN1C(=O)CCC1=O	{1: 1, 2: 4, 11: 2, 33: 1, 25: 2}
OK	5332-52-5	CCCCCCCCCCCS	{1: 1, 2: 10, 39: 1}
OK	5332-73-0	COCCCN	{1: 1, 2: 3, 30: 1, 22: 1}
OK	5333-42-6	CCCCCCCCCCC(CCCCCCCC)CO	{1: 2, 2: 17, 3: 1, 20: 1}
OK	5333-44-8	CCCCCCCCCC(CCCCCCC)CO	{1: 2, 2: 15, 3: 1, 20: 1}
OK	5333-48-2	CCCCCCCC(CCCCC)CO	{1: 2, 2: 11, 3: 1, 20: 1}
OK	5333-87-9	CC(C)C(C#C)(C(C)C)O	{1: 4, 3: 2, 4: 1, 9: 1, 10: 1, 20: 1}
OK	5333-88-0	CCCCCC(C(=O)OCC)Br	{1: 2, 2: 5, 3: 1, 28: 1, 18: 1}
OK	53346-71-7	CCCCCCCCCCCCC(CC)O	{1: 2, 2: 12, 3: 1, 20: 1}
OK	5335-09-1	C(CCl)OC(=O)/C=C\C(=O)OCCCl	{17: 2, 2: 4, 28: 2, 6: 2}
OK	5335-91-1	CC(NC(=O)C)NC(=O)C	{24: 2, 1: 3, 3: 1, 31: 2}
OK	53351-10-3	CCCC(C(CC)CO)O.C(CCC(=O)O)CC(=O)O	{27: 2, 1: 2, 2: 8, 3: 2, 20: 2}
OK	5336-24-3	CC(C)(C)NC(=O)NC(C)(C)C	{24: 1, 1: 6, 4: 2, 31: 2}
OK	5336-75-4	CCN(CC)CCCC#N	{1: 2, 2: 5, 37: 1, 33: 1}
OK	5336-95-8	C1CC(=O)N(C1=O)[N+](=O)[O-]	{25: 2, 11: 2, 38: 1, 33: 1}
OK	53366-51-1	CC(C)CC=C1CCCC1	{1: 2, 2: 1, 3: 1, 6: 1, 11: 4, 15: 1}
OK	53366-55-5	CCCCC=C1CCCC1	{1: 1, 2: 3, 11: 4, 6: 1, 15: 1}
OK	53369-17-8	CC1([C@H]2CC[C@@H]([C@@H]1C2)CO)C	{1: 2, 2: 1, 11: 3, 12: 3, 13: 1, 20: 1}
OK	53369-71-4	CC(C)(CN)CN(C)C	{1: 4, 2: 2, 4: 1, 30: 1, 33: 1}
OK	5337-03-1	C1COCCC1C(=O)O	{27: 1, 11: 4, 12: 1, 23: 1}
OK	5337-70-2	CC(C)CCOC(OCCC(C)C)OCCC(C)C	{1: 6, 2: 6, 3: 4, 22: 3}
OK	5337-72-4	CC1CCCC(C1O)C	{1: 2, 11: 3, 12: 3, 20: 1}
OK	5338-18-1	CC(=O)N(CCOC(=O)C)CCOC(=O)C	{24: 1, 1: 3, 2: 4, 28: 2, 33: 1}
OK	5338-45-4	CC(C)CC(C(=O)O)NC=O	{1: 2, 2: 1, 3: 2, 26: 1, 27: 1, 31: 1}
OK	5339-43-5	CCCCCCCCCCCCCCSC(=NC)NC.I	{1: 3, 2: 13, 7: 1, 40: 1, 34: 1, 19: 1, 31: 1}
OK	53398-76-8	CC=CC=CC=O	{1: 1, 26: 1, 6: 4}
OK	53398-80-4	CCCC=CCOC(=O)CC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	53398-83-7	CCCC=CCOC(=O)CCC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	53398-85-9	CCC=CCCOC(=O)C(C)CC	{1: 3, 2: 4, 3: 1, 28: 1, 6: 2}
OK	53398-86-0	CCCCCC(=O)OCC=CCCC	{1: 2, 2: 7, 28: 1, 6: 2}
OK	53398-87-1	CCC/C=C/C(=O)OCC/C=C\CC	{1: 2, 2: 5, 28: 1, 6: 4}
OK	53398-90-6	CC1CCC2(O1)C(CCCC2(C)O)(C)C	{1: 4, 11: 5, 12: 1, 13: 3, 20: 1, 23: 1}
OK	53399-81-8	CCOC(=O)C(C)CC=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 28: 1}
OK	534-03-2	C(C(CO)N)O	{2: 2, 3: 1, 20: 2, 30: 1}
OK	534-07-6	C(C(=O)CCl)Cl	{24: 1, 17: 2, 2: 2}
OK	534-15-6	CC(OC)OC	{1: 3, 3: 1, 22: 2}
OK	534-26-9	CC1=NCCN1	{32: 1, 1: 1, 11: 2, 35: 1, 15: 1}
OK	534-59-8	CCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 3, 3: 1}
OK	534-76-9	C(CCCCN=C(N)N)CCCC(C(CCCN)NC(=O)CCCCCCCCN=C(N)N)O	{2: 19, 3: 2, 7: 2, 34: 2, 20: 1, 24: 1, 30: 5, 31: 1}
OK	534-84-9	C1CCN(CC1)CC2CCCCC2=O	{25: 1, 2: 1, 11: 9, 12: 1, 33: 1}
OK	5340-26-1	CC(C)(C)COC(=O)C(C)(C)C	{1: 6, 2: 1, 4: 2, 28: 1}
OK	5340-36-3	CCCCCC(C)(CC)O	{1: 3, 2: 5, 4: 1, 20: 1}
OK	5340-41-0	CCCC(C)(C(C)(C)C)O	{1: 5, 2: 2, 4: 2, 20: 1}
OK	5340-45-4	CC(C(=O)C)C(C)(C)C	{24: 1, 1: 5, 3: 1, 4: 1}
OK	5340-47-6	CC(C)C(C)(C)C(=O)C	{24: 1, 1: 5, 3: 1, 4: 1}
OK	5340-62-5	CCC(CC)(CC(C)(C)C)O	{1: 5, 2: 3, 4: 2, 20: 1}
OK	5340-64-7	CCCCCC(=O)C(C)(C)C	{24: 1, 1: 4, 2: 4, 4: 1}
OK	5340-68-1	CC(C)CC(=O)OCC(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 28: 1}
OK	5340-78-3	CCOC(=O)CC(C)(C)C	{1: 4, 2: 2, 4: 1, 28: 1}
OK	5340-95-4	C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O)O)O)O)O)O)O)O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
OK	53404-39-0	CCCCCCCCCCCCCC(=O)O.C(CO)NCCO	{1: 1, 2: 16, 27: 1, 20: 2, 31: 1}
OK	5341-61-7	NN.Cl.Cl	{17: 2, 30: 2}
OK	5341-95-7	C[C@H]([C@H](C)O)O	{1: 2, 3: 2, 20: 2}
OK	53411-22-6	CCCCCCCCCCCCC(C(=O)Cl)Br	{1: 1, 2: 11, 3: 1, 17: 1, 18: 1, 24: 1}
OK	53414-23-6	CCSCC1CO1	{1: 1, 2: 2, 40: 1, 11: 1, 12: 1, 23: 1}
OK	53417-29-1	C=CC(=O)OCC(CO)(CO)COC(=O)C=C	{2: 4, 4: 1, 5: 2, 6: 2, 20: 2, 28: 2}
OK	5342-78-9	CC(C)(C)CC(C)(C)[N+](=O)[O-]	{1: 5, 2: 1, 4: 2, 38: 1}
OK	53421-31-1	CCCCCCCCCCCCCCCC(=O)NC[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 15, 33: 1, 14: 5, 17: 1, 24: 1, 31: 1}
OK	5343-02-2	C(CC(=O)O)C(=O)NNC(=O)CCC(=O)O	{24: 2, 2: 4, 27: 2, 31: 2}
OK	5343-92-0	CCCC(CO)O	{1: 1, 2: 3, 3: 1, 20: 2}
OK	5343-96-4	CC(C)C(C)OC(=O)C	{1: 4, 3: 2, 28: 1}
OK	5344-20-7	CC(C)CCCN	{1: 2, 2: 3, 3: 1, 30: 1}
OK	5344-55-8	CC(C(C(=O)O)(Cl)Cl)Cl	{27: 1, 1: 1, 3: 1, 4: 1, 17: 3}
OK	53447-45-3	C[C@H](C=O)[C@@H]1CC[C@@](O1)(C)C=C	{1: 2, 3: 1, 5: 1, 6: 1, 11: 2, 12: 1, 13: 1, 23: 1, 26: 1}
OK	53448-09-2	CC(C)C[C@H](CO)N	{1: 2, 2: 2, 3: 2, 20: 1, 30: 1}
OK	5345-01-7	CCC(C)(CC(=O)O)CC(=O)O	{1: 2, 2: 3, 27: 2, 4: 1}
OK	5345-33-5	CCCCCCCC(CCCCC)(CCCCCC)CC#N	{1: 3, 2: 16, 4: 1, 37: 1}
OK	5346-73-6	COCC1C(C(C(C(O1)OC2(C(C(C(O2)COC)OC)OC)COC)OC)OC)OC	{1: 8, 2: 3, 12: 8, 13: 1, 22: 9, 23: 2}
OK	5346-77-0	CC(=O)OCC(C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 6, 2: 2, 3: 4, 28: 6}
OK	5346-90-7	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=O)C)OC(=O)C)OC(=O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 8, 2: 2, 12: 10, 22: 1, 23: 2, 28: 8}
OK	53460-46-1	CC1(CC2CC(C1)(CN2)C)C	{32: 1, 1: 3, 11: 4, 12: 1, 13: 2}
OK	53460-80-3	CC(=O)CC1OCC(O1)CCl	{1: 1, 2: 2, 11: 1, 12: 2, 17: 1, 23: 2, 24: 1}
OK	53463-68-6	C(CCCCCBr)CCCCO	{2: 10, 20: 1, 18: 1}
OK	53475-15-3	CC(C(=O)C)SC	{24: 1, 1: 3, 3: 1, 40: 1}
OK	53477-04-6	C#C/C=C/C=C/C#C	{9: 2, 10: 2, 6: 4}
OK	53489-11-5	CC(=C)C(=O)OCCN(C)C.CC(=O)OC=C	{1: 4, 2: 2, 5: 2, 6: 1, 7: 1, 33: 1, 28: 2}
OK	5349-21-3	CCCOC(=O)CSC#N	{40: 1, 1: 1, 2: 3, 28: 1, 37: 1}
OK	5349-27-9	C1CCC(CC1)OC(=O)CSC#N	{2: 1, 37: 1, 40: 1, 11: 5, 12: 1, 28: 1}
OK	5349-28-0	CCOC(=O)CSC#N	{40: 1, 1: 1, 2: 2, 28: 1, 37: 1}
OK	5349-51-9	CCC(C)(C)C1CCC(CC1)O	{1: 3, 2: 1, 4: 1, 11: 4, 12: 2, 20: 1}
OK	5349-52-0	CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCO	{1: 1, 2: 34, 20: 1, 22: 8, 28: 1}
OK	5349-55-3	CC(C(=O)OCC=C)O	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 20: 1, 28: 1}
OK	5349-80-4	C(C(=O)NO)N	{24: 1, 2: 1, 20: 1, 30: 1, 31: 1}
OK	5349-99-5	CCOC(=O)CC(=CC(=O)OCC)C(=O)OCC	{1: 3, 2: 4, 28: 3, 6: 1, 7: 1}
OK	53494-70-5	C1C2C3C4C1C(=O)C2C5(C3(C(C4(C5Cl)Cl)(Cl)Cl)Cl)Cl	{17: 6, 11: 1, 12: 6, 13: 4, 25: 1}
OK	53496-15-4	CCCC(C)OC(=O)C	{1: 3, 2: 2, 3: 1, 28: 1}
OK	53497-78-2	CCCC/C=C\C#CC	{1: 2, 2: 3, 10: 2, 6: 2}
OK	53497-79-3	CCCC/C=C/C#CC	{1: 2, 2: 3, 10: 2, 6: 2}
OK	535-11-5	CCOC(=O)C(C)Br	{1: 2, 2: 1, 3: 1, 28: 1, 18: 1}
OK	535-13-7	CCOC(=O)C(C)Cl	{1: 2, 2: 1, 3: 1, 28: 1, 17: 1}
OK	535-15-9	CCOC(=O)C(Cl)Cl	{1: 1, 2: 1, 3: 1, 28: 1, 17: 2}
OK	535-17-1	CC(C(=O)O)OC(=O)C	{27: 1, 1: 2, 3: 1, 28: 1}
OK	535-75-1	C1CCNC(C1)C(=O)O	{27: 1, 32: 1, 11: 4, 12: 1}
OK	5350-17-4	CCC(C)N(C(C)CC)N=O	{1: 4, 34: 1, 3: 2, 33: 1, 2: 2, 29: 1}
OK	53504-41-9	C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCO)CO	{2: 5, 8: 2, 11: 13, 12: 4, 34: 2, 20: 2, 28: 1, 29: 2}
OK	5351-04-2	CCN(CC)CCC#N	{1: 2, 2: 4, 37: 1, 33: 1}
OK	53510-40-0	CC(CC1=CCC(CC1)C(=C)C)C=O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	53520-28-8	CC1(CCSC=C1)C	{1: 2, 11: 2, 13: 1, 14: 2, 41: 1}
OK	53531-14-9	CCC[C@@H](C)C=O	{1: 2, 2: 2, 3: 1, 26: 1}
OK	53535-68-5	C(C(=O)CBr)Cl	{24: 1, 17: 1, 2: 2, 18: 1}
OK	53545-96-3	CC(C)(CCCCBr)C#N	{1: 2, 2: 4, 4: 1, 18: 1, 37: 1}
OK	5355-48-6	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3C[C@H]([C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)C)O)O[C@H]7C[C@@H]([C@@H]([C@H](O7)C)O[C@H]8C[C@@H]([C@@H]([C@H](O8)C)OC(=O)C)O)O	{1: 6, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 5, 22: 3, 23: 3, 28: 2}
OK	5355-54-4	CC(CO)(CCl)CCl	{1: 1, 2: 3, 4: 1, 20: 1, 17: 2}
OK	5355-68-0	CC(C)N1CCC(=O)CC1	{11: 4, 1: 2, 3: 1, 33: 1, 25: 1}
OK	53558-93-3	C1CC(=O)O[C@H]1C(=O)O	{27: 1, 28: 1, 11: 2, 12: 1}
OK	53558-94-4	C1CC(=O)O[C@H]1C(=O)Cl	{24: 1, 17: 1, 11: 2, 12: 1, 28: 1}
OK	53561-46-9	CC1(CCCCC(C#C1)(C)C)C	{1: 4, 10: 2, 11: 4, 13: 2}
OK	53561-47-0	CC1(CCC(CSC1)(C)C)C	{1: 4, 11: 4, 13: 2, 41: 1}
OK	53562-86-0	C[C@@H](CC(=O)OC)O	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	53566-37-3	CC#CCC(C)C	{1: 3, 2: 1, 3: 1, 10: 2}
OK	53566-76-0	CCC(C)(C)C(=O)OOC(C)(C)C	{1: 6, 2: 1, 4: 2, 22: 1, 28: 1}
OK	53576-49-1	CCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 18, 3: 1, 33: 1, 20: 3, 24: 1, 27: 2, 31: 1}
OK	53578-15-7	C12C3C4C1C5C2C3C45C(=O)O	{27: 1, 12: 7, 13: 1}
OK	53584-29-5	CCCCCCCCCCCCCCCCOCC(CO)O	{1: 1, 2: 17, 3: 1, 20: 2, 22: 1}
OK	53585-52-7	CCCCCCCCCCCCCCCCCC(=O)NCCNCCO.CC(=O)O	{1: 2, 2: 20, 20: 1, 24: 1, 27: 1, 31: 2}
OK	53588-92-4	CCOCBr	{1: 1, 2: 2, 18: 1, 22: 1}
OK	536-59-4	CC(=C)C1CCC(=CC1)CO	{1: 1, 2: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	53605-94-0	CCCCOC(=O)CC(C)O	{1: 2, 2: 4, 3: 1, 20: 1, 28: 1}
OK	53608-85-8	C=C(CC1CCCCC1)Br	{2: 1, 5: 1, 7: 1, 11: 5, 12: 1, 18: 1}
OK	53608-93-8	CCOC(=O)C(C1CCC=C1)C(=O)OCC	{1: 2, 2: 2, 3: 1, 11: 2, 12: 1, 14: 2, 28: 2}
OK	53609-64-6	CC(CN(CC(C)O)N=O)O	{1: 2, 2: 2, 3: 2, 33: 1, 34: 1, 20: 2, 29: 1}
OK	5362-56-1	CC(C)C=CC=O	{1: 2, 26: 1, 3: 1, 6: 2}
OK	53620-54-5	CCCCCCCCCCCCCCCCCC(=O)NCCNCCNCCNC(=O)CCCCCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 38, 31: 4}
OK	5363-64-4	CCCCCCOC=C	{1: 1, 2: 5, 22: 1, 5: 1, 6: 1}
OK	53636-17-2	C[C@@H](CN(C)C)O	{1: 3, 2: 1, 3: 1, 20: 1, 33: 1}
OK	53640-62-3	CC(=O)OC=C.C1C=CC2C1C3CC2C=C3	{1: 1, 5: 1, 6: 1, 11: 2, 12: 4, 14: 4, 28: 1}
OK	53640-63-4	C=CCO.C1C=CC2C1C3CC2C=C3	{2: 1, 5: 1, 6: 1, 11: 2, 12: 4, 14: 4, 20: 1}
OK	53651-69-7	CCCOC(=O)[C@H](C)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 1}
OK	53660-21-2	CCCCCC(CCl)O	{1: 1, 2: 5, 3: 1, 20: 1, 17: 1}
OK	53660-26-7	C1N(CN(CN1CCO)CCO)CCO.[I]	{19: 1, 33: 3, 2: 6, 11: 3, 20: 3}
OK	53663-26-6	CCCCCCCC(C#N)C(=O)OC	{1: 2, 2: 6, 3: 1, 28: 1, 37: 1}
OK	53685-77-1	CCCCCCCCCCCCCC(=O)CCC	{24: 1, 1: 2, 2: 14}
OK	53687-79-9	COC1CCCCN1	{32: 1, 1: 1, 11: 4, 12: 1, 22: 1}
OK	53690-50-9	C1C#CCSCC#CCS1	{41: 2, 10: 4, 11: 4}
OK	53696-14-3	CCCCC(C)CCCCC(=O)O	{27: 1, 1: 2, 2: 7, 3: 1}
OK	537-32-6	CC(C(=O)OCC(COC(=O)C(C)O)OC(=O)C(C)O)O	{1: 3, 2: 2, 3: 4, 20: 3, 28: 3}
OK	537-39-3	CCCCCCCC/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CCCCCCCC)COC(=O)CCCCCCC/C=C/CCCCCCCC	{1: 3, 2: 44, 3: 1, 28: 3, 6: 6}
OK	537-40-6	CCCCCC=CCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCCCCC)OC(=O)CCCCCCCC=CCC=CCCCCC	{1: 3, 2: 38, 3: 1, 28: 3, 6: 12}
OK	537-45-1	C1=C(C(=O)C(=CC1=NCl)Br)Br	{34: 1, 14: 2, 15: 3, 17: 1, 18: 2, 25: 1}
OK	53715-47-2	CCO/C=C/SCC	{40: 1, 1: 2, 2: 2, 22: 1, 6: 2}
OK	53716-44-2	CCN(CC)CC(C)OC(=O)C1CCCC[C@@]1(C2CCCCC2)O	{1: 3, 2: 3, 3: 1, 33: 1, 11: 9, 12: 2, 13: 1, 20: 1, 28: 1}
OK	53723-18-5	CCC#CCC(CC)O	{1: 2, 2: 3, 3: 1, 20: 1, 10: 2}
OK	53723-19-6	CCCC#CCC(CC)O	{1: 2, 2: 4, 3: 1, 20: 1, 10: 2}
OK	53731-19-4	CC(C=C)F	{16: 1, 1: 1, 3: 1, 5: 1, 6: 1}
OK	53731-22-9	CC(C)CC(F)F	{16: 2, 1: 2, 2: 1, 3: 2}
OK	53731-25-2	CC(C(C)(C)F)F	{16: 2, 1: 3, 3: 1, 4: 1}
OK	53735-22-1	C1C2C1C(=O)C=CC2=O	{25: 2, 11: 1, 12: 2, 14: 2}
OK	53750-02-0	C#CS	{9: 1, 10: 1, 39: 1}
OK	53750-52-0	CC(=C)CCI	{1: 1, 2: 2, 19: 1, 5: 1, 7: 1}
OK	53764-10-6	C1CC2CCC1CC23CC3	{11: 7, 12: 2, 13: 1}
OK	53767-86-5	CC(CCCC(C)(C)OC)C=C	{1: 4, 2: 3, 3: 1, 4: 1, 5: 1, 6: 1, 22: 1}
OK	53771-88-3	CC1CCC(C1)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2}
OK	53774-20-2	CC(C=C)C(=O)O	{27: 1, 1: 1, 3: 1, 5: 1, 6: 1}
OK	53778-73-7	CCC(COC)O	{1: 2, 2: 2, 3: 1, 20: 1, 22: 1}
OK	53779-85-4	CN1C2CCC(N1C)CC2	{1: 2, 11: 4, 12: 2, 33: 2}
OK	53779-86-5	CC12CCC(CC1)(N(N2C)C)C	{1: 4, 11: 4, 13: 2, 33: 2}
OK	53779-87-6	CCC1(CN(N(C1)C)C)CC	{1: 4, 2: 2, 11: 2, 13: 1, 33: 2}
OK	53779-88-7	CC12CCC(C=C1)(N(N2C)C)C	{1: 4, 11: 2, 13: 2, 14: 2, 33: 2}
OK	53779-89-8	C1CN(C1)N	{33: 1, 11: 3, 30: 1}
OK	53779-90-1	CN(C)N1CCCC1	{1: 2, 11: 4, 33: 2}
OK	53782-41-5	CCCCCCCCC(Cl)Cl	{1: 1, 2: 7, 3: 1, 17: 2}
OK	53783-12-3	CN(C)C1=C2C=CC=C2C(=N1)N(C)C	{1: 4, 35: 1, 33: 2, 14: 3, 15: 4}
OK	538-02-3	CC(CC1CCCC1)NC.Cl	{1: 2, 2: 1, 3: 1, 11: 4, 12: 1, 17: 1, 31: 1}
OK	538-07-8	CCN(CCCl)CCCl	{1: 1, 2: 5, 33: 1, 17: 2}
OK	538-08-9	C=CCN(CC=C)C#N	{33: 1, 2: 2, 5: 2, 6: 2, 37: 1}
OK	538-23-8	CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC	{1: 3, 2: 20, 3: 1, 28: 3}
OK	538-24-9	CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC	{1: 3, 2: 32, 3: 1, 28: 3}
OK	538-75-0	C1CCC(CC1)N=C=NC2CCCCC2	{8: 1, 34: 2, 11: 10, 12: 2}
OK	53815-59-1	CCCCOC(=O)CC(C)Cl	{1: 2, 2: 4, 3: 1, 28: 1, 17: 1}
OK	53817-54-2	CC(C)CCCCCCOC(=O)C=CC(=O)OCCCCCCC(C)C	{1: 4, 2: 12, 3: 2, 28: 2, 6: 2}
OK	5382-16-1	C1CNCCC1O	{32: 1, 20: 1, 11: 4, 12: 1}
OK	5382-77-4	CCOC(=O)C1(CCOCC1)C(=O)OCC	{1: 2, 2: 2, 11: 4, 13: 1, 23: 1, 28: 2}
OK	5382-89-8	CC(=NOCC(=O)O)C	{1: 2, 2: 1, 7: 1, 34: 1, 22: 1, 27: 1}
OK	53835-21-5	C1CNCCOCCNCCN1	{32: 3, 11: 8, 23: 1}
OK	53837-34-6	CC(CCC=C(C)CCC=C(C)C)O	{1: 4, 2: 4, 3: 1, 6: 2, 7: 2, 20: 1}
OK	53839-23-9	CCCCCCCCOCCCC	{1: 2, 2: 10, 22: 1}
OK	53848-19-4	CC(=C1C2C=CC1C3C2CC3)C	{1: 2, 7: 1, 11: 2, 12: 4, 14: 2, 15: 1}
OK	53848-20-7	CC(=C1C2CCC1C3C2CC3)C	{15: 1, 1: 2, 11: 4, 12: 4, 7: 1}
OK	53861-57-7	C([C@@H](C(=O)O)N)C(C(=O)O)C(=O)O	{27: 3, 2: 1, 3: 2, 30: 1}
OK	53862-36-5	C1CC2CC1C3C2C4C3C4	{11: 4, 12: 6}
OK	53878-96-9	C(C#CCN)N	{2: 2, 10: 2, 30: 2}
OK	53880-51-6	CC=CC=CCCCCCCCOC(=O)C	{1: 2, 2: 7, 28: 1, 6: 4}
OK	5389-87-7	CC(=CCC/C(=C/CCl)/C)C	{1: 3, 2: 3, 17: 1, 6: 2, 7: 2}
OK	53894-19-2	CC(C(Cl)Cl)O	{1: 1, 3: 2, 20: 1, 17: 2}
OK	53897-50-0	CC(C)CCCS	{1: 2, 2: 3, 3: 1, 39: 1}
OK	53897-51-1	CC(C)C(C)SC	{40: 1, 1: 4, 3: 2}
OK	53897-63-5	CC1NC(SC(N1)C)C	{32: 2, 1: 3, 12: 3, 41: 1}
OK	539-64-0	CN(C)CC(=O)NN.Cl	{1: 2, 2: 1, 33: 1, 17: 1, 24: 1, 30: 1, 31: 1}
OK	539-74-2	CCOC(=O)CCBr	{1: 1, 2: 3, 28: 1, 18: 1}
OK	539-80-0	C1=CC=CC(=O)C=C1	{25: 1, 14: 6}
OK	539-82-2	CCCCC(=O)OCC	{1: 2, 2: 4, 28: 1}
OK	539-87-7	C1CCCOC(=O)CC1	{11: 6, 28: 1}
OK	539-88-8	CCOC(=O)CCC(=O)C	{24: 1, 1: 2, 2: 3, 28: 1}
OK	539-89-9	CCOC(=O)NCC(C)C	{1: 3, 2: 2, 3: 1, 28: 1, 31: 1}
OK	539-90-2	CCCC(=O)OCC(C)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	539-93-5	CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)O	{1: 2, 2: 22, 3: 1, 20: 1, 28: 2}
OK	5390-04-5	C#CCCCO	{9: 1, 2: 3, 20: 1, 10: 1}
OK	5390-54-5	CCC(COC(=O)C=C)[N+](=O)[O-]	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 38: 1, 28: 1}
OK	5390-71-6	CC(COC)Cl	{1: 2, 2: 1, 3: 1, 22: 1, 17: 1}
OK	5390-72-7	CC(CCl)OC	{1: 2, 2: 1, 3: 1, 22: 1, 17: 1}
OK	53907-46-3	CC(C(=O)OC)S	{1: 2, 3: 1, 28: 1, 39: 1}
OK	53907-72-5	CCCC(CCC=C)O	{1: 1, 2: 4, 3: 1, 5: 1, 6: 1, 20: 1}
OK	53908-27-3	C(CCl)Cl.C(CBr)Br.C(Cl)(Cl)(Cl)Cl	{17: 6, 2: 4, 4: 1, 18: 2}
OK	53915-73-4	CN(C)C[N+](=O)[O-]	{1: 2, 2: 1, 38: 1, 33: 1}
OK	5392-40-5	CC(=CCCC(=CC=O)C)C	{1: 3, 2: 2, 26: 1, 6: 2, 7: 2}
OK	53922-67-1	CC1C=C(CC(=C1)OC)C	{1: 3, 11: 1, 12: 1, 14: 2, 15: 2, 22: 1}
OK	53934-26-2	CCOC(=O)C=C.CC(=C)C(=O)O.COC(=O)C=C.C=CC(=O)O	{1: 3, 2: 1, 5: 4, 6: 3, 7: 1, 27: 2, 28: 2}
OK	53935-66-3	CCOC(=O)CCN(CCCO)CCC(=O)OCC	{1: 2, 2: 9, 20: 1, 28: 2, 33: 1}
OK	53935-67-4	CCOC(=O)CCN(CCCCl)CCC(=O)OCC	{1: 2, 2: 9, 28: 2, 33: 1, 17: 1}
OK	53939-27-8	CCCCC=CCCCCCCCC=O	{1: 1, 2: 10, 26: 1, 6: 2}
OK	53939-28-9	CCCCC=CCCCCCCCCCC=O	{1: 1, 2: 12, 26: 1, 6: 2}
OK	53939-51-8	CCCCCCCCCCCCCCCCCCCO.CC(=O)O	{1: 2, 2: 18, 27: 1, 20: 1}
OK	5394-63-8	CC1=CC(=O)OC(O1)(C)C	{1: 3, 13: 1, 14: 1, 15: 1, 23: 1, 28: 1}
OK	53941-19-8	CCC(C)(C)C(=CC)C	{1: 5, 2: 1, 4: 1, 6: 1, 7: 1}
OK	5395-01-7	C(COC(=O)N)O	{28: 1, 2: 2, 20: 1, 30: 1}
OK	5395-04-0	C1CCN(CC1)C(=O)N2CCCCC2	{24: 1, 33: 2, 11: 10}
OK	5395-75-5	CCSCCSCC	{40: 2, 1: 2, 2: 4}
OK	53951-43-2	CC1COC(C)(CO)O1	{1: 2, 2: 1, 11: 1, 12: 1, 13: 1, 20: 1, 23: 2}
OK	53951-45-4	CC(C)CN(C)[N+](=O)[O-]	{1: 3, 2: 1, 3: 1, 38: 1, 33: 1}
OK	5396-09-8	CC(C)C(C)(CC(C)(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	5396-24-7	CCCOC(=O)CCl	{1: 1, 2: 3, 28: 1, 17: 1}
OK	5396-58-7	CC(C(C)(C)O)O	{1: 3, 3: 1, 4: 1, 20: 2}
OK	53962-20-2	CC(C)CC(=O)O[C@H]1[C@H]2[C@H](C[C@@H]([C@@H]2CO)O)C(=CO1)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O	{1: 2, 2: 4, 3: 1, 11: 1, 12: 10, 14: 1, 15: 1, 20: 6, 22: 1, 23: 2, 28: 1}
OK	53963-03-4	CCCCC#CCCC#C	{1: 1, 2: 5, 10: 3, 9: 1}
OK	53963-07-8	CCCCC=CCCC#C	{1: 1, 2: 5, 10: 1, 6: 2, 9: 1}
OK	53963-10-3	C1CCOC(C1)OCCCCCCBr	{2: 6, 11: 4, 12: 1, 18: 1, 22: 1, 23: 1}
OK	53966-36-2	CCSSC(C)C	{40: 2, 1: 3, 2: 1, 3: 1}
OK	53966-51-1	CCCCC(=CCC)CC	{1: 3, 2: 5, 6: 1, 7: 1}
OK	53966-52-2	CCCCC(CC)C=CC	{1: 3, 2: 4, 3: 1, 6: 2}
OK	53966-53-3	CCCCCC=CC(C)C	{1: 3, 2: 4, 3: 1, 6: 2}
OK	5397-31-9	CCCCC(CC)COCCCN	{1: 2, 2: 8, 3: 1, 30: 1, 22: 1}
OK	5397-67-1	C1CN2CCCN2C1	{33: 2, 11: 6}
OK	53971-47-4	CC1C(S1)(C)C	{1: 3, 12: 1, 13: 1, 41: 1}
OK	53977-99-4	CCCCC(=C(Cl)Cl)Cl	{1: 1, 2: 3, 17: 3, 7: 2}
OK	5398-08-3	CCOC(=O)C(CCC(C)C)C(=O)OCC	{1: 4, 2: 4, 3: 2, 28: 2}
OK	5398-10-7	CCCCCCC(C(=O)OCC)C(=O)OCC	{1: 3, 2: 7, 3: 1, 28: 2}
OK	5398-25-4	CCC(C(C)Br)Br	{1: 2, 2: 1, 3: 2, 18: 2}
OK	5398-29-8	C(CSC(=N)N)C(=O)O	{2: 2, 36: 1, 7: 1, 40: 1, 27: 1, 30: 1}
OK	53989-20-1	C(CCC(=O)O)CC(=O)O.C(CC(=O)O)CC(=O)O.C(CC(=O)O)C(=O)O.C(COCCO)O.C(C(CO)O)O	{27: 6, 2: 15, 3: 1, 20: 5, 22: 1}
OK	53989-67-6	CCCCCCCCCCCCCC(=O)NCCNCCO	{24: 1, 1: 1, 2: 16, 20: 1, 31: 2}
OK	5399-02-0	CCCCCCCCCCCCCCCCC#N	{1: 1, 2: 15, 37: 1}
OK	5399-19-9	CCCCSCC=C	{40: 1, 1: 1, 2: 4, 5: 1, 6: 1}
OK	5399-68-8	C1=C/C(=C/NO)/C(=CC1=O)O	{6: 1, 14: 3, 15: 2, 20: 2, 25: 1, 31: 1}
OK	53994-42-6	C1CCC2(CC1)N3CC4=CN2C(=C3)C=C4	{33: 2, 11: 6, 13: 1, 14: 4, 15: 2}
OK	54-06-8	CN1CC(C2=CC(=O)C(=O)C=C21)O	{1: 1, 33: 1, 11: 1, 12: 1, 14: 2, 15: 2, 20: 1, 25: 2}
OK	54-25-1	C1=NN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{32: 1, 33: 1, 2: 1, 35: 1, 12: 4, 14: 1, 20: 3, 23: 1, 25: 2}
OK	54-91-1	C1CN(CCN1C(=O)CCBr)C(=O)CCBr	{24: 2, 33: 2, 2: 4, 11: 4, 18: 2}
OK	540-07-8	CCCCCC(=O)OCCCCC	{1: 2, 2: 8, 28: 1}
OK	540-08-9	CCCCCCCCC(=O)CCCCCCCC	{24: 1, 1: 2, 2: 14}
OK	540-09-0	CCCCCCCCCCCC(=O)CCCCCCCCCCC	{24: 1, 1: 2, 2: 20}
OK	540-10-3	CCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC	{1: 2, 2: 29, 28: 1}
OK	540-11-4	CCCCCCC(C/C=C/CCCCCCCCO)O	{1: 1, 2: 14, 3: 1, 20: 2, 6: 2}
OK	540-18-1	CCCCCOC(=O)CCC	{1: 2, 2: 6, 28: 1}
OK	540-42-1	CCC(=O)OCC(C)C	{1: 3, 2: 2, 3: 1, 28: 1}
OK	540-43-2	CCCCCC(C)NC	{1: 3, 2: 4, 3: 1, 31: 1}
OK	540-47-6	COC1CC1	{1: 1, 11: 2, 12: 1, 22: 1}
OK	540-49-8	C(=CBr)Br	{18: 2, 6: 2}
OK	540-51-2	C(CBr)O	{2: 2, 20: 1, 18: 1}
OK	540-54-5	CCCCl	{1: 1, 2: 2, 17: 1}
OK	540-59-0	C(=CCl)Cl	{17: 2, 6: 2}
OK	540-61-4	C(C#N)N	{2: 1, 37: 1, 30: 1}
OK	540-63-6	C(CS)S	{2: 2, 39: 2}
OK	540-67-0	CCOC	{1: 2, 2: 1, 22: 1}
OK	540-73-8	CNNC	{1: 2, 31: 2}
OK	540-80-7	CC(C)(C)ON=O	{1: 3, 34: 1, 4: 1, 29: 1, 22: 1}
OK	540-84-1	CC(C)CC(C)(C)C	{1: 5, 2: 1, 3: 1, 4: 1}
OK	540-88-5	CC(=O)OC(C)(C)C	{1: 4, 4: 1, 28: 1}
OK	5400-88-4	CC(C)(C)C1CCC(CC1)N	{1: 3, 11: 4, 4: 1, 30: 1, 12: 2}
OK	54004-41-0	CCCC(CC(C)C)CO	{1: 3, 2: 4, 3: 2, 20: 1}
OK	54004-42-1	CCOC(=O)C(C)C(C)C	{1: 4, 2: 1, 3: 2, 28: 1}
OK	54004-43-2	CCCC(C)OC(=O)CC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	54007-33-9	CCCCC(=O)NCC	{24: 1, 1: 2, 2: 4, 31: 1}
OK	54009-81-3	C1C(O1)CC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F	{2: 1, 4: 5, 11: 1, 12: 1, 16: 11, 23: 1}
OK	5401-62-7	C1CCC(C(C1)Br)Br	{18: 2, 11: 4, 12: 2}
OK	5402-28-8	CC1CCC(CC1)(C)O	{1: 2, 11: 4, 12: 1, 13: 1, 20: 1}
OK	54024-22-5	CC[C@]12CC(=C)[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CCCC[C@H]34	{1: 1, 2: 1, 5: 1, 9: 1, 10: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 2, 20: 1}
OK	54025-36-4	CC12CCC3C(C1CC[C@@H]2OC(=O)N(CCCl)N=O)CCC4=CC(=O)CCC34	{1: 1, 2: 2, 34: 1, 33: 1, 11: 8, 12: 5, 13: 1, 14: 1, 15: 1, 17: 1, 25: 1, 28: 1, 29: 1}
OK	54043-65-1	CC(C)(C)N=NC1(CCCCC1)O	{1: 3, 34: 2, 4: 1, 11: 5, 13: 1, 20: 1}
OK	5405-40-3	CC1(COC(=O)[C@H]1O)C	{1: 2, 11: 1, 12: 1, 13: 1, 20: 1, 28: 1}
OK	5405-41-4	CCOC(=O)CC(C)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 1}
OK	5405-79-8	CCCC(=O)C(C)(C)C	{24: 1, 1: 4, 2: 2, 4: 1}
OK	5405-88-9	COCCOCCOCOCCOCCOC	{1: 2, 2: 9, 22: 6}
OK	54050-92-9	CCC#CCC(C)C	{1: 3, 2: 2, 3: 1, 10: 2}
OK	54052-90-3	C=CC(=O)OCC(C(C(F)(F)F)F)(F)F	{2: 1, 3: 1, 4: 2, 5: 1, 6: 1, 16: 6, 28: 1}
OK	54059-76-6	CCC(C)(CC(C)C)Cl	{1: 4, 2: 2, 3: 1, 4: 1, 17: 1}
OK	5407-04-5	CN(C)CCCCl.Cl	{1: 2, 2: 3, 33: 1, 17: 2}
OK	54074-85-0	CCC(CC(=O)OCC)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1}
OK	54078-53-4	CCC(=O)OCOCC	{1: 2, 2: 3, 28: 1, 22: 1}
OK	5408-52-6	C(CCN)C[C@@H](C(=O)O)N.C(CC(=O)O)[C@@H](C(=O)O)N	{27: 3, 2: 6, 3: 2, 30: 3}
OK	5408-57-1	CCC(=O)CCCC(C)C	{24: 1, 1: 3, 2: 4, 3: 1}
OK	5408-86-6	CC(C(C)Br)Br	{1: 2, 18: 2, 3: 2}
OK	5409-42-7	C1CNC2C(N1)NCCN2	{32: 4, 11: 4, 12: 2}
OK	54096-45-6	C1C(S1)CCC#N	{41: 1, 2: 2, 11: 1, 12: 1, 37: 1}
OK	54099-13-7	CCI.CN(C)CCNC(=O)CC12CC3CC(C1)CC(C3)C2	{1: 3, 2: 4, 33: 1, 11: 6, 12: 3, 13: 1, 19: 1, 24: 1, 31: 1}
OK	54099-14-8	CCN(CC)CCNC(=O)CC12CC3CC(C1)CC(C3)C2.CCI	{1: 3, 2: 6, 33: 1, 11: 6, 12: 3, 13: 1, 19: 1, 24: 1, 31: 1}
OK	541-16-2	CC(C)(C)OC(=O)CC(=O)OC(C)(C)C	{1: 6, 2: 1, 4: 2, 28: 2}
OK	541-28-6	CC(C)CCI	{19: 1, 1: 2, 2: 2, 3: 1}
OK	541-31-1	CC(C)CCS	{1: 2, 2: 2, 3: 1, 39: 1}
OK	541-33-3	CCCC(Cl)Cl	{1: 1, 2: 2, 3: 1, 17: 2}
OK	541-35-5	CCCC(=O)N	{24: 1, 1: 1, 2: 2, 30: 1}
OK	541-41-3	CCOC(=O)Cl	{1: 1, 2: 1, 28: 1, 17: 1}
OK	541-42-4	CC(C)ON=O	{1: 2, 34: 1, 3: 1, 29: 1, 22: 1}
OK	541-46-8	CC(C)CC(=O)N	{24: 1, 1: 2, 2: 1, 3: 1, 30: 1}
OK	541-47-9	CC(=CC(=O)O)C	{1: 2, 27: 1, 6: 1, 7: 1}
OK	541-48-0	CC(CC(=O)O)N	{27: 1, 1: 1, 2: 1, 3: 1, 30: 1}
OK	541-50-4	CC(=O)CC(=O)O	{24: 1, 1: 1, 2: 1, 27: 1}
OK	541-57-1	C1C(=CC(=O)O1)O	{28: 1, 11: 1, 20: 1, 14: 1, 15: 1}
OK	541-59-3	C1=CC(=O)NC1=O	{32: 1, 25: 2, 14: 2}
OK	541-85-5	CCC(C)CC(=O)CC	{24: 1, 1: 3, 2: 3, 3: 1}
OK	541-91-3	CC1CCCCCCCCCCCCC(=O)C1	{1: 1, 11: 13, 12: 1, 25: 1}
OK	541-95-7	CCCC(C)OC(=O)N	{1: 2, 2: 2, 3: 1, 28: 1, 30: 1}
OK	54105-66-7	CCCCCCCCCCCC1CCCCC1	{1: 1, 2: 10, 11: 5, 12: 1}
OK	54105-76-9	CC(C)CCC1CCCCC1	{11: 5, 1: 2, 2: 2, 3: 1, 12: 1}
OK	54105-77-0	CCC(C)CC1CCCCC1	{11: 5, 1: 2, 2: 2, 3: 1, 12: 1}
OK	5411-55-2	CCCCCOC(=O)CCl	{1: 1, 2: 5, 28: 1, 17: 1}
OK	5411-58-5	CCN(CC)C(=O)C(=O)OCC	{24: 1, 1: 3, 2: 3, 28: 1, 33: 1}
OK	5412-01-1	CC(C)OCCOCCO	{1: 2, 2: 4, 3: 1, 20: 1, 22: 2}
OK	5412-69-1	CCN(CC)CCCC(C)O	{1: 3, 2: 5, 3: 1, 20: 1, 33: 1}
OK	54125-39-2	CCCCCCC[C@H]1[C@@H](O1)C	{1: 2, 2: 6, 12: 2, 23: 1}
OK	54133-31-2	CC1(C(=NC2CCCCC2)C(C1=O)(C)C)C	{1: 4, 34: 1, 11: 5, 12: 1, 13: 2, 15: 1, 25: 1}
OK	5414-19-7	C(CBr)OCCBr	{2: 4, 18: 2, 22: 1}
OK	5414-21-1	C(CCBr)CC#N	{2: 4, 18: 1, 37: 1}
OK	54140-20-4	CCCCCCCCCCCCCCCC(=O)O[C@H]1CO[C@@H]([C@@H]1OC(=O)CCCCCCCCCCCCCCC)[C@@H](CO)OC(=O)CCCCCCCCCCCCCCC	{1: 3, 2: 43, 3: 1, 11: 1, 12: 3, 20: 1, 23: 1, 28: 3}
OK	54143-30-5	C1CC2CCC(C1)[N+](=O)N2[O-]	{33: 2, 11: 5, 12: 2, 29: 2}
OK	54143-31-6	C1CCC2CCC(C1)N([N+]2=O)[O-]	{33: 2, 11: 6, 12: 2, 29: 2}
OK	54143-34-9	CC1(CCC([N+](=N1)[O-])(C)C)C	{1: 4, 35: 1, 33: 1, 11: 2, 13: 2, 29: 1}
OK	54143-35-0	CC1(CCC([N+](=O)N1[O-])(C)C)C	{1: 4, 33: 2, 11: 2, 13: 2, 29: 2}
OK	54149-17-6	COCCOCCBr	{1: 1, 2: 4, 18: 1, 22: 2}
OK	5415-99-6	CCC(CCC(=O)O)N	{27: 1, 1: 1, 2: 3, 3: 1, 30: 1}
OK	5416-94-4	CCCCCCCSC#N	{40: 1, 1: 1, 2: 6, 37: 1}
OK	54162-90-2	C1C=CC[C@@H]([C@@H]1C(=O)O)N	{27: 1, 11: 2, 12: 2, 30: 1, 14: 2}
OK	54166-22-2	CC1(C(N=N1)(C)C)C	{1: 4, 35: 2, 13: 2}
OK	54168-20-6	CN=NOC	{1: 2, 34: 2, 22: 1}
OK	54168-23-9	CC(C)(C)N=[N+](C(C)(C)C)[O-]	{1: 6, 34: 1, 4: 2, 29: 1, 33: 1}
OK	5417-32-3	C1C=CCOCO1	{11: 3, 14: 2, 23: 2}
OK	5417-82-3	CCOC(=C(C#N)C#N)C	{1: 2, 2: 1, 37: 2, 22: 1, 7: 2}
OK	5418-86-0	CSC(SC)SC	{40: 3, 1: 3, 3: 1}
OK	54187-03-0	C1CC1C(C2CC2)NC(=O)NCCCl	{2: 2, 3: 1, 11: 4, 12: 2, 17: 1, 24: 1, 31: 2}
OK	54196-16-6	CC1(C2=C(C(O1)(C)C)SC3(O2)C(=O)C(OC3(C)C)(C)C)C	{1: 8, 41: 1, 13: 5, 15: 2, 23: 3, 25: 1}
OK	54198-71-9	C(C(=N)N)O.Cl	{2: 1, 36: 1, 7: 1, 17: 1, 20: 1, 30: 1}
OK	542-05-2	C(C(=O)CC(=O)O)C(=O)O	{24: 1, 2: 2, 27: 2}
OK	542-08-5	CC(C)OC(=O)CC(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 28: 1}
OK	542-10-9	CC(OC(=O)C)OC(=O)C	{1: 3, 3: 1, 28: 2}
OK	542-18-7	C1CCC(CC1)Cl	{17: 1, 11: 5, 12: 1}
OK	542-28-9	C1CCOC(=O)C1	{11: 4, 28: 1}
OK	542-37-0	CCC(C)(C)OC(=O)CC(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 28: 1}
OK	542-44-9	CCCCCCCCCCCCCCCC(=O)OCC(CO)O	{1: 1, 2: 16, 3: 1, 20: 2, 28: 1}
OK	542-46-1	C1CCCC=CCCCCCCCC(=O)CCC1	{25: 1, 11: 14, 14: 2}
OK	542-50-7	CCCCCCCCCCCCCC(=O)CCCCCCCCCCCCC	{24: 1, 1: 2, 2: 24}
OK	542-54-1	CC(C)CCC#N	{1: 2, 2: 2, 3: 1, 37: 1}
OK	542-56-3	CC(C)CON=O	{1: 2, 34: 1, 3: 1, 2: 1, 22: 1, 29: 1}
OK	542-58-5	CC(=O)OCCCl	{1: 1, 2: 2, 28: 1, 17: 1}
OK	542-59-6	CC(=O)OCCO	{1: 1, 2: 2, 20: 1, 28: 1}
OK	542-69-8	CCCCI	{1: 1, 2: 3, 19: 1}
OK	542-75-6	C(C=CCl)Cl	{17: 2, 2: 1, 6: 2}
OK	542-76-7	C(CCl)C#N	{17: 1, 2: 2, 37: 1}
OK	542-78-9	C(C=O)C=O	{2: 1, 26: 2}
OK	542-81-4	CSCCCl	{40: 1, 1: 1, 2: 2, 17: 1}
OK	542-88-1	C(OCCl)Cl	{17: 2, 2: 2, 22: 1}
OK	542-90-5	CCSC#N	{40: 1, 1: 1, 2: 1, 37: 1}
OK	542-92-7	C1C=CC=C1	{11: 1, 14: 4}
OK	5420-17-7	CCCCCCCCC=CCCCCCCCC(=O)OCC1CCCO1	{1: 1, 2: 15, 6: 2, 11: 3, 12: 1, 23: 1, 28: 1}
OK	54200-50-9	CC(C)C1=CC2=CCC3C(CCCC3(C2CC1)C)(C)COC(=O)C	{1: 5, 2: 1, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 28: 1}
OK	5421-27-2	CC(C)COC(=O)CCCCCCCCC=C	{1: 2, 2: 9, 3: 1, 5: 1, 6: 1, 28: 1}
OK	5421-99-8	CCCC1(OCC(CO1)(C)C)C	{1: 4, 2: 2, 11: 2, 13: 2, 23: 2}
OK	5422-34-4	CC(C(=O)NCCO)O	{1: 1, 2: 2, 3: 1, 20: 2, 24: 1, 31: 1}
OK	5422-52-6	CCCCCC(CCCCC)C(=O)O	{27: 1, 1: 2, 2: 8, 3: 1}
OK	54221-01-1	CC1=CC(CC(C1)C=O)CCC(C)(C)O	{1: 3, 2: 2, 4: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 1, 26: 1}
OK	5423-24-5	CN(CC#N)CC#N	{1: 1, 2: 2, 37: 2, 33: 1}
OK	5423-61-0	C1CN(CCN1CCCN)CCCN.C(CCC(=O)O)CC(=O)O	{27: 2, 33: 2, 2: 10, 11: 4, 30: 2}
OK	54240-85-6	CCCCCCCCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 14, 3: 1}
OK	54244-72-3	CCCCC1CC(=O)CC1=O	{1: 1, 2: 3, 11: 2, 12: 1, 25: 2}
OK	54244-90-5	CCCC(=C(CC)C(=O)C)C	{24: 1, 1: 4, 2: 3, 7: 2}
OK	54253-56-4	CCCN(CCC)N=C	{1: 2, 2: 4, 34: 1, 5: 1, 33: 1}
OK	5426-52-8	CCC(=O)NC(=O)N	{24: 2, 1: 1, 2: 1, 30: 1, 31: 1}
OK	54268-02-9	C(C(CBr)(Br)Br)Br	{2: 2, 4: 1, 18: 4}
OK	5427-26-9	C(C1C(=O)NC(=O)N1)C(=O)O	{32: 2, 25: 2, 2: 1, 27: 1, 12: 1}
OK	54280-90-9	CC1CCC(C(C1)(CCO)O)C(C)C	{1: 3, 2: 2, 3: 1, 11: 3, 12: 2, 13: 1, 20: 2}
OK	54286-88-3	CCC(C)C(OC)OC	{1: 4, 2: 1, 3: 2, 22: 2}
OK	54287-41-1	CCC(C(C)C)N	{1: 3, 2: 1, 3: 2, 30: 1}
OK	54289-82-6	CC(CCO)OC(C)CCO	{1: 2, 2: 4, 3: 2, 20: 2, 22: 1}
OK	5429-56-1	CC(=O)NC(=C)C(=O)O	{1: 1, 5: 1, 7: 1, 24: 1, 27: 1, 31: 1}
OK	54290-40-3	CC(=C(C)C(C)(C)C)C(C)(C)C	{1: 8, 4: 2, 7: 2}
OK	54290-41-4	C=C1CC=CCC1=C	{11: 2, 5: 2, 14: 2, 15: 2}
OK	543-15-7	CC(CCCC(C)(C)O)N.Cl	{1: 3, 2: 3, 3: 1, 4: 1, 17: 1, 20: 1, 30: 1}
OK	543-20-4	C(CC(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 2: 2}
OK	543-21-5	C(#CC(=O)N)C(=O)N	{24: 2, 10: 2, 30: 2}
OK	543-24-8	CC(=O)NCC(=O)O	{24: 1, 1: 1, 2: 1, 27: 1, 31: 1}
OK	543-27-1	CC(C)COC(=O)Cl	{1: 2, 2: 1, 3: 1, 28: 1, 17: 1}
OK	543-28-2	CC(C)COC(=O)N	{1: 2, 2: 1, 3: 1, 28: 1, 30: 1}
OK	543-38-4	C(CON=C(N)N)C(C(=O)O)N	{2: 2, 3: 1, 7: 1, 34: 1, 22: 1, 27: 1, 30: 3}
OK	543-39-5	CC(C)(CCCC(=C)C=C)O	{1: 2, 2: 3, 4: 1, 5: 2, 6: 1, 7: 1, 20: 1}
OK	543-49-7	CCCCCC(C)O	{1: 2, 2: 4, 3: 1, 20: 1}
OK	543-59-9	CCCCCCl	{1: 1, 2: 4, 17: 1}
OK	543-67-9	CCCON=O	{1: 1, 2: 2, 34: 1, 29: 1, 22: 1}
OK	543-75-9	C1COC=CO1	{11: 2, 14: 2, 23: 2}
OK	543-82-8	CC(C)CCCC(C)N	{1: 3, 2: 3, 3: 2, 30: 1}
OK	543-83-9	CC(=CCN=C(N)N)C	{1: 2, 2: 1, 6: 1, 7: 2, 34: 1, 30: 2}
OK	5430-01-3	CCCCCCC(C)(C#C)O	{1: 2, 2: 5, 4: 1, 9: 1, 10: 1, 20: 1}
OK	5430-02-4	CCC(C)(CCC(=CC)C)O	{1: 4, 2: 3, 4: 1, 6: 1, 7: 1, 20: 1}
OK	54302-04-4	C=C.C=C(C(F)(F)F)C(F)(F)F.C(=C(F)Cl)(F)F	{16: 9, 17: 1, 4: 2, 5: 3, 7: 3}
OK	54303-31-0	COCCOCCCN	{1: 1, 2: 5, 30: 1, 22: 2}
OK	54305-87-2	CCCC(C(C)Cl)Cl	{1: 2, 2: 2, 3: 2, 17: 2}
OK	54306-01-3	CCCCCC=CC(OCC)OCC	{1: 3, 2: 6, 3: 1, 22: 2, 6: 2}
OK	54306-03-5	CCCCCCCCCC=CC=CC=O	{1: 1, 2: 8, 26: 1, 6: 4}
OK	5431-33-4	CCCCCCCC/C=C\CCCCCCCC(=O)OCC1CO1	{1: 1, 2: 15, 6: 2, 11: 1, 12: 1, 23: 1, 28: 1}
OK	5432-28-0	CN(C1CCCCC1)N=O	{1: 1, 34: 1, 33: 1, 11: 5, 12: 1, 29: 1}
OK	5432-85-9	CC(C)C1CCC(=O)CC1	{11: 4, 1: 2, 3: 1, 12: 1, 25: 1}
OK	54325-12-1	CC(=CCCC(=CCCC(C)(C#C)O)C)C	{1: 4, 2: 4, 4: 1, 6: 2, 7: 2, 9: 1, 10: 1, 20: 1}
OK	54333-75-4	CCN(CC)C(=O)C(C)Cl	{1: 3, 2: 2, 3: 1, 33: 1, 17: 1, 24: 1}
OK	54334-64-4	CCCCCCCCCCCN(CC)CC	{1: 3, 2: 12, 33: 1}
OK	5434-27-5	CC(C)(CBr)CBr	{1: 2, 2: 2, 4: 1, 18: 2}
OK	5434-31-1	C1C2C(C3C(COCO3)OCO2)OCO1	{11: 5, 12: 4, 23: 6}
OK	5434-57-1	CCCCCCOC(=O)C(C)(C)C	{1: 4, 2: 5, 4: 1, 28: 1}
OK	54340-90-8	CCCCCCOC(C)OC	{1: 3, 2: 5, 3: 1, 22: 2}
OK	54340-93-1	CCCC(C)OC(=O)C(C)C	{1: 4, 2: 2, 3: 2, 28: 1}
OK	54344-61-5	CC1C=CC2(O1)C(=CCCC2(C)C)C	{1: 4, 11: 2, 12: 1, 13: 2, 14: 3, 15: 1, 23: 1}
OK	5435-64-3	CC(CC=O)CC(C)(C)C	{1: 4, 2: 2, 3: 1, 4: 1, 26: 1}
OK	5436-01-1	CN1C(=O)C=CC(=O)N1	{32: 1, 1: 1, 33: 1, 14: 2, 25: 2}
OK	5436-21-5	CC(=O)CC(OC)OC	{24: 1, 1: 3, 2: 1, 3: 1, 22: 2}
OK	5436-93-1	CCCCCCCCCCOC(=O)CBr	{1: 1, 2: 10, 28: 1, 18: 1}
OK	54364-60-2	CCC=CC=CCCCCCCO	{1: 1, 2: 7, 20: 1, 6: 4}
OK	54364-62-4	CCC=CC=CCCCCCCOC(=O)C	{1: 2, 2: 7, 28: 1, 6: 4}
OK	5437-67-2	COC(=O)C(C(=O)OC)[N+](=O)[O-]	{1: 2, 3: 1, 28: 2, 38: 1}
OK	54376-32-8	C1CC1=N	{11: 2, 36: 1, 15: 1}
OK	54376-39-5	CC1(C(=C)C1(C)C)C	{1: 4, 15: 1, 5: 1, 13: 2}
OK	54377-34-3	CCCCC#CCCCCCl	{1: 1, 2: 7, 10: 2, 17: 1}
OK	54391-01-4	C=CCN(CC=C)C1CCCCC1	{33: 1, 2: 2, 5: 2, 6: 2, 11: 5, 12: 1}
OK	54392-27-7	CC(C)CCCCCCCCCCCCCCC(=O)O[C@H]1CO[C@@H]([C@@H]1OC(=O)CCCCCCCCCCCCCCC(C)C)[C@@H](CO)OC(=O)CCCCCCCCCCCCCCC(C)C	{1: 6, 2: 43, 3: 4, 11: 1, 12: 3, 20: 1, 23: 1, 28: 3}
OK	54396-97-3	CCOCCOC(=O)C(C)C	{1: 3, 2: 3, 3: 1, 28: 1, 22: 1}
OK	544-00-3	CC(C)CCNCCC(C)C	{1: 4, 2: 4, 3: 2, 31: 1}
OK	544-01-4	CC(C)CCOCCC(C)C	{1: 4, 2: 4, 3: 2, 22: 1}
OK	544-02-5	CC(C)CCSCCC(C)C	{40: 1, 1: 4, 2: 4, 3: 2}
OK	544-10-5	CCCCCCCl	{1: 1, 2: 5, 17: 1}
OK	544-12-7	CCC=CCCO	{1: 1, 2: 3, 20: 1, 6: 2}
OK	544-13-8	C(CC#N)CC#N	{2: 3, 37: 2}
OK	544-16-1	CCCCON=O	{1: 1, 2: 3, 34: 1, 29: 1, 22: 1}
OK	544-25-2	C1C=CC=CC=C1	{11: 1, 14: 6}
OK	544-31-0	CCCCCCCCCCCCCCCC(=O)NCCO	{24: 1, 1: 1, 2: 16, 20: 1, 31: 1}
OK	544-35-4	CCCCCC=CCC=CCCCCCCCC(=O)OCC	{1: 2, 2: 13, 28: 1, 6: 4}
OK	544-40-1	CCCCSCCCC	{40: 1, 1: 2, 2: 6}
OK	544-62-7	CCCCCCCCCCCCCCCCCCOCC(CO)O	{1: 1, 2: 19, 3: 1, 20: 2, 22: 1}
OK	544-63-8	CCCCCCCCCCCCCC(=O)O	{1: 1, 2: 12, 27: 1}
OK	544-64-9	CCCCC=CCCCCCCCC(=O)O	{1: 1, 2: 10, 27: 1, 6: 2}
OK	544-65-0	CCCCCCCCCC=CCCC(=O)O	{1: 1, 2: 10, 27: 1, 6: 2}
OK	544-72-9	CCCC/C=C\C=C\C=C/CCCCCCCC(=O)O	{1: 1, 2: 10, 27: 1, 6: 6}
OK	544-74-1	CCCCCCCCCCCC#CCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 10: 2}
OK	544-76-3	CCCCCCCCCCCCCCCC	{1: 2, 2: 14}
OK	544-77-4	CCCCCCCCCCCCCCCCI	{1: 1, 2: 15, 19: 1}
OK	544-85-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 30}
OK	5440-42-6	CCOC(=O)C(CCC#N)(C(=O)OCC)NC(=O)C	{1: 3, 2: 4, 4: 1, 37: 1, 24: 1, 28: 2, 31: 1}
OK	5440-83-5	CC(=O)OCC1CCCCO1	{1: 1, 2: 1, 11: 4, 12: 1, 23: 1, 28: 1}
OK	5440-89-1	CCCCC(CC)CCC(=O)C	{24: 1, 1: 3, 2: 6, 3: 1}
OK	54406-48-3	CC/C=C(\C)/C(C#C)OC(=O)C1C(C1(C)C)C=C(C)C	{1: 6, 2: 1, 3: 1, 6: 2, 7: 2, 9: 1, 10: 1, 12: 2, 13: 1, 28: 1}
OK	5441-40-7	CN1CCC(=O)NCC1	{32: 1, 1: 1, 11: 4, 33: 1, 25: 1}
OK	5441-51-0	CCC1CCC(=O)CC1	{1: 1, 2: 1, 11: 4, 12: 1, 25: 1}
OK	5441-52-1	CC1CC(CC(C1)O)C	{1: 2, 11: 3, 12: 3, 20: 1}
OK	5441-63-4	C=CCOC(=O)COCC(=O)OCC=C	{2: 4, 22: 1, 28: 2, 5: 2, 6: 2}
OK	54410-57-0	NN=NN	{34: 2, 30: 2}
OK	54410-63-8	CSCCCCCSC	{40: 2, 1: 2, 2: 5}
OK	54410-94-5	CC(C)CC(=O)OCCC(=C)C	{1: 3, 2: 3, 3: 1, 5: 1, 7: 1, 28: 1}
OK	54411-01-7	CCCCCC1CCCCC1C	{1: 2, 2: 4, 11: 4, 12: 2}
OK	5442-00-2	CC(CO)C1CCCCC1	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 20: 1}
OK	5442-32-0	C(CSC(=N)N)CSC(=N)N.Br.Br	{2: 3, 36: 2, 7: 2, 40: 2, 18: 2, 30: 2}
OK	54423-67-5	CC(C)(C)CCCCC(=O)OC=C	{1: 3, 2: 4, 4: 1, 5: 1, 6: 1, 28: 1}
OK	54440-40-3	C1CCC2(C=C2)C3(C1)C=C3	{11: 4, 13: 2, 14: 4}
OK	5445-17-0	CC(C(=O)OC)Br	{1: 2, 18: 1, 3: 1, 28: 1}
OK	5445-19-2	CCCCC(C(=O)OC)Br	{1: 2, 2: 3, 3: 1, 28: 1, 18: 1}
OK	5445-22-7	CCCCCCC(C(=O)OC)Br	{1: 2, 2: 5, 3: 1, 28: 1, 18: 1}
OK	5445-24-9	CCCC1(CCCCC1)O	{1: 1, 2: 2, 11: 5, 20: 1, 13: 1}
OK	5445-29-4	CCCCCCC(C(=O)OCC)Br	{1: 2, 2: 6, 3: 1, 28: 1, 18: 1}
OK	5445-30-7	CCCCC1(CCCCC1)O	{1: 1, 2: 3, 11: 5, 20: 1, 13: 1}
OK	5445-31-8	CCCCCCC(=O)C(C)C	{24: 1, 1: 3, 2: 5, 3: 1}
OK	5445-51-2	C1CC(C1)(C(=O)O)C(=O)O	{27: 2, 11: 3, 13: 1}
OK	5445-85-2	CC(=O)NC(C(Cl)(Cl)Cl)O	{1: 1, 3: 1, 4: 1, 17: 3, 20: 1, 24: 1, 31: 1}
OK	54458-61-6	CC1C(C(=O)C(=C1C)C)C	{1: 4, 12: 2, 25: 1, 15: 2}
OK	54459-71-1	CCCCCCOCCCC	{1: 2, 2: 8, 22: 1}
OK	54460-46-7	CCCCCCCCCCCCCCCCOC(=O)C1CC1	{1: 1, 2: 15, 11: 2, 12: 1, 28: 1}
OK	54460-96-7	CC(COCC(C)Cl)Cl	{1: 2, 2: 2, 3: 2, 22: 1, 17: 2}
OK	54462-70-3	CC(CBr)C(C)CBr	{1: 2, 2: 2, 3: 2, 18: 2}
OK	5447-66-5	CC(C(C#N)C(=O)N)C(C#N)C(=O)N	{24: 2, 1: 1, 3: 3, 37: 2, 30: 2}
OK	5447-97-2	CC(C)([N+](=O)[O-])Br	{1: 2, 18: 1, 4: 1, 38: 1}
OK	5447-99-4	CCC(C(C)O)[N+](=O)[O-]	{1: 2, 2: 1, 3: 2, 20: 1, 38: 1}
OK	54471-59-9	C12(C(C(C(C(C1(C(F)(F)F)C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F	{16: 22, 4: 2, 13: 10}
OK	54473-70-0	C(CCC(=O)OCC(CBr)(CBr)CBr)CC(=O)OCC(CBr)(CBr)CBr	{28: 2, 2: 12, 4: 2, 18: 6}
OK	54484-66-1	CCCC=CCOC(C)OCC	{1: 3, 2: 4, 3: 1, 22: 2, 6: 2}
OK	54484-73-0	CCCCCCOC(C)OCC	{1: 3, 2: 6, 3: 1, 22: 2}
OK	545-06-2	C(#N)C(Cl)(Cl)Cl	{17: 3, 4: 1, 37: 1}
OK	545-26-6	C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(C[C@@H]([C@@H]4C5=CC(=O)OC5)O)O)C)O	{1: 2, 11: 9, 12: 6, 13: 3, 14: 1, 15: 1, 20: 3, 28: 1}
OK	545-47-1	CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4(C3(CC2)C)C)(C)C)O)C)C	{1: 7, 5: 1, 7: 1, 11: 10, 12: 6, 13: 5, 20: 1}
OK	545-93-7	CC(C)C1(C(=O)NC(=O)NC1=O)CC(=C)Br	{32: 2, 1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 13: 1, 18: 1, 25: 3}
OK	54505-72-5	CCC(CC)(C(=O)Cl)C(=O)Cl	{24: 2, 1: 2, 2: 2, 4: 1, 17: 2}
OK	5451-51-4	C(COC(=O)CI)OC(=O)CI	{2: 4, 19: 2, 28: 2}
OK	5451-80-9	CCCCCCCOC(=O)CCCC	{1: 2, 2: 9, 28: 1}
OK	5451-85-4	CCCCCCCCOC(=O)CCCC	{1: 2, 2: 10, 28: 1}
OK	5451-96-7	CCCCCCCCCOC(=O)CCl	{1: 1, 2: 9, 28: 1, 17: 1}
OK	5451-98-9	CCCCCCCCOC(=O)CCl	{1: 1, 2: 8, 28: 1, 17: 1}
OK	54512-75-3	C(CCCl)CCBr	{17: 1, 2: 5, 18: 1}
OK	54518-97-7	CCC(C)CN=CC(C)CC	{1: 4, 2: 3, 3: 2, 34: 1, 6: 1}
OK	5452-29-9	CCCCCCCCCCCCC1CCCC(C1)C	{1: 2, 2: 11, 11: 4, 12: 2}
OK	5452-35-7	C1CCCC(CC1)N	{11: 6, 12: 1, 30: 1}
OK	5452-37-9	C1CCCC(CCC1)N	{11: 7, 12: 1, 30: 1}
OK	5452-75-5	CCOC(=O)CC1CCCCC1	{1: 1, 2: 2, 11: 5, 12: 1, 28: 1}
OK	54524-31-1	C(C#N)S	{2: 1, 37: 1, 39: 1}
OK	54527-03-6	CCCCCCCC(=O)CCCCCC(=O)OC	{24: 1, 1: 2, 2: 11, 28: 1}
OK	54527-68-3	CC(=O)CC(=O)OCCCl	{24: 1, 1: 1, 2: 3, 28: 1, 17: 1}
OK	5453-80-5	C1C2CC(C1C=C2)C=O	{26: 1, 11: 2, 12: 3, 14: 2}
OK	5454-09-1	CCCCCCCCCCOC(=O)CCC	{1: 2, 2: 11, 28: 1}
OK	5454-12-6	CCCCCCCCCCOC(=O)CCCC	{1: 2, 2: 12, 28: 1}
OK	5454-19-3	CCCCCCCCCCOC(=O)CC	{1: 2, 2: 10, 28: 1}
OK	5454-28-4	CCCCCCC(=O)OCCCC	{1: 2, 2: 8, 28: 1}
OK	5454-48-8	CCCCCCCCCCCCCCCCOC(=O)CBr	{1: 1, 2: 16, 28: 1, 18: 1}
OK	5454-55-7	C[C@]12CCC(=O)C[C@@H]1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@]4(C)O)C)O	{1: 3, 11: 8, 12: 5, 13: 3, 20: 2, 25: 1}
OK	5454-79-5	C[C@@H]1CCC[C@@H](C1)O	{1: 1, 11: 4, 12: 2, 20: 1}
OK	5454-83-1	COC(=O)CCCCBr	{1: 1, 2: 4, 28: 1, 18: 1}
OK	54546-26-8	CCCCC1OC(CC(O1)(C)C)C	{1: 4, 2: 3, 11: 1, 12: 2, 13: 1, 23: 2}
OK	54549-24-5	CCCCCCOC1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O	{1: 1, 2: 6, 12: 5, 20: 4, 22: 1, 23: 1}
OK	54549-80-3	CCC1CCCC1(C)C	{1: 3, 2: 1, 11: 3, 12: 1, 13: 1}
OK	5455-24-3	CCCC(=O)C(=O)CCC	{24: 2, 1: 2, 2: 4}
OK	5455-66-3	CCCCCC1OCCC(O1)C	{1: 2, 2: 4, 11: 2, 12: 2, 23: 2}
OK	5455-94-7	CC1(CC(=O)C(O1)(C)C)C	{1: 4, 11: 1, 25: 1, 13: 2, 23: 1}
OK	54553-14-9	C1CC(=O)N(C1=O)CCl	{17: 1, 2: 1, 11: 2, 33: 1, 25: 2}
OK	54564-31-7	C1C2CC3CC1CC(C2)C3[N+](=O)[O-]	{11: 5, 12: 5, 38: 1}
OK	5457-40-9	CCCC(=C)C1CC1	{1: 1, 2: 2, 5: 1, 7: 1, 11: 2, 12: 1}
OK	5457-41-0	CC(C)C(C(C)C)(C(C)(C)C)O	{1: 7, 3: 2, 4: 2, 20: 1}
OK	5457-42-1	CC(C)C(C(C)(C)C)(C(C)(C)C)O	{1: 8, 3: 1, 4: 3, 20: 1}
OK	5457-44-3	COC(=O)CCC(=O)CC(=O)OC	{24: 1, 1: 2, 2: 3, 28: 2}
OK	5457-66-9	CCCCCCCC(=O)OC(C)(C)C	{1: 4, 2: 6, 4: 1, 28: 1}
OK	54573-13-6	CCCCCC#CI	{1: 1, 2: 4, 19: 1, 10: 2}
OK	54575-17-6	CC(C)CCCCCOC(=O)CSCC(CO)O	{1: 2, 2: 8, 3: 2, 40: 1, 20: 2, 28: 1}
OK	54576-10-2	CC1CC(CC(=O)C1C(=O)OC)(C)C	{1: 4, 11: 2, 12: 2, 13: 1, 25: 1, 28: 1}
OK	54576-13-5	CC(CCC(=O)OC)CC(=O)OC	{1: 3, 2: 3, 3: 1, 28: 2}
OK	54576-32-8	CCSCCCCSCC	{40: 2, 1: 2, 2: 6}
OK	5458-06-0	C(CCO)CC1C(=O)NC(=O)N1	{32: 2, 20: 1, 2: 4, 12: 1, 25: 2}
OK	5458-16-2	CCCC(C)C1CC1	{11: 2, 1: 2, 2: 2, 3: 1, 12: 1}
OK	5458-59-3	CCCCCCCC(=O)OC(C)C	{1: 3, 2: 6, 3: 1, 28: 1}
OK	5458-61-7	CCCCCCCC(=O)OC(C)CC	{1: 3, 2: 7, 3: 1, 28: 1}
OK	5458-64-0	CC(C)OC(=O)C1C(C1(C)C)C=C(C)C	{1: 6, 3: 1, 6: 1, 7: 1, 12: 2, 13: 1, 28: 1}
OK	5458-83-3	CCCCN=C(N)N[N+](=O)[O-]	{1: 1, 2: 3, 38: 1, 7: 1, 34: 1, 30: 1, 31: 1}
OK	54580-22-2	CC(C)C(=C(C)C)C(=C(C)C)C(=C)C	{1: 7, 3: 1, 5: 1, 7: 5}
OK	54580-23-3	CC(C)C(=C(C)C)C(=C(C)C)C(C)C	{1: 8, 3: 2, 7: 4}
OK	5459-10-9	C(CSCCC(=O)N)C(=O)N	{24: 2, 40: 1, 2: 4, 30: 2}
OK	5459-35-8	CCOC(=O)C(=C)Br	{1: 1, 2: 1, 5: 1, 7: 1, 18: 1, 28: 1}
OK	5459-37-0	CCCCCCCOC(=O)C(=C)C	{1: 2, 2: 6, 28: 1, 5: 1, 7: 1}
OK	5459-38-1	C=CC(=O)OCC(COC(=O)C=C)OC(=O)C=C	{2: 2, 3: 1, 28: 3, 5: 3, 6: 3}
OK	5459-42-7	CC(=O)NC(C)(C)CC(C)(C)C	{24: 1, 1: 6, 2: 1, 4: 2, 31: 1}
OK	5459-58-5	CCCCOC(=O)CC#N	{1: 1, 2: 4, 28: 1, 37: 1}
OK	5459-93-8	CCNC1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1, 31: 1}
OK	5459-95-0	CCN(CC)CCCNC	{1: 3, 2: 5, 33: 1, 31: 1}
OK	5459-97-2	CCCOC(=O)C(CC)Br	{1: 2, 2: 3, 3: 1, 28: 1, 18: 1}
OK	5459-98-3	CC(C)OC(=O)CCCCCCCCC=C	{1: 2, 2: 8, 3: 1, 5: 1, 6: 1, 28: 1}
OK	54596-69-9	CCCCCCNCCO	{1: 1, 2: 7, 20: 1, 31: 1}
OK	546-06-5	CC1C2CCC3C2(CCC4C3CC=C5C4(CCC(C5)N(C)C)C)CN1C	{1: 5, 33: 2, 11: 9, 12: 6, 13: 2, 14: 1, 15: 1}
OK	546-28-1	CC1CCC2C13CCC(=C)C(C3)C2(C)C	{1: 3, 5: 1, 11: 5, 12: 3, 13: 2, 15: 1}
OK	546-43-0	CC1CCCC2(C1=CC3C(C2)OC(=O)C3=C)C	{1: 2, 5: 1, 11: 4, 12: 3, 13: 1, 14: 1, 15: 2, 28: 1}
OK	546-48-5	CC1(CCCC(N1C)(C)C)C.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 5, 3: 2, 33: 1, 11: 3, 13: 2, 20: 2, 27: 2}
OK	546-49-6	CC(=CC(=O)C(C)(C)C=C)C	{1: 4, 4: 1, 5: 1, 6: 2, 7: 1, 24: 1}
OK	546-79-2	CC(C)C12CCC(C1C2)(C)O	{1: 3, 3: 1, 11: 3, 12: 1, 13: 2, 20: 1}
OK	546-80-5	C[C@@H]1[C@H]2C[C@]2(CC1=O)C(C)C	{1: 3, 3: 1, 11: 2, 12: 2, 13: 1, 25: 1}
OK	546-88-3	CC(=O)NO	{24: 1, 1: 1, 20: 1, 31: 1}
OK	5460-63-9	CC(=CC1C(C1(C)C)C(=O)OC)C	{1: 5, 6: 1, 7: 1, 12: 2, 13: 1, 28: 1}
OK	54606-29-0	CC1CCCC2N1C(=O)C(=CN2C)C(=O)N	{1: 2, 33: 2, 11: 3, 12: 2, 14: 1, 15: 1, 24: 1, 25: 1, 30: 1}
OK	5461-02-9	CCCCCCCCCCCOC(=O)CCC	{1: 2, 2: 12, 28: 1}
OK	5461-06-3	CCCCCCCC(=O)OCC(C)C	{1: 3, 2: 7, 3: 1, 28: 1}
OK	5461-85-8	CC(C)CN(/C(=N/[N+](=O)[O-])/N)N=O	{1: 2, 2: 1, 3: 1, 33: 1, 38: 1, 7: 1, 34: 2, 29: 1, 30: 1}
OK	54622-44-5	CC1CC(NCCNC(CC(NCCN1)(C)C)C)(C)C	{32: 4, 1: 6, 11: 6, 12: 2, 13: 2}
OK	5463-82-1	CCCCCCCC(=O)C(C)C	{24: 1, 1: 3, 2: 6, 3: 1}
OK	54630-50-1	CCC(C)CCC(C)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	54634-49-0	C1CC(=O)N(C1)N=O	{25: 1, 34: 1, 11: 3, 29: 1, 33: 1}
OK	54634-98-9	C1CCCCCC(=O)NCCCCC1.C1CCC(=O)NCC1.C(CCCCCN)CCCCC(=O)O.C(CCCC(=O)O)CCCC(=O)O.C(CCCN)CCN	{32: 2, 2: 23, 11: 16, 25: 2, 27: 3, 30: 3}
OK	5464-28-8	C1C(OCO1)CO	{20: 1, 2: 1, 11: 2, 12: 1, 23: 2}
OK	5464-71-1	CCCCCCCCOC(=O)C(C)O	{1: 2, 2: 7, 3: 1, 20: 1, 28: 1}
OK	54640-88-9	CCOC(=O)C=C.CC(C)COCNC(=O)C=C.CC(=C)C(=O)OC.C=CC(=O)O	{1: 5, 2: 3, 3: 1, 5: 4, 6: 3, 7: 1, 22: 1, 24: 1, 27: 1, 28: 2, 31: 1}
OK	54644-28-9	CCC1SC(SS1)CC	{1: 2, 2: 2, 12: 2, 41: 3}
OK	54648-79-2	CC(C)NC(=NC(C)C)OC	{1: 5, 34: 1, 3: 2, 7: 1, 22: 1, 31: 1}
OK	5465-09-8	CC1CCC(=O)CC1C	{1: 2, 11: 3, 12: 2, 25: 1}
OK	54653-26-8	CCCC(C)(Br)Br	{1: 2, 2: 2, 4: 1, 18: 2}
OK	54653-27-9	CCC(CC)(Br)Br	{1: 2, 2: 2, 4: 1, 18: 2}
OK	54653-29-1	CCC=C(C)Br	{1: 2, 2: 1, 18: 1, 6: 1, 7: 1}
OK	54654-71-6	CC[N+]1=C(SCC1)C.[I-]	{1: 2, 2: 1, 33: 1, 41: 1, 11: 2, 15: 1, 19: 1}
OK	54657-09-9	C1CC(CCC1C(=O)N)C(=O)N	{24: 2, 11: 4, 12: 2, 30: 2}
OK	54658-01-4	CCCC(CC)OC	{1: 3, 2: 3, 3: 1, 22: 1}
OK	5466-06-8	CCOC(=O)CCS	{1: 1, 2: 3, 28: 1, 39: 1}
OK	54664-77-6	CCC=CC#CCCCCCCCCOC1CCCCO1	{1: 1, 2: 9, 6: 2, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	54664-98-1	CCC=CC=CCCCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 6: 4}
OK	5467-28-7	CCOC(=O)CC(C(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OCC	{1: 8, 2: 3, 3: 2, 4: 2, 28: 4}
OK	54676-39-0	CCCCC1C(CCCC1(C)C)C	{1: 4, 2: 3, 11: 3, 12: 2, 13: 1}
OK	5468-23-5	CCOC(=O)C(C(=O)OCC)OC(=O)C	{1: 3, 2: 2, 3: 1, 28: 3}
OK	54680-52-3	C=CN=O	{34: 1, 5: 1, 6: 1, 29: 1}
OK	54684-78-5	CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC(CCCCCC)OC(=O)CCCCCCCCCCCCCCCCC	{1: 3, 2: 48, 3: 1, 28: 2}
OK	5469-26-1	CC(C)(C)C(=O)CBr	{24: 1, 1: 3, 2: 1, 4: 1, 18: 1}
OK	547-60-4	CC1C2CC(C2(C)C)CC1=O	{1: 3, 11: 2, 12: 3, 13: 1, 25: 1}
OK	547-61-5	CC1([C@H]2C[C@@H]1C(=C)C(C2)O)C	{1: 2, 5: 1, 11: 2, 12: 3, 13: 1, 15: 1, 20: 1}
OK	547-63-7	CC(C)C(=O)OC	{1: 3, 3: 1, 28: 1}
OK	547-64-8	CC(C(=O)OC)O	{1: 2, 3: 1, 20: 1, 28: 1}
OK	547-65-9	C=C1CCOC1=O	{11: 2, 28: 1, 5: 1, 15: 1}
OK	5470-02-0	CCCN1CCCCC1	{1: 1, 2: 2, 11: 5, 33: 1}
OK	5470-11-1	NO.Cl	{17: 1, 20: 1, 30: 1}
OK	5470-27-9	C[C@@H]1C[C@]2([C@@H](CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)CC1=O)C	{1: 3, 11: 8, 12: 5, 13: 2, 25: 2}
OK	5470-28-0	CCOC(=O)N1CCN(CC1)C(=O)OCC	{1: 2, 2: 2, 11: 4, 28: 2, 33: 2}
OK	54714-50-0	C1CCCN(CC1)CC#N	{33: 1, 2: 1, 11: 6, 37: 1}
OK	54716-02-8	CCOC(=O)/C=C(\C)/N1CCCC1	{1: 2, 2: 1, 33: 1, 6: 1, 7: 1, 11: 4, 28: 1}
OK	54716-29-9	CCOC(=O)C(C)ON=C(C)C	{1: 4, 2: 1, 3: 1, 7: 1, 34: 1, 22: 1, 28: 1}
OK	54717-80-5	CC(=O)CC(=O)OC1CC2CCC1(C2(C)C)C	{1: 4, 2: 1, 11: 3, 12: 2, 13: 2, 24: 1, 28: 1}
OK	5472-38-8	CCOC(=O)CC(C=O)C(=O)OCC	{1: 2, 2: 3, 3: 1, 28: 2, 26: 1}
OK	54722-72-4	CC(C)(C)N1CCCCO1	{1: 3, 11: 4, 4: 1, 33: 1, 23: 1}
OK	54723-19-2	CCCCOC(=O)CCCC(=O)C	{24: 1, 1: 2, 2: 6, 28: 1}
OK	54736-47-9	CC(CNCCN1CCNCC1)O	{32: 1, 1: 1, 2: 3, 3: 1, 33: 1, 11: 4, 20: 1, 31: 1}
OK	54739-35-4	CC1(C(C2(C(O1)(C)C)OC3=C(S2)C(OC3(C)C)(C)C)O)C	{1: 8, 41: 1, 12: 1, 13: 5, 15: 2, 20: 1, 23: 3}
OK	54746-50-8	C=CCCN(CC=C)N=O	{33: 1, 2: 3, 5: 2, 6: 2, 34: 1, 29: 1}
OK	54755-18-9	C1=CC(=CC=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]	{38: 2, 14: 6, 15: 2}
OK	54774-99-1	CC(C)OC(=O)C(CCl)Cl	{1: 2, 2: 1, 3: 2, 28: 1, 17: 2}
OK	54798-83-3	CCCCC(C)(CCC)C(=O)OC	{1: 4, 2: 5, 4: 1, 28: 1}
OK	548-98-1	CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4[C@@]3(CCCC4)C)C	{1: 4, 2: 2, 3: 1, 11: 10, 12: 5, 13: 2}
OK	54809-53-9	CC(=CC(CC(=C)C=C)O)C	{1: 2, 2: 1, 3: 1, 5: 2, 6: 2, 7: 2, 20: 1}
OK	54812-86-1	CC(C(C)S)O	{1: 2, 3: 2, 20: 1, 39: 1}
OK	54814-64-1	CCCCCC1CC=CC(=O)O1	{1: 1, 2: 4, 11: 1, 12: 1, 14: 2, 28: 1}
OK	54815-12-2	CCCCCCOCOCCCCCC	{1: 2, 2: 11, 22: 2}
OK	54819-86-2	CCCCOC(=O)C(C)Cl	{1: 2, 2: 3, 3: 1, 28: 1, 17: 1}
OK	54823-94-8	CC1CCCCC1C2CCCCC2C	{1: 2, 11: 8, 12: 4}
OK	54823-95-9	CC1CCCC(C1)C2CCCC(C2)C	{1: 2, 11: 8, 12: 4}
OK	54823-96-0	CC1CCCC(C1)CC2CCCCC2	{1: 1, 2: 1, 11: 9, 12: 3}
OK	54823-97-1	CC1CCC(CC1)CC2CCCCC2	{1: 1, 2: 1, 11: 9, 12: 3}
OK	54823-98-2	CC1CCC(CC1)C2CCC(CC2)C	{1: 2, 11: 8, 12: 4}
OK	54824-04-3	CC1CCCCC1CC2CCCCC2	{1: 1, 2: 1, 11: 9, 12: 3}
OK	54833-23-7	CCCCCCCCCCC(C)CCCCCCCCC	{1: 3, 2: 17, 3: 1}
OK	54833-30-6	CCCCC(C1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 3, 3: 1, 12: 2}
OK	54833-31-7	C1CCC(CC1)CCCCCC2CCCCC2	{2: 5, 11: 10, 12: 2}
OK	54833-34-0	CCC(CC1CCCCC1)CC2CCCCC2	{11: 10, 1: 1, 2: 3, 3: 1, 12: 2}
OK	54833-48-6	CCC(C)CCCCC(C)CCCC(C)CCCC(C)C	{1: 6, 2: 11, 3: 4}
OK	54839-24-6	CCOCC(C)OC(=O)C	{1: 3, 2: 2, 3: 1, 28: 1, 22: 1}
OK	54839-25-7	CC(C)OCC(C)OC(=O)C	{1: 4, 2: 1, 3: 2, 28: 1, 22: 1}
OK	54843-13-9	CCOC(=O)C(=CO)C	{1: 2, 2: 1, 6: 1, 7: 1, 20: 1, 28: 1}
OK	54844-65-4	CCCCCCCCCCC(=O)CCCC=CCCCCC	{24: 1, 1: 2, 2: 16, 6: 2}
OK	54844-69-8	CCCCCCCCCCC(=O)CCCC#CCCCCC	{24: 1, 1: 2, 2: 16, 10: 2}
OK	54844-70-1	CCCCCCCCCCC(CCCC#CCCCCC)O	{1: 2, 2: 16, 3: 1, 20: 1, 10: 2}
OK	54863-80-8	CCCCCCCCCCCCCCC=CCCCCCCCCCCCCC	{1: 2, 2: 25, 6: 2}
OK	54867-98-0	C(CN)CNCCCN.C(CCl)Cl	{17: 2, 2: 8, 30: 2, 31: 1}
OK	5487-60-5	CCC(C)OC(=O)C(C)(C)C	{1: 5, 2: 1, 3: 1, 4: 1, 28: 1}
OK	54878-25-0	C[C@@H]1CC(=O)C=C(C12CC[C@H](C2)C(=C)C)C	{1: 3, 5: 1, 7: 1, 11: 4, 12: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	54890-00-5	CCCC(C1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 2, 3: 1, 12: 2}
OK	54890-01-6	CCC(CC1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 2, 3: 1, 12: 2}
OK	54890-02-7	CCC(C)(C1CCCCC1)C2CCCCC2	{1: 2, 2: 1, 11: 10, 4: 1, 12: 2}
OK	54892-13-6	CCCCCCCCCCCCCCC(C)(CCC)O	{1: 3, 2: 15, 4: 1, 20: 1}
OK	54897-62-0	CCN(CCCCO)N=O	{1: 1, 2: 5, 33: 1, 34: 1, 20: 1, 29: 1}
OK	54897-63-1	CCN(CCCC(=O)O)N=O	{1: 1, 34: 1, 33: 1, 2: 4, 27: 1, 29: 1}
OK	54910-68-8	C(C1C(C(C(C(=O)O1)O)O)O)O	{20: 4, 2: 1, 12: 4, 28: 1}
OK	54914-37-3	CC(C)C=NCC1(CC(CC(C1)(C)C)N=CC(C)C)C	{1: 7, 2: 1, 3: 2, 6: 2, 11: 3, 12: 1, 13: 2, 34: 2}
OK	54914-38-4	CCCCCCCCCCCC(=O)N(CC(C)O)CC(C)O	{1: 3, 2: 12, 3: 2, 33: 1, 20: 2, 24: 1}
OK	5493-45-8	C1CCC(C(C1)C(=O)OCC2CO2)C(=O)OCC3CO3	{28: 2, 2: 2, 11: 6, 12: 4, 23: 2}
OK	54934-88-2	CCCC1CCCCC1C2CCCCC2	{1: 1, 2: 2, 11: 9, 12: 3}
OK	54934-90-6	CC(C)(C1CCCCC1)C2CCCCC2	{1: 2, 11: 10, 4: 1, 12: 2}
OK	54934-91-7	CCC(C1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 1, 3: 1, 12: 2}
OK	54934-92-8	CCC1CCCCC1CC2CCCCC2	{1: 1, 2: 2, 11: 9, 12: 3}
OK	54934-94-0	CCC1CCC(CC1)CC2CCCCC2	{1: 1, 2: 2, 11: 9, 12: 3}
OK	54939-04-7	C12=C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)C(C(C(C2(F)F)(F)F)(F)F)(F)F	{16: 16, 13: 8, 15: 2}
OK	54947-74-9	CCCCC(C)CCC(=O)O	{27: 1, 1: 2, 2: 5, 3: 1}
OK	54949-74-5	C(CO)C(C(F)(F)F)(F)F	{16: 5, 20: 1, 2: 2, 4: 2}
OK	54953-79-6	CC1(CNC(=O)OC1)C	{32: 1, 1: 2, 11: 2, 28: 1, 13: 1}
OK	5496-10-6	C1CCC(CC1)(C#N)N	{11: 5, 13: 1, 30: 1, 37: 1}
OK	54964-82-8	CCCCC(C)CCCC(C)CCCC(C)CCCC(C)C	{1: 6, 2: 12, 3: 4}
OK	54964-83-9	CCCCCCCCC1CCCC2C1C(CCC2C)C	{1: 3, 2: 7, 11: 5, 12: 5}
OK	54964-85-1	CCCCCCCCC1CC2CC(CCC2CC1C)C	{1: 3, 2: 7, 11: 5, 12: 5}
OK	54965-61-6	CC(C)C1CCC(CC1)CC2CCCCC2	{11: 9, 1: 2, 2: 1, 3: 1, 12: 3}
OK	5497-67-6	CC(C)(CC=C)C=O	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 26: 1}
OK	54971-26-5	CCCCC(C(=O)Br)Br	{24: 1, 1: 1, 2: 3, 3: 1, 18: 2}
OK	5498-70-4	CN1CCCCCCCCCCCC1=O	{1: 1, 11: 11, 33: 1, 25: 1}
OK	54986-15-1	CC(=C1N(N=NN1C)C)C	{1: 4, 15: 1, 33: 2, 35: 2, 7: 1}
OK	54996-03-1	CCOC(=O)C1=CC(NC(C1)(C)C)(C)C	{32: 1, 1: 5, 2: 1, 11: 1, 13: 2, 14: 1, 15: 1, 28: 1}
OK	55-18-5	CCN(CC)N=O	{1: 2, 2: 2, 34: 1, 29: 1, 33: 1}
OK	55-65-2	C1CCCN(CCC1)CCN=C(N)N	{33: 1, 2: 2, 7: 1, 11: 7, 34: 1, 30: 2}
OK	55-86-7	CN(CCCl)CCCl.Cl	{1: 1, 2: 4, 33: 1, 17: 3}
OK	550-24-3	CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)O)O	{1: 1, 2: 10, 14: 1, 15: 3, 20: 2, 25: 2}
OK	550-43-6	C=CC[C@H]1[C@H]2C[C@H](CN1)[C@H]3CCCC(=O)N3C2	{32: 1, 33: 1, 2: 1, 5: 1, 6: 1, 11: 6, 12: 4, 25: 1}
OK	550-90-3	C1CCN2C[C@@H]3C[C@H]([C@@H]2C1)CN4[C@@H]3CCCC4=O	{25: 1, 11: 10, 12: 4, 33: 2}
OK	5500-21-0	C1CC1C#N	{11: 2, 12: 1, 37: 1}
OK	55000-52-7	CCCCCCC(C)CCCC(C)CCCC(C)C	{1: 5, 2: 11, 3: 3}
OK	5502-88-5	CC1=CCC(CC1)C(C)C	{1: 3, 3: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	55028-70-1	CCCCC[C@](C)(C=C[C@H]1[C@@H](CC(=O)[C@@H]1CC=CCCCC(=O)O)O)O	{1: 2, 2: 8, 4: 1, 6: 4, 11: 1, 12: 3, 20: 2, 25: 1, 27: 1}
OK	5503-12-8	CC(=C)[C@@H]1CCC(=CC1)C=O	{1: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	55030-20-1	CCCCCC(C1CCCCC1)C2CCCCC2	{11: 10, 1: 1, 2: 4, 3: 1, 12: 2}
OK	55030-21-2	CCCC(CC1CCCCC1)CC2CCCCC2	{11: 10, 1: 1, 2: 4, 3: 1, 12: 2}
OK	55030-62-1	CCCCCC(C)CCCC(C)CCC	{1: 4, 2: 9, 3: 2}
OK	55044-10-5	CCCCCCCCCCCCCC(CCC)CCC	{1: 3, 2: 16, 3: 1}
OK	55045-09-5	CCCCCCC(CCC)CCCCCC	{1: 3, 2: 12, 3: 1}
OK	55045-11-9	CCCCCCCCC(CCC)CCCC	{1: 3, 2: 12, 3: 1}
OK	55045-14-2	CCCCCCCCCCC(CC)CCC	{1: 3, 2: 12, 3: 1}
OK	5505-63-5	C([C@H]([C@H]([C@@H]([C@@H](C=O)N)O)O)O)O.Cl	{2: 1, 3: 4, 17: 1, 20: 4, 26: 1, 30: 1}
OK	5505-84-0	CC1CCC(CC1)C(C)(C)CC(=O)C	{1: 4, 2: 1, 4: 1, 11: 4, 12: 2, 24: 1}
OK	55058-68-9	C1=CC2C(=O)C(=O)C1O2	{25: 2, 12: 2, 14: 2, 23: 1}
OK	55066-43-8	CC(=CCCC(=CCOC(=O)C=C(C)C)C)C	{1: 5, 2: 3, 28: 1, 6: 3, 7: 3}
OK	55066-53-0	CCCCCC[C@H](CC=CCCCCCCCC(=O)OCC)O	{1: 2, 2: 14, 3: 1, 6: 2, 20: 1, 28: 1}
OK	55075-35-9	CC#N.CC#N.C1COCCOCCOCCOCCOCCO1	{1: 2, 11: 12, 37: 2, 23: 6}
OK	55088-65-8	CCOC(=O)C=C.CC(=C)C(=O)O.CC(=C)C(=O)OCC=C	{1: 3, 2: 2, 5: 4, 6: 2, 7: 2, 27: 1, 28: 2}
OK	55090-44-3	CCCCCCCCCCCCN(C)N=O	{1: 2, 2: 11, 34: 1, 29: 1, 33: 1}
OK	551-11-1	CCCCC[C@@H](C=C[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)O)O)O)O	{1: 1, 2: 8, 3: 1, 6: 4, 11: 1, 12: 4, 20: 3, 27: 1}
OK	551-16-6	CC1(C(N2C(S1)C(C2=O)N)C(=O)O)C	{1: 2, 33: 1, 41: 1, 12: 3, 13: 1, 25: 1, 27: 1, 30: 1}
OK	551-58-6	C[C@H]([C@@](C(C)C)(C(=O)OCC1=CCN2[C@H]1CCC2)O)O	{1: 3, 2: 1, 3: 2, 4: 1, 33: 1, 11: 4, 12: 1, 14: 1, 15: 1, 20: 2, 28: 1}
OK	551-74-6	C(CCl)NC[C@H]([C@H]([C@@H]([C@@H](CNCCCl)O)O)O)O.Cl.Cl	{17: 4, 2: 6, 3: 4, 20: 4, 31: 2}
OK	551-84-8	C([C@H]([C@@H](C(=O)CO)O)O)O	{24: 1, 2: 2, 3: 2, 20: 4}
OK	551-88-2	CCC(CC)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 38: 1}
OK	55100-40-8	CN1CC2CCC1CC2	{1: 1, 11: 5, 12: 2, 33: 1}
OK	55102-43-7	CC(=O)O[C@@H]1COC([C@@H]([C@@H]1OC(=O)C)OC(=O)C)NC(=O)N(CCCl)N=O	{1: 3, 2: 2, 33: 1, 11: 1, 12: 4, 34: 1, 17: 1, 23: 1, 24: 1, 28: 3, 29: 1, 31: 1}
OK	55107-14-7	CC(C)(C)C(=O)CC(=O)OC	{24: 1, 1: 4, 2: 1, 4: 1, 28: 1}
OK	5511-18-2	C1C2CC3CC1CC(C2)(C3)C(=O)N	{24: 1, 11: 6, 12: 3, 13: 1, 30: 1}
OK	5511-98-8	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5C[C@H]([C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)O)C)C)C)OC(=O)C)O	{1: 6, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 5, 22: 3, 23: 3, 28: 2}
OK	55112-89-5	CCCCN(CCCl)CCCl.Cl	{1: 1, 2: 7, 33: 1, 17: 3}
OK	55124-79-3	CCCCCCCCC(CCCCCC)CCCCCCCC	{1: 3, 2: 19, 3: 1}
OK	55124-80-6	CCCCCC(C)CCCC(C)CCCC(C)CCCC(C)C	{1: 6, 2: 13, 3: 4}
OK	55130-39-7	CCOC=C(C(=O)C(=O)OCC)C(=O)OCC	{1: 3, 2: 3, 6: 1, 7: 1, 22: 1, 24: 1, 28: 2}
OK	55134-13-9	CC[C@H]([C@H]1[C@H](C[C@@H]([C@@H](O1)[C@@H](C)[C@@H]([C@H](C)C(=O)[C@H](CC)[C@@H]2[C@H](C[C@H]([C@]3(O2)C=C[C@H]([C@@]4(O3)CC[C@@](O4)(C)[C@H]5CC[C@@]([C@@H](O5)C)(CC)O)O)C)C)O)C)C)C(=O)O	{1: 11, 2: 3, 3: 5, 11: 6, 12: 10, 13: 4, 14: 2, 20: 3, 23: 5, 24: 1, 27: 1}
OK	55136-52-2	CCC#CC=O	{1: 1, 2: 1, 26: 1, 10: 2}
OK	55145-28-3	CCCC(C)(C=C)O	{1: 2, 2: 2, 4: 1, 5: 1, 6: 1, 20: 1}
OK	5515-83-3	CCN(CC)CCC(=O)OCC	{1: 3, 2: 5, 28: 1, 33: 1}
OK	55154-18-2	C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F	{16: 41, 3: 1, 4: 19, 22: 6}
OK	5518-19-4	CCCCCCCC(=O)NCCCCNC(=O)CCCCCCC	{24: 2, 1: 2, 2: 16, 31: 2}
OK	55182-74-6	CCCCCCCCCCC#CCCO	{1: 1, 2: 11, 20: 1, 10: 2}
OK	5519-50-6	CN1CCCC(=O)C1	{1: 1, 11: 4, 33: 1, 25: 1}
OK	55194-05-3	CCCCCCCCCCCC(=O)OC(C)CCCC	{1: 3, 2: 13, 3: 1, 28: 1}
OK	55194-65-5	CCCCCCCCCCCCCCCCCC(=O)OC(C)CCCCCCCC	{1: 3, 2: 23, 3: 1, 28: 1}
OK	55195-24-9	CCCCCCCCCC(=O)OC(C)CC	{1: 3, 2: 9, 3: 1, 28: 1}
OK	552-02-3	C[C@@H]1CC[C@H]2[C@@H]1C3[C@H](C3(C)C)CC[C@]2(C)O	{1: 4, 11: 4, 12: 5, 13: 2, 20: 1}
OK	552-70-5	CN1C2CCCC1CC(=O)C2	{1: 1, 11: 5, 12: 2, 33: 1, 25: 1}
OK	55204-44-9	CC(C)(/N=N/C(C)(C)OC)OC	{1: 6, 34: 2, 4: 2, 22: 2}
OK	55204-46-1	CC1(CC(N=N1)(C)Cl)C	{1: 3, 11: 1, 13: 2, 35: 2, 17: 1}
OK	55204-47-2	CC(=C1C(N=NC1(C)C)(C)C)C	{1: 6, 15: 1, 13: 2, 35: 2, 7: 1}
OK	55217-61-3	C1C[C@H]([C@@H]1CS)N.Cl	{2: 1, 39: 1, 11: 2, 12: 2, 17: 1, 30: 1}
OK	55230-25-6	CC1C=CCCO1	{1: 1, 11: 2, 12: 1, 14: 2, 23: 1}
OK	55231-26-0	C1CCC(=O)OCC1.C(CCC(=O)O)CC(=O)O.C(COCCO)O	{2: 8, 11: 5, 20: 2, 22: 1, 27: 2, 28: 1}
OK	5524-05-0	C[C@@H]1CC[C@H](CC1=O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 2, 25: 1}
OK	55250-78-7	CC1(C(=O)N(C(=O)N1CCOC(=O)CCS)CCOC(=O)CCS)C	{1: 2, 2: 8, 33: 2, 39: 2, 13: 1, 25: 2, 28: 2}
OK	55255-74-8	CCCCCCCCCCCCCC(CC1CCCCC1)CC2CCCCC2	{11: 10, 1: 1, 2: 14, 3: 1, 12: 2}
OK	55256-07-0	CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC	{1: 3, 2: 46, 3: 1}
OK	55257-88-0	CCCCCCCCCCN1CCCC1=O	{1: 1, 2: 9, 11: 3, 33: 1, 25: 1}
OK	55281-91-9	C1CCC(CC1)C(CCCCC(C2CCCCC2)C3CCCCC3)C4CCCCC4	{11: 20, 2: 4, 3: 2, 12: 4}
OK	55282-10-5	CCCCCCCCCCC(CCCCCCCCCC)CC(C)(C)C	{1: 5, 2: 19, 3: 1, 4: 1}
OK	55282-12-7	CCCCCCCCCCCCCC(CC(CC)CC)CC(CC)CC	{1: 5, 2: 18, 3: 3}
OK	55282-13-8	CCCCC(CCCC)CCCCCCCCC(CCCC)CCCC	{1: 4, 2: 20, 3: 2}
OK	55282-14-9	CCCCCCCCCCCCCC(CCCC)CCCCCCCC	{1: 3, 2: 22, 3: 1}
OK	55282-15-0	CCCCCCCCCCCCCCCC(CCCC)CCCCCC	{1: 3, 2: 22, 3: 1}
OK	55282-16-1	CCCCCCCCCCCCCCCCCC(CCCC)CCCC	{1: 3, 2: 22, 3: 1}
OK	55282-17-2	CCCCCCCCCCCCCCCCCCCCCC(CC)CC	{1: 3, 2: 22, 3: 1}
OK	55282-27-4	CCCCCCCCCC(CC)(CCCCCCC)CCCCCCCC	{1: 4, 2: 22, 4: 1}
OK	55282-29-6	CCCCCCCCC(CCCCC)(CCCCCC)CCCCCCC	{1: 4, 2: 22, 4: 1}
OK	55289-53-7	CC(CO)CO.CC(=O)O.CC(=O)O	{27: 2, 1: 3, 2: 2, 3: 1, 20: 2}
OK	55297-95-5	CCN(CC)CCSCC(=O)O[C@@H]1C[C@@]([C@H]([C@@H](C23CC[C@H](C1([C@@H]2C(=O)CC3)C)C)C)O)(C)C=C	{1: 6, 2: 5, 5: 1, 6: 1, 33: 1, 40: 1, 11: 5, 12: 5, 13: 3, 20: 1, 25: 1, 28: 1}
OK	55297-96-6	CCN(CC)CCSCC(=O)O[C@@H]1C[C@@]([C@H]([C@@H](C23CC[C@H](C1([C@H]2C(=O)CC3)C)C)C)O)(C)C=C.C(=C/C(=O)O)\C(=O)O	{1: 6, 2: 5, 5: 1, 6: 3, 33: 1, 40: 1, 11: 5, 12: 5, 13: 3, 20: 1, 25: 1, 27: 2, 28: 1}
OK	553-75-3	CCC[C@H]1CCCCN1C	{1: 2, 2: 2, 11: 4, 12: 1, 33: 1}
OK	553-90-2	COC(=O)C(=O)OC	{1: 2, 28: 2}
OK	553-97-9	CC1=CC(=O)C=CC1=O	{1: 1, 25: 2, 14: 3, 15: 1}
OK	5530-96-1	C1C2C=CC1C3C2C=CC3=O	{25: 1, 11: 1, 12: 4, 14: 4}
OK	55305-37-8	CCCCC=CCCCCCCOC1CCCCO1	{1: 1, 2: 9, 6: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	5531-30-6	CC(C)(CC1CCCCC1)O	{1: 2, 2: 1, 4: 1, 11: 5, 12: 1, 20: 1}
OK	5531-31-7	CC(C)(CC1CCCCC1)N	{1: 2, 2: 1, 4: 1, 11: 5, 12: 1, 30: 1}
OK	55314-57-3	CCC#CC(=O)OCC	{1: 2, 2: 2, 28: 1, 10: 2}
OK	55319-83-0	CCCCCCCCCCCCCC(CCCCCCCC)CCCCCCCC	{1: 3, 2: 26, 3: 1}
OK	5532-23-0	C[C@H]1[C@@]2(O1)CC(=C)[C@@](C(=O)OCC3=CCN4[C@H]3[C@@H](CC4)OC2=O)(C)O	{1: 2, 5: 1, 33: 1, 11: 5, 12: 3, 13: 2, 14: 1, 15: 2, 20: 1, 23: 1, 28: 2}
OK	55320-06-4	CCCCCCCCCCC(CCCCCCCCCC)CCCCCCCCCC	{1: 3, 2: 27, 3: 1}
OK	55320-40-6	C1CC2C=CC1CC2O	{20: 1, 11: 3, 12: 3, 14: 2}
OK	55332-01-9	CC1CC2CCCCC2CC1=O	{1: 1, 11: 6, 12: 3, 25: 1}
OK	55333-99-8	CCCCCCCCCCCCCC(CCCCCC)CCCCCC	{1: 3, 2: 22, 3: 1}
OK	55334-09-3	CCCCCCCCCCCC(C1CCC(CC1)C)C2CCC(CC2)C	{11: 8, 1: 3, 2: 10, 3: 1, 12: 4}
OK	55334-11-7	CCCCCCCCCCCCCCCCC1CCCC1C2CCCC2	{1: 1, 2: 15, 11: 7, 12: 3}
OK	55334-20-8	CCCCCCCCCCC1CCC(CC1)CCCCCCCCCC	{1: 2, 2: 18, 11: 4, 12: 2}
OK	55334-42-4	CCCCCCCCCCC(CBr)Br	{1: 1, 2: 10, 3: 1, 18: 2}
OK	5534-09-8	CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)Cl)O)C)C)OC(=O)CC	{1: 5, 2: 3, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 17: 1, 20: 1, 24: 1, 25: 1, 28: 2}
OK	55349-70-7	CCCCCCCCCCCCCCCCCC(=O)N(CCO)CCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 36, 33: 1, 20: 1, 24: 1, 28: 1}
OK	55360-11-7	CC(C(=O)OCC=C)Cl	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 17: 1, 28: 1}
OK	55362-80-6	C(CCCCO)CCCCBr	{2: 9, 20: 1, 18: 1}
OK	55370-32-6	CCOC(=C)C(=C)OCC	{1: 2, 2: 2, 5: 2, 22: 2, 7: 2}
OK	55373-76-7	C#CC1(CCCCCCC1)O	{9: 1, 10: 1, 11: 7, 20: 1, 13: 1}
OK	55373-86-9	CCCCCCCCCCCCCCCC(CCCCCC)CCCCCC	{1: 3, 2: 24, 3: 1}
OK	55373-89-2	CCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 23, 28: 1}
OK	55380-34-2	CC1CN(CC(N1N=O)C)N=O	{1: 2, 34: 2, 33: 2, 11: 2, 12: 2, 29: 2}
OK	55391-34-9	CNC(=O)O/N=C/1\CSCCS1	{1: 1, 34: 1, 41: 2, 11: 3, 15: 1, 28: 1, 31: 1}
OK	55398-96-4	C1CCCCCC(=O)NCCCCC1.C1CCC(=O)NCC1.C(CCCCC(=O)O)CCCC(=O)O.C(CCCN)CCN.C(CCC(=O)O)CC(=O)O	{32: 2, 2: 18, 11: 16, 25: 2, 27: 4, 30: 2}
OK	55399-28-5	C[C@@H]1[C@H](CC[C@]2(C1CC=C3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4[C@H](C)CCC(=C)C(C)C)C)C)OC(=O)C	{1: 7, 2: 2, 3: 2, 5: 1, 7: 1, 11: 7, 12: 6, 13: 2, 14: 1, 15: 1, 28: 1}
OK	554-10-9	C(C(CI)O)O	{19: 1, 2: 2, 3: 1, 20: 2}
OK	554-12-1	CCC(=O)OC	{1: 2, 2: 1, 28: 1}
OK	554-15-4	CN1CC=CC1	{1: 1, 11: 2, 14: 2, 33: 1}
OK	554-21-2	C1(C(=O)OC(O1)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	{12: 2, 23: 1, 4: 2, 28: 1, 17: 6}
OK	554-35-8	CC(C)(C#N)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O	{1: 2, 2: 1, 4: 1, 37: 1, 12: 5, 20: 4, 22: 1, 23: 1}
OK	554-59-6	CC1CCC2C(C1)C2(C)C	{1: 3, 11: 3, 12: 3, 13: 1}
OK	554-68-7	CCN(CC)CC.Cl	{1: 3, 2: 3, 33: 1, 17: 1}
OK	554-91-6	C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O)O)O)O)O)O)O)O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
OK	55401-55-3	CCCCCCCCCCCC(CCCCCCCCCC)CCCCCCCCCC	{1: 3, 2: 28, 3: 1}
OK	55401-64-4	CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)C)OC(=O)C	{1: 3, 2: 16, 3: 1, 28: 3, 6: 2}
OK	55401-76-8	CCCCCCCCCCCCCCCC(C1CCCC1)C2CCCC2	{11: 8, 1: 1, 2: 14, 3: 1, 12: 2}
OK	55402-15-8	CCCCC#CC(C)C	{1: 3, 2: 3, 3: 1, 10: 2}
OK	55429-35-1	C1CCC(C1)CCCC(CCCC2CCCC2)CCCC3CCCC3	{11: 12, 2: 9, 3: 1, 12: 3}
OK	55429-83-9	CCCCCCCCCCCCCCCCCC(CCCCCCCC)CCCCCCCC	{1: 3, 2: 30, 3: 1}
OK	55444-65-0	CCC=CCC(OC)OC	{1: 3, 2: 2, 3: 1, 22: 2, 6: 2}
OK	55444-67-2	COC(CCCBr)(OC)OC	{1: 3, 2: 3, 4: 1, 18: 1, 22: 3}
OK	55446-21-4	CC(C)(C)CC(C)(C)OOC(=O)C1CCCCC1	{1: 5, 2: 1, 4: 2, 11: 5, 12: 1, 22: 1, 28: 1}
OK	55470-98-9	CCCCCCCCCCC(CCCCCCC)(CCCCCCCC)CCCCCCCCC	{1: 4, 2: 30, 4: 1}
OK	55482-22-9	C1(=NO)C(=O)NC(=NC1=O)N	{32: 1, 34: 1, 35: 1, 15: 2, 20: 1, 25: 2, 30: 1}
OK	5549-09-7	C1CC2CC=CC2C1	{11: 4, 12: 2, 14: 2}
OK	55497-53-5	CC=CC=C1C(=CCCC1(C)C)C	{1: 4, 6: 3, 11: 2, 13: 1, 14: 1, 15: 2}
OK	55499-04-2	CCCCCCC(C)C(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	555-10-2	CC(C)C1CCC(=C)C=C1	{1: 2, 3: 1, 5: 1, 11: 2, 12: 1, 14: 2, 15: 1}
OK	555-43-1	CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC	{1: 3, 2: 50, 3: 1, 28: 3}
OK	555-44-2	CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC	{1: 3, 2: 44, 3: 1, 28: 3}
OK	555-45-3	CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC	{1: 3, 2: 38, 3: 1, 28: 3}
OK	555-77-1	C(CCl)N(CCCl)CCCl	{17: 3, 2: 6, 33: 1}
OK	55505-23-2	CC(C)C(C)(C)CO	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1}
OK	55505-24-3	CC(C)CC(CO)C(C)C	{1: 4, 2: 2, 3: 3, 20: 1}
OK	55505-26-5	CC(C)CCCCCCCO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	55505-28-7	CC(C)CCCCCCCCO	{1: 2, 2: 8, 3: 1, 20: 1}
OK	55510-03-7	C12C(N(C(=O)N1[N+](=O)[O-])[N+](=O)[O-])N(C(=O)N2[N+](=O)[O-])[N+](=O)[O-]	{25: 2, 12: 2, 38: 4, 33: 4}
OK	55512-40-8	CCCCCCCCCCCCSC(=O)Cl	{24: 1, 1: 1, 2: 11, 40: 1, 17: 1}
OK	55517-73-2	CCCCCCCCCCCCCC(CCCCCCCCCCCC)CCCCCCCCCCCC	{1: 3, 2: 34, 3: 1}
OK	55517-75-4	CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C1CCCCC1	{11: 5, 1: 2, 2: 30, 3: 1, 12: 1}
OK	55517-89-0	CCCCCCCCCCCCC(CCCCCCCCCCC)CCCCCCCCCCCC	{1: 3, 2: 32, 3: 1}
OK	5552-30-7	CC1=CC=C2C(CCCC2(O1)C)(C)C	{1: 4, 11: 3, 13: 2, 14: 2, 15: 2, 23: 1}
OK	55521-27-2	CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C1CCCCC1	{11: 5, 1: 2, 2: 26, 3: 1, 12: 1}
OK	55525-54-7	CC1(CC(CC(C1)(C)CNC(=O)NCC2(CC(CC(C2)(C)C)N=C=O)C)N=C=O)C	{1: 6, 2: 2, 34: 2, 8: 2, 11: 6, 12: 2, 13: 4, 24: 1, 29: 2, 31: 2}
OK	55528-90-0	CC(C)[C@H]1CC[C@]2(CCCC(=O)[C@]2(C1)C)C	{1: 4, 3: 1, 11: 6, 12: 1, 13: 2, 25: 1}
OK	55538-59-5	CC(C)(C)C1CCC(C(C1)C2CCCCC2)O	{1: 3, 11: 8, 4: 1, 12: 4, 20: 1}
OK	55541-30-5	CCC(=O)OCC(=O)[C@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)OC(=O)CC	{1: 5, 2: 3, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 1, 24: 1, 25: 1, 28: 2}
OK	55546-11-7	CC1CCOC(O1)C=C(C)C	{1: 3, 6: 1, 7: 1, 11: 2, 12: 2, 23: 2}
OK	55554-08-0	CCCCCCCCCCC(C)C(=O)OC	{1: 3, 2: 9, 3: 1, 28: 1}
OK	55554-09-1	CCCCCCCCCCCCC(C)C(=O)OC	{1: 3, 2: 11, 3: 1, 28: 1}
OK	55556-85-9	C1CC(CN(C1)N=O)O	{33: 1, 34: 1, 11: 4, 12: 1, 20: 1, 29: 1}
OK	55556-86-0	CC1CCC(N1N=O)C	{1: 2, 34: 1, 33: 1, 11: 2, 12: 2, 29: 1}
OK	55556-88-2	CC1CN(C(CN1N=O)C)N=O	{1: 2, 34: 2, 33: 2, 11: 2, 12: 2, 29: 2}
OK	55556-91-7	C1CN(CCC1=O)N=O	{25: 1, 34: 1, 11: 4, 29: 1, 33: 1}
OK	55556-92-8	C1CN(CC=C1)N=O	{33: 1, 34: 1, 11: 3, 29: 1, 14: 2}
OK	55556-93-9	C1CN(CCC1O)N=O	{33: 1, 34: 1, 11: 4, 12: 1, 20: 1, 29: 1}
OK	55556-94-0	CC1CN(CCN1N=O)N=O	{1: 1, 34: 2, 33: 2, 11: 3, 12: 1, 29: 2}
OK	55557-00-1	C1CN(CCN(C1)N=O)N=O	{33: 2, 34: 2, 11: 5, 29: 2}
OK	55557-02-3	COC(=O)C1=CCCN(C1)N=O	{1: 1, 34: 1, 33: 1, 11: 3, 14: 1, 15: 1, 28: 1, 29: 1}
OK	5557-31-3	CCCCCCCC/C=C/CCCCCCCC	{1: 2, 2: 14, 6: 2}
OK	5557-88-0	C#CC=CCO	{9: 1, 2: 1, 20: 1, 10: 1, 6: 2}
OK	5557-98-2	CC(C)CCC=C(C)C	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1}
OK	55576-87-9	CCN(CC)CC.C=CC(=O)O	{1: 3, 2: 3, 5: 1, 6: 1, 33: 1, 27: 1}
OK	55590-24-4	C1CC2C=CC1N2	{32: 1, 11: 2, 12: 2, 14: 2}
OK	55590-83-5	CCCCC(=O)OCC(C)CC	{1: 3, 2: 5, 3: 1, 28: 1}
OK	556-22-9	CCCCCCCCCCCCCCCCCC1=NCCN1.CC(=O)O	{32: 1, 1: 2, 2: 16, 35: 1, 11: 2, 15: 1, 27: 1}
OK	556-24-1	CC(C)CC(=O)OC	{1: 3, 2: 1, 3: 1, 28: 1}
OK	556-33-2	C(C(=O)NCC(=O)NCC(=O)O)N	{24: 2, 2: 3, 27: 1, 30: 1, 31: 2}
OK	556-48-9	C1CC(CCC1O)O	{20: 2, 11: 4, 12: 2}
OK	556-50-3	C(C(=O)NCC(=O)O)N	{24: 1, 2: 2, 27: 1, 30: 1, 31: 1}
OK	556-52-5	C1C(O1)CO	{20: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	556-53-6	CCCN.Cl	{1: 1, 2: 2, 30: 1, 17: 1}
OK	556-56-9	C=CCI	{2: 1, 19: 1, 5: 1, 6: 1}
OK	556-64-9	CSC#N	{40: 1, 1: 1, 37: 1}
OK	556-72-9	CC1=NC(NC(C1)(C)C)(C)C	{32: 1, 1: 5, 35: 1, 11: 1, 13: 2, 15: 1}
OK	556-82-1	CC(=CCO)C	{1: 2, 2: 1, 20: 1, 6: 1, 7: 1}
OK	556-88-7	C(=N[N+](=O)[O-])(N)N	{34: 1, 38: 1, 30: 2, 7: 1}
OK	556-89-8	C(=O)(N)N[N+](=O)[O-]	{24: 1, 38: 1, 30: 1, 31: 1}
OK	556-90-1	C1C(=O)N=C(S1)N	{35: 1, 41: 1, 11: 1, 15: 1, 25: 1, 30: 1}
OK	556-99-0	C(=O)(N)NC(=O)NC(=O)N	{24: 3, 30: 2, 31: 2}
OK	55611-39-7	C=CCNC1CCCC1	{2: 1, 5: 1, 6: 1, 11: 4, 12: 1, 31: 1}
OK	55621-29-9	CCCCN(CC(CC)O)N=O	{1: 2, 2: 5, 3: 1, 33: 1, 34: 1, 20: 1, 29: 1}
OK	55634-91-8	CCCC(=C1C(=O)CC(C(C1=O)C(=O)OC)(C)C)NOCC=C	{1: 4, 2: 3, 5: 1, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1, 15: 1, 22: 1, 25: 2, 28: 1, 31: 1}
OK	55649-53-1	C/C=C(\C)/C(=O)NCC(=O)OC	{1: 3, 2: 1, 6: 1, 7: 1, 24: 1, 28: 1, 31: 1}
OK	55649-71-3	CC=C(C(=O)O)NC(=O)C	{1: 2, 6: 1, 7: 1, 24: 1, 27: 1, 31: 1}
OK	55658-55-4	CC1=CCC(CC1=NO)C(=C)C	{1: 2, 34: 1, 5: 1, 7: 1, 11: 2, 12: 1, 14: 1, 15: 2, 20: 1}
OK	5566-34-7	C1C2C(CC1(Cl)Cl)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{17: 8, 11: 2, 12: 2, 13: 4, 15: 2}
OK	55665-79-7	CC/C(=C/CC(=O)O)/C	{1: 2, 2: 2, 27: 1, 6: 1, 7: 1}
OK	55667-40-8	CC1([C@H]([C@H]1C(=O)O)C=C(Cl)Cl)C	{1: 2, 6: 1, 7: 1, 12: 2, 13: 1, 17: 2, 27: 1}
OK	55667-43-1	CC(=CC=C(Cl)Cl)C	{1: 2, 17: 2, 6: 2, 7: 2}
OK	55679-31-7	C1CC2CCC(C1)C2=O	{25: 1, 11: 5, 12: 2}
OK	55682-88-7	CCC=CCC=CCC=CCCCCCCCCCC(=O)OC	{1: 2, 2: 12, 28: 1, 6: 6}
OK	55682-89-8	C1CCC(CC1)CCC(C2CCCCC2)C3CCCCC3	{11: 15, 2: 2, 3: 1, 12: 3}
OK	55682-92-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 26, 28: 1}
OK	55683-21-1	CC1C(C(=O)C=C1C)C	{1: 3, 12: 2, 25: 1, 14: 1, 15: 1}
OK	55685-40-0	CC(C)CC(C)(C#N)N=NC(C)(CC(C)(C)OC)C#N	{1: 7, 2: 2, 3: 1, 4: 3, 37: 2, 34: 2, 22: 1}
OK	55685-41-1	CC(CCC=C(C)CO)C=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	557-00-6	CCCOC(=O)CC(C)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	557-01-7	C1=CNC(=O)N=C1	{32: 1, 25: 1, 35: 1, 14: 3}
OK	557-11-9	C=CCNC(=O)N	{2: 1, 5: 1, 6: 1, 24: 1, 30: 1, 31: 1}
OK	557-17-5	CCCOC	{1: 2, 2: 2, 22: 1}
OK	557-22-2	C1CSSC1	{41: 2, 11: 3}
OK	557-24-4	C(=CC(=O)O)C(=O)N	{24: 1, 27: 1, 30: 1, 6: 2}
OK	557-25-5	CCCC(=O)OCC(CO)O	{1: 1, 2: 4, 3: 1, 20: 2, 28: 1}
OK	557-30-2	C(=CN=O)NO	{34: 1, 20: 1, 29: 1, 6: 2, 31: 1}
OK	557-31-3	CCOCC=C	{1: 1, 2: 2, 22: 1, 5: 1, 6: 1}
OK	557-35-7	CCCCCCC(C)Br	{1: 2, 2: 5, 3: 1, 18: 1}
OK	557-36-8	CCCCCCC(C)I	{19: 1, 1: 2, 2: 5, 3: 1}
OK	557-40-4	C=CCOCC=C	{2: 2, 22: 1, 5: 2, 6: 2}
OK	557-48-2	CC/C=C\CC/C=C/C=O	{1: 1, 2: 3, 26: 1, 6: 4}
OK	557-59-5	CCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 22, 27: 1}
OK	557-61-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 27, 20: 1}
OK	557-66-4	CCN.Cl	{1: 1, 2: 1, 30: 1, 17: 1}
OK	557-68-6	C(Br)I	{2: 1, 19: 1, 18: 1}
OK	557-91-5	CC(Br)Br	{1: 1, 18: 2, 3: 1}
OK	557-93-7	CC(=C)Br	{1: 1, 18: 1, 5: 1, 7: 1}
OK	557-95-9	C(Br)(I)I	{19: 2, 18: 1, 3: 1}
OK	557-98-2	CC(=C)Cl	{1: 1, 17: 1, 5: 1, 7: 1}
OK	557-99-3	CC(=O)F	{16: 1, 1: 1, 24: 1}
OK	5570-77-4	CN1CCC(CC1)Cl	{1: 1, 11: 4, 12: 1, 33: 1, 17: 1}
OK	55701-05-8	CC1(C(C1C(=O)O)C=C(Cl)Cl)C	{1: 2, 6: 1, 7: 1, 12: 2, 13: 1, 17: 2, 27: 1}
OK	55704-78-4	CC1(CSC(CS1)(C)O)O	{1: 2, 11: 2, 20: 2, 13: 2, 41: 2}
OK	55716-11-5	C1(C(OC(C(N1C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 33: 1, 4: 2, 13: 4, 23: 1}
OK	55721-11-4	C[C@H](CC[C@H](C(C)(C)O)O)[C@H]1CC[C@@H]2[C@@]1(CCCC2=CC=C3C[C@H](CCC3=C)O)C	{1: 4, 2: 2, 3: 2, 4: 1, 5: 1, 6: 2, 11: 8, 12: 3, 13: 1, 15: 3, 20: 3}
OK	55728-11-5	CCCCCCCCCC(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)OC	{1: 5, 2: 8, 3: 3, 24: 3, 28: 1, 31: 3}
OK	55728-12-6	CCCCCCCCCC(=O)NC(C)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)OC	{1: 6, 2: 9, 3: 4, 24: 3, 28: 1, 31: 3}
OK	55728-13-7	CC(C)C(C(=O)NC(C)C(=O)OC)NC(=O)C	{24: 2, 1: 5, 3: 3, 28: 1, 31: 2}
OK	55728-14-8	CCCCCCCCCC(=O)NC(CC(C)C)C(=O)NCC(=O)OC	{1: 4, 2: 10, 3: 2, 24: 2, 28: 1, 31: 2}
OK	55728-15-9	CCCCCCCCCC(=O)NC(C)C(=O)NC(CO)C(=O)OC	{1: 3, 2: 9, 3: 2, 20: 1, 24: 2, 28: 1, 31: 2}
OK	55728-16-0	CCCCCCCCCC(=O)NC(CCC(=O)OC)C(=O)NC(C)C(=O)OC	{1: 4, 2: 10, 3: 2, 24: 2, 28: 2, 31: 2}
OK	55730-88-6	CC1=CCC(C1(C)C)CC=CC(=O)C	{1: 4, 2: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	55730-89-7	CC1=CCC(C1(C)C)C=CCC(=O)C	{1: 4, 2: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	55738-53-9	CC(C)CCCCCCCCCCCCCCC(=O)O.CC(CN)O	{1: 3, 2: 15, 3: 2, 20: 1, 27: 1, 30: 1}
OK	55757-34-1	CCCCCCCCC(F)(F)F	{16: 3, 1: 1, 2: 7, 4: 1}
OK	55757-46-5	CC(C)(C)OC(=O)N[C@@H](CS)C(=O)OC	{1: 4, 2: 1, 3: 1, 4: 1, 39: 1, 28: 2, 31: 1}
OK	55764-18-6	C1CC2C(C1)C3CC2CC(=O)O3	{28: 1, 11: 5, 12: 4}
OK	55764-37-9	CCC=C(C)C(=O)Cl	{1: 2, 2: 1, 6: 1, 7: 1, 17: 1, 24: 1}
OK	5577-48-0	CCCCC(=NO)C	{1: 2, 2: 3, 20: 1, 34: 1, 7: 1}
OK	55775-41-2	CC(C(C=O)Cl)Cl	{1: 1, 26: 1, 3: 2, 17: 2}
OK	55779-06-1	CC(C1CCC(C(O1)OC2C(C(C(C(C2O)N(C)C(=O)CN)OC)O)N)N)N	{1: 3, 2: 1, 3: 1, 33: 1, 11: 2, 12: 9, 20: 2, 22: 2, 23: 1, 24: 1, 30: 4}
OK	5579-73-7	CCCCC(=O)C(=O)CCCC	{24: 2, 1: 2, 2: 6}
OK	5579-78-2	CCCCC1CCCCC(=O)O1	{1: 1, 2: 3, 11: 4, 12: 1, 28: 1}
OK	55790-53-9	CC(=O)C1CCC(=C)C2CC(C2CCC1=C)(C)C	{1: 3, 5: 2, 11: 5, 12: 3, 13: 1, 15: 2, 24: 1}
OK	55790-78-8	CC1(C(=C)C(N=N1)(C)C)C	{1: 4, 15: 1, 5: 1, 35: 2, 13: 2}
OK	55794-45-1	C1CCC(=O)CCC(=O)C1	{25: 2, 11: 6}
OK	558-13-4	C(Br)(Br)(Br)Br	{18: 4, 4: 1}
OK	558-16-7	C(Br)(I)(I)I	{18: 1, 19: 3, 4: 1}
OK	558-17-8	CC(C)(C)I	{1: 3, 19: 1, 4: 1}
OK	558-30-5	CC1(CO1)C	{1: 2, 11: 1, 13: 1, 23: 1}
OK	558-37-2	CC(C)(C)C=C	{1: 3, 4: 1, 5: 1, 6: 1}
OK	558-42-9	CC(C)(CCl)O	{1: 2, 2: 1, 4: 1, 20: 1, 17: 1}
OK	558-43-0	CC(C)(CO)O	{1: 2, 2: 1, 4: 1, 20: 2}
OK	558-61-2	C1C(C(C1(F)F)(F)F)Cl	{16: 4, 17: 1, 11: 1, 12: 1, 13: 2}
OK	558-64-5	C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C2(C(C(C(C(C2(F)F)(F)F)(F)F)(F)F)(F)F)F)F	{16: 22, 13: 12}
OK	558-97-4	C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F	{16: 19, 19: 1, 4: 9}
OK	5581-94-2	CC(C)(C)C1CCC(=O)C1	{1: 3, 11: 3, 4: 1, 12: 1, 25: 1}
OK	55816-17-6	CCCCCCC(C(C)CC)O	{1: 3, 2: 6, 3: 2, 20: 1}
OK	55819-53-9	CCCCCCCCCCCCCCCCCC(=O)NCCCN(C)C.CC(C(=O)O)O	{1: 4, 2: 19, 3: 1, 33: 1, 20: 1, 24: 1, 27: 1, 31: 1}
OK	55819-54-0	CCCCCCCCCCCCCCCCCC(=O)NCCCN(CCO)CCO	{1: 1, 2: 23, 33: 1, 20: 2, 24: 1, 31: 1}
OK	5582-82-1	CCCCC(C)(CC)O	{1: 3, 2: 4, 4: 1, 20: 1}
OK	55849-06-4	CC1(CC=CCC(S1)(C)C)C	{1: 4, 11: 2, 13: 2, 14: 2, 41: 1}
OK	5585-39-7	CC(=CCCC(=CC#N)C)C	{1: 3, 2: 2, 37: 1, 6: 2, 7: 2}
OK	55852-14-7	CCCCCCCCCCCCCCCCCC(=O)NCCCN1CCOCC1.CC(C(=O)O)O	{1: 2, 2: 19, 3: 1, 33: 1, 11: 4, 20: 1, 23: 1, 24: 1, 27: 1, 31: 1}
OK	55852-15-8	CC(C)CCCCCCCCCCCCCCC(=O)NCCCN(C)C.CC(C(=O)O)O	{1: 5, 2: 17, 3: 2, 33: 1, 20: 1, 24: 1, 27: 1, 31: 1}
OK	5587-63-3	CC1=C(CCC1(C)C)C(=O)O	{27: 1, 1: 3, 11: 2, 13: 1, 15: 2}
OK	55870-64-9	C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@H]2O)O[C@@H]3[C@@H](CC=C(O3)CN)N)N)N)O	{1: 2, 2: 1, 11: 3, 12: 10, 13: 1, 14: 1, 15: 1, 20: 3, 22: 2, 23: 2, 30: 4, 31: 1}
OK	55877-01-5	CCOC(=O)CCC(C)CC(=O)OCC	{1: 3, 2: 5, 3: 1, 28: 2}
OK	5588-20-5	CCCCC(CC)C1C(=O)N(C(=O)N1)SC(Cl)(Cl)Cl	{32: 1, 1: 2, 2: 4, 3: 1, 4: 1, 33: 1, 40: 1, 12: 1, 17: 3, 25: 2}
OK	5588-25-0	C1CCC(CC1)C2(CCCCC2)C(=O)OCCN3CCCCC3.Cl	{33: 1, 2: 2, 11: 15, 12: 1, 13: 1, 17: 1, 28: 1}
OK	55882-21-8	C(CSCCCCl)CCl	{40: 1, 17: 2, 2: 6}
OK	5589-96-8	C(C(=O)O)(Cl)Br	{27: 1, 17: 1, 18: 1, 3: 1}
OK	55894-21-8	COCCN1C(=O)C(C(=O)N(C1=O)CCOC)C=CC=CC=C2C(=O)N(C(=O)N(C2=O)CCOC)CCOC	{1: 4, 2: 8, 6: 5, 33: 4, 12: 1, 15: 1, 22: 4, 25: 6}
OK	55898-33-4	CC[C@H](C1[C@H](C[C@@](O1)(C)[C@]2([C@@H](C[C@](O2)(CC)[C@H](CC)O)C)O)C)C(=O)[C@@H](C)[C@H](C(C)[C@@H]3[C@H](C[C@H]([C@@H](O3)CC(=O)OO)C)C)O	{1: 10, 2: 4, 3: 5, 11: 3, 12: 7, 13: 3, 20: 4, 23: 3, 24: 1, 28: 1}
OK	559-11-5	C=CC(=O)OCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 6, 5: 1, 6: 1, 16: 13, 28: 1}
OK	559-14-8	C(=C(F)F)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	{16: 16, 4: 6, 7: 2}
OK	559-40-0	C1(=C(C(C(C1(F)F)(F)F)(F)F)F)F	{16: 8, 13: 3, 15: 2}
OK	559-70-6	C[C@@]12CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]1CC(CC2)(C)C)C	{1: 8, 11: 10, 12: 4, 13: 6, 14: 1, 15: 1, 20: 1}
OK	55904-98-8	CCCC(C)(OC)OC	{1: 4, 2: 2, 4: 1, 22: 2}
OK	55910-12-8	CC(CNCCCN(C)C)C(=O)NCCCN(C)C	{1: 5, 2: 7, 3: 1, 33: 2, 24: 1, 31: 2}
OK	55911-95-0	CC(CN)N.C(=O)(N)O	{27: 1, 1: 1, 2: 1, 3: 1, 30: 3}
OK	55912-17-9	CC(C)(C)N=NC(C)(CC(C)(C)OC)C#N	{1: 7, 2: 1, 4: 3, 37: 1, 34: 2, 22: 1}
OK	55912-18-0	CC(C)CC(C)(C#N)N=NC(C)(C)C	{1: 6, 2: 1, 3: 1, 4: 2, 37: 1, 34: 2}
OK	55912-19-1	CCC(C)(C)N=NC1(CCCCC1)C#N	{1: 3, 34: 2, 4: 1, 37: 1, 11: 5, 2: 1, 13: 1}
OK	5593-20-4	CCC(=O)OCC(=O)[C@]1([C@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)OC(=O)CC	{1: 5, 2: 3, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 1, 24: 1, 25: 1, 28: 2}
OK	55934-93-5	CCOCCCC(C)OCCOCC(C)CO	{1: 3, 2: 8, 3: 2, 20: 1, 22: 3}
OK	55941-39-4	CC(=O)NC(CCCN(C#N)N=O)C(=O)N	{1: 1, 2: 3, 3: 1, 37: 1, 33: 1, 34: 1, 24: 2, 29: 1, 30: 1, 31: 1}
OK	55944-70-2	C(CCCO)CCCCl	{17: 1, 2: 7, 20: 1}
OK	55944-71-3	C1CCOC(C1)OCCCCCCCCl	{2: 7, 11: 4, 12: 1, 17: 1, 22: 1, 23: 1}
OK	55952-31-3	CNCCOCCOCCNC	{1: 2, 2: 6, 22: 2, 31: 2}
OK	55956-00-8	CCCC(CC)(CC)S	{1: 3, 2: 4, 4: 1, 39: 1}
OK	55956-25-7	CC(COC(C)COCC=C)O	{1: 2, 2: 3, 3: 2, 5: 1, 6: 1, 20: 1, 22: 2}
OK	5597-27-3	C=C1C2CCC(C2)C1=O	{25: 1, 11: 3, 12: 2, 5: 1, 15: 1}
OK	55980-70-6	C1CC2(C=C2)C3(C1)C=C3	{11: 3, 13: 2, 14: 4}
OK	55984-51-5	CC(=O)CN(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 24: 1, 29: 1}
OK	56-03-1	C(=NC(=N)N)(N)N	{34: 1, 36: 1, 30: 3, 7: 2}
OK	56-12-2	C(CC(=O)O)CN	{2: 3, 27: 1, 30: 1}
OK	56-18-8	C(CN)CNCCCN	{2: 6, 30: 2, 31: 1}
OK	56-23-5	C(Cl)(Cl)(Cl)Cl	{17: 4, 4: 1}
OK	56-29-1	CC1(C(=O)NC(=O)N(C1=O)C)C2=CCCCC2	{32: 1, 1: 2, 33: 1, 11: 4, 13: 1, 14: 1, 15: 1, 25: 3}
OK	56-40-6	C(C(=O)O)N	{2: 1, 27: 1, 30: 1}
OK	56-41-7	C[C@@H](C(=O)O)N	{27: 1, 1: 1, 3: 1, 30: 1}
OK	56-45-1	C([C@@H](C(=O)O)N)O	{27: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	56-47-3	CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C	{1: 3, 2: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 24: 1, 25: 1, 28: 1}
OK	56-81-5	C(C(CO)O)O	{2: 2, 3: 1, 20: 3}
OK	56-82-6	C(C(C=O)O)O	{2: 1, 3: 1, 20: 2, 26: 1}
OK	56-84-8	C([C@@H](C(=O)O)N)C(=O)O	{27: 2, 2: 1, 3: 1, 30: 1}
OK	56-85-9	C(CC(=O)N)[C@@H](C(=O)O)N	{24: 1, 27: 1, 2: 2, 3: 1, 30: 2}
OK	56-86-0	C(CC(=O)O)[C@@H](C(=O)O)N	{27: 2, 2: 2, 3: 1, 30: 1}
OK	56-87-1	C(CCN)C[C@@H](C(=O)O)N	{27: 1, 2: 4, 3: 1, 30: 2}
OK	56-97-3	C1=CN(C=CC1=C[NH+]=O)CCCN2C=CC(=C[NH+]=O)C=C2.[Br-].[Br-]	{33: 2, 2: 3, 6: 2, 14: 8, 15: 2, 18: 2, 29: 2, 31: 2}
OK	560-21-4	CCC(C)(C)C(C)C	{1: 5, 2: 1, 3: 1, 4: 1}
OK	560-22-5	CC(C)C(C)(C)C=C	{1: 4, 3: 1, 4: 1, 5: 1, 6: 1}
OK	560-23-6	CCC(C)(C)C(=C)C	{1: 4, 2: 1, 4: 1, 5: 1, 7: 1}
OK	560-95-2	C([N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])Br	{18: 1, 4: 1, 38: 3}
OK	56000-16-9	CCCCCCCCC=CCCCCCCC=C1C(C(=O)O1)CCCCCCC=CCCCCCCCC	{1: 2, 2: 26, 6: 5, 12: 1, 15: 1, 28: 1}
OK	56004-38-7	C1=CC2C=CC3C2C(C=C1)C=C3	{12: 4, 14: 8}
OK	56011-12-2	CCOC(C)(C#N)OCC	{1: 3, 2: 2, 4: 1, 37: 1, 22: 2}
OK	56021-63-7	CC1CC=CC(C1)C	{1: 2, 11: 2, 12: 2, 14: 2}
OK	5603-34-9	C1=CC2C3C4C1C5C2C3C45	{12: 8, 14: 2}
OK	56039-55-5	CC1CC=CC1C	{1: 2, 11: 1, 12: 2, 14: 2}
OK	5604-55-7	CC=CCC=O	{1: 1, 2: 1, 26: 1, 6: 2}
OK	56049-80-0	CCCCCCCCCCCCCCCOCCOCCO	{1: 1, 2: 18, 20: 1, 22: 2}
OK	56058-30-1	CCOC(=O)C1CC(C(=O)C=C1C)C(=O)OCC	{1: 3, 2: 2, 11: 1, 12: 2, 14: 1, 15: 1, 25: 1, 28: 2}
OK	56058-69-6	C/C=C(\C)/C1CCC(O1)(C)C	{1: 4, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 23: 1}
OK	56065-42-0	CCCC(C)CC(C)(CC)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	56065-43-1	CCCC(C)(CC(C)CC)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	56072-27-6	CCCC(C(C)C(=O)C)O	{24: 1, 1: 3, 2: 2, 3: 2, 20: 1}
OK	56078-99-0	CC1C(CC(=O)O1)S	{1: 1, 11: 1, 12: 2, 28: 1, 39: 1}
OK	561-20-6	C1CN2CC3=CCO[C@H]([C@@H]4[C@H]3C[C@H]2[C@@]15[C@H]4NC6=C(C(=O)C(=O)C=C56)[N+](=O)[O-])CC(=O)O	{32: 1, 33: 1, 2: 1, 38: 1, 11: 5, 12: 5, 13: 1, 14: 2, 15: 4, 23: 1, 25: 2, 27: 1}
OK	561-77-3	C1CCC(CC1)C2(CCCCC2)C(=O)OCCN3CCCCC3	{33: 1, 2: 2, 11: 15, 12: 1, 13: 1, 28: 1}
OK	561-86-4	C=CCC1(C(=O)NC(=O)NC1=O)CC(=C)Br	{32: 2, 2: 2, 5: 2, 6: 1, 7: 1, 13: 1, 18: 1, 25: 3}
OK	5610-40-2	C1CCN2[C@H](C1)[C@]34CC2C=CC3=CC(=O)O4	{33: 1, 11: 5, 12: 2, 13: 1, 14: 3, 15: 1, 28: 1}
OK	5610-49-1	CCCCN1CCNCC1	{32: 1, 1: 1, 2: 3, 11: 4, 33: 1}
OK	56105-46-5	CC(C)CC(=CCCC(C)(C=C)O)C	{1: 4, 2: 3, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	5611-51-8	C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)COC(=O)CC(C)(C)C)CCC5=CC(=O)C=C[C@@]53C)F)O	{1: 7, 2: 2, 4: 1, 11: 4, 12: 4, 13: 5, 14: 3, 15: 1, 16: 1, 20: 1, 23: 2, 24: 1, 25: 1, 28: 1}
OK	56125-88-3	CN1C=CC2CC1C=C2	{1: 1, 11: 1, 12: 2, 14: 4, 33: 1}
OK	56125-90-7	CN1C=CC2CCC1C2	{1: 1, 11: 3, 12: 2, 14: 2, 33: 1}
OK	56125-92-9	CN1CCC2CC1C=C2	{1: 1, 11: 3, 12: 2, 14: 2, 33: 1}
OK	56125-93-0	COC(=O)N1C=CC2CC1C=C2	{1: 1, 33: 1, 11: 1, 12: 2, 14: 4, 28: 1}
OK	56125-94-1	COC(=O)N1C=CC2CCC1C2	{1: 1, 33: 1, 11: 3, 12: 2, 14: 2, 28: 1}
OK	56125-95-2	COC(=O)N1CCC2CC1C=C2	{1: 1, 33: 1, 11: 3, 12: 2, 14: 2, 28: 1}
OK	56133-38-1	C=C1CCCCCCCC1	{11: 8, 5: 1, 15: 1}
OK	56134-03-3	CCCCCC=CCC=CCCCCCC=C	{1: 1, 2: 10, 5: 1, 6: 5}
OK	56134-53-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCl	{1: 1, 2: 25, 17: 1}
OK	5614-37-9	COC1CCCC1	{1: 1, 11: 4, 12: 1, 22: 1}
OK	5615-90-7	CC1CC(=O)NC1=O	{32: 1, 1: 1, 11: 1, 12: 1, 25: 2}
OK	5616-32-0	CNCC#N	{1: 1, 2: 1, 37: 1, 31: 1}
OK	5616-51-3	CC1SCCS1	{1: 1, 11: 2, 12: 1, 41: 2}
OK	56160-71-5	CC1CCC2N1C(CC2)C	{1: 2, 11: 4, 12: 3, 33: 1}
OK	56160-79-3	CC(CO)CS	{1: 1, 2: 2, 3: 1, 20: 1, 39: 1}
OK	5617-32-3	C(COCCOCCOCCOCCOCCOCCO)O	{2: 14, 20: 2, 22: 6}
OK	5617-41-4	CCCCCCCC1CCCCC1	{1: 1, 2: 6, 11: 5, 12: 1}
OK	5617-42-5	CCCCCCCC1CCCC1	{1: 1, 2: 6, 11: 4, 12: 1}
OK	5617-92-5	CC(=CC1C(C1(C)C)CO)C	{1: 4, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 20: 1}
OK	56172-46-4	CC=CC(=O)OCC=C(C)CCC=C(C)C	{1: 4, 2: 3, 28: 1, 6: 4, 7: 2}
OK	56175-55-4	CC(C)C1CCC(=CC1)CC2CCCC2=O	{1: 2, 2: 1, 3: 1, 11: 6, 12: 2, 14: 1, 15: 1, 25: 1}
OK	56180-94-0	C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](OC([C@@H]([C@H]3O)O)O)CO)CO)O)O)N[C@H]4C=C([C@H]([C@@H]([C@H]4O)O)O)CO	{1: 1, 2: 3, 12: 19, 14: 1, 15: 1, 20: 13, 22: 2, 23: 3, 31: 1}
OK	562-28-7	C[C@@]12CCCC([C@H]1CCC34[C@H]2CC[C@H](C3)C(=C)C4)(C)C	{1: 3, 5: 1, 11: 9, 12: 3, 13: 3, 15: 1}
OK	562-46-9	CC1(CCC(=O)CC1=O)C	{1: 2, 11: 3, 13: 1, 25: 2}
OK	562-49-2	CCC(C)(C)CC	{1: 4, 2: 2, 4: 1}
OK	562-73-2	C1C(C(C(CC1(C(=O)O)O)O)O)O	{27: 1, 20: 4, 11: 2, 12: 3, 13: 1}
OK	562-74-3	CC1=CCC(CC1)(C(C)C)O	{1: 3, 3: 1, 11: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	562-94-7	C#CC1(CCCCC1)OC(=O)NC(=O)N	{9: 1, 10: 1, 11: 5, 13: 1, 24: 1, 28: 1, 30: 1, 31: 1}
OK	56206-38-3	COC1CC2CCC1C=C2	{1: 1, 11: 3, 12: 3, 22: 1, 14: 2}
OK	56206-39-4	COC1CC2CCC1CC2	{1: 1, 11: 5, 12: 3, 22: 1}
OK	56207-45-5	C1CC(C(C(C1)(Cl)Cl)O)(Cl)Cl	{17: 4, 11: 3, 12: 1, 13: 2, 20: 1}
OK	56219-04-6	CCCCCC/C=C\CCCCCCCC=O	{1: 1, 2: 12, 26: 1, 6: 2}
OK	56219-10-4	CCCCCCC=CCCCCCCCC(=O)OCC	{1: 2, 2: 13, 28: 1, 6: 2}
OK	56221-91-1	CC(=O)O.C=CCCCCCCCCCCCCO	{1: 1, 2: 12, 5: 1, 6: 1, 20: 1, 27: 1}
OK	56222-35-6	C1CN(CC1O)N=O	{33: 1, 34: 1, 11: 3, 12: 1, 20: 1, 29: 1}
OK	5625-41-2	C(C1C(=O)NC(C(=O)N1)CO)O	{32: 2, 20: 2, 2: 2, 12: 2, 25: 2}
OK	5625-46-7	CC1C(=O)NC(C(=O)N1)C	{32: 2, 1: 2, 12: 2, 25: 2}
OK	5625-50-3	CC(C)CC1C(=O)NC(C(=O)N1)C(C)C	{32: 2, 1: 4, 2: 1, 3: 2, 12: 2, 25: 2}
OK	5625-69-4	C1CCN(CC1)CCNCCN	{33: 1, 2: 4, 11: 5, 30: 1, 31: 1}
OK	5625-90-1	C1COCCN1CN2CCOCC2	{33: 2, 2: 1, 11: 8, 23: 2}
OK	56258-86-7	CC(C)(C)N1C2CCCC1CC(=O)C2	{1: 3, 4: 1, 33: 1, 11: 5, 12: 2, 25: 1}
OK	56259-14-4	CC(C)C=CC(=O)C(C)C	{24: 1, 1: 4, 3: 2, 6: 2}
OK	56262-41-0	CC(C)(CC(C)(C#N)N)OC	{1: 4, 2: 1, 4: 2, 37: 1, 22: 1, 30: 1}
OK	56269-22-8	CCC=CC=CC=CC=O	{1: 1, 2: 1, 26: 1, 6: 6}
OK	5627-05-4	C1CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{32: 1, 33: 1, 2: 1, 11: 2, 12: 4, 20: 3, 23: 1, 25: 2}
OK	56275-41-3	CC(F)F.C(F)(F)(Cl)Cl	{16: 4, 1: 1, 3: 1, 4: 1, 17: 2}
OK	56279-27-7	C1CC(=O)C2=C3NC=CN3C4=C5C(=NC=N5)C=CC46C2=C1CC(=O)C6	{32: 1, 33: 1, 35: 2, 11: 4, 13: 1, 14: 5, 15: 7, 25: 2}
OK	56279-50-6	CCCCCCCCCCCCCCCCC(C(=O)O)(Cl)Cl	{1: 1, 2: 15, 27: 1, 4: 1, 17: 2}
OK	5628-77-3	C=C1C2CC(C1=C)C=C2	{11: 1, 12: 2, 5: 2, 14: 2, 15: 2}
OK	5628-99-9	C=CN1CC1	{33: 1, 11: 2, 5: 1, 6: 1}
OK	56280-96-7	CC(=O)OC=C.COC(=O)/C=C\C(=O)O.C=CC(=O)O	{1: 2, 27: 2, 28: 2, 5: 2, 6: 4}
OK	56298-90-9	CCCC(C)CC(C)O	{1: 3, 2: 3, 3: 2, 20: 1}
OK	56299-00-4	C[C@H]1[C@H]([C@@H]2[C@@H](O2)C3=CC(=O)[C@@]4(C[C@]13C)[C@@](O4)(C)C=O)OC(=O)C	{1: 4, 11: 1, 12: 4, 13: 3, 14: 1, 15: 1, 23: 2, 25: 1, 26: 1, 28: 1}
OK	563-16-6	CCCC(C)(C)CC	{1: 4, 2: 3, 4: 1}
OK	563-41-7	C(=O)(N)NN.Cl	{24: 1, 17: 1, 30: 2, 31: 1}
OK	563-45-1	CC(C)C=C	{1: 2, 3: 1, 5: 1, 6: 1}
OK	563-46-2	CCC(=C)C	{1: 2, 2: 1, 5: 1, 7: 1}
OK	563-47-3	CC(=C)CCl	{1: 1, 2: 1, 17: 1, 5: 1, 7: 1}
OK	563-52-0	CC(C=C)Cl	{1: 1, 3: 1, 5: 1, 6: 1, 17: 1}
OK	563-54-2	CC(=CCl)Cl	{1: 1, 17: 2, 6: 1, 7: 1}
OK	563-57-5	C=CC(Cl)Cl	{17: 2, 3: 1, 5: 1, 6: 1}
OK	563-58-6	CC=C(Cl)Cl	{1: 1, 17: 2, 6: 1, 7: 1}
OK	563-70-2	C([N+](=O)[O-])Br	{2: 1, 18: 1, 38: 1}
OK	563-76-8	CC(C(=O)Br)Br	{24: 1, 1: 1, 18: 2, 3: 1}
OK	563-78-0	CC(C)C(=C)C	{1: 3, 3: 1, 5: 1, 7: 1}
OK	563-79-1	CC(=C(C)C)C	{1: 4, 7: 2}
OK	563-80-4	CC(C)C(=O)C	{24: 1, 1: 3, 3: 1}
OK	563-83-7	CC(C)C(=O)N	{24: 1, 1: 2, 3: 1, 30: 1}
OK	563-84-8	CC(C(C)Cl)O	{1: 2, 3: 2, 20: 1, 17: 1}
OK	563-86-0	CC(C(C)N)N	{1: 2, 3: 2, 30: 2}
OK	56316-37-1	CCCN(CCCC(=O)O)N=O	{1: 1, 34: 1, 33: 1, 2: 5, 27: 1, 29: 1}
OK	5632-47-3	C1CN(CCN1)N=O	{32: 1, 33: 1, 34: 1, 11: 4, 29: 1}
OK	5632-85-9	C1CC2C=CCC1N2	{32: 1, 11: 3, 12: 2, 14: 2}
OK	56329-47-6	CC(=O)O.CC(=O)O.C(CNCCN)N	{1: 2, 2: 4, 27: 2, 30: 2, 31: 1}
OK	5634-30-0	CCCCCCCCCCCCC1CCCC1	{1: 1, 2: 11, 11: 4, 12: 1}
OK	5634-39-9	CC(C1OCC(O1)CO)I	{1: 1, 2: 1, 3: 1, 11: 1, 12: 2, 19: 1, 20: 1, 23: 2}
OK	5634-54-8	CC(=C(OC)OC)C	{1: 4, 22: 2, 7: 2}
OK	56348-00-6	CCN(CC)CC.[Br]	{1: 3, 2: 3, 18: 1, 33: 1}
OK	56357-87-0	C=C(F)F.C(=C(F)F)(OC(F)(F)F)F.C(=C(F)F)(F)F	{16: 12, 4: 1, 5: 1, 22: 1, 7: 5}
OK	5636-65-7	CC(=CCCC(=O)O)C	{1: 2, 2: 2, 27: 1, 6: 1, 7: 1}
OK	56375-33-8	CCCCNN=O	{1: 1, 2: 3, 34: 1, 29: 1, 31: 1}
OK	56375-88-3	CCCC(CCCl)Cl	{1: 1, 2: 4, 3: 1, 17: 2}
OK	5638-09-5	CCCCCCCCC(CCCCCCCC)CCCC1CCCC1	{11: 4, 1: 2, 2: 17, 3: 1, 12: 1}
OK	5638-26-6	CC=CC(CC=C)O	{1: 1, 2: 1, 3: 1, 5: 1, 6: 3, 20: 1}
OK	5638-92-6	CCCC(CO)(CO)[N+](=O)[O-]	{1: 1, 2: 4, 4: 1, 38: 1, 20: 2}
OK	56381-65-8	CCCCCCCCC=CCCCCCCCC(=O)NCCOCCOC(=O)C=CC(=O)O	{1: 1, 2: 18, 6: 4, 22: 1, 24: 1, 27: 1, 28: 1, 31: 1}
OK	56391-56-1	CCNC1CC(C(C(C1OC2C(C(C(CO2)(C)O)NC)O)O)OC3C(CC=C(O3)CN)N)N	{1: 3, 2: 2, 11: 3, 12: 10, 13: 1, 14: 1, 15: 1, 20: 3, 22: 2, 23: 2, 30: 3, 31: 2}
OK	56392-13-3	CCCCCCCCCCCCCCCNCC	{1: 2, 2: 15, 31: 1}
OK	56399-02-1	CCOC(=O)C=C.CCOC(=O)C(=C)C	{1: 3, 2: 2, 5: 2, 6: 1, 7: 1, 28: 2}
OK	56399-98-5	CC=CCCI	{1: 1, 2: 2, 19: 1, 6: 2}
OK	564-02-3	CCC(C)C(C)(C)C	{1: 5, 2: 1, 3: 1, 4: 1}
OK	564-03-4	CC(C=C)C(C)(C)C	{1: 4, 3: 1, 4: 1, 5: 1, 6: 1}
OK	564-04-5	CCC(=O)C(C)(C)C	{24: 1, 1: 4, 2: 1, 4: 1}
OK	564-11-4	C1(C(C(N(C(C1(F)F)(F)F)C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 15, 33: 1, 4: 2, 13: 5}
OK	564-94-3	CC1(C2CC=C(C1C2)C=O)C	{1: 2, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1, 26: 1}
OK	56407-83-1	C(F)(F)(F)I=O	{16: 3, 19: 1, 4: 1, 29: 1}
OK	56418-17-8	CCCC=CCCCCCCCCCC1CC(=O)N(C1=O)CCO	{1: 1, 2: 13, 6: 2, 33: 1, 11: 1, 12: 1, 20: 1, 25: 2}
OK	56444-80-5	CC#CSCC(C)C	{40: 1, 1: 3, 2: 1, 3: 1, 10: 2}
OK	56444-81-6	CCSCCOC	{40: 1, 1: 2, 2: 3, 22: 1}
OK	56486-59-0	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(C)COC(=O)C=C	{1: 4, 2: 18, 3: 1, 5: 2, 6: 1, 7: 1, 28: 2}
OK	56487-95-7	CC(=C)C(=O)OC(F)(F)F	{1: 1, 4: 1, 5: 1, 7: 1, 16: 3, 28: 1}
OK	5649-95-6	C1=CC2C1C=C2	{12: 2, 14: 4}
OK	565-48-0	CC(C)(O)[C@H]1CC[C@@](C)(O)CC1	{1: 3, 4: 1, 11: 4, 12: 1, 13: 1, 20: 2}
OK	565-50-4	CC(C)(O)[C@H]1CC[C@](C)(O)CC1	{1: 3, 4: 1, 11: 4, 12: 1, 13: 1, 20: 2}
OK	565-53-7	CCOC(=O)C(F)(Br)Br	{1: 1, 2: 1, 4: 1, 16: 1, 18: 2, 28: 1}
OK	565-59-3	CCC(C)C(C)C	{1: 4, 2: 1, 3: 2}
OK	565-60-6	CCC(C)C(C)O	{1: 3, 2: 1, 3: 2, 20: 1}
OK	565-61-7	CCC(C)C(=O)C	{24: 1, 1: 3, 2: 1, 3: 1}
OK	565-62-8	CC=C(C)C(=O)C	{24: 1, 1: 3, 6: 1, 7: 1}
OK	565-64-0	C(C(C(=O)O)Cl)Cl	{27: 1, 17: 2, 2: 1, 3: 1}
OK	565-65-1	C=CC(=C(F)F)F	{16: 3, 5: 1, 6: 1, 7: 2}
OK	565-67-3	CCC(C(C)C)O	{1: 3, 2: 1, 3: 2, 20: 1}
OK	565-69-5	CCC(=O)C(C)C	{24: 1, 1: 3, 2: 1, 3: 1}
OK	565-70-8	CCC(C(=O)O)O	{27: 1, 1: 1, 2: 1, 3: 1, 20: 1}
OK	565-71-9	C(C(C(=O)O)O)N	{27: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	565-74-2	CC(C)C(C(=O)O)Br	{27: 1, 1: 2, 18: 1, 3: 2}
OK	565-75-3	CC(C)C(C)C(C)C	{1: 5, 3: 3}
OK	565-76-4	CC(C)C(C)C(=C)C	{1: 4, 3: 2, 5: 1, 7: 1}
OK	565-77-5	CC(C)C(=C(C)C)C	{1: 5, 3: 1, 7: 2}
OK	565-78-6	CC(C)C(C)C(=O)C	{24: 1, 1: 4, 3: 2}
OK	565-80-0	CC(C)C(=O)C(C)C	{24: 1, 1: 4, 3: 2}
OK	565-96-8	CC(=O)[C@H]1CC[C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)O)C	{1: 3, 11: 8, 12: 6, 13: 2, 20: 1, 24: 1, 25: 1}
OK	5650-20-4	CCOCCOCCOCCOCCO	{1: 1, 2: 9, 20: 1, 22: 4}
OK	5650-75-9	CCCC(=C)C(=O)O	{1: 1, 2: 2, 27: 1, 5: 1, 7: 1}
OK	56502-00-2	C(C(C(C(C(CBr)O)O)O)O)Br	{2: 2, 3: 4, 20: 4, 18: 2}
OK	56505-81-8	CCCCCCCCCCCCC(C)N(C)C	{1: 4, 2: 11, 3: 1, 33: 1}
OK	56519-50-7	CC(C)C1(C(=O)N(C1=O)CC(F)(F)F)C(C)C	{1: 4, 2: 1, 3: 2, 4: 1, 33: 1, 13: 1, 16: 3, 25: 2}
OK	56519-61-0	CC(CCCCl)(OC)OC	{1: 3, 2: 3, 4: 1, 22: 2, 17: 1}
OK	56523-30-9	CC=C(C)CCCC(C)C	{1: 4, 2: 3, 3: 1, 6: 1, 7: 1}
OK	5653-21-4	C(/C=N/O)[N+](=O)[O-]	{2: 1, 38: 1, 20: 1, 34: 1, 6: 1}
OK	56530-47-3	CCCCCCCCCCCC(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C	{1: 5, 2: 11, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 1}
OK	56530-48-4	CCCCCCCCC/C=C/C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C	{1: 5, 2: 9, 6: 2, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 1}
OK	56530-49-5	CCCCCCCCCCCC(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)COC(=O)C)O)C	{1: 6, 2: 11, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 2, 25: 1, 28: 2}
OK	56534-03-3	C1[C@H]2C3C([C@@H]1C(=C(C3(C(=C2Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 11: 1, 12: 4, 13: 1, 15: 4}
OK	56539-66-3	CC(C)(CCO)OC	{1: 3, 2: 2, 4: 1, 22: 1, 20: 1}
OK	56544-17-3	CCOC(=C)C(C)C	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1, 22: 1}
OK	56544-18-4	CC(C)C(=C)OC(C)C	{1: 4, 3: 2, 5: 1, 22: 1, 7: 1}
OK	56552-15-9	C1C(OCO1)COCC2COCO2	{2: 2, 11: 4, 12: 2, 22: 1, 23: 4}
OK	56554-34-8	CCC(C)CCCC(C)CCCC(C)CCC=C(C)C	{1: 6, 2: 9, 3: 3, 6: 1, 7: 1}
OK	56554-86-0	C=CCCCCCCCCCCCCCCCC=O	{2: 15, 26: 1, 5: 1, 6: 1}
OK	56561-57-0	C1=CC(=O)C(=O)C=CC1=O	{25: 3, 14: 4}
OK	5657-17-0	C(CNCC(=O)O)NCC(=O)O	{2: 4, 27: 2, 31: 2}
OK	56570-48-0	C/C(=C\C(=O)C)/NCCN/C(=C\C(=O)C)/C	{1: 4, 2: 2, 6: 2, 7: 2, 24: 2, 31: 2}
OK	56570-54-8	CCCNC1=CC(=O)CC(C1)(C)C	{1: 3, 2: 2, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1, 31: 1}
OK	56582-02-6	C=C1C2C=CC(C1=C)O2	{23: 1, 12: 2, 5: 2, 14: 2, 15: 2}
OK	56586-13-1	CC1CCCCC1C(=O)O	{27: 1, 1: 1, 11: 4, 12: 2}
OK	5659-93-8	CC(C)(C(=O)Cl)C(=O)Cl	{24: 2, 1: 2, 4: 1, 17: 2}
OK	566-09-6	C[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CC[C@@H](C3)[C@@H](C4)CO)(C)C(=O)O	{1: 2, 2: 1, 11: 9, 12: 4, 13: 3, 20: 1, 27: 1}
OK	566-28-9	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	566-48-3	C[C@]12CCC(=O)C(=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)O	{1: 2, 11: 8, 12: 3, 13: 2, 15: 2, 20: 1, 25: 2}
OK	566-65-4	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C	{1: 3, 11: 9, 12: 5, 13: 2, 24: 1, 25: 1}
OK	566-88-1	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 5, 13: 2, 25: 1}
OK	566-93-8	CC(C)CCCC(C)C1CCC2C1(CCC3C2C=CC4=CC(=O)CCC34C)C	{1: 5, 2: 3, 3: 2, 11: 6, 12: 4, 13: 2, 14: 3, 15: 1, 25: 1}
OK	56602-09-6	CCCCC/C=C/C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)COC(=O)C)O)C	{1: 6, 2: 5, 6: 2, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 2, 25: 1, 28: 2}
OK	56605-16-4	C1CCC2(CC1)C(=O)N(C(=O)N2)CCN(CCCl)CCCl	{32: 1, 33: 2, 2: 6, 11: 5, 13: 1, 17: 2, 25: 2}
OK	5661-71-2	C1CCCCNCCC1	{32: 1, 11: 8}
OK	56617-18-6	CC#CCC(C)(C)C	{1: 4, 2: 1, 4: 1, 10: 2}
OK	56618-58-7	CCCCCCC[C@H](CC(=O)OC)O	{1: 2, 2: 7, 3: 1, 20: 1, 28: 1}
OK	5663-29-6	CCCCCC1OCCCO1	{1: 1, 2: 4, 11: 3, 12: 1, 23: 2}
OK	5663-95-6	CCCCCC#CC#N	{1: 1, 2: 4, 10: 2, 37: 1}
OK	5663-96-7	CCCCCC#CC(=O)O	{1: 1, 2: 4, 27: 1, 10: 2}
OK	56630-30-9	CCCCCCCC(=O)NCCS	{24: 1, 1: 1, 2: 8, 39: 1, 31: 1}
OK	56630-31-0	CCC#CCCCCC(=O)O	{1: 1, 2: 5, 27: 1, 10: 2}
OK	56630-34-3	CCCC#CCCCC(=O)O	{1: 1, 2: 5, 27: 1, 10: 2}
OK	56631-01-7	C(C(C(=C(Cl)Cl)Cl)(Cl)Cl)Cl	{17: 6, 2: 1, 4: 1, 7: 2}
OK	5664-10-8	C=CC=C1CCCCC1	{11: 5, 5: 1, 6: 2, 15: 1}
OK	5664-20-0	C=C=C1CCCCC1	{8: 1, 11: 5, 5: 1, 15: 1}
OK	5664-33-5	C1C=CC(=O)C=C1	{25: 1, 11: 1, 14: 4}
OK	56640-69-8	CC/C=C/O	{1: 1, 2: 1, 20: 1, 6: 2}
OK	56652-39-2	CC(CC(=O)OC)(CC(=O)OC)O	{1: 3, 2: 2, 4: 1, 20: 1, 28: 2}
OK	56654-39-8	COC1C(C(C(O1)C(CO)O)O)O	{1: 1, 2: 1, 3: 1, 12: 4, 20: 4, 22: 1, 23: 1}
OK	56654-52-5	CCCCNC(=O)N(CCCC)N=O	{1: 2, 2: 6, 33: 1, 34: 1, 24: 1, 29: 1, 31: 1}
OK	56654-53-6	CCCCN(C(=O)N(C)C)N=O	{1: 3, 2: 3, 33: 2, 34: 1, 24: 1, 29: 1}
OK	5666-17-1	CCN(CC)CC=C	{1: 2, 2: 3, 5: 1, 6: 1, 33: 1}
OK	5666-19-3	CCCN(CCC)CC=C	{1: 2, 2: 5, 5: 1, 6: 1, 33: 1}
OK	5666-21-7	CCCNCC=C	{1: 1, 2: 3, 5: 1, 6: 1, 31: 1}
OK	56661-88-2	COC(=O)C1=C(CCCC1)N	{1: 1, 11: 4, 28: 1, 30: 1, 15: 2}
OK	56669-87-5	CC(C(=O)O)O.CN(C)CCO	{1: 3, 2: 2, 3: 1, 33: 1, 20: 2, 27: 1}
OK	56672-87-8	CCCCC(CC)CN1CC(CN(C1)CC(CC)CCCC)(C)[N+](=O)[O-]	{1: 5, 2: 10, 3: 2, 38: 1, 33: 2, 11: 3, 13: 1}
OK	56683-54-6	CCCCC=CCCCCCCCCCCO	{1: 1, 2: 13, 20: 1, 6: 2}
OK	5669-09-0	CC(C)COC(C)OCC(C)C	{1: 5, 2: 2, 3: 3, 22: 2}
OK	5669-39-6	CN(C)OC	{1: 3, 22: 1, 33: 1}
OK	56700-77-7	CCCCC/C=C/C=C	{1: 1, 2: 4, 5: 1, 6: 3}
OK	56702-89-7	CC(CCCl)CCCl	{1: 1, 2: 4, 3: 1, 17: 2}
OK	56726-04-6	CCCCC/C=C/C=C/C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)COC(=O)C)O)C	{1: 6, 2: 5, 6: 4, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 2, 25: 1, 28: 2}
OK	56745-61-0	CC(CCC(=O)C)O	{24: 1, 1: 2, 2: 2, 3: 1, 20: 1}
OK	5675-25-2	CCCC=CCC=C	{1: 1, 2: 3, 5: 1, 6: 3}
OK	5675-31-0	C=C(CO)F	{16: 1, 2: 1, 20: 1, 5: 1, 7: 1}
OK	5675-51-4	C(CCCCCCO)CCCCCO	{2: 12, 20: 2}
OK	56752-50-2	CC(=O)OC1CCC(OC1(C)C)(C)C=C	{1: 4, 5: 1, 6: 1, 11: 2, 12: 1, 13: 2, 23: 1, 28: 1}
OK	56755-30-7	CC(C)/C=C/1\CCCO1	{1: 2, 3: 1, 6: 1, 11: 3, 15: 1, 23: 1}
OK	56755-32-9	CC(C)/C=C\1/CCCO1	{1: 2, 3: 1, 6: 1, 11: 3, 15: 1, 23: 1}
OK	56761-30-9	CCC1C=CC(=O)S1	{1: 1, 2: 1, 41: 1, 12: 1, 14: 2, 25: 1}
OK	56779-88-5	CCCCCC(/C=C/C1C(CC(C1C/C=C/CCCC(=O)O)O)O)O	{1: 1, 2: 8, 3: 1, 6: 4, 11: 1, 12: 4, 20: 3, 27: 1}
OK	5678-98-8	CC=CC(=C(C)C)C	{1: 4, 6: 2, 7: 2}
OK	56795-65-4	CCCCNN.Cl	{1: 1, 2: 3, 31: 1, 30: 1, 17: 1}
OK	56795-66-5	CCCNN.Cl	{1: 1, 2: 2, 31: 1, 30: 1, 17: 1}
OK	56797-40-1	CCCCCCCCC=CCCCCCC=O	{1: 1, 2: 12, 26: 1, 6: 2}
OK	56798-13-1	CC(C)C(=C)OCCOC	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1, 22: 2}
OK	56798-14-2	CC(C)C(=C)OCCCl	{1: 2, 2: 2, 3: 1, 5: 1, 7: 1, 17: 1, 22: 1}
OK	56798-16-4	CC(C)COC(=C)C(C)C	{1: 4, 2: 1, 3: 2, 5: 1, 7: 1, 22: 1}
OK	56798-18-6	CCC(CC)OC(=C)C(C)C	{1: 4, 2: 2, 3: 2, 5: 1, 7: 1, 22: 1}
OK	56804-18-3	C1CO1.C(COCCO)O.C(=O)=O	{2: 4, 8: 1, 11: 2, 20: 2, 22: 1, 23: 1, 29: 2}
OK	56816-01-4	CCOC(=O)C[C@H](C)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 1}
OK	5682-79-1	CC(=C(C(=O)C(=C(C)C)Br)Br)C	{24: 1, 1: 4, 18: 2, 7: 4}
OK	5683-44-3	CC(C(C)O)C(C)O	{1: 3, 3: 3, 20: 2}
OK	56832-67-8	C[C@@H]1[C@H](CC2(CC[C@@](O2)(C)[C@H]3CC[C@@](O3)(C)[C@H]4[C@H]([C@H]([C@@H](O4)[C@@H]5[C@H]([C@@H]([C@H]([C@@](O5)(C)O)C)OC)C)OC)C)O[C@@H]1[C@@H](C)[C@@H]6[C@@H]([C@@H]([C@H]([C@@](O6)([C@H](C)C(=O)O)O)C)OC)C)OC	{1: 15, 3: 2, 11: 5, 12: 16, 13: 5, 20: 2, 22: 4, 23: 6, 27: 1}
OK	56833-74-0	CC(C)C/C=C/C(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1OC2[C@H]([C@@H]([C@H]([C@@H](O2)CO)O)O)NC(=O)C)CC([C@@H]3[C@H]([C@H]([C@@H](O3)N4CCC(=O)NC4=O)O)O)O)O)O	{32: 1, 1: 3, 2: 3, 3: 2, 6: 2, 33: 1, 11: 2, 12: 14, 20: 8, 22: 1, 23: 3, 24: 2, 25: 2, 31: 2}
OK	5684-29-7	C1COSC1	{41: 1, 11: 3, 23: 1}
OK	5684-31-1	CC1(OCCS1)C	{1: 2, 41: 1, 11: 2, 13: 1, 23: 1}
OK	56848-61-4	CCCCC(CC)COC(=O)C=C.CCCCOC(=O)C=C.C=CCl	{1: 3, 2: 8, 3: 1, 5: 3, 6: 3, 17: 1, 28: 2}
OK	5685-46-1	C1CC1C2CC2	{11: 4, 12: 2}
OK	5685-47-2	C1CC1CC2CC2	{2: 1, 11: 4, 12: 2}
OK	56856-83-8	CC(=O)OCN(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	56862-62-5	CCCCCCCCCC(C)CCCCCCCCC	{1: 3, 2: 16, 3: 1}
OK	56863-02-6	CCCCCC=CCC=CCCCCCCCC(=O)N(CCO)CCO	{1: 1, 2: 16, 6: 4, 33: 1, 20: 2, 24: 1}
OK	56881-90-4	C1COC(=O)[C@@H]1O	{20: 1, 11: 2, 12: 1, 28: 1}
OK	56897-57-5	C[C](C)C#C	{1: 2, 10: 1, 9: 1, 7: 1}
OK	56898-37-4	CCCCCCCC(C)C(=O)OC	{1: 3, 2: 6, 3: 1, 28: 1}
OK	56905-18-1	CC(C(=O)OC)I	{19: 1, 1: 2, 3: 1, 28: 1}
OK	5691-20-3	C1CC[C@@H]([C@@H](C1)C(=O)O)N	{27: 1, 11: 4, 12: 2, 30: 1}
OK	5692-97-7	CCC(CC)(CC(=O)O)C(=O)O	{1: 2, 2: 3, 27: 2, 4: 1}
OK	56922-72-6	CCCCCOC(=O)C=C(C)C	{1: 3, 2: 4, 28: 1, 6: 1, 7: 1}
OK	56922-73-7	CC(C)CCOC(=O)C=C(C)C	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 28: 1}
OK	56922-74-8	CCCCC(=O)OCC=CCCC	{1: 2, 2: 6, 28: 1, 6: 2}
OK	56927-54-9	C(CCCN)CCN.C(CCl)Cl	{17: 2, 2: 8, 30: 2}
OK	5693-62-9	COC1=NCCCC1	{1: 1, 11: 4, 35: 1, 22: 1, 15: 1}
OK	56937-68-9	CCCCCCCCCCCCCC(=O)OC1C(C2(C(C=C(CC3(C2C=C(C3O)C)O)CO)C4C1(C4(C)C)OC(=O)C)O)C	{1: 6, 2: 13, 11: 1, 12: 6, 13: 4, 14: 2, 15: 2, 20: 4, 28: 2}
OK	56938-23-9	CCCCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCCOCCOCCOC(=O)C(=C)C	{1: 5, 2: 9, 5: 4, 6: 1, 7: 3, 22: 2, 28: 4}
OK	5694-00-8	C1C(O1)C(=O)N	{24: 1, 11: 1, 12: 1, 30: 1, 23: 1}
OK	5694-82-6	CC(=CCCC(=CC1OCC(O1)CO)C)C	{1: 3, 2: 3, 6: 2, 7: 2, 11: 1, 12: 2, 20: 1, 23: 2}
OK	5697-56-3	CC1(C2CCC3(C(C2(CCC1OC(=O)CCC(=O)O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C	{1: 7, 2: 2, 11: 9, 12: 4, 13: 6, 14: 1, 15: 1, 25: 1, 27: 2, 28: 1}
OK	5698-29-3	C1CCCC(=O)OCCC1	{11: 7, 28: 1}
OK	56986-35-7	CCCCN(C(CCC)OC(=O)C)N=O	{1: 3, 2: 5, 3: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	56986-36-8	CCCCN(COC(=O)C)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 28: 1, 29: 1}
OK	56986-37-9	CCC(C)N(COC(=O)C)N=O	{1: 3, 2: 2, 3: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	56987-74-7	CCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCC	{1: 4, 2: 27, 3: 2}
OK	56987-75-8	CCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCCCC	{1: 4, 2: 27, 3: 2}
OK	56987-76-9	CCCCCCCCCCCCCCCCCCCCC(C)CCCCCCCCCCCC	{1: 3, 2: 30, 3: 1}
OK	56987-78-1	CCCCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCC	{1: 4, 2: 29, 3: 2}
OK	56987-80-5	CCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCCCCCC	{1: 4, 2: 29, 3: 2}
OK	56987-84-9	CCCCCCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCC	{1: 4, 2: 31, 3: 2}
OK	56987-86-1	CCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCCCCCC	{1: 4, 2: 31, 3: 2}
OK	56987-91-8	CCCCCCCCCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCCCCCC	{1: 4, 2: 33, 3: 2}
OK	5699-54-7	CC(C)C(CC(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	5699-58-1	CC(=O)CC(=O)C(=O)O	{24: 2, 1: 1, 2: 1, 27: 1}
OK	5699-74-1	CCCC(CCC)(C#N)O	{1: 2, 2: 4, 4: 1, 37: 1, 20: 1}
OK	56991-23-2	CCCCCCCC(C=C)OC(=O)C	{1: 2, 2: 6, 3: 1, 5: 1, 6: 1, 28: 1}
OK	57-00-1	CN(CC(=O)O)C(=N)N	{1: 1, 2: 1, 36: 1, 33: 1, 7: 1, 27: 1, 30: 1}
OK	57-08-9	CC(=O)NCCCCCC(=O)O	{24: 1, 1: 1, 2: 5, 27: 1, 31: 1}
OK	57-10-3	CCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 14, 27: 1}
OK	57-11-4	CCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 16, 27: 1}
OK	57-13-6	C(=O)(N)N	{24: 1, 30: 2}
OK	57-14-7	CN(C)N	{1: 2, 30: 1, 33: 1}
OK	57-15-8	CC(C)(C(Cl)(Cl)Cl)O	{1: 2, 4: 2, 20: 1, 17: 3}
OK	57-43-2	CCC1(C(=O)NC(=O)NC1=O)CCC(C)C	{32: 2, 1: 3, 2: 3, 3: 1, 13: 1, 25: 3}
OK	57-44-3	CCC1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 2, 2: 2, 13: 1, 25: 3}
OK	57-48-7	O=C(CO)[C@@H](O)[C@H](O)[C@H](O)CO	{24: 1, 2: 2, 3: 3, 20: 5}
OK	57-50-1	C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O	{2: 3, 12: 8, 13: 1, 20: 8, 22: 1, 23: 2}
OK	57-53-4	CCCC(C)(COC(=O)N)COC(=O)N	{1: 2, 2: 4, 4: 1, 30: 2, 28: 2}
OK	57-55-6	CC(CO)O	{1: 1, 2: 1, 3: 1, 20: 2}
OK	57-56-7	C(=O)(N)NN	{24: 1, 30: 2, 31: 1}
OK	57-57-8	C1COC1=O	{11: 2, 28: 1}
OK	57-71-6	CC(=NO)C(=O)C	{24: 1, 1: 2, 34: 1, 20: 1, 7: 1}
OK	57-83-0	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C	{1: 3, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 24: 1, 25: 1}
OK	57-85-2	CCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C	{1: 3, 2: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	57-87-4	CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C	{1: 6, 3: 3, 6: 2, 11: 7, 12: 4, 13: 2, 14: 2, 15: 2, 20: 1}
OK	57-88-5	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	57-92-1	C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(C=O)O	{1: 2, 2: 1, 34: 2, 7: 2, 12: 14, 13: 1, 20: 7, 22: 2, 23: 2, 26: 1, 30: 4, 31: 1}
OK	570-08-1	CCOC(=O)C(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 2, 3: 1, 28: 2}
OK	570-46-7	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CCCC4)C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 5, 13: 2, 25: 1}
OK	570-74-1	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CCCC4)C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 4, 13: 2, 14: 1, 15: 1}
OK	57018-52-7	CC(COC(C)(C)C)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1, 22: 1}
OK	5702-49-8	CC(C)C1OCCCO1	{11: 3, 1: 2, 3: 1, 12: 1, 23: 2}
OK	57021-67-7	CC(C)(CO)COC	{1: 3, 2: 2, 4: 1, 22: 1, 20: 1}
OK	57024-78-9	CCCCC(C=O)(Cl)Cl	{1: 1, 2: 3, 4: 1, 26: 1, 17: 2}
OK	5703-46-8	C1CCOOC1	{11: 4, 23: 2}
OK	57033-22-4	CCCCC(CC)COC(=O)C=C.CCCCOC(=O)C=C.CC(=C)C(=O)OCC1CO1	{1: 4, 2: 9, 3: 1, 5: 3, 6: 2, 7: 1, 11: 1, 12: 1, 23: 1, 28: 3}
OK	5704-04-1	C(C(=O)O)NC(CO)(CO)CO	{20: 3, 2: 4, 27: 1, 4: 1, 31: 1}
OK	5704-66-5	CC(=O)C(=O)Cl	{24: 2, 1: 1, 17: 1}
OK	57041-67-5	C(C(F)(F)F)(OC(F)F)F	{16: 6, 3: 2, 4: 1, 22: 1}
OK	57044-24-3	CC1(OC[C@@H](O1)CCl)C	{1: 2, 2: 1, 11: 1, 12: 1, 13: 1, 17: 1, 23: 2}
OK	57044-25-4	C1[C@H](O1)CO	{20: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	57069-87-1	CC(CCC1C(=C)C=CCC1(C)C)O	{1: 3, 2: 2, 3: 1, 5: 1, 11: 1, 12: 1, 13: 1, 14: 2, 15: 1, 20: 1}
OK	57070-90-3	CN(C)C1C2CCC(C2)C1O	{1: 2, 11: 3, 12: 4, 20: 1, 33: 1}
OK	57074-37-0	CCCCCC=CCCCO	{1: 1, 2: 7, 20: 1, 6: 2}
OK	57082-24-3	CC(=O)OC12CCCC(C1)(CCC3C2CC3(C)C)C	{1: 4, 11: 7, 12: 2, 13: 3, 28: 1}
OK	57090-45-6	C([C@H](CCl)O)O	{17: 1, 2: 2, 3: 1, 20: 2}
OK	57093-84-2	CCC(CC)SC	{40: 1, 1: 3, 2: 2, 3: 1}
OK	57094-35-6	CC(C)CC(OC)OC	{1: 4, 2: 1, 3: 2, 22: 2}
OK	571-20-0	C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4O)C)O	{1: 2, 11: 9, 12: 6, 13: 2, 20: 2}
OK	571-22-2	C[C@]12CCC(=O)C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4O)C	{1: 2, 11: 9, 12: 5, 13: 2, 20: 1, 25: 1}
OK	571-31-3	C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)O	{1: 2, 11: 9, 12: 5, 13: 2, 20: 1, 25: 1}
OK	571-40-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC[C@@H]4[C@@]3(C=CC(=O)C4)C	{1: 2, 11: 7, 12: 4, 13: 2, 14: 2, 25: 2}
OK	571-44-8	C[C@]12CC[C@@H](C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)O	{1: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	571-55-1	CCO/C=C(/C(=O)C(F)(F)F)\C(=O)OCC	{1: 2, 2: 2, 4: 1, 6: 1, 7: 1, 16: 3, 22: 1, 24: 1, 28: 1}
OK	57117-24-5	C/C(=N\OC(=O)N(C)N=O)/SC	{1: 3, 34: 2, 33: 1, 40: 1, 7: 1, 28: 1, 29: 1}
OK	57124-87-5	CC1C(CCO1)S	{1: 1, 11: 2, 12: 2, 39: 1, 23: 1}
OK	57137-41-4	C1C(C1F)F	{16: 2, 11: 1, 12: 2}
OK	57137-50-5	CC(=NCCNCCNCCNCCN=C(C)C)C	{1: 4, 2: 8, 31: 3, 34: 2, 7: 2}
OK	5714-80-7	COC(=O)C(CS)N.Cl	{1: 1, 2: 1, 3: 1, 39: 1, 17: 1, 28: 1, 30: 1}
OK	5715-23-1	CC1CCC(CC1C)O	{1: 2, 11: 3, 12: 3, 20: 1}
OK	5716-15-4	C1=CC(=O)NNC1=O.C(CO)NCCO	{32: 2, 2: 4, 14: 2, 20: 2, 25: 2, 31: 1}
OK	57166-92-4	C(N)N.Cl.Cl	{17: 2, 2: 1, 30: 2}
OK	5718-74-1	CC1(C2CCC(S1)(CC2)C)C	{1: 3, 11: 4, 12: 1, 13: 2, 41: 1}
OK	57212-57-4	CC(=C=C)C=C=C	{8: 2, 1: 1, 5: 2, 6: 1, 7: 1}
OK	57223-18-4	CCCCCC#CC=C	{1: 1, 2: 4, 10: 2, 5: 1, 6: 1}
OK	57233-31-5	CCCC(C)(CC(C)(C)C)O	{1: 5, 2: 3, 4: 2, 20: 1}
OK	57239-03-9	CC1(C2CC(C1=O)C(C2=O)(C)C)C	{1: 4, 11: 1, 12: 2, 13: 2, 25: 2}
OK	57246-61-4	CCC(=O)C(C)CN(CC)N=O	{1: 3, 2: 3, 3: 1, 33: 1, 34: 1, 24: 1, 29: 1}
OK	5725-96-2	CN(C)O	{1: 2, 20: 1, 33: 1}
OK	57254-27-0	CC\1=CSS/C1=C\C(=NC)C	{1: 3, 34: 1, 6: 1, 7: 1, 41: 2, 14: 1, 15: 2}
OK	57260-71-6	CC(C)(C)OC(=O)N1CCNCC1	{32: 1, 1: 3, 4: 1, 33: 1, 11: 4, 28: 1}
OK	57260-73-8	CC(C)(C)OC(=O)NCCN	{1: 3, 2: 2, 4: 1, 28: 1, 30: 1, 31: 1}
OK	57281-78-4	C([C@@H](C(=O)O)NC(=O)CN)S	{2: 2, 3: 1, 39: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	57282-45-8	CC1CCOC(O1)C=C(C)CCC=C(C)C	{1: 4, 2: 2, 6: 2, 7: 2, 11: 2, 12: 2, 23: 2}
OK	57282-49-2	CC(=O)O.C(CCN)C[C@@H](C(=O)O)N	{27: 2, 1: 1, 2: 4, 3: 1, 30: 2}
OK	5729-47-5	CC(=O)C=CC=O	{24: 1, 1: 1, 26: 1, 6: 2}
OK	5729-59-9	CCOCOCOCOCOCC	{1: 2, 2: 6, 22: 5}
OK	57294-38-9	CC(C)(C)OC(=O)NCCCC(=O)O	{1: 3, 2: 3, 4: 1, 27: 1, 28: 1, 31: 1}
OK	57297-56-0	C=C1C2CCC(C1=C)C3C2C=C3	{11: 2, 12: 4, 5: 2, 14: 2, 15: 2}
OK	57297-57-1	C=C1C2C=CC(C1=C)C2=O	{25: 1, 12: 2, 5: 2, 14: 2, 15: 2}
OK	57297-82-2	CCCCCCCCCC(CC)CC	{1: 3, 2: 10, 3: 1}
OK	57302-15-5	CC(C(C)Br)F	{16: 1, 1: 2, 18: 1, 3: 2}
OK	57303-23-8	CCCCCCCC(=O)N(CCCC)CCCC	{24: 1, 1: 3, 2: 12, 33: 1}
OK	57303-85-2	CCCC(C)N(C)C	{1: 4, 2: 2, 3: 1, 33: 1}
OK	5732-47-8	COCCOCCNCCOCCOC	{1: 2, 2: 8, 22: 4, 31: 1}
OK	5732-88-7	C1CCC(=CC#N)C1	{11: 4, 37: 1, 6: 1, 15: 1}
OK	5732-97-8	C1CC2CC1C(=O)O2	{28: 1, 11: 3, 12: 2}
OK	57322-59-5	CC(=C)C(=O)OCC(CCl)OC(=O)C(=C)C	{1: 2, 2: 2, 3: 1, 5: 2, 7: 2, 17: 1, 28: 2}
OK	57333-96-7	C[C@H](CC[C@H](C(C)C)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C	{1: 4, 2: 2, 3: 3, 5: 1, 6: 2, 11: 7, 12: 4, 13: 1, 15: 3, 20: 3}
OK	57342-48-0	CC(C)(C=C)C=C=C	{8: 1, 1: 2, 4: 1, 5: 2, 6: 2}
OK	57350-34-2	CC=CC(=O)C1C(CC=CC1(C)C)C	{1: 4, 6: 2, 11: 1, 12: 2, 13: 1, 14: 2, 24: 1}
OK	57355-72-3	CCCC#CCC(C)O	{1: 2, 2: 3, 3: 1, 20: 1, 10: 2}
OK	5736-03-8	CC1(OCC(O1)C=O)C	{1: 2, 11: 1, 12: 1, 13: 1, 23: 2, 26: 1}
OK	57374-02-4	CC1CCC(=C1)C	{1: 2, 11: 2, 12: 1, 14: 1, 15: 1}
OK	57377-32-9	C[C@@H]1C[C@@H]2[C@H](C[C@]3([C@H]1C[C@@H](O[C@H]3O)O)C)C(=C)C(=O)O2	{1: 2, 5: 1, 11: 3, 12: 6, 13: 1, 15: 1, 20: 2, 23: 1, 28: 1}
OK	5739-17-3	CCCCCC1=C(C(=O)CC1)C	{1: 2, 2: 4, 11: 2, 25: 1, 15: 2}
OK	57392-55-9	CC(C)CCOC(=O)C(Cl)(Cl)Cl	{1: 2, 2: 2, 3: 1, 4: 1, 17: 3, 28: 1}
OK	57396-75-5	CC=CC=C(C)C(=CC)C	{1: 4, 6: 4, 7: 2}
OK	57403-32-4	CCCCCC=CC(=O)OCCCC	{1: 2, 2: 7, 28: 1, 6: 2}
OK	57409-52-6	CCCC(C)(CCC)CO	{1: 3, 2: 5, 4: 1, 20: 1}
OK	57409-53-7	CCC(C)C(C)(C)CO	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	57413-34-0	CCCCCCCCCCCCCCCC(=O)N(C(C)C)C(C)C	{24: 1, 1: 5, 2: 14, 3: 2, 33: 1}
OK	57417-85-3	CC(C)CCCCCCCCCCOC(=O)CS	{1: 2, 2: 11, 3: 1, 28: 1, 39: 1}
OK	5743-97-5	C1CCC2C(C1)CCC3C2CCCC3	{11: 10, 12: 4}
OK	5744-03-6	C1CCC2C(C1)CC3C2CCCC3	{11: 9, 12: 4}
OK	57448-83-6	C([C@@H](C1C(=C(C(=O)O1)O)O)O)O.C1(C(=O)NC(=O)N1)NC(=O)N	{32: 2, 2: 1, 3: 1, 12: 2, 15: 2, 20: 4, 24: 1, 25: 2, 28: 1, 30: 1, 31: 1}
OK	5746-90-7	CC(=CC(=O)O)CC(=O)O	{1: 1, 2: 1, 27: 2, 6: 1, 7: 1}
OK	57460-65-8	CCOC(=O)C=C.CC(=C)C1=NCCO1.CC(=C)C(=O)OC	{1: 4, 2: 1, 35: 1, 5: 3, 6: 1, 7: 2, 11: 2, 15: 1, 23: 1, 28: 2}
OK	5749-72-4	CC(=C1CCCCC1)C	{15: 1, 1: 2, 11: 5, 7: 1}
OK	5749-78-0	CCC(OC/C=C/C)OC/C=C/C	{1: 3, 2: 3, 3: 1, 22: 2, 6: 4}
OK	57490-81-0	CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)O	{1: 3, 11: 8, 12: 5, 13: 3, 20: 2, 24: 1, 25: 1}
OK	57491-35-7	CCCCC=CCCCCCCCCC=CCCOC(=O)C	{1: 2, 2: 13, 28: 1, 6: 4}
OK	5750-02-7	CCC(C)C1CC1	{11: 2, 1: 2, 2: 1, 3: 1, 12: 1}
OK	57503-67-0	CN1C(=O)COCC1=O	{1: 1, 11: 2, 25: 2, 33: 1, 23: 1}
OK	57516-73-1	C=C1COC2(OCCCO2)OC1	{15: 1, 23: 4, 11: 5, 5: 1, 13: 1}
OK	57520-17-9	CC(=O)O.CC(=O)O.CC(=O)O.C(CCCCN=C(N)N)CCCNCCCCCCCCN=C(N)N	{1: 3, 2: 16, 7: 2, 34: 2, 27: 3, 30: 4, 31: 1}
OK	57523-94-1	CC1CC(=O)C=C(C1CC=C(C)C)C	{1: 4, 2: 1, 6: 1, 7: 1, 11: 1, 12: 2, 14: 1, 15: 1, 25: 1}
OK	57526-28-0	CCC(C)C(=O)Cl	{24: 1, 1: 2, 2: 1, 3: 1, 17: 1}
OK	5754-89-2	C1CN(CN(C1)[N+](=O)[O-])[N+](=O)[O-]	{33: 2, 11: 4, 38: 2}
OK	5754-90-5	C1CCN(CN(C1)[N+](=O)[O-])[N+](=O)[O-]	{33: 2, 11: 5, 38: 2}
OK	57541-72-7	C1CN(CC(C1Cl)Cl)N=O	{33: 1, 34: 1, 11: 3, 12: 2, 17: 2, 29: 1}
OK	57541-73-8	C1CN(CC(C1Br)Br)N=O	{33: 1, 34: 1, 11: 3, 12: 2, 18: 2, 29: 1}
OK	57556-03-3	CCC1=CC(=O)C(S1)C	{1: 2, 2: 1, 41: 1, 12: 1, 14: 1, 15: 1, 25: 1}
OK	57556-04-4	CC1C(=O)C=C(S1)C(C)C	{1: 3, 3: 1, 41: 1, 12: 1, 14: 1, 15: 1, 25: 1}
OK	57556-05-5	CC1C(=O)C=C(S1)C(C)(C)C	{1: 4, 4: 1, 41: 1, 12: 1, 14: 1, 15: 1, 25: 1}
OK	57556-06-6	CCC1C(=O)C=C(S1)C	{1: 2, 2: 1, 41: 1, 12: 1, 14: 1, 15: 1, 25: 1}
OK	57556-07-7	CC1=CC(=O)C(S1)C(C)(C)C	{1: 4, 4: 1, 41: 1, 12: 1, 14: 1, 15: 1, 25: 1}
OK	57556-09-9	CC1=CC(=O)C(S1)(C)C	{1: 3, 41: 1, 13: 1, 14: 1, 15: 1, 25: 1}
OK	57556-14-6	CC(C)(C)C1=CCSC1=O	{1: 3, 4: 1, 41: 1, 11: 1, 14: 1, 15: 1, 25: 1}
OK	57556-15-7	CC1=C(C(=O)SC1)C(C)(C)C	{1: 4, 4: 1, 41: 1, 11: 1, 15: 2, 25: 1}
OK	57556-18-0	CC1(C=CSC1=O)C(C)(C)C	{1: 4, 4: 1, 41: 1, 13: 1, 14: 2, 25: 1}
OK	5756-24-1	CSSSSC	{40: 4, 1: 2}
OK	5756-37-6	CCCCCOC(C)C	{1: 3, 2: 4, 3: 1, 22: 1}
OK	5756-43-4	CCCCCCOCC	{1: 2, 2: 6, 22: 1}
OK	57564-91-7	C(CC(=O)NC(CSN=O)C(=O)NCC(=O)O)C(C(=O)O)N	{2: 4, 3: 2, 40: 1, 34: 1, 24: 2, 27: 2, 29: 1, 30: 1, 31: 2}
OK	57565-08-9	C1CCC2(CC1)COC3(OC2)OCC4(CCCCC4)CO3	{11: 14, 13: 3, 23: 4}
OK	57567-83-6	CN(C)CCCN(CCO)CCO	{1: 2, 2: 7, 20: 2, 33: 2}
OK	57567-84-7	CC1CCC(C(C1)C(=O)O)C(=O)O	{27: 2, 1: 1, 11: 3, 12: 3}
OK	57576-09-7	C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C)C(=C)C	{1: 3, 5: 1, 7: 1, 11: 3, 12: 3, 28: 1}
OK	57576-15-5	CC1=C(C(CCC1)(C)C)CC#N	{1: 3, 2: 1, 37: 1, 11: 3, 13: 1, 15: 2}
OK	57586-92-2	CCC=CCCCCCCCCCCOC1CCCCO1	{1: 1, 2: 11, 6: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	57590-20-2	CCCC/C=N/N(C)C=O	{1: 2, 2: 3, 6: 1, 33: 1, 34: 1, 26: 1}
OK	57595-39-8	C1CC2C=CC3C2C1CC3	{11: 4, 12: 4, 14: 2}
OK	57597-62-3	COC(CC#N)OC	{1: 2, 2: 1, 3: 1, 37: 1, 22: 2}
OK	576-68-1	C(CCl)NC[C@H]([C@H]([C@@H]([C@@H](CNCCCl)O)O)O)O	{17: 2, 2: 6, 3: 4, 20: 4, 31: 2}
OK	5760-73-6	C(CNCCNCCN)C#N	{2: 6, 37: 1, 30: 1, 31: 2}
OK	57602-94-5	CCCCCC=CCCC(=O)O	{1: 1, 2: 6, 27: 1, 6: 2}
OK	57602-97-8	CC(C)(C)C(C(C)(C)C)S	{1: 6, 3: 1, 4: 2, 39: 1}
OK	57604-92-9	C(CC(=O)O)CC(=O)O.C(CNCCN)N	{2: 7, 27: 2, 30: 2, 31: 1}
OK	57619-29-1	CN1CC=CC=C1/C=N/O.Cl	{1: 1, 34: 1, 6: 1, 33: 1, 11: 1, 14: 3, 15: 1, 17: 1, 20: 1}
OK	57619-91-7	C1COC=CC(C1=COC=C2CCOC=CC2(O)O)(O)O	{6: 2, 11: 4, 13: 2, 14: 4, 15: 2, 20: 4, 22: 1, 23: 2}
OK	57620-56-1	CC(C)(CCC1OCCO1)[N+](=O)[O-]	{1: 2, 2: 2, 4: 1, 38: 1, 11: 2, 12: 1, 23: 2}
OK	57629-90-0	CCCCOCNCN=O	{1: 1, 2: 5, 34: 1, 22: 1, 29: 1, 31: 1}
OK	5763-45-1	C1CC2CC1C(=O)NC2=O	{32: 1, 25: 2, 11: 3, 12: 2}
OK	57635-61-7	CCCCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCCNC(C)(C)C.C=CC(=O)OCCO	{1: 7, 2: 7, 4: 1, 5: 4, 6: 2, 7: 2, 20: 1, 28: 4, 31: 1}
OK	57642-95-2	CC=CO	{1: 1, 20: 1, 6: 2}
OK	57644-85-6	CC(C)(/C=N/OC(=O)N(C)N=O)SC	{1: 4, 34: 2, 4: 1, 6: 1, 33: 1, 40: 1, 28: 1, 29: 1}
OK	57647-92-4	CCOC(=O)CC1=CCCC1	{1: 1, 2: 2, 11: 3, 14: 1, 15: 1, 28: 1}
OK	57651-82-8	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@@H](CCC3=C)O)C	{1: 4, 2: 3, 3: 2, 5: 1, 6: 2, 11: 8, 12: 3, 13: 1, 15: 3, 20: 1}
OK	5766-67-6	C(CN(CC#N)CC#N)N(CC#N)CC#N	{33: 2, 2: 6, 37: 4}
OK	57661-23-1	CCCCCCCCCCC(=O)CCCCC	{24: 1, 1: 2, 2: 13}
OK	5767-20-4	C1CCN2CN3CCCCN3CN2C1	{33: 4, 11: 10}
OK	57670-85-6	C(#N)SSSC#N	{40: 3, 37: 2}
OK	57683-45-1	CCCCCCCCC=CCCCCCCCC(=O)OCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 29, 3: 1, 28: 1, 6: 2}
OK	57693-77-3	CCC1C(=C(C(=C1C)C)C)C	{1: 5, 2: 1, 12: 1, 15: 4}
OK	577-37-7	C1CCN2C[C@H]3C[C@H]([C@@H]2C1)C(=O)N4[C@@H]3CCCC4	{25: 1, 11: 10, 12: 4, 33: 2}
OK	5770-03-6	CCCCCCCC(CCCCC)O	{1: 2, 2: 10, 3: 1, 20: 1}
OK	5771-02-8	CC(=NNC)C	{1: 3, 34: 1, 31: 1, 7: 1}
OK	57716-89-9	CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)OC)CO)[C@H]4[C@@]1(C4(C)C)OC(=O)C)O)C	{1: 7, 2: 13, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 2, 22: 1, 25: 1, 28: 2}
OK	57744-39-5	CC1(CC(C(=O)C(=O)C1=O)(C)C)C	{1: 4, 11: 1, 13: 2, 25: 3}
OK	57744-40-8	C1CC2CCC1C(=O)C(=O)C2=O	{25: 3, 11: 4, 12: 2}
OK	57757-60-5	CCC(C)(C)N(C)C	{1: 5, 2: 1, 4: 1, 33: 1}
OK	57781-14-3	CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@H](C4=CC(=O)C(=C[C@@]43C)Br)F)F)O)C)OC(=O)C	{1: 4, 2: 1, 11: 4, 12: 4, 13: 4, 14: 2, 15: 2, 16: 2, 18: 1, 20: 1, 24: 1, 25: 1, 28: 2}
OK	57794-08-8	C1CC[C@@H]([C@H](C1)O)O	{20: 2, 11: 4, 12: 2}
OK	57807-80-4	CC(C)CCCCCOC(=O)CCCl	{1: 2, 2: 7, 3: 1, 28: 1, 17: 1}
OK	5781-53-3	COC(=O)C(=O)Cl	{24: 1, 1: 1, 28: 1, 17: 1}
OK	57839-84-6	CN1CCCCC(=C)CCCC1	{1: 1, 33: 1, 11: 8, 5: 1, 15: 1}
OK	57843-53-5	CC(CN(CC(C)O)C(=O)CCCCC(=O)N(CC(C)O)CC(C)O)O	{1: 4, 2: 8, 3: 4, 33: 2, 20: 4, 24: 2}
OK	57855-22-8	CCCCC=CBr	{1: 1, 2: 3, 18: 1, 6: 2}
OK	57856-10-7	CCC(C(=O)C)(Cl)Cl	{24: 1, 1: 2, 2: 1, 4: 1, 17: 2}
OK	57856-81-2	CCCCCCCCCC(=O)OCC=C	{1: 1, 2: 9, 28: 1, 5: 1, 6: 1}
OK	57858-34-1	CCCCCC(C)OC	{1: 3, 2: 4, 3: 1, 22: 1}
OK	57877-72-2	CCCCCCCCC1C(=O)C=C(O1)C	{1: 2, 2: 7, 12: 1, 14: 1, 15: 1, 23: 1, 25: 1}
OK	57893-27-3	CC1CCC2(O1)C(CCCC2(C)OC(=O)C)(C)C	{1: 5, 11: 5, 12: 1, 13: 3, 23: 1, 28: 1}
OK	579-04-4	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O)OC)O	{1: 2, 11: 1, 12: 4, 20: 2, 22: 1, 23: 1}
OK	579-58-8	CNNC.Cl	{1: 2, 31: 2, 17: 1}
OK	579-94-2	CCOCC(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)C)C	{1: 4, 2: 2, 3: 1, 11: 3, 12: 3, 22: 1, 28: 1}
OK	57905-89-2	CC(C)(C)CC(C)(C)N=NC(C)(C)C	{1: 8, 2: 1, 4: 3, 34: 2}
OK	57910-39-1	CC(C)(C)N=NC(C)(C)O	{1: 5, 34: 2, 4: 2, 20: 1}
OK	57910-79-9	CCC(C)(N=NC(C)(C)C)O	{1: 5, 2: 1, 4: 2, 34: 2, 20: 1}
OK	57916-91-3	CC1CO1.C1CO1.C(=C/C(=O)O)\C(=O)O	{1: 1, 6: 2, 11: 3, 12: 1, 23: 2, 27: 2}
OK	57933-83-2	CC(=C)OC(=O)Cl	{1: 1, 17: 1, 5: 1, 28: 1, 7: 1}
OK	57934-98-2	CCC1=C(C(CCC1)(C)C)C(=O)C=CC	{1: 4, 2: 1, 6: 2, 11: 3, 13: 1, 15: 2, 24: 1}
OK	57934-99-3	CCC1=CCCC(C1C(=O)C=CC)(C)C	{1: 4, 2: 1, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	57935-00-9	CC=CC(=O)C1C(=CC)CCCC1(C)C	{1: 4, 6: 3, 11: 3, 12: 1, 13: 1, 15: 1, 24: 1}
OK	5794-03-6	CC1([C@@H]2CC[C@@H](C2)C1=C)C	{1: 2, 5: 1, 11: 3, 12: 2, 13: 1, 15: 1}
OK	57947-82-7	C=CCOCCOCCOCC=C	{2: 6, 22: 3, 5: 2, 6: 2}
OK	5796-86-1	CCCCCCCCCCCCCCCCCC(=O)OO	{1: 1, 2: 16, 20: 1, 28: 1}
OK	57966-40-2	CCCC(C)OC(=O)C(C)CC	{1: 4, 2: 3, 3: 2, 28: 1}
OK	57966-95-7	CCNC(=O)NC(=O)C(=NOC)C#N	{1: 2, 2: 1, 37: 1, 7: 1, 34: 1, 22: 1, 24: 2, 31: 2}
OK	5798-88-9	CC(C)(CC(=O)O)Br	{1: 2, 2: 1, 27: 1, 4: 1, 18: 1}
OK	57981-60-9	CCCCCC=CCC=CCCCOC(=O)C	{1: 2, 2: 8, 28: 1, 6: 4}
OK	57984-32-4	CCCC(=C(CCC)CCC)CCC	{1: 4, 2: 8, 7: 2}
OK	57998-68-2	CCOC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)OCC)N3CC3	{1: 2, 2: 2, 33: 2, 11: 4, 15: 4, 25: 2, 28: 2, 31: 2}
OK	58-18-4	CC12CCC(=O)C=C1CCC3C2CCC4(C3CCC4(C)O)C	{1: 3, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 20: 1, 25: 1}
OK	58-20-8	CC12CCC3C(C1CCC2OC(=O)CCC4CCCC4)CCC5=CC(=O)CCC35C	{1: 2, 2: 2, 11: 12, 12: 5, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	58-22-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CC[C@]34C	{1: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	58-85-5	C1[C@H]2[C@@H]([C@@H](S1)CCCCC(=O)O)NC(=O)N2	{32: 2, 2: 4, 41: 1, 11: 1, 12: 3, 25: 1, 27: 1}
OK	58-89-9	C1(C(C(C(C(C1Cl)Cl)Cl)Cl)Cl)Cl	{17: 6, 12: 6}
OK	58-96-8	C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O	{32: 1, 33: 1, 2: 1, 12: 4, 14: 2, 20: 3, 23: 1, 25: 2}
OK	580-49-4	CC1CC2C(CC=C1C(CC(=O)C)OC(=O)C)C(=C)C(=O)O2	{1: 3, 2: 1, 3: 1, 5: 1, 11: 2, 12: 3, 14: 1, 15: 2, 24: 1, 28: 2}
OK	5800-63-5	C1CN(CN(CN1[N+](=O)[O-])N=O)[N+](=O)[O-]	{33: 3, 34: 1, 11: 4, 29: 1, 38: 2}
OK	58012-66-1	CCOC(=O)CCC1CCC(=O)CC1	{1: 1, 2: 3, 11: 4, 12: 1, 25: 1, 28: 1}
OK	5802-82-4	CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 24, 28: 1}
OK	58046-40-5	CC(C)CCC(C)(C(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	58048-85-4	CCCCOC(=O)C=C.CC(=C)C(=O)OCCN(C)C.CC(=O)OC=C	{1: 5, 2: 5, 5: 3, 6: 2, 7: 1, 33: 1, 28: 3}
OK	58049-91-5	CC1(CCC=C1)C	{1: 2, 11: 2, 13: 1, 14: 2}
OK	58050-49-0	CCOC(=O)NCN1CCOCC1	{1: 1, 2: 2, 33: 1, 11: 4, 23: 1, 28: 1, 31: 1}
OK	5806-90-6	CC(=O)NOC	{24: 1, 1: 2, 22: 1, 31: 1}
OK	5807-14-7	C1CNC2=NCCCN2C1	{32: 1, 33: 1, 11: 6, 35: 1, 15: 1}
OK	58070-68-1	COCCCCC1CCCCC1	{1: 1, 2: 4, 11: 5, 12: 1, 22: 1}
OK	5809-08-5	CC(C)(C)CC(C)(C)OO	{1: 5, 2: 1, 4: 2, 22: 1, 20: 1}
OK	5809-54-1	CCC(=C)C1CC1	{1: 1, 2: 1, 5: 1, 7: 1, 11: 2, 12: 1}
OK	5809-59-6	C=C(C#N)O	{37: 1, 20: 1, 5: 1, 7: 1}
OK	5810-82-2	C1C2CC(C1C=C2)Br	{18: 1, 11: 2, 12: 3, 14: 2}
OK	58100-26-8	C([C@@H](C(=O)NN)N)S	{2: 1, 3: 1, 39: 1, 24: 1, 30: 2, 31: 1}
OK	58113-54-5	CC1(CC(CC(N1)(C)C)C(=O)OC)C	{32: 1, 1: 5, 11: 2, 12: 1, 13: 2, 28: 1}
OK	5813-48-9	CSCl	{40: 1, 1: 1, 17: 1}
OK	5813-49-0	CC(=O)ON=O	{1: 1, 34: 1, 28: 1, 29: 1}
OK	5813-64-9	CC(C)(C)CN	{1: 3, 2: 1, 4: 1, 30: 1}
OK	58130-93-1	C1C(S1)CC#N	{41: 1, 2: 1, 11: 1, 12: 1, 37: 1}
OK	58133-26-9	CCCCCC(Br)Br	{1: 1, 2: 4, 3: 1, 18: 2}
OK	58145-14-5	C(CN(CCN)CCO)N	{33: 1, 2: 6, 20: 1, 30: 2}
OK	58152-03-7	CC1(COC(C(C1NC)O)OC2C(CC(C(C2O)OC3C(C(C(C(O3)CN)O)O)O)N)NC(=O)C(CN)O)O	{1: 2, 2: 2, 3: 1, 11: 2, 12: 13, 13: 1, 20: 7, 22: 2, 23: 2, 24: 1, 30: 3, 31: 2}
OK	58159-12-9	CCCCC(C(CCC)O)O	{1: 2, 2: 5, 3: 2, 20: 2}
OK	5817-08-3	CC(=O)NC(CCC(=O)O)C(=O)O	{1: 1, 2: 2, 3: 1, 24: 1, 27: 2, 31: 1}
OK	58175-57-8	CCCC(CCC)CO	{1: 2, 2: 5, 3: 1, 20: 1}
OK	58190-94-6	CCC(C)(C(=O)OCC)Cl	{1: 3, 2: 2, 4: 1, 28: 1, 17: 1}
OK	58194-00-6	C(=O)(C(C(F)(F)F)(OC(C(C(OC(F)(F)F)(F)F)(F)F)(F)F)F)F	{16: 14, 24: 1, 4: 6, 22: 2}
OK	58196-47-7	C1CC1NCCC#N	{2: 2, 11: 2, 12: 1, 37: 1, 31: 1}
OK	582-52-5	CC1(OC[C@H](O1)[C@@H]2[C@@H]([C@@H]3[C@H](O2)OC(O3)(C)C)O)C	{1: 4, 11: 1, 12: 5, 13: 2, 20: 1, 23: 5}
OK	58208-49-4	C1C2=C1C2	{11: 2, 15: 2}
OK	58223-34-0	CC(C)CCCC(C)CC=CC(=CC(=O)Cl)C	{1: 4, 2: 4, 3: 2, 6: 3, 7: 1, 17: 1, 24: 1}
OK	5824-85-1	CC(C)NN(C)C	{1: 4, 3: 1, 33: 1, 31: 1}
OK	58243-08-6	CCOC=CC#N	{1: 1, 2: 1, 22: 1, 6: 2, 37: 1}
OK	58258-44-9	CCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 26, 28: 2, 6: 2}
OK	5826-73-3	COC(=O)C1C2CC(C1C(=O)OC)C=C2	{1: 2, 11: 1, 12: 4, 14: 2, 28: 2}
OK	58275-58-4	CC(=O)C1C2CC3CC(C2)C1C3	{24: 1, 1: 1, 11: 4, 12: 5}
OK	58279-48-4	CC(C)N=C(C)C(=NC(C)C)C	{1: 6, 34: 2, 3: 2, 7: 2}
OK	58295-64-0	CCOC(=O)C=C.CC(=C)C(=C)O.C=CCl	{1: 2, 2: 1, 5: 4, 6: 2, 7: 2, 17: 1, 20: 1, 28: 1}
OK	58296-43-8	C1CCCCC(=O)OCCCCOC(=O)CCC1	{11: 12, 28: 2}
OK	583-48-2	CCC(C)C(C)CC	{1: 4, 2: 2, 3: 2}
OK	583-57-3	CC1CCCCC1C	{1: 2, 11: 4, 12: 2}
OK	583-59-5	CC1CCCCC1O	{1: 1, 11: 4, 12: 2, 20: 1}
OK	583-60-8	CC1CCCCC1=O	{1: 1, 11: 4, 12: 1, 25: 1}
OK	583-63-1	C1=CC(=O)C(=O)C=C1	{25: 2, 14: 4}
OK	583-91-5	CSCCC(C(=O)O)O	{1: 1, 2: 2, 3: 1, 40: 1, 20: 1, 27: 1}
OK	583-93-7	C(CC(C(=O)O)N)CC(C(=O)O)N	{27: 2, 2: 3, 3: 2, 30: 2}
OK	5830-30-8	CCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 4, 33: 1}
OK	5834-84-4	CCCOC(=O)CCC(=O)N(CC)CC	{24: 1, 1: 3, 2: 6, 28: 1, 33: 1}
OK	58349-83-0	CCCCCCCCCCCCCCCCCCCCC(C)CCCCCCCCCCC	{1: 3, 2: 29, 3: 1}
OK	58349-84-1	CCCCCCCCCCCCCCCCCCC(C)CCCCCCCCCCCCC	{1: 3, 2: 29, 3: 1}
OK	58349-86-3	CCCCCCCCCCCCCCCCCCCCCCCCC(C)CCCCCCCC	{1: 3, 2: 30, 3: 1}
OK	58349-88-5	CCCCCCCCCCCCCCCCC(C)CCCCCCCCCCCCCCCC	{1: 3, 2: 30, 3: 1}
OK	5835-26-7	C[C@]12CCC[C@@](C1CC=C3C2CCC(C3)(C)C=C)(C)C(=O)O	{1: 3, 5: 1, 6: 1, 11: 7, 12: 2, 13: 3, 14: 1, 15: 1, 27: 1}
OK	5836-66-8	COCC(CBr)Br	{1: 1, 2: 2, 3: 1, 18: 2, 22: 1}
OK	5837-45-6	CC(=CC(=O)CC(=C)C)C	{1: 3, 2: 1, 5: 1, 6: 1, 7: 2, 24: 1}
OK	5837-78-5	CCOC(=O)/C(=C/C)/C	{1: 3, 2: 1, 28: 1, 6: 1, 7: 1}
OK	5837-93-4	CCCC(C)(C)C(=O)OCC	{1: 4, 2: 3, 4: 1, 28: 1}
OK	58371-98-5	CC(=O)C(CCCl)Cl	{24: 1, 1: 1, 2: 2, 3: 1, 17: 2}
OK	58391-29-0	CCCCCCCCCCCC(=O)O.CC1CO1.C1CO1	{1: 2, 2: 10, 11: 3, 12: 1, 23: 2, 27: 1}
OK	584-02-1	CCC(CC)O	{1: 2, 2: 2, 3: 1, 20: 1}
OK	584-03-2	CCC(CO)O	{1: 1, 2: 2, 3: 1, 20: 2}
OK	584-04-3	C(C(CS)O)S	{2: 2, 3: 1, 20: 1, 39: 2}
OK	584-13-4	C1=NN=CN1N	{33: 1, 35: 2, 30: 1, 14: 2}
OK	584-20-3	C(C(C(F)(F)F)N)C(=O)O	{2: 1, 3: 1, 4: 1, 16: 3, 27: 1, 30: 1}
OK	584-27-0	CC(=C(CC(=O)O)C(=O)O)C	{1: 2, 2: 1, 27: 2, 7: 2}
OK	584-79-2	CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=C	{1: 5, 2: 1, 5: 1, 6: 2, 7: 1, 11: 1, 12: 3, 13: 1, 15: 2, 25: 1, 28: 1}
OK	584-92-9	CCCCC/C(=N\O)/C(=O)C	{1: 2, 2: 4, 7: 1, 34: 1, 20: 1, 24: 1}
OK	584-93-0	CCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 2, 3: 1, 18: 1}
OK	584-94-1	CCCC(C)C(C)C	{1: 4, 2: 2, 3: 2}
OK	584-99-6	C(=C(\C(=O)O)/Br)\C(=O)O	{18: 1, 27: 2, 6: 1, 7: 1}
OK	5842-00-2	CCCCNCCS	{1: 1, 2: 5, 39: 1, 31: 1}
OK	5842-07-9	CC(C)N(CCS)C(C)C	{1: 4, 2: 2, 3: 2, 39: 1, 33: 1}
OK	58428-97-0	CCCC(=O)OCC(CSC(=O)CCC)SC(=O)CCC	{1: 3, 2: 8, 3: 1, 40: 2, 24: 2, 28: 1}
OK	5843-42-5	COC(=O)N=C=O	{8: 1, 1: 1, 34: 1, 28: 1, 29: 1}
OK	58430-94-7	CC(CCOC(=O)C)CC(C)(C)C	{1: 5, 2: 3, 3: 1, 4: 1, 28: 1}
OK	58431-24-6	CCN(C(C)OC(=O)C)N=O	{1: 3, 2: 1, 3: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	58434-77-8	C/C=C(\C)/C=C/C=C	{1: 2, 5: 1, 6: 4, 7: 1}
OK	58435-05-5	C=C1CCC23C1(C(=C)CC2)C(=O)CC3	{15: 2, 25: 1, 11: 6, 5: 2, 13: 2}
OK	58437-71-1	CC1(C2CCC(C2)C1=CCO)C	{1: 2, 2: 1, 6: 1, 11: 3, 12: 2, 13: 1, 15: 1, 20: 1}
OK	58443-86-0	C(CC(CBr)Br)C(CBr)Br	{2: 4, 3: 2, 18: 4}
OK	58444-07-8	CCCCC#CCCC#CCCCCCCCl	{1: 1, 2: 11, 10: 4, 17: 1}
OK	58447-69-1	CCOC(=O)C(C)(C(C)C)C(=O)OCC	{1: 5, 2: 2, 3: 1, 4: 1, 28: 2}
OK	5845-61-4	C[C@H]1C(=O)N[C@H](C(=O)N1)C	{32: 2, 1: 2, 12: 2, 25: 2}
OK	58461-87-3	C=C1CCC23C1(C(=C)CC2)C(=C)CC3	{15: 3, 11: 6, 5: 3, 13: 2}
OK	58471-09-3	CC(C)(C)CNC(C)(C)C	{1: 6, 2: 1, 4: 2, 31: 1}
OK	58477-85-3	C=CCNC(=O)[C@@H]([C@H](C(=O)NCC=C)O)O	{2: 2, 3: 2, 5: 2, 6: 2, 20: 2, 24: 2, 31: 2}
OK	58484-07-4	C(CCl)N(C(=O)N[C@H]1C([C@H]([C@@H]([C@H](O1)CO)O)O)O)N=O	{33: 1, 2: 3, 12: 5, 34: 1, 17: 1, 20: 4, 23: 1, 24: 1, 29: 1, 31: 1}
OK	58494-43-2	C1CC[C@H]([C@@H](C1)NC(=O)N(CCCl)N=O)O	{33: 1, 2: 2, 11: 4, 12: 2, 34: 1, 17: 1, 20: 1, 24: 1, 29: 1, 31: 1}
OK	585-07-9	CC(=C)C(=O)OC(C)(C)C	{1: 4, 4: 1, 5: 1, 28: 1, 7: 1}
OK	585-25-1	CCCCCC(=O)C(=O)C	{24: 2, 1: 2, 2: 4}
OK	585-86-4	C(C1C(C(C(C(O1)OC(C(CO)O)C(C(CO)O)O)O)O)O)O	{2: 3, 3: 4, 12: 5, 20: 9, 22: 1, 23: 1}
OK	5853-08-7	CC(=O)OCC1C(C(C(C(O1)OC(C(COC(=O)C)OC(=O)C)C(C(C=O)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 8, 2: 2, 3: 4, 12: 5, 22: 1, 23: 1, 26: 1, 28: 8}
OK	58531-29-6	CC1CCCNC1.Cl	{32: 1, 1: 1, 11: 4, 12: 1, 17: 1}
OK	58539-11-0	CCOC(=O)C(CBr)CBr	{1: 1, 2: 3, 3: 1, 28: 1, 18: 2}
OK	5854-93-3	C([C@@H](C(=O)O)N)N(N=O)O	{33: 1, 2: 1, 3: 1, 34: 1, 20: 1, 27: 1, 29: 1, 30: 1}
OK	58551-69-2	CCCCC[C@@](C)(/C=C/[C@H]1[C@@H](C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)O)O.C(C(CO)(CO)N)O	{1: 2, 2: 11, 4: 2, 6: 4, 11: 1, 12: 4, 20: 6, 27: 1, 30: 1}
OK	5856-62-2	CC[C@@H](CO)N	{1: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	5856-63-3	CC[C@H](CO)N	{1: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	5856-66-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 52}
OK	5856-67-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 55}
OK	5856-77-9	CCC(C)(C)C(=O)Cl	{24: 1, 1: 3, 2: 1, 4: 1, 17: 1}
OK	5856-82-6	CCCC(=O)Br	{24: 1, 1: 1, 2: 2, 18: 1}
OK	58561-04-9	CC(C)[C@@H](C(=O)OC)NC(=O)OC(C)(C)C	{1: 6, 3: 2, 4: 1, 28: 2, 31: 1}
OK	58567-11-6	CCOCOC1CCCCCCCCCCC1	{1: 1, 2: 2, 11: 11, 12: 1, 22: 2}
OK	58569-87-2	CC(=[N+](C)C)Cl.[Cl-]	{1: 3, 17: 2, 33: 1, 7: 1}
OK	5857-25-0	CCC1=C(CCC1=O)O	{1: 1, 2: 1, 11: 2, 15: 2, 20: 1, 25: 1}
OK	5857-36-3	CC(C)C(=O)C(C)(C)C	{24: 1, 1: 5, 3: 1, 4: 1}
OK	5857-68-1	CC(C)(C)C(=C)C(C)(C)C	{1: 6, 4: 2, 5: 1, 7: 1}
OK	5857-69-2	CC(C)(C)C(C)(C(C)(C)C)O	{1: 7, 4: 3, 20: 1}
OK	58576-98-0	CCCCCC(C)(C#N)N	{1: 2, 2: 4, 4: 1, 37: 1, 30: 1}
OK	58577-00-7	CCCCCC(C)(C#N)N=NC(C)(CCCCC)C#N	{1: 4, 2: 8, 4: 2, 34: 2, 37: 2}
OK	58577-08-5	CCCC(C)(C#N)N	{1: 2, 2: 2, 4: 1, 37: 1, 30: 1}
OK	58577-17-6	CCCCCC(C)(C#N)N=NC(C)(CCC)C#N	{1: 4, 2: 6, 4: 2, 34: 2, 37: 2}
OK	58581-03-6	CC(C)C1(CCC2(C(C1)O2)C)O	{1: 3, 3: 1, 11: 3, 12: 1, 13: 2, 20: 1, 23: 1}
OK	58585-94-7	N(=O)I	{34: 1, 19: 1, 29: 1}
OK	58598-43-9	CCCCCC(C)(C#N)N=NC(C)(CC)C#N	{1: 4, 2: 5, 4: 2, 34: 2, 37: 2}
OK	586-62-9	CC1=CCC(=C(C)C)CC1	{15: 2, 1: 3, 11: 3, 14: 1, 7: 1}
OK	586-63-0	CC1CCC(=C(C)C)C=C1	{1: 3, 7: 1, 11: 2, 12: 1, 14: 2, 15: 1}
OK	586-67-4	CC1CCC(=CC1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	586-81-2	CC(=C1CCC(CC1)(C)O)C	{1: 3, 7: 1, 11: 4, 13: 1, 15: 1, 20: 1}
OK	586-82-3	CC(C)C1=CCC(CC1)(C)O	{1: 3, 3: 1, 11: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	5860-30-0	C/C=C(\C)/C1CC1	{1: 2, 11: 2, 12: 1, 6: 1, 7: 1}
OK	58605-97-3	CC(C)CC(=CCCC(=CC=O)C)C	{1: 4, 2: 3, 3: 1, 6: 2, 7: 2, 26: 1}
OK	58616-95-8	C1[C@H]([C@@H]1C(=O)O)C(=O)O	{27: 2, 11: 1, 12: 2}
OK	5862-40-8	CC(=O)OCCS	{1: 1, 2: 2, 28: 1, 39: 1}
OK	5862-53-3	CC1CSC(S1)(C)C	{1: 3, 11: 1, 12: 1, 13: 1, 41: 2}
OK	58628-98-1	CC1C(OC(=O)N1)C	{32: 1, 1: 2, 12: 2, 28: 1}
OK	58629-01-9	CC1(COC(=O)N1Cl)C	{1: 2, 33: 1, 11: 1, 13: 1, 17: 1, 28: 1}
OK	5865-15-6	CC(C)SCCSC(C)C	{40: 2, 1: 4, 2: 2, 3: 2}
OK	58653-97-7	CC1(CO1)C(=O)OC	{1: 2, 11: 1, 28: 1, 13: 1, 23: 1}
OK	58654-36-7	CC(C)CCC(=NNC(C)(C)C)C	{1: 6, 2: 2, 3: 1, 4: 1, 7: 1, 34: 1, 31: 1}
OK	58654-67-4	CCCC(C)CCC(=O)C	{24: 1, 1: 3, 2: 4, 3: 1}
OK	58668-40-9	CCCCCCCCCCCCCCCCC(C)CCCC(C)CCCC(C)CCCCCCCCCCCC	{1: 5, 2: 32, 3: 3}
OK	58670-89-6	CCCCCCCCCCCCC(CCCCCCCCCC)CO	{1: 2, 2: 21, 3: 1, 20: 1}
OK	58675-12-0	CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C1CCC(=O)OCC1	{1: 3, 2: 1, 34: 2, 8: 2, 11: 8, 12: 1, 13: 2, 28: 1, 29: 2}
OK	58695-41-3	C1CCC(CC1)NCC(=O)O	{27: 1, 2: 1, 11: 5, 12: 1, 31: 1}
OK	5870-61-1	C(=C(Cl)Cl)Br	{17: 2, 18: 1, 6: 1, 7: 1}
OK	5870-62-2	C1CC(=O)C=C1O	{25: 1, 11: 2, 20: 1, 14: 1, 15: 1}
OK	5870-63-3	CC1=C(CCC1=O)O	{1: 1, 11: 2, 20: 1, 25: 1, 15: 2}
OK	5870-68-8	CCC(C)CC(=O)OCC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	5870-82-6	CCOC(C)CC(OCC)OCC	{1: 4, 2: 4, 3: 2, 22: 3}
OK	5870-93-9	CCCCCCCOC(=O)CCC	{1: 2, 2: 8, 28: 1}
OK	58715-08-5	C(C([N+](=O)[O-])([N+](=O)[O-])F)OC(OCC([N+](=O)[O-])([N+](=O)[O-])F)(F)F	{16: 4, 2: 2, 4: 3, 38: 4, 22: 2}
OK	58738-49-1	C1CCC2(C=C2)C3(CC1)C=C3	{11: 5, 13: 2, 14: 4}
OK	5875-24-1	C(CCl)C(=O)N	{24: 1, 17: 1, 2: 2, 30: 1}
OK	58751-77-2	CCCC1N(O1)C	{1: 2, 2: 2, 12: 1, 33: 1, 23: 1}
OK	58751-78-3	C[N+](=C1CCCCC1)[O-]	{1: 1, 33: 1, 11: 5, 29: 1, 15: 1}
OK	5876-87-9	C=CCCCCCCCCC=C	{2: 8, 5: 2, 6: 2}
OK	58763-65-8	CCC#CC=CCCCBr	{1: 1, 2: 4, 18: 1, 10: 2, 6: 2}
OK	58763-67-0	CCC#CC=CCCCCCCOC(C)OCC	{1: 3, 2: 8, 3: 1, 6: 2, 10: 2, 22: 2}
OK	58763-68-1	CCC#CC=CCCCCCCO	{1: 1, 2: 7, 20: 1, 10: 2, 6: 2}
OK	5877-42-9	CCCCC(CC)C(C#C)O	{1: 2, 2: 4, 3: 2, 9: 1, 10: 1, 20: 1}
OK	5877-76-9	CCCCCCCCCCCCCCCCNCC	{1: 2, 2: 16, 31: 1}
OK	58772-83-1	CC(CCC=C(C)C)CCC=O	{1: 3, 2: 4, 3: 1, 6: 1, 7: 1, 26: 1}
OK	5878-19-3	CC(=O)COC	{24: 1, 1: 2, 2: 1, 22: 1}
OK	58783-82-7	CCCCCCCCC(CCCC)O	{1: 2, 2: 10, 3: 1, 20: 1}
OK	58790-01-5	CC1=CC=CC2=CC=CC=C1C2	{1: 1, 11: 1, 14: 7, 15: 3}
OK	58793-73-0	CCCCCCCCCC(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 14, 27: 1, 20: 3, 33: 1}
OK	58797-58-3	CC(O)COC(C)COC(C)(C)C	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1, 22: 2}
OK	588-43-2	CCCCOC(OCCCC)OCCCC	{1: 3, 2: 9, 3: 1, 22: 3}
OK	5881-17-4	CCCCCC(CC)CC	{1: 3, 2: 6, 3: 1}
OK	58853-55-7	COC1=CC=CC2=CC=CC=C1C2	{1: 1, 11: 1, 22: 1, 14: 7, 15: 3}
OK	58859-46-4	CCOC(=O)N1CCC(CC1)N	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 28: 1, 30: 1}
OK	5888-33-5	C[C@]12CC[C@H](C1(C)C)CC2OC(=O)C=C	{1: 3, 5: 1, 6: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	5888-39-1	CC(=O)OC1CC2CC1CC2OC(=O)C	{1: 2, 11: 3, 12: 4, 28: 2}
OK	5888-87-9	C1CCC(=O)N(CC1)C(=O)NCCCCCCNC(=O)N2CCCCCC2=O	{33: 2, 2: 6, 11: 10, 24: 2, 25: 2, 31: 2}
OK	589-32-2	CCN(CC)CCSSCCN(CC)CC	{40: 2, 1: 4, 2: 8, 33: 2}
OK	589-33-3	CCCCN1C=CC=C1	{1: 1, 2: 3, 14: 4, 33: 1}
OK	589-34-4	CCCC(C)CC	{1: 3, 2: 3, 3: 1}
OK	589-35-5	CCC(C)CCO	{1: 2, 2: 3, 3: 1, 20: 1}
OK	589-37-7	CCC(CCN)N	{1: 1, 2: 3, 3: 1, 30: 2}
OK	589-38-8	CCCC(=O)CC	{24: 1, 1: 2, 2: 3}
OK	589-41-3	CCOC(=O)NO	{1: 1, 2: 1, 20: 1, 28: 1, 31: 1}
OK	589-43-5	CCC(C)CC(C)C	{1: 4, 2: 2, 3: 2}
OK	589-44-6	C(C(CO)N)C(=O)O	{27: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	589-53-7	CCCC(C)CCC	{1: 3, 2: 4, 3: 1}
OK	589-55-9	CCCC(CCC)O	{1: 2, 2: 4, 3: 1, 20: 1}
OK	589-59-3	CC(C)CC(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 28: 1}
OK	589-62-8	CCCCC(CCC)O	{1: 2, 2: 5, 3: 1, 20: 1}
OK	589-63-9	CCCCC(=O)CCC	{24: 1, 1: 2, 2: 5}
OK	589-66-2	CC=CC(=O)OCC(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 6: 2}
OK	589-68-4	CCCCCCCCCCCCCC(=O)OCC(CO)O	{1: 1, 2: 14, 3: 1, 20: 2, 28: 1}
OK	589-75-3	CCCCCCCC(=O)OCCCC	{1: 2, 2: 9, 28: 1}
OK	589-79-7	CCOC(=O)CCCCCF	{16: 1, 1: 1, 2: 6, 28: 1}
OK	589-81-1	CCCCC(C)CC	{1: 3, 2: 4, 3: 1}
OK	589-82-2	CCCCC(CC)O	{1: 2, 2: 4, 3: 1, 20: 1}
OK	589-91-3	CC1CCC(O)CC1	{1: 1, 11: 4, 12: 2, 20: 1}
OK	589-92-4	CC1CCC(=O)CC1	{1: 1, 11: 4, 12: 1, 25: 1}
OK	589-96-8	CC(=O)O.C(C(CCl)Cl)O	{1: 1, 2: 2, 3: 1, 17: 2, 20: 1, 27: 1}
OK	589-98-0	CCCCCC(CC)O	{1: 2, 2: 5, 3: 1, 20: 1}
OK	5891-06-5	CCCCCCCCCCNCCS	{1: 1, 2: 11, 39: 1, 31: 1}
OK	5891-21-4	CC(=O)CCCCl	{24: 1, 1: 1, 2: 3, 17: 1}
OK	5891-25-8	CC(C)(C)C(=O)C#C	{24: 1, 1: 3, 10: 1, 4: 1, 9: 1}
OK	58911-30-1	C1(N=N1)(C(F)(F)F)Cl	{16: 3, 17: 1, 35: 2, 4: 1, 13: 1}
OK	58913-91-0	C1C2C=CC3C2C1C=C3	{11: 1, 12: 4, 14: 4}
OK	58917-39-8	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@H](C2)CC[C@@H]4[C@@H]3CC[C@]5(C4(CC[C@@H]5C6=CC(=O)OC6)O)C)C=O)O)O)O	{1: 2, 11: 10, 12: 10, 13: 3, 14: 1, 15: 1, 20: 4, 22: 1, 23: 1, 26: 1, 28: 1}
OK	58927-81-4	CCC=CCC(C)O	{1: 2, 2: 2, 3: 1, 20: 1, 6: 2}
OK	58941-14-3	C(C(=O)O)N(Cl)Cl	{17: 2, 2: 1, 27: 1, 33: 1}
OK	58943-75-2	CCCCCCCCCCCCCCCOCCCN	{1: 1, 2: 17, 30: 1, 22: 1}
OK	58946-24-0	C1CCC/C=C\2/CCC23COCC3CCC1	{11: 11, 12: 1, 13: 1, 14: 1, 15: 1, 23: 1}
OK	58962-41-7	CCCCCC(=O)NCCCCNC(=O)CCCCC	{24: 2, 1: 2, 2: 12, 31: 2}
OK	58979-41-2	C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F	{16: 59, 3: 1, 4: 28, 22: 9}
OK	59-01-8	C1[C@H]([C@@H]([C@H]([C@@H]([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN)O)O)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)O)N	{2: 2, 11: 1, 12: 15, 20: 7, 22: 2, 23: 2, 30: 4}
OK	59-23-4	O=C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO	{2: 1, 3: 4, 20: 5, 26: 1}
OK	59-51-8	CSCCC(C(=O)O)N	{1: 1, 2: 2, 3: 1, 40: 1, 27: 1, 30: 1}
OK	59-52-9	C(C(CS)S)O	{2: 2, 3: 1, 20: 1, 39: 2}
OK	59-53-0	CC(=O)NC(C(=O)O)C(C)(C)S	{1: 3, 3: 1, 4: 1, 39: 1, 24: 1, 27: 1, 31: 1}
OK	59-89-2	C1COCCN1N=O	{33: 1, 34: 1, 11: 4, 29: 1, 23: 1}
OK	590-01-2	CCCCOC(=O)CC	{1: 2, 2: 4, 28: 1}
OK	590-02-3	CCCCOC(=O)CCl	{1: 1, 2: 4, 28: 1, 17: 1}
OK	590-14-7	CC=CBr	{1: 1, 18: 1, 6: 2}
OK	590-15-8	C/C=C/Br	{1: 1, 18: 1, 6: 2}
OK	590-16-9	C(CI)Br	{2: 2, 19: 1, 18: 1}
OK	590-17-0	C(C#N)Br	{2: 1, 18: 1, 37: 1}
OK	590-18-1	C/C=C\C	{1: 2, 6: 2}
OK	590-19-2	CC=C=C	{8: 1, 1: 1, 5: 1, 6: 1}
OK	590-21-6	CC=CCl	{1: 1, 6: 2, 17: 1}
OK	590-35-2	CCCC(C)(C)C	{1: 4, 2: 2, 4: 1}
OK	590-36-3	CCCC(C)(C)O	{1: 3, 2: 2, 4: 1, 20: 1}
OK	590-38-5	CC#CC(C)(C)O	{1: 3, 10: 2, 4: 1, 20: 1}
OK	590-50-1	CC(=O)CC(C)(C)C	{24: 1, 1: 4, 2: 1, 4: 1}
OK	590-60-3	CCC(C)(C)OC(=O)N	{1: 3, 2: 1, 4: 1, 30: 1, 28: 1}
OK	590-66-9	CC1(CCCCC1)C	{1: 2, 11: 5, 13: 1}
OK	590-67-0	CC1(CCCCC1)O	{1: 1, 11: 5, 20: 1, 13: 1}
OK	590-71-6	CCCC=C=CC(C)(C)C=O	{1: 3, 2: 2, 4: 1, 6: 2, 8: 1, 26: 1}
OK	590-73-8	CCCCC(C)(C)C	{1: 4, 2: 3, 4: 1}
OK	590-86-3	CC(C)CC=O	{1: 2, 2: 1, 3: 1, 26: 1}
OK	590-87-4	CCCC(C)F	{16: 1, 1: 2, 2: 2, 3: 1}
OK	590-88-5	CC(CCN)N	{1: 1, 2: 2, 3: 1, 30: 2}
OK	590-90-9	CC(=O)CCO	{24: 1, 1: 1, 2: 2, 20: 1}
OK	590-92-1	C(CBr)C(=O)O	{2: 2, 27: 1, 18: 1}
OK	590-93-2	CC#CC(=O)O	{1: 1, 10: 2, 27: 1}
OK	590-96-5	C[N+](=NCO)[O-]	{1: 1, 2: 1, 33: 1, 34: 1, 20: 1, 29: 1}
OK	590-97-6	CC(=O)OCBr	{1: 1, 2: 1, 28: 1, 18: 1}
OK	59006-05-2	CC(C)(C)CF	{16: 1, 1: 3, 2: 1, 4: 1}
OK	59007-89-5	CC1COC(O1)CCSC	{1: 2, 2: 2, 40: 1, 11: 1, 12: 2, 23: 2}
OK	59012-19-0	C(=NF)F	{16: 2, 34: 1, 6: 1}
OK	59014-95-8	C1C2CC3CC1C4CC3C4C2	{11: 5, 12: 6}
OK	59020-33-6	CC1(CC1)C2(CC2)C	{1: 2, 11: 4, 13: 2}
OK	59034-32-1	COC1=C(C1(F)F)F	{16: 3, 1: 1, 13: 1, 22: 1, 15: 2}
OK	59034-34-3	COC1=C(C1(F)F)Cl	{1: 1, 13: 1, 15: 2, 16: 2, 17: 1, 22: 1}
OK	5904-70-1	CC(=O)OC(C1(C=CC(O1)[N+](=O)[O-])OC(=O)C)OC(=O)C	{1: 3, 3: 1, 38: 1, 12: 1, 13: 1, 14: 2, 23: 1, 28: 3}
OK	5905-46-4	CCCSS/C=C/C	{40: 2, 1: 2, 2: 2, 6: 2}
OK	5905-47-5	CC=CSSC	{40: 2, 1: 2, 6: 2}
OK	59056-66-5	CC1(CCC(C23C14C2CC(C4)C3(C)C)C=O)C	{1: 4, 26: 1, 11: 4, 12: 3, 13: 4}
OK	59056-72-3	CC(=O)C1CCC(C23C14C2CC(C3)C4(C)C)(C)C	{24: 1, 1: 5, 11: 4, 12: 3, 13: 4}
OK	59056-93-8	C[C@H]1CC2=C(C[C@@]1(C)C(=O)C)C(CCC2)(C)C	{1: 5, 11: 5, 12: 1, 13: 2, 15: 2, 24: 1}
OK	5906-35-4	C1CCCN(CC1)N	{33: 1, 11: 6, 30: 1}
OK	59070-48-3	CCCCC(CC)COC(=O)C=C.CC(=C)C(=O)O.CC(=O)OC=C	{1: 4, 2: 5, 3: 1, 5: 3, 6: 2, 7: 1, 27: 1, 28: 2}
OK	59078-44-3	C1CC1=C=O	{8: 1, 11: 2, 29: 1, 15: 1}
OK	5908-87-2	CCCCCCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 21, 28: 1}
OK	59086-92-9	CCCCCCCCCC(=O)OC12C(C1(C)C)C3C=C(CC4(C(C3(C(C2OC(=O)C(=CC)C)C)O)C=C(C4=O)C)O)CO	{1: 7, 2: 9, 6: 1, 7: 1, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	591-07-1	CC(=O)NC(=O)N	{24: 2, 1: 1, 30: 1, 31: 1}
OK	591-11-7	CC1C=CC(=O)O1	{1: 1, 12: 1, 14: 2, 28: 1}
OK	591-12-8	CC1=CCC(=O)O1	{1: 1, 11: 1, 28: 1, 14: 1, 15: 1}
OK	591-21-9	CC1CCCC(C1)C	{1: 2, 11: 4, 12: 2}
OK	591-23-1	CC1CCCC(C1)O	{1: 1, 11: 4, 12: 2, 20: 1}
OK	591-24-2	CC1CCCC(=O)C1	{1: 1, 11: 4, 12: 1, 25: 1}
OK	591-34-4	CCC(C)OC(=O)CC	{1: 3, 2: 2, 3: 1, 28: 1}
OK	591-47-9	CC1CCC=CC1	{1: 1, 11: 3, 12: 1, 14: 2}
OK	591-48-0	CC1CCCC=C1	{1: 1, 11: 3, 12: 1, 14: 2}
OK	591-49-1	CC1=CCCCC1	{1: 1, 11: 4, 14: 1, 15: 1}
OK	591-60-6	CCCCOC(=O)CC(=O)C	{24: 1, 1: 2, 2: 4, 28: 1}
OK	591-62-8	CCCCNC(=O)OCC	{1: 2, 2: 4, 28: 1, 31: 1}
OK	591-68-4	CCCCC(=O)OCCCC	{1: 2, 2: 6, 28: 1}
OK	591-76-4	CCCCC(C)C	{1: 3, 2: 3, 3: 1}
OK	591-78-6	CCCCC(=O)C	{24: 1, 1: 2, 2: 3}
OK	591-80-0	C=CCCC(=O)O	{2: 2, 27: 1, 5: 1, 6: 1}
OK	591-81-1	C(CC(=O)O)CO	{2: 3, 27: 1, 20: 1}
OK	591-84-4	CC(C)CSC#N	{40: 1, 1: 2, 2: 1, 3: 1, 37: 1}
OK	591-87-7	CC(=O)OCC=C	{1: 1, 2: 1, 28: 1, 5: 1, 6: 1}
OK	591-93-5	C=CCC=C	{2: 1, 5: 2, 6: 2}
OK	591-95-7	CCC=C=C	{8: 1, 1: 1, 2: 1, 5: 1, 6: 1}
OK	591-96-8	CC=C=CC	{8: 1, 1: 2, 6: 2}
OK	591-97-9	CC=CCCl	{1: 1, 2: 1, 6: 2, 17: 1}
OK	5910-28-1	C1C=CCC2=C1CC3=C(C2)CC=CC3	{11: 6, 14: 4, 15: 4}
OK	5910-77-0	CCCCCCCCCCCCCN(CCCCCCCCCCCCC)CCCCCCCCCCCCC	{1: 3, 2: 36, 33: 1}
OK	5910-87-2	CCCCC=CC=CC=O	{1: 1, 2: 3, 26: 1, 6: 4}
OK	5911-04-6	CCCCCCC(C)CC	{1: 3, 2: 6, 3: 1}
OK	5911-05-7	CCCCCC(CC)CCC	{1: 3, 2: 7, 3: 1}
OK	5911-08-0	C1CC1CCl	{17: 1, 2: 1, 11: 2, 12: 1}
OK	59117-77-0	CCCCCCCCCCC(C(=O)Cl)Cl	{24: 1, 1: 1, 2: 9, 3: 1, 17: 2}
OK	59120-04-6	C=CC(=C)O	{20: 1, 5: 2, 6: 1, 7: 1}
OK	59121-24-3	CSCCCC#N	{40: 1, 1: 1, 2: 3, 37: 1}
OK	59121-25-4	C[C@@H]1CC[C@@H]2[C@H]1COC(=O)[C@H]2C	{1: 2, 11: 3, 12: 4, 28: 1}
OK	59122-46-2	CCCCC(C)(C/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCCCCC(=O)OC)O)O	{1: 3, 2: 10, 4: 1, 6: 2, 11: 1, 12: 3, 20: 2, 25: 1, 28: 1}
OK	59122-55-3	CCCCCCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O	{1: 1, 2: 12, 12: 5, 20: 4, 22: 1, 23: 1}
OK	59123-41-0	CC1(CCCCCCC1)O	{1: 1, 11: 7, 20: 1, 13: 1}
OK	59127-80-9	CCNCCCC(=O)C	{24: 1, 1: 2, 2: 4, 31: 1}
OK	5913-13-3	C[C@H](C1CCCCC1)N	{11: 5, 1: 1, 3: 1, 12: 1, 30: 1}
OK	59130-69-7	CCCCCCCCCCCCCCCCOC(=O)C(CC)CCCC	{1: 3, 2: 19, 3: 1, 28: 1}
OK	59154-46-0	CCOC(=O)C(C)CBr	{1: 2, 2: 2, 3: 1, 28: 1, 18: 1}
OK	59157-17-4	CCCCCCCCCCCC(C)Br	{1: 2, 2: 10, 3: 1, 18: 1}
OK	5917-47-5	CCCCCCCCCCCCN1CCCCC1	{1: 1, 2: 11, 11: 5, 33: 1}
OK	5917-61-3	CC(COCOCC(C)([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 2, 2: 3, 4: 2, 38: 4, 22: 2}
OK	59171-38-9	C1CC2CC1C=CO2	{11: 3, 12: 2, 14: 2, 23: 1}
OK	59177-62-7	CNCC12CC3CC(C1)CC(C3)C2Cl.Cl	{1: 1, 2: 1, 11: 5, 12: 4, 13: 1, 17: 2, 31: 1}
OK	59177-70-7	CNC1C2CCC3C1CC(C3)C2.Cl	{31: 1, 1: 1, 11: 5, 12: 5, 17: 1}
OK	59177-76-3	CNCC1C2CCC3C1CC(C3)C2.C(=CC(=O)O)C(=O)O	{1: 1, 2: 1, 6: 2, 11: 5, 12: 5, 27: 2, 31: 1}
OK	59177-85-4	CNCC12CC3CC(C1)CC(C3)C2Br.Cl	{1: 1, 2: 1, 11: 5, 12: 4, 13: 1, 17: 1, 18: 1, 31: 1}
OK	5919-74-4	CC(=C)C(=O)OCC(CO)O	{1: 1, 2: 2, 3: 1, 5: 1, 7: 1, 20: 2, 28: 1}
OK	59198-70-8	CCCCC(=O)OCC(=O)[C@H]1[C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)O)C)C	{1: 4, 2: 4, 11: 3, 12: 6, 13: 3, 14: 3, 15: 1, 16: 2, 20: 1, 24: 1, 25: 1, 28: 1}
OK	592-13-2	CC(C)CCC(C)C	{1: 4, 2: 2, 3: 2}
OK	592-17-6	CC(C)CNC(=O)N	{1: 2, 2: 1, 3: 1, 24: 1, 30: 1, 31: 1}
OK	592-20-1	CC(=O)COC(=O)C	{24: 1, 1: 2, 2: 1, 28: 1}
OK	592-27-8	CCCCCC(C)C	{1: 3, 2: 4, 3: 1}
OK	592-31-4	CCCCNC(=O)N	{24: 1, 1: 1, 2: 3, 30: 1, 31: 1}
OK	592-34-7	CCCCOC(=O)Cl	{1: 1, 2: 3, 28: 1, 17: 1}
OK	592-35-8	CCCCOC(=O)N	{1: 1, 2: 3, 28: 1, 30: 1}
OK	592-41-6	CCCCC=C	{1: 1, 2: 3, 5: 1, 6: 1}
OK	592-42-7	C=CCCC=C	{2: 2, 5: 2, 6: 2}
OK	592-43-8	CCC/C=C/C	{1: 2, 2: 2, 6: 2}
OK	592-44-9	CCCC=C=C	{8: 1, 1: 1, 2: 2, 5: 1, 6: 1}
OK	592-45-0	CC=CCC=C	{1: 1, 2: 1, 5: 1, 6: 3}
OK	592-46-1	CC=CC=CC	{1: 2, 6: 4}
OK	592-48-3	CC/C=C/C=C	{1: 1, 2: 1, 5: 1, 6: 3}
OK	592-49-4	CCC=C=CC	{8: 1, 1: 2, 2: 1, 6: 2}
OK	592-50-7	CCCCCF	{16: 1, 1: 1, 2: 4}
OK	592-51-8	C=CCCC#N	{2: 2, 5: 1, 6: 1, 37: 1}
OK	592-55-2	CCOCCBr	{1: 1, 2: 3, 18: 1, 22: 1}
OK	592-56-3	C/C=N/N=C/C	{1: 2, 34: 2, 6: 2}
OK	592-57-4	C1CC=CC=C1	{11: 2, 14: 4}
OK	592-62-1	CC(=O)OCN=[N+](C)[O-]	{1: 2, 2: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	592-65-4	CC(C)CSCC(C)C	{40: 1, 1: 4, 2: 2, 3: 2}
OK	592-76-7	CCCCCC=C	{1: 1, 2: 4, 5: 1, 6: 1}
OK	592-78-9	CCC/C=C/CC	{1: 2, 2: 3, 6: 2}
OK	592-79-0	C(CCN)CCF	{16: 1, 2: 5, 30: 1}
OK	592-80-3	C(CCO)CCF	{16: 1, 2: 5, 20: 1}
OK	592-88-1	C=CCSCC=C	{40: 1, 2: 2, 5: 2, 6: 2}
OK	592-90-5	C1CCCOCC1	{11: 6, 23: 1}
OK	592-94-9	CCCCCCCC(=O)F	{16: 1, 1: 1, 2: 6, 24: 1}
OK	5921-54-0	CC/C(=N/N=C(/C)\CC)/C	{1: 4, 2: 2, 34: 2, 7: 2}
OK	5921-73-3	CCCCCCC#CCO	{1: 1, 2: 6, 20: 1, 10: 2}
OK	5921-80-2	CCCCOC(CCC)OCCCC	{1: 3, 2: 8, 3: 1, 22: 2}
OK	5921-82-4	CCCCCC(C)OC(=O)C	{1: 3, 2: 4, 3: 1, 28: 1}
OK	5921-84-6	CCCC(CCC)OC(=O)C	{1: 3, 2: 4, 3: 1, 28: 1}
OK	5921-87-9	CCCCC(CCC)OC(=O)C	{1: 3, 2: 5, 3: 1, 28: 1}
OK	59219-71-5	CC(CCOC(=O)CC(C)CC(C)(C)C)CC(C)(C)C	{1: 8, 2: 5, 3: 2, 4: 2, 28: 1}
OK	5922-69-0	CN(C)CCCNC=O	{1: 2, 2: 3, 33: 1, 26: 1, 31: 1}
OK	59222-86-5	CCCCCCCCCCCCC(C)(C)C	{1: 4, 2: 11, 4: 1}
OK	59228-00-1	C(C(C(Br)Br)O)Br	{2: 1, 3: 2, 20: 1, 18: 3}
OK	59231-34-4	CCCCCCCCC=CCCCCCCCC(=O)OCCCCCCCC(C)C	{1: 3, 2: 21, 3: 1, 28: 1, 6: 2}
OK	59231-35-5	CC(C)CCCCCCCOC(=O)CC(C)CC(C)(C)C	{1: 6, 2: 9, 3: 2, 4: 1, 28: 1}
OK	59231-42-4	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(CO)NCCO	{1: 1, 2: 16, 6: 4, 20: 2, 27: 1, 31: 1}
OK	5926-87-4	C(CO)C(C(F)F)(F)F	{16: 4, 20: 1, 2: 2, 3: 1, 4: 1}
OK	5926-90-9	CCCCCCOCC1CO1	{1: 1, 2: 6, 11: 1, 12: 1, 22: 1, 23: 1}
OK	5927-57-1	CCCCCCOC(=O)CCl	{1: 1, 2: 6, 28: 1, 17: 1}
OK	5929-72-6	CC(C)(C#CC#CC(C)(C)O)O	{1: 4, 10: 4, 4: 2, 20: 2}
OK	593-03-3	CCCCCCCCCCCCCC(CC)O	{1: 2, 2: 13, 3: 1, 20: 1}
OK	593-08-8	CCCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 10}
OK	593-12-4	C(CCCCBr)CCCF	{16: 1, 2: 8, 18: 1}
OK	593-14-6	C(CCCCCl)CCCF	{16: 1, 17: 1, 2: 8}
OK	593-32-8	CCCCCCCCCCCCCCCCC(C)O	{1: 2, 2: 15, 3: 1, 20: 1}
OK	593-33-9	CCCCCCCCCCCCCCF	{16: 1, 1: 1, 2: 13}
OK	593-39-5	CCCCCCCCCCCC=CCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 6: 2}
OK	593-45-3	CCCCCCCCCCCCCCCCCC	{1: 2, 2: 16}
OK	593-49-7	CCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 25}
OK	593-50-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 29, 20: 1}
OK	593-51-1	CN.Cl	{1: 1, 30: 1, 17: 1}
OK	593-53-3	CF	{16: 1, 1: 1}
OK	593-55-5	CCN.Br	{1: 1, 2: 1, 18: 1, 30: 1}
OK	593-56-6	CON.Cl	{1: 1, 30: 1, 22: 1, 17: 1}
OK	593-60-2	C=CBr	{18: 1, 5: 1, 6: 1}
OK	593-61-3	C#CBr	{9: 1, 10: 1, 18: 1}
OK	593-63-5	C#CCl	{9: 1, 10: 1, 17: 1}
OK	593-66-8	C=CI	{19: 1, 5: 1, 6: 1}
OK	593-67-9	C=CN	{30: 1, 5: 1, 6: 1}
OK	593-70-4	C(F)Cl	{16: 1, 17: 1, 2: 1}
OK	593-71-5	C(Cl)I	{17: 1, 2: 1, 19: 1}
OK	593-77-1	CNO	{1: 1, 20: 1, 31: 1}
OK	593-78-2	COCl	{1: 1, 22: 1, 17: 1}
OK	593-81-7	CN(C)C.Cl	{1: 3, 33: 1, 17: 1}
OK	593-82-8	CN(C)N.Cl	{1: 2, 33: 1, 30: 1, 17: 1}
OK	593-87-3	CC(=O)O.C(=N)(N)N	{1: 1, 27: 1, 36: 1, 30: 2, 7: 1}
OK	593-92-0	C=C(Br)Br	{18: 2, 5: 1, 7: 1}
OK	593-94-2	C(Br)(Br)I	{19: 1, 18: 2, 3: 1}
OK	593-95-3	C(=O)(Br)Br	{24: 1, 18: 2}
OK	593-96-4	CC(Cl)Br	{1: 1, 18: 1, 3: 1, 17: 1}
OK	593-98-6	C(F)(Cl)Br	{16: 1, 17: 1, 18: 1, 3: 1}
OK	59300-35-5	CCCCN(CC#C)C(=O)SCC	{1: 2, 2: 5, 33: 1, 40: 1, 9: 1, 10: 1, 24: 1}
OK	59313-59-6	CCC1C(C12C=CC=C2)CC	{1: 2, 2: 2, 12: 2, 13: 1, 14: 4}
OK	5932-53-6	CN1C2CC(C1CC(=O)C2)O	{1: 1, 33: 1, 11: 3, 12: 3, 20: 1, 25: 1}
OK	5932-79-6	CCCCCC(CCC)O	{1: 2, 2: 6, 3: 1, 20: 1}
OK	59346-69-9	C12C3C4C1C5C2C3C45Br	{18: 1, 12: 7, 13: 1}
OK	59346-70-2	C12C3C4C1(C5C2C3(C45)Br)Br	{18: 2, 12: 6, 13: 2}
OK	5935-25-1	C=CC1OCCCO1	{11: 3, 12: 1, 5: 1, 6: 1, 23: 2}
OK	59355-75-8	CC#C.C=C=C	{8: 1, 1: 1, 10: 1, 5: 2, 9: 1}
OK	59357-07-2	CC(C)C(=O)CC(C)O	{24: 1, 1: 3, 2: 1, 3: 2, 20: 1}
OK	59388-64-6	C1CC2(CCC1C2)N=NC34CCC(C3)CC4	{34: 2, 11: 10, 12: 2, 13: 2}
OK	594-02-5	CC(I)I	{19: 2, 1: 1, 3: 1}
OK	594-04-7	C(Cl)(Cl)I	{19: 1, 17: 2, 3: 1}
OK	594-11-6	CC1CC1	{1: 1, 11: 2, 12: 1}
OK	594-15-0	C(Cl)(Br)(Br)Br	{17: 1, 18: 3, 4: 1}
OK	594-16-1	CC(C)(Br)Br	{1: 2, 18: 2, 4: 1}
OK	594-17-2	CC(Cl)(Br)Br	{1: 1, 18: 2, 4: 1, 17: 1}
OK	594-18-3	C(Cl)(Cl)(Br)Br	{17: 2, 18: 2, 4: 1}
OK	594-20-7	CC(C)(Cl)Cl	{1: 2, 4: 1, 17: 2}
OK	594-21-8	CC(I)(I)I	{1: 1, 19: 3, 4: 1}
OK	594-23-0	C(Cl)(Cl)(I)I	{17: 2, 19: 2, 4: 1}
OK	594-36-5	CCC(C)(C)Cl	{1: 3, 2: 1, 4: 1, 17: 1}
OK	594-37-6	CC(C)(CCl)Cl	{1: 2, 2: 1, 4: 1, 17: 2}
OK	594-38-7	CCC(C)(C)I	{1: 3, 2: 1, 19: 1, 4: 1}
OK	594-39-8	CCC(C)(C)N	{1: 3, 2: 1, 4: 1, 30: 1}
OK	594-42-3	C(SCl)(Cl)(Cl)Cl	{40: 1, 17: 4, 4: 1}
OK	594-47-8	C(=O)(C(Br)(Br)Br)N	{24: 1, 18: 3, 4: 1, 30: 1}
OK	594-51-4	CC(C(C)(C)Br)Br	{1: 3, 18: 2, 3: 1, 4: 1}
OK	594-52-5	CC(C)C(C)(C)Br	{1: 4, 18: 1, 3: 1, 4: 1}
OK	594-56-9	CC(=C)C(C)(C)C	{1: 4, 4: 1, 5: 1, 7: 1}
OK	594-57-0	CC(C)C(C)(C)Cl	{1: 4, 3: 1, 4: 1, 17: 1}
OK	594-58-1	CC(C)(C(=O)O)Cl	{1: 2, 27: 1, 4: 1, 17: 1}
OK	594-59-2	CC(C)C(C)(C)I	{19: 1, 1: 4, 3: 1, 4: 1}
OK	594-60-5	CC(C)C(C)(C)O	{1: 4, 3: 1, 4: 1, 20: 1}
OK	594-61-6	CC(C)(C(=O)O)O	{1: 2, 27: 1, 4: 1, 20: 1}
OK	594-65-0	C(=O)(C(Cl)(Cl)Cl)N	{24: 1, 17: 3, 4: 1, 30: 1}
OK	594-70-7	CC(C)(C)[N+](=O)[O-]	{1: 3, 4: 1, 38: 1}
OK	594-71-8	CC(C)([N+](=O)[O-])Cl	{1: 2, 4: 1, 38: 1, 17: 1}
OK	594-72-9	CC([N+](=O)[O-])(Cl)Cl	{1: 1, 4: 1, 38: 1, 17: 2}
OK	594-73-0	C(C(Br)(Br)Br)(Br)(Br)Br	{18: 6, 4: 2}
OK	594-81-0	CC(C)(C(C)(C)Br)Br	{1: 4, 18: 2, 4: 2}
OK	594-82-1	CC(C)(C)C(C)(C)C	{1: 6, 4: 2}
OK	594-83-2	CC(C)(C)C(C)(C)O	{1: 5, 4: 2, 20: 1}
OK	594-85-4	CC(C)(C(C)(C)Cl)Cl	{1: 4, 4: 2, 17: 2}
OK	594-89-8	C(C(C(Cl)(Cl)Cl)(Cl)Cl)(Cl)Cl	{17: 7, 3: 1, 4: 2}
OK	594-91-2	C(C(C(F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 12, 4: 5}
OK	59403-01-9	C=C/C=C/NC(=O)C(Cl)(Cl)Cl	{4: 1, 5: 1, 6: 3, 17: 3, 24: 1, 31: 1}
OK	59411-58-4	C1CCC(CC1)C(CO)O	{11: 5, 20: 2, 2: 1, 3: 1, 12: 1}
OK	59424-37-2	CCC(CO)(CO)COCC=C.C(COCCO)O.C(CSCCO)O	{1: 1, 2: 13, 4: 1, 5: 1, 6: 1, 40: 1, 20: 6, 22: 2}
OK	59426-77-6	C(C(OC(F)(F)F)(F)F)(C(F)(F)F)(F)F	{16: 10, 4: 4, 22: 1}
OK	5943-30-6	CCC(C)SSC(C)CC	{40: 2, 1: 4, 2: 2, 3: 2}
OK	5945-40-4	C[C@@H]1C[C@@H]2[C@H](C[C@@H]3[C@H]1C=CC3=O)C(=C)C(=O)O2	{1: 1, 5: 1, 11: 2, 12: 5, 14: 2, 15: 1, 25: 1, 28: 1}
OK	5947-36-4	CC1(C2CC1C(=C)C(C2)O)C	{1: 2, 5: 1, 11: 2, 12: 3, 13: 1, 15: 1, 20: 1}
OK	59480-92-1	CC1C=CC(N1)C	{32: 1, 1: 2, 12: 2, 14: 2}
OK	59485-81-3	CCCCCCCC/C=C\CCCCCCCCCl	{1: 1, 2: 15, 6: 2, 17: 1}
OK	5949-05-3	C[C@@H](CCC=C(C)C)CC=O	{1: 3, 2: 3, 3: 1, 6: 1, 7: 1, 26: 1}
OK	5949-44-0	CCCCCCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C	{1: 3, 2: 9, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	595-21-1	CC1[C@@H](C(C([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CCC4C3CC[C@]5([C@@]4(CC([C@@H]5C6=CC(=O)OC6)O)O)C)C)O)OC)O	{1: 4, 11: 9, 12: 11, 13: 3, 14: 1, 15: 1, 20: 4, 22: 2, 23: 1, 28: 1}
OK	595-33-5	CC1=C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)OC(=O)C)C)[C@@]4(C1=CC(=O)CC4)C	{1: 5, 11: 6, 12: 3, 13: 3, 14: 2, 15: 2, 24: 1, 25: 1, 28: 1}
OK	595-37-9	CCC(C)(C)C(=O)O	{1: 3, 2: 1, 27: 1, 4: 1}
OK	595-38-0	CCC(C)(C(C)C)Cl	{1: 4, 2: 1, 3: 1, 4: 1, 17: 1}
OK	595-41-5	CCC(C)(C(C)C)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1}
OK	595-42-6	CCC(C)(C)[N+](=O)[O-]	{1: 3, 2: 1, 4: 1, 38: 1}
OK	595-44-8	CCC([N+](=O)[O-])(Cl)Cl	{1: 1, 2: 1, 4: 1, 38: 1, 17: 2}
OK	595-46-0	CC(C)(C(=O)O)C(=O)O	{1: 2, 27: 2, 4: 1}
OK	595-49-3	CC(C)([N+](=O)[O-])[N+](=O)[O-]	{1: 2, 4: 1, 38: 2}
OK	595-71-1	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@]3(CC[C@@H]4C(=O)CO)O)C	{1: 2, 2: 1, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1}
OK	595-86-8	CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 4: 1, 38: 3}
OK	595-98-2	CC(C(=O)O)(C(=O)O)O	{1: 1, 27: 2, 4: 1, 20: 1}
OK	5950-19-6	CC(=O)C(C)(C)Cl	{24: 1, 1: 3, 4: 1, 17: 1}
OK	59507-56-1	CSC#CSC	{40: 2, 1: 2, 10: 2}
OK	5951-67-7	CC(C)C1=CC(=C(C)C)CC[C@@]1(C)C=C	{1: 5, 3: 1, 5: 1, 6: 1, 7: 1, 11: 2, 13: 1, 14: 1, 15: 2}
OK	5952-26-1	C(COC(=O)N)OCCOC(=O)N	{2: 4, 28: 2, 30: 2, 22: 1}
OK	5953-49-1	CCCCC(C)OC(=O)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	5953-76-4	CC=C(C)C(=O)OC	{1: 3, 28: 1, 6: 1, 7: 1}
OK	5954-71-2	C[C@@H]1[C@@H](S1)C	{1: 2, 12: 2, 41: 1}
OK	5954-75-6	C=CC1CS1	{41: 1, 11: 1, 12: 1, 5: 1, 6: 1}
OK	59547-52-3	C1CSSC1CCCCC(=O)NCCCC(=O)O	{2: 7, 41: 2, 11: 2, 12: 1, 24: 1, 27: 1, 31: 1}
OK	5955-98-6	C[C@H]1[C@@H](S1)C	{1: 2, 12: 2, 41: 1}
OK	59554-08-4	CC(C)C(C)(OC)OC	{1: 5, 3: 1, 4: 1, 22: 2}
OK	59557-05-0	C[C@H]1CC[C@@H]([C@H](C1)OC(=O)CC(=O)C)C(C)C	{1: 4, 2: 1, 3: 1, 11: 3, 12: 3, 24: 1, 28: 1}
OK	5956-09-2	CC1CCCC2(C13CC(CC2)C(O3)(C)C)C	{1: 4, 11: 6, 12: 2, 13: 3, 23: 1}
OK	59562-82-2	CC(C)(C)C(CO)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 2}
OK	59570-04-6	CCCCCCCCCCCNCC	{1: 2, 2: 11, 31: 1}
OK	59570-06-8	CCCCCCCCCCCCCNCC	{1: 2, 2: 13, 31: 1}
OK	5959-95-5	C(CC(=O)N)[C@H](C(=O)O)N	{24: 1, 27: 1, 2: 2, 3: 1, 30: 2}
OK	596-75-8	CCCCC(CCCC)(C(=O)OCC)C(=O)OCC	{1: 4, 2: 8, 4: 1, 28: 2}
OK	596-84-9	C[C@@]1(CC[C@H]2[C@@]3(CCCC([C@H]3CC[C@@]2(O1)C)(C)C)C)C=C	{1: 5, 5: 1, 6: 1, 11: 7, 12: 2, 13: 4, 23: 1}
OK	5960-88-3	C(C(Cl)Cl)N	{17: 2, 2: 1, 3: 1, 30: 1}
OK	5960-95-2	C1CN2CCC1(CC2)Cl	{17: 1, 11: 6, 13: 1, 33: 1}
OK	5960-99-6	C1CCC(=NCC1)CCCCCN	{35: 1, 2: 5, 11: 5, 30: 1, 15: 1}
OK	59609-49-3	CCOC(=O)C1C(C1(C)C)C=C(Cl)Cl	{1: 3, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 17: 2, 28: 1}
OK	5961-98-8	C(#N)SCl	{40: 1, 17: 1, 37: 1}
OK	5962-88-9	C1CCC(CC1)CCCCC(=O)O	{27: 1, 2: 4, 11: 5, 12: 1}
OK	5963-14-4	CC(C)CCCCCCC(=O)O	{27: 1, 1: 2, 2: 6, 3: 1}
OK	5963-77-9	CCC#CC(=O)O	{1: 1, 2: 1, 27: 1, 10: 2}
OK	59643-68-4	CCC(C)C=C(C)CC	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1}
OK	59643-70-8	CCC(CC)/C(=C/C)/CC	{1: 4, 2: 3, 3: 1, 6: 1, 7: 1}
OK	59643-72-0	CCC(=CC(C)(C)C)C	{1: 5, 2: 1, 4: 1, 6: 1, 7: 1}
OK	59643-75-3	CCC=C(C)C(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1}
OK	5965-66-2	C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
OK	59653-73-5	C1[C@@H](O1)CN2C(=O)N(C(=O)N(C2=O)C[C@@H]3CO3)C[C@@H]4CO4	{33: 3, 2: 3, 11: 3, 12: 3, 23: 3, 25: 3}
OK	5966-51-8	CN(C)CC(CN(C)C)O	{1: 4, 2: 2, 3: 1, 20: 1, 33: 2}
OK	59660-64-9	CC=C=C=CC	{8: 2, 1: 2, 6: 2}
OK	59660-96-7	CCCCCCOC(=O)C(C)(C)NCl	{1: 3, 2: 5, 4: 1, 17: 1, 28: 1, 31: 1}
OK	59660-97-8	CCCCCCCCOC(=O)C(C)(C)NCl	{1: 3, 2: 7, 4: 1, 17: 1, 28: 1, 31: 1}
OK	59661-02-8	CCCCCCOC(=O)C(C)(C)N(Cl)Cl	{1: 3, 2: 5, 4: 1, 33: 1, 17: 2, 28: 1}
OK	59661-03-9	CCCCCCCCOC(=O)C(C)(C)N(Cl)Cl	{1: 3, 2: 7, 4: 1, 33: 1, 17: 2, 28: 1}
OK	59665-11-1	CC(=O)NCN(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 24: 1, 29: 1, 31: 1}
OK	59669-26-0	CC(=NOC(=O)N(C)SN(C)C(=O)ON=C(C)SC)SC	{1: 6, 34: 2, 33: 2, 40: 3, 7: 2, 28: 2}
OK	59681-35-5	C/C=C/C(=C(C)C)C	{1: 4, 6: 2, 7: 2}
OK	5969-12-0	CC(CCCC(C)O)O	{1: 2, 2: 3, 3: 2, 20: 2}
OK	597-04-6	CCOC(=O)C(C)(C)C(=O)C	{24: 1, 1: 4, 2: 1, 4: 1, 28: 1}
OK	597-05-7	CCC(CC)(C(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	597-09-1	CCC(CO)(CO)[N+](=O)[O-]	{1: 1, 2: 3, 4: 1, 38: 1, 20: 2}
OK	597-12-6	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@H]2[C@@H]([C@H](O[C@@]2(CO)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)CO)O)O)O)O)O	{2: 4, 12: 13, 13: 1, 20: 11, 22: 2, 23: 3}
OK	597-31-9	CC(C)(CO)C=O	{1: 2, 2: 1, 4: 1, 26: 1, 20: 1}
OK	597-32-0	CC(CCl)(CCl)O	{1: 1, 2: 2, 4: 1, 20: 1, 17: 2}
OK	597-33-1	CC(CO)(CCl)O	{1: 1, 2: 2, 4: 1, 20: 2, 17: 1}
OK	597-43-3	CC(C)(CC(=O)O)C(=O)O	{1: 2, 2: 1, 27: 2, 4: 1}
OK	597-44-4	CC(CC(=O)O)(C(=O)O)O	{1: 1, 2: 1, 27: 2, 4: 1, 20: 1}
OK	597-49-9	CCC(CC)(CC)O	{1: 3, 2: 3, 4: 1, 20: 1}
OK	597-72-8	CCCOC(OCCC)(OCCC)OCCC	{1: 4, 2: 8, 4: 1, 22: 4}
OK	597-76-2	CCCC(CC)(CC)O	{1: 3, 2: 4, 4: 1, 20: 1}
OK	597-77-3	CCC(CC)(CC(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	597-90-0	CCCC(CC)(CCC)O	{1: 3, 2: 5, 4: 1, 20: 1}
OK	597-93-3	CCCCC(CCCC)(CCCC)O	{1: 3, 2: 9, 4: 1, 20: 1}
OK	597-96-6	CCCC(C)(CC)O	{1: 3, 2: 3, 4: 1, 20: 1}
OK	5970-63-8	CCCC(C)(CC)CO	{1: 3, 2: 4, 4: 1, 20: 1}
OK	59702-31-7	CCN1CCNC(=O)C1=O	{32: 1, 1: 1, 2: 1, 33: 1, 11: 2, 25: 2}
OK	59710-71-3	CCCCCCCCCCCCCC(=O)OOC(C)(C)C	{1: 4, 2: 12, 4: 1, 22: 1, 28: 1}
OK	59719-74-3	C1CC(CC1O)O	{20: 2, 11: 3, 12: 2}
OK	59734-23-5	CCCC(C)C(CCC)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	59739-66-1	CC(=CF)C	{16: 1, 1: 2, 6: 1, 7: 1}
OK	5975-73-5	C=CCOCC(COC(=O)C=CC(=O)OCC(COCC=C)O)O	{2: 6, 3: 2, 5: 2, 6: 4, 20: 2, 22: 2, 28: 2}
OK	5976-47-6	C=C(CO)Cl	{17: 1, 2: 1, 20: 1, 5: 1, 7: 1}
OK	59767-05-4	C(C[C@@H](C(=O)O)N)CN=C(N)N.C1(C(=O)NC(=O)N1)NC(=O)N	{32: 2, 2: 3, 3: 1, 7: 1, 12: 1, 34: 1, 24: 1, 25: 2, 27: 1, 30: 4, 31: 1}
OK	5977-14-0	CC(=O)CC(=O)N	{24: 2, 1: 1, 2: 1, 30: 1}
OK	59777-81-0	CCN(C)CC.BrBr	{1: 3, 2: 2, 18: 2, 33: 1}
OK	59777-82-1	CCCN(CCC)CCC.BrBr	{1: 3, 2: 6, 18: 2, 33: 1}
OK	59777-83-2	CCCCN(CCCC)CCCC.BrBr	{1: 3, 2: 9, 18: 2, 33: 1}
OK	59779-47-4	C(CCCO)CCO.C(=O)(Cl)Cl	{24: 1, 17: 2, 2: 6, 20: 2}
OK	59779-75-8	CCOC(=O)C1C(OC(O1)(C)C)C(=O)OCC	{1: 4, 2: 2, 12: 2, 13: 1, 23: 2, 28: 2}
OK	5978-08-5	CC1(OCCO1)CCCCl	{1: 1, 2: 3, 11: 2, 13: 1, 17: 1, 23: 2}
OK	598-01-6	CCCC(C)(CCC)O	{1: 3, 2: 4, 4: 1, 20: 1}
OK	598-07-2	CC(=C)CCCC(C)(C=C)O	{1: 2, 2: 3, 4: 1, 5: 2, 6: 1, 7: 1, 20: 1}
OK	598-09-4	CC1(CO1)CCl	{1: 1, 2: 1, 11: 1, 13: 1, 17: 1, 23: 1}
OK	598-10-7	C1CC1(C(=O)O)C(=O)O	{27: 2, 11: 2, 13: 1}
OK	598-16-3	C(=C(Br)Br)Br	{18: 3, 6: 1, 7: 1}
OK	598-19-6	C=C(CO)Br	{2: 1, 18: 1, 20: 1, 5: 1, 7: 1}
OK	598-20-9	C(C(Cl)Br)Br	{17: 1, 2: 1, 3: 1, 18: 2}
OK	598-21-0	C(C(=O)Br)Br	{24: 1, 2: 1, 18: 2}
OK	598-22-1	CCC(=O)Br	{24: 1, 1: 1, 2: 1, 18: 1}
OK	598-23-2	CC(C)C#C	{1: 2, 10: 1, 3: 1, 9: 1}
OK	598-25-4	CC(=C=C)C	{8: 1, 1: 2, 5: 1, 7: 1}
OK	598-26-5	CC(=C=O)C	{8: 1, 1: 2, 29: 1, 7: 1}
OK	598-29-8	CC(CI)I	{19: 2, 1: 1, 2: 1, 3: 1}
OK	598-31-2	CC(=O)CBr	{24: 1, 1: 1, 2: 1, 18: 1}
OK	598-32-3	CC(C=C)O	{1: 1, 3: 1, 20: 1, 5: 1, 6: 1}
OK	598-35-6	CC(C=O)O	{1: 1, 26: 1, 3: 1, 20: 1}
OK	598-38-9	C(C(Cl)Cl)O	{17: 2, 2: 1, 3: 1, 20: 1}
OK	598-39-0	C(C(F)F)I	{16: 2, 19: 1, 2: 1, 3: 1}
OK	598-41-4	C(C(=O)N)N	{24: 1, 2: 1, 30: 2}
OK	598-42-5	C(C(=O)N)O	{24: 1, 2: 1, 20: 1, 30: 1}
OK	598-49-2	CC(=O)NCl	{24: 1, 1: 1, 31: 1, 17: 1}
OK	598-50-5	CNC(=O)N	{24: 1, 1: 1, 30: 1, 31: 1}
OK	598-53-8	CC(C)OC	{1: 3, 3: 1, 22: 1}
OK	598-55-0	COC(=O)N	{1: 1, 28: 1, 30: 1}
OK	598-56-1	CCN(C)C	{1: 3, 2: 1, 33: 1}
OK	598-61-8	CC1CCC1	{1: 1, 11: 3, 12: 1}
OK	598-72-1	CC(C(=O)O)Br	{27: 1, 1: 1, 18: 1, 3: 1}
OK	598-73-2	C(=C(F)Br)(F)F	{16: 3, 18: 1, 7: 2}
OK	598-74-3	CC(C)C(C)N	{1: 3, 3: 2, 30: 1}
OK	598-75-4	CC(C)C(C)O	{1: 3, 3: 2, 20: 1}
OK	598-76-5	CC(C)C(Cl)Cl	{1: 2, 3: 2, 17: 2}
OK	598-77-6	CC(C(Cl)Cl)Cl	{1: 1, 3: 2, 17: 3}
OK	598-78-7	CC(C(=O)O)Cl	{27: 1, 1: 1, 3: 1, 17: 1}
OK	598-79-8	C=C(C(=O)O)Cl	{17: 1, 27: 1, 5: 1, 7: 1}
OK	598-80-1	CC(C(=O)O)I	{19: 1, 1: 1, 3: 1, 27: 1}
OK	598-88-9	C(=C(F)Cl)(F)Cl	{16: 2, 17: 2, 7: 2}
OK	598-92-5	CC([N+](=O)[O-])Cl	{1: 1, 3: 1, 38: 1, 17: 1}
OK	598-94-7	CN(C)C(=O)N	{24: 1, 1: 2, 30: 1, 33: 1}
OK	598-96-9	C/C=C(\C)/C(C)(C)C	{1: 5, 4: 1, 6: 1, 7: 1}
OK	598-98-1	CC(C)(C)C(=O)OC	{1: 4, 4: 1, 28: 1}
OK	598-99-2	COC(=O)C(Cl)(Cl)Cl	{1: 1, 4: 1, 28: 1, 17: 3}
OK	5980-15-4	CCCCCCCCCCCCOC(=O)CCC(=O)OCCCCCCCCCCCC	{1: 2, 2: 24, 28: 2}
OK	59808-78-5	C1C(C(C(C1Cl)Cl)Cl)Cl	{17: 4, 11: 1, 12: 4}
OK	5981-06-6	C1COCOCO1	{11: 4, 23: 3}
OK	5981-17-9	C1CC2N(C1)C3CCCN3C4N2CCC4	{33: 3, 11: 9, 12: 3}
OK	5982-97-8	CC/C(=C\C)/C(=O)NC(=O)N	{1: 2, 2: 1, 6: 1, 7: 1, 24: 2, 30: 1, 31: 1}
OK	59822-58-1	CCCCOC(=O)C=C.CC(=C)C(=O)O.C=CC(=O)NCO	{1: 2, 2: 4, 5: 3, 6: 2, 7: 1, 20: 1, 24: 1, 27: 1, 28: 1, 31: 1}
OK	59829-81-1	CCCCCCCCCCC[C@@H]1CO1	{1: 1, 2: 10, 11: 1, 12: 1, 23: 1}
OK	59843-83-3	CCC(C(=O)N(C)C)Cl	{1: 3, 2: 1, 3: 1, 33: 1, 17: 1, 24: 1}
OK	59846-11-6	CCC=CCC=CCC=CCCCCCCCC(=O)N(CCO)CCO	{1: 1, 2: 14, 6: 6, 33: 1, 20: 2, 24: 1}
OK	59849-54-6	CCCSSC(C)CC	{40: 2, 1: 3, 2: 3, 3: 1}
OK	59852-65-2	C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F	{16: 47, 3: 1, 4: 22, 22: 7}
OK	5986-38-9	CC(=CCCC(C)(C)O)C=C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	5986-55-0	C[C@H]1CCC2([C@@]3(C1CC(C2(C)C)CC3)C)O	{1: 4, 11: 5, 12: 3, 13: 3, 20: 1}
OK	59865-13-3	CCC1C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1)C(C(C)CC=CC)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C	{32: 4, 1: 24, 2: 6, 3: 8, 6: 2, 33: 7, 11: 1, 12: 10, 20: 1, 25: 11}
OK	59866-32-9	C#CC#CC#N	{9: 1, 10: 3, 37: 1}
OK	59871-24-8	CCCCCCC=CCl	{1: 1, 2: 5, 6: 2, 17: 1}
OK	59872-84-3	COC(C(C(F)(F)F)(F)F)O	{1: 1, 3: 1, 4: 2, 16: 5, 20: 1, 22: 1}
OK	5988-19-2	C1[C@H](NC(=O)NC1=O)C(=O)O	{27: 1, 25: 2, 11: 1, 12: 1, 32: 2}
OK	5988-91-0	CC(C)CCCC(C)CC=O	{1: 3, 2: 4, 3: 2, 26: 1}
OK	59880-80-7	CC(C)C12CCC(C=C1)(OCO2)C	{1: 3, 3: 1, 11: 3, 13: 2, 14: 2, 23: 2}
OK	59880-81-8	CC(C)C1(CCC(C=C1)(C)OC)OC	{1: 5, 3: 1, 11: 2, 13: 2, 14: 2, 22: 2}
OK	59880-82-9	COC12CCC(CC1)(C=C2)OC	{1: 2, 22: 2, 11: 4, 13: 2, 14: 2}
OK	59880-83-0	CC(C)C12CCC(CC1)(OCO2)C	{11: 5, 1: 3, 3: 1, 13: 2, 23: 2}
OK	59880-84-1	COC12CCC(CC1)(CC2)OC	{1: 2, 11: 6, 13: 2, 22: 2}
OK	59889-45-1	CCC(C)C(C)(C)Cl	{1: 4, 2: 1, 3: 1, 4: 1, 17: 1}
OK	5989-05-9	C[C@]1\2CCCC([C@H]3[C@H]1CC[C@H]3/C2=C/CO)(C)C	{1: 3, 2: 1, 6: 1, 11: 5, 12: 3, 13: 2, 15: 1, 20: 1}
OK	5989-08-2	CC1=CCC2C3C1C2(CCCC3(C)C)C	{1: 4, 11: 4, 12: 3, 13: 2, 14: 1, 15: 1}
OK	5989-27-5	C=C(C)[C@H]1CC=C(C)CC1	{1: 2, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	5989-54-8	CC1=CC[C@H](CC1)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	59892-35-2	CC(=O)C=C(C(C)(C)C)O	{1: 4, 4: 1, 6: 1, 7: 1, 20: 1, 24: 1}
OK	599-01-9	C(C(=O)O)(C(Cl)(Cl)Cl)O	{27: 1, 17: 3, 3: 1, 4: 1, 20: 1}
OK	599-04-2	CC1(COC(=O)[C@@H]1O)C	{1: 2, 11: 1, 12: 1, 13: 1, 20: 1, 28: 1}
OK	599-52-0	C1(=C(C(C(=C(C1=O)Cl)Cl)(Cl)Cl)Cl)Cl	{17: 6, 25: 1, 13: 1, 15: 4}
OK	599-97-3	CCOC(C(Cl)(Cl)Cl)OCC	{1: 2, 2: 2, 3: 1, 4: 1, 17: 3, 22: 2}
OK	599-99-5	CCOC(=O)C(Br)(Br)Br	{1: 1, 2: 1, 4: 1, 18: 3, 28: 1}
OK	59905-53-2	C[C@@H]1CC[C@H]([C@@H](C1)O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 3, 20: 1}
OK	59905-55-4	CC(C)C12CC1C(=C)C(C2)O	{1: 2, 3: 1, 5: 1, 11: 2, 12: 2, 13: 1, 15: 1, 20: 1}
OK	59917-23-6	NO.I	{19: 1, 20: 1, 30: 1}
OK	59922-36-0	CC(C)C1(CCC(CC1)(C)OC)OC	{11: 4, 1: 5, 3: 1, 13: 2, 22: 2}
OK	59937-28-9	CC(C)OC(=O)C(=C1SC=CS1)C(=O)OC(C)C	{1: 4, 3: 2, 7: 1, 41: 2, 14: 2, 15: 1, 28: 2}
OK	59956-48-8	CC(C)COC(=O)CBr	{1: 2, 2: 2, 3: 1, 28: 1, 18: 1}
OK	59969-91-4	CCCSC(SCCC)SCCC	{40: 3, 1: 3, 2: 6, 3: 1}
OK	59970-59-1	C(CS)C(=O)OCCS	{2: 4, 28: 1, 39: 2}
OK	59973-07-8	CCCCCCCCCSC	{40: 1, 1: 2, 2: 8}
OK	59973-08-9	CCCCCCCCCSCC	{40: 1, 1: 2, 2: 9}
OK	59983-39-0	COC[C@@H]1CCCN1N	{1: 1, 2: 1, 33: 1, 11: 3, 12: 1, 22: 1, 30: 1}
OK	59985-28-3	CCCCCC=CCC(C=CC=CCC=CCCCC(=O)O)O	{1: 1, 2: 9, 3: 1, 6: 8, 20: 1, 27: 1}
OK	59989-92-3	CCN1CC2(CCC(C34C2C(C5(C31)C6(CC(C7CC4(C6C7O)O)OC)OCO5)OC(=O)C)OC)C	{1: 5, 2: 1, 33: 1, 11: 6, 12: 8, 13: 5, 20: 2, 22: 2, 23: 2, 28: 1}
OK	59997-51-2	CC(C)(C)C(=O)CC#N	{24: 1, 1: 3, 2: 1, 4: 1, 37: 1}
OK	60-00-4	C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O	{33: 2, 2: 6, 27: 4}
OK	60-01-5	CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC	{1: 3, 2: 8, 3: 1, 28: 3}
OK	60-23-1	C(CS)N	{2: 2, 30: 1, 39: 1}
OK	60-24-2	C(CS)O	{2: 2, 20: 1, 39: 1}
OK	60-27-5	CN1CC(=O)N=C1N	{1: 1, 35: 1, 33: 1, 11: 1, 15: 1, 25: 1, 30: 1}
OK	60-29-7	CCOCC	{1: 2, 2: 2, 22: 1}
OK	60-32-2	C(CCC(=O)O)CCN	{2: 5, 27: 1, 30: 1}
OK	60-33-3	CCCCCC=CCC=CCCCCCCCC(=O)O	{1: 1, 2: 12, 27: 1, 6: 4}
OK	60-34-4	CNN	{1: 1, 30: 1, 31: 1}
OK	60-35-5	CC(=O)N	{24: 1, 1: 1, 30: 1}
OK	60-40-2	CC1(C2CCC(C2)C1(C)NC)C	{1: 4, 11: 3, 12: 2, 13: 2, 31: 1}
OK	600-00-0	CCOC(=O)C(C)(C)Br	{1: 3, 2: 1, 4: 1, 18: 1, 28: 1}
OK	600-05-5	C(C(C(=O)O)Br)Br	{27: 1, 2: 1, 3: 1, 18: 2}
OK	600-06-6	CC(C)C(C)CCl	{1: 3, 2: 1, 3: 2, 17: 1}
OK	600-10-2	CC(C)C(CCl)Cl	{1: 2, 2: 1, 3: 2, 17: 2}
OK	600-11-3	CCC(C(C)Cl)Cl	{1: 2, 2: 1, 3: 2, 17: 2}
OK	600-14-6	CCC(=O)C(=O)C	{24: 2, 1: 2, 2: 1}
OK	600-17-9	C=CC(C(=O)O)O	{27: 1, 3: 1, 20: 1, 5: 1, 6: 1}
OK	600-18-0	CCC(=O)C(=O)O	{24: 1, 1: 1, 2: 1, 27: 1}
OK	600-22-6	CC(=O)C(=O)OC	{24: 1, 1: 2, 28: 1}
OK	600-24-8	CCC(C)[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1}
OK	600-25-9	CCC([N+](=O)[O-])Cl	{1: 1, 2: 1, 3: 1, 38: 1, 17: 1}
OK	600-26-0	C/C(=N/O)/[N+](=O)[O-]	{1: 1, 34: 1, 20: 1, 38: 1, 7: 1}
OK	600-30-6	CC(C(C(=O)O)Br)Br	{27: 1, 1: 1, 18: 2, 3: 2}
OK	600-31-7	C(C(=O)O)(C(=O)O)Br	{27: 2, 18: 1, 3: 1}
OK	600-36-2	CC(C)C(C(C)C)O	{1: 4, 3: 3, 20: 1}
OK	600-40-8	CC([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 3: 1, 38: 2}
OK	6000-43-7	C(C(=O)O)N.Cl	{17: 1, 2: 1, 27: 1, 30: 1}
OK	6000-82-4	CC(=C)CN(C)C	{1: 3, 2: 1, 33: 1, 5: 1, 7: 1}
OK	6001-87-2	COC(=O)CCCl	{1: 1, 2: 2, 28: 1, 17: 1}
OK	60012-89-7	C1CCN(CC1)CC2CC3(CC(OC3=O)CN4CCCCC4)C(=O)O2	{33: 2, 2: 2, 11: 12, 12: 2, 13: 1, 28: 2}
OK	60027-50-1	CC(=O)CC(C)(C)N=O	{1: 3, 2: 1, 4: 1, 34: 1, 24: 1, 29: 1}
OK	60029-23-4	C1COCCN1C(C(Cl)(Cl)Cl)NC=O	{33: 1, 3: 1, 4: 1, 11: 4, 17: 3, 23: 1, 26: 1, 31: 1}
OK	60033-39-8	C1CCCC2(CCC1)CCC(=O)C=C2	{25: 1, 11: 9, 13: 1, 14: 2}
OK	60037-58-3	CCCC/C=C\CCCCCCCCCCCCOC(=O)C	{1: 2, 2: 15, 28: 1, 6: 2}
OK	60037-69-6	CCCCC#CCCCCCCCCO	{1: 1, 2: 11, 20: 1, 10: 2}
OK	60038-41-7	C1C2CC3CC1CC(C2)C3(C#N)N=O	{34: 1, 37: 1, 11: 5, 12: 4, 13: 1, 29: 1}
OK	6004-38-2	C1CC2C3CCC(C3)C2C1	{11: 6, 12: 4}
OK	6004-44-0	CC=C=O	{8: 1, 1: 1, 29: 1, 6: 1}
OK	6004-60-0	CC(=O)C1CCCC1	{24: 1, 1: 1, 11: 4, 12: 1}
OK	60042-77-5	CCC1(CC1)C=C=CC	{1: 2, 2: 1, 6: 2, 8: 1, 11: 2, 13: 1}
OK	60046-25-5	C([C@H]([C@H]([C@H]1[C@H](C(C(=O)O1)O)O)O)O)O	{20: 5, 2: 1, 3: 2, 12: 3, 28: 1}
OK	60046-87-9	CC(C)CCCC(C)CCCC(C)CC(CC(C)C=C)O	{1: 5, 2: 8, 3: 5, 5: 1, 6: 1, 20: 1}
OK	60047-17-8	CC1(CCC(O1)C(C)(C)O)C=C	{1: 3, 4: 1, 5: 1, 6: 1, 11: 2, 12: 1, 13: 1, 20: 1, 23: 1}
OK	60051-16-3	CC(=O)N(C)N(C)/C(=C/C(=O)OC)/C(=O)OC	{1: 5, 6: 1, 33: 2, 7: 1, 24: 1, 28: 2}
OK	6006-06-0	C=CCCCCCCCCCCC(=O)O	{2: 10, 27: 1, 5: 1, 6: 1}
OK	6006-15-1	CCN(CC)C(C)C	{1: 4, 2: 2, 3: 1, 33: 1}
OK	6006-33-3	CCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 12, 11: 5, 12: 1}
OK	6006-34-4	CCCCCCCCCCCCCC1CCCC1	{1: 1, 2: 12, 11: 4, 12: 1}
OK	6006-65-1	CCCOC(N(C)C)OCCC	{1: 4, 2: 4, 3: 1, 22: 2, 33: 1}
OK	6006-95-7	CCCCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 14, 11: 5, 12: 1}
OK	60066-53-7	CCOC(=O)CC(C)(C)C(CC(Cl)(Cl)Cl)Cl	{1: 3, 2: 3, 3: 1, 4: 2, 17: 4, 28: 1}
OK	60066-84-4	CCOC(=O)C1C(C1(C)C)CC(Cl)(Cl)Cl	{1: 3, 2: 2, 4: 1, 12: 2, 13: 1, 17: 3, 28: 1}
OK	6007-23-4	CCC1SCCCS1	{1: 1, 2: 1, 11: 3, 12: 1, 41: 2}
OK	6007-26-7	CC1SCCCS1	{1: 1, 11: 3, 12: 1, 41: 2}
OK	6008-17-9	CCCCC(CCCC)(CCCC)CCCC	{1: 4, 2: 12, 4: 1}
OK	6008-27-1	C1CCCCOC(=O)CCC1	{11: 8, 28: 1}
OK	6008-51-1	C1CCSSCC1	{41: 2, 11: 5}
OK	6008-78-2	CC1(SCCS1)C	{1: 2, 11: 2, 13: 1, 41: 2}
OK	6008-81-7	CCC1(SCCS1)C	{1: 2, 2: 1, 11: 2, 13: 1, 41: 2}
OK	60092-21-9	CC(=C)C(=O)OC.C=CC#N.C=CO	{1: 2, 5: 3, 6: 2, 7: 1, 20: 1, 28: 1, 37: 1}
OK	60094-06-6	C1CCN(CC1)Br	{33: 1, 18: 1, 11: 5}
OK	60096-09-5	CCC(CCCCO)O	{1: 1, 2: 5, 3: 1, 20: 2}
OK	601-05-8	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C(=O)CO)O)C	{1: 2, 2: 1, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1}
OK	601-34-3	CCCCCCCCCCCCCCCC(=O)OC1CCC2([C@H]3CCC4([C@H](C3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 17, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	601-53-6	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 5, 13: 2, 25: 1}
OK	601-54-7	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CCC(=O)C4)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1}
OK	601-57-0	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1}
OK	601-58-1	CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4[C@@]3(CCCC4)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 10, 12: 5, 13: 2}
OK	601-75-2	CCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 1, 3: 1}
OK	601-76-3	CCC([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 3: 1, 38: 2}
OK	601-77-4	CC(C)N(C(C)C)N=O	{1: 4, 34: 1, 3: 2, 29: 1, 33: 1}
OK	60102-37-6	C[C@@H]1C[C@@]2([C@H](O2)C)C(=O)O[C@@H]3CCN(C/C=C(\C3=O)/COC(=O)[C@]1(C)O)C	{1: 4, 33: 1, 11: 5, 12: 3, 13: 2, 14: 1, 15: 1, 20: 1, 23: 1, 25: 1, 28: 2}
OK	6011-14-9	C(C#N)N.Cl	{17: 1, 2: 1, 37: 1, 30: 1}
OK	60111-68-4	CC(CBr)(CBr)CBr	{1: 1, 2: 3, 4: 1, 18: 3}
OK	60114-74-1	CCCCCCCCCC(C)(C)SSC(Cl)(Cl)Cl	{40: 2, 1: 3, 2: 8, 4: 2, 17: 3}
OK	60130-68-9	CCCCCCCCCCCCCCCCCC(=O)OCC(CC)(CO)CO	{1: 2, 2: 20, 4: 1, 20: 2, 28: 1}
OK	6014-43-3	C[C@]12CCC3C([C@]1(CC[C@@H]2C4=CC(=O)OC4)O)CC[C@]5([C@@]3(CC[C@@H](C5)O[C@H]6C(C([C@@H](C(O6)CO)O)O)O)C=O)O	{1: 1, 2: 1, 11: 10, 12: 9, 13: 4, 14: 1, 15: 1, 20: 6, 22: 1, 23: 1, 26: 1, 28: 1}
OK	60145-64-4	C1CC2CC3CCC2C(C1)(C3)N	{11: 7, 12: 3, 13: 1, 30: 1}
OK	60153-49-3	CN(CCC#N)N=O	{1: 1, 2: 2, 37: 1, 33: 1, 34: 1, 29: 1}
OK	60163-97-5	CC(C)C.C=C	{1: 3, 3: 1, 5: 2}
OK	60164-05-8	CCCCC(CC)COC(=O)C=C.CC(=O)OC=C.C=CC(=O)N	{1: 3, 2: 5, 3: 1, 5: 3, 6: 3, 24: 1, 28: 2, 30: 1}
OK	60166-69-0	CC=C=C(C)C1CC1	{1: 2, 6: 1, 7: 1, 8: 1, 11: 2, 12: 1}
OK	60166-70-3	C=C=C(C1CC1)C2CC2	{8: 1, 11: 4, 12: 2, 5: 1, 7: 1}
OK	60166-71-4	CC=C=CC1CC1C	{8: 1, 1: 2, 11: 1, 12: 2, 6: 2}
OK	60166-72-5	CC(=C=CC1CC1)C	{1: 2, 6: 1, 7: 1, 8: 1, 11: 2, 12: 1}
OK	60182-96-9	CCCC(C)C(C(=O)O)N	{27: 1, 1: 2, 2: 2, 3: 2, 30: 1}
OK	60186-78-9	CCCCCCCCCC#CCC	{1: 2, 2: 9, 10: 2}
OK	60186-79-0	CCCCCCCCC#CCCC	{1: 2, 2: 9, 10: 2}
OK	60186-80-3	CCCCCCCC#CCCCC	{1: 2, 2: 9, 10: 2}
OK	6020-51-5	C[C@H]1[C@H](NC(=O)N1)CCCCCC(=O)OC	{32: 2, 1: 2, 2: 5, 12: 2, 25: 1, 28: 1}
OK	60212-29-5	CCCCCCCCC#CC	{1: 2, 2: 7, 10: 2}
OK	60212-30-8	CCCCCCCC#CCC	{1: 2, 2: 7, 10: 2}
OK	60212-31-9	CCCCCCC#CCCC	{1: 2, 2: 7, 10: 2}
OK	60212-32-0	CCCCCCCCCCC#CCC	{1: 2, 2: 10, 10: 2}
OK	60212-33-1	CCCCCCCCCC#CCCC	{1: 2, 2: 10, 10: 2}
OK	60212-34-2	CCCCCCCCC#CCCCC	{1: 2, 2: 10, 10: 2}
OK	60241-52-3	CCC(CCC1C(CCCC1(C)C)C)O	{1: 4, 2: 3, 3: 1, 11: 3, 12: 2, 13: 1, 20: 1}
OK	60241-69-2	CCC(=O)CCC1C(CCCC1(C)C)C	{1: 4, 2: 3, 11: 3, 12: 2, 13: 1, 24: 1}
OK	60242-08-2	C1CCC2=C(C1)C(=O)N(C2=O)C3CC(=O)NC(=O)C3	{32: 1, 33: 1, 11: 6, 12: 1, 15: 2, 25: 4}
OK	60247-14-5	CCN(C)CC(C)C	{1: 4, 2: 2, 3: 1, 33: 1}
OK	60250-80-8	CCCCC(C)COC(=O)C(=C)C	{1: 3, 2: 4, 3: 1, 5: 1, 7: 1, 28: 1}
OK	60254-65-1	CCCCCCOC(=O)C(=O)N(CC)CC	{24: 1, 1: 3, 2: 7, 28: 1, 33: 1}
OK	60254-66-2	CCCCCCCOC(=O)C(=O)N(CC)CC	{24: 1, 1: 3, 2: 8, 28: 1, 33: 1}
OK	60254-67-3	CCCCCCCCOC(=O)C(=O)N(CC)CC	{24: 1, 1: 3, 2: 9, 28: 1, 33: 1}
OK	60254-68-4	CCCCCCCCCOC(=O)C(=O)N(CC)CC	{24: 1, 1: 3, 2: 10, 28: 1, 33: 1}
OK	60263-54-9	C1CCC(CC1)C2(CCCCC2)C(=O)O	{27: 1, 11: 10, 12: 1, 13: 1}
OK	6027-13-0	C(CS)[C@@H](C(=O)O)N	{27: 1, 2: 2, 3: 1, 30: 1, 39: 1}
OK	60274-60-4	C(CCCl)CCI	{17: 1, 2: 5, 19: 1}
OK	6028-61-1	CCCSSSCCC	{40: 3, 1: 2, 2: 4}
OK	60285-25-8	C(CNC(=O)N(CCC#N)N=O)C#N	{33: 1, 2: 4, 37: 2, 34: 1, 24: 1, 29: 1, 31: 1}
OK	60285-29-2	C=CCNC(=O)N(CC=C)N=O	{33: 1, 2: 2, 5: 2, 6: 2, 34: 1, 24: 1, 29: 1, 31: 1}
OK	60288-48-4	CCC(=C)[CH2]	{1: 1, 2: 1, 5: 2, 7: 1}
OK	6029-84-1	C[C@H]([C@@](C(C)C)(C(=O)OCC1=CCN2[C@H]1[C@H](CC2)O)O)O	{1: 3, 2: 1, 3: 2, 4: 1, 33: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 3, 28: 1}
OK	6029-87-4	C[C@@H]1C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC(=O)[C@H]([C@@]1(C)O)C	{1: 3, 33: 1, 11: 4, 12: 4, 13: 1, 14: 1, 15: 1, 20: 1, 28: 2}
OK	603-67-8	CCOC(=O)C(C(=O)OCC)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 28: 2, 38: 1}
OK	603-69-0	CCOC(=O)C(C(=O)C)C(=O)C	{24: 2, 1: 3, 2: 1, 3: 1, 28: 1}
OK	60302-21-8	CCCC(CCC)C(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	60302-23-0	CC(C)C(C)(C)CC(C)(C)C	{1: 7, 2: 1, 3: 1, 4: 2}
OK	60302-24-1	CC(C)(C)CC(C)(C)C(C)(C)C	{1: 8, 2: 1, 4: 3}
OK	60302-27-4	CC(C)(C)C(C)(C)C(C)(C)C	{1: 8, 4: 3}
OK	60302-28-5	CCC(CC)(CC)C(C)(C)C	{1: 6, 2: 3, 4: 2}
OK	60302-96-7	CCCN(CCC)CC(CO)O	{1: 2, 2: 6, 3: 1, 20: 2, 33: 1}
OK	60308-82-9	CCCCCCCC(C)CC(=O)O	{27: 1, 1: 2, 2: 7, 3: 1}
OK	6032-29-7	CCCC(C)O	{1: 2, 2: 2, 3: 1, 20: 1}
OK	60323-50-4	C1CC#CCCC#CCCC#C1	{10: 6, 11: 6}
OK	60329-21-7	C1CC23C1(CC=CC2)C=CC=C3	{11: 4, 13: 2, 14: 6}
OK	6033-23-4	CCCCC[C@H](C)O	{1: 2, 2: 4, 3: 1, 20: 1}
OK	6033-24-5	CCCCC[C@@H](C)O	{1: 2, 2: 4, 3: 1, 20: 1}
OK	60336-83-6	CC#N.C1COCCOCCOCCOCCOCCO1	{1: 1, 11: 12, 37: 1, 23: 6}
OK	6034-46-4	C[C@@H](C(=O)O)OC(=O)C	{27: 1, 1: 2, 3: 1, 28: 1}
OK	60362-71-2	CC1=C(C2(CCC1(C(C2(C)O)(C)C)C)C)C	{1: 7, 11: 2, 20: 1, 13: 4, 15: 2}
OK	60364-26-3	CC=C(C(C)C)C(=O)NC(=O)N	{1: 3, 3: 1, 6: 1, 7: 1, 24: 2, 30: 1, 31: 1}
OK	60367-00-2	C[C@@H]1C[C@@](C(=O)O[C@@H]2CCN(C/C=C(\C2=O)/COC(=O)[C@]1(C)OC(=O)C)C)([C@@H](C)Cl)O	{1: 5, 3: 1, 33: 1, 11: 5, 12: 2, 13: 2, 14: 1, 15: 1, 17: 1, 20: 1, 25: 1, 28: 3}
OK	60391-92-6	C(C(=O)O)N(C(=O)N)N=O	{33: 1, 2: 1, 34: 1, 24: 1, 27: 1, 29: 1, 30: 1}
OK	604-33-1	CCCCCC=CCC=CCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C	{1: 6, 2: 15, 3: 2, 6: 4, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	604-35-3	CC(C)CCCC(C)[C@H]1CC[C@@H]2C1(CC[C@H]3C2CC=C4C3(CC[C@@H](C4)OC(=O)C)C)C	{1: 6, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	604-68-2	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 5, 2: 1, 12: 5, 28: 5, 23: 1}
OK	6040-19-3	CC(=O)OC(C)(C)/C=C/C(=O)[C@@](C)([C@H]1[C@@H](C[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O)CO)C)C)O)O	{1: 8, 2: 1, 4: 2, 6: 2, 11: 4, 12: 5, 13: 4, 14: 1, 15: 1, 20: 4, 24: 1, 25: 2, 28: 1}
OK	6040-62-6	CC1C2C(C(C3(C=CC(=O)C(=C3C2OC1=O)OC)C)O)O	{1: 3, 12: 5, 13: 1, 14: 2, 15: 2, 20: 2, 22: 1, 25: 1, 28: 1}
OK	60414-81-5	CC(CN(CC(C)OC(=O)C)N=O)OC(=O)C	{1: 4, 2: 2, 3: 2, 33: 1, 34: 1, 28: 2, 29: 1}
OK	60415-61-4	CCCC(C)OC(=O)CCC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	60435-70-3	CCCCCC(C)CO	{1: 2, 2: 5, 3: 1, 20: 1}
OK	60435-94-1	CCCCN(CCCC)CCCC.F	{16: 1, 1: 3, 2: 9, 33: 1}
OK	60437-19-6	CC(=CCCC(=CC=C(C)C=O)C)C	{1: 4, 2: 2, 26: 1, 6: 3, 7: 3}
OK	6044-68-4	COC(C=C)OC	{1: 2, 22: 2, 3: 1, 5: 1, 6: 1}
OK	60456-21-5	CC1(OC[C@H](O1)C(=O)OC)C	{1: 3, 11: 1, 12: 1, 13: 1, 23: 2, 28: 1}
OK	60456-23-7	C1[C@@H](O1)CO	{20: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	60456-26-0	CCCC(=O)OC[C@H]1CO1	{1: 1, 2: 3, 11: 1, 12: 1, 23: 1, 28: 1}
OK	60462-02-4	CCCCCC(=O)C(C(=O)C)C(=O)OCC	{24: 2, 1: 3, 2: 5, 3: 1, 28: 1}
OK	60491-95-4	CC1(COC(=O)N1Br)C	{1: 2, 33: 1, 11: 1, 13: 1, 18: 1, 28: 1}
OK	60498-06-8	C1C2C1C3C=CC2C4C3C4	{11: 2, 12: 6, 14: 2}
OK	605-94-7	CC1=CC(=O)C(=C(C1=O)OC)OC	{1: 3, 25: 2, 22: 2, 14: 1, 15: 3}
OK	6050-26-6	CCC(=O)NC(=O)CC	{24: 2, 1: 2, 2: 2, 31: 1}
OK	60501-41-9	CCCCCCCCC=CCCCCCCCCOCC1CO1	{1: 1, 2: 16, 6: 2, 11: 1, 12: 1, 22: 1, 23: 1}
OK	6051-00-9	CCC(C1CCCCC1)C(=O)O	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 27: 1}
OK	6051-30-5	C(C(C(=O)N)O)(C(=O)N)O	{24: 2, 3: 2, 20: 2, 30: 2}
OK	6051-40-7	C1CCC(C1)C2CCC(C2)C3CCCC3	{11: 11, 12: 4}
OK	60525-38-4	C1CC(CCC1C(=O)NCl)C(=O)NCl	{24: 2, 17: 2, 11: 4, 12: 2, 31: 2}
OK	60526-38-7	CC(=C1C2C=CC1C(=O)C2=O)C	{1: 2, 7: 1, 12: 2, 14: 2, 15: 1, 25: 2}
OK	60526-40-1	C1CC12C3C=CC2C(=O)C3=O	{25: 2, 11: 2, 12: 2, 13: 1, 14: 2}
OK	60526-42-3	CC1(C2C=CC1C(=O)C2=O)C	{1: 2, 12: 2, 13: 1, 14: 2, 25: 2}
OK	60526-44-5	C1CCC2(C1)C3C=CC2C(=O)C3=O	{25: 2, 11: 4, 12: 2, 13: 1, 14: 2}
OK	60526-48-9	CC1=CC2CC1C(=O)C2=O	{1: 1, 11: 1, 12: 2, 14: 1, 15: 1, 25: 2}
OK	6053-74-3	C1=CC2C=CC3C2C1C=C3	{12: 4, 14: 6}
OK	6053-81-2	C1CCC(C1)CN	{2: 1, 11: 4, 12: 1, 30: 1}
OK	6054-74-6	C1NCNCNCN1	{32: 4, 11: 4}
OK	60542-45-2	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OCCO	{1: 3, 2: 19, 5: 2, 7: 2, 20: 1, 28: 2}
OK	60544-70-9	C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.C(CO)N(CCO)CCO	{33: 3, 2: 12, 27: 4, 20: 3}
OK	6055-52-3	C(CCCN)CCN.Cl.Cl	{17: 2, 2: 6, 30: 2}
OK	60556-85-6	C=C(C(=O)F)F	{16: 2, 24: 1, 5: 1, 7: 1}
OK	60558-96-5	CCN(CC)CCCN(CC)CC	{1: 4, 2: 7, 33: 2}
OK	60564-76-3	CC(C)C(C)CCCO	{1: 3, 2: 3, 3: 2, 20: 1}
OK	60569-13-3	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])N(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-]	{16: 1, 33: 1, 2: 2, 4: 2, 38: 6}
OK	60569-14-4	CCC(CN(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 3, 4: 2, 38: 5, 33: 1, 16: 1}
OK	60582-65-2	C1CC(=O)C2CC2C1=O	{25: 2, 11: 3, 12: 2}
OK	60593-11-5	CC1=CCC(CC1=O)C(C)(C)O	{1: 3, 4: 1, 11: 2, 12: 1, 14: 1, 15: 1, 20: 1, 25: 1}
OK	60595-37-1	CCCCCC=CI	{1: 1, 2: 4, 19: 1, 6: 2}
OK	60597-20-8	CNN(C)C.Cl	{1: 3, 31: 1, 33: 1, 17: 1}
OK	60599-38-4	CC(=O)CN(CC(=O)C)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 24: 2, 29: 1}
OK	60606-96-4	C1CC2CC3CCC4C3C2C1C4	{11: 6, 12: 6}
OK	60609-53-2	CCC(C)CCCCC=CCCCCCCC=O	{1: 2, 2: 11, 3: 1, 26: 1, 6: 2}
OK	6061-10-5	CCCCCC(C)CC(=O)O	{27: 1, 1: 2, 2: 5, 3: 1}
OK	60623-04-3	CCCCCCCCC(CCCCCC)C(=O)OCC(COC(=O)C(CCCCCC)CCCCCCCC)(COC(=O)C(CCCCCC)CCCCCCCC)COC(=O)C(CCCCCC)CCCCCCCC	{1: 8, 2: 52, 3: 4, 4: 1, 28: 4}
OK	6064-27-3	CCCCCCC(=O)CCCCC	{24: 1, 1: 2, 2: 9}
OK	6064-38-6	CCCCCCCCC(=O)CCCCCC	{24: 1, 1: 2, 2: 12}
OK	6064-42-2	CCCCCCCCCCC(=O)CCCCCC	{24: 1, 1: 2, 2: 14}
OK	6064-63-7	CCCCC(C(=O)O)O	{27: 1, 1: 1, 2: 3, 3: 1, 20: 1}
OK	6064-90-0	CCCCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 19, 28: 1}
OK	6064-97-7	CCCCCCCCCCCCCCOCCC(=O)OC	{1: 2, 2: 15, 28: 1, 22: 1}
OK	60642-67-3	C(CC(=O)OCCS)C(=O)OCCS	{2: 6, 28: 2, 39: 2}
OK	60642-68-4	C(CC(=O)OCCS)CC(=O)OCCS	{2: 7, 28: 2, 39: 2}
OK	60642-69-5	C(CCCCC(=O)OCCS)CCCC(=O)OCCS	{2: 12, 28: 2, 39: 2}
OK	60643-93-8	CC(C)/C(=C(/C)\C(C)C)/C	{1: 6, 3: 2, 7: 2}
OK	60643-94-9	CC(C)C(=C(C)C(C)C)C	{1: 6, 3: 2, 7: 2}
OK	6065-01-6	CCCCC(=CCCC)[N+](=O)[O-]	{1: 2, 2: 5, 38: 1, 6: 1, 7: 1}
OK	6065-04-9	CCCCCC=C(CC)[N+](=O)[O-]	{1: 2, 2: 5, 38: 1, 6: 1, 7: 1}
OK	6065-09-4	CCCCC=C(CC)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 6: 1, 7: 1}
OK	6065-10-7	CCCCCC(=CC)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 6: 1, 7: 1}
OK	6065-11-8	CCCCCC=C(C)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 6: 1, 7: 1}
OK	6065-13-0	CCCCC(=CC)[N+](=O)[O-]	{1: 2, 2: 3, 38: 1, 6: 1, 7: 1}
OK	6065-14-1	CCCCC=C(C)[N+](=O)[O-]	{1: 2, 2: 3, 38: 1, 6: 1, 7: 1}
OK	6065-17-4	CCCC=C(C)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 6: 1, 7: 1}
OK	6065-18-5	CCC(=CC)[N+](=O)[O-]	{1: 2, 2: 1, 38: 1, 6: 1, 7: 1}
OK	6065-19-6	CC/C=C(\C)/[N+](=O)[O-]	{1: 2, 2: 1, 38: 1, 6: 1, 7: 1}
OK	6065-54-9	CC(C)(C(=O)OC)C(=O)OC	{1: 4, 4: 1, 28: 2}
OK	6065-59-4	CCCCCC(C(=O)OCC)C(=O)OCC	{1: 3, 2: 6, 3: 1, 28: 2}
OK	6065-82-3	CCOC(C(=O)OCC)OCC	{1: 3, 2: 3, 3: 1, 28: 1, 22: 2}
OK	6065-90-3	CC(C)(C)CC(CCl)Cl	{1: 3, 2: 2, 3: 1, 4: 1, 17: 2}
OK	6065-93-6	CC(=C(Cl)Cl)C	{1: 2, 17: 2, 7: 2}
OK	60657-70-7	CCC#CC(CC(C)C)O	{1: 3, 2: 2, 3: 2, 20: 1, 10: 2}
OK	6066-82-6	C1CC(=O)N(C1=O)O	{25: 2, 11: 2, 20: 1, 33: 1}
OK	60669-40-1	CCCCCCCC=CCC	{1: 2, 2: 7, 6: 2}
OK	60671-32-1	CCCCCCC(C)C(C)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	60671-36-5	CCCCCCCCC(C(C)C)O	{1: 3, 2: 7, 3: 2, 20: 1}
OK	60678-65-1	CCCN(C)N(C)C	{1: 4, 2: 2, 33: 2}
OK	60678-66-2	CC(C)N(C(C)C)N(C)C	{1: 6, 3: 2, 33: 2}
OK	60678-67-3	CCCCN(CCCC)N(C)C	{1: 4, 2: 6, 33: 2}
OK	60678-68-4	CCCCN(CC)N(CC)CCCC	{1: 4, 2: 8, 33: 2}
OK	60678-69-5	CCCN(CCC)N(CCC)CCC	{1: 4, 2: 8, 33: 2}
OK	60678-70-8	CCCCN(CCCC)N(CCCC)CCCC	{1: 4, 2: 12, 33: 2}
OK	60678-71-9	CC(C)N(C)N(C)C(C)C	{1: 6, 3: 2, 33: 2}
OK	60678-73-1	CC(C)(C)N(C)N(C)C	{1: 6, 4: 1, 33: 2}
OK	60678-74-2	CC(C)CN(CC(C)C)N(C)C	{1: 6, 2: 2, 3: 2, 33: 2}
OK	60678-75-3	C1CCCN(CC1)N2CCCC2	{33: 2, 11: 10}
OK	60678-76-4	CN(C)N1CCCCCC1	{1: 2, 11: 6, 33: 2}
OK	60678-79-7	CN(C)N1C2CCCC1CCC2	{1: 2, 11: 6, 12: 2, 33: 2}
OK	60678-80-0	CC1(CCC(N(N1C)C)(C)C)C	{1: 6, 11: 2, 13: 2, 33: 2}
OK	60678-82-2	CCN1CCCCN1CC	{1: 2, 2: 2, 11: 4, 33: 2}
OK	60678-83-3	C1CCC2CN3CCCCN3CC2C1	{33: 2, 11: 10, 12: 2}
OK	6068-62-8	COC(/C=C/C(OC)OC)OC	{1: 4, 3: 2, 22: 4, 6: 2}
OK	6068-96-8	CCCOO	{1: 1, 2: 2, 20: 1, 22: 1}
OK	60681-10-9	CC1(CC(C(=O)CC1=O)(C)C)C	{1: 4, 11: 2, 13: 2, 25: 2}
OK	6069-42-7	C=CCOO	{2: 1, 22: 1, 20: 1, 5: 1, 6: 1}
OK	6069-71-2	CC1(C2CC[C@@H](C2)C1=O)C	{1: 2, 11: 3, 12: 2, 13: 1, 25: 1}
OK	6069-98-3	CC1CCC(CC1)C(C)C	{11: 4, 1: 3, 3: 1, 12: 2}
OK	607-97-6	CCC(C(=O)C)C(=O)OCC	{24: 1, 1: 3, 2: 2, 3: 1, 28: 1}
OK	60700-47-2	C1C=CCC2=C1CC3=C(C2)CC4=C(C3)CC=CC4	{11: 8, 14: 4, 15: 6}
OK	60703-31-3	CC(C)C(C=C(C)C)O	{1: 4, 3: 2, 20: 1, 6: 1, 7: 1}
OK	6071-27-8	CCCCCCCC(CCO)O	{1: 1, 2: 8, 3: 1, 20: 2}
OK	6071-32-5	CCCCCCCCC(CCO)O	{1: 1, 2: 9, 3: 1, 20: 2}
OK	60715-98-2	CCN(CC)C=CC(=O)N(C)C	{24: 1, 1: 4, 2: 2, 6: 2, 33: 2}
OK	60718-46-9	C1=CN(C=N1)C(=O)CCCCC(=O)O	{33: 1, 2: 4, 35: 1, 14: 3, 24: 1, 27: 1}
OK	60728-51-0	CCOC(=O)N(CC=C)CC=C	{1: 1, 2: 3, 5: 2, 6: 2, 33: 1, 28: 1}
OK	6074-99-3	C1C2C=CC=CC1C=CC=C2	{11: 1, 12: 2, 14: 8}
OK	60754-24-7	CCOC(=O)N(C)C#N	{1: 2, 2: 1, 28: 1, 37: 1, 33: 1}
OK	6076-38-6	CCCCCCCCCCCCCCCCCCOCC(CO)OCCCCCCCCCCCCCCCCCC	{1: 2, 2: 36, 3: 1, 20: 1, 22: 2}
OK	6076-42-2	CCCCCCCCCCCCCCCCCCOCC(COCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCC	{1: 3, 2: 53, 3: 1, 22: 3}
OK	60762-50-7	CC(C)NNC(=O)C(CCC(=O)O)N	{1: 2, 2: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 2}
OK	60763-78-2	CCSCC(CO)O	{40: 1, 1: 1, 2: 3, 3: 1, 20: 2}
OK	60768-10-7	CCCCCCCCCCCCCCCCC(CCN)C(=O)NC(=O)CCCCCCCCC(=O)NC(=O)C(CCCCCCCCCCCCCCCC)CCN	{1: 2, 2: 42, 3: 2, 24: 4, 30: 2, 31: 2}
OK	60768-75-4	SI	{19: 1, 39: 1}
OK	6077-65-2	C(=NC(=O)C(Cl)Cl)=O	{34: 1, 3: 1, 8: 1, 17: 2, 24: 1, 29: 1}
OK	6077-72-1	CC1CC1CO	{1: 1, 2: 1, 11: 1, 12: 2, 20: 1}
OK	60778-60-1	C1CCCN(CC1)N2CCCCC2	{33: 2, 11: 11}
OK	60779-24-0	CCCCSSC	{40: 2, 1: 2, 2: 3}
OK	60784-41-0	C(CNC(=O)N(CCCl)N=O)NC(=O)N(CCCl)N=O	{33: 2, 2: 6, 34: 2, 17: 2, 24: 2, 29: 2, 31: 2}
OK	60784-42-1	CC(CNC(=O)N(CCCl)N=O)NC(=O)N(CCCl)N=O	{1: 1, 2: 5, 3: 1, 33: 2, 34: 2, 17: 2, 24: 2, 29: 2, 31: 2}
OK	60784-43-2	C(CCNC(=O)N(CCCl)N=O)CNC(=O)N(CCCl)N=O	{33: 2, 2: 8, 34: 2, 17: 2, 24: 2, 29: 2, 31: 2}
OK	60784-44-3	C(CCNC(=O)N(CCCl)N=O)CCNC(=O)N(CCCl)N=O	{33: 2, 2: 9, 34: 2, 17: 2, 24: 2, 29: 2, 31: 2}
OK	60784-46-5	C(CO)NC(=O)N(CCCl)N=O	{33: 1, 2: 4, 34: 1, 17: 1, 20: 1, 24: 1, 29: 1, 31: 1}
OK	60784-47-6	C(CNC(=O)N(CCCl)N=O)CO	{33: 1, 2: 5, 34: 1, 17: 1, 20: 1, 24: 1, 29: 1, 31: 1}
OK	60784-48-7	C(CCO)CNC(=O)N(CCCl)N=O	{33: 1, 2: 6, 34: 1, 17: 1, 20: 1, 24: 1, 29: 1, 31: 1}
OK	6079-57-8	CC(C)(C)CSC	{40: 1, 1: 4, 2: 1, 4: 1}
OK	608-34-4	CN1C(=O)C=CNC1=O	{32: 1, 1: 1, 33: 1, 14: 2, 25: 2}
OK	608-37-7	C(=C(C(=O)O)Br)(C(=O)O)Br	{18: 2, 27: 2, 7: 2}
OK	608-45-7	C1[C@H]([C@H]([C@@H]([C@H](O1)O)O)O)O	{20: 4, 11: 1, 12: 4, 23: 1}
OK	608-66-2	C(C(C(C(C(CO)O)O)O)O)O	{2: 2, 3: 4, 20: 6}
OK	608-68-4	COC(=O)[C@@H]([C@H](C(=O)OC)O)O	{1: 2, 3: 2, 20: 2, 28: 2}
OK	608-89-9	CCOC(=O)C(C(C(=O)O)O)O	{1: 1, 2: 1, 3: 2, 20: 2, 27: 1, 28: 1}
OK	60812-41-1	CC(OC)OCC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 22: 2}
OK	60816-64-0	C(CO)NCCO.C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O	{33: 2, 2: 10, 27: 4, 20: 2, 31: 1}
OK	60827-45-4	C([C@@H](CCl)O)O	{17: 1, 2: 2, 3: 1, 20: 2}
OK	60836-07-9	CC(C)CC(C)(CC(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	60838-50-8	CO/C=C/C#N	{1: 1, 22: 1, 6: 2, 37: 1}
OK	60857-05-8	CC(=CC1CC(=C)CCO1)C	{1: 2, 5: 1, 6: 1, 7: 1, 11: 3, 12: 1, 15: 1, 23: 1}
OK	6086-21-1	CN1C=NC=N1	{1: 1, 35: 2, 14: 2, 33: 1}
OK	6086-22-2	CCCCN1C=NC=N1	{1: 1, 2: 3, 35: 2, 14: 2, 33: 1}
OK	6088-90-0	C#CC#CBr	{9: 1, 10: 3, 18: 1}
OK	6088-91-1	C#CC#CI	{9: 1, 10: 3, 19: 1}
OK	60887-86-7	C/C(=C\C(=O)C)/SC	{24: 1, 1: 3, 40: 1, 6: 1, 7: 1}
OK	6089-04-9	C#CCOC1CCCCO1	{2: 1, 9: 1, 10: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	6089-09-4	C#CCCC(=O)O	{9: 1, 2: 2, 27: 1, 10: 1}
OK	609-02-9	CC(C(=O)OC)C(=O)OC	{1: 3, 3: 1, 28: 2}
OK	609-06-3	C(C(C(C(C=O)O)O)O)O	{2: 1, 3: 3, 20: 4, 26: 1}
OK	609-08-5	CCOC(=O)C(C)C(=O)OCC	{1: 3, 2: 2, 3: 1, 28: 2}
OK	609-09-6	CCOC(=O)C(=O)C(=O)OCC	{24: 1, 1: 2, 2: 2, 28: 2}
OK	609-11-0	CCOC(=O)C(C(C)Br)Br	{1: 2, 2: 1, 3: 2, 28: 1, 18: 2}
OK	609-12-1	CCOC(=O)C(C(C)C)Br	{1: 3, 2: 1, 3: 2, 28: 1, 18: 1}
OK	609-13-2	CCOC(=O)C(C(=O)C)Br	{1: 2, 2: 1, 3: 1, 18: 1, 24: 1, 28: 1}
OK	609-14-3	CCOC(=O)C(C)C(=O)C	{24: 1, 1: 3, 2: 1, 3: 1, 28: 1}
OK	609-15-4	CCOC(=O)C(C(=O)C)Cl	{1: 2, 2: 1, 3: 1, 17: 1, 24: 1, 28: 1}
OK	609-26-7	CCC(CC)C(C)C	{1: 4, 2: 2, 3: 2}
OK	609-27-8	CCC(CC)C(C)O	{1: 3, 2: 2, 3: 2, 20: 1}
OK	609-29-0	CC/C(=N\O)/C(=O)C	{1: 2, 2: 1, 7: 1, 34: 1, 20: 1, 24: 1}
OK	609-31-4	CCC(CO)[N+](=O)[O-]	{1: 1, 2: 2, 3: 1, 20: 1, 38: 1}
OK	609-36-9	C1CC(NC1)C(=O)O	{27: 1, 32: 1, 11: 3, 12: 1}
OK	609-41-6	CC(=O)N1C=CC=C1	{24: 1, 1: 1, 14: 4, 33: 1}
OK	6090-09-1	CC1=CCC(CC1)C(=O)C	{1: 2, 11: 3, 12: 1, 14: 1, 15: 1, 24: 1}
OK	6090-16-0	CC(=CCC=C(C)C)C	{1: 4, 2: 1, 6: 2, 7: 2}
OK	6091-44-7	C1CCNCC1.Cl	{32: 1, 17: 1, 11: 5}
OK	6092-47-3	CCOC(=O)NC(=O)CCl	{1: 1, 2: 2, 17: 1, 24: 1, 28: 1, 31: 1}
OK	6092-54-2	CCCCCCOC(=O)Cl	{1: 1, 2: 5, 28: 1, 17: 1}
OK	6094-02-6	CCCCC(=C)C	{1: 2, 2: 3, 5: 1, 7: 1}
OK	6094-40-2	C1CNCCN1.Cl	{32: 2, 17: 1, 11: 4}
OK	60948-91-6	CCCCCCC(CCCCCC)C(=O)O	{27: 1, 1: 2, 2: 10, 3: 1}
OK	60964-67-2	C1C=CCC23C1(CC=CC2)CC3=O	{25: 1, 11: 5, 13: 2, 14: 4}
OK	60998-24-5	CCCCCCCCC=CC=CC=O	{1: 1, 2: 7, 26: 1, 6: 4}
OK	61-90-5	CC(C)C[C@@H](C(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	61-94-9	CN1CCC=C(C1)C(=O)OC.Cl	{1: 2, 33: 1, 11: 3, 14: 1, 15: 1, 17: 1, 28: 1}
OK	610-09-3	C1CC[C@@H]([C@@H](C1)C(=O)O)C(=O)O	{27: 2, 11: 4, 12: 2}
OK	610-88-8	CCC(C)C1C(=C(C(=O)N1)C(=O)C)O	{32: 1, 1: 3, 2: 1, 3: 1, 12: 1, 15: 2, 20: 1, 24: 1, 25: 1}
OK	610-89-9	CCOC(=O)C(CC=C)C(=O)C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 24: 1, 28: 1}
OK	61012-98-4	CN1CN2CCCCN2CN1C	{1: 2, 11: 6, 33: 4}
OK	6102-15-4	CCOC(=O)C1C(CC(=O)C=C1C)C	{1: 3, 2: 1, 11: 1, 12: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	61020-07-3	COC1CCCCN1C=O	{1: 1, 33: 1, 11: 4, 12: 1, 22: 1, 26: 1}
OK	61020-09-5	COC1COCCN1C=O	{1: 1, 33: 1, 11: 3, 12: 1, 22: 1, 23: 1, 26: 1}
OK	6104-30-9	CC(C)C(NC(=O)N)NC(=O)N	{24: 2, 1: 2, 3: 2, 30: 2, 31: 2}
OK	61041-75-6	CC=CC=CC(=O)OCC(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 6: 4}
OK	61050-68-8	CCCC(=C(CCC)N=O)NO	{1: 2, 2: 4, 7: 2, 34: 1, 20: 1, 29: 1, 31: 1}
OK	61064-08-2	CC(C)C(C)C#C	{1: 3, 10: 1, 3: 2, 9: 1}
OK	61064-09-3	CCC(C)CCC#C	{1: 2, 2: 3, 3: 1, 10: 1, 9: 1}
OK	6109-70-2	CC(=O)OC1CN2CCC1CC2.Cl	{1: 1, 33: 1, 11: 5, 12: 2, 17: 1, 28: 1}
OK	61092-76-0	CC(C)(C)CC=C=CC(C)(C)C	{8: 1, 1: 6, 2: 1, 4: 2, 6: 2}
OK	61097-65-2	CC(=C1C(S1)(C)C)C	{1: 4, 41: 1, 15: 1, 13: 1, 7: 1}
OK	611-10-9	CCOC(=O)C1CCCC1=O	{1: 1, 2: 1, 11: 3, 12: 1, 25: 1, 28: 1}
OK	611-12-1	CCN(CC)C(C)CO	{1: 3, 2: 3, 3: 1, 20: 1, 33: 1}
OK	6110-53-8	CCCCCCCCC=CCCCCCCCCBr	{1: 1, 2: 15, 18: 1, 6: 2}
OK	6111-88-2	CC(C)(C)CC(C)(C)Cl	{1: 5, 2: 1, 4: 2, 17: 1}
OK	61114-77-0	C1C=CC2C1C3CC2C=C3.C(=C/C(=O)O)\C(=O)O	{27: 2, 11: 2, 12: 4, 14: 4, 6: 2}
OK	61121-67-3	CC(C(=O)O)O.CN(C)C1CCCCC1	{1: 3, 3: 1, 33: 1, 11: 5, 12: 1, 20: 1, 27: 1}
OK	61129-34-8	CCC=C=CCC(C)(C)C	{8: 1, 1: 4, 2: 2, 4: 1, 6: 2}
OK	61141-83-1	CCC1CCC1CC	{1: 2, 2: 2, 11: 2, 12: 2}
OK	61142-36-7	CCC=C(CC)C(=C)C	{1: 3, 2: 2, 5: 1, 6: 1, 7: 2}
OK	61142-79-8	CCC(C)CCCCCC=C	{1: 2, 2: 6, 3: 1, 5: 1, 6: 1}
OK	6117-80-2	OC/C=C\CO	{2: 2, 20: 2, 6: 2}
OK	6117-91-5	CC=CCO	{1: 1, 2: 1, 20: 1, 6: 2}
OK	6117-97-1	CCCCCCCCC(C)CCC	{1: 3, 2: 9, 3: 1}
OK	6117-98-2	CCCCCCCCCC(C)C(C)C	{1: 4, 2: 8, 3: 2}
OK	6117-99-3	CCCCCCCCC(C)CC(C)C	{1: 4, 2: 8, 3: 2}
OK	61171-34-4	CCOC(=O)C1CC(NC(C1)(C)C)(C)C	{32: 1, 1: 5, 2: 1, 11: 2, 12: 1, 13: 2, 28: 1}
OK	61184-93-8	CC[C@H](CCOCC)O	{1: 2, 2: 4, 3: 1, 20: 1, 22: 1}
OK	61189-99-9	CCOC(C(=O)N)OCC	{1: 2, 2: 2, 3: 1, 22: 2, 24: 1, 30: 1}
OK	6119-44-4	CC1(C(=NC2CCCCC2)C(C1=NC3CCCCC3)(C)C)C	{1: 4, 34: 2, 11: 10, 12: 2, 13: 2, 15: 2}
OK	61196-11-0	C(C(OC(C(F)(Cl)Cl)(F)F)(Cl)Cl)(C(F)(F)Cl)(F)F	{16: 7, 17: 5, 4: 5, 22: 1}
OK	612-05-5	COC1C(C(C(CO1)O)O)O	{1: 1, 11: 1, 12: 4, 20: 3, 22: 1, 23: 1}
OK	61203-01-8	CC(=O)C(=C)Br	{24: 1, 1: 1, 18: 1, 5: 1, 7: 1}
OK	61228-09-9	CCC#CC(C)CC	{1: 3, 2: 2, 3: 1, 10: 2}
OK	6124-90-9	CCCC1C(O1)C	{1: 2, 2: 2, 12: 2, 23: 1}
OK	61242-71-5	CCOC(=O)C1CC2CCC1C2	{1: 1, 2: 1, 11: 4, 12: 3, 28: 1}
OK	61244-93-7	C=C=C=O	{8: 2, 5: 1, 29: 1}
OK	6125-21-9	C(C[N+](=O)[O-])C[N+](=O)[O-]	{2: 3, 38: 2}
OK	6125-73-1	CCC(=NC1CCCCC1)CC	{1: 2, 2: 2, 7: 1, 11: 5, 12: 1, 34: 1}
OK	61256-56-2	C1CCC(=O)NCC1.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{32: 1, 2: 8, 11: 5, 20: 2, 25: 1, 27: 2}
OK	61260-55-7	CC1(CC(CC(N1)(C)C)NCCCCCCNC2CC(NC(C2)(C)C)(C)C)C	{32: 2, 1: 8, 2: 6, 11: 4, 12: 2, 13: 4, 31: 2}
OK	61262-94-0	CC(=O)CC[C@H]1C(OC(O1)(C)C)(C)C	{1: 5, 2: 2, 12: 1, 13: 2, 23: 2, 24: 1}
OK	61262-96-2	C/C(=C/CO)/CC[C@H]1C(OC(O1)(C)C)(C)C	{1: 5, 2: 3, 6: 1, 7: 1, 12: 1, 13: 2, 20: 1, 23: 2}
OK	61269-61-2	CC1(CC(CC(N1)(C)C)NCCCCCCNC2CC(NC(C2)(C)C)(C)C)C.C(CBr)Br	{32: 2, 1: 8, 2: 8, 11: 4, 12: 2, 13: 4, 18: 2, 31: 2}
OK	61277-90-5	C1C[C@H]2C[C@@H]1C[C@H]2O	{20: 1, 11: 4, 12: 3}
OK	61278-21-5	C([C@@H](CO)O)N	{2: 2, 3: 1, 20: 2, 30: 1}
OK	61278-81-7	CCOC(N1C=CN=C1)OCC	{1: 2, 2: 2, 3: 1, 33: 1, 14: 3, 35: 1, 22: 2}
OK	61278-83-9	C1=CC2C3C=CC=CC2C3C=C1	{12: 4, 14: 8}
OK	61278-86-2	C=C1C2C3C=CC=CC2C3C1=C	{12: 4, 5: 2, 14: 4, 15: 2}
OK	61299-72-7	CC1C(CC2CC1C2(C)C)CN	{1: 3, 2: 1, 11: 2, 12: 4, 13: 1, 30: 1}
OK	613-40-1	CC(C)CC(=O)OC1C(C2CCC1(C2)C)(C)C	{1: 5, 2: 1, 3: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	6130-87-6	CN(C)/N=N\N(C)C	{1: 4, 34: 2, 33: 2}
OK	6130-92-3	CC1(CCCC(N1N)(C)C)C	{1: 4, 11: 3, 13: 2, 30: 1, 33: 1}
OK	6130-94-5	C1CCN(CC1)N2CCCCC2	{33: 2, 11: 10}
OK	6130-96-7	CC(C)(C)CC(Cl)Cl	{1: 3, 2: 1, 3: 1, 4: 1, 17: 2}
OK	6130-98-9	CC(C)(C)C#CC#CC(C)(C)C	{1: 6, 10: 4, 4: 2}
OK	6131-24-4	CCC[C@@H](C)CC	{1: 3, 2: 3, 3: 1}
OK	6134-66-3	CCOC(=O)C(C(=O)C)(Cl)Cl	{1: 2, 2: 1, 4: 1, 17: 2, 24: 1, 28: 1}
OK	61346-73-4	C[C@]12CCCC([C@@H]1CCC(=C)[C@@H]2CCC(C)(C=C)O)(C)C	{1: 4, 2: 2, 4: 1, 5: 2, 6: 1, 11: 5, 12: 2, 13: 2, 15: 1, 20: 1}
OK	61348-28-5	CC(C)(C)OC(=O)N[C@H](CCC(=O)N)C(=O)O	{1: 3, 2: 2, 3: 1, 4: 1, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
OK	6135-29-1	C(=O)(C(Cl)(Cl)Cl)OC(Cl)(Cl)Cl	{17: 6, 4: 2, 28: 1}
OK	6135-36-0	CCCCNC(=O)NC	{24: 1, 1: 2, 2: 3, 31: 2}
OK	61350-03-6	CCCCCCCC(F)F	{16: 2, 1: 1, 2: 6, 3: 1}
OK	6136-93-2	CCOC(C#N)OCC	{1: 2, 2: 2, 3: 1, 37: 1, 22: 2}
OK	61361-18-0	CCCCCNC(C)CCC	{1: 3, 2: 6, 3: 1, 31: 1}
OK	61365-93-3	CCCOC(CBr)OCCC	{1: 2, 2: 5, 3: 1, 18: 1, 22: 2}
OK	6137-03-7	CCC(CC)C(=O)C	{24: 1, 1: 3, 2: 2, 3: 1}
OK	6137-06-0	CCCC(C)CC(=O)C	{24: 1, 1: 3, 2: 3, 3: 1}
OK	6137-08-2	CCCCCC(C)C(=O)C	{24: 1, 1: 3, 2: 4, 3: 1}
OK	6137-11-7	CCCC(C)C(=O)CC	{24: 1, 1: 3, 2: 3, 3: 1}
OK	6137-15-1	CCCCC(C)C(=O)CC	{24: 1, 1: 3, 2: 4, 3: 1}
OK	6137-26-4	CCCCCCCCC(=O)CCC	{24: 1, 1: 2, 2: 9}
OK	6137-34-4	CCCCCCCC(=O)CCCCCC	{24: 1, 1: 2, 2: 11}
OK	6138-85-8	CC1CCCC(C1CCC(=O)C)(C)C	{1: 4, 2: 2, 11: 3, 12: 2, 13: 1, 24: 1}
OK	6138-90-5	CC(=CCC/C(=C/CBr)/C)C	{1: 3, 2: 3, 18: 1, 6: 2, 7: 2}
OK	61382-99-8	CC(CCC(C(=C)C)OC(=O)C)C=C	{1: 3, 2: 2, 3: 2, 5: 2, 6: 1, 7: 1, 28: 1}
OK	61385-78-2	CCC(CC)C=NCC(C)C	{1: 4, 2: 3, 3: 2, 34: 1, 6: 1}
OK	61394-27-2	C[C@H]1C[C@@H](C=C1)C	{1: 2, 11: 1, 12: 2, 14: 2}
OK	614-95-9	CCN(C(=O)OCC)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 28: 1, 29: 1}
OK	6140-61-0	CC(C)(CCC#N)C=O	{1: 2, 2: 2, 4: 1, 26: 1, 37: 1}
OK	6140-65-4	C1CC=C(C1)C=O	{26: 1, 11: 3, 14: 1, 15: 1}
OK	6140-80-3	CC(C)OCC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 22: 1}
OK	61413-61-4	CCCCCCCCCCCC(=O)OCN1C=C[N+](=C1)C.[Cl-]	{1: 2, 2: 11, 33: 2, 14: 3, 17: 1, 28: 1}
OK	61413-67-0	CCCCCCCCCCCC(=O)OCCl	{1: 1, 2: 11, 28: 1, 17: 1}
OK	61413-70-5	CCCCCCCC(=O)OCCl	{1: 1, 2: 7, 28: 1, 17: 1}
OK	61414-48-0	CC1(C#CC(C#CC(C#CC(C#C1)(C)C)(C)C)(C)C)C	{1: 8, 10: 8, 13: 4}
OK	6142-73-0	C=C1CC1	{11: 2, 5: 1, 15: 1}
OK	61424-17-7	C=CCN(CCCCO)N=O	{33: 1, 2: 5, 5: 1, 6: 1, 34: 1, 20: 1, 29: 1}
OK	61424-18-8	C=CCCN(CCCO)N=O	{33: 1, 2: 5, 5: 1, 6: 1, 34: 1, 20: 1, 29: 1}
OK	6143-29-9	CC(=O)OC1CC2CC1C=C2	{1: 1, 11: 2, 12: 3, 14: 2, 28: 1}
OK	61433-91-8	C(C(=O)OCC(F)(F)F)Br	{16: 3, 28: 1, 2: 2, 4: 1, 18: 1}
OK	6144-15-6	CC(C)(C(=O)OC)N([N+](=O)C(C)(C)C(=O)OC)[O-]	{1: 6, 4: 2, 29: 2, 28: 2, 33: 2}
OK	6144-93-0	CC(CC(C)(C)C)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1}
OK	61444-39-1	CCCCCCC(=O)OCCC=CCC	{1: 2, 2: 8, 28: 1, 6: 2}
OK	61444-41-5	CCCCCCCC(=O)OCCC=CCC	{1: 2, 2: 9, 28: 1, 6: 2}
OK	61445-55-4	CN(CCCC(=O)O)N=O	{1: 1, 34: 1, 33: 1, 2: 3, 27: 1, 29: 1}
OK	61446-86-4	CC(=C)CCC(Cl)(Cl)Cl	{1: 1, 2: 2, 4: 1, 5: 1, 7: 1, 17: 3}
OK	61447-07-2	CC(=O)OC(C)(C[N+](=O)[O-])C=C	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 38: 1, 28: 1}
OK	6145-42-2	CN(C)C(=N)N	{1: 2, 36: 1, 33: 1, 30: 1, 7: 1}
OK	61463-28-3	CC/C=C/O/C=C/C	{1: 2, 2: 1, 22: 1, 6: 4}
OK	61463-32-9	C/C=C/O/C=C/C(C)C	{1: 3, 3: 1, 22: 1, 6: 4}
OK	61463-36-3	CC(C)CC(=C)OC=C	{1: 2, 2: 1, 3: 1, 5: 2, 6: 1, 7: 1, 22: 1}
OK	61463-37-4	CC(C)/C=C(\C)/OC=C	{1: 3, 3: 1, 5: 1, 6: 2, 7: 1, 22: 1}
OK	61463-38-5	CC(C)C=C(C)OC=C	{1: 3, 3: 1, 5: 1, 6: 2, 7: 1, 22: 1}
OK	61463-39-6	CC(C)CC(=C)OC(=C)C	{1: 3, 2: 1, 3: 1, 5: 2, 7: 2, 22: 1}
OK	61463-40-9	CC(C)/C=C(\C)/OC(=C)C	{1: 4, 3: 1, 5: 1, 6: 1, 7: 2, 22: 1}
OK	61463-41-0	CC(C)C=C(C)OC(=C)C	{1: 4, 3: 1, 5: 1, 6: 1, 7: 2, 22: 1}
OK	61463-42-1	CC(C)C(=C)OC=C	{1: 2, 3: 1, 5: 2, 6: 1, 7: 1, 22: 1}
OK	61463-43-2	CC(=C(C)OC=C)C	{1: 3, 22: 1, 5: 1, 6: 1, 7: 2}
OK	6147-66-6	C=CCNCC=C.Cl	{17: 1, 2: 2, 5: 2, 6: 2, 31: 1}
OK	61470-87-9	CN(C)CCCN.COC(=O)CCCC(=O)OC.C(CNCCN)N.C(CCl)OCCCl	{1: 4, 2: 14, 33: 1, 17: 2, 22: 1, 28: 2, 30: 3, 31: 1}
OK	61488-62-8	CCCCOC(=O)C=C.CC(=C)C(=O)OCC=C	{1: 2, 2: 4, 5: 3, 6: 2, 7: 1, 28: 2}
OK	61489-23-4	C1CCC2(CC1)OC[C@@H](O2)[C@@H]3[C@H]4[C@@H]([C@H](O3)O)OC5(O4)CCCCC5	{20: 1, 11: 11, 12: 5, 13: 2, 23: 5}
OK	6149-41-3	COC(=O)CCO	{1: 1, 2: 2, 20: 1, 28: 1}
OK	6149-45-7	CC(C)(CC(=O)OC)O	{1: 3, 2: 1, 4: 1, 20: 1, 28: 1}
OK	61499-28-3	CC(CN(CC(=O)C)N=O)O	{1: 2, 2: 2, 3: 1, 33: 1, 34: 1, 20: 1, 24: 1, 29: 1}
OK	615-29-2	CCC(C)C(CC)O	{1: 3, 2: 2, 3: 2, 20: 1}
OK	615-30-5	CCC(C(C)C=O)O	{1: 2, 2: 1, 3: 2, 20: 1, 26: 1}
OK	615-35-0	CNC(=O)C(=O)NC	{24: 2, 1: 2, 31: 2}
OK	615-53-2	CCOC(=O)N(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	615-77-0	CN1C=CC(=O)NC1=O	{32: 1, 1: 1, 33: 1, 14: 2, 25: 2}
OK	615-79-2	CCOC(=O)C(=O)CC(=O)C	{24: 2, 1: 2, 2: 2, 28: 1}
OK	615-81-6	CC(C)OC(=O)C(=O)OC(C)C	{1: 4, 3: 2, 28: 2}
OK	615-82-7	CC(C)CC(C(=O)NCC(=O)O)N	{1: 2, 2: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	615-83-8	CCCC(C(=O)OCC)Br	{1: 2, 2: 3, 3: 1, 28: 1, 18: 1}
OK	615-84-9	CCNC(=O)C(=O)NCC	{24: 2, 1: 2, 2: 2, 31: 2}
OK	615-93-0	C1=C(C(=O)C=C(C1=O)Cl)Cl	{17: 2, 25: 2, 14: 2, 15: 2}
OK	615-94-1	C1=C(C(=O)C=C(C1=O)O)O	{25: 2, 20: 2, 14: 2, 15: 2}
OK	615-96-3	CCCCC(C(=O)OCC)Br	{1: 2, 2: 4, 3: 1, 28: 1, 18: 1}
OK	615-98-5	CCCOC(=O)C(=O)OCCC	{1: 2, 2: 4, 28: 2}
OK	615-99-6	C=CCOC(=O)C(=O)OCC=C	{2: 2, 28: 2, 5: 2, 6: 2}
OK	61506-29-4	C1CCC2C3CCCCC2C3C1	{11: 8, 12: 4}
OK	6152-95-0	CC1(CCCC(N1C)(C)C)C.Cl	{1: 5, 33: 1, 11: 3, 13: 2, 17: 1}
OK	6153-16-8	CC(C)[C@@H]1CCC(=C)C=C1	{1: 2, 3: 1, 5: 1, 11: 2, 12: 1, 14: 2, 15: 1}
OK	61531-45-1	CCCCCCCCC(=O)OCCCCC	{1: 2, 2: 11, 28: 1}
OK	61539-75-1	CCCC(C(CCC)Br)Br	{1: 2, 2: 4, 3: 2, 18: 2}
OK	6154-14-9	CNCl	{1: 1, 31: 1, 17: 1}
OK	61542-18-5	CCCC(=O)OCC(C)(C)NCl	{1: 3, 2: 3, 4: 1, 17: 1, 28: 1, 31: 1}
OK	61542-19-6	CCCC(=O)OCC(C)(C)N(Cl)Cl	{1: 3, 2: 3, 4: 1, 33: 1, 17: 2, 28: 1}
OK	61542-20-9	CC(C)(C)C(=O)OCC(C)(C)NCl	{1: 5, 2: 1, 4: 2, 17: 1, 28: 1, 31: 1}
OK	61542-21-0	CC(C)(C)C(=O)OCC(C)(C)N(Cl)Cl	{1: 5, 2: 1, 4: 2, 33: 1, 17: 2, 28: 1}
OK	6155-58-4	CC1=C(C(CC=C1)(C)C)C=NO	{1: 3, 34: 1, 6: 1, 11: 1, 13: 1, 14: 2, 15: 2, 20: 1}
OK	61553-03-5	CCOC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCC=C	{1: 4, 2: 2, 5: 4, 6: 2, 7: 2, 28: 3}
OK	6156-25-8	CSC(SC)(SC)SC	{40: 4, 1: 4, 4: 1}
OK	61565-20-6	CCOC(C)OCCCC#CCO	{1: 2, 2: 5, 3: 1, 10: 2, 20: 1, 22: 2}
OK	61565-21-7	CCOC(C)OCCCC=CCO	{1: 2, 2: 5, 3: 1, 6: 2, 20: 1, 22: 2}
OK	61565-22-8	CCOC(C)OCCCC=CCCl	{1: 2, 2: 5, 3: 1, 6: 2, 17: 1, 22: 2}
OK	61565-23-9	CCCCCC#CCC=CCCCOC(C)OCC	{1: 3, 2: 9, 3: 1, 6: 2, 10: 2, 22: 2}
OK	61565-24-0	CCCCCC#CCC=CCCCO	{1: 1, 2: 8, 20: 1, 10: 2, 6: 2}
OK	61568-36-3	CC[C@H]1[C@@H](CCS1)C	{1: 2, 2: 1, 11: 2, 12: 2, 41: 1}
OK	61568-37-4	CC[C@H]1[C@H](CCS1)C	{1: 2, 2: 1, 11: 2, 12: 2, 41: 1}
OK	61568-42-1	C[C@@H]1CCS[C@H](C1)C	{1: 2, 11: 3, 12: 2, 41: 1}
OK	61568-43-2	C[C@H]1CCS[C@H](C1)C	{1: 2, 11: 3, 12: 2, 41: 1}
OK	61568-48-7	CCC1CCCSC1	{1: 1, 2: 1, 11: 4, 12: 1, 41: 1}
OK	61586-79-6	CCOC(=O)[C@@H]1CCC[C@@H]1O	{1: 1, 2: 1, 11: 3, 12: 2, 20: 1, 28: 1}
OK	61589-68-2	CCCC(C(=O)Cl)Cl	{24: 1, 1: 1, 2: 2, 3: 1, 17: 2}
OK	61597-96-4	CC(C)COC(=O)C(C)O	{1: 3, 2: 1, 3: 2, 20: 1, 28: 1}
OK	616-01-3	CCCCCCCCC(C(CCCCCCCCCCCC(=O)O)O)O	{27: 1, 1: 1, 2: 18, 3: 2, 20: 2}
OK	616-03-5	CC1C(=O)NC(=O)N1	{32: 2, 1: 1, 12: 1, 25: 2}
OK	616-04-6	CN1CC(=O)NC1=O	{32: 1, 1: 1, 11: 1, 33: 1, 25: 2}
OK	616-05-7	CCCCC(C(=O)O)Br	{27: 1, 1: 1, 2: 3, 3: 1, 18: 1}
OK	616-06-8	CCCCC(C(=O)O)N	{27: 1, 1: 1, 2: 3, 3: 1, 30: 1}
OK	616-09-1	CCCOC(=O)C(C)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 1}
OK	616-12-6	C/C=C(\C)CC	{1: 3, 2: 1, 6: 1, 7: 1}
OK	616-13-7	CCC(C)CCl	{1: 2, 2: 2, 3: 1, 17: 1}
OK	616-14-8	CCC(C)CI	{19: 1, 1: 2, 2: 2, 3: 1}
OK	616-19-3	CC(CCl)CCl	{1: 1, 2: 2, 3: 1, 17: 2}
OK	616-20-6	CCC(CC)Cl	{1: 2, 2: 2, 3: 1, 17: 1}
OK	616-21-7	CCC(CCl)Cl	{1: 1, 2: 2, 3: 1, 17: 2}
OK	616-23-9	C(C(CCl)Cl)O	{17: 2, 2: 2, 3: 1, 20: 1}
OK	616-24-0	CCC(CC)N	{1: 2, 2: 2, 3: 1, 30: 1}
OK	616-25-1	CCC(C=C)O	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 20: 1}
OK	616-27-3	CCC(=O)CCl	{24: 1, 1: 1, 2: 2, 17: 1}
OK	616-29-5	C(C(CN)O)N	{2: 2, 3: 1, 20: 1, 30: 2}
OK	616-30-8	C(C(CO)O)N	{2: 2, 3: 1, 20: 2, 30: 1}
OK	616-31-9	CCC(CC)S	{1: 2, 2: 2, 3: 1, 39: 1}
OK	616-34-2	COC(=O)CN	{1: 1, 2: 1, 28: 1, 30: 1}
OK	616-39-7	CCN(C)CC	{1: 3, 2: 2, 33: 1}
OK	616-45-5	C1CC(=O)NC1	{32: 1, 25: 1, 11: 3}
OK	616-47-7	CN1C=CN=C1	{1: 1, 35: 1, 14: 3, 33: 1}
OK	616-62-6	CCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 2, 3: 1}
OK	616-88-6	CCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 4, 3: 1}
OK	616-91-1	CC(=O)N[C@@H](CS)C(=O)O	{1: 1, 2: 1, 3: 1, 39: 1, 24: 1, 27: 1, 31: 1}
OK	61626-05-9	C1=NNC=NN1	{32: 2, 35: 2, 14: 2}
OK	6163-64-0	CC(C)(C)SC	{40: 1, 1: 4, 4: 1}
OK	6163-66-2	CC(C)(C)OC(C)(C)C	{1: 6, 4: 2, 22: 1}
OK	6165-37-3	CCCCCC(CCC)CCC	{1: 3, 2: 8, 3: 1}
OK	6165-39-5	CCCCCCCC(C)CCCCCC	{1: 3, 2: 11, 3: 1}
OK	6165-40-8	CCCCCCCCC(C)CCCCCC	{1: 3, 2: 12, 3: 1}
OK	6165-44-2	C1CCC(CC1)CCCCC2CCCCC2	{2: 4, 11: 10, 12: 2}
OK	6165-96-4	C#CC#CC#CC#C	{9: 2, 10: 6}
OK	61675-14-7	CC(CC(=O)C)C=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 24: 1}
OK	6168-72-5	CC(CO)N	{1: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	6168-76-9	CCC(C(=O)N(C)C)N(CC)C(=O)/C=C/C	{1: 5, 2: 2, 3: 1, 6: 2, 33: 2, 24: 2}
OK	6168-86-1	CC(CCC=C(C)C)NC.Cl	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 17: 1, 31: 1}
OK	61680-38-4	CCC(CO)(CO)COCC=C.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 9, 4: 1, 5: 1, 6: 1, 20: 2, 22: 1, 27: 2}
OK	61682-73-3	CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCC	{1: 4, 2: 84, 4: 1, 28: 4}
OK	61685-40-3	C=CC1SCCCS1	{41: 2, 11: 3, 12: 1, 5: 1, 6: 1}
OK	6169-06-8	CCCCCC[C@H](C)O	{1: 2, 2: 5, 3: 1, 20: 1}
OK	61692-77-1	CCC(C)COC(=O)C(=CC)C	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 28: 1}
OK	61692-83-9	CCCOC(=O)/C(=C/C)/C	{1: 3, 2: 2, 28: 1, 6: 1, 7: 1}
OK	617-27-6	CCOC(=O)C(C)N.Cl	{1: 2, 2: 1, 3: 1, 17: 1, 28: 1, 30: 1}
OK	617-29-8	CCCC(C(C)C)O	{1: 3, 2: 2, 3: 2, 20: 1}
OK	617-30-1	CCCC(C(C)O)O	{1: 2, 2: 2, 3: 2, 20: 2}
OK	617-31-2	CCCC(C(=O)O)O	{27: 1, 1: 1, 2: 2, 3: 1, 20: 1}
OK	617-32-3	C/C(=N\OC)/C(=O)C	{24: 1, 1: 3, 34: 1, 22: 1, 7: 1}
OK	617-33-4	CCOC(=O)C(Br)Br	{1: 1, 2: 1, 3: 1, 28: 1, 18: 2}
OK	617-35-6	CCOC(=O)C(=O)C	{24: 1, 1: 2, 2: 1, 28: 1}
OK	617-36-7	CCOC(=O)C(=O)N	{24: 1, 1: 1, 2: 1, 28: 1, 30: 1}
OK	617-45-8	C(C(C(=O)O)N)C(=O)O	{27: 2, 2: 1, 3: 1, 30: 1}
OK	617-50-5	CC(C)C(=O)OC(C)C	{1: 4, 3: 2, 28: 1}
OK	617-52-7	COC(=O)CC(=C)C(=O)OC	{1: 2, 2: 1, 28: 2, 5: 1, 7: 1}
OK	617-54-9	CC(=CC(=O)OC)C(=O)OC	{1: 3, 28: 2, 6: 1, 7: 1}
OK	617-60-7	CCCCCCCCCCC(C(=O)OC)Br	{1: 2, 2: 9, 3: 1, 28: 1, 18: 1}
OK	617-65-2	C(CC(=O)O)C(C(=O)O)N	{27: 2, 2: 2, 3: 1, 30: 1}
OK	617-73-2	CCCCCCC(C(=O)O)O	{27: 1, 1: 1, 2: 5, 3: 1, 20: 1}
OK	617-78-7	CCC(CC)CC	{1: 3, 2: 3, 3: 1}
OK	617-79-8	CCC(CC)CN	{1: 2, 2: 3, 3: 1, 30: 1}
OK	617-80-1	CCC(CC)C#N	{1: 2, 2: 2, 3: 1, 37: 1}
OK	617-83-4	CCN(CC)C#N	{1: 2, 2: 2, 37: 1, 33: 1}
OK	617-84-5	CCN(CC)C=O	{1: 2, 2: 2, 26: 1, 33: 1}
OK	617-92-5	CCN1C=CC=C1	{1: 1, 2: 1, 14: 4, 33: 1}
OK	61702-61-2	CCCCCCCCCCCCCCCCCC(=O)N(CC)CCN(CC)C(=O)CCCCCCCCCCCCCCCCC	{24: 2, 1: 4, 2: 36, 33: 2}
OK	61702-64-5	CCCCCCCCCCCCCCCCCC(=O)NCOCCN(CCO)CCO	{1: 1, 2: 23, 33: 1, 20: 2, 22: 1, 24: 1, 31: 1}
OK	61713-23-3	CCOC(=O)CSCSCC(=O)OCC	{40: 2, 1: 2, 2: 5, 28: 2}
OK	61732-96-5	CCCCCCC1OCC=CCO1	{1: 1, 2: 5, 11: 2, 12: 1, 14: 2, 23: 2}
OK	61734-86-9	CCCCCN(CCCCO)N=O	{1: 1, 2: 8, 33: 1, 34: 1, 20: 1, 29: 1}
OK	61734-88-1	CCN(CCCO)N=O	{1: 1, 2: 4, 33: 1, 34: 1, 20: 1, 29: 1}
OK	61734-89-2	CCCCN(CC(=O)CC)N=O	{1: 2, 2: 5, 33: 1, 34: 1, 24: 1, 29: 1}
OK	61738-03-2	CCN(C(C)OC)N=O	{1: 3, 2: 1, 3: 1, 33: 1, 34: 1, 22: 1, 29: 1}
OK	61738-04-3	CCN(COC)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 22: 1, 29: 1}
OK	61738-05-4	CC(N(C)N=O)OC	{1: 3, 34: 1, 3: 1, 33: 1, 22: 1, 29: 1}
OK	6174-95-4	CCOC(=O)C(=C(C(=O)OCC)C(=O)OCC)C(=O)OCC	{1: 4, 2: 4, 28: 4, 7: 2}
OK	6175-23-1	CCCCCC(=O)CC(=O)C	{24: 2, 1: 2, 2: 5}
OK	6175-49-1	CCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 9}
OK	61759-61-3	CCOC(=O)N/C=C/C=C	{1: 1, 2: 1, 5: 1, 6: 3, 28: 1, 31: 1}
OK	61764-94-1	CCCC(C)(CCC)Cl	{1: 3, 2: 4, 4: 1, 17: 1}
OK	61771-84-4	C1C=CC2=C1C=CC2	{11: 2, 14: 4, 15: 2}
OK	61772-31-4	CC12CC=CC3C1C23	{1: 1, 11: 1, 12: 3, 13: 1, 14: 2}
OK	61772-32-5	CC12CC=CC3C1C23C	{1: 2, 11: 1, 12: 2, 13: 2, 14: 2}
OK	61772-33-6	CC12C3C1C2C=CC3	{1: 1, 11: 1, 12: 3, 13: 1, 14: 2}
OK	61777-25-1	CCCCC1(CCCC1=O)C(=O)OC	{1: 2, 2: 3, 11: 3, 13: 1, 25: 1, 28: 1}
OK	61786-07-0	CC(C)C(=C(C)C)C#C	{1: 4, 10: 1, 3: 1, 9: 1, 7: 2}
OK	61789-10-4	CCCCCCCCCCCCCCCCCC(=O)OC(C(CO)O)O	{1: 1, 2: 17, 3: 2, 20: 3, 28: 1}
OK	61791-92-2	CCCCCCCCCCCCCOC(=O)C=CC(=O)OCCCCCCCCCCCCC	{1: 2, 2: 24, 28: 2, 6: 2}
OK	61791-98-8	CCCCCCCCCCCCCCOC(=O)C(C)N.C(CO)N(CCO)CCO	{1: 2, 2: 19, 3: 1, 33: 1, 20: 3, 28: 1, 30: 1}
OK	61792-11-8	CCC(=CCCC(=CC#N)C)C	{1: 3, 2: 3, 37: 1, 6: 2, 7: 2}
OK	618-27-9	C1[C@@H](CN[C@@H]1C(=O)O)O	{27: 1, 20: 1, 11: 2, 12: 2, 32: 1}
OK	618-42-8	CC(=O)N1CCCCC1	{24: 1, 1: 1, 11: 5, 33: 1}
OK	61827-84-7	CCCCCCCCO.CC1CO1.C1CO1	{1: 2, 2: 7, 11: 3, 12: 1, 20: 1, 23: 2}
OK	61827-88-1	CCCCCC/C=C\C#C	{1: 1, 2: 5, 10: 1, 6: 2, 9: 1}
OK	61827-89-2	CCC#CCCCCC#CCC	{1: 2, 2: 6, 10: 4}
OK	61828-01-1	C[C@@H]1CCC[C@H]1C(C)C	{11: 3, 1: 3, 3: 1, 12: 2}
OK	61828-02-2	C[C@H]1CC[C@H](C1)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2}
OK	61828-03-3	C[C@H]1CC[C@@H](C1)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2}
OK	61828-09-9	CCCCCCCCCCCCCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 23, 11: 5, 12: 1}
OK	61832-41-5	CNC(=C[N+](=O)[O-])SC	{1: 2, 6: 1, 38: 1, 7: 1, 40: 1, 31: 1}
OK	61836-75-7	CC(C)CC(C)(C)CCOC(=O)C	{1: 5, 2: 3, 3: 1, 4: 1, 28: 1}
OK	61847-85-6	CCCCCCCCCCCCCCCCCCCCCCCC#C	{1: 1, 2: 22, 10: 1, 9: 1}
OK	61847-86-7	CCCCCCCCCCCCCCCCCCCCCCCCC#C	{1: 1, 2: 23, 10: 1, 9: 1}
OK	61847-87-8	CCCCCCCCCCCCCCCCCCCCCCCCCC#C	{1: 1, 2: 24, 10: 1, 9: 1}
OK	61849-14-7	CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)O2)O)O	{1: 1, 2: 7, 3: 1, 6: 3, 11: 2, 12: 4, 15: 1, 20: 2, 23: 1, 27: 1}
OK	6186-91-0	C=C(CCl)F	{16: 1, 17: 1, 2: 1, 5: 1, 7: 1}
OK	61860-67-1	COCC(=C)OC	{1: 2, 2: 1, 5: 1, 22: 2, 7: 1}
OK	61860-68-2	CC(=COC)OC	{1: 3, 22: 2, 6: 1, 7: 1}
OK	61860-71-7	COC1CCCC=C1OC	{1: 2, 11: 3, 12: 1, 14: 1, 15: 1, 22: 2}
OK	61860-72-8	COC1=C(CCCC1)OC	{1: 2, 11: 4, 22: 2, 15: 2}
OK	61860-73-9	COC1CCC=C1OC	{1: 2, 11: 2, 12: 1, 14: 1, 15: 1, 22: 2}
OK	61860-74-0	COC1=C(CCC1)OC	{1: 2, 11: 3, 22: 2, 15: 2}
OK	61865-96-1	CC=CSC(C)(C)C	{40: 1, 1: 4, 4: 1, 6: 2}
OK	61865-97-2	CC=CSC(C)C	{40: 1, 1: 3, 3: 1, 6: 2}
OK	61865-98-3	CCS/C=C/C	{40: 1, 1: 2, 2: 1, 6: 2}
OK	61865-99-4	C/C=C/SC(C)C	{40: 1, 1: 3, 3: 1, 6: 2}
OK	61866-00-0	C/C=C/SC(C)(C)C	{40: 1, 1: 4, 4: 1, 6: 2}
OK	61868-01-7	C[C@@H]1CCC[C@@H]1C(C)C	{11: 3, 1: 3, 3: 1, 12: 2}
OK	61868-05-1	CCCCCCCCCC(C)CC(C)C	{1: 4, 2: 9, 3: 2}
OK	61868-06-2	CCCCCCCCCCC(C)CC(C)C	{1: 4, 2: 10, 3: 2}
OK	61868-11-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 30, 5: 1, 6: 1}
OK	61868-13-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 32, 5: 1, 6: 1}
OK	61868-14-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 33, 5: 1, 6: 1}
OK	61868-15-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 34, 5: 1, 6: 1}
OK	61868-16-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 35, 5: 1, 6: 1}
OK	61868-17-5	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 36, 5: 1, 6: 1}
OK	61868-18-6	C=CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 1, 2: 37, 5: 1, 6: 1}
OK	61868-21-1	CCCCC(C)(CC)C(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-22-2	CCCC(CC)C(C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-23-3	CCC(CC)CC(C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-24-4	CCCC(C)C(CC)C(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-25-5	CCCC(C)(CC)CC(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-26-6	CCC(CC)C(C)CC(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-27-7	CCC(C)CC(CC)C(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-28-8	CCC(C)C(CC)CC(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-29-9	CCC(C)(CC)CCC(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-30-2	CCC(CCC(C)C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-31-3	CCC(CC(C)C)CC(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-32-4	CCCC(CC)C(C)(C)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-33-5	CCC(CC)CC(C)(C)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-34-6	CCCC(C)C(C)(CC)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-35-7	CCCC(C)(CC)C(C)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-36-8	CCC(C)C(C)C(CC)CC	{1: 5, 2: 3, 3: 3}
OK	61868-37-9	CCC(C)CC(C)(CC)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-38-0	CCC(C)C(CC)C(C)CC	{1: 5, 2: 3, 3: 3}
OK	61868-39-1	CCCC(C)(C)C(CC)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-40-4	CCCCC(C)(C)C(C)(C)C	{1: 6, 2: 3, 4: 2}
OK	61868-41-5	CCCC(C)C(C)C(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-42-6	CCC(C)CC(C)C(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-43-7	CC(C)CCC(C)C(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-44-8	CCCC(C)(C)CC(C)(C)C	{1: 6, 2: 3, 4: 2}
OK	61868-45-9	CCC(C)C(C)CC(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-46-0	CC(C)CC(C)CC(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-47-1	CCC(C)(C)CCC(C)(C)C	{1: 6, 2: 3, 4: 2}
OK	61868-48-2	CC(C)C(C)CCC(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-49-3	CCCC(C)C(C)(C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-50-6	CCC(C)CC(C)(C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-51-7	CC(C)CCC(C)(C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-52-8	CCCC(C)(C)C(C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-53-9	CCC(C)C(C)C(C)C(C)C	{1: 6, 2: 1, 3: 4}
OK	61868-54-0	CC(C)CC(C)C(C)C(C)C	{1: 6, 2: 1, 3: 4}
OK	61868-55-1	CCC(C)(C)CC(C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-56-2	CCC(C)C(C)(C)CC(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-57-3	CC(C)CC(C)(C)CC(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-58-4	CCC(C)(C)C(C)CC(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-59-5	CCCC(C)(C)C(C)(C)CC	{1: 6, 2: 3, 4: 2}
OK	61868-60-8	CCC(C)C(C)C(C)(C)CC	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-61-9	CCC(C)(C)CC(C)(C)CC	{1: 6, 2: 3, 4: 2}
OK	61868-62-0	CCC(C)C(C)(C)C(C)CC	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-63-1	CCCC(C(C)C)C(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-64-2	CCCC(C)(C(C)C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-65-3	CCC(C)C(C(C)C)C(C)C	{1: 6, 2: 1, 3: 4}
OK	61868-66-4	CC(C)CC(C(C)C)C(C)C	{1: 6, 2: 1, 3: 4}
OK	61868-67-5	CCCC(CC)(CC)C(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-68-6	CCC(CC)C(CC)C(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-69-7	CCC(CC)(CC)CC(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-70-0	CCC(CC)C(C)(CC)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-71-1	CCC(C)C(CC)(CC)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-72-2	CCCC(C)(CC)C(C)(C)C	{1: 6, 2: 3, 4: 2}
OK	61868-73-3	CCC(CC)C(C)C(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-74-4	CCC(C)C(CC)C(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-75-5	CCC(C)(CC)CC(C)(C)C	{1: 6, 2: 3, 4: 2}
OK	61868-76-6	CCC(CC(C)C)C(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-77-7	CCC(CC(C)(C)C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-78-8	CCC(CC)C(C)(C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-79-9	CCC(C)C(C)(CC)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-80-2	CCC(C)(CC)C(C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-81-3	CCC(C)(CC(C)C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-82-4	CCC(C(C)C)C(C)C(C)C	{1: 6, 2: 1, 3: 4}
OK	61868-83-5	CCC(C(C)C)C(C)(C)CC	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-84-6	CCC(C)(C)C(C)(CC)CC	{1: 6, 2: 3, 4: 2}
OK	61868-85-7	CCC(C)C(C)(C)C(C)(C)C	{1: 7, 2: 1, 3: 1, 4: 2}
OK	61868-86-8	CC(C)CC(C)(C)C(C)(C)C	{1: 7, 2: 1, 3: 1, 4: 2}
OK	61868-87-9	CCC(C)(C)C(C)C(C)(C)C	{1: 7, 2: 1, 3: 1, 4: 2}
OK	61868-88-0	CC(C)C(C)C(C)C(C)(C)C	{1: 7, 3: 3, 4: 1}
OK	61868-89-1	CCC(C)(C)C(C)(C)C(C)C	{1: 7, 2: 1, 3: 1, 4: 2}
OK	61868-90-4	CC(C)C(C(C)C)C(C)(C)C	{1: 7, 3: 3, 4: 1}
OK	61868-91-5	CC(C)C(C)(C(C)C)C(C)C	{1: 7, 3: 3, 4: 1}
OK	61868-92-6	CCC(CC)(C(C)C)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1}
OK	61868-93-7	CCC(C)(C(C)C)C(C)(C)C	{1: 7, 2: 1, 3: 1, 4: 2}
OK	61868-94-8	CCCC(C)(C)CC(C)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-95-9	CCCC(C)C(C)(C)CCC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61868-96-0	CCCC(CCC)CC(C)C	{1: 4, 2: 5, 3: 2}
OK	61868-97-1	CCCC(CCC)C(C)CC	{1: 4, 2: 5, 3: 2}
OK	61868-98-2	CCCC(CC(C)C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	61868-99-3	CCCC(C(C)C)C(C)CC	{1: 5, 2: 3, 3: 3}
OK	61869-00-9	CCCC(C)(CCC)C(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61869-01-0	CCCC(CC)C(CC)CC	{1: 4, 2: 5, 3: 2}
OK	61869-02-1	CCC(CC)CC(CC)CC	{1: 4, 2: 5, 3: 2}
OK	61869-03-2	CCCCC(CC)C(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	61869-04-3	CCCCCCCCCCCC(C)(C)C	{1: 4, 2: 10, 4: 1}
OK	61885-53-8	C1C2CC1C=CC=C2	{11: 2, 12: 2, 14: 4}
OK	61885-54-9	C1C=CCC2CC1C2	{11: 4, 12: 2, 14: 2}
OK	61886-61-1	CCCCCCCCCCCC#CCC	{1: 2, 2: 11, 10: 2}
OK	61886-62-2	CCCCCCCCCCCCC#CCC	{1: 2, 2: 12, 10: 2}
OK	61892-85-1	CC(=O)CC(C(=O)C)O	{24: 2, 1: 2, 2: 1, 3: 1, 20: 1}
OK	61893-09-2	CCN1CC(=O)NC1=O	{32: 1, 1: 1, 2: 1, 33: 1, 11: 1, 25: 2}
OK	61898-95-1	CC1(C(C1C(=O)OC)C=C(Cl)Cl)C	{1: 3, 6: 1, 7: 1, 12: 2, 13: 1, 17: 2, 28: 1}
OK	619-01-2	CC1CCC(CC1O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 3, 20: 1}
OK	619-33-0	CCOC(C(Cl)Cl)OCC	{1: 2, 2: 2, 3: 2, 22: 2, 17: 2}
OK	619-39-6	CCCCCCCCC(CCCCCCCC)C(=O)O	{27: 1, 1: 2, 2: 14, 3: 1}
OK	619-52-3	C[C@@H]1CCC(=CC1)C(C)C	{1: 3, 3: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	619-82-9	C1CC(CCC1C(=O)O)C(=O)O	{27: 2, 11: 4, 12: 2}
OK	619-99-8	CCCC(CC)CC	{1: 3, 2: 4, 3: 1}
OK	6191-71-5	CCC=CCCCO	{1: 1, 2: 4, 20: 1, 6: 2}
OK	61911-58-8	CCCCCCCCOC(=O)C=CC(=O)OCCCC	{1: 2, 2: 10, 28: 2, 6: 2}
OK	6192-29-6	CCCCSCC(=O)N[C@H]1[C@@H]2N(C1=O)[C@H](C(S2)(C)C)C(=O)O	{1: 3, 2: 4, 33: 1, 40: 1, 41: 1, 12: 3, 13: 1, 24: 1, 25: 1, 27: 1, 31: 1}
OK	61923-55-5	CCC(=C)O	{1: 1, 2: 1, 20: 1, 5: 1, 7: 1}
OK	61931-78-0	CC(=C)C(CC=C(C)C=C)OC(=O)C	{1: 3, 2: 1, 3: 1, 5: 2, 6: 2, 7: 2, 28: 1}
OK	61931-80-4	CCC(=CCCC(C)(C=C)OC(=O)C)C	{1: 4, 2: 3, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	61949-26-6	CCCCC(C)CO	{1: 2, 2: 4, 3: 1, 20: 1}
OK	6196-58-3	CCCCCOCCO	{1: 1, 2: 6, 20: 1, 22: 1}
OK	6196-60-7	CCC(C)(CC)C=C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 1}
OK	6196-80-1	CC(C)CCCI	{19: 1, 1: 2, 2: 3, 3: 1}
OK	6196-85-6	CC1(CCCC1)Cl	{1: 1, 11: 4, 13: 1, 17: 1}
OK	61962-23-0	CCCOC(C)CC	{1: 3, 2: 3, 3: 1, 22: 1}
OK	6198-57-8	C[C@@]12CCCC3(C1CCC45C3CCC(C4)C(=C)[C@@H]5O)C6N(C2)CCO6.Cl	{1: 1, 5: 1, 33: 1, 11: 11, 12: 5, 13: 3, 15: 1, 17: 1, 20: 1, 23: 1}
OK	6198-58-9	CCCCCC/C=C/CCCCCCCCCC(=O)OC	{1: 2, 2: 14, 28: 1, 6: 2}
OK	61987-71-1	CC(C)CCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)O	{1: 4, 2: 7, 3: 1, 5: 2, 7: 2, 27: 1, 28: 1}
OK	6199-67-3	CC(=O)OC(C)(C)/C=C/C(=O)[C@@](C)([C@H]1[C@@H](C[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O)C)C)C)O)O	{1: 9, 4: 2, 6: 2, 11: 4, 12: 5, 13: 4, 14: 1, 15: 1, 20: 3, 24: 1, 25: 2, 28: 1}
OK	61996-79-0	CC(C)CC(C#C)O	{1: 2, 2: 1, 3: 2, 9: 1, 10: 1, 20: 1}
OK	62-47-5	C(CNC(=O)CS)N	{24: 1, 2: 3, 39: 1, 30: 1, 31: 1}
OK	62-48-6	C(C(=O)NNC(=O)CS)S	{24: 2, 2: 2, 39: 2, 31: 2}
OK	62-57-7	CC(C)(C(=O)O)N	{1: 2, 27: 1, 4: 1, 30: 1}
OK	62-59-9	CC=C(C)C(=O)OC1CCC2(C3C1(OC24CC5(C6CN7CC(CCC7C(C6(C(CC5(C4CC3)O)O)O)(C)O)C)O)O)C	{1: 5, 33: 1, 6: 1, 7: 1, 11: 10, 12: 7, 13: 7, 20: 6, 23: 1, 28: 1}
OK	62-75-9	CN(C)N=O	{1: 2, 34: 1, 29: 1, 33: 1}
OK	620-11-1	CCC(CC)OC(=O)C	{1: 3, 2: 2, 3: 1, 28: 1}
OK	620-43-9	CCC(C)CN(CC(C)CC)CC(C)CC	{1: 6, 2: 6, 3: 3, 33: 1}
OK	620-63-3	CC(C)CC(=O)OCC(COC(=O)CC(C)C)OC(=O)CC(C)C	{1: 6, 2: 5, 3: 4, 28: 3}
OK	620-64-4	CCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC	{1: 3, 2: 56, 3: 1, 28: 3}
OK	620-82-6	C1CCC(CC1)OC(=O)C(=O)OC2CCCCC2	{28: 2, 11: 10, 12: 2}
OK	62016-13-1	CCCC(C(C)C)C(C)C	{1: 5, 2: 2, 3: 3}
OK	62016-14-2	CCC(C)C(C)CCC(C)C	{1: 5, 2: 3, 3: 3}
OK	62016-15-3	CCCCC(CCC)C(C)C	{1: 4, 2: 5, 3: 2}
OK	62016-16-4	CCCCCC(CC)C(C)C	{1: 4, 2: 5, 3: 2}
OK	62016-20-0	CCCCC(CC)C(C)CC	{1: 4, 2: 5, 3: 2}
OK	62016-21-1	CCCC(CC)CC(C)CC	{1: 4, 2: 5, 3: 2}
OK	62016-22-2	CCC(C)CCC(CC)CC	{1: 4, 2: 5, 3: 2}
OK	62016-23-3	CCCCC(C)C(CC)CC	{1: 4, 2: 5, 3: 2}
OK	62016-24-4	CCCC(C)C(CC)CCC	{1: 4, 2: 5, 3: 2}
OK	62016-25-5	CCCC(C)CC(CC)CC	{1: 4, 2: 5, 3: 2}
OK	62016-26-6	CCCCCC(C)C(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-27-7	CCCC(C)CCC(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-28-8	CCC(C)CCCC(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-29-9	CC(C)CCCCC(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-30-2	CCCCCC(C)(C)C(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-31-3	CCCCC(C)C(C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	62016-32-4	CCCC(C)CC(C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	62016-33-5	CCC(C)CCC(C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	62016-34-6	CC(C)CCCC(C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	62016-35-7	CCCCC(C)(C)CC(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-36-8	CCCC(C)C(C)CC(C)C	{1: 5, 2: 3, 3: 3}
OK	62016-37-9	CCC(C)CC(C)CC(C)C	{1: 5, 2: 3, 3: 3}
OK	62016-38-0	CC(C)CCC(C)CC(C)C	{1: 5, 2: 3, 3: 3}
OK	62016-39-1	CCCC(C)(C)CCC(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-40-4	CCCCC(C)C(C)(C)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-41-5	CCCC(C)CC(C)(C)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-42-6	CCC(C)CCC(C)(C)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-43-7	CCCCC(C)(C)C(C)CC	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-44-8	CCCC(C)C(C)C(C)CC	{1: 5, 2: 3, 3: 3}
OK	62016-45-9	CCC(C)CC(C)C(C)CC	{1: 5, 2: 3, 3: 3}
OK	62016-46-0	CCCC(CC)CC(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-47-1	CCC(CC)CCC(C)(C)C	{1: 5, 2: 4, 3: 1, 4: 1}
OK	62016-48-2	CCC(C)COC	{1: 3, 2: 2, 3: 1, 22: 1}
OK	62016-49-3	CC(C)C(C)OC	{1: 4, 3: 2, 22: 1}
OK	62016-61-9	CCC1CCC(C1)(C)C	{1: 3, 2: 1, 11: 3, 12: 1, 13: 1}
OK	62016-75-5	CCCCCCCCCCCCCCCCCCl	{1: 1, 2: 16, 17: 1}
OK	62016-82-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCl	{1: 1, 2: 29, 17: 1}
OK	62016-93-7	CCC(C)CCCl	{1: 2, 2: 3, 3: 1, 17: 1}
OK	62016-94-8	CC(C)CCCCl	{1: 2, 2: 3, 3: 1, 17: 1}
OK	62017-17-8	CCCCCCCCCCCC(Cl)Cl	{1: 1, 2: 10, 3: 1, 17: 2}
OK	62018-46-6	CC=C=C=C	{8: 2, 1: 1, 5: 1, 6: 1}
OK	62018-89-7	C(CCO)CN(CCO)N=O	{33: 1, 2: 6, 34: 1, 20: 2, 29: 1}
OK	62018-90-0	C(CCO)CN(CCCO)N=O	{33: 1, 2: 7, 34: 1, 20: 2, 29: 1}
OK	62018-91-1	CCCCN(CC(CCO)O)N=O	{1: 1, 2: 6, 3: 1, 33: 1, 34: 1, 20: 2, 29: 1}
OK	62018-92-2	CCCCN(CCC(=O)O)N=O	{1: 1, 34: 1, 33: 1, 2: 5, 27: 1, 29: 1}
OK	62024-60-6	CC1=C(SC(=C2SC=CS2)S1)C	{1: 2, 41: 4, 14: 2, 15: 4}
OK	62030-39-1	CCCOC(=O)/C=C/CC	{1: 2, 2: 3, 28: 1, 6: 2}
OK	62030-40-4	CCCOC(=O)C/C=C/C	{1: 2, 2: 3, 28: 1, 6: 2}
OK	62030-41-5	C/C=C/CC(=O)OC(C)C	{1: 3, 2: 1, 3: 1, 28: 1, 6: 2}
OK	62030-43-7	CCCOC(=O)CCC=C	{1: 1, 2: 4, 28: 1, 5: 1, 6: 1}
OK	62030-44-8	CC(C)OC(=O)CCC=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 28: 1}
OK	62032-12-6	C1C2(CSS1)C(=O)NC(=O)N2	{32: 2, 25: 2, 11: 2, 13: 1, 41: 2}
OK	62037-46-1	C(C(CCl)O)N.Cl	{17: 2, 2: 2, 3: 1, 20: 1, 30: 1}
OK	62038-11-3	C1COCCN1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{32: 1, 2: 2, 4: 1, 11: 4, 20: 1, 23: 1, 27: 3}
OK	62038-48-6	CC(C)(C)C(C)(OC)OC	{1: 6, 4: 2, 22: 2}
OK	62039-14-9	CC(C)(C)C(C1CCCCC1)O	{1: 3, 3: 1, 4: 1, 11: 5, 12: 1, 20: 1}
OK	62042-45-9	CCCCOC(CC)(OCCCC)OCCCC	{1: 4, 2: 10, 4: 1, 22: 3}
OK	62059-56-7	CCOC(=O)C1CCCC(C1)C(=O)OCC	{1: 2, 2: 2, 11: 4, 12: 2, 28: 2}
OK	62064-82-8	FS	{16: 1, 39: 1}
OK	62075-20-1	CC(=O)C1=C2C(C3CCC2(C3)C(CC1)(C)C)(C)C	{1: 5, 11: 5, 12: 1, 13: 3, 15: 2, 24: 1}
OK	62079-29-2	C1CCCC2(CCC1)CCCO2	{11: 10, 13: 1, 23: 1}
OK	62080-86-8	CCCCCC(C(CC(C(CCCCCCCC(=O)OC)Br)Br)Br)Br	{1: 2, 2: 12, 3: 4, 28: 1, 18: 4}
OK	62088-36-2	CCC1=CCC(CC1)C	{1: 2, 2: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	62093-65-6	COC(=O)C(CCCl)Cl	{1: 1, 2: 2, 3: 1, 28: 1, 17: 2}
OK	621-13-6	C1CCC(CC1)OC(=O)/C=C\C(=O)OC2CCCCC2	{28: 2, 11: 10, 12: 2, 6: 2}
OK	621-56-7	CCN(CC)CC(CO)O	{1: 2, 2: 4, 3: 1, 20: 2, 33: 1}
OK	621-61-4	CCCCCCCCCCCCCCCCCC(=O)OC(CO)CO	{1: 1, 2: 18, 3: 1, 20: 2, 28: 1}
OK	621-62-5	CCOC(CCl)OCC	{1: 2, 2: 3, 3: 1, 22: 2, 17: 1}
OK	621-63-6	CCOC(CO)OCC	{1: 2, 2: 3, 3: 1, 20: 1, 22: 2}
OK	621-64-7	CCCN(CCC)N=O	{1: 2, 2: 4, 34: 1, 29: 1, 33: 1}
OK	621-70-5	CCCCCC(=O)OCC(COC(=O)CCCCC)OC(=O)CCCCC	{1: 3, 2: 14, 3: 1, 28: 3}
OK	621-71-6	CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC	{1: 3, 2: 26, 3: 1, 28: 3}
OK	621-76-1	CCCOC(OCCC)OCCC	{1: 3, 2: 6, 3: 1, 22: 3}
OK	621-77-2	CCCCCN(CCCCC)CCCCC	{1: 3, 2: 12, 33: 1}
OK	62101-31-9	CCCCCCCCC(CC)(CC)O	{1: 3, 2: 9, 4: 1, 20: 1}
OK	62103-09-7	CC(C)C(CC(Cl)(Cl)Cl)Cl	{1: 2, 2: 1, 3: 2, 4: 1, 17: 4}
OK	62103-12-2	CCCCC#CCCC#CCCCCCCOC(=O)C	{1: 2, 2: 11, 28: 1, 10: 4}
OK	62103-65-5	CCCCCCCC(=O)NCCCCCCCCCCCCNC(=O)CCCCCCC	{24: 2, 1: 2, 2: 24, 31: 2}
OK	62103-66-6	CCCCCCCCCSCCC	{40: 1, 1: 2, 2: 10}
OK	62108-06-9	CCCCC(C)(CC=C)O	{1: 2, 2: 4, 4: 1, 5: 1, 6: 1, 20: 1}
OK	62108-22-9	CC(C)CCCC(C)CCC(C)C	{1: 5, 2: 5, 3: 3}
OK	62108-66-1	CCCOC(=O)CCCl	{1: 1, 2: 4, 28: 1, 17: 1}
OK	62108-67-2	CC(C)COC(=O)C(C)Cl	{1: 3, 2: 1, 3: 2, 28: 1, 17: 1}
OK	62108-68-3	CC(C)COC(=O)CCCl	{1: 2, 2: 3, 3: 1, 28: 1, 17: 1}
OK	62108-69-4	CC(C)CCOC(=O)C(C)Cl	{1: 3, 2: 2, 3: 2, 28: 1, 17: 1}
OK	62108-70-7	CC(C)CCOC(=O)CCCl	{1: 2, 2: 4, 3: 1, 28: 1, 17: 1}
OK	62108-71-8	CCCOC(=O)C(CC)Cl	{1: 2, 2: 3, 3: 1, 28: 1, 17: 1}
OK	62108-72-9	CCCOC(=O)CC(C)Cl	{1: 2, 2: 3, 3: 1, 28: 1, 17: 1}
OK	62108-74-1	CCCCOC(=O)C(CC)Cl	{1: 2, 2: 4, 3: 1, 28: 1, 17: 1}
OK	62108-76-3	CC(C)COC(=O)CC(C)Cl	{1: 3, 2: 2, 3: 2, 28: 1, 17: 1}
OK	62108-77-4	CC(C)COC(=O)CCCCl	{1: 2, 2: 4, 3: 1, 28: 1, 17: 1}
OK	62108-79-6	CC(C)CCOC(=O)CC(C)Cl	{1: 3, 2: 3, 3: 2, 28: 1, 17: 1}
OK	6211-16-1	C(C[C@@H](C(=O)O)N)CN.Cl.Cl	{27: 1, 17: 2, 2: 3, 3: 1, 30: 2}
OK	62111-47-1	C1(C(=C(C(C1(Cl)Cl)(Cl)Cl)Cl)Cl)Cl	{17: 7, 12: 1, 13: 2, 15: 2}
OK	62116-23-8	C(C=CC=CCBr)Br	{2: 2, 18: 2, 6: 4}
OK	62118-43-8	C(CCC(=O)O)CC(=O)O.C(CO)N(CCO)CCO	{33: 1, 2: 10, 27: 2, 20: 3}
OK	6212-93-7	CCCCCCCCCCCCCCCCCCC(=O)NC	{24: 1, 1: 2, 2: 17, 31: 1}
OK	62125-22-8	CC(C)CCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC(C)C)(COC(=O)CCCCCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCCCCC(C)C	{1: 8, 2: 60, 3: 4, 4: 1, 28: 4}
OK	62126-90-3	CC(CF)F	{16: 2, 1: 1, 2: 1, 3: 1}
OK	62127-41-7	CCCCCC(F)F	{16: 2, 1: 1, 2: 4, 3: 1}
OK	62127-42-8	CCCCCCCCC(F)F	{16: 2, 1: 1, 2: 7, 3: 1}
OK	62127-47-3	CC(C(C)(Br)Br)Br	{1: 2, 18: 3, 3: 1, 4: 1}
OK	62127-51-9	CCCCCCCCCCCCCCCCCCCI	{1: 1, 2: 18, 19: 1}
OK	62127-53-1	CCCCCCCCCCCCCCCCCCCCCCI	{1: 1, 2: 21, 19: 1}
OK	62127-58-6	CCC(C)C(Br)Br	{1: 2, 2: 1, 3: 2, 18: 2}
OK	62127-59-7	CC(C)CC(Br)Br	{1: 2, 2: 1, 3: 2, 18: 2}
OK	62127-60-0	CC(C)C(C)(Br)Br	{1: 3, 18: 2, 3: 1, 4: 1}
OK	6213-87-2	COC(=O)C=CBr	{1: 1, 18: 1, 28: 1, 6: 2}
OK	6213-88-3	COC(=O)/C=C/I	{1: 1, 19: 1, 28: 1, 6: 2}
OK	6213-90-7	C/C(=C/C(=O)O)/Cl	{1: 1, 27: 1, 17: 1, 6: 1, 7: 1}
OK	6214-01-3	CC(CO)OC(=O)C	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	6214-22-8	COC(=O)/C=C\Br	{1: 1, 18: 1, 28: 1, 6: 2}
OK	6214-23-9	COC(=O)/C=C\I	{1: 1, 19: 1, 28: 1, 6: 2}
OK	6214-25-1	CC(=CC(=O)OC)Cl	{1: 2, 17: 1, 28: 1, 6: 1, 7: 1}
OK	6214-28-4	C/C(=C\C(=O)O)/Cl	{1: 1, 27: 1, 17: 1, 6: 1, 7: 1}
OK	62147-49-3	C1C(OCC(O1)(CO)O)(CO)O	{2: 2, 11: 2, 20: 4, 13: 2, 23: 2}
OK	62151-90-0	CCCCOC(=O)C=C.COC(=O)C=C.C=CC(=O)NCO	{1: 2, 2: 4, 5: 3, 6: 3, 20: 1, 24: 1, 28: 2, 31: 1}
OK	62154-78-3	CCC(C(C)(C)[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 3, 2: 1, 4: 2, 38: 3}
OK	62155-02-6	CCCCCCCCCC(C)S	{1: 2, 2: 8, 3: 1, 39: 1}
OK	62155-03-7	CCCCCCCCCCCC(C)S	{1: 2, 2: 10, 3: 1, 39: 1}
OK	62155-04-8	CCCCCCCCCCCCC(C)S	{1: 2, 2: 11, 3: 1, 39: 1}
OK	62155-05-9	CCCCCCCCCCCCCC(C)S	{1: 2, 2: 12, 3: 1, 39: 1}
OK	62155-09-3	CCCCCCCCCCCCCSC	{40: 1, 1: 2, 2: 12}
OK	62155-10-6	CCCCCCCCCCCCCCCSC	{40: 1, 1: 2, 2: 14}
OK	62155-31-1	CC(C)C(CO)(CO)[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 4: 1, 38: 1, 20: 2}
OK	62163-62-6	C1C2CC2C=CC3C1C3	{11: 3, 12: 4, 14: 2}
OK	62168-25-6	CCCC(Br)Br	{1: 1, 2: 2, 3: 1, 18: 2}
OK	62168-26-7	CCCCCCCC(Br)Br	{1: 1, 2: 6, 3: 1, 18: 2}
OK	62168-27-8	CCCCCCCCC(Br)Br	{1: 1, 2: 7, 3: 1, 18: 2}
OK	62168-28-9	CCCCCCCCCCC(Br)Br	{1: 1, 2: 9, 3: 1, 18: 2}
OK	62168-42-7	CCC(C)(C)CBr	{1: 3, 2: 2, 4: 1, 18: 1}
OK	62173-55-1	COC(=O)C(C(C(=O)OC)Cl)Cl	{1: 2, 3: 2, 28: 2, 17: 2}
OK	62183-50-0	CCC(CC)C(C)CCC(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-51-1	CCC(C)CCC(CC)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-52-2	CCC(C)CC(CC)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-53-3	CCC(C)C(CC)CCC(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-54-4	CCC(C)(CC)CCCC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-55-5	CCC(CCCC(C)C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-56-6	CCC(CCC(C)C)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-57-7	CCCCC(CC)C(C)(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-58-8	CCCC(CC)CC(C)(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-59-9	CCC(CC)CCC(C)(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-60-2	CCCCC(C)(CC)C(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-61-3	CCCC(CC)C(C)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	62183-62-4	CCC(C)C(C)CC(CC)CC	{1: 5, 2: 4, 3: 3}
OK	62183-63-5	CCCC(C)CC(C)(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-64-6	CCCC(C)C(CC)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	62183-65-7	CCCC(C)(CC)CC(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-66-8	CCC(C)CC(C)C(CC)CC	{1: 5, 2: 4, 3: 3}
OK	62183-67-9	CCC(C)CCC(C)(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-68-0	CCC(C)CC(CC)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	62183-69-1	CCCCC(C)(C)C(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-70-4	CCCC(CC)C(C)(C)CCC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-71-5	CCCC(C)(C)CC(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-72-6	CCCC(C)C(C)C(CC)CC	{1: 5, 2: 4, 3: 3}
OK	62183-73-7	CCCC(C)C(C)(CC)CCC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-75-9	CCCCC(C)C(C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62183-76-0	CCCC(C)CC(C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62183-77-1	CCC(C)CCC(C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62183-78-2	CC(C)CCCC(C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62183-79-3	CCCCC(C)(C)CC(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62183-80-6	CCCC(C)C(C)CC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62183-81-7	CCC(C)CC(C)CC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62183-82-8	CC(C)CCC(C)CC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62183-83-9	CCCC(C)(C)CCC(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62183-84-0	CCC(C)C(C)CCC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62183-85-1	CCCC(C)C(CCC)CCC	{1: 4, 2: 6, 3: 2}
OK	62183-86-2	CCCCC(CC(C)C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-87-3	CCCC(CCC(C)C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-88-4	CCCCC(C(C)C)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	62183-89-5	CCCC(CC(C)CC)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-90-8	CCCCC(C)(CCC)C(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-91-9	CCCC(C)C(CCC)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62183-92-0	CCCCC(CC)C(CC)CC	{1: 4, 2: 6, 3: 2}
OK	62183-93-1	CCCC(CC)CC(CC)CC	{1: 4, 2: 6, 3: 2}
OK	62183-94-2	CCC(CC)CCC(CC)CC	{1: 4, 2: 6, 3: 2}
OK	62183-95-3	CCCCCC(CC)C(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-96-4	CCCCC(CC)CC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-97-5	CCCC(CC)CCC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-98-6	CCC(CC)CCCC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62183-99-7	CCCCCC(C)(CC)C(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-00-3	CCCCC(CC)C(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-01-4	CCCC(CC)CC(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-02-5	CCC(CC)CCC(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-03-6	CCCCC(C)C(CC)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-04-7	CCCCC(C)(CC)CC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-05-8	CCCC(CC)C(C)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-06-9	CCC(CC)CC(C)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-07-0	CCCC(C)CC(CC)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-08-1	CCCC(C)C(CC)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-09-2	CCCC(C)(CC)CCC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-10-5	CCCC(C)CC(C)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-11-6	CCC(C)CCC(C)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-12-7	CCCCC(C)(C)CCC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-13-8	CCCC(C)C(C)CCC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-14-9	CCC(C)CC(C)CCC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-15-0	CCCC(C)(C)CCCC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-16-1	CCC(C)C(C)CCCC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-17-2	CCC(C)(C)CCCCC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-18-3	CCCCCC(C)C(C)(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-19-4	CCCCC(C)CC(C)(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-20-7	CCCC(C)CCC(C)(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-21-8	CCC(C)CCCC(C)(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-22-9	CCCCCC(C)(C)C(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-23-0	CCCCC(C)C(C)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	62184-24-1	CCCC(C)CC(C)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	62184-25-2	CCCCC(C)(C)CC(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-26-3	CCCC(C)C(C)CC(C)CC	{1: 5, 2: 4, 3: 3}
OK	62184-27-4	CCC(C)CC(C)CC(C)CC	{1: 5, 2: 4, 3: 3}
OK	62184-28-5	CCCC(C)(C)CCC(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-29-6	CCCCC(C)C(C)(C)CCC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-30-9	CCCC(C)CC(C)(C)CCC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-31-0	CCCCC(C)(C)C(C)CCC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-32-1	CCCCC(CCC)C(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-33-2	CCCCC(CCC)CC(C)C	{1: 4, 2: 6, 3: 2}
OK	62184-34-3	CCCC(CCC)CCC(C)C	{1: 4, 2: 6, 3: 2}
OK	62184-35-4	CCCCC(CCC)C(C)CC	{1: 4, 2: 6, 3: 2}
OK	62184-36-5	CCCC(CCC)CC(C)CC	{1: 4, 2: 6, 3: 2}
OK	62184-38-7	CCCCC(CC)CCC(C)C	{1: 4, 2: 6, 3: 2}
OK	62184-39-8	CCCC(CC)CCCC(C)C	{1: 4, 2: 6, 3: 2}
OK	62184-40-1	CCC(CC)CCCCC(C)C	{1: 4, 2: 6, 3: 2}
OK	62184-41-2	CCCCCC(CC)C(C)CC	{1: 4, 2: 6, 3: 2}
OK	62184-42-3	CCCCC(CC)CC(C)CC	{1: 4, 2: 6, 3: 2}
OK	62184-43-4	CCCC(CC)CCC(C)CC	{1: 4, 2: 6, 3: 2}
OK	62184-44-5	CCC(C)CCCC(CC)CC	{1: 4, 2: 6, 3: 2}
OK	62184-45-6	CCCCCC(C)C(CC)CC	{1: 4, 2: 6, 3: 2}
OK	62184-46-7	CCCCC(CC)C(C)CCC	{1: 4, 2: 6, 3: 2}
OK	62184-47-8	CCCC(C)CC(CC)CCC	{1: 4, 2: 6, 3: 2}
OK	62184-48-9	CCCC(C)CCC(CC)CC	{1: 4, 2: 6, 3: 2}
OK	62184-49-0	CCCCC(C)CC(CC)CC	{1: 4, 2: 6, 3: 2}
OK	62184-50-3	CCCCCC(C)CC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-51-4	CCCCC(C)CCC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-52-5	CCCC(C)CCCC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-53-6	CCC(C)CCCCC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-54-7	CC(C)CCCCCC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-55-8	CCCCCCC(C)(C)C(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-56-9	CCCCCC(C)C(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-57-0	CCCCC(C)CC(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-58-1	CCCC(C)CCC(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-59-2	CCC(C)CCCC(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-60-5	CC(C)CCCCC(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-61-6	CCCCCC(C)(C)CC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62184-62-7	CCCCC(C)C(C)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62184-63-8	C1C(CC1C(=O)O)C(=O)O	{27: 2, 11: 2, 12: 2}
OK	62184-71-8	CCCCCC(CCC)C(C)C	{1: 4, 2: 6, 3: 2}
OK	62184-72-9	CCCCC(CCCC)C(C)C	{1: 4, 2: 6, 3: 2}
OK	62184-73-0	CCCCCCC(CC)C(C)C	{1: 4, 2: 6, 3: 2}
OK	62184-83-2	CC1=CCCC1(C)C	{1: 3, 11: 2, 13: 1, 14: 1, 15: 1}
OK	62184-89-8	CCC(CC)(CC)CC(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62184-90-1	CCC(CC)C(C)(CC)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62184-91-2	CCC(CC)(CC)C(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62184-92-3	CCC(C)C(CC)(CC)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62184-93-4	CCC(C(C)C)C(C)(CC)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62184-94-5	CCC(CC)(CC(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62184-95-6	CCC(C(C)C)C(CC)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62184-96-7	CCC(C)(C)C(CC)(CC)CC	{1: 6, 2: 4, 4: 2}
OK	62184-97-8	CCC(C)(CC)C(C)(CC)CC	{1: 6, 2: 4, 4: 2}
OK	62184-98-9	CCC(CC)C(C)(C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62184-99-0	CCC(C)C(C)(CC)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-00-6	CCC(C)(CC)C(C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-01-7	CCC(C)(CC(C)C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-02-8	CCC(C(C)C)C(C)C(C)(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62185-03-9	CCC(C(C)(C)C)C(C)(C)CC	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-04-0	CCC(C(C)C(C)C)C(C)(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62185-05-1	CCC(C)(CC(C)(C)C)C(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-06-2	CCC(CC(C)(C)C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-07-3	CCC(C)(CC)C(C)(C)C(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-08-4	CCC(C(C)C)C(C)(C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62185-09-5	CCC(C)(C)C(C)(CC)C(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-10-8	CCC(C)(C(C)C)C(C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62185-11-9	CCC(C)(C)C(C)(C)C(C)(C)C	{1: 8, 2: 1, 4: 3}
OK	62185-12-0	CC(C)C(C)C(C)(C)C(C)(C)C	{1: 8, 3: 2, 4: 2}
OK	62185-13-1	CC(C)C(C)(C)C(C)C(C)(C)C	{1: 8, 3: 2, 4: 2}
OK	62185-14-2	CC(C(C)C(C)(C)C)C(C)(C)C	{1: 8, 3: 2, 4: 2}
OK	62185-15-3	CCC(CC)(C(C)C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62185-16-4	CCC(C(C)C)(C(C)C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62185-17-5	CC(C)C(C)(C(C)C)C(C)(C)C	{1: 8, 3: 2, 4: 2}
OK	62185-18-6	CC(C)C(C(C)(C)C)C(C)(C)C	{1: 8, 3: 2, 4: 2}
OK	62185-19-7	CCC(C)CC(C)(C)C(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62185-20-0	CCCC(C)(C)C(C)C(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62185-21-1	CCC(C)C(C)C(C)C(C)CC	{1: 6, 2: 2, 3: 4}
OK	62185-22-2	CCCC(C)(C)C(C)(C)CCC	{1: 6, 2: 4, 4: 2}
OK	62185-23-3	CCCC(CC(C)C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62185-25-5	CCCC(C)(CCC)C(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62185-27-7	CCCC(C(C)C)C(CC)CC	{1: 5, 2: 4, 3: 3}
OK	62185-29-9	CC(C)C(C)(C(C)(C)C)O	{1: 6, 3: 1, 4: 2, 20: 1}
OK	62185-30-2	CCCC(CCC)C(C)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62185-31-3	CCCC(C)(CCC)CC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62185-32-4	CCCC(CC(C)C)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	62185-33-5	CCCC(CC(C)C)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62185-34-6	CCCC(CCC)C(C)(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62185-35-7	CCCC(C)(CCC)C(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62185-36-8	CCCC(C(C)CC)C(C)CC	{1: 5, 2: 4, 3: 3}
OK	62185-37-9	CCCCC(C(C)C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62185-38-0	CCCC(CC(C)(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62185-39-1	CCCCC(C)(C(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62185-40-4	CCCC(C(C)C)C(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62185-41-5	CCCC(C)C(C(C)C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62185-42-6	CCCC(C)(CC(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62185-43-7	CCC(C)CC(C(C)C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62185-44-8	CCC(C)C(CC(C)C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62185-45-9	CC(C)CCC(C(C)C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62185-46-0	CCCC(C(C)C)C(C)(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62185-47-1	CCCC(C)(C(C)C)C(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-55-4	CCCC(C)(CC)C(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-56-5	CCC(CC)C(C)C(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62198-57-6	CCC(C)CC(C)(CC)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-58-7	CCC(C)C(CC)C(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62198-59-8	CCC(C)(CC)CC(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-60-1	CCC(C)(CCC(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-61-2	CCC(CC(C)C)C(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62198-62-3	CCC(CC(C)C(C)C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62198-63-4	CCCC(C)(C)C(CC)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-64-5	CCC(CC)C(C)(C)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-65-6	CCC(C)C(C)C(CC)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62198-66-7	CCC(C)C(C)(CC)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-67-8	CCC(C)(CC)C(C)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-68-9	CCC(C(C)C)C(C)CC(C)C	{1: 6, 2: 2, 3: 4}
OK	62198-69-0	CCC(C)(CC(C)C)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-70-3	CCC(CC(C)(C)CC)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-71-4	CCC(CC(C)C)C(C)(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-72-5	CCCC(C)(CC)C(C)(C)CC	{1: 6, 2: 4, 4: 2}
OK	62198-73-6	CCC(CC)C(C)C(C)(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-74-7	CCC(C)C(CC)C(C)(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-75-8	CCC(C)(C)CC(C)(CC)CC	{1: 6, 2: 4, 4: 2}
OK	62198-76-9	CCCC(C)(C)C(C)(CC)CC	{1: 6, 2: 4, 4: 2}
OK	62198-77-0	CCC(C)C(C)(C)C(CC)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-78-1	CCC(C)C(C)C(C)(CC)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-79-2	CCC(C)C(C)(CC)C(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62198-80-5	CCCC(C)C(C)(C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62198-81-6	CCC(C)CC(C)(C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62198-82-7	CC(C)CCC(C)(C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62198-83-8	CCCC(C)(C)C(C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62198-84-9	CCC(C)C(C)C(C)C(C)(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62198-85-0	CC(C)CC(C)C(C)C(C)(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62198-86-1	CCC(C)(C)CC(C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62198-87-2	CC(C)C(C)CC(C)C(C)(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62198-88-3	CC(CCC(C)(C)C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62198-89-4	CCC(C)C(C(C)C)C(C)CC	{1: 6, 2: 2, 3: 4}
OK	62198-90-7	CCCCC(CC)(CC)C(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62198-91-8	CCCC(CC)C(CC)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62198-92-9	CCC(CC)CC(CC)C(C)C	{1: 5, 2: 4, 3: 3}
OK	62198-93-0	CCCC(CC)(CC)CC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62198-94-1	CCC(CC)C(CC)CC(C)C	{1: 5, 2: 4, 3: 3}
OK	62198-95-2	CCC(CC)(CC)CCC(C)C	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62198-96-3	CCCC(CC)C(C)(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62198-97-4	CCC(CC)CC(C)(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62198-98-5	CCCC(CC)(CC)C(C)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62198-99-6	CCC(C)C(CC)C(CC)CC	{1: 5, 2: 4, 3: 3}
OK	62199-00-2	CCC(C)CC(CC)(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62199-01-3	CCCC(C)C(CC)(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62199-02-4	CCCC(C)(CC)C(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62199-03-5	CCC(CC)C(C)C(CC)CC	{1: 5, 2: 4, 3: 3}
OK	62199-04-6	CCCCC(C)(CC)C(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62199-05-7	CCCC(CC)C(C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-06-8	CCC(CC)CC(C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-07-9	CCCC(C)C(CC)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-08-0	CCCC(C)(CC)CC(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62199-09-1	CCC(CC)C(C)CC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-10-4	CCC(C)CC(CC)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-11-5	CCC(C)C(CC)CC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-12-6	CCC(C)(CC)CCC(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62199-13-7	CCC(CCC(C)C)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-14-8	CCC(CC(C)C)CC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-15-9	CCC(CCC(C)(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-16-0	CCCC(CC)C(C)(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-17-1	CCC(CC)CC(C)(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-18-2	CCCC(C)C(C)(CC)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-19-3	CC(C)CC(C)CCC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-20-6	CCC(C)(C)CCCC(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62199-21-7	CC(C)C(C)CCCC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-22-8	CCCCC(C)C(C)(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-23-9	CCCC(C)CC(C)(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-24-0	CCC(C)CCC(C)(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-25-1	CC(C)CCCC(C)(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-26-2	CCCCC(C)(C)C(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-27-3	CCCC(C)C(C)C(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62199-28-4	CCC(C)CC(C)C(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62199-29-5	CC(C)CCC(C)C(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62199-30-8	CCCC(C)(C)CC(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-31-9	CCC(C)C(C)CC(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62199-32-0	CC(C)CC(C)CC(C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62199-33-1	CCC(C)(C)CCC(C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-34-2	CCCC(C)C(C)(C)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-35-3	CCC(C)CC(C)(C)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-36-4	CCCC(C)(C)C(C)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-37-5	CCC(C)C(C)C(C)CC(C)C	{1: 6, 2: 2, 3: 4}
OK	62199-38-6	CCC(C)(C)CC(C)CC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-39-7	CCC(C)C(C)(C)CCC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-40-0	CCC(C)(C)C(C)CCC(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-41-1	CCCCC(C)(C)C(C)(C)CC	{1: 6, 2: 4, 4: 2}
OK	62199-42-2	CCCC(C)C(C)C(C)(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-43-3	CCC(C)CC(C)C(C)(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-44-4	CCCC(C)(C)CC(C)(C)CC	{1: 6, 2: 4, 4: 2}
OK	62199-45-5	CCC(C)C(C)CC(C)(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-46-6	CCC(C)(C)CCC(C)(C)CC	{1: 6, 2: 4, 4: 2}
OK	62199-47-7	CCCC(C)C(C)(C)C(C)CC	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-52-4	CCCCC1CCCC1CCCC	{1: 2, 2: 6, 11: 3, 12: 2}
OK	62199-61-5	CCC(C)C(C)(C)CC(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-62-6	CC(C)CC(C)(C)CC(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-63-7	CCC(C)(C)C(C)CC(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-64-8	CC(C)C(C)C(C)CC(C)(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-65-9	CC(C)C(C)(C)CCC(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-66-0	CCCC(C)(C)C(C)(C)C(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-67-1	CCC(C)C(C)C(C)(C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-68-2	CC(C)CC(C)C(C)(C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-69-3	CCC(C)(C)CC(C)(C)C(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-70-6	CCC(C)C(C)(C)C(C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-71-7	CC(C)CC(C)(C)C(C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-72-8	CCC(C)(C)C(C)C(C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-73-9	CCC(C)(C)C(C)(C)CC(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-74-0	CCC(C)C(C)(C)C(C)(C)CC	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-75-1	CCC(C)(C)C(C)C(C)(C)CC	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-76-2	CCCC(C(C)(C)C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-77-3	CCCC(CC)(C(C)C)C(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	62199-78-4	CCC(CC)C(C(C)C)C(C)C	{1: 6, 2: 2, 3: 4}
OK	62199-79-5	CCCC(C)(C(C)C)C(C)(C)C	{1: 7, 2: 2, 3: 1, 4: 2}
OK	62199-80-8	CCC(C)C(C(C)C)C(C)(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-81-9	CC(C)CC(C(C)C)C(C)(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-82-0	CC(C)C(CC(C)(C)C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-83-1	CCC(C)C(C)(C(C)C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-84-2	CC(C)CC(C)(C(C)C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-85-3	CC(C)C(C)C(C(C)C)C(C)C	{1: 7, 3: 5}
OK	62199-86-4	CCC(C)(C)C(C(C)C)C(C)C	{1: 7, 2: 1, 3: 3, 4: 1}
OK	62199-87-5	CCC(CC)C(CC)(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	62199-88-6	CCCC(CC)(CC)C(C)(C)C	{1: 6, 2: 4, 4: 2}
OK	62199-89-7	CCC(CC)C(CC)C(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1}
OK	622-26-4	C1CNCCC1CCO	{32: 1, 20: 1, 2: 2, 11: 4, 12: 1}
OK	622-40-2	C1COCCN1CCO	{33: 1, 2: 2, 11: 4, 20: 1, 23: 1}
OK	622-45-7	CC(=O)OC1CCCCC1	{1: 1, 11: 5, 12: 1, 28: 1}
OK	622-93-5	CCN(CC)CCCO	{1: 2, 2: 5, 20: 1, 33: 1}
OK	6221-55-2	C1CC2CCC(C1)C2	{11: 6, 12: 2}
OK	6221-92-7	CC(=O)OC1CCCCCCCCCCC1	{1: 1, 11: 11, 12: 1, 28: 1}
OK	6221-93-8	CCCCCCCCCCCCOC(=O)CC	{1: 2, 2: 12, 28: 1}
OK	6221-95-0	CCCCCCCCCCCCCCOC(=O)CC	{1: 2, 2: 14, 28: 1}
OK	6221-96-1	CCCCCCCCCCCCCCCCOC(=O)CC	{1: 2, 2: 16, 28: 1}
OK	6221-99-4	CCCCCCCCCCCCCCCCOC(=O)CCC	{1: 2, 2: 17, 28: 1}
OK	62211-27-2	C1C=CC2CC2C3C1C3	{11: 3, 12: 4, 14: 2}
OK	62211-85-2	CCCC(C)C(C)C(C)CCC	{1: 5, 2: 4, 3: 3}
OK	62212-28-6	CCCCC(C)C(C)(CC)CC	{1: 5, 2: 5, 3: 1, 4: 1}
OK	6222-17-9	CC(=O)OCCCCCCOC(=O)C	{1: 2, 2: 6, 28: 2}
OK	6222-35-1	CCC(=O)OC1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1, 28: 1}
OK	62223-12-5	CCC(C)OC(=O)C(Cl)Cl	{1: 2, 2: 1, 3: 2, 28: 1, 17: 2}
OK	6223-78-5	CC(C)(CCC(C)(C)Cl)Cl	{1: 4, 2: 2, 4: 2, 17: 2}
OK	62237-77-8	CC/C(=N/N(C)CC=C)/C	{1: 3, 2: 2, 5: 1, 6: 1, 33: 1, 7: 1, 34: 1}
OK	62238-01-1	CCC(C)CCCCCC(C)(C)C	{1: 5, 2: 6, 3: 1, 4: 1}
OK	62248-95-7	C1=CC=C=NC=C1	{8: 1, 35: 1, 14: 5}
OK	6225-06-5	CCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 3, 33: 1}
OK	6225-08-7	CCCCCCCCC(=O)N(C)C	{24: 1, 1: 3, 2: 7, 33: 1}
OK	6225-10-1	CCCCC(=O)NC	{24: 1, 1: 2, 2: 3, 31: 1}
OK	62261-05-6	CCOC(=O)N(C(C)C)[N+](=O)[O-]	{1: 3, 2: 1, 3: 1, 38: 1, 33: 1, 28: 1}
OK	62279-35-0	C1C2CC2C3CC3C4C1C4	{11: 4, 12: 6}
OK	6228-25-7	C1C(COCO1)(CO)CO	{2: 2, 11: 3, 20: 2, 13: 1, 23: 2}
OK	6228-73-5	C1CC1C(=O)N	{24: 1, 11: 2, 12: 1, 30: 1}
OK	62289-63-8	C=C1C2CC(C1=C)C(=O)C2	{25: 1, 11: 2, 12: 2, 5: 2, 15: 2}
OK	623-32-5	CCOC(=O)CCCCCCCCCCCCC1CCC=C1	{1: 1, 2: 13, 11: 2, 12: 1, 14: 2, 28: 1}
OK	623-33-6	CCOC(=O)CN.Cl	{1: 1, 2: 2, 28: 1, 30: 1, 17: 1}
OK	623-34-7	CC(CCCl)CCl	{1: 1, 2: 3, 3: 1, 17: 2}
OK	623-36-9	CC/C=C(\C)/C=O	{1: 2, 2: 1, 26: 1, 6: 1, 7: 1}
OK	623-37-0	CCCC(CC)O	{1: 2, 2: 3, 3: 1, 20: 1}
OK	623-39-2	COCC(CO)O	{1: 1, 2: 2, 3: 1, 20: 2, 22: 1}
OK	623-40-5	CCC/C(=N\O)/C	{1: 2, 2: 2, 20: 1, 34: 1, 7: 1}
OK	623-42-7	CCCC(=O)OC	{1: 2, 2: 2, 28: 1}
OK	623-43-8	C/C=C/C(=O)OC	{1: 2, 28: 1, 6: 2}
OK	623-46-1	CCOC(CCl)Cl	{1: 1, 2: 2, 3: 1, 22: 1, 17: 2}
OK	623-47-2	CCOC(=O)C#C	{1: 1, 2: 1, 28: 1, 10: 1, 9: 1}
OK	623-48-3	CCOC(=O)CI	{1: 1, 2: 2, 19: 1, 28: 1}
OK	623-49-4	CCOC(=O)C#N	{1: 1, 2: 1, 28: 1, 37: 1}
OK	623-50-7	CCOC(=O)CO	{1: 1, 2: 2, 20: 1, 28: 1}
OK	623-51-8	CCOC(=O)CS	{1: 1, 2: 2, 28: 1, 39: 1}
OK	623-55-2	CCC(CC(C)C)O	{1: 3, 2: 2, 3: 2, 20: 1}
OK	623-56-3	CCC(=O)CC(C)C	{24: 1, 1: 3, 2: 2, 3: 1}
OK	623-57-4	CN(C)CC(CO)O	{1: 2, 2: 2, 3: 1, 20: 2, 33: 1}
OK	623-59-6	CC(=O)NC(=O)NC	{24: 2, 1: 2, 31: 2}
OK	623-60-9	CC(CCl)OC(=O)C	{1: 2, 2: 1, 3: 1, 28: 1, 17: 1}
OK	623-69-8	COCC(COC)O	{1: 2, 2: 2, 3: 1, 20: 1, 22: 2}
OK	623-70-1	CCOC(=O)C=CC	{1: 2, 2: 1, 28: 1, 6: 2}
OK	623-71-2	CCOC(=O)CCCl	{1: 1, 2: 3, 28: 1, 17: 1}
OK	623-72-3	CCOC(=O)CCO	{1: 1, 2: 3, 20: 1, 28: 1}
OK	623-76-7	CCNC(=O)NCC	{24: 1, 1: 2, 2: 2, 31: 2}
OK	623-78-9	CCNC(=O)OCC	{1: 2, 2: 2, 28: 1, 31: 1}
OK	623-80-3	CCSC(=O)SCC	{24: 1, 1: 2, 2: 2, 40: 2}
OK	623-82-5	C[C@H](CCC(=O)O)CC(=O)O	{27: 2, 1: 1, 2: 3, 3: 1}
OK	623-84-7	CC(COC(=O)C)OC(=O)C	{1: 3, 2: 1, 3: 1, 28: 2}
OK	623-85-8	CCCNC(=O)OCC	{1: 2, 2: 3, 28: 1, 31: 1}
OK	623-91-6	CCOC(=O)/C=C/C(=O)OCC	{1: 2, 2: 2, 28: 2, 6: 2}
OK	623-93-8	CCCCC(CCCC)O	{1: 2, 2: 6, 3: 1, 20: 1}
OK	623-95-0	CCCNC(=O)NCCC	{24: 1, 1: 2, 2: 4, 31: 2}
OK	62322-39-8	CC=COCOC	{1: 2, 2: 1, 22: 2, 6: 2}
OK	62322-40-1	CC=COC(C)OC	{1: 3, 3: 1, 22: 2, 6: 2}
OK	62322-41-2	CC=COC(C)(C)OC	{1: 4, 4: 1, 22: 2, 6: 2}
OK	62322-42-3	CC=COCCOC	{1: 2, 2: 2, 22: 2, 6: 2}
OK	62322-45-6	COCOCC=C	{1: 1, 2: 2, 22: 2, 5: 1, 6: 1}
OK	62322-46-7	CC(C)(OC)OCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 22: 2}
OK	6233-04-1	CC(=O)NN(C)C	{24: 1, 1: 3, 33: 1, 31: 1}
OK	62331-25-3	CCCCC1(OOC(CCC(OO1)(C)C)(C)C)C	{1: 6, 2: 3, 11: 2, 13: 3, 23: 4}
OK	62331-37-7	CCOC(=O)CC1(OOC(CCC(OO1)(C)C)(C)C)C	{1: 6, 2: 2, 11: 2, 13: 3, 23: 4, 28: 1}
OK	62338-09-4	CCCCCCCC(C)C(C)(C)C	{1: 5, 2: 6, 3: 1, 4: 1}
OK	6236-10-8	C[C@@](CC(=O)O)(C(=O)O)O	{1: 1, 2: 1, 27: 2, 4: 1, 20: 1}
OK	6236-71-1	C1CC2CC1C(=O)C2=O	{25: 2, 11: 3, 12: 2}
OK	6238-14-8	C1CN2CCC1C(C2)N	{33: 1, 11: 5, 12: 2, 30: 1}
OK	62382-21-2	C/C(=N/OC(=O)N(C)SN1CCOCC1)/SC	{1: 3, 34: 1, 33: 2, 40: 2, 11: 4, 23: 1, 7: 1, 28: 1}
OK	62382-23-4	CC(C)(/C=N/OC(=O)N(C)SN1CCOCC1)SC	{1: 4, 34: 1, 4: 1, 6: 1, 33: 2, 40: 2, 11: 4, 23: 1, 28: 1}
OK	62391-95-1	CCOC(=O)C(C#N)(C(C)C)C(C)C	{1: 5, 2: 1, 3: 2, 4: 1, 37: 1, 28: 1}
OK	624-03-3	CCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCCC	{1: 2, 2: 30, 28: 2}
OK	624-04-4	CCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCC	{1: 2, 2: 22, 28: 2}
OK	624-07-7	CCCCCCCCCCCC(=O)OCCCCOC(=O)CCCCCCCCCCC	{1: 2, 2: 24, 28: 2}
OK	624-08-8	CCCCCCCCC(CCCCCCCC)O	{1: 2, 2: 14, 3: 1, 20: 1}
OK	624-09-9	CCCCCCCOC(=O)CCCCCC	{1: 2, 2: 11, 28: 1}
OK	624-10-2	CCOCCOC(=O)CCCCCCCCC(=O)OCCOCC	{1: 2, 2: 14, 28: 2, 22: 2}
OK	624-13-5	CCCCCCCC(=O)OCCC	{1: 2, 2: 8, 28: 1}
OK	624-16-8	CCCCCCC(=O)CCC	{24: 1, 1: 2, 2: 7}
OK	624-17-9	CCOC(=O)CCCCCCCC(=O)OCC	{1: 2, 2: 9, 28: 2}
OK	624-20-4	CCCCC(CBr)Br	{1: 1, 2: 4, 3: 1, 18: 2}
OK	624-22-6	CCCCC(C)CO	{1: 2, 2: 4, 3: 1, 20: 1}
OK	624-24-8	CCCCC(=O)OC	{1: 2, 2: 3, 28: 1}
OK	624-29-3	C[C@H]1CC[C@@H](C)CC1	{1: 2, 11: 4, 12: 2}
OK	624-40-8	C1(=O)NNC(=O)NN1	{32: 4, 25: 2}
OK	624-41-9	CCC(C)COC(=O)C	{1: 3, 2: 2, 3: 1, 28: 1}
OK	624-42-0	CCC(=O)CCC(C)C	{24: 1, 1: 3, 2: 3, 3: 1}
OK	624-44-2	CC(C)CCC(=NO)C	{1: 3, 2: 2, 3: 1, 7: 1, 34: 1, 20: 1}
OK	624-45-3	CC(=O)CCC(=O)OC	{24: 1, 1: 2, 2: 2, 28: 1}
OK	624-46-4	CCC(=NNC(=O)N)C	{1: 2, 2: 1, 7: 1, 34: 1, 24: 1, 30: 1, 31: 1}
OK	624-47-5	CCC(=O)OC(C(CO)O)O	{1: 1, 2: 2, 3: 2, 20: 3, 28: 1}
OK	624-48-6	COC(=O)C=CC(=O)OC	{1: 2, 28: 2, 6: 2}
OK	624-49-7	COC(=O)/C=C/C(=O)OC	{1: 2, 28: 2, 6: 2}
OK	624-51-1	CCCCCCC(CC)O	{1: 2, 2: 6, 3: 1, 20: 1}
OK	624-54-4	CCCCCOC(=O)CC	{1: 2, 2: 5, 28: 1}
OK	624-57-7	C1C(O1)CI	{19: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	624-58-8	C1C(O1)CC#N	{2: 1, 11: 1, 12: 1, 37: 1, 23: 1}
OK	624-59-9	C(CN)N.Br.Br	{2: 2, 18: 2, 30: 2}
OK	624-61-3	C(#CBr)Br	{10: 2, 18: 2}
OK	624-64-6	C/C=C/C	{1: 2, 6: 2}
OK	624-65-7	C#CCCl	{9: 1, 2: 1, 10: 1, 17: 1}
OK	624-66-8	CC#CI	{1: 1, 10: 2, 19: 1}
OK	624-67-9	C#CC=O	{9: 1, 10: 1, 26: 1}
OK	624-70-4	C(CI)Cl	{17: 1, 2: 2, 19: 1}
OK	624-72-6	C(CF)F	{16: 2, 2: 2}
OK	624-73-7	C(CI)I	{2: 2, 19: 2}
OK	624-74-8	C(#CI)I	{10: 2, 19: 2}
OK	624-75-9	C(C#N)I	{2: 1, 19: 1, 37: 1}
OK	624-76-0	C(CI)O	{2: 2, 19: 1, 20: 1}
OK	624-78-2	CCNC	{1: 2, 2: 1, 31: 1}
OK	624-80-6	CCNN	{1: 1, 2: 1, 30: 1, 31: 1}
OK	624-81-7	CCNO	{1: 1, 2: 1, 20: 1, 31: 1}
OK	624-82-8	C(=NO)N	{34: 1, 20: 1, 30: 1, 6: 1}
OK	624-83-9	CN=C=O	{8: 1, 1: 1, 34: 1, 29: 1}
OK	624-84-0	C(=O)NN	{26: 1, 30: 1, 31: 1}
OK	624-85-1	CCOCl	{1: 1, 2: 1, 22: 1, 17: 1}
OK	624-89-5	CCSC	{40: 1, 1: 2, 2: 1}
OK	624-91-9	CON=O	{1: 1, 34: 1, 29: 1, 22: 1}
OK	624-92-0	CSSC	{40: 2, 1: 2}
OK	624-95-3	CC(C)(C)CCO	{1: 3, 2: 2, 4: 1, 20: 1}
OK	624-96-4	CC(C)(CCCl)Cl	{1: 2, 2: 2, 4: 1, 17: 2}
OK	624-97-5	CC(C)(CC=C)O	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 20: 1}
OK	6240-11-5	C1C2CC3CC1CC(C2)(C3)CCO	{20: 1, 2: 2, 11: 6, 12: 3, 13: 1}
OK	6240-90-0	CCCCC[C@@H](C)N	{1: 2, 2: 4, 3: 1, 30: 1}
OK	62406-83-1	CC1COC2(O1)CCC(CC2)C(C)(C)C	{1: 4, 4: 1, 11: 5, 12: 2, 13: 1, 23: 2}
OK	62409-40-9	CCOC(=O)C1=C(OC(=O)C1=C(C)O)C	{1: 3, 2: 1, 7: 1, 15: 3, 20: 1, 28: 2}
OK	62413-60-9	CC=C1CC2CCC1(C2(C)C)C	{1: 4, 6: 1, 11: 3, 12: 1, 13: 2, 15: 1}
OK	62417-08-7	CCC(C)CCCC(C)CO	{1: 3, 2: 5, 3: 2, 20: 1}
OK	6243-10-3	CCCCCC(=O)OC1CCCCC1	{1: 1, 2: 4, 11: 5, 12: 1, 28: 1}
OK	62435-06-7	CCCCCCCCCCCCCCCCCCOCC	{1: 2, 2: 18, 22: 1}
OK	62435-72-7	COC1C=CC(O1)(C(=O)OC)OC	{1: 3, 12: 1, 13: 1, 14: 2, 22: 2, 23: 1, 28: 1}
OK	62439-40-1	CC(CCCC(C)(C)OC)C(CO)O	{1: 4, 2: 4, 3: 2, 4: 1, 20: 2, 22: 1}
OK	6244-05-9	CC1(C2CCC(C2)(C1=C)[N+](=O)[O-])C	{1: 2, 5: 1, 38: 1, 11: 3, 12: 1, 13: 2, 15: 1}
OK	6246-48-6	CC(=CCCC(=CCN)C)C	{1: 3, 2: 3, 30: 1, 6: 2, 7: 2}
OK	6248-88-0	CC1(CC2(CCC1C2)C)C	{1: 3, 11: 4, 12: 1, 13: 2}
OK	62488-52-2	C=CC1C=CCSS1	{5: 1, 6: 1, 41: 2, 11: 1, 12: 1, 14: 2}
OK	62488-53-3	C=CC1CC=CSS1	{5: 1, 6: 1, 41: 2, 11: 1, 12: 1, 14: 2}
OK	62496-43-9	CC(C)(C#C)C#C	{1: 2, 10: 2, 4: 1, 9: 2}
OK	62496-53-1	CC(C)(CCCl)CCCl	{1: 2, 2: 4, 4: 1, 17: 2}
OK	625-06-9	CC(C)CC(C)(C)O	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1}
OK	625-08-1	CC(C)(CC(=O)O)O	{1: 2, 2: 1, 27: 1, 4: 1, 20: 1}
OK	625-15-0	CCC(C)(C)NC(=O)N	{1: 3, 2: 1, 4: 1, 24: 1, 30: 1, 31: 1}
OK	625-16-1	CCC(C)(C)OC(=O)C	{1: 4, 2: 1, 4: 1, 28: 1}
OK	625-23-0	CCCCC(C)(C)O	{1: 3, 2: 3, 4: 1, 20: 1}
OK	625-24-1	CC(=O)OCC(Cl)(Cl)Cl	{1: 1, 2: 1, 4: 1, 28: 1, 17: 3}
OK	625-25-2	CCCCCC(C)(C)O	{1: 3, 2: 4, 4: 1, 20: 1}
OK	625-27-4	CCC=C(C)C	{1: 3, 2: 1, 6: 1, 7: 1}
OK	625-28-5	CC(C)CC#N	{1: 2, 2: 1, 3: 1, 37: 1}
OK	625-29-6	CCCC(C)Cl	{1: 2, 2: 2, 3: 1, 17: 1}
OK	625-31-0	CC(CC=C)O	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 20: 1}
OK	625-33-2	CC=CC(=O)C	{24: 1, 1: 2, 6: 2}
OK	625-35-4	C/C=C/C(=O)Cl	{24: 1, 1: 1, 6: 2, 17: 1}
OK	625-36-5	C(CCl)C(=O)Cl	{24: 1, 17: 2, 2: 2}
OK	625-38-7	C=CCC(=O)O	{2: 1, 27: 1, 5: 1, 6: 1}
OK	625-43-4	CC(C)CNC	{1: 3, 2: 1, 3: 1, 31: 1}
OK	625-44-5	CC(C)COC	{1: 3, 2: 1, 3: 1, 22: 1}
OK	625-45-6	COCC(=O)O	{1: 1, 2: 1, 27: 1, 22: 1}
OK	625-46-7	C=CC[N+](=O)[O-]	{2: 1, 38: 1, 5: 1, 6: 1}
OK	625-47-8	C(CCl)[N+](=O)[O-]	{17: 1, 2: 2, 38: 1}
OK	625-48-9	C(CO)[N+](=O)[O-]	{2: 2, 20: 1, 38: 1}
OK	625-50-3	CCNC(=O)C	{24: 1, 1: 2, 2: 1, 31: 1}
OK	625-51-4	CC(=O)NCO	{24: 1, 1: 1, 2: 1, 20: 1, 31: 1}
OK	625-52-5	CCNC(=O)N	{24: 1, 1: 1, 2: 1, 30: 1, 31: 1}
OK	625-54-7	CCOC(C)C	{1: 3, 2: 1, 3: 1, 22: 1}
OK	625-56-9	CC(=O)OCCl	{1: 1, 2: 1, 28: 1, 17: 1}
OK	625-59-2	CC(C)SC#N	{40: 1, 1: 2, 3: 1, 37: 1}
OK	625-60-5	CCSC(=O)C	{24: 1, 1: 2, 2: 1, 40: 1}
OK	625-65-0	CC(C)C=C(C)C	{1: 4, 3: 1, 6: 1, 7: 1}
OK	625-66-1	CC(C)CC(Cl)Cl	{1: 2, 2: 1, 3: 2, 17: 2}
OK	625-67-2	CC(CC(C)Cl)Cl	{1: 2, 2: 1, 3: 2, 17: 2}
OK	625-69-4	CC(CC(C)O)O	{1: 2, 2: 1, 3: 2, 20: 2}
OK	625-74-1	CC(C)C[N+](=O)[O-]	{1: 2, 2: 1, 3: 1, 38: 1}
OK	625-76-3	C([N+](=O)[O-])[N+](=O)[O-]	{2: 1, 38: 2}
OK	625-77-4	CC(=O)NC(=O)C	{24: 2, 1: 2, 31: 1}
OK	625-80-9	CC(C)SC(C)C	{40: 1, 1: 4, 3: 2}
OK	6250-72-2	CC(C)CCCCCCCCCCCCCCCCC(=O)O	{27: 1, 1: 2, 2: 16, 3: 1}
OK	62503-58-6	CN(C)C.C1C(O1)CCl	{1: 3, 2: 1, 33: 1, 11: 1, 12: 1, 17: 1, 23: 1}
OK	6251-26-9	CSS	{40: 1, 1: 1, 39: 1}
OK	6251-69-0	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H]4CC5([C@H]3CC[C@@H]5C(=O)CO)C(O4)O	{1: 1, 2: 1, 11: 7, 12: 6, 13: 2, 14: 1, 15: 1, 20: 2, 23: 1, 24: 1, 25: 1}
OK	62518-75-6	CCCC1C(C(=O)C(=O)O1)C	{1: 2, 2: 2, 12: 2, 28: 1, 25: 1}
OK	6253-28-7	C1=CC2C3C(C1O2)C(=O)NC3=O	{32: 1, 25: 2, 12: 4, 14: 2, 23: 1}
OK	62538-61-8	C(COC(=O)C=CC(=O)O)OCCOC(=O)C=CC(=O)O	{2: 4, 27: 2, 28: 2, 22: 1, 6: 4}
OK	62563-15-9	CCCCOC(=O)[C@H]([C@@H](C(=O)OCCCC)O)O	{1: 2, 2: 6, 3: 2, 20: 2, 28: 2}
OK	62563-80-8	CC1CC(C=C(C2C1CC(=C(C)C)C2)C)OC(=O)C	{1: 5, 7: 1, 11: 3, 12: 4, 14: 1, 15: 2, 28: 1}
OK	6257-51-8	CC(C)(CCCC(C)(C)O)O	{1: 4, 2: 3, 4: 2, 20: 2}
OK	62571-86-2	C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O	{1: 1, 2: 1, 3: 1, 33: 1, 11: 3, 12: 1, 24: 1, 39: 1, 27: 1}
OK	6258-05-5	C1CCN(C1)CCNCCN	{33: 1, 2: 4, 11: 4, 30: 1, 31: 1}
OK	6258-28-2	C1C(CC(=O)NC1=O)CC(=O)O	{32: 1, 2: 1, 11: 2, 12: 1, 25: 2, 27: 1}
OK	62595-44-2	C1=CC1C2C=C2	{12: 2, 14: 4}
OK	626-10-8	CCOC(=O)C=C(C(=O)OCC)Cl	{1: 2, 2: 2, 6: 1, 7: 1, 17: 1, 28: 2}
OK	626-23-3	CCC(C)NC(C)CC	{1: 4, 2: 2, 3: 2, 31: 1}
OK	626-26-6	CCC(C)SC(C)CC	{40: 1, 1: 4, 2: 2, 3: 2}
OK	626-31-3	CCC(C)OC(=O)CCC(=O)OC(C)CC	{1: 4, 2: 4, 3: 2, 28: 2}
OK	626-33-5	CCCC(=O)CC(C)C	{24: 1, 1: 3, 2: 3, 3: 1}
OK	626-34-6	CCOC(=O)/C=C(/C)\N	{1: 2, 2: 1, 6: 1, 7: 1, 28: 1, 30: 1}
OK	626-35-7	CCOC(=O)C[N+](=O)[O-]	{1: 1, 2: 2, 28: 1, 38: 1}
OK	626-36-8	CCOC(=O)NC(=O)N	{1: 1, 2: 1, 24: 1, 28: 1, 30: 1, 31: 1}
OK	626-37-9	CCOC(=O)N[N+](=O)[O-]	{1: 1, 2: 1, 28: 1, 38: 1, 31: 1}
OK	626-51-7	CC(CC(=O)O)CC(=O)O	{27: 2, 1: 1, 2: 2, 3: 1}
OK	626-53-9	CC(=O)CC(=O)CC(=O)C	{24: 3, 1: 2, 2: 2}
OK	626-56-2	CC1CCCNC1	{32: 1, 1: 1, 11: 4, 12: 1}
OK	626-58-4	CC1CCNCC1	{32: 1, 1: 1, 11: 4, 12: 1}
OK	626-62-0	C1CCC(CC1)I	{19: 1, 11: 5, 12: 1}
OK	626-64-2	C1=CNC=CC1=O	{32: 1, 25: 1, 14: 4}
OK	626-67-5	CN1CCCCC1	{1: 1, 11: 5, 33: 1}
OK	626-68-6	CC1OCCCO1	{1: 1, 11: 3, 12: 1, 23: 2}
OK	626-77-7	CCCCCC(=O)OCCC	{1: 2, 2: 6, 28: 1}
OK	626-78-8	CC(C)CCOCC(COCCC(C)C)O	{1: 4, 2: 6, 3: 3, 20: 1, 22: 2}
OK	626-82-4	CCCCCC(=O)OCCCC	{1: 2, 2: 7, 28: 1}
OK	626-86-8	CCOC(=O)CCCCC(=O)O	{1: 1, 2: 5, 27: 1, 28: 1}
OK	626-87-9	CC(CCCBr)Br	{1: 1, 2: 3, 3: 1, 18: 2}
OK	626-88-0	CC(C)CCCBr	{1: 2, 2: 3, 3: 1, 18: 1}
OK	626-89-1	CC(C)CCCO	{1: 2, 2: 3, 3: 1, 20: 1}
OK	626-90-4	CC(C)CC=NO	{1: 2, 2: 1, 3: 1, 6: 1, 34: 1, 20: 1}
OK	626-91-5	CC(C)CCOC	{1: 3, 2: 2, 3: 1, 22: 1}
OK	626-92-6	CC(CCCCl)Cl	{1: 1, 2: 3, 3: 1, 17: 2}
OK	626-93-7	CCCCC(C)O	{1: 2, 2: 3, 3: 1, 20: 1}
OK	626-94-8	CC(CCC=C)O	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 20: 1}
OK	626-95-9	CC(CCCO)O	{1: 1, 2: 3, 3: 1, 20: 2}
OK	626-96-0	CC(=O)CCC=O	{24: 1, 1: 1, 2: 2, 26: 1}
OK	626-97-1	CCCCC(=O)N	{24: 1, 1: 1, 2: 3, 30: 1}
OK	626-98-2	CC/C=C\C(=O)O	{1: 1, 2: 1, 27: 1, 6: 2}
OK	626-99-3	C=C/C=C/C(=O)O	{27: 1, 5: 1, 6: 3}
OK	62601-71-2	C[C@H]1C2C(CC3[C@@]2(CCC4C3CC=C5[C@@]4(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)O)O)C)C)O[C@@]1(CC[C@H](C)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O	{1: 4, 2: 9, 3: 1, 11: 7, 12: 37, 13: 3, 14: 1, 15: 1, 20: 21, 22: 6, 23: 7}
OK	6261-22-9	CCC#CCO	{1: 1, 2: 2, 20: 1, 10: 2}
OK	62613-82-5	C1C(CN(C1=O)CC(=O)N)O	{33: 1, 2: 1, 11: 2, 12: 1, 20: 1, 24: 1, 25: 1, 30: 1}
OK	62617-39-4	CC(C)(C)C(OC)OC	{1: 5, 3: 1, 4: 1, 22: 2}
OK	6262-42-6	C1(=C(C1(Cl)Cl)Cl)Cl	{17: 4, 13: 1, 15: 2}
OK	6262-51-7	C1(C(C1(Cl)Cl)(Cl)Cl)Cl	{17: 5, 12: 1, 13: 2}
OK	62624-30-0	C(C(C1C(=C(C(=O)O1)O)O)O)O	{2: 1, 3: 1, 12: 1, 15: 2, 20: 4, 28: 1}
OK	62625-23-4	CCCCCCCCCCCCCCCC(=O)CC(=O)OCC	{24: 1, 1: 2, 2: 16, 28: 1}
OK	62625-25-6	CCCCC(CC)COCCCC	{1: 3, 2: 8, 3: 1, 22: 1}
OK	62626-83-9	CC(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 4: 2, 38: 5}
OK	6263-27-0	COC(=N)OC	{1: 2, 36: 1, 22: 2, 7: 1}
OK	6263-74-7	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OCOCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{2: 3, 4: 2, 38: 6, 22: 2}
OK	62637-96-1	CCCCCCCCCCC(=O)OCC(C)C	{1: 3, 2: 10, 3: 1, 28: 1}
OK	62638-06-6	COC(=O)C1CCCC(C1)C(=O)OC	{1: 2, 11: 4, 12: 2, 28: 2}
OK	62641-66-1	C1CNC(=O)N(C1)N=O	{32: 1, 33: 1, 34: 1, 11: 3, 25: 1, 29: 1}
OK	62641-67-2	CC1CN(C(=O)NC1=O)N=O	{32: 1, 1: 1, 34: 1, 33: 1, 11: 1, 12: 1, 25: 2, 29: 1}
OK	62641-68-3	CCOC(=O)N(CCO)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 20: 1, 28: 1, 29: 1}
OK	6265-26-5	C1CC(OC1)CCC(CCC2CCCO2)O	{2: 4, 3: 1, 11: 6, 12: 2, 20: 1, 23: 2}
OK	6266-23-5	C1=CC=[N+](C=C1)CC(=O)O.[Cl-]	{17: 1, 2: 1, 27: 1, 14: 5, 33: 1}
OK	6267-24-9	CCSC(SCC)SCC	{40: 3, 1: 3, 2: 3, 3: 1}
OK	6267-39-6	CCOC1=CC(=O)CC(C1)(C)C	{1: 3, 2: 1, 11: 2, 13: 1, 14: 1, 15: 1, 22: 1, 25: 1}
OK	62678-52-8	CC(C)C(C1CCCCC1)C(C2CCCCC2)C(C)C	{11: 10, 1: 4, 3: 4, 12: 2}
OK	62678-54-0	CC(C)(C)[C@H](C1=CCCCC1)C(C2=CCCCC2)C(C)(C)C	{1: 6, 3: 2, 4: 2, 11: 8, 14: 2, 15: 2}
OK	6268-90-2	CC1C2CC(C1C=CC(=O)C)C=C2	{1: 2, 6: 2, 11: 1, 12: 4, 14: 2, 24: 1}
OK	62681-13-4	CCOC(=O)N(CCOC(=O)C)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 28: 2, 29: 1}
OK	62683-37-8	CC1CO1.C1CO1.C(CC(=O)O)C(=O)O	{1: 1, 2: 2, 11: 3, 12: 1, 23: 2, 27: 2}
OK	6269-92-7	CCCCCCC(CBr)Br	{1: 1, 2: 6, 3: 1, 18: 2}
OK	627-00-9	C(CC(=O)O)CCl	{17: 1, 2: 3, 27: 1}
OK	627-02-1	CCOCC(C)C	{1: 3, 2: 2, 3: 1, 22: 1}
OK	627-03-2	CCOCC(=O)O	{1: 1, 2: 2, 27: 1, 22: 1}
OK	627-04-3	CCSCC(=O)O	{40: 1, 1: 1, 2: 2, 27: 1}
OK	627-05-4	CCCC[N+](=O)[O-]	{1: 1, 2: 3, 38: 1}
OK	627-06-5	CCCNC(=O)N	{24: 1, 1: 1, 2: 2, 30: 1, 31: 1}
OK	627-07-6	CCCN[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 31: 1}
OK	627-08-7	CCCOC(C)C	{1: 3, 2: 2, 3: 1, 22: 1}
OK	627-09-8	CC(=O)OCC#C	{1: 1, 2: 1, 28: 1, 10: 1, 9: 1}
OK	627-11-2	C(CCl)OC(=O)Cl	{17: 2, 2: 2, 28: 1}
OK	627-12-3	CCCOC(=O)N	{1: 1, 2: 2, 28: 1, 30: 1}
OK	627-15-6	C(C=CBr)Br	{2: 1, 18: 2, 6: 2}
OK	627-16-7	C(C#CBr)Br	{2: 1, 18: 2, 10: 2}
OK	627-18-9	C(CO)CBr	{2: 3, 20: 1, 18: 1}
OK	627-19-0	CCCC#C	{1: 1, 2: 2, 10: 1, 9: 1}
OK	627-20-3	CCC=CC	{1: 2, 2: 1, 6: 2}
OK	627-21-4	CCC#CC	{1: 2, 2: 1, 10: 2}
OK	627-22-5	C=C/C=C/Cl	{17: 1, 5: 1, 6: 3}
OK	627-24-7	CC=CCI	{1: 1, 2: 1, 19: 1, 6: 2}
OK	627-26-9	C/C=C/C#N	{1: 1, 37: 1, 6: 2}
OK	627-27-0	C=CCCO	{2: 2, 20: 1, 5: 1, 6: 1}
OK	627-30-5	C(CO)CCl	{17: 1, 2: 3, 20: 1}
OK	627-31-6	C(CI)CI	{2: 3, 19: 2}
OK	627-32-7	C(CO)CI	{2: 3, 19: 1, 20: 1}
OK	627-35-0	CCCNC	{1: 2, 2: 2, 31: 1}
OK	627-37-2	CNCC=C	{1: 1, 2: 1, 5: 1, 6: 1, 31: 1}
OK	627-39-4	CCC=NO	{1: 1, 2: 1, 20: 1, 34: 1, 6: 1}
OK	627-40-7	COCC=C	{1: 1, 2: 1, 22: 1, 5: 1, 6: 1}
OK	627-41-8	COCC#C	{1: 1, 2: 1, 10: 1, 22: 1, 9: 1}
OK	627-42-9	COCCCl	{1: 1, 2: 2, 22: 1, 17: 1}
OK	627-43-0	COCCF	{16: 1, 1: 1, 2: 2, 22: 1}
OK	627-45-2	CCNC=O	{1: 1, 2: 1, 26: 1, 31: 1}
OK	627-48-5	CCOC#N	{1: 1, 2: 1, 37: 1, 22: 1}
OK	627-50-9	CCSC=C	{40: 1, 1: 1, 2: 1, 5: 1, 6: 1}
OK	627-51-0	C=CSC=C	{40: 1, 5: 2, 6: 2}
OK	627-52-1	C(#N)SC#N	{40: 1, 37: 2}
OK	627-58-7	CC(=C)CCC(=C)C	{1: 2, 2: 2, 5: 2, 7: 2}
OK	627-59-8	CC(C)CCC(C)O	{1: 3, 2: 2, 3: 2, 20: 1}
OK	627-63-4	C(=CC(=O)Cl)C(=O)Cl	{24: 2, 17: 2, 6: 2}
OK	627-64-5	C(=CC(=O)N)C(=O)N	{24: 2, 30: 2, 6: 2}
OK	627-67-8	CC(C)CC[N+](=O)[O-]	{1: 2, 2: 2, 3: 1, 38: 1}
OK	627-69-0	CC(COC(=O)C)O	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	627-70-3	CC(=NN=C(C)C)C	{1: 4, 34: 2, 7: 2}
OK	627-72-5	C([C@@H](C(=O)O)N)SC(=CCl)Cl	{2: 1, 3: 1, 6: 1, 7: 1, 40: 1, 17: 2, 27: 1, 30: 1}
OK	627-73-6	CCOC(=O)CCC(=O)OC	{1: 2, 2: 3, 28: 2}
OK	627-74-7	CCOC(=O)CNC(=O)CN	{1: 1, 2: 3, 24: 1, 28: 1, 30: 1, 31: 1}
OK	627-75-8	C(C[C@H](C(=O)O)N)CN=C(N)N.Cl	{2: 3, 3: 1, 7: 1, 34: 1, 17: 1, 27: 1, 30: 3}
OK	627-77-0	C(CC(C(=O)O)N)CNC(=O)N	{2: 3, 3: 1, 24: 1, 27: 1, 30: 2, 31: 1}
OK	627-82-7	C(C(COCC(CO)O)O)O	{2: 4, 3: 2, 20: 4, 22: 1}
OK	627-83-8	CCCCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 28: 2}
OK	627-84-9	CCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCC	{1: 2, 2: 26, 28: 2}
OK	627-88-3	CCCCCCCCCCCCCCCCCC(=O)OCCC(C)C	{1: 3, 2: 18, 3: 1, 28: 1}
OK	627-89-4	CCCCCCCCC=CCCCCCCCC(=O)OCCC(C)C	{1: 3, 2: 16, 3: 1, 28: 1, 6: 2}
OK	627-90-7	CCCCCCCCCCC(=O)OCC	{1: 2, 2: 10, 28: 1}
OK	627-91-8	COC(=O)CCCCC(=O)O	{1: 1, 2: 4, 27: 1, 28: 1}
OK	627-92-9	CC(C)CCOCC(CO)O	{1: 2, 2: 4, 3: 2, 20: 2, 22: 1}
OK	627-93-0	COC(=O)CCCCC(=O)OC	{1: 2, 2: 4, 28: 2}
OK	627-96-3	CC(CCCCBr)Br	{1: 1, 2: 4, 3: 1, 18: 2}
OK	627-97-4	CCCCC=C(C)C	{1: 3, 2: 3, 6: 1, 7: 1}
OK	627-98-5	CC(C)CCCCO	{1: 2, 2: 4, 3: 1, 20: 1}
OK	6270-16-2	CC(C(C)O)[N+](=O)[O-]	{1: 2, 3: 2, 20: 1, 38: 1}
OK	6270-19-5	C1COCCN1CC2CO2	{33: 1, 2: 1, 11: 5, 12: 1, 23: 2}
OK	62702-04-9	CC12CCCCC1C=CCC2	{1: 1, 11: 6, 12: 1, 13: 1, 14: 2}
OK	62708-55-8	C(CNCCN)CNCCNCCCNCCN	{2: 12, 30: 2, 31: 4}
OK	6272-74-8	CCCCCCCCCCCC(=O)OCCNC(=O)C[N+]1=CC=CC=C1.[Cl-]	{1: 1, 2: 13, 33: 1, 14: 5, 17: 1, 24: 1, 28: 1, 31: 1}
OK	62739-27-9	C1C(O1)CCl.C(CO)NCCO	{2: 5, 11: 1, 12: 1, 17: 1, 20: 2, 23: 1, 31: 1}
OK	6274-16-4	CCN(C(=O)OCC)[N+](=O)[O-]	{1: 2, 2: 2, 28: 1, 38: 1, 33: 1}
OK	62759-83-5	CC(C(=O)CC(=O)OC)(OC)OC	{1: 4, 2: 1, 4: 1, 22: 2, 24: 1, 28: 1}
OK	62765-93-9	CN(C)CCC#N.CN(C)CCOCCN(C)C	{1: 6, 2: 6, 37: 1, 22: 1, 33: 3}
OK	62766-55-6	CCCCOC(=O)C=C.CCC(=C)C(=O)O.CC(=C)C(=O)O.C=CC(=O)O	{1: 3, 2: 4, 5: 4, 6: 2, 7: 2, 27: 3, 28: 1}
OK	6279-86-3	CCOC(=O)C(C(=O)OCC)C(=O)OCC	{1: 3, 2: 3, 3: 1, 28: 3}
OK	62796-83-2	C1CC2CCCC(C1)N2N3C4CCCC3CCC4	{33: 2, 11: 12, 12: 4}
OK	628-00-2	CCCCCC(C)S	{1: 2, 2: 4, 3: 1, 39: 1}
OK	628-02-4	CCCCCC(=O)N	{24: 1, 1: 1, 2: 4, 30: 1}
OK	628-04-6	CCOCCC(C)C	{1: 3, 2: 3, 3: 1, 22: 1}
OK	628-05-7	CCCCC[N+](=O)[O-]	{1: 1, 2: 4, 38: 1}
OK	628-08-0	CC=CCOC(=O)C	{1: 2, 2: 1, 28: 1, 6: 2}
OK	628-09-1	CC(=O)OCCCCl	{1: 1, 2: 3, 28: 1, 17: 1}
OK	628-11-5	C(COC(=O)Cl)CCl	{17: 2, 2: 3, 28: 1}
OK	628-12-6	COCCOC(=O)Cl	{1: 1, 2: 2, 28: 1, 22: 1, 17: 1}
OK	628-13-7	C1=CC=NC=C1.Cl	{17: 1, 35: 1, 14: 5}
OK	628-16-0	C#CCCC#C	{9: 2, 2: 2, 10: 2}
OK	628-17-1	CCCCCI	{1: 1, 2: 4, 19: 1}
OK	628-20-6	C(CC#N)CCl	{17: 1, 2: 3, 37: 1}
OK	628-21-7	C(CCI)CI	{2: 4, 19: 2}
OK	628-28-4	CCCCOC	{1: 2, 2: 3, 22: 1}
OK	628-29-5	CCCCSC	{40: 1, 1: 2, 2: 3}
OK	628-32-0	CCCOCC	{1: 2, 2: 3, 22: 1}
OK	628-33-1	CCOCC#C	{1: 1, 2: 2, 10: 1, 22: 1, 9: 1}
OK	628-34-2	CCOCCCl	{1: 1, 2: 3, 22: 1, 17: 1}
OK	628-36-4	C(=O)NNC=O	{26: 2, 31: 2}
OK	628-37-5	CCOOCC	{1: 2, 2: 2, 22: 2}
OK	628-41-1	C1C=CCC=C1	{11: 2, 14: 4}
OK	628-44-4	CCCCCCC(C)(C)O	{1: 3, 2: 5, 4: 1, 20: 1}
OK	628-46-6	CC(C)CCCC(=O)O	{27: 1, 1: 2, 2: 3, 3: 1}
OK	628-47-7	CC(CCCC(=O)O)N	{27: 1, 1: 1, 2: 3, 3: 1, 30: 1}
OK	628-48-8	C(/C=C/C(=O)O)C(=O)O	{2: 1, 27: 2, 6: 2}
OK	628-51-3	CC(=O)OCOC(=O)C	{1: 2, 2: 1, 28: 2}
OK	628-55-7	CC(C)COCC(C)C	{1: 4, 2: 2, 3: 2, 22: 1}
OK	628-56-8	CC(=C)COCC(=C)C	{1: 2, 2: 2, 5: 2, 22: 1, 7: 2}
OK	628-61-5	CCCCCCC(C)Cl	{1: 2, 2: 5, 3: 1, 17: 1}
OK	628-62-6	CCCCCCC(=O)N	{24: 1, 1: 1, 2: 5, 30: 1}
OK	628-63-7	CCCCCOC(=O)C	{1: 2, 2: 4, 28: 1}
OK	628-64-8	CCOCCOC(=O)Cl	{1: 1, 2: 3, 28: 1, 22: 1, 17: 1}
OK	628-66-0	CC(=O)OCCCOC(=O)C	{1: 2, 2: 3, 28: 2}
OK	628-67-1	CC(=O)OCCCCOC(=O)C	{1: 2, 2: 4, 28: 2}
OK	628-71-7	CCCCCC#C	{1: 1, 2: 4, 10: 1, 9: 1}
OK	628-73-9	CCCCCC#N	{1: 1, 2: 4, 37: 1}
OK	628-76-2	C(CCCl)CCCl	{17: 2, 2: 5}
OK	628-77-3	C(CCI)CCI	{2: 5, 19: 2}
OK	628-80-8	CCCCCOC	{1: 2, 2: 4, 22: 1}
OK	628-81-9	CCCCOCC	{1: 2, 2: 4, 22: 1}
OK	628-83-1	CCCCSC#N	{40: 1, 1: 1, 2: 3, 37: 1}
OK	628-87-5	C(C#N)NCC#N	{2: 2, 37: 2, 31: 1}
OK	628-89-7	C(COCCCl)O	{17: 1, 2: 4, 20: 1, 22: 1}
OK	628-92-2	C1CCC=CCC1	{11: 5, 14: 2}
OK	628-94-4	C(CCC(=O)N)CC(=O)N	{24: 2, 2: 4, 30: 2}
OK	628-97-7	CCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 15, 28: 1}
OK	628-99-9	CCCCCCCC(C)O	{1: 2, 2: 6, 3: 1, 20: 1}
OK	6280-03-1	CCCCCCCCC(=O)OC=C	{1: 1, 2: 7, 28: 1, 5: 1, 6: 1}
OK	6280-15-5	CC(CC=O)CC=O	{1: 1, 2: 2, 3: 1, 26: 2}
OK	6280-87-1	C(CCCl)CC#N	{17: 1, 2: 4, 37: 1}
OK	6280-99-5	CCCCOC(=O)CC(C(=O)OCCCC)O	{1: 2, 2: 7, 3: 1, 20: 1, 28: 2}
OK	62806-49-9	CCOC(=O)N(C)C(=NC(=O)NC1CCCCC1)N(C)C	{1: 4, 2: 1, 33: 2, 7: 1, 11: 5, 12: 1, 34: 1, 24: 1, 28: 1, 31: 1}
OK	6281-14-7	C1CCC(CC1)N2CN(CN(C2)C3CCCCC3)C4CCCCC4	{33: 3, 11: 18, 12: 3}
OK	6281-42-1	C1CN(C(=O)N1)CCN	{32: 1, 33: 1, 2: 2, 11: 2, 25: 1, 30: 1}
OK	6281-79-4	CCCCCCCCCCCCNCC	{1: 2, 2: 12, 31: 1}
OK	6281-94-3	CCCNC=O	{1: 1, 2: 2, 26: 1, 31: 1}
OK	6282-00-4	CCCN(CCC)C=O	{1: 2, 2: 4, 26: 1, 33: 1}
OK	6282-06-0	CCCCCCCCNC=O	{1: 1, 2: 7, 26: 1, 31: 1}
OK	6282-52-6	CCCCCC(=O)OCCBr	{1: 1, 2: 6, 28: 1, 18: 1}
OK	6282-96-8	CC(C)C(=O)NC1CCCCC1	{1: 2, 3: 1, 11: 5, 12: 1, 24: 1, 31: 1}
OK	6282-98-0	CC(C)C(=O)N(C(C)C)C(C)C	{24: 1, 1: 6, 3: 3, 33: 1}
OK	62839-54-7	CCC=C(C)C#C	{1: 2, 2: 1, 6: 1, 7: 1, 9: 1, 10: 1}
OK	6284-08-8	CCCCCCCCCCCC(=O)NCCCC	{24: 1, 1: 2, 2: 13, 31: 1}
OK	6284-40-8	CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O	{1: 1, 2: 2, 3: 4, 20: 5, 31: 1}
OK	6284-43-1	CCCCCCC(CCCCCCCCCCC(=O)OCC(CO)O)O	{1: 1, 2: 17, 3: 2, 20: 3, 28: 1}
OK	6285-06-9	CCC(CC)(C#C)O	{1: 2, 2: 2, 4: 1, 9: 1, 10: 1, 20: 1}
OK	62850-21-9	CC(C)(C)C(C(C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 3: 2, 4: 4}
OK	62851-70-1	CCC(C)(C#CC(=CC)C)O	{1: 4, 2: 1, 4: 1, 6: 1, 7: 1, 10: 2, 20: 1}
OK	62859-26-1	C[C@@]12CC[C@@H](C1(C)C)C(=C(C(F)(F)F)O)C2=O	{1: 3, 4: 1, 7: 1, 11: 2, 12: 1, 13: 2, 15: 1, 16: 3, 20: 1, 25: 1}
OK	6286-43-7	C1CC(C(C(C1)O)O)O	{20: 3, 11: 3, 12: 3}
OK	62860-10-0	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)SC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 5, 2: 1, 40: 1, 12: 5, 23: 1, 24: 1, 28: 4}
OK	6287-19-0	CC1CCNC(C1)C	{32: 1, 1: 2, 11: 3, 12: 2}
OK	6287-90-7	COC(=O)CCCCCCCCCCBr	{1: 1, 2: 10, 28: 1, 18: 1}
OK	6289-46-9	COC(=O)C1CC(=O)C(CC1=O)C(=O)OC	{1: 2, 11: 2, 12: 2, 28: 2, 25: 2}
OK	629-01-6	CCCCCCCC(=O)N	{24: 1, 1: 1, 2: 6, 30: 1}
OK	629-03-8	C(CCCBr)CCBr	{2: 6, 18: 2}
OK	629-04-9	CCCCCCCBr	{1: 1, 2: 6, 18: 1}
OK	629-05-0	CCCCCCC#C	{1: 1, 2: 5, 10: 1, 9: 1}
OK	629-06-1	CCCCCCCCl	{1: 1, 2: 6, 17: 1}
OK	629-08-3	CCCCCCC#N	{1: 1, 2: 5, 37: 1}
OK	629-09-4	C(CCCI)CCI	{2: 6, 19: 2}
OK	629-11-8	C(CCCO)CCO	{2: 6, 20: 2}
OK	629-14-1	CCOCCOCC	{1: 2, 2: 4, 22: 2}
OK	629-17-4	C(CSC#N)SC#N	{40: 2, 2: 2, 37: 2}
OK	629-19-6	CCCSSCCC	{40: 2, 1: 2, 2: 4}
OK	629-20-9	C1=CC=CC=CC=C1	{14: 8}
OK	629-23-2	CCCCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 11}
OK	629-27-6	CCCCCCCCI	{1: 1, 2: 7, 19: 1}
OK	629-30-1	C(CCCO)CCCO	{2: 7, 20: 2}
OK	629-31-2	CCCCCCC=NO	{1: 1, 2: 5, 20: 1, 34: 1, 6: 1}
OK	629-32-3	CCCCCCCOC	{1: 2, 2: 6, 22: 1}
OK	629-36-7	C(COCCCCl)CCl	{17: 2, 2: 6, 22: 1}
OK	629-37-8	CCCCCCCC[N+](=O)[O-]	{1: 1, 2: 7, 38: 1}
OK	629-38-9	CC(=O)OCCOCCOC	{1: 2, 2: 4, 28: 1, 22: 2}
OK	629-40-3	C(CCCC#N)CCC#N	{2: 6, 37: 2}
OK	629-41-4	C(CCCCO)CCCO	{2: 8, 20: 2}
OK	629-43-6	CCCCCCCON=O	{1: 1, 2: 6, 34: 1, 29: 1, 22: 1}
OK	629-45-8	CCCCSSCCCC	{40: 2, 1: 2, 2: 6}
OK	629-46-9	CCCCCCCCON=O	{1: 1, 2: 7, 34: 1, 29: 1, 22: 1}
OK	629-49-2	CCCCCCCCCC#CC	{1: 2, 2: 8, 10: 2}
OK	629-50-5	CCCCCCCCCCCCC	{1: 2, 2: 11}
OK	629-54-9	CCCCCCCCCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 14, 30: 1}
OK	629-58-3	CCCCCCCCCCCCCCCOC(=O)C	{1: 2, 2: 14, 28: 1}
OK	629-59-4	CCCCCCCCCCCCCC	{1: 2, 2: 12}
OK	629-60-7	CCCCCCCCCCCCC#N	{1: 1, 2: 11, 37: 1}
OK	629-62-9	CCCCCCCCCCCCCCC	{1: 2, 2: 13}
OK	629-63-0	CCCCCCCCCCCCCC#N	{1: 1, 2: 12, 37: 1}
OK	629-64-1	CCCCCCCOCCCCCCC	{1: 2, 2: 12, 22: 1}
OK	629-65-2	CCCCCCCSCCCCCCC	{40: 1, 1: 2, 2: 12}
OK	629-66-3	CCCCCCCCCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 16}
OK	629-70-9	CCCCCCCCCCCCCCCCOC(=O)C	{1: 2, 2: 15, 28: 1}
OK	629-72-1	CCCCCCCCCCCCCCCBr	{1: 1, 2: 14, 18: 1}
OK	629-73-2	CCCCCCCCCCCCCCC=C	{1: 1, 2: 13, 5: 1, 6: 1}
OK	629-74-3	CCCCCCCCCCCCCCC#C	{1: 1, 2: 13, 10: 1, 9: 1}
OK	629-75-4	CCCCCCCCCCCCCC#CC	{1: 2, 2: 12, 10: 2}
OK	629-76-5	CCCCCCCCCCCCCCCO	{1: 1, 2: 14, 20: 1}
OK	629-78-7	CCCCCCCCCCCCCCCCC	{1: 2, 2: 15}
OK	629-79-8	CCCCCCCCCCCCCCCC#N	{1: 1, 2: 14, 37: 1}
OK	629-80-1	CCCCCCCCCCCCCCCC=O	{1: 1, 2: 14, 26: 1}
OK	629-82-3	CCCCCCCCOCCCCCCCC	{1: 2, 2: 14, 22: 1}
OK	629-89-0	CCCCCCCCCCCCCCCCC#C	{1: 1, 2: 15, 10: 1, 9: 1}
OK	629-90-3	CCCCCCCCCCCCCCCCC=O	{1: 1, 2: 15, 26: 1}
OK	629-92-5	CCCCCCCCCCCCCCCCCCC	{1: 2, 2: 17}
OK	629-93-6	CCCCCCCCCCCCCCCCCCI	{1: 1, 2: 17, 19: 1}
OK	629-94-7	CCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 19}
OK	629-96-9	CCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 19, 20: 1}
OK	629-97-0	CCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 20}
OK	629-98-1	CCCCCCCCC=CCCCCCCCCCCCCO	{1: 1, 2: 19, 20: 1, 6: 2}
OK	629-99-2	CCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 23}
OK	6290-03-5	C[C@H](CCO)O	{1: 1, 2: 2, 3: 1, 20: 2}
OK	6290-05-7	CCOC(=O)CNCC(=O)OCC	{1: 2, 2: 4, 28: 2, 31: 1}
OK	6290-17-1	CCOC(=O)CC1(OCC(O1)C)C	{1: 3, 2: 2, 11: 1, 12: 1, 13: 1, 23: 2, 28: 1}
OK	6290-49-9	COCC(=O)OC	{1: 2, 2: 1, 28: 1, 22: 1}
OK	6290-50-2	CC(=O)CC(=O)COC	{24: 2, 1: 2, 2: 2, 22: 1}
OK	6291-84-5	CNCCCN	{1: 1, 2: 3, 30: 1, 31: 1}
OK	6291-85-6	CCOCCCN	{1: 1, 2: 4, 30: 1, 22: 1}
OK	6292-20-2	CCC(C)C1CCC(CC1)O	{1: 2, 2: 1, 3: 1, 11: 4, 12: 2, 20: 1}
OK	6292-82-6	CC1CC(NC(C1)(C)C)C	{32: 1, 1: 4, 11: 2, 12: 2, 13: 1}
OK	6293-37-4	CCCCC(CC)COC(=O)CC	{1: 3, 2: 6, 3: 1, 28: 1}
OK	6294-17-3	C(CCCBr)CCCl	{17: 1, 2: 6, 18: 1}
OK	6294-31-1	CCCCCCSCCCCCC	{40: 1, 1: 2, 2: 10}
OK	6294-39-9	CC1CCCCC1Br	{1: 1, 18: 1, 11: 4, 12: 2}
OK	6294-40-2	CC1CCC(CC1)Br	{1: 1, 18: 1, 11: 4, 12: 2}
OK	6294-89-9	COC(=O)NN	{1: 1, 28: 1, 30: 1, 31: 1}
OK	62946-68-3	CCCC(CCO)CO	{1: 1, 2: 5, 3: 1, 20: 2}
OK	62948-64-5	C1CCC(CC1)C2CCOC(=O)C2	{28: 1, 11: 8, 12: 2}
OK	6295-06-3	CCCCOC(=O)C=O	{1: 1, 2: 3, 28: 1, 26: 1}
OK	6295-87-0	C1=CC=[N+](C=C1)N.[I-]	{33: 1, 19: 1, 30: 1, 14: 5}
OK	62957-60-2	CCOCC#N	{1: 1, 2: 2, 37: 1, 22: 1}
OK	6296-45-3	CCOC(=O)N(CCCl)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 17: 1, 28: 1, 29: 1}
OK	6296-84-0	CC1(CCCCC1O)O	{1: 1, 11: 4, 12: 1, 13: 1, 20: 2}
OK	62961-64-2	CC(C)OC(=O)[C@H]([C@@H](C(=O)OC(C)C)O)O	{1: 4, 3: 4, 20: 2, 28: 2}
OK	6297-08-1	C1CCC(CC1)C2CC(CC(C2)C3CCCCC3)C4CCCCC4	{11: 18, 12: 6}
OK	6297-41-2	CCCCOC(=O)C(C)CCC	{1: 3, 2: 5, 3: 1, 28: 1}
OK	6297-42-3	CCCC(C)C(=O)OCC(C)C	{1: 4, 2: 3, 3: 2, 28: 1}
OK	6297-48-9	CCCCCOC(=O)C(C)CCC	{1: 3, 2: 6, 3: 1, 28: 1}
OK	6298-65-3	C1(=C2C(=C(C(=C2Cl)Cl)Cl)Cl)C(=C(C(=C1Cl)Cl)Cl)Cl	{17: 8, 15: 10}
OK	6299-37-2	C(CCl)N1C(=O)N(C(=O)N(C1=O)CCCl)CCCl	{17: 3, 2: 6, 33: 3, 25: 3}
OK	6299-73-6	C=CCOC(=O)CC(CC(=O)OCC=C)(C(=O)OCC=C)O	{2: 5, 4: 1, 5: 3, 6: 3, 20: 1, 28: 3}
OK	63-00-3	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)C[C@H](C4=CC(=O)CC[C@]34C)O	{1: 2, 11: 7, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 2}
OK	63-05-8	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C	{1: 2, 11: 8, 12: 3, 13: 2, 14: 1, 15: 1, 25: 2}
OK	63-68-3	CSCC[C@@H](C(=O)O)N	{1: 1, 2: 2, 3: 1, 40: 1, 27: 1, 30: 1}
OK	63-75-2	CN1CCC=C(C1)C(=O)OC	{1: 2, 33: 1, 11: 3, 14: 1, 15: 1, 28: 1}
OK	630-01-3	CCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 24}
OK	630-02-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 26}
OK	630-03-5	CCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 27}
OK	630-04-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 29}
OK	630-05-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 31}
OK	630-06-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 34}
OK	630-07-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 33}
OK	630-13-7	CC(C)(I)I	{1: 2, 19: 2, 4: 1}
OK	630-16-0	C(C(Br)(Br)Br)Br	{2: 1, 4: 1, 18: 4}
OK	630-17-1	CC(C)(C)CBr	{1: 3, 2: 1, 4: 1, 18: 1}
OK	630-18-2	CC(C)(C)C#N	{1: 3, 4: 1, 37: 1}
OK	630-19-3	CC(C)(C)C=O	{1: 3, 26: 1, 4: 1}
OK	630-20-6	C(C(Cl)(Cl)Cl)Cl	{17: 4, 2: 1, 4: 1}
OK	630-25-1	C(C(Cl)(Cl)Br)(Cl)(Cl)Br	{17: 4, 18: 2, 4: 2}
OK	630-51-3	CC(C)(C(=O)O)C(C)(C)C(=O)O	{1: 4, 27: 2, 4: 2}
OK	630-56-8	CCCCCC(=O)O[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)C(=O)C	{1: 4, 2: 4, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 24: 1, 25: 1, 28: 1}
OK	630-60-4	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@H]([C@@]3([C@@H]4[C@@H](CC[C@@]3(C2)O)[C@]5(CC[C@@H]([C@]5(C[C@H]4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O	{1: 2, 2: 1, 11: 8, 12: 11, 13: 4, 14: 1, 15: 1, 20: 8, 22: 1, 23: 1, 28: 1}
OK	630-64-8	CC1[C@H](C(C[C@@H](O1)O[C@H]2CC[C@@]3(C4CC[C@@]5([C@H](CC[C@@]5(C4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O)O)O	{1: 2, 11: 11, 12: 8, 13: 4, 14: 1, 15: 1, 20: 4, 22: 1, 23: 1, 26: 1, 28: 1}
OK	630-70-6	C([N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])I	{19: 1, 4: 1, 38: 3}
OK	630-72-8	C(#N)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{4: 1, 37: 1, 38: 3}
OK	6300-00-1	CC(C)(C)CC(CBr)Br	{1: 3, 2: 2, 3: 1, 4: 1, 18: 2}
OK	63001-13-8	CC12C3C1(C2C3=C)C	{1: 2, 15: 1, 12: 2, 5: 1, 13: 2}
OK	6301-71-9	C1CCC(CC1)N2C(=O)CCC2=O	{25: 2, 11: 7, 12: 1, 33: 1}
OK	63019-57-8	CCC(CC)C(=O)N1CC1	{1: 2, 2: 2, 3: 1, 33: 1, 11: 2, 24: 1}
OK	6302-94-9	CN1CSCSC1	{1: 1, 11: 3, 41: 2, 33: 1}
OK	63021-11-4	CCCCCCCCC=CCCCCCCCC(=O)N1CC1	{1: 1, 2: 14, 6: 2, 33: 1, 11: 2, 24: 1}
OK	63021-23-8	CCCCOCCOC(=O)CCCCCCCC(=O)OCCOCCCC	{1: 2, 2: 17, 28: 2, 22: 2}
OK	63021-43-2	CCCCCCCCCCCCCC(=O)N1CC1	{24: 1, 1: 1, 2: 12, 11: 2, 33: 1}
OK	63021-51-2	CCCCCCCCC(=O)N1CC1	{24: 1, 1: 1, 2: 7, 11: 2, 33: 1}
OK	63025-02-5	CCC=CC=CCCCCCCCCO	{1: 1, 2: 9, 20: 1, 6: 4}
OK	63027-88-3	C1CC(C(OC1)Cl)(Cl)Cl	{17: 3, 11: 3, 12: 1, 13: 1, 23: 1}
OK	6303-64-6	C1CC2CCC1CC2CN.Cl	{17: 1, 2: 1, 11: 5, 12: 3, 30: 1}
OK	63039-46-3	CC(C)(C)OC(=O)N[C@H](CC#C)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 9: 1, 10: 1, 27: 1, 28: 1, 31: 1}
OK	63039-48-5	CC(C)(C)OC(=O)N[C@@H](CC#C)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 9: 1, 10: 1, 27: 1, 28: 1, 31: 1}
OK	6304-34-3	C=CCOC(=O)C(Cl)(Cl)Cl	{2: 1, 4: 1, 5: 1, 6: 1, 17: 3, 28: 1}
OK	6304-39-8	CCCCCCCC(=O)NN	{24: 1, 1: 1, 2: 6, 30: 1, 31: 1}
OK	63040-43-7	CCCCCCCCCC(=O)O[C@@]12[C@@H](C1(C)C)[C@@H]3C=C(C[C@]4([C@H]([C@]3([C@@H](C2OC(=O)C(C)CC)C)O)C=C(C4=O)C)O)CO	{1: 7, 2: 10, 3: 1, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	63040-44-8	CCCCCCCCCCCC(=O)O[C@@]12[C@@H](C1(C)C)[C@@H]3C=C(C[C@]4([C@H]([C@]3([C@@H]([C@H]2OC(=O)[C@@H](C)CC)C)O)C=C(C4=O)C)O)CO	{1: 7, 2: 12, 3: 1, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	63041-01-0	CC(CN(CC(C)OCC1CO1)C(C)(C)C)OCC2CO2	{1: 5, 2: 4, 3: 2, 4: 1, 33: 1, 11: 2, 12: 2, 22: 2, 23: 2}
OK	6305-43-7	C(C(=O)C(=O)CBr)Br	{24: 2, 2: 2, 18: 2}
OK	6305-71-1	CC(C)CC(C)CO	{1: 3, 2: 2, 3: 2, 20: 1}
OK	63059-33-6	CCCCNC(=O)NCC(=O)O	{24: 1, 1: 1, 2: 4, 27: 1, 31: 2}
OK	63059-37-0	CCCCN1C(=O)CC(=O)N(C1=O)CC(=O)O	{1: 1, 2: 4, 33: 2, 11: 1, 25: 3, 27: 1}
OK	63059-78-9	CC(C)CCCCCCCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCCCCCCCC(C)C	{24: 2, 1: 4, 2: 30, 3: 2, 31: 2}
OK	63059-80-3	CCCCCCCCCCCC(=O)OCCN1C(=O)C(N(C1=O)CCOC(=O)CCCCCCCCCCC)(C)C	{1: 4, 2: 24, 33: 2, 13: 1, 25: 2, 28: 2}
OK	6308-94-7	CCCCCCCCCCN(CC)CC	{1: 3, 2: 11, 33: 1}
OK	63087-22-9	CCCCCCC(CCCCCCCCCCC(=O)O)O.CC(=C)C(=O)O.CC(=C)C(=O)OCC1CO1	{1: 3, 2: 16, 3: 1, 5: 2, 7: 2, 11: 1, 12: 1, 20: 1, 23: 1, 27: 2, 28: 1}
OK	63089-86-1	CCCCCCCC/C=C\CCCCCCCC(=O)O.CCCCCCCC/C=C\CCCCCCCC(=O)O.CCCCCCCC/C=C\CCCCCCCC(=O)O.CCCCCCCC/C=C\CCCCCCCC(=O)O.C(O)COCC(OCCO)C(OCCO)C(OCCO)C(OCCO)COCCO	{1: 4, 2: 70, 3: 4, 6: 8, 20: 6, 22: 6, 27: 4}
OK	6309-50-8	CCCCCCCCCCCC(=O)OCCBr	{1: 1, 2: 12, 28: 1, 18: 1}
OK	6309-51-9	CCCCCCCCCCCC(=O)OCCC(C)C	{1: 3, 2: 12, 3: 1, 28: 1}
OK	63093-41-4	CCOC(=O)CCC#C	{1: 1, 2: 3, 28: 1, 10: 1, 9: 1}
OK	63095-33-0	CCC=CCCC1CCC(=O)O1	{1: 1, 2: 3, 6: 2, 11: 2, 12: 1, 28: 1}
OK	63096-02-6	CC(C)C[C@@H](C(=O)OC)NC(=O)OC(C)(C)C	{1: 6, 2: 1, 3: 2, 4: 1, 28: 2, 31: 1}
OK	631-01-6	C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)O)C)C)(C)C=O)O	{1: 6, 11: 9, 12: 5, 13: 6, 14: 1, 15: 1, 20: 2, 26: 1, 27: 1}
OK	631-22-1	CCOC(=O)C(C(=O)OCC)(Br)Br	{1: 2, 2: 2, 4: 1, 18: 2, 28: 2}
OK	631-28-7	CC(CBr)(CBr)Br	{1: 1, 2: 2, 4: 1, 18: 3}
OK	631-57-2	CC(=O)C#N	{24: 1, 1: 1, 37: 1}
OK	631-64-1	C(C(=O)O)(Br)Br	{27: 1, 18: 2, 3: 1}
OK	631-65-2	CC(C)C(C)Cl	{1: 3, 3: 2, 17: 1}
OK	631-66-3	CC(=O)C(=O)N	{24: 2, 1: 1, 30: 1}
OK	6310-76-5	CC(=NCCN=C(C)CC(=O)C)CC(=O)C	{24: 2, 1: 4, 2: 4, 34: 2, 7: 2}
OK	63123-41-1	CC(C)OCC(COCC=C)O	{1: 2, 2: 3, 3: 2, 5: 1, 6: 1, 20: 1, 22: 2}
OK	63126-45-4	COC[C@@H]1CCCN1C=O	{1: 1, 2: 1, 33: 1, 11: 3, 12: 1, 22: 1, 26: 1}
OK	63126-47-6	COC[C@@H]1CCCN1	{32: 1, 1: 1, 2: 1, 11: 3, 12: 1, 22: 1}
OK	63126-48-7	CCCCC(C(CC)CC)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	63126-52-3	CN(C)C(=O)[C@H]([C@@H](C(=O)N(C)C)O)O	{24: 2, 1: 4, 3: 2, 20: 2, 33: 2}
OK	63135-03-5	CCOC(=O)CCCCCC1CCCC1=O	{1: 1, 2: 6, 11: 3, 12: 1, 25: 1, 28: 1}
OK	63145-02-8	CCCCNCC(C)C#N	{1: 2, 2: 4, 3: 1, 37: 1, 31: 1}
OK	63149-34-8	C(CC=O)CC=O.C(CC=O)CC=O.C(CC=O)CC=O.C(CC=O)CC=O.C([C@@H](C(=O)O)N)S	{2: 13, 3: 1, 39: 1, 26: 8, 27: 1, 30: 1}
OK	63149-54-2	C/C(=N\N=C(N)N)/C=C.C(C(=O)O)O	{1: 1, 2: 1, 5: 1, 6: 1, 7: 2, 34: 2, 20: 1, 27: 1, 30: 2}
OK	63149-77-9	COC(=O)C=C.C=CCCO/C=C/O/C=C/OCCC=C.C=CC#N	{1: 1, 2: 4, 5: 4, 6: 8, 22: 3, 28: 1, 37: 1}
OK	6315-60-2	CCOC(=O)CCN(C)CCC(=O)OCC	{1: 3, 2: 6, 28: 2, 33: 1}
OK	63150-11-8	C(CCCCC(=O)O)CCCC(=O)O.C(COCCO)O.C(C(CO)O)O	{27: 2, 2: 14, 3: 1, 20: 5, 22: 1}
OK	63150-17-4	CC(CCl)C#C	{1: 1, 2: 1, 3: 1, 9: 1, 10: 1, 17: 1}
OK	6316-04-7	CCCCCCCCCCCCOC(=O)CCl	{1: 1, 2: 12, 28: 1, 17: 1}
OK	63165-89-9	CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C2=C(C#N)C#N)C=C(C1=O)C(C)(C)C	{1: 12, 4: 4, 37: 2, 7: 1, 14: 4, 15: 9, 25: 2}
OK	63165-90-2	CCOC(=O)C(=C1C(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C1=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C#N	{1: 13, 2: 1, 4: 4, 37: 1, 7: 1, 14: 4, 15: 9, 25: 2, 28: 1}
OK	63165-91-3	CC(=O)C(=C1C(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C1=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C(=O)C	{1: 14, 4: 4, 7: 1, 14: 4, 15: 9, 24: 2, 25: 2}
OK	63165-92-4	CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C2=C4C(=C(C(=C4Cl)Cl)Cl)Cl)C=C(C1=O)C(C)(C)C	{1: 12, 4: 4, 14: 4, 15: 14, 17: 4, 25: 2}
OK	63165-93-5	CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C2=C4C(=O)C(=C(C4=O)Cl)Cl)C=C(C1=O)C(C)(C)C	{1: 12, 4: 4, 14: 4, 15: 12, 17: 2, 25: 4}
OK	6317-18-6	C(SC#N)SC#N	{40: 2, 2: 1, 37: 2}
OK	6317-49-3	CCOC(=O)CCC(=O)CCC(=O)OCC	{24: 1, 1: 2, 2: 6, 28: 2}
OK	63180-06-3	CC1(C2CCC1(C(=O)C2=C(C(C(C(F)(F)F)(F)F)(F)F)O)C)C	{1: 3, 4: 3, 7: 1, 11: 2, 12: 1, 13: 2, 15: 1, 16: 7, 20: 1, 25: 1}
OK	63181-88-4	CCOC(=O)C=C.CC(=O)OC=C.COC(=O)C=C	{1: 3, 2: 1, 28: 3, 5: 3, 6: 3}
OK	632-05-3	CC(C(CBr)Br)Br	{1: 1, 2: 1, 3: 2, 18: 3}
OK	632-07-5	CC(C#N)C(=O)O	{27: 1, 1: 1, 3: 1, 37: 1}
OK	632-14-4	CNC(=O)N(C)C	{24: 1, 1: 3, 33: 1, 31: 1}
OK	632-20-2	C[C@@H]([C@H](C(=O)O)N)O	{27: 1, 1: 1, 3: 2, 20: 1, 30: 1}
OK	632-21-3	C(C(=O)C(Cl)Cl)(Cl)Cl	{24: 1, 17: 4, 3: 2}
OK	632-22-4	CN(C)C(=O)N(C)C	{24: 1, 1: 4, 33: 2}
OK	632-32-6	CC(C)C(C)CCC(C)C1CCC2=C3CCC4CC(CCC4(C3CCC12C)C)O	{1: 6, 2: 2, 3: 3, 11: 9, 12: 4, 13: 2, 15: 2, 20: 1}
OK	632-56-4	CCOC(=O)C(C(C(=O)OCC)C(=O)OCC)C(=O)OCC	{1: 4, 2: 4, 3: 2, 28: 4}
OK	632-93-9	CCOC(=O)C1=C(NC(=C(C1C)C(=O)OCC)C)C	{32: 1, 1: 5, 2: 2, 12: 1, 15: 4, 28: 2}
OK	6320-16-7	C(CO)NC(=O)CCl	{24: 1, 17: 1, 2: 3, 20: 1, 31: 1}
OK	6320-68-9	CCC(C)(C#CC)O	{1: 3, 2: 1, 4: 1, 10: 2, 20: 1}
OK	6320-96-3	C(CBr)C(=O)N	{24: 1, 2: 2, 18: 1, 30: 1}
OK	6321-40-0	CC(=C)CN(CC(=C)C)CC(=C)C	{1: 3, 2: 3, 33: 1, 5: 3, 7: 3}
OK	6321-45-5	CCCCC(=O)OCC=C	{1: 1, 2: 4, 28: 1, 5: 1, 6: 1}
OK	63212-76-0	CC(C)(C)C#CC#N	{1: 3, 10: 2, 4: 1, 37: 1}
OK	63217-76-5	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 72}
OK	63217-79-8	C1CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1	{11: 96}
OK	6322-01-6	CCN(CC)CC(CN)O	{1: 2, 2: 4, 3: 1, 33: 1, 20: 1, 30: 1}
OK	6322-49-2	CC(=O)CCCl	{24: 1, 1: 1, 2: 2, 17: 1}
OK	63225-53-6	CCCCNC(=O)OCCOC(=O)C=C	{1: 1, 2: 5, 5: 1, 6: 1, 28: 2, 31: 1}
OK	6323-79-1	CCCN(CCC)CC#C	{1: 2, 2: 5, 33: 1, 10: 1, 9: 1}
OK	6323-82-6	CCN(CC)CC#CC	{1: 3, 2: 3, 10: 2, 33: 1}
OK	63231-83-4	CCCCCCCCCCCCCCCCCC(C=C)N1CCCC1=O	{1: 1, 2: 16, 3: 1, 5: 1, 6: 1, 33: 1, 11: 3, 25: 1}
OK	63250-48-6	CCN1C(=CC(=O)OCC)SC(C1=O)N2CCCCC2	{1: 2, 2: 2, 6: 1, 33: 2, 41: 1, 11: 5, 12: 1, 15: 1, 25: 1, 28: 1}
OK	6326-44-9	CCOC(=O)C(C(=O)OCC)NC=O	{1: 2, 2: 2, 3: 1, 26: 1, 28: 2, 31: 1}
OK	63261-45-0	C1C[C@@H]([C@H](C1)O)O	{20: 2, 11: 3, 12: 2}
OK	63262-98-6	CC(=NN(C)/C=C/C(=O)C)C	{1: 4, 34: 1, 6: 2, 33: 1, 7: 1, 24: 1}
OK	63263-00-3	CC(=NN(C)/C=C/C(=O)OC)C	{1: 4, 34: 1, 6: 2, 33: 1, 7: 1, 28: 1}
OK	63263-01-4	CCN(/C=C/C(=O)OC)/N=C/C	{1: 3, 2: 1, 6: 3, 33: 1, 34: 1, 28: 1}
OK	63263-02-5	CC(C)N(/C=C/C(=O)OC)N=C(C)C	{1: 5, 34: 1, 3: 1, 6: 2, 33: 1, 7: 1, 28: 1}
OK	6327-74-8	CC12SC3(SC(S1)(SC(S2)(S3)C)C)C	{1: 4, 13: 4, 41: 6}
OK	63270-18-8	CCC(=O)OC(C)C(C)CC=C(C)C	{1: 5, 2: 2, 3: 2, 6: 1, 7: 1, 28: 1}
OK	633-31-8	CCC(=O)O[C@H]1CCC2([C@H]3CCC4([C@H](C3CC=C2C1)CC[C@@H]4C(C)CCCC(C)C)C)C	{1: 6, 2: 4, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	633-47-6	CCCN(C(CC)C(=O)N(C)C)C(=O)/C=C/C	{1: 5, 2: 3, 3: 1, 6: 2, 33: 2, 24: 2}
OK	63301-31-5	C1CC[C@H]([C@@H](C1)C#N)O	{20: 1, 11: 4, 12: 2, 37: 1}
OK	63302-04-5	C1CCC(C1)NCN	{2: 1, 11: 4, 12: 1, 30: 1, 31: 1}
OK	63302-64-7	CCCCC(CC)COC(=O)C1CCC=CC1	{1: 2, 2: 5, 3: 1, 11: 3, 12: 1, 14: 2, 28: 1}
OK	63323-26-2	CCC(=O)C(C)CC(C)C=C	{1: 3, 2: 2, 3: 2, 5: 1, 6: 1, 24: 1}
OK	63324-22-1	CCC(=O)C(C)CC(C)C1CO1	{1: 3, 2: 2, 3: 2, 11: 1, 12: 1, 23: 1, 24: 1}
OK	63331-67-9	COC(C(C(OC)OC)Br)OC	{1: 4, 18: 1, 3: 3, 22: 4}
OK	6334-96-9	C(CCCl)COCCCCCl	{17: 2, 2: 8, 22: 1}
OK	6335-02-0	CCOC(=O)C(CCOC)C(=O)OCC	{1: 3, 2: 4, 3: 1, 28: 2, 22: 1}
OK	6335-97-3	CCCCCCCCN(CCCCCCCC)N=O	{1: 2, 2: 14, 34: 1, 29: 1, 33: 1}
OK	6336-58-9	CCCCN(CCCC)CC#C	{1: 2, 2: 7, 33: 1, 10: 1, 9: 1}
OK	63364-70-5	CC(=C=C=O)C	{8: 2, 1: 2, 29: 1, 7: 1}
OK	6338-55-2	C(COCCOCCO)N	{2: 6, 20: 1, 30: 1, 22: 2}
OK	6338-83-6	CC1CCC(=O)C(C1)C(=O)C2CC(=O)NC(=O)C2	{32: 1, 1: 1, 11: 5, 12: 3, 24: 1, 25: 3}
OK	63393-28-2	CC1C(SC(O1)C)C	{1: 3, 12: 3, 41: 1, 23: 1}
OK	634-55-9	CCOC(=O)C(C#N)C(=O)C	{1: 2, 2: 1, 3: 1, 37: 1, 24: 1, 28: 1}
OK	634-62-8	C(C(C(=O)O)O)(C(=O)O)O.NN	{27: 2, 3: 2, 20: 2, 30: 2}
OK	634-85-5	C1=C(C(=O)C(=C(C1=O)Cl)Cl)Cl	{17: 3, 25: 2, 14: 1, 15: 3}
OK	634-95-7	CCN(CC)C(=O)N	{24: 1, 1: 2, 2: 2, 30: 1, 33: 1}
OK	63408-88-8	CCCCCCC(CCOC(=O)CC)O	{1: 2, 2: 8, 3: 1, 20: 1, 28: 1}
OK	6341-85-1	CC1(CO1)C2CO2	{1: 1, 11: 2, 12: 1, 13: 1, 23: 2}
OK	63428-83-1	C(CCC=O)CCNC(=O)CCCCCNC(=O)CCCCCN	{24: 2, 2: 15, 26: 1, 30: 1, 31: 2}
OK	63428-89-7	CCCCC(CC)C(=O)O.C(CNCCN)N	{1: 2, 2: 8, 3: 1, 27: 1, 30: 2, 31: 1}
OK	6343-16-4	C1C2C=CC1[C@@H]([C@H]2C#N)C#N	{11: 1, 12: 4, 37: 2, 14: 2}
OK	6343-21-1	C1C2C=CC1C(C2(C#N)C#N)(C#N)C#N	{11: 1, 12: 2, 13: 2, 14: 2, 37: 4}
OK	6343-47-1	CCN(CC)CC(C)(C)C=O	{1: 4, 2: 3, 4: 1, 26: 1, 33: 1}
OK	63441-20-3	CC1CCCN(C1)C(=O)C2CCCCC2	{24: 1, 1: 1, 11: 9, 12: 2, 33: 1}
OK	63441-26-9	CCCCCCCCC=CCCCCCCCC1=NCCN1CCNC(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 30, 35: 1, 6: 4, 33: 1, 11: 2, 15: 1, 24: 1, 31: 1}
OK	63448-63-5	CCC(COC)N	{1: 2, 2: 2, 3: 1, 30: 1, 22: 1}
OK	63449-89-8	CCCCCC1OC(CC(O1)(C)C)C	{1: 4, 2: 4, 11: 1, 12: 2, 13: 1, 23: 2}
OK	63449-90-1	CC1CCOC2(O1)CCC(CC2)C(C)(C)C	{1: 4, 4: 1, 11: 6, 12: 2, 13: 1, 23: 2}
OK	63449-97-8	CC1(CC(=O)C2C3CCCCC3C2(C1)C)C	{1: 3, 11: 6, 12: 3, 13: 2, 25: 1}
OK	63450-10-2	CC(CC1CCCCC1)C(C)O	{1: 2, 2: 1, 3: 2, 11: 5, 12: 1, 20: 1}
OK	63450-12-4	C/C=C/C1CC(=O)O1	{1: 1, 11: 1, 12: 1, 6: 2, 28: 1}
OK	63450-13-5	CCCCOC(=O)C=C.CC(=O)OC=C.C=C(CC(=O)O)C(=O)O	{1: 2, 2: 4, 5: 3, 6: 2, 7: 1, 27: 2, 28: 2}
OK	63450-23-7	CCCCC(CC)COC(=O)C=C.CC(=O)CC(C)(C)O.C=CC(=O)N	{1: 5, 2: 6, 3: 1, 4: 1, 5: 2, 6: 2, 20: 1, 24: 2, 28: 1, 30: 1}
OK	63450-28-2	CC(C)CCCOC(=O)C=CC(=O)OCCCCOC(=O)C=CC(=O)OCCCC(C)C	{1: 4, 2: 10, 3: 2, 28: 4, 6: 4}
OK	63450-29-3	CCCCCCOC(=O)C=CC(=O)OCCCCOC(=O)C=CC(=O)OCCCCCC	{1: 2, 2: 14, 28: 4, 6: 4}
OK	63450-32-8	CCCCCCC1CC(=O)OC1	{1: 1, 2: 5, 11: 2, 12: 1, 28: 1}
OK	63450-36-2	CCCC=CC=CCCO	{1: 1, 2: 4, 20: 1, 6: 4}
OK	63450-56-6	CC(C)CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)Br)OC(=O)CC(C)C)OC(=O)CC(C)C)OC(=O)CC(C)C	{1: 8, 2: 5, 3: 4, 12: 5, 18: 1, 23: 1, 28: 4}
OK	63451-00-3	CC1(CCCC(N1C)(C)C)C.I	{19: 1, 1: 5, 11: 3, 13: 2, 33: 1}
OK	63451-15-0	CCCCCCCC(=O)NCCNCCO	{24: 1, 1: 1, 2: 10, 20: 1, 31: 2}
OK	63451-22-9	CCCCCCCCCC1=NCCN1CCOCCC(=O)O	{1: 1, 2: 12, 35: 1, 33: 1, 11: 2, 15: 1, 22: 1, 27: 1}
OK	6346-09-4	CCOC(CCCN)OCC	{1: 2, 2: 5, 3: 1, 30: 1, 22: 2}
OK	63467-53-8	CC1(CC(=NO)CC(N1)(C)C)C.Cl	{32: 1, 1: 4, 34: 1, 11: 2, 13: 2, 15: 1, 17: 1, 20: 1}
OK	63467-96-9	C1(=O)NC(=O)NN1.NN	{32: 3, 25: 2, 30: 2}
OK	63468-00-8	CCCOC(=O)C(C)(CO)CO	{1: 2, 2: 4, 4: 1, 20: 2, 28: 1}
OK	63468-05-3	CC=CC(C)(C)O	{1: 3, 4: 1, 6: 2, 20: 1}
OK	63468-70-2	CCCCCCC(C#N)N	{1: 1, 2: 5, 3: 1, 37: 1, 30: 1}
OK	63469-23-8	CC(CN(CCCN(C)C)CC(C)O)O	{1: 4, 2: 5, 3: 2, 20: 2, 33: 2}
OK	6347-01-9	C1C(C(C(C(O1)(CO)O)O)O)O	{2: 1, 11: 1, 12: 3, 13: 1, 20: 5, 23: 1}
OK	63473-60-9	C[C@H](CC(=O)O)CC(=O)OC	{27: 1, 1: 2, 2: 2, 3: 1, 28: 1}
OK	63493-28-7	CCCC(C)N	{1: 2, 2: 2, 3: 1, 30: 1}
OK	635-03-0	CCOC(=O)CC(C(C(=O)OCC)C(=O)OCC)C(=O)OCC	{1: 4, 2: 5, 3: 2, 28: 4}
OK	63505-49-7	CCCCCCOC(=O)CCCl	{1: 1, 2: 7, 28: 1, 17: 1}
OK	63505-50-0	CCCCCCCCOC(=O)CCCl	{1: 1, 2: 9, 28: 1, 17: 1}
OK	63512-22-1	C(CCCN)CCN.C(=O)=O	{8: 1, 2: 6, 29: 2, 30: 2}
OK	63512-34-5	CC(C)C(=O)OCC(C)(C)COC(=O)C(C)C	{1: 6, 2: 2, 3: 2, 4: 1, 28: 2}
OK	63512-36-7	CCCCOCCOCCOCCOCCCC	{1: 2, 2: 12, 22: 4}
OK	63512-39-0	CC(C)CC(=O)OCC(C(C(C(C=O)OC(=O)CC(C)C)OC(=O)CC(C)C)OC(=O)CC(C)C)O	{1: 8, 2: 5, 3: 8, 20: 1, 26: 1, 28: 4}
OK	63512-62-9	CCCC(=O)SCCN(C)C	{24: 1, 1: 3, 2: 4, 40: 1, 33: 1}
OK	63521-36-8	CC(CCO)C(C)(C)O	{1: 3, 2: 2, 3: 1, 4: 1, 20: 2}
OK	63521-37-9	CCC(C)(C(C)O)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 2}
OK	63549-24-6	COC/C(=C\1/C=CC(=O)C=C1O)/N.Cl	{1: 1, 2: 1, 7: 1, 14: 3, 15: 2, 17: 1, 20: 1, 22: 1, 25: 1, 30: 1}
OK	63563-21-3	CCCCC(=O)CC(=O)O	{24: 1, 1: 1, 2: 4, 27: 1}
OK	63573-84-2	CCCC(C1CCCCC1)OC(=O)C	{1: 2, 2: 2, 3: 1, 11: 5, 12: 1, 28: 1}
OK	63573-88-6	CC1CCC(CC1)C(C)OC(=O)C	{11: 4, 1: 3, 3: 1, 12: 2, 28: 1}
OK	63574-03-8	CC(C)C(=O)OC(C)(C)C1CCCCC1	{1: 4, 3: 1, 4: 1, 11: 5, 12: 1, 28: 1}
OK	636-48-6	CCC(CC(=O)O)C(=O)O	{27: 2, 1: 1, 2: 2, 3: 1}
OK	636-61-3	C([C@H](C(=O)O)O)C(=O)O	{27: 2, 2: 1, 3: 1, 20: 1}
OK	636-70-4	CCN(CC)CC.Br	{1: 3, 2: 3, 18: 1, 33: 1}
OK	636-82-8	C1CCC(=CC1)C(=O)O	{27: 1, 11: 4, 14: 1, 15: 1}
OK	63615-05-4	C(=C=C=C=O)=C=C=C=O	{8: 7, 29: 2}
OK	63642-17-1	CN(C(=O)NCCC[C@@H](C(=O)O)N)N=O	{1: 1, 2: 3, 3: 1, 33: 1, 34: 1, 24: 1, 27: 1, 29: 1, 30: 1, 31: 1}
OK	63649-50-3	CC1=CCC(C(C1)(C)C)C(C)OC(=O)C	{1: 5, 3: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 28: 1}
OK	63654-41-1	C(=C(F)F)(C(F)(F)F)F.C(=C(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F.C(=C(F)F)(F)F	{16: 20, 4: 4, 22: 1, 7: 6}
OK	6366-35-4	CCC(C)(C)CCl	{1: 3, 2: 2, 4: 1, 17: 1}
OK	63663-21-8	CCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCCC)C(=O)NCCCC	{24: 3, 1: 3, 2: 18, 3: 1, 31: 3}
OK	63665-41-8	C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@@H]([C@@H]2OC(=O)C(C)(C)C)N4CCCCC4)CC[C@@H]5[C@@]3(C[C@@H]([C@H](C5)OC(=O)C(C)(C)C)N6CCCCC6)C	{1: 8, 4: 2, 33: 2, 11: 17, 12: 8, 13: 2, 28: 2}
OK	6368-20-3	CC(C)(C)OC(=O)N[C@H](CO)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 1, 27: 1, 28: 1, 31: 1}
OK	63680-10-4	CC(=O)O.CC(=O)O.C(CSC(=N)N)N	{1: 2, 2: 2, 36: 1, 7: 1, 40: 1, 27: 2, 30: 2}
OK	63697-00-7	CC(C)OC(=O)C(C)O	{1: 3, 3: 2, 20: 1, 28: 1}
OK	63697-52-9	C1CCC(CC1)C(=O)N2CCC=CC2	{24: 1, 33: 1, 11: 8, 12: 1, 14: 2}
OK	637-39-8	C(CO)N(CCO)CCO.Cl	{17: 1, 2: 6, 20: 3, 33: 1}
OK	637-42-3	CCCCCOC(OCCCCC)OCCCCC	{1: 3, 2: 12, 3: 1, 22: 3}
OK	637-61-6	C1=CC(=O)C=CC1=NCl	{17: 1, 34: 1, 25: 1, 14: 4, 15: 1}
OK	637-64-9	CC(=O)OCC1CCCO1	{1: 1, 2: 1, 11: 3, 12: 1, 23: 1, 28: 1}
OK	637-65-0	CCC(=O)OCC1CCCO1	{1: 1, 2: 2, 11: 3, 12: 1, 23: 1, 28: 1}
OK	637-70-7	C1=CC(=NCl)C=CC1=NCl	{17: 2, 34: 2, 14: 4, 15: 2}
OK	637-78-5	CCC(=O)OC(C)C	{1: 3, 2: 1, 3: 1, 28: 1}
OK	637-84-3	C(C(=O)NCC(=O)NCC(=O)NCC(=O)O)N	{24: 3, 2: 4, 27: 1, 30: 1, 31: 3}
OK	637-88-7	C1CC(=O)CCC1=O	{25: 2, 11: 4}
OK	637-90-1	C1CC2C(O2)CCC=C1	{11: 4, 12: 2, 14: 2, 23: 1}
OK	637-91-2	CC(C)(C)/C=N/O	{1: 3, 34: 1, 4: 1, 6: 1, 20: 1}
OK	637-92-3	CCOC(C)(C)C	{1: 4, 2: 1, 4: 1, 22: 1}
OK	637-96-7	CNCC(=O)O.Cl	{31: 1, 1: 1, 2: 1, 27: 1, 17: 1}
OK	637-97-8	CCCC(C)I	{19: 1, 1: 2, 2: 2, 3: 1}
OK	637-98-9	CCSC(=O)N	{24: 1, 1: 1, 2: 1, 30: 1, 40: 1}
OK	63703-34-4	COC1(CCCCC1O)OC	{1: 2, 11: 4, 12: 1, 13: 1, 20: 1, 22: 2}
OK	63716-10-9	CCOCCOCC(C)O	{1: 2, 2: 4, 3: 1, 20: 1, 22: 2}
OK	63716-41-6	CCCC(CC)OC(C)CO	{1: 3, 2: 4, 3: 2, 20: 1, 22: 1}
OK	63721-05-1	CC(C)(CC(=O)OC)C=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 28: 1}
OK	63732-23-0	CSC(=O)CC(CF)O	{1: 1, 2: 2, 3: 1, 40: 1, 16: 1, 20: 1, 24: 1}
OK	63737-71-3	CC(C)NCCCNC(C)C	{1: 4, 2: 3, 3: 2, 31: 2}
OK	63744-63-8	COC(=O)C=C.C=CC(=O)OCCO.C=C(Cl)Cl	{1: 1, 2: 2, 5: 3, 6: 2, 7: 1, 17: 2, 20: 1, 28: 2}
OK	63744-77-4	CCCCOC(=O)C=C.COC(=O)C=C.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 3, 5: 2, 6: 4, 27: 2, 28: 2}
OK	63747-59-1	CCCCCCCCCCCCS.C=CC#N.C=CC(=O)O	{1: 1, 2: 11, 5: 2, 6: 2, 39: 1, 27: 1, 37: 1}
OK	63758-86-1	CCCCCCCCCCCCCCCCCCC(C)Cl	{1: 2, 2: 17, 3: 1, 17: 1}
OK	63765-78-6	CC(CCCC(=O)OCCF)F	{16: 2, 1: 1, 2: 5, 3: 1, 28: 1}
OK	63765-80-0	CCC(C(C(C)C)O)N	{1: 3, 2: 1, 3: 3, 20: 1, 30: 1}
OK	63767-85-1	CCOC(=O)C1CCC(CC1)C(C)(C)C	{1: 4, 2: 1, 4: 1, 11: 4, 12: 2, 28: 1}
OK	63767-86-2	CC(C)C1CCC(CC1)C(C)O	{11: 4, 1: 3, 3: 2, 12: 2, 20: 1}
OK	63767-87-3	CC(C1CCC(CC1)C(C)(C)C)O	{1: 4, 3: 1, 4: 1, 11: 4, 12: 2, 20: 1}
OK	6378-65-0	CCCCCCOC(=O)CCCCC	{1: 2, 2: 9, 28: 1}
OK	63789-05-9	CCCCN1C=C(C=C(C1CCC)CC)CC	{1: 4, 2: 7, 33: 1, 12: 1, 14: 2, 15: 2}
OK	6379-69-7	CC=CC(=O)OC1CC2C3(C1(C4(CC(=O)C(=CC4O2)C)C)C)CO3	{1: 4, 6: 2, 11: 3, 12: 3, 13: 3, 14: 1, 15: 1, 23: 2, 25: 1, 28: 1}
OK	63793-44-2	CCCCOC(=O)C=C.CC(C)CCCCCOC(=O)C=C.C=CC(=O)O	{1: 3, 2: 8, 3: 1, 5: 3, 6: 3, 27: 1, 28: 2}
OK	638-04-0	C[C@H]1CCC[C@@H](C)C1	{1: 2, 11: 4, 12: 2}
OK	638-07-3	CCOC(=O)CC(=O)CCl	{24: 1, 1: 1, 2: 3, 28: 1, 17: 1}
OK	638-10-8	CCOC(=O)C=C(C)C	{1: 3, 2: 1, 28: 1, 6: 1, 7: 1}
OK	638-11-9	CCCC(=O)OC(C)C	{1: 3, 2: 2, 3: 1, 28: 1}
OK	638-17-5	CC1NC(SC(S1)C)C	{32: 1, 1: 3, 12: 3, 41: 2}
OK	638-20-0	CC(=O)NC(=O)NC(=O)C	{24: 3, 1: 2, 31: 2}
OK	638-23-3	C([C@@H](C(=O)O)N)SCC(=O)O	{27: 2, 40: 1, 2: 2, 3: 1, 30: 1}
OK	638-25-5	CCCCCCCC(=O)OCCCCC	{1: 2, 2: 10, 28: 1}
OK	638-28-8	CCCCC(C)Cl	{1: 2, 2: 3, 3: 1, 17: 1}
OK	638-29-9	CCCCC(=O)Cl	{24: 1, 1: 1, 2: 3, 17: 1}
OK	638-32-4	C(CC(=O)O)C(=O)N	{24: 1, 2: 2, 27: 1, 30: 1}
OK	638-36-8	CCC(C)CCCC(C)CCCC(C)CCCC(C)C	{1: 6, 2: 10, 3: 4}
OK	638-37-9	C(CC=O)C=O	{2: 2, 26: 2}
OK	638-41-5	CCCCCOC(=O)Cl	{1: 1, 2: 4, 28: 1, 17: 1}
OK	638-45-9	CCCCCCI	{1: 1, 2: 5, 19: 1}
OK	638-46-0	CCCCSCC	{40: 1, 1: 2, 2: 4}
OK	638-51-7	CCCCCCON=O	{1: 1, 2: 5, 34: 1, 29: 1, 22: 1}
OK	638-53-9	CCCCCCCCCCCCC(=O)O	{1: 1, 2: 11, 27: 1}
OK	638-54-0	C(CCCC=O)CCC=O	{2: 6, 26: 2}
OK	638-58-4	CCCCCCCCCCCCCC(=O)N	{24: 1, 1: 1, 2: 12, 30: 1}
OK	638-59-5	CCCCCCCCCCCCCCOC(=O)C	{1: 2, 2: 13, 28: 1}
OK	638-60-8	CCCCCCCCCCCC#CC	{1: 2, 2: 10, 10: 2}
OK	638-65-3	CCCCCCCCCCCCCCCCCC#N	{1: 1, 2: 16, 37: 1}
OK	638-66-4	CCCCCCCCCCCCCCCCCC=O	{1: 1, 2: 16, 26: 1}
OK	638-67-5	CCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 21}
OK	638-68-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 28}
OK	638-73-3	C(Cl)(I)I	{19: 2, 17: 1, 3: 1}
OK	638-79-9	C(C(C(F)(F)F)(F)F)(C(C(F)(F)I)(F)F)(F)F	{16: 11, 19: 1, 4: 5}
OK	638-95-9	C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C	{1: 8, 11: 9, 12: 6, 13: 5, 14: 1, 15: 1, 20: 1}
OK	6380-71-8	CCCCCCCCCCCCOC(=O)CCS	{1: 1, 2: 13, 28: 1, 39: 1}
OK	6380-95-6	CC=C(C)OC	{1: 3, 22: 1, 6: 1, 7: 1}
OK	63807-78-3	CC(C)CCCC1CCCC1=O	{1: 2, 2: 3, 3: 1, 11: 3, 12: 1, 25: 1}
OK	63815-37-2	CC(C#N)(NCCCl)NCCCl	{1: 1, 2: 4, 4: 1, 37: 1, 17: 2, 31: 2}
OK	63817-78-7	C/C=C/C=C/C(=O)O.C1CCC2=NCCCN2CC1	{1: 1, 35: 1, 6: 4, 33: 1, 11: 8, 15: 1, 27: 1}
OK	6382-06-5	CCCCCOC(=O)C(C)O	{1: 2, 2: 4, 3: 1, 20: 1, 28: 1}
OK	6382-13-4	CCCCCCCCCCCCCCCCCC(=O)OCCCCC	{1: 2, 2: 20, 28: 1}
OK	63832-50-8	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OC.CC(=C)C(=O)OCC1CO1	{1: 5, 2: 18, 5: 3, 7: 3, 11: 1, 12: 1, 23: 1, 28: 3}
OK	63833-75-0	C(CN)CNCCCNCCNCCCN	{2: 11, 30: 2, 31: 3}
OK	63833-76-1	C(CN)CNCCCNCCNCCCNCCCN	{2: 14, 30: 2, 31: 4}
OK	63833-80-7	CCCCCCCCCCCCCCCCCC(=O)OCCNCCO	{1: 1, 2: 20, 20: 1, 28: 1, 31: 1}
OK	63833-84-1	CCOC(=O)C=C.CC(=C)C(=O)OC.C=CC(=O)OCCCCO	{1: 3, 2: 5, 5: 3, 6: 2, 7: 1, 20: 1, 28: 3}
OK	63833-87-4	C1CC(=O)OC1.C(CNCCN)N	{2: 4, 11: 3, 28: 1, 30: 2, 31: 1}
OK	63834-30-0	CCCCC(CC)C(C(=O)O)O	{27: 1, 1: 2, 2: 4, 3: 2, 20: 1}
OK	6384-92-5	CN[C@H](CC(=O)O)C(=O)O	{27: 2, 1: 1, 2: 1, 3: 1, 31: 1}
OK	63863-43-4	COC(=O)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F	{1: 1, 4: 5, 7: 2, 16: 13, 22: 2, 28: 1}
OK	63867-09-4	COC(=O)C(C(C(F)(F)F)(F)F)(F)Br	{16: 6, 1: 1, 18: 1, 4: 3, 28: 1}
OK	63867-20-9	CCC(C(=O)OC(C)C)F	{16: 1, 1: 3, 2: 1, 3: 2, 28: 1}
OK	63867-64-1	CC1(CC(CC(N1C)(C)C)Br)C	{1: 5, 33: 1, 11: 2, 12: 1, 13: 2, 18: 1}
OK	63869-13-6	C(CCl)SCSCCCl	{40: 2, 17: 2, 2: 5}
OK	63869-17-0	CC1(C(O1)CCC(=C)C2CO2)C	{1: 2, 2: 2, 5: 1, 7: 1, 11: 1, 12: 2, 13: 1, 23: 2}
OK	63870-28-0	CCC(COC(=O)[C@H](C)CN1CC1)(COC(=O)[C@H](C)CN2CC2)COC(=O)[C@H](C)CN3CC3	{1: 4, 2: 7, 3: 3, 4: 1, 33: 3, 11: 6, 28: 3}
OK	63883-69-2	CC/C(=C\C)/C=O	{1: 2, 2: 1, 26: 1, 6: 1, 7: 1}
OK	63884-38-8	CC1CC1C(=O)NN	{1: 1, 11: 1, 12: 2, 24: 1, 30: 1, 31: 1}
OK	63884-92-4	C(CCl)N(C(=O)OCCF)N=O	{33: 1, 2: 4, 34: 1, 16: 1, 17: 1, 28: 1, 29: 1}
OK	63886-56-6	CC1CN(CC1C)CCO	{1: 2, 2: 2, 33: 1, 11: 2, 12: 2, 20: 1}
OK	639-14-5	C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C=O)O	{1: 6, 11: 10, 12: 4, 13: 6, 14: 1, 15: 1, 20: 1, 26: 1, 27: 1}
OK	639-99-6	CC(=C)[C@@H]1C[C@@H](CC[C@@]1(C)C=C)C(C)(C)O	{1: 4, 4: 1, 5: 2, 6: 1, 7: 1, 11: 3, 12: 2, 13: 1, 20: 1}
OK	63904-24-5	C(#COC(F)(F)F)C(F)(F)F	{16: 6, 10: 2, 4: 2, 22: 1}
OK	63904-97-2	CC(C)OC(=O)CCCF	{16: 1, 1: 2, 2: 3, 3: 1, 28: 1}
OK	63904-99-4	COC(=O)C(CCF)O	{1: 1, 2: 2, 3: 1, 16: 1, 20: 1, 28: 1}
OK	63905-05-5	CN(CCO)CCCl.Cl	{1: 1, 2: 4, 20: 1, 33: 1, 17: 2}
OK	63905-13-5	CC(C)NCCCN(C)C	{1: 4, 2: 3, 3: 1, 33: 1, 31: 1}
OK	63905-29-3	C1CC(CC=C1)COC(=O)CCCCC(=O)OCC2CCC=CC2	{28: 2, 2: 6, 11: 6, 12: 2, 14: 4}
OK	63905-44-2	CC(C)CN(CCCl)CCCl.Cl	{1: 2, 2: 5, 3: 1, 33: 1, 17: 3}
OK	63905-80-6	C1C(C(=O)C=CC1=O)SCC(=O)O	{2: 1, 40: 1, 11: 1, 12: 1, 14: 2, 25: 2, 27: 1}
OK	63906-14-9	C1=CN(C=CC1=C[NH+]=O)CC(C(CN2C=CC(=C[NH+]=O)C=C2)O)O.[Br-].[Br-]	{33: 2, 2: 2, 3: 2, 6: 2, 14: 8, 15: 2, 18: 2, 20: 2, 29: 2, 31: 2}
OK	63906-36-5	C(COC(=O)CI)O	{28: 1, 2: 3, 19: 1, 20: 1}
OK	63907-04-0	CC1C2CCC(C2)C1(C)N(C)C	{1: 4, 11: 3, 12: 3, 13: 1, 33: 1}
OK	63907-07-3	CCC(CC)COCCOCCCN1C(=O)C2C3CC(C2C1=O)C=C3	{1: 2, 2: 8, 3: 1, 33: 1, 11: 1, 12: 4, 14: 2, 22: 2, 25: 2}
OK	63907-29-9	C1=NC2=NN=NC(=O)C2=N1	{25: 1, 35: 5, 14: 1, 15: 2}
OK	63907-41-5	N=O.[N+](=O)([N+](=O)[O-])[O-]	{36: 1, 29: 1, 38: 2}
OK	63915-89-9	CC(C)(C(=O)N)SCC=C	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 40: 1, 24: 1, 30: 1}
OK	63917-01-1	CCCCCCCCCCCC(=O)OCSC#N.CCCCCCCCCCCC(=O)OCSC#N.CCCCCCCCCCCC(=O)OCSC#N.CCCCOCCOCCSC#N	{1: 4, 2: 40, 37: 4, 40: 4, 22: 2, 28: 3}
OK	63917-25-9	CC(=C)COC(=O)COCC(=O)OCC(=C)C	{1: 2, 2: 4, 5: 2, 7: 2, 22: 1, 28: 2}
OK	63918-89-8	C(CSCCCl)OCCSCCCl	{40: 2, 17: 2, 2: 8, 22: 1}
OK	63918-91-2	CCCCCCOC(COCC(OCC)OCCCCCC)OCC	{1: 4, 2: 14, 3: 2, 22: 5}
OK	63934-40-7	CC(CCN(CC(C)O)N=O)O	{1: 2, 2: 3, 3: 2, 33: 1, 34: 1, 20: 2, 29: 1}
OK	63934-41-8	CC(CN(CCCCO)N=O)O	{1: 1, 2: 5, 3: 1, 33: 1, 34: 1, 20: 2, 29: 1}
OK	63937-27-9	CC1=C(C(=O)CC1O)CC=C.CN(C)C(=O)O	{1: 3, 2: 1, 5: 1, 6: 1, 33: 1, 11: 1, 12: 1, 15: 2, 20: 1, 25: 1, 27: 1}
OK	63937-32-6	CCCCOC1CC1C(=O)OCCCC	{1: 2, 2: 6, 11: 1, 12: 2, 22: 1, 28: 1}
OK	63951-45-1	CCC(C)C(=O)O[C@H]1CC[C@]2(C3[C@@]1(O[C@@]24CC5C6CN7C[C@H](CC[C@H]7[C@@](C6[C@H](C([C@]5(C4[C@@H](C3)O)O)OC(=O)C(C)(CC)O)O)(C)O)C)O)C	{1: 7, 2: 2, 3: 1, 4: 1, 33: 1, 11: 8, 12: 11, 13: 5, 20: 6, 23: 1, 28: 2}
OK	63951-48-4	CC(CC(C)(C=O)OC)C=O	{1: 3, 2: 1, 3: 1, 4: 1, 22: 1, 26: 2}
OK	63956-95-6	C1CC(OC1)CN(CCCl)CCCl	{33: 1, 2: 5, 11: 3, 12: 1, 17: 2, 23: 1}
OK	63960-06-5	CC1C=C(OC(=C1)C(C)(C)C)C(C)(C)C	{1: 7, 4: 2, 12: 1, 14: 2, 15: 2, 23: 1}
OK	63966-83-6	CCCCCCCCCCCCCCCCOC(=O)C(C)Br	{1: 2, 2: 15, 3: 1, 28: 1, 18: 1}
OK	63968-64-9	CC1CCC2C(C(=O)OC3C24C1CCC(O3)(OO4)C)C	{1: 3, 11: 4, 12: 5, 13: 2, 23: 3, 28: 1}
OK	63978-55-2	CCCCN(CCCC)CCCC.Cl	{1: 3, 2: 9, 33: 1, 17: 1}
OK	63978-58-5	CCN1CC(SC(C1)Cl)Cl	{1: 1, 2: 1, 33: 1, 41: 1, 11: 2, 12: 2, 17: 2}
OK	63979-65-7	CCCC(=O)O[C@H]1CC[C@@]2(C3CC[C@@]4([C@H](CC[C@@]4(C3CC[C@@]2(C1)O)O)C5=CC(=O)OC5)C)C=O	{1: 2, 2: 2, 11: 10, 12: 4, 13: 4, 14: 1, 15: 1, 20: 2, 26: 1, 28: 2}
OK	63979-84-0	C(CC(=O)C#N)C(=O)C#N	{24: 2, 2: 2, 37: 2}
OK	63980-20-1	CCNN=NCC	{1: 2, 2: 2, 34: 2, 31: 1}
OK	63980-44-9	C1CN(CCN1CCCl)CCCl.Cl	{17: 3, 2: 4, 11: 4, 33: 2}
OK	63980-59-6	CN(C)CCO.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{1: 2, 2: 2, 3: 4, 33: 1, 20: 5, 27: 4}
OK	63980-62-1	CC(C)CC(CC(C)C)OCCOCCO	{1: 4, 2: 6, 3: 3, 20: 1, 22: 2}
OK	63981-46-4	CCOC(=O)[C@@H]1[C@@H](C1(C)C)C=C(Cl)Cl	{1: 3, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 17: 2, 28: 1}
OK	63981-47-5	CCOC(=O)[C@@H]1[C@H](C1(C)C)C=C(Cl)Cl	{1: 3, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 17: 2, 28: 1}
OK	63982-15-0	CN(C(=O)OCCF)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 16: 1, 28: 1, 29: 1}
OK	63986-03-8	CCCCSSCC	{40: 2, 1: 2, 2: 4}
OK	63990-01-2	COCCN1C(=O)CC(=O)N(C1=O)CCOC	{1: 2, 2: 4, 33: 2, 11: 1, 22: 2, 25: 3}
OK	64-17-5	CCO	{1: 1, 2: 1, 20: 1}
OK	64-19-7	CC(=O)O	{1: 1, 27: 1}
OK	64-55-1	CCC(C)C(C)(COC(=O)N)COC(=O)N	{1: 3, 2: 3, 3: 1, 4: 1, 28: 2, 30: 2}
OK	64-65-3	CCC1(CC(=O)NC(=O)C1)C	{32: 1, 1: 2, 2: 1, 11: 2, 13: 1, 25: 2}
OK	64-69-7	C(C(=O)O)I	{27: 1, 2: 1, 19: 1}
OK	64-85-7	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)CO)CCC4=CC(=O)CC[C@]34C	{1: 2, 2: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 24: 1, 25: 1}
OK	640-19-7	C(C(=O)N)F	{16: 1, 24: 1, 2: 1, 30: 1}
OK	640-21-1	CC(C)(C)C(CBr)Br	{1: 3, 2: 1, 3: 1, 4: 1, 18: 2}
OK	640-68-6	CC(C)[C@H](C(=O)O)N	{27: 1, 1: 2, 3: 2, 30: 1}
OK	64001-06-5	C1CC(OC1)OCCCCO	{2: 4, 11: 3, 12: 1, 20: 1, 22: 1, 23: 1}
OK	64005-61-4	CCCCN(COC)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 22: 1, 29: 1}
OK	64005-62-5	CCCCCN(C(=O)OCC)N=O	{1: 2, 2: 5, 33: 1, 34: 1, 28: 1, 29: 1}
OK	64005-63-6	CCC(C)N(COC)N=O	{1: 3, 2: 2, 3: 1, 33: 1, 34: 1, 22: 1, 29: 1}
OK	64011-43-4	CC(=O)CC#CO	{24: 1, 1: 1, 2: 1, 20: 1, 10: 2}
OK	64011-44-5	CC(CC(C)(N)OC)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 1, 22: 1, 30: 1}
OK	64011-46-7	C1C(O1)/C=C/C=O	{26: 1, 11: 1, 12: 1, 6: 2, 23: 1}
OK	64012-04-0	CCCCCCCCCC(=O)O.CC(CN)O	{1: 2, 2: 9, 3: 1, 20: 1, 27: 1, 30: 1}
OK	6402-36-4	C(CCCCC(=O)O)CCC/C=C/C(=O)O	{2: 8, 27: 2, 6: 2}
OK	64020-56-0	CC(C)(CCC(C)(C)C#C)C#C	{1: 4, 2: 2, 4: 2, 10: 2, 9: 2}
OK	64022-57-7	CC1(CC(CC(N1)(C)C)OC(=O)CN(CC(=O)OC2CC(NC(C2)(C)C)(C)C)CC(=O)OC3CC(NC(C3)(C)C)(C)C)C	{32: 3, 1: 12, 2: 3, 33: 1, 11: 6, 12: 3, 13: 6, 28: 3}
OK	64022-61-3	CC1(CC(CC(N1)(C)C)OC(=O)CC(C(CC(=O)OC2CC(NC(C2)(C)C)(C)C)C(=O)OC3CC(NC(C3)(C)C)(C)C)C(=O)OC4CC(NC(C4)(C)C)(C)C)C	{32: 4, 1: 16, 2: 2, 3: 2, 11: 8, 12: 4, 13: 8, 28: 4}
OK	64028-90-6	C(CBr)[C@@H](CBr)O	{2: 3, 3: 1, 20: 1, 18: 2}
OK	64028-99-5	CCOC(=O)N(C)SN(C)C(=O)ON=C(C)SC	{1: 5, 2: 1, 33: 2, 40: 2, 7: 1, 34: 1, 28: 2}
OK	64036-86-8	C\1CC2C(=C3C=CC(=O)C=C3O2)CCC(=O)NCC4CC(C=C4)NCC(=O)CNC/C=C1.Cl	{32: 3, 11: 9, 12: 3, 14: 7, 15: 3, 17: 1, 23: 1, 25: 3}
OK	64037-53-2	CC(/C=C/Cl)Br	{1: 1, 18: 1, 3: 1, 6: 2, 17: 1}
OK	64037-56-5	CC(CC=C(C)C)C(C)OC(=O)C	{1: 5, 2: 1, 3: 2, 6: 1, 7: 1, 28: 1}
OK	64037-65-6	CCC(CC)(C(=O)N)SCC=C	{1: 2, 2: 3, 4: 1, 5: 1, 6: 1, 40: 1, 24: 1, 30: 1}
OK	64038-56-8	CN(C)N/N=C/1\C(=NC=N1)C(=O)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 2, 2: 2, 35: 2, 4: 1, 33: 1, 34: 1, 14: 1, 15: 2, 20: 1, 24: 1, 27: 3, 30: 1, 31: 1}
OK	6404-28-0	CCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 4, 2: 3, 3: 1, 4: 1, 27: 1, 28: 1, 31: 1}
OK	64042-18-8	CCCCCCCCCCCCCC(=O)CC(=O)C	{24: 2, 1: 2, 2: 13}
OK	64046-46-4	CC(C)(OC)OC(=O)CCl	{1: 3, 2: 1, 4: 1, 17: 1, 22: 1, 28: 1}
OK	64046-61-3	CC(=O)OC/C=C/OCC=C	{1: 1, 2: 2, 5: 1, 6: 3, 22: 1, 28: 1}
OK	64046-67-9	CC(C)(OC)OC(=O)CBr	{1: 3, 2: 1, 4: 1, 18: 1, 22: 1, 28: 1}
OK	64047-30-9	CC1CCCOC(=O)C1(C)C	{1: 3, 11: 3, 12: 1, 13: 1, 28: 1}
OK	64051-42-9	CCCCCCCCCCCCCCCCCCCCCCC1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)CCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 50, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64051-44-1	CCCCCCCCCCCCCCCC=CCCCCCCCC1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)CCCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 46, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64051-52-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=CC1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)C=CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 76, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64057-51-8	CC(=O)N(CCCl)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 17: 1, 24: 1, 29: 1}
OK	64058-47-5	CC(C)CC(=O)OC[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)OC(=O)CC(C)C)OC(=O)CC(C)C)OC(=O)CC(C)C)OC(=O)CC(C)C	{1: 10, 2: 6, 3: 5, 12: 5, 23: 1, 28: 5}
OK	64059-72-9	CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCCCCCCCC(C)C	{1: 3, 2: 19, 3: 1, 28: 1, 6: 4}
OK	6406-32-2	CCCCCCCC1=NCCN1CCOCCC(=O)O	{1: 1, 2: 10, 35: 1, 33: 1, 11: 2, 15: 1, 22: 1, 27: 1}
OK	6407-34-7	CC(=NC)C	{1: 3, 34: 1, 7: 1}
OK	6407-36-9	CC(=NC1CCCCC1)C	{1: 2, 34: 1, 11: 5, 12: 1, 7: 1}
OK	64096-73-7	C=C1C2C=CC3C2C1C=C3	{12: 4, 5: 1, 14: 4, 15: 1}
OK	64096-77-1	CC(=C1C2C=CC3C2C1C=C3)C	{1: 2, 15: 1, 12: 4, 14: 4, 7: 1}
OK	641-06-5	CC(=O)N(C(=O)C)C(=O)C	{24: 3, 1: 3, 33: 1}
OK	641-81-6	C[C@H](CCC(=O)O)[C@H]1CCC2=C3CC[C@@H]4C[C@@H](CC[C@@]4([C@H]3C[C@@H]([C@]12C)O)C)O	{1: 3, 2: 2, 3: 1, 11: 8, 12: 5, 13: 2, 15: 2, 20: 2, 27: 1}
OK	641-85-0	CCC1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C	{1: 3, 2: 1, 11: 10, 12: 5, 13: 2}
OK	64114-59-6	C(CCC(=O)OCCOCCOCCO)CC(=O)O	{28: 1, 2: 10, 27: 1, 20: 1, 22: 2}
OK	64120-16-7	CCCCCCCCCCCCCCOC(=O)CCCl	{1: 1, 2: 15, 28: 1, 17: 1}
OK	64129-91-5	CCCCC=CCCCCCCC(CC(=O)O)C(=O)OC	{1: 2, 2: 10, 3: 1, 6: 2, 27: 1, 28: 1}
OK	6413-10-1	CCOC(=O)CC1(OCCO1)C	{1: 2, 2: 2, 11: 2, 13: 1, 23: 2, 28: 1}
OK	64131-22-2	CCCCCCCCCCCCCCCC(=O)OCC(CC)(CO)CO	{1: 2, 2: 18, 4: 1, 20: 2, 28: 1}
OK	64131-24-4	CCCCCC=CCC=CCCCCCCCC(=O)OCC(CC)(CO)CO	{1: 2, 2: 16, 4: 1, 6: 4, 20: 2, 28: 1}
OK	6414-69-3	CCOC(=O)CCI	{1: 1, 2: 3, 19: 1, 28: 1}
OK	6414-96-6	CCCCC(C)(C)CCCC	{1: 4, 2: 6, 4: 1}
OK	6415-12-9	CN(C)N(C)C	{1: 4, 33: 2}
OK	64168-11-2	CN1CCC(CC1)CCCC2CCN(CC2)C	{1: 2, 2: 3, 11: 8, 12: 2, 33: 2}
OK	6418-41-3	CCCCCCCCCCC(C)CC	{1: 3, 2: 10, 3: 1}
OK	6418-43-5	CCCCCCCCCCCCCC(C)CC	{1: 3, 2: 13, 3: 1}
OK	6418-44-6	CCCCCCCCCCCCCCC(C)CC	{1: 3, 2: 14, 3: 1}
OK	6418-45-7	CCCCCCCCCCCCCCCCC(C)CC	{1: 3, 2: 16, 3: 1}
OK	6418-46-8	CCCCCCCCCCCCCCCCCC(C)CC	{1: 3, 2: 17, 3: 1}
OK	6418-47-9	CCCCCCCCCCCCCCCCCCC(C)CC	{1: 3, 2: 18, 3: 1}
OK	64183-49-9	CCCCCCCCCCC#CCCCCCC	{1: 2, 2: 14, 10: 2}
OK	64190-48-3	C[C@H]1CC(=O)OC1	{1: 1, 11: 2, 12: 1, 28: 1}
OK	642-38-6	COC1[C@@H]([C@H](C([C@@H]([C@H]1O)O)O)O)O	{1: 1, 12: 6, 22: 1, 20: 5}
OK	6422-99-7	C(CCCCC(=O)O)CCCC(=O)O.C(CCCN)CCN	{2: 14, 27: 2, 30: 2}
OK	6423-02-5	CCCC(C(C)Br)Br	{1: 2, 2: 2, 3: 2, 18: 2}
OK	64245-25-6	CC(C)C=CI	{19: 1, 1: 2, 3: 1, 6: 2}
OK	64249-76-9	CC(=CC(=O)C(C(F)F)(F)F)S	{1: 1, 3: 1, 4: 1, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	64249-77-0	CCCCC(=CC(=O)C(C(F)F)(F)F)S	{1: 1, 2: 3, 3: 1, 4: 1, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	64249-78-1	CC(C)(C)C(=CC(=O)C(C(F)F)(F)F)S	{1: 3, 3: 1, 4: 2, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	6425-32-7	C1COCCN1CC(CO)O	{33: 1, 2: 2, 3: 1, 11: 4, 20: 2, 23: 1}
OK	6425-41-8	C1CCC(CC1)N2CCOCC2	{33: 1, 11: 9, 12: 1, 23: 1}
OK	64253-30-1	CCCCCCCCCCCCSCCC(=O)OCCOCCOCCOCCOC(=O)CCSCCCCCCCCCCCC	{40: 2, 1: 2, 2: 34, 28: 2, 22: 3}
OK	64265-45-8	CCCCCCCC(=O)NCCN(CCC(=O)O)CCO	{1: 1, 2: 12, 33: 1, 20: 1, 24: 1, 27: 1, 31: 1}
OK	6427-21-0	COCN=C=O	{1: 1, 2: 1, 8: 1, 34: 1, 22: 1, 29: 1}
OK	64275-73-6	CCC=CCCCCO	{1: 1, 2: 5, 20: 1, 6: 2}
OK	64285-06-9	CC(=O)C1=CCCC2CCC1N2	{32: 1, 1: 1, 11: 4, 12: 2, 14: 1, 15: 1, 24: 1}
OK	643-01-6	C([C@@H]([C@@H]([C@H]([C@H](CO)O)O)O)O)O	{2: 2, 3: 4, 20: 6}
OK	643-20-9	C1CC2CCCN2C1	{33: 1, 11: 6, 12: 1}
OK	643-22-1	CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O	{1: 13, 2: 1, 33: 1, 11: 3, 12: 15, 13: 3, 20: 5, 22: 3, 23: 2, 25: 1, 28: 1}
OK	64318-79-2	CCCCC(C)(C)[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCC/C=C/C(=O)OC)O)O	{1: 4, 2: 7, 3: 1, 4: 1, 6: 4, 11: 1, 12: 3, 20: 2, 25: 1, 28: 1}
OK	6434-77-1	CCCCCC/C=C\C	{1: 2, 2: 5, 6: 2}
OK	6434-78-2	CCCCCCC=CC	{1: 2, 2: 5, 6: 2}
OK	64341-49-7	C=CC(CBr)O	{2: 1, 3: 1, 5: 1, 6: 1, 18: 1, 20: 1}
OK	64346-25-4	CC1(CC(CC(N1)(C)C)OCCO)C	{32: 1, 1: 4, 2: 2, 11: 2, 12: 1, 13: 2, 20: 1, 22: 1}
OK	64346-47-0	CC(=CC(=O)OC)NC(=O)NC(C)(C)C	{1: 5, 4: 1, 6: 1, 7: 1, 24: 1, 28: 1, 31: 2}
OK	64346-55-0	C1CCC(C(C1)N/C=C/2\C=CC=CC2=O)N/C=C\3/C=CC=CC3=O	{6: 2, 11: 4, 12: 2, 14: 8, 15: 2, 25: 2, 31: 2}
OK	64346-93-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=CC1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)C=CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 80, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64346-95-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/C=C/C1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)/C=C/CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 82, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64346-99-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/C=C/C1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)/C=C/CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 80, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64347-01-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/C=C/C1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)/C=C/CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 82, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64347-03-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=CC1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)C=CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 84, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64347-09-7	CCCCCCCCCCCCCCCCCCCCCCC=CC1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)C=CCCCCCCCCCCCCCCCC	{1: 2, 2: 44, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64347-11-1	CCCCCCCCCCCCCCCCCCCC[C@H]1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)C[C@H](C2=O)CCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 46, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64347-13-3	CCCCCCCCCCCCCC=CCCCCCCCC1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)CCCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 44, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64347-21-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/C=C/C1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)/C=C/CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 78, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64354-92-3	CC(C)CCCCCCCOCCC#N	{1: 2, 2: 9, 3: 1, 37: 1, 22: 1}
OK	64365-62-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=CC1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)C=CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 84, 6: 4, 33: 2, 11: 2, 12: 2, 25: 4, 31: 3}
OK	64371-17-1	C1CCCC2(C=C2)C3(CC1)C=C3	{11: 6, 13: 2, 14: 4}
OK	64379-30-2	CC(C)CC(C)(C)N	{1: 4, 2: 1, 3: 1, 4: 1, 30: 1}
OK	64382-00-9	C(CCCBr)CCC(C(F)(F)Br)(F)F	{16: 4, 2: 6, 4: 2, 18: 2}
OK	64387-77-5	CC1CCN(CC1)C(=O)C2CCCCC2C	{24: 1, 1: 2, 11: 8, 12: 3, 33: 1}
OK	64387-78-6	CC1CCCN(C1)C(=O)C2CCCCC2C	{24: 1, 1: 2, 11: 8, 12: 3, 33: 1}
OK	64394-19-0	CC1(CC(C2C3CCCCC3C2(C1)C)O)C	{1: 3, 11: 6, 12: 4, 13: 2, 20: 1}
OK	64395-92-2	CCCCCCCCCCCC(=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O	{1: 1, 2: 11, 12: 5, 20: 4, 23: 1, 28: 1}
OK	64396-12-9	CCCCCCCCCC/C=C/C(CC(=O)O)C(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 16, 3: 1, 6: 2, 33: 1, 20: 3, 27: 2}
OK	644-49-5	CCCOC(=O)C(C)C	{1: 3, 2: 2, 3: 1, 28: 1}
OK	644-80-4	C(=C(/C(=O)O)\Br)\C(=O)O	{18: 1, 27: 2, 6: 1, 7: 1}
OK	644-90-6	CCCCCCC(C(=O)O)N	{27: 1, 1: 1, 2: 5, 3: 1, 30: 1}
OK	64408-93-1	CCCCOCC(COCCCC)OC(=O)C	{1: 3, 2: 8, 3: 1, 28: 1, 22: 2}
OK	6443-91-0	COC#C	{1: 1, 10: 1, 22: 1, 9: 1}
OK	6443-92-1	CCCCC=CC	{1: 2, 2: 3, 6: 2}
OK	64491-68-5	COC[C@@H]1CO1	{1: 1, 2: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	64491-70-9	COC[C@H]1CO1	{1: 1, 2: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	645-36-3	CCOC(CN)OCC	{1: 2, 2: 3, 3: 1, 30: 1, 22: 2}
OK	645-41-0	CC(C)CCN(CCC(C)C)CCC(C)C	{1: 6, 2: 6, 3: 3, 33: 1}
OK	645-62-5	CCCC=C(CC)C=O	{1: 2, 2: 3, 26: 1, 6: 1, 7: 1}
OK	645-67-0	CCCOC(=O)CCC(=O)C	{24: 1, 1: 2, 2: 4, 28: 1}
OK	645-69-2	CCCCCOC(=O)CCC(=O)OCCCCC	{1: 2, 2: 10, 28: 2}
OK	645-88-5	C(C(=O)O)ON	{2: 1, 27: 1, 30: 1, 22: 1}
OK	64501-77-5	CCCC=CCC(C)C	{1: 3, 2: 3, 3: 1, 6: 2}
OK	64502-86-9	CC(C)C(C)C(C)O	{1: 4, 3: 3, 20: 1}
OK	64502-89-2	CCCC(=O)CO	{24: 1, 1: 1, 2: 3, 20: 1}
OK	64505-10-8	CCOC(=O)C(CC(C)C)N=C=O	{1: 3, 2: 2, 3: 2, 8: 1, 34: 1, 28: 1, 29: 1}
OK	64512-96-5	CC(C)(C)C(C(C)(C)O)O	{1: 5, 3: 1, 4: 2, 20: 2}
OK	64520-58-7	CCOC(=O)/C=C/[C@H]1COC(O1)(C)C	{1: 3, 2: 1, 6: 2, 11: 1, 12: 1, 13: 1, 23: 2, 28: 1}
OK	64531-26-6	CCCCCCC#CCl	{1: 1, 2: 5, 10: 2, 17: 1}
OK	64531-49-3	C[C@@H](C#N)OC	{1: 2, 3: 1, 37: 1, 22: 1}
OK	6454-22-4	CCCCCCC1OC(C(O1)C)C	{1: 3, 2: 5, 12: 3, 23: 2}
OK	64552-25-6	CC1C[C@@H]2[C@H](C([C@]3(O2)CCC4C5CC=C6CC(CCC6(C5C(=O)C4=C3C)C)O)C)N(C1)C	{1: 5, 33: 1, 11: 8, 12: 8, 13: 2, 14: 1, 15: 3, 20: 1, 23: 1, 25: 1}
OK	646-01-5	CSCCC(=O)O	{40: 1, 1: 1, 2: 2, 27: 1}
OK	646-04-8	CC/C=C/C	{1: 2, 2: 1, 6: 2}
OK	646-05-9	CC#CC=C	{1: 1, 10: 2, 5: 1, 6: 1}
OK	646-06-0	C1COCO1	{11: 3, 23: 2}
OK	646-07-1	CC(C)CCC(=O)O	{27: 1, 1: 2, 2: 2, 3: 1}
OK	646-13-9	CCCCCCCCCCCCCCCCCC(=O)OCC(C)C	{1: 3, 2: 17, 3: 1, 28: 1}
OK	646-14-0	CCCCCC[N+](=O)[O-]	{1: 1, 2: 5, 38: 1}
OK	646-19-5	C(CCCN)CCCN	{2: 7, 30: 2}
OK	646-20-8	C(CCC#N)CCC#N	{2: 5, 37: 2}
OK	646-24-2	C(CCCCN)CCCCN	{2: 9, 30: 2}
OK	646-25-3	C(CCCCCN)CCCCN	{2: 10, 30: 2}
OK	646-30-0	CCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 17, 27: 1}
OK	646-31-1	CCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 22}
OK	646-55-9	CC(C)(C)N(F)F	{16: 2, 1: 3, 4: 1, 33: 1}
OK	646-97-9	C=CCC(C(F)(F)F)(C(F)(F)F)O	{2: 1, 4: 3, 5: 1, 6: 1, 16: 6, 20: 1}
OK	64601-13-4	CCCCCCCC(=O)O.CC(C)NCCO	{1: 3, 2: 8, 3: 1, 20: 1, 27: 1, 31: 1}
OK	64601-15-6	CCCCCCCCCC(=O)O.CC(C)NCCO	{1: 3, 2: 10, 3: 1, 20: 1, 27: 1, 31: 1}
OK	64601-40-7	C1CCCC2(CC2)C3(CC1)CC3	{11: 10, 13: 2}
OK	64604-09-7	CCCCC/C=C/C=C/C=C/C=C/C(=O)O[C@@H]1[C@H]([C@]2([C@@H](C=C(C[C@]3([C@H]2C=C(C3=O)C)O)CO)[C@H]4[C@@]1(C4(C)C)OC(=O)C)O)C	{1: 6, 2: 5, 6: 8, 11: 1, 12: 5, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 2}
OK	64604-68-8	CCCC#CCCCCCCCOC1CCCCO1	{1: 1, 2: 9, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	64604-69-9	CCCC=CCCCCCCCOC1CCCCO1	{1: 1, 2: 9, 6: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	64611-40-1	CC=NC	{1: 2, 34: 1, 6: 1}
OK	64611-78-5	CC1CO1.CC(CO)O.C=CCOCC1CO1.C=CC#N.C1CO1	{1: 2, 2: 3, 3: 1, 5: 2, 6: 2, 11: 4, 12: 2, 20: 2, 22: 1, 23: 3, 37: 1}
OK	64611-79-6	CC1CO1.C=CCOCC1CO1.C=CC#N.C1CO1.C(C(CO)O)O	{1: 1, 2: 4, 3: 1, 5: 2, 6: 2, 11: 4, 12: 2, 20: 3, 22: 1, 23: 3, 37: 1}
OK	64611-83-2	CC(C)OCN1C(C(N(C1=O)COC(C)C)O)O	{1: 4, 2: 2, 3: 2, 33: 2, 12: 2, 20: 2, 22: 2, 25: 1}
OK	64611-88-7	CC(C)CCCC(=CCCC(C)(C=C)O)C	{1: 4, 2: 5, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	64630-96-2	C=C1C2C3C4C3C1C5C4C52	{12: 8, 5: 1, 15: 1}
OK	64652-56-8	CCCCOC(=O)C=C.CC=C.CC(=C)C(=O)OC	{1: 4, 2: 3, 5: 3, 6: 2, 7: 1, 28: 2}
OK	64654-00-8	CCCCCCCCCCC=CCCCCCCCCC(CC(=O)OCCN(CCO)CCO)C(=O)OCCN(CCO)CCO	{1: 1, 2: 30, 3: 1, 6: 2, 33: 2, 20: 4, 28: 2}
OK	64654-02-0	CCCCCCCCCCCCC=CCCCCCCCCC(CC(=O)OCCN(CCO)CCO)C(=O)OCCN(CCO)CCO	{1: 1, 2: 32, 3: 1, 6: 2, 33: 2, 20: 4, 28: 2}
OK	64654-04-2	CCCCCCCCCCCCCCC=CCCCCCCCCC(CC(=O)OCCN(CCO)CCO)C(=O)OCCN(CCO)CCO	{1: 1, 2: 34, 3: 1, 6: 2, 33: 2, 20: 4, 28: 2}
OK	64667-33-0	CC(C)(CC(=O)OC)C(CC(Cl)(Cl)Cl)Cl	{1: 3, 2: 2, 3: 1, 4: 2, 17: 4, 28: 1}
OK	64683-27-8	CCCCCCCCC=CCCCCCCCCC(CC(=O)OCCN(CCO)CCO)C(=O)OCCN(CCO)CCO	{1: 1, 2: 28, 3: 1, 6: 2, 33: 2, 20: 4, 28: 2}
OK	64683-28-9	CCCCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 31}
OK	647-42-7	C(CO)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 13, 20: 1, 2: 2, 4: 6}
OK	64704-32-1	CCCCCCCCC(=O)OCC(COCC(COC(=O)CCCCCCCC)(COC(=O)CCCCCCCC)COC(=O)CCCCCCCC)(COC(=O)CCCCCCCC)COC(=O)CCCCCCCC	{1: 6, 2: 50, 4: 2, 22: 1, 28: 6}
OK	64712-27-2	C(C(F)(F)F)C(F)(Cl)Cl	{16: 4, 17: 2, 2: 1, 4: 2}
OK	64715-97-5	CCCCCCCCCCCCCCCC(=O)O.C(CO)NCCO	{1: 1, 2: 18, 27: 1, 20: 2, 31: 1}
OK	64725-58-2	C1CC2CC=CCC1C2O	{20: 1, 11: 4, 12: 3, 14: 2}
OK	64725-60-6	C1CC2C=CC=CC1C2O	{20: 1, 11: 2, 12: 3, 14: 4}
OK	64725-62-8	COC1C2CCC1C=CC=C2	{1: 1, 11: 2, 12: 3, 22: 1, 14: 4}
OK	64726-91-6	CCCCCCCC/C=C\[C@H]1CCC(=O)O1	{1: 1, 2: 7, 6: 2, 11: 2, 12: 1, 28: 1}
OK	64754-06-9	CC1(CC(C23C1CCC(C2)(CCC3)C)O)C	{1: 3, 11: 7, 12: 2, 13: 3, 20: 1}
OK	64776-29-0	CCN1C2CCCC1CCC2	{1: 1, 2: 1, 11: 6, 12: 2, 33: 1}
OK	64776-33-6	CC(C)N1C2CCCC1CCC2	{11: 6, 1: 2, 3: 1, 12: 2, 33: 1}
OK	64776-36-9	CC(C)(C)N1C2CCCC1CCC2	{1: 3, 11: 6, 4: 1, 12: 2, 33: 1}
OK	64781-13-1	CCCCCCC(C(=O)Cl)Cl	{24: 1, 1: 1, 2: 5, 3: 1, 17: 2}
OK	64788-23-4	C(#CF)C#CF	{16: 2, 10: 4}
OK	64788-24-5	C(#CC(F)(F)F)C#CF	{16: 4, 10: 4, 4: 1}
OK	6480-47-3	CN1CCCCCCCCC1	{1: 1, 11: 9, 33: 1}
OK	64805-64-7	CC(CSC(=O)C)C(=O)Cl	{1: 2, 2: 1, 3: 1, 40: 1, 17: 1, 24: 2}
OK	64808-91-9	CCCCCCCCCCCCCCCCCCCCCCC/C=C/C	{1: 2, 2: 22, 6: 2}
OK	6481-95-4	CCC(C)(C)CCCO	{1: 3, 2: 4, 4: 1, 20: 1}
OK	64819-51-8	CC(C)CCC(C)(N=NC(C)(C)C)O	{1: 6, 2: 2, 3: 1, 4: 2, 34: 2, 20: 1}
OK	6482-24-2	COCCBr	{1: 1, 2: 2, 18: 1, 22: 1}
OK	6482-26-4	COC(=O)C(Br)Br	{1: 1, 18: 2, 3: 1, 28: 1}
OK	6483-50-7	CCN1CCN(CC1)CC	{1: 2, 2: 2, 11: 4, 33: 2}
OK	6485-40-1	CC1=CC[C@H](CC1=O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	64852-22-8	CC(CO)N.CC(CO)O.C(C(CO)O)O	{1: 2, 2: 4, 3: 3, 20: 6, 30: 1}
OK	64885-69-4	N1=S=NS[N]S1	{41: 3, 35: 3}
OK	64891-12-9	CCCCCCC(=O)NCCCCC	{24: 1, 1: 2, 2: 9, 31: 1}
OK	64897-90-1	CC(=O)OCCN(CCO)CCOC(=O)C	{1: 2, 2: 6, 20: 1, 28: 2, 33: 1}
OK	64919-15-9	CCCCCCCCCCCC(=O)OCCCl	{1: 1, 2: 12, 28: 1, 17: 1}
OK	64919-20-6	CCCCCCCCCCCCCCCSCC	{40: 1, 1: 2, 2: 15}
OK	64929-56-2	CC1COC(C=C1C)C=C(C)C	{1: 4, 6: 1, 7: 1, 11: 1, 12: 2, 14: 1, 15: 1, 23: 1}
OK	6493-77-2	COC(=O)C1CCC=CC1	{1: 1, 11: 3, 12: 1, 14: 2, 28: 1}
OK	64934-83-4	CC1=[N+](C(NC1(C)C)(C)C)[O-]	{32: 1, 1: 5, 33: 1, 13: 2, 15: 1, 29: 1}
OK	64940-50-7	C1CC23CCC(=O)C2(C1=O)C(=O)CC3	{25: 3, 11: 6, 13: 2}
OK	6498-34-6	C1CCC(CC1)NN	{11: 5, 12: 1, 30: 1, 31: 1}
OK	65-82-7	CC(=O)N[C@@H](CCSC)C(=O)O	{1: 2, 2: 2, 3: 1, 40: 1, 24: 1, 27: 1, 31: 1}
OK	650-42-0	C12C3C1C4C2C34	{12: 6}
OK	650-69-1	CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=O)/C)/C	{1: 7, 6: 12, 7: 4, 11: 2, 12: 1, 13: 1, 15: 2, 20: 1, 26: 1}
OK	65000-33-1	CCCCOCCCN1CCCCC1C	{1: 2, 2: 6, 33: 1, 11: 4, 12: 1, 22: 1}
OK	65002-17-7	CC(C)(C(=O)N[C@@H](CS)C(=O)O)S	{1: 2, 2: 1, 3: 1, 4: 1, 39: 2, 24: 1, 27: 1, 31: 1}
OK	65031-96-1	CCCC(=O)OC[C@@H]1CO1	{1: 1, 2: 3, 11: 1, 12: 1, 23: 1, 28: 1}
OK	65041-92-1	CC1=C[C@@H]2[C@](C[C@@H]1OC(=O)C)([C@]3([C@@H]([C@H]([C@H](C34CO4)O2)O)OC(=O)C)C)COC(=O)C	{1: 5, 2: 1, 11: 2, 12: 5, 13: 3, 14: 1, 15: 1, 20: 1, 23: 2, 28: 3}
OK	65045-74-1	CC(=O)OC=C.C=CC(=O)NCO.C=CCl	{1: 1, 2: 1, 5: 3, 6: 3, 17: 1, 20: 1, 24: 1, 28: 1, 31: 1}
OK	65045-75-2	COC(=O)C=C.C=CC(=O)NCO.C=CC(=O)O.C=CCl	{1: 1, 2: 1, 5: 4, 6: 4, 17: 1, 20: 1, 24: 1, 27: 1, 28: 1, 31: 1}
OK	65050-07-9	CC(C)(C)[C@H]1C(=O)NCC(=O)N1	{32: 2, 1: 3, 4: 1, 11: 1, 12: 1, 25: 2}
OK	65064-78-0	C(C(C(F)F)(F)F)OC(C(F)(F)F)C(F)(F)F	{16: 10, 2: 1, 3: 2, 4: 3, 22: 1}
OK	65064-81-5	C(C(C(C(C(F)F)(F)F)(F)F)(F)F)OC(C(F)(F)F)C(F)(F)F	{16: 14, 2: 1, 3: 2, 4: 5, 22: 1}
OK	65064-83-7	C(C(C(F)F)(F)F)OC(C(F)Cl)(F)F	{2: 1, 3: 2, 4: 2, 16: 7, 17: 1, 22: 1}
OK	65064-84-8	C(C(C(C(C(F)F)(F)F)(F)F)(F)F)OC(C(F)Cl)(F)F	{2: 1, 3: 2, 4: 4, 16: 11, 17: 1, 22: 1}
OK	65064-85-9	C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OC(C(F)Cl)(F)F	{2: 1, 3: 2, 4: 6, 16: 15, 17: 1, 22: 1}
OK	65072-38-0	CCOC(=O)/C=C\C(=O)OCC.CC(=O)OC=C.C=CCl	{1: 3, 2: 2, 5: 2, 6: 4, 17: 1, 28: 3}
OK	65086-63-7	CCCCCCCCCCCCCOC(=O)C(=C)C.CCN(CC)CCOC(=O)C(=C)C	{1: 5, 2: 16, 5: 2, 33: 1, 7: 2, 28: 2}
OK	65086-67-1	CC(=C)C(=O)OC.CC(=C)C(=O)OCCC1CCCC2(C1)NCCO2	{32: 1, 1: 3, 2: 2, 5: 2, 7: 2, 11: 6, 12: 1, 13: 1, 23: 1, 28: 2}
OK	65086-70-6	CCCCCCC=CCCC=CCCCCCCN(CC(C)O)CC(C)O	{1: 3, 2: 15, 3: 2, 6: 4, 33: 1, 20: 2}
OK	65086-71-7	CCCCCCCCCCC=CCCCCCCN(CC(C)O)CC(C)O	{1: 3, 2: 17, 3: 2, 6: 2, 33: 1, 20: 2}
OK	65087-12-9	C1CC(C(C1)N/C=C/2\C=CC=CC2=O)CN/C=C/3\C=CC=CC3=O	{2: 1, 6: 2, 11: 3, 12: 2, 14: 8, 15: 2, 25: 2, 31: 2}
OK	65087-13-0	CC(CCCN/C=C/1\C=CC=CC1=O)CN/C=C/2\C=CC=CC2=O	{1: 1, 2: 4, 3: 1, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
OK	65087-21-0	CCOC(C(OCC)(Cl)Cl)(Cl)Cl	{1: 2, 2: 2, 4: 2, 22: 2, 17: 4}
OK	65104-54-3	CCCCCCCCCCCCCCNCCC(=O)O.C(CO)NCCO	{1: 1, 2: 19, 27: 1, 20: 2, 31: 2}
OK	65104-63-4	C(CI)C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 37, 2: 2, 19: 1, 4: 18}
OK	65104-64-5	C=CC(=O)OCCC(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 18, 5: 1, 6: 1, 16: 37, 28: 1}
OK	65113-95-3	CC1=CCC(C1(C)C)CC=C(C)C(=O)C	{1: 5, 2: 1, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	65113-96-4	CCC(=O)C=CCC1CC=C(C1(C)C)C	{1: 4, 2: 2, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	65114-83-2	COC(=O)CCCCCCC=CC=O	{1: 1, 2: 6, 28: 1, 26: 1, 6: 2}
OK	65115-71-1	CC1(CC(=CC(=O)C1)C#N)C	{1: 2, 37: 1, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	65115-73-3	CCN(CC)C1=CC(=O)CC(C1)(C)C	{1: 4, 2: 2, 33: 1, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	65121-95-1	CC(=O)OCCNCCOC(=O)C	{1: 2, 2: 4, 28: 2, 31: 1}
OK	65122-15-8	CCNC(=O)NC(=O)C(=NOC)C#N.C(=CC(=O)O)C(=O)O	{1: 2, 2: 1, 37: 1, 6: 2, 7: 1, 34: 1, 22: 1, 24: 2, 27: 2, 31: 2}
OK	65122-18-1	CCC1(CCC(CC1)CN)CN	{1: 1, 2: 3, 11: 4, 12: 1, 13: 1, 30: 2}
OK	65122-23-8	CCCCCCCCC=CCCCCCCCC(=O)O.CN(C)C1CCCCC1	{1: 3, 2: 14, 6: 2, 33: 1, 11: 5, 12: 1, 27: 1}
OK	65128-96-3	CCCCCCC=CCCCCCC=O	{1: 1, 2: 10, 26: 1, 6: 2}
OK	6513-03-7	CCCCCCCCC(=O)OCCC	{1: 2, 2: 9, 28: 1}
OK	65149-84-0	CC(C)(C)C(C)(C)C(C)(C)C(C)(C)C	{1: 10, 4: 4}
OK	65150-83-6	CCOC(=O)NCC(=NC)NC	{1: 3, 2: 2, 7: 1, 34: 1, 28: 1, 31: 2}
OK	65150-85-8	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N(CCO)CCO)CO	{1: 2, 2: 30, 6: 8, 33: 1, 20: 3, 27: 2}
OK	65150-86-9	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CN(C1CCCCC1)C	{1: 4, 2: 24, 6: 8, 33: 1, 11: 5, 12: 1, 27: 2}
OK	65150-88-1	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)(F)F)F)F	{16: 60, 24: 1, 4: 29, 22: 9}
OK	65150-93-8	C=CC(=O)OCCC(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 4: 16, 5: 1, 6: 1, 16: 33, 28: 1}
OK	65150-94-9	C(CI)C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 33, 2: 2, 19: 1, 4: 16}
OK	65166-20-3	CCCCCCCCCC/C=C/C(CC(=O)O)C(=O)O.CN(C)C1CCCCC1.CN(C)C1CCCCC1	{1: 5, 2: 10, 3: 1, 6: 2, 33: 2, 11: 10, 12: 2, 27: 2}
OK	65166-21-4	CCCCCCCCCC/C=C/C(CC(=O)O)C(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 1, 2: 22, 3: 1, 6: 2, 33: 2, 20: 6, 27: 2}
OK	65166-22-5	CCCCCCCCCC/C=C/C(CC(=O)O)C(=O)O.CN(C)C1CCCCC1	{1: 3, 2: 10, 3: 1, 6: 2, 33: 1, 11: 5, 12: 1, 27: 2}
OK	65181-88-6	C1=CC2C3C=CC(C1C2O)C3=O	{20: 1, 12: 5, 14: 4, 25: 1}
OK	65181-92-2	C1C2C3C=CC4C3OC1C4C2=O	{25: 1, 11: 1, 12: 6, 14: 2, 23: 1}
OK	65186-10-9	CCCCCCCCCCCCCCCC(=O)N(CCO)CCOC(=O)CCCCCCCCCCCCCCC	{1: 2, 2: 32, 33: 1, 20: 1, 24: 1, 28: 1}
OK	65194-05-0	C/[N+](=C\C1CC1)/[O-]	{1: 1, 6: 1, 33: 1, 11: 2, 12: 1, 29: 1}
OK	65195-44-0	CC(=C)C(=O)OCCC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 5, 5: 1, 7: 1, 16: 11, 28: 1}
OK	65195-55-3	CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C	{1: 10, 2: 1, 3: 1, 11: 6, 12: 17, 13: 2, 14: 7, 15: 3, 20: 3, 22: 4, 23: 5, 28: 1}
OK	652-67-5	C1[C@H]([C@@H]2[C@H](O1)[C@H](CO2)O)O	{20: 2, 11: 2, 12: 4, 23: 2}
OK	65206-90-8	CCOC(=O)N(C)C=NN(C)C.Cl	{1: 4, 2: 1, 6: 1, 33: 2, 34: 1, 17: 1, 28: 1}
OK	6522-54-9	C1CCC2CCC(C1)S2	{41: 1, 11: 6, 12: 2}
OK	65229-18-7	C(CCO)CN(CCN(CCCCO)N=O)N=O	{33: 2, 2: 10, 34: 2, 20: 2, 29: 2}
OK	6523-29-1	CN1CC2CCN1CC2	{1: 1, 11: 5, 12: 1, 33: 2}
OK	6526-78-9	CC1(CCCCC1)N	{1: 1, 11: 5, 13: 1, 30: 1}
OK	65282-16-8	C1COC2(O1)OCC3(CO2)COC4(OCCO4)OC3	{11: 8, 13: 3, 23: 8}
OK	65295-97-8	CC(=O)/C=N/N(C)C	{24: 1, 1: 3, 34: 1, 6: 1, 33: 1}
OK	6530-09-2	C1CN2CCC1C(C2)N.Cl.Cl	{17: 2, 11: 5, 12: 2, 30: 1, 33: 1}
OK	65308-76-1	CCCCCCCCCC(=O)NCCNCCN	{24: 1, 1: 1, 2: 12, 30: 1, 31: 2}
OK	6531-31-3	CC1CNC(=O)N1	{32: 2, 1: 1, 11: 1, 12: 1, 25: 1}
OK	6531-38-0	C1CN(CCN1CCN)CCN	{33: 2, 2: 4, 11: 4, 30: 2}
OK	6531-86-8	C1CCC(CC1)C2CCCCC2O	{20: 1, 11: 9, 12: 3}
OK	65328-78-1	C(CCCN=C=O)CCN=C=O.C(CNCCN)N	{2: 10, 8: 2, 34: 2, 29: 2, 30: 2, 31: 1}
OK	65332-44-7	CC(C)N(CCSSCCN(C(C)C)C(C)C)C(C)C	{40: 2, 1: 8, 2: 4, 3: 4, 33: 2}
OK	65355-35-3	CCCC1CCC(CC1)C2CCC(CC2)C#N	{1: 1, 2: 2, 11: 8, 12: 4, 37: 1}
OK	65355-37-5	CCCCCCCC1CCC(CC1)C2CCC(CC2)C#N	{1: 1, 2: 6, 11: 8, 12: 4, 37: 1}
OK	65375-86-2	C1C2C1C3C4C5CC5C6C2C3C64	{11: 2, 12: 10}
OK	65378-76-9	CC1=C(CC(C1)(C)C)C	{1: 4, 11: 2, 13: 1, 15: 2}
OK	65379-25-1	CCOC(=O)C=C.C=CC(=O)N.C=C(CC(=O)O)C(=O)O	{1: 1, 2: 2, 5: 3, 6: 2, 7: 1, 24: 1, 27: 2, 28: 1, 30: 1}
OK	65379-39-7	CCCCOC(=O)C(=C)C.C=C(CC(=O)O)C(=O)O	{1: 2, 2: 4, 5: 2, 7: 2, 27: 2, 28: 1}
OK	65379-49-9	CCCCOC(=O)C(C)O.CCOC(=O)C=C.CC(=C)C(=O)OC	{1: 5, 2: 4, 3: 1, 5: 2, 6: 1, 7: 1, 20: 1, 28: 3}
OK	65388-53-6	CC(C)(C)C=C=CCl	{8: 1, 1: 3, 4: 1, 6: 2, 17: 1}
OK	6540-56-3	CCCCCCCCCCCCCCCCCC(=O)NO	{24: 1, 1: 1, 2: 16, 20: 1, 31: 1}
OK	6540-98-3	CCCCC(C(=O)CCCC)O	{24: 1, 1: 2, 2: 6, 3: 1, 20: 1}
OK	65400-81-9	CC(=O)NCC(=O)N=C1N(CCS1)C	{1: 2, 2: 1, 33: 1, 41: 1, 11: 2, 34: 1, 15: 1, 24: 2, 31: 1}
OK	65402-65-5	CC1(CC(CC(N1)(C)C)(C(=O)O)O)C	{32: 1, 1: 4, 11: 2, 13: 3, 20: 1, 27: 1}
OK	65405-68-7	CCCCC(CO)C(=O)C	{24: 1, 1: 2, 2: 4, 3: 1, 20: 1}
OK	65405-73-4	CC(=CCCC(=CCOCC=O)C)C	{1: 3, 2: 4, 6: 2, 7: 2, 22: 1, 26: 1}
OK	65405-80-3	CCC=CCCOC(=O)C=CC	{1: 2, 2: 3, 28: 1, 6: 4}
OK	6541-82-8	CCCCN(CCCC)SCl	{40: 1, 1: 2, 2: 6, 33: 1, 17: 1}
OK	65416-16-2	CC=C(C)CCOC(=O)C(C)C	{1: 4, 2: 2, 3: 1, 6: 1, 7: 1, 28: 1}
OK	65416-30-0	CCC(=O)OC(C)(CCC=C(C)C)C#C	{1: 4, 2: 3, 4: 1, 6: 1, 7: 1, 9: 1, 10: 1, 28: 1}
OK	65416-34-4	CC(CCCC1(C(O1)C(=O)O)C)CCC=C(C)C	{1: 4, 2: 5, 3: 1, 6: 1, 7: 1, 12: 1, 13: 1, 23: 1, 27: 1}
OK	65416-35-5	CCCCCCCCC1(C(O1)C(=O)O)C	{1: 2, 2: 7, 12: 1, 13: 1, 23: 1, 27: 1}
OK	65416-36-6	CC(=CCCC1(C(O1)C(=O)O)C)C	{1: 3, 2: 2, 6: 1, 7: 1, 12: 1, 13: 1, 23: 1, 27: 1}
OK	6542-37-6	C1C2(COCN2CO1)CO	{33: 1, 2: 1, 11: 4, 13: 1, 20: 1, 23: 2}
OK	6542-60-5	C1CC1CC#N	{2: 1, 11: 2, 12: 1, 37: 1}
OK	65423-25-8	C=CCCCCCCCCCC(=O)O	{2: 9, 27: 1, 5: 1, 6: 1}
OK	65427-54-5	C(CN)C(C(=O)O)N.Cl.Cl	{27: 1, 17: 2, 2: 2, 3: 1, 30: 2}
OK	65431-89-2	CCCCCCCC(C)CCCC(C)CCCCCC	{1: 4, 2: 14, 3: 2}
OK	65437-70-9	CC1(CC(=O)CC2(C3C1CC2(CC3)C)C)C	{1: 4, 11: 5, 12: 2, 13: 3, 25: 1}
OK	6544-40-7	CC(=CCC(C=O)C(=C)C)C	{1: 3, 2: 1, 3: 1, 5: 1, 6: 1, 7: 2, 26: 1}
OK	65445-09-2	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)OC(=O)C(C)(C)C)CCC4=CC(=O)CC[C@H]34	{1: 4, 4: 1, 9: 1, 10: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	65445-60-5	C1CC(CN(C1)N=O)Cl	{33: 1, 34: 1, 11: 4, 12: 1, 17: 1, 29: 1}
OK	65445-61-6	C1CN(CCC1Cl)N=O	{33: 1, 34: 1, 11: 4, 12: 1, 17: 1, 29: 1}
OK	6550-99-8	CCCCOCCBr	{1: 1, 2: 5, 18: 1, 22: 1}
OK	65505-03-5	C=CC(=O)N.C=CC(=O)O.C(=O)C=O	{5: 2, 6: 2, 24: 1, 26: 2, 27: 1, 30: 1}
OK	65510-55-6	C(CI)C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 29, 2: 2, 19: 1, 4: 14}
OK	65510-56-7	C(CI)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 19, 2: 2, 19: 1, 4: 9}
OK	65520-45-8	CCCCOCCOCCOCCOC(=O)CCC(=O)OCCOCCOCCOCCCC	{1: 2, 2: 20, 28: 2, 22: 6}
OK	65520-70-9	CCCCCCCCCCCCCCCCCCCCCC(=O)O.C1COCCN1	{32: 1, 1: 1, 2: 20, 11: 4, 23: 1, 27: 1}
OK	6553-80-6	CC(C)OC(=O)C1CCCCC1	{11: 5, 1: 2, 3: 1, 12: 1, 28: 1}
OK	65530-92-9	CC(C)CC(CC(C)C)N	{1: 4, 2: 2, 3: 3, 30: 1}
OK	65530-93-0	CCCC(C)CCN	{1: 2, 2: 4, 3: 1, 30: 1}
OK	6554-73-0	CC(=C)C(=O)NC(C)(C)C	{1: 4, 4: 1, 5: 1, 7: 1, 24: 1, 31: 1}
OK	65540-77-4	CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 46, 28: 2}
OK	65544-06-1	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OC.C=CC(=O)O	{1: 4, 2: 17, 5: 3, 6: 1, 7: 2, 27: 1, 28: 2}
OK	6555-54-0	C\1=C\C#C/C=C\C#C/C=C\C#C1	{10: 6, 14: 6}
OK	6555-95-9	CC12CCC(CC1)(CC2)OC	{1: 2, 11: 6, 13: 2, 22: 1}
OK	65561-73-1	C1=CC(=O)C(=O)C=C1/C(=C/NO)/NO	{6: 1, 7: 1, 14: 3, 15: 1, 20: 2, 25: 2, 31: 2}
OK	6558-78-7	CCCCN(C(=O)OCC)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 28: 1, 29: 1}
OK	65591-14-2	CCCCCCCCCCCCCCCCCCCCOC(=O)CC	{1: 2, 2: 20, 28: 1}
OK	656-57-5	C1CCC(C(C1)F)Br	{16: 1, 18: 1, 11: 4, 12: 2}
OK	6561-39-3	CCCCCCCCC(=O)OCCCCCC	{1: 2, 2: 12, 28: 1}
OK	6561-44-0	CCCCCCCCCCCCCCCC(C)CC	{1: 3, 2: 15, 3: 1}
OK	65611-31-6	CCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 6, 4: 1, 28: 1, 17: 3}
OK	65611-32-7	CCCCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 8, 4: 1, 28: 1, 17: 3}
OK	65611-33-8	CCCCCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 9, 4: 1, 28: 1, 17: 3}
OK	65651-41-4	C1CC2CCCC(C1)OO2	{11: 6, 12: 2, 23: 2}
OK	65651-43-6	CC(=C1C2CCC1OO2)C	{1: 2, 7: 1, 11: 2, 12: 2, 15: 1, 23: 2}
OK	65652-27-9	CC(=CCCC1=CCCC(C1)(C)C(=O)O)C	{1: 3, 2: 2, 6: 1, 7: 1, 11: 3, 13: 1, 14: 1, 15: 1, 27: 1}
OK	65652-34-8	CCCCN(CC)CCCC.CCCCN(CC)CCCC.C(CCCO)CCO	{1: 6, 2: 20, 20: 2, 33: 2}
OK	65652-37-1	CC(OC=C)OC=C.CC(=O)OC=C.C=CO	{1: 2, 3: 1, 5: 4, 6: 4, 20: 1, 22: 2, 28: 1}
OK	6568-33-8	C1CCCCCC/C=C/CCCCC1	{11: 12, 14: 2}
OK	65686-49-9	CCCCC#CCCCCCCCCCCO	{1: 1, 2: 13, 20: 1, 10: 2}
OK	657-24-9	CN(C)C(=N)N=C(N)N	{1: 2, 34: 1, 36: 1, 33: 1, 7: 2, 30: 2}
OK	657-26-1	C(CCN)C[C@@H](C(=O)O)N.Cl.Cl	{27: 1, 17: 2, 2: 4, 3: 1, 30: 2}
OK	657-27-2	C(CCN)C[C@@H](C(=O)O)N.Cl	{27: 1, 17: 1, 2: 4, 3: 1, 30: 2}
OK	657-36-3	C1CNCCC1C(F)(F)F	{16: 3, 12: 1, 11: 4, 4: 1, 32: 1}
OK	6570-87-2	CC(C)C(C)CCO	{1: 3, 2: 2, 3: 2, 20: 1}
OK	6570-88-3	CC(C)C(C)C(C)CO	{1: 4, 2: 1, 3: 3, 20: 1}
OK	65700-59-6	C/C=C(/C)\C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)COC(=O)C)O)C	{1: 7, 2: 1, 6: 1, 7: 1, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 2, 25: 1, 28: 2}
OK	65700-60-9	C/C=C(/C)\C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C	{1: 6, 2: 1, 6: 1, 7: 1, 11: 2, 12: 4, 13: 4, 14: 2, 15: 2, 20: 3, 25: 1, 28: 1}
OK	65713-63-5	CCOC(=O)C1=C(NCC1=O)C	{32: 1, 1: 2, 2: 1, 11: 1, 15: 2, 25: 1, 28: 1}
OK	6572-82-3	C1CC2CC1C=CC=C2	{11: 3, 12: 2, 14: 4}
OK	6572-89-0	C1CCCOOCC1	{11: 6, 23: 2}
OK	6572-90-3	C1CCOCOCC1	{11: 6, 23: 2}
OK	6572-98-1	C1CCCOCCC1	{11: 7, 23: 1}
OK	65728-19-0	CC1(CC(CC(N1)(C)C)C(=O)O)C	{32: 1, 1: 4, 11: 2, 12: 1, 13: 2, 27: 1}
OK	6573-52-0	C1CCCC#CCCC1	{10: 2, 11: 7}
OK	6573-64-4	C1C#CCOCC#CCO1	{10: 4, 11: 4, 23: 2}
OK	6573-72-4	C1CCCCCCC=CCCCCCC1	{11: 13, 14: 2}
OK	65737-52-2	CCCCCC=CCC1CCCC1=O	{1: 1, 2: 5, 6: 2, 11: 3, 12: 1, 25: 1}
OK	65754-71-4	C1C2=CC=CC1=CC=CC=C2	{11: 1, 14: 8, 15: 2}
OK	6576-93-8	C1CSSCCS1	{41: 3, 11: 4}
OK	65769-10-0	CC(C)(C)CCCCCO	{1: 3, 2: 5, 4: 1, 20: 1}
OK	65785-54-8	CC(C)N(C(C)C)C(=C(C)C)F	{16: 1, 1: 6, 3: 2, 33: 1, 7: 2}
OK	65786-09-6	CCCCCC(C)(Cl)Cl	{1: 2, 2: 4, 4: 1, 17: 2}
OK	65786-11-0	CCCCCC(=C)Cl	{1: 1, 2: 4, 17: 1, 5: 1, 7: 1}
OK	6579-55-1	CC(CNCCO)O	{1: 1, 2: 3, 3: 1, 20: 2, 31: 1}
OK	65792-56-5	CCCN(C(=O)CC)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 24: 1, 29: 1}
OK	65808-58-4	CCCCCCCCC=CCCCCCCCC(=O)OCCSCCOC(=O)CCCCCCCC=CCCCCCCCC	{40: 1, 1: 2, 2: 32, 28: 2, 6: 4}
OK	6581-57-3	COC1CCCC(O1)OC	{1: 2, 11: 3, 12: 2, 22: 2, 23: 1}
OK	6581-64-2	CCCOC1CCCCO1	{1: 1, 2: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	6581-66-4	COC1CCCCO1	{1: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	65819-74-1	C/C=C/S/C=C/C	{40: 1, 1: 2, 6: 4}
OK	65822-93-7	CCCC(C)CC(C)(C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	65839-06-7	C1C=CC2C1C3CC2CC3N	{11: 3, 12: 5, 30: 1, 14: 2}
OK	65849-81-2	CC(CCOC(C)CCO)O	{1: 2, 2: 4, 3: 2, 20: 2, 22: 1}
OK	659-70-1	CC(C)CCOC(=O)CC(C)C	{1: 4, 2: 3, 3: 2, 28: 1}
OK	659-85-8	C1=CC2C3C1C23	{12: 4, 14: 2}
OK	659-86-9	C#CCI	{9: 1, 2: 1, 19: 1, 10: 1}
OK	65915-87-9	CC(=C1C2C3C4C3C1C5C4C52)C	{1: 2, 15: 1, 12: 8, 7: 1}
OK	65915-88-0	C1CC12C3C4C5C4C2C6C5C63	{11: 2, 12: 8, 13: 1}
OK	65915-89-1	C=C=C1C2C3C4C3C1C5C4C52	{8: 1, 12: 8, 5: 1, 15: 1}
OK	65923-98-0	CC1=C(S1)C	{1: 2, 41: 1, 15: 2}
OK	65927-60-8	CC(C)CC(C)(C(C)C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	65937-22-6	C#CC#CC#CC#N	{9: 1, 10: 5, 37: 1}
OK	65940-92-3	CCOC(=O)C=C.C=CCOCC1CO1	{1: 1, 2: 3, 5: 2, 6: 2, 11: 1, 12: 1, 22: 1, 23: 1, 28: 1}
OK	65947-11-7	CCC(=O)OC1=CC(=O)OC(CC2C(O2)C=CC(C(CC(C(C1OC)OC3C(C(C(C(O3)C)OC4CC(C(C(O4)C)OC(=O)C)(C)O)N(C)C)O)CC=O)C)O)C	{1: 10, 2: 2, 33: 1, 11: 3, 12: 16, 13: 1, 14: 3, 15: 1, 20: 3, 22: 3, 23: 3, 26: 1, 28: 3}
OK	65954-19-0	CCCCCCCC/C=C\CCCOC(=O)C	{1: 2, 2: 10, 28: 1, 6: 2}
OK	6596-35-6	C1CCC2CC3CCCCC3CC2C1	{11: 10, 12: 4}
OK	6596-40-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 48}
OK	65970-32-3	CCCCOCNC(=O)C=C.CCOC(=O)C=C.CC(=C)C(=O)O.C=CC#N	{1: 3, 2: 5, 5: 4, 6: 3, 7: 1, 22: 1, 24: 1, 27: 1, 28: 1, 37: 1, 31: 1}
OK	65970-58-3	CCCCOC(=O)C(=C)C.CC(=C)C(=O)OCCNC(C)(C)C.C=CC#N	{1: 6, 2: 5, 4: 1, 5: 3, 6: 1, 7: 2, 28: 2, 37: 1, 31: 1}
OK	65986-79-0	CC(N(C)N=O)OC(=O)C	{1: 3, 34: 1, 3: 1, 33: 1, 28: 1, 29: 1}
OK	65986-80-3	CCN(COC(=O)C)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 28: 1, 29: 1}
OK	6599-04-8	CCC(C)N1CCOCC1.Br	{1: 2, 2: 1, 3: 1, 33: 1, 11: 4, 18: 1, 23: 1}
OK	65992-66-7	C1CC(CC(C1)CN(CC2CO2)CC3CO3)CN(CC4CO4)CC5CO5	{33: 2, 2: 6, 11: 8, 12: 6, 23: 4}
OK	66-22-8	C1=CNC(=O)NC1=O	{32: 2, 25: 2, 14: 2}
OK	66-25-1	CCCCCC=O	{1: 1, 2: 4, 26: 1}
OK	66-28-4	C[C@]12CC[C@H]3[C@H]([C@]1(CC[C@@H]2C4=CC(=O)OC4)O)CC[C@]5([C@@]3(CC[C@@H](C5)O)C=O)O	{1: 1, 11: 10, 12: 4, 13: 4, 14: 1, 15: 1, 20: 3, 26: 1, 28: 1}
OK	66-81-9	C[C@H]1C[C@@H](C(=O)[C@@H](C1)[C@@H](CC2CC(=O)NC(=O)C2)O)C	{32: 1, 1: 2, 2: 1, 3: 1, 11: 4, 12: 4, 20: 1, 25: 3}
OK	66-86-4	C1C(C(C(C(C1N)OC2C(C(C(C(O2)CN)O)O)N)OC3C(C(C(O3)CO)OC4C(C(C(C(O4)CN)O)O)N)O)O)N	{2: 3, 11: 1, 12: 19, 20: 7, 22: 3, 23: 3, 30: 6}
OK	660-27-5	CC(C)NC(C)C.C(C(=O)O)(Cl)Cl	{27: 1, 1: 4, 3: 3, 31: 1, 17: 2}
OK	660-68-4	CCNCC.Cl	{1: 2, 2: 2, 31: 1, 17: 1}
OK	660-88-8	C(CCN)CC(=O)O	{2: 4, 27: 1, 30: 1}
OK	6600-31-3	C1CC(CC=C1)C2OCC3(CO2)COC(OC3)C4CCC=CC4	{11: 10, 12: 4, 13: 1, 14: 4, 23: 4}
OK	6600-40-4	CCC[C@@H](C(=O)O)N	{27: 1, 1: 1, 2: 2, 3: 1, 30: 1}
OK	66017-19-4	CCCC(=C(C)C)OC	{1: 4, 2: 2, 22: 1, 7: 2}
OK	66017-25-2	C/C(=C\C(C)(C)C)/OC	{1: 5, 4: 1, 22: 1, 6: 1, 7: 1}
OK	66017-91-2	CCCN(COC(=O)C)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 28: 1, 29: 1}
OK	66028-30-6	C=CC(=O)OCCN(CCOC(=O)C=C)C=O	{33: 1, 2: 4, 5: 2, 6: 2, 26: 1, 28: 2}
OK	66036-92-8	CC1=CCC2C3C1C23C	{1: 2, 11: 1, 12: 3, 13: 1, 14: 1, 15: 1}
OK	66039-62-1	C1CC2C3C1C2C=CC=C3	{11: 2, 12: 4, 14: 4}
OK	66051-48-7	C(#CC(F)(F)F)C#N	{16: 3, 10: 2, 4: 1, 37: 1}
OK	66052-32-2	CC(=CCC(C)(C=C)C(=O)OC)C	{1: 4, 2: 1, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	66057-42-9	CCCCOC(=O)C(=C)C.CC(COC(=O)C(=C)C)O.CC(=C)C(=O)O	{1: 5, 2: 4, 3: 1, 5: 3, 7: 3, 20: 1, 27: 1, 28: 2}
OK	6606-65-1	CCCCOC(=O)C(=C)C#N	{1: 1, 2: 3, 37: 1, 7: 1, 28: 1, 5: 1}
OK	6606-66-2	CCCOC(=O)C(=C)C#N	{1: 1, 2: 2, 37: 1, 7: 1, 28: 1, 5: 1}
OK	6607-49-4	CCCCSCCOC=C	{1: 1, 2: 5, 5: 1, 6: 1, 40: 1, 22: 1}
OK	6607-66-5	CC(CCOC)(OC)OC	{1: 4, 2: 2, 4: 1, 22: 3}
OK	66070-54-0	CCCCCCCCC=C.CCCCCCC=C	{1: 2, 2: 12, 5: 2, 6: 2}
OK	66081-13-8	C1=CC2C3C=CC4C3C5C2C1C6C5C4C=C6	{12: 10, 14: 6}
OK	66085-55-0	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CNCCNCCN	{1: 2, 2: 30, 6: 8, 27: 2, 30: 2, 31: 2}
OK	66086-33-7	CC(C)(C)OC(=O)C#CC(=O)OC(C)(C)C	{1: 6, 10: 2, 4: 2, 28: 2}
OK	661-11-0	CCCCCCCF	{16: 1, 1: 1, 2: 6}
OK	661-19-8	CCCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 21, 20: 1}
OK	661-20-1	N#C[O-]	{29: 1, 37: 1}
OK	661-53-0	CCC(C)(C)F	{16: 1, 1: 3, 2: 1, 4: 1}
OK	661-54-1	C#CC(F)(F)F	{16: 3, 9: 1, 10: 1, 4: 1}
OK	661-71-2	C1CC(C1(F)F)(F)Cl	{16: 3, 17: 1, 11: 2, 13: 2}
OK	661-95-0	C(C(F)(F)F)(C(F)(F)Br)(F)Br	{16: 6, 18: 2, 4: 3}
OK	661-97-2	C(C(F)(F)F)(C(F)(F)Cl)(F)Cl	{16: 6, 17: 2, 4: 3}
OK	66104-67-4	CCCCCCCCCCCCOCCOCCOCCOC(=O)C=CC(=O)O	{1: 1, 2: 17, 6: 2, 22: 3, 27: 1, 28: 1}
OK	6611-01-4	C1CN1C(=O)NCCCCNC(=O)N2CC2	{24: 2, 33: 2, 2: 4, 11: 4, 31: 2}
OK	6611-78-5	CC1(C=CC(=O)C=C1)C(Cl)Cl	{1: 1, 3: 1, 13: 1, 14: 4, 17: 2, 25: 1}
OK	66142-23-2	CCCCOC(=O)C(=C)C.CC(=C)C(=O)OCC1CC2CCC1C2	{1: 3, 2: 4, 5: 2, 7: 2, 11: 4, 12: 3, 28: 2}
OK	66142-97-0	CN(C)CCCN.C1C(O1)CCl.Cl	{1: 2, 2: 4, 33: 1, 11: 1, 12: 1, 17: 2, 23: 1, 30: 1}
OK	66143-00-8	C(=C(F)Br)(F)F.C(F)(Br)(Br)Br	{16: 4, 18: 4, 4: 1, 7: 2}
OK	66149-44-8	CC(=C1C2CCC3C2C1CC3)C	{15: 1, 1: 2, 11: 4, 12: 4, 7: 1}
OK	66161-52-2	CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCC=CCCCCCCCC	{1: 2, 2: 35, 28: 1, 6: 2}
OK	66161-53-3	CCCCCCCCCCCC(=O)NCCCN1CCOCC1	{1: 1, 2: 13, 33: 1, 11: 4, 23: 1, 24: 1, 31: 1}
OK	66161-61-3	CCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCC(=O)O	{1: 1, 2: 27, 27: 1, 22: 8}
OK	66161-63-5	CCCCCCCCCCCC(=O)NCCCN(CCO)CCO	{1: 1, 2: 17, 33: 1, 20: 2, 24: 1, 31: 1}
OK	66161-64-6	CCCCCCCCCCCCCC(=O)NCCCN(CCO)CCO	{1: 1, 2: 19, 33: 1, 20: 2, 24: 1, 31: 1}
OK	66175-24-4	CN1CCSCN1C	{1: 2, 11: 3, 41: 1, 33: 2}
OK	66175-25-5	CN1CCN(N(C1)C)C	{1: 3, 11: 3, 33: 3}
OK	66178-19-6	CC=COC(OC)OC	{1: 3, 3: 1, 22: 3, 6: 2}
OK	66178-21-0	C/C=C/OC(C)(OC)OC	{1: 4, 4: 1, 22: 3, 6: 2}
OK	66178-22-1	CC=COC(C)(OC)OC	{1: 4, 4: 1, 22: 3, 6: 2}
OK	66178-23-2	C/C=C/OC(O/C=C/C)(OC)C	{1: 4, 4: 1, 22: 3, 6: 4}
OK	6619-97-2	CC(=O)O[C@@H]1C(=C)C2CC[C@@H]3C1(C2)CC[C@H]4C3(CCCC4(C)C(=O)O)C	{1: 3, 5: 1, 11: 8, 12: 4, 13: 3, 15: 1, 27: 1, 28: 1}
OK	662-01-1	C(C(F)(F)Cl)(C(F)(F)Cl)(F)F	{16: 6, 17: 2, 4: 3}
OK	662-16-8	COC(C(F)(F)F)(C(F)(F)F)O	{16: 6, 1: 1, 4: 3, 22: 1, 20: 1}
OK	662-35-1	C(C(C(C(F)(F)F)(F)F)(F)F)F	{16: 8, 2: 1, 4: 3}
OK	662-50-0	C(=O)(C(C(C(F)(F)F)(F)F)(F)F)N	{16: 7, 24: 1, 4: 3, 30: 1}
OK	6620-95-7	C(C(C(=O)NC(CO)C(=O)O)N)O	{2: 2, 3: 2, 20: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	6621-47-2	C1CCC(CC1)C(CC2CCCCN2)C3CCCCC3	{11: 14, 32: 1, 2: 1, 3: 1, 12: 3}
OK	6621-59-6	C(CCC#N)CCBr	{2: 5, 18: 1, 37: 1}
OK	6621-60-9	COC(=O)CCCCCNC(=O)NCCCCCC(=O)OC	{24: 1, 1: 2, 2: 10, 28: 2, 31: 2}
OK	66214-00-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 29, 30: 1}
OK	66214-14-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 31, 30: 1}
OK	66214-27-5	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C	{1: 3, 2: 30, 3: 1}
OK	66225-12-5	CC=C(C)CC(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1}
OK	66225-15-8	CCCC(=CC)CC	{1: 3, 2: 3, 6: 1, 7: 1}
OK	66225-17-0	CCCC(C)/C=C/C	{1: 3, 2: 2, 3: 1, 6: 2}
OK	66225-20-5	CC/C=C/CC(C)C	{1: 3, 2: 2, 3: 1, 6: 2}
OK	66225-22-7	CCCCCCCC(I)I	{19: 2, 1: 1, 2: 6, 3: 1}
OK	66225-38-5	CC(C)C(C)N(C)C	{1: 5, 3: 2, 33: 1}
OK	66225-39-6	CCC(C)CN(C)C	{1: 4, 2: 2, 3: 1, 33: 1}
OK	66225-40-9	CCCCN(C)CC	{1: 3, 2: 4, 33: 1}
OK	66225-41-0	CCC(C)N(C)CC	{1: 4, 2: 2, 3: 1, 33: 1}
OK	66225-42-1	CCCN(C)C(C)C	{1: 4, 2: 2, 3: 1, 33: 1}
OK	66225-51-2	CCC(CC)CCO	{1: 2, 2: 4, 3: 1, 20: 1}
OK	66225-59-0	C1=C(C(=CC(=O)C1=O)O)C[C@@H](C(=O)O)N	{2: 1, 3: 1, 14: 2, 15: 2, 20: 1, 25: 2, 27: 1, 30: 1}
OK	6624-58-4	CCCCCC(C)OC(=O)CCCCC	{1: 3, 2: 8, 3: 1, 28: 1}
OK	6624-70-0	CC(C)CCOC(=O)CCCCC(=O)OCCC(C)C	{1: 4, 2: 8, 3: 2, 28: 2}
OK	6624-76-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 28, 20: 1}
OK	6624-79-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO	{1: 1, 2: 31, 20: 1}
OK	6624-84-6	CCCCCOC(=O)CC(=O)C	{24: 1, 1: 2, 2: 5, 28: 1}
OK	66250-03-1	C(CC(Cl)Cl)CCl	{17: 3, 2: 3, 3: 1}
OK	66251-42-1	CC(C)CCCCCOC(=O)C=C.CC(=C)C(=O)O	{1: 3, 2: 5, 3: 1, 5: 2, 6: 1, 7: 1, 27: 1, 28: 1}
OK	66251-44-3	CC(C)CCCCCOC(=O)C=C.CC(=C)C(=O)O.CC(=O)OC=C	{1: 4, 2: 5, 3: 1, 5: 3, 6: 2, 7: 1, 27: 1, 28: 2}
OK	66256-39-1	CCC(C)(C(C)(C)C(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	66256-40-4	CCC(C)(C(C)C(C)(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	66256-41-5	CCC(C(C)C)(C(C)(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	66256-42-6	CCC(C)C(CC(C)(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66256-43-7	CC(C)CCC(C(C)(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66256-44-8	CC(C)CC(CC(C)(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66256-46-0	CCC(C)C(C)(CC(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66256-47-1	CC(C)CC(C)CC(C)(C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66256-48-2	CC(C)C(C)CCC(C)(C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66256-50-6	CCC(C)(C)CC(C)(CC)O	{1: 5, 2: 3, 4: 2, 20: 1}
OK	66256-60-8	CCCC(C)CCCC(C)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66256-61-9	CCC(C)CCCCC(C)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66256-62-0	CCCC(CC(C)CC)CO	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66256-63-1	CCC(C)C(C)(C(C)(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	66256-64-2	CC(C)CC(C)(C(C)(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	66256-65-3	CCC(C)(C)C(C(C)(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	66256-66-4	CCC(C)(C)C(C)C(C)(C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	66256-67-5	CCC(C)(C)C(C)(C(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	66256-68-6	CC(C)C(C(C)(C)C(C)C)O	{1: 6, 3: 3, 4: 1, 20: 1}
OK	66256-69-7	CC(C(C)(C)CC(C)(C)C)O	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	6626-33-1	CCC(C)(C#CC#CC(C)(CC)O)O	{1: 4, 2: 2, 4: 2, 10: 4, 20: 2}
OK	6627-74-3	CC1=CCCC(C1CO)(C)C	{1: 3, 2: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	66270-36-8	CC(C)(C(Cl)(Cl)Cl)OC(=O)Cl	{1: 2, 4: 2, 28: 1, 17: 4}
OK	66271-53-2	CCCCCCCCCCCCCCC(C)S	{1: 2, 2: 13, 3: 1, 39: 1}
OK	66271-54-3	CCCCCCCCCCCCCCSCC	{40: 1, 1: 2, 2: 14}
OK	66271-55-4	CCCCCCCCCCCCCSCCC	{40: 1, 1: 2, 2: 14}
OK	66271-71-4	CCCCCCCCCCCCCCC=CF	{16: 1, 1: 1, 2: 13, 6: 2}
OK	66271-77-0	CCCCCCCCCCCCCOC(=O)CC	{1: 2, 2: 13, 28: 1}
OK	66271-82-7	CCCCCCCCCCCCSCCC	{40: 1, 1: 2, 2: 13}
OK	66271-91-8	CC(CO)OCC(C)OCCOCCOC	{1: 3, 2: 6, 3: 2, 20: 1, 22: 4}
OK	6628-00-8	C=CCNC1CCCCC1	{2: 1, 5: 1, 6: 1, 11: 5, 12: 1, 31: 1}
OK	6628-18-8	CSCCSC	{40: 2, 1: 2, 2: 2}
OK	6628-21-3	CCOC(=O)C(CCl)Cl	{1: 1, 2: 2, 3: 1, 28: 1, 17: 2}
OK	6628-25-7	CCCCCCC(=O)CC(C)C	{24: 1, 1: 3, 2: 6, 3: 1}
OK	6628-38-2	CCCCC(CC)C=C1CCCCC1=O	{1: 2, 2: 4, 3: 1, 6: 1, 11: 4, 15: 1, 25: 1}
OK	6628-78-0	C(CCC#N)CCCl	{17: 1, 2: 5, 37: 1}
OK	6628-79-1	CC(CC(=O)O)C(=O)C	{24: 1, 1: 2, 2: 1, 3: 1, 27: 1}
OK	6628-80-4	C1CC[C@H]([C@@H](C1)O)Cl	{17: 1, 11: 4, 12: 2, 20: 1}
OK	6628-83-7	C1CCOC(C1)CN	{2: 1, 11: 4, 12: 1, 30: 1, 23: 1}
OK	66280-55-5	C(CCCCCC(=O)OO)CCCCC(=O)OO	{28: 2, 2: 10, 20: 2}
OK	6629-04-5	CCOC(=O)NC(=O)CC#N	{1: 1, 2: 2, 37: 1, 24: 1, 28: 1, 31: 1}
OK	6629-60-3	CCNN.C(=O)(C(=O)O)O	{1: 1, 2: 1, 27: 2, 30: 1, 31: 1}
OK	6629-96-5	C1(C(OC(C(O1)(Cl)Cl)(Cl)Cl)(Cl)Cl)Cl	{17: 7, 12: 1, 13: 3, 23: 2}
OK	66291-45-0	CCCCCCCCCCCCCC=CI	{1: 1, 2: 12, 19: 1, 6: 2}
OK	66291-47-2	CCCCCCCCC=CCl	{1: 1, 2: 7, 6: 2, 17: 1}
OK	66291-51-8	CCCCCCCCC=CI	{1: 1, 2: 7, 19: 1, 6: 2}
OK	66291-72-3	CCCCCCCCC=CBr	{1: 1, 2: 7, 18: 1, 6: 2}
OK	663-25-2	C(=O)(C(C(C(F)(F)F)(F)F)(F)F)ON=O	{16: 7, 28: 1, 34: 1, 4: 3, 29: 1}
OK	663-35-4	CCOC(=O)CC(=O)C(C(F)(F)F)(F)F	{1: 1, 2: 2, 4: 2, 16: 5, 24: 1, 28: 1}
OK	663-45-6	C1(=O)C(=O)C(C1(F)F)(F)F	{16: 4, 25: 2, 13: 2}
OK	6631-98-7	CCC(=O)O[C@@H]1C(C[C@H]2[C@]1([C@H]3CC[C@]4([C@H]([C@@H]3CC2)CC[C@]4(C#C)OC(=O)CC)C)C)C#C	{1: 4, 2: 2, 9: 2, 10: 2, 11: 7, 12: 6, 13: 3, 28: 2}
OK	66310-72-3	CC(=CCCC1=CCC(CC1)(CC=C)C=O)C	{1: 2, 2: 3, 5: 1, 6: 2, 7: 1, 11: 3, 13: 1, 14: 1, 15: 1, 26: 1}
OK	66324-47-8	CC1CCCCC1C2CCCCC2	{1: 1, 11: 9, 12: 3}
OK	66326-13-4	CCCCCCCCCCCCCCCCCCCCC#N	{1: 1, 2: 19, 37: 1}
OK	66326-18-9	CCCCCCCCCCCCCCCCCN(CC)CC	{1: 3, 2: 18, 33: 1}
OK	66327-54-6	CC(C)CCCC1=CCC(CC1)(C)C=O	{1: 3, 2: 3, 3: 1, 11: 3, 13: 1, 14: 1, 15: 1, 26: 1}
OK	66343-91-7	CC12CCC(CC1)N=N2	{1: 1, 11: 4, 12: 1, 13: 1, 35: 2}
OK	6637-50-9	CCC(CC)(CC)CC(=O)O	{1: 3, 2: 4, 27: 1, 4: 1}
OK	66374-73-0	CC(C)C1CCCCC1C2CCCCC2	{11: 9, 1: 2, 3: 1, 12: 3}
OK	66374-92-3	C1CCC(CC1)CCC(=CCC2CCCCC2)CCC3CCCCC3	{2: 5, 11: 15, 12: 3, 6: 1, 7: 1}
OK	66374-93-4	C1CCC(C1)CCCC(=CCCC2CCCC2)CCCC3CCCC3	{2: 8, 11: 12, 12: 3, 6: 1, 7: 1}
OK	66375-02-8	CCCCCCCCCCCCCCCCCCCN(CC)CC	{1: 3, 2: 20, 33: 1}
OK	6638-79-5	CNOC.Cl	{1: 2, 31: 1, 22: 1, 17: 1}
OK	66398-52-5	C(C(C(=O)O)O)C(=O)N	{2: 1, 3: 1, 20: 1, 24: 1, 27: 1, 30: 1}
OK	66408-78-4	CC(=CCCC(=CC1OCCO1)C)C	{1: 3, 2: 2, 6: 2, 7: 2, 11: 2, 12: 1, 23: 2}
OK	66409-97-0	CCCCN1C[C@H](C[C@@H]2[C@@H]1[C@H](C3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5C(=O)[C@@H]4[C@H]3C)C)OC(=O)C)C)C	{1: 6, 2: 3, 33: 1, 11: 8, 12: 10, 13: 2, 14: 1, 15: 1, 23: 1, 25: 1, 28: 1}
OK	66409-98-1	CC1C[C@@H]2[C@H](C([C@]3(O2)CCC4C5CC=C6CC(CCC6(C5C(=O)C4=C3C)C)O)C)N(C1)C=O	{1: 4, 33: 1, 11: 8, 12: 8, 13: 2, 14: 1, 15: 3, 20: 1, 23: 1, 25: 1, 26: 1}
OK	6641-83-4	CC(CC(=O)C)C(=O)O	{24: 1, 1: 2, 2: 1, 3: 1, 27: 1}
OK	66415-50-7	C1CC(CCC1CO)CO.C(=C/C(=O)O)\C(=O)O	{2: 2, 6: 2, 11: 4, 12: 2, 20: 2, 27: 2}
OK	66415-55-2	C=COCCCN	{30: 1, 2: 3, 22: 1, 5: 1, 6: 1}
OK	6642-21-3	CC(=C(C(=O)O)NC(=O)C)C	{24: 1, 1: 3, 27: 1, 31: 1, 7: 2}
OK	6642-30-4	CNC(=O)OC	{1: 2, 28: 1, 31: 1}
OK	66438-87-7	CC1(CC(C1C=C)(C)C)C	{1: 4, 5: 1, 6: 1, 11: 1, 12: 1, 13: 2}
OK	66438-88-8	CC1(CC(C1)C#C)C	{1: 2, 9: 1, 10: 1, 11: 2, 12: 1, 13: 1}
OK	66438-89-9	CC1(CC(C1C#C)(C)C)C	{1: 4, 9: 1, 10: 1, 11: 1, 12: 1, 13: 2}
OK	66487-26-1	CCCCCCCCCCCCOCCOCCOCCC#N	{1: 1, 2: 17, 37: 1, 22: 3}
OK	665-66-7	C1C2CC3CC1CC(C2)(C3)N.Cl	{17: 1, 11: 6, 12: 3, 13: 1, 30: 1}
OK	66512-92-3	CC(CCC=C(C)C)CC1OCCO1	{1: 3, 2: 3, 3: 1, 6: 1, 7: 1, 11: 2, 12: 1, 23: 2}
OK	66542-51-6	CCCCCC(=O)OCCl	{1: 1, 2: 5, 28: 1, 17: 1}
OK	66553-05-7	CC(C)C(C)CN	{1: 3, 2: 1, 3: 2, 30: 1}
OK	66553-15-9	CC(C)C(C)(CO)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 2}
OK	66553-16-0	CCC(CC)(CO)O	{1: 2, 2: 3, 4: 1, 20: 2}
OK	66553-17-1	CCC(CO)C(C)O	{1: 2, 2: 2, 3: 2, 20: 2}
OK	66553-45-5	CCCCCCCCCCC=CI	{1: 1, 2: 9, 19: 1, 6: 2}
OK	66553-52-4	CCCCCCCCCCNCC	{1: 2, 2: 10, 31: 1}
OK	66553-53-5	CCCCCCCCCCCNC	{1: 2, 2: 10, 31: 1}
OK	66558-62-1	CCCCCCCCCCCCNCCNCCNC(=O)C=CC(=O)O	{1: 1, 2: 15, 6: 2, 24: 1, 27: 1, 31: 3}
OK	66563-84-6	CCCCCCCCCNCC	{1: 2, 2: 9, 31: 1}
OK	66575-29-9	CC(=O)OC1C(C2C(CCC(C2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)O)(C)C)O	{1: 6, 5: 1, 6: 1, 11: 3, 12: 4, 13: 5, 20: 3, 23: 1, 25: 1, 28: 1}
OK	66575-72-2	CCCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCC	{1: 3, 2: 54, 33: 1}
OK	66576-21-4	CCC(C)(C(C)(C)C)C(C)(C)C	{1: 8, 2: 1, 4: 3}
OK	66576-22-5	CCC(C)(CC)C(C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	66576-23-6	CCC(C(C)C)C(C)O	{1: 4, 2: 1, 3: 3, 20: 1}
OK	66576-24-7	CC(C)(C)C(C)(C)CO	{1: 5, 2: 1, 4: 2, 20: 1}
OK	66576-26-9	CC(C)C(C)C(C)(C)O	{1: 5, 3: 2, 4: 1, 20: 1}
OK	66576-27-0	CC(C)CC(C)C(C)O	{1: 4, 2: 1, 3: 3, 20: 1}
OK	66576-31-6	CCC(CC(C)(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	66576-56-5	CCC(CO)C(C)(C)C	{1: 4, 2: 2, 3: 1, 4: 1, 20: 1}
OK	66576-57-6	CCC(C)C(C)CCO	{1: 3, 2: 3, 3: 2, 20: 1}
OK	66576-70-3	CCC(=O)OC(C)C(C)C	{1: 4, 2: 1, 3: 2, 28: 1}
OK	66576-71-4	CCC(C)C(=O)OC(C)C	{1: 4, 2: 1, 3: 2, 28: 1}
OK	66577-30-8	CCCCCCCCCCCSCC	{40: 1, 1: 2, 2: 11}
OK	66577-31-9	CCCCCCCCCCSCCC	{40: 1, 1: 2, 2: 11}
OK	66577-48-8	CCCCCCCCCCCCCN(CC)CC	{1: 3, 2: 14, 33: 1}
OK	66587-05-1	CC1(CC(CC(N1)(C)C)(C(=O)OC)O)C	{32: 1, 1: 5, 11: 2, 13: 3, 20: 1, 28: 1}
OK	666-21-7	CC(C(C)F)F	{16: 2, 1: 2, 3: 2}
OK	666-99-9	CCCCCCCCCCCCCCCCC(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 1, 2: 16, 3: 1, 4: 1, 20: 1, 27: 3}
OK	66610-39-7	CC[C@H](C)OC	{1: 3, 2: 1, 3: 1, 22: 1}
OK	66637-25-0	CC1(/C(=N\OC(=O)NC)/SCC(=O)N1)C	{32: 1, 1: 3, 34: 1, 41: 1, 11: 1, 13: 1, 15: 1, 25: 1, 28: 1, 31: 1}
OK	66637-26-1	CC1C(=O)NC(/C(=N\OC(=O)NC)/S1)(C)C	{32: 1, 1: 4, 34: 1, 41: 1, 12: 1, 13: 1, 15: 1, 25: 1, 28: 1, 31: 1}
OK	66637-32-9	CC1/C(=N\OC(=O)NC)/SCC(=O)N1	{32: 1, 1: 2, 34: 1, 41: 1, 11: 1, 12: 1, 15: 1, 25: 1, 28: 1, 31: 1}
OK	66637-35-2	CC1/C(=N\OC(=O)N(C)SC(Cl)(Cl)Cl)/SCC(=O)N1C	{1: 3, 34: 1, 4: 1, 33: 2, 40: 1, 41: 1, 11: 1, 12: 1, 15: 1, 17: 3, 25: 1, 28: 1}
OK	66641-27-8	CC1(C[C@@H](C(N1O)(C)C)C(=O)NCCN2C(=O)C=CC2=O)C	{1: 4, 2: 2, 33: 2, 11: 1, 12: 1, 13: 2, 14: 2, 20: 1, 24: 1, 25: 2, 31: 1}
OK	66673-40-3	C1CC(=O)N[C@H]1CO	{32: 1, 2: 1, 11: 2, 12: 1, 20: 1, 25: 1}
OK	66675-32-9	CCC(C(Cl)Cl)Cl	{1: 1, 2: 1, 3: 2, 17: 3}
OK	66688-32-2	CC(CCI)CI	{19: 2, 1: 1, 2: 3, 3: 1}
OK	66688-35-5	CCCCC(I)I	{19: 2, 1: 1, 2: 3, 3: 1}
OK	66688-47-9	CC(CC(C)F)F	{16: 2, 1: 2, 2: 1, 3: 2}
OK	66688-49-1	CC(C)(CI)CI	{1: 2, 2: 2, 19: 2, 4: 1}
OK	66688-56-0	CCC=CCI	{1: 1, 2: 2, 19: 1, 6: 2}
OK	6669-36-9	C1COOO1	{11: 2, 23: 3}
OK	667-27-6	CCOC(=O)C(F)(F)Br	{1: 1, 2: 1, 4: 1, 16: 2, 18: 1, 28: 1}
OK	667-49-2	C(=C(F)F)(C(=O)F)F	{16: 4, 24: 1, 7: 2}
OK	667-50-5	CN(C)C(=O)C(F)F	{16: 2, 1: 2, 3: 1, 24: 1, 33: 1}
OK	66701-25-5	CC(C)C[C@@H](C(=O)NCCCCN=C(N)N)NC(=O)[C@@H]1[C@H](O1)C(=O)O	{1: 2, 2: 5, 3: 2, 7: 1, 12: 2, 34: 1, 23: 1, 24: 2, 27: 1, 30: 2, 31: 2}
OK	66702-99-6	CC(=C(C)I)C	{1: 3, 19: 1, 7: 2}
OK	66703-02-4	CCCC=CI	{1: 1, 2: 2, 19: 1, 6: 2}
OK	6671-66-5	C1CC2CC=CC(C1)C2	{11: 5, 12: 2, 14: 2}
OK	6671-70-1	C1CC2C=CC1OO2	{11: 2, 12: 2, 14: 2, 23: 2}
OK	6671-85-8	C1C2CNC1C=C2	{32: 1, 11: 2, 12: 2, 14: 2}
OK	66719-30-0	CCCCC(C)(C(C)CC)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	66719-31-1	CCC(C)CC(C(C)CC)O	{1: 4, 2: 3, 3: 3, 20: 1}
OK	66719-32-2	CCCC(C)C(C)CCCO	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66719-33-3	CCC(C)CC(C)CCCO	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66719-34-4	CC(C)CCC(C)CCCO	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66719-36-6	CCCCCC(CC)CCO	{1: 2, 2: 7, 3: 1, 20: 1}
OK	66719-37-7	CCCCC(CC)(C(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	66719-41-3	CCC(C)CC(CO)C(C)C	{1: 4, 2: 3, 3: 3, 20: 1}
OK	66719-43-5	CCCCC(C)CC(CC)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66719-44-6	CCCCC(C)C(CCC)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66719-47-9	CCC(CC)C(C(C)(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66719-48-0	CCC(C)(CC)C(C(C)C)O	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66719-50-4	CC(C)C(C)(C(C)C)C(C)O	{1: 6, 3: 3, 4: 1, 20: 1}
OK	66719-51-5	CC(C)C(CCO)C(C)(C)C	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1}
OK	66719-52-6	CCCCC(CC(C)(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	66719-53-7	CCCC(C)C(CC(C)C)O	{1: 4, 2: 3, 3: 3, 20: 1}
OK	66719-54-8	CCC(C)CC(CC(C)C)O	{1: 4, 2: 3, 3: 3, 20: 1}
OK	66719-55-9	CC(C)CCCC(C(C)C)O	{1: 4, 2: 3, 3: 3, 20: 1}
OK	66728-50-5	CC(C)(C)OCCOC	{1: 4, 2: 2, 4: 1, 22: 2}
OK	66731-42-8	CCCCCCCCCCCCCC(=O)OC1C(C2(C(CC(CC3(C2C=C(C3=O)C)O)CO)C4C1(C4(C)C)OC(=O)C)O)C	{1: 6, 2: 13, 11: 2, 12: 6, 13: 4, 14: 1, 15: 1, 20: 3, 25: 1, 28: 2}
OK	66731-94-0	CCC(CC)C(C)C(CC)O	{1: 4, 2: 3, 3: 3, 20: 1}
OK	66731-95-1	CCCCC(C)CCC(C)O	{1: 3, 2: 5, 3: 2, 20: 1}
OK	66734-13-2	CCC(=O)OCC(=O)[C@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2[C@@H](CC4=CC(=O)C=C[C@]34C)Cl)O)C)C)OC(=O)CC	{1: 5, 2: 3, 11: 3, 12: 6, 13: 3, 14: 3, 15: 1, 17: 1, 20: 1, 24: 1, 25: 1, 28: 2}
OK	66735-69-1	CCC(=O)CCSC	{24: 1, 1: 2, 2: 3, 40: 1}
OK	6674-22-2	C1CCC2=NCCCN2CC1	{33: 1, 11: 8, 35: 1, 15: 1}
OK	66747-40-8	CC(=C)C(=O)OC.C=CC(=O)O.C=CC(=O)OCCO	{1: 2, 2: 2, 5: 3, 6: 2, 7: 1, 20: 1, 27: 1, 28: 2}
OK	6675-71-4	C1C=C2C3CC(C2=C1)C=C3	{11: 2, 12: 2, 14: 4, 15: 2}
OK	6675-72-5	C1CC2CC1C3=CCC=C23	{11: 4, 12: 2, 14: 2, 15: 2}
OK	66753-01-3	CCCCCCCCCCCCCCCCCC(=O)OCC(CC)(CO)COC(=O)CCCCCCCCCCCCCCCCC	{1: 3, 2: 36, 4: 1, 20: 1, 28: 2}
OK	66793-71-3	CC(C)(C)CCC(C)(C)O	{1: 5, 2: 2, 4: 2, 20: 1}
OK	66793-72-4	CC(C)C(CC(C)(C)C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	66793-73-5	CCC(C)(C)C(C)CCO	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66793-74-6	CCC(C)(C)C(C)(CC)O	{1: 5, 2: 2, 4: 2, 20: 1}
OK	66793-75-7	CC(CCCO)C(C)(C)C	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66793-76-8	CCCCCCCNCC	{1: 2, 2: 7, 31: 1}
OK	66793-80-4	CCCCC(C)C(CC)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	66793-81-5	CCCC(C)CCC(C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	66793-82-6	CCCC(CC(C)CC)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	66793-83-7	CC(C)CCCCC(C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	66793-84-8	CCC(CCCC(C)C)O	{1: 3, 2: 4, 3: 2, 20: 1}
OK	66793-85-9	CCCC(CCC)CCO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	66793-86-0	CC(C)C(C)(C)C(C)(C)O	{1: 6, 3: 1, 4: 2, 20: 1}
OK	66793-87-1	CC(C(C)(C)C)C(C)(C)O	{1: 6, 3: 1, 4: 2, 20: 1}
OK	66793-88-2	CC(C(C)(C)C(C)(C)C)O	{1: 6, 3: 1, 4: 2, 20: 1}
OK	66793-89-3	CCC(C)C(C(C)(C)C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	66793-90-6	CCC(C)C(C)(C(C)C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	66793-91-7	CCC(C)(C)CC(C)(C)O	{1: 5, 2: 2, 4: 2, 20: 1}
OK	66793-92-8	CCC(C)(C)C(C(C)C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	66793-93-9	CC(C)C(C)CC(C)(C)O	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1}
OK	66793-94-0	CCC(CC)(CC)C(C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66793-95-1	CCC(CC)C(C)(C)CO	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66793-96-2	CCC(CC)(C(C)(C)C)O	{1: 5, 2: 2, 4: 2, 20: 1}
OK	66793-97-3	CCC(C)(CC)C(C)(C)O	{1: 5, 2: 2, 4: 2, 20: 1}
OK	66793-98-4	CCC(C)(CC(C)C)CO	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66793-99-5	CCCC(CC(C)(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66794-02-3	CCCC(CC)C(C)(C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66794-03-4	CCCC(CC)(C(C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66794-04-5	CCCC(C)C(CC)CO	{1: 3, 2: 4, 3: 2, 20: 1}
OK	66794-05-6	CCC(CC)C(C)(CC)O	{1: 4, 2: 3, 3: 1, 4: 1, 20: 1}
OK	66794-06-7	CCC(C)CC(CC)CO	{1: 3, 2: 4, 3: 2, 20: 1}
OK	66794-07-8	CCC(CCC(C)C)CO	{1: 3, 2: 4, 3: 2, 20: 1}
OK	66794-30-7	C(C(F)F)C(F)F	{16: 4, 2: 1, 3: 2}
OK	66794-36-3	C(C(CF)F)F	{16: 3, 2: 2, 3: 1}
OK	66795-86-6	C/C=C(\C)/C(=O)O[C@H]1[C@@H]([C@@]2([C@@H](C[C@@]3(C(=CCC4[C@]3(CCC5[C@@]4(CC[C@H]([C@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)C)C2CC1(C)C)C)O)CO)OC(=O)C.C/C=C(/C)\C(=O)O[C@H]1[C@@H]([C@@]2([C@@H](C[C@@]3(C(=CCC4[C@]3(CCC5[C@@]4(CC[C@H]([C@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)C)C2CC1(C)C)C)O)CO)OC(=O)C	{1: 18, 2: 8, 6: 2, 7: 2, 11: 14, 12: 44, 13: 12, 14: 2, 15: 2, 20: 24, 22: 6, 23: 6, 27: 2, 28: 4}
OK	6680-73-5	C[C@@H]1C(C(C(=O)O[C@@H]2CCN3C2C(=CC3)COC(=O)C1(C)O)(CO)O)C	{1: 3, 2: 1, 33: 1, 11: 4, 12: 4, 13: 2, 14: 1, 15: 1, 20: 3, 28: 2}
OK	66809-05-0	CC(C)(C)C1=C(C(=C1C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 4: 4, 15: 4}
OK	66809-06-1	CC(C)(C)C12C3(C1(C23C(C)(C)C)C(C)(C)C)C(C)(C)C	{1: 12, 4: 4, 13: 4}
OK	66810-87-5	CCC(C)(CC(C)(C)C)O	{1: 5, 2: 2, 4: 2, 20: 1}
OK	66826-72-0	C(C1C(O1)Cl)Cl	{17: 2, 2: 1, 12: 2, 23: 1}
OK	66826-73-1	C([C@@H]1[C@H](O1)Cl)Cl	{17: 2, 2: 1, 12: 2, 23: 1}
OK	66826-84-4	CCCCCCCCCCCSCCC	{40: 1, 1: 2, 2: 12}
OK	6683-71-2	CCCCCCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 11, 3: 1}
OK	66843-04-7	CCC/C=C(\C)/C1(C(=O)NC(=O)NC1=O)C	{32: 2, 1: 3, 2: 2, 6: 1, 7: 1, 13: 1, 25: 3}
OK	66848-41-7	CC1C=C(CCC1C#N)C	{1: 2, 37: 1, 11: 2, 12: 2, 14: 1, 15: 1}
OK	66857-17-8	C(CC(=O)NCCO)CO	{24: 1, 2: 5, 20: 2, 31: 1}
OK	66857-22-5	C(CC(=O)N(CCO)CCO)CO	{24: 1, 33: 1, 2: 7, 20: 3}
OK	66859-63-0	CCCSC(CC)(CC)C(=O)N	{1: 3, 2: 4, 4: 1, 40: 1, 24: 1, 30: 1}
OK	6688-11-5	C1CCCC(CCC1)C=O	{26: 1, 11: 7, 12: 1}
OK	66893-81-0	CC(C)(C)[N+](=O)C=C1C=CN(C=C1)[O-]	{1: 3, 4: 1, 6: 1, 33: 2, 14: 4, 15: 1, 29: 2}
OK	669-81-8	CC1CCCC(N1C)C	{1: 3, 11: 3, 12: 2, 33: 1}
OK	66903-23-9	CC1CCCC(C1)OOC2CCCC(C2)C	{1: 2, 11: 8, 12: 4, 22: 2}
OK	66922-18-7	CC(C)(C)C1CCCC(N1)C(C)(C)C	{32: 1, 1: 6, 11: 3, 4: 2, 12: 2}
OK	66929-46-2	C1CCC(CC1)NC(=O)NCCO	{2: 2, 11: 5, 12: 1, 20: 1, 24: 1, 31: 2}
OK	66929-86-0	C=C1C2CCC1C3C2CC3	{11: 4, 12: 4, 5: 1, 15: 1}
OK	66929-89-3	C=C1C2C=CC1C3C2CC3	{11: 2, 12: 4, 5: 1, 14: 2, 15: 1}
OK	66930-02-7	CC1(C2C1C3CCC2C3=C)C	{1: 2, 5: 1, 11: 2, 12: 4, 13: 1, 15: 1}
OK	66941-08-0	CCCC(C)C1(C(=O)NC(=O)N(C1=O)C)C	{32: 1, 1: 4, 2: 2, 3: 1, 33: 1, 13: 1, 25: 3}
OK	66941-81-9	CC=C(C)C1(C(=O)NC(=O)NC1=O)CC=C	{32: 2, 1: 2, 2: 1, 5: 1, 6: 2, 7: 1, 13: 1, 25: 3}
OK	66943-05-3	C1COCCOCCOCCOCCN1	{32: 1, 11: 10, 23: 4}
OK	66946-48-3	C1CSC2=C(S1)SC(=C3SC4=C(S3)SCCS4)S2	{41: 8, 11: 4, 15: 6}
OK	66955-43-9	CC(=O)OOCl(=O)(=O)=O	{1: 1, 28: 1, 29: 3, 22: 1, 17: 1}
OK	6696-47-5	C[C@@H]1C[C@@H]([C@H]([C@@H](O1)O[C@H]2[C@H](C[C@@]3(CO3)C(=O)[C@@H]([C@H]([C@H]([C@H](OC(=O)[C@@H]([C@H]([C@@H]2C)O[C@H]4C[C@@H]([C@H]([C@@H](O4)C)O)OC)C)C)C)O)C)C)O)N(C)C.Cl	{1: 11, 33: 1, 11: 4, 12: 17, 13: 1, 17: 1, 20: 3, 22: 3, 23: 3, 25: 1, 28: 1}
OK	66964-26-9	C[C@]12CCC(=O)C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@H]3CC[C@@H]4OC(=O)C=C)C	{1: 2, 5: 1, 6: 1, 11: 9, 12: 5, 13: 2, 25: 1, 28: 1}
OK	66967-60-0	COC(=O)COCCOCCOC=C	{1: 1, 2: 5, 5: 1, 6: 1, 22: 3, 28: 1}
OK	66968-89-6	CCC1(C(=O)NC(=O)N(C1=O)C)/C(=C/C)/C	{32: 1, 1: 4, 2: 1, 33: 1, 6: 1, 7: 1, 13: 1, 25: 3}
OK	6697-15-0	CCCCCCCCCCCCC(CCCCCCCCCCCC)C1CCCCC1	{11: 5, 1: 2, 2: 22, 3: 1, 12: 1}
OK	6698-74-4	C(#N)C(F)(Br)Br	{16: 1, 18: 2, 4: 1, 37: 1}
OK	67-21-0	CCSCCC(C(=O)O)N	{1: 1, 2: 3, 3: 1, 40: 1, 27: 1, 30: 1}
OK	67-42-5	C(COCCOCCN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O	{33: 2, 2: 10, 27: 4, 22: 2}
OK	67-43-6	C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O	{33: 3, 2: 9, 27: 5}
OK	67-52-7	C1C(=O)NC(=O)NC1=O	{32: 2, 25: 3, 11: 1}
OK	67-56-1	CO	{1: 1, 20: 1}
OK	67-62-9	CON	{1: 1, 30: 1, 22: 1}
OK	67-63-0	CC(C)O	{1: 2, 3: 1, 20: 1}
OK	67-64-1	CC(=O)C	{24: 1, 1: 2}
OK	67-66-3	C(Cl)(Cl)Cl	{17: 3, 3: 1}
OK	67-72-1	C(C(Cl)(Cl)Cl)(Cl)(Cl)Cl	{17: 6, 4: 2}
OK	67-73-2	C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CO)C[C@@H](C5=CC(=O)C=C[C@@]53C)F)F)O	{1: 4, 2: 1, 11: 3, 12: 5, 13: 5, 14: 3, 15: 1, 16: 2, 20: 2, 23: 2, 24: 1, 25: 1}
OK	67-78-7	CC(=O)OCC(=O)[C@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)OC(=O)C)O	{1: 4, 2: 1, 11: 4, 12: 4, 13: 4, 14: 3, 15: 1, 16: 1, 20: 2, 24: 1, 25: 1, 28: 2}
OK	67-92-5	CCN(CC)CCOC(=O)C1(CCCCC1)C2CCCCC2.Cl	{1: 2, 2: 4, 33: 1, 11: 10, 12: 1, 13: 1, 17: 1, 28: 1}
OK	67-96-9	CC1CCC(CC1=CC=C2CCCC3(C2CCC3C(C)C=CC(C)C(C)C)C)O	{1: 6, 3: 3, 6: 4, 11: 8, 12: 4, 13: 1, 15: 2, 20: 1}
OK	67-97-0	CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C	{1: 4, 2: 3, 3: 2, 5: 1, 6: 2, 11: 8, 12: 3, 13: 1, 15: 3, 20: 1}
OK	67-99-2	CN1C(=O)C23CC4=CC=CC(C4N2C(=O)C1(SS3)CO)O	{1: 1, 2: 1, 33: 2, 41: 2, 11: 1, 12: 2, 13: 2, 14: 3, 15: 1, 20: 2, 25: 2}
OK	670-54-2	C(#N)C(=C(C#N)C#N)C#N	{37: 4, 7: 2}
OK	670-80-4	C1CCC(=CC1)N2CCOCC2	{23: 1, 33: 1, 11: 8, 14: 1, 15: 1}
OK	67004-64-2	CN1CCCC1CCO	{1: 1, 2: 2, 33: 1, 11: 3, 12: 1, 20: 1}
OK	67023-84-1	CC(=CCCC(=CCCC(=CCCl)C)C)C	{1: 4, 2: 5, 17: 1, 6: 3, 7: 3}
OK	6703-79-3	CCCCCCCCCCC(CCCCCCCCCC)CC1CCCC1	{11: 4, 1: 2, 2: 19, 3: 1, 12: 1}
OK	6703-81-7	CCCCCCCCCCC(CCCCCCCCCC)C1CCCC1	{11: 4, 1: 2, 2: 18, 3: 1, 12: 1}
OK	6703-82-8	CCCCCCCCCCCCCCCCCCCCCC1CCCC1	{1: 1, 2: 20, 11: 4, 12: 1}
OK	6703-98-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 98}
OK	6703-99-7	CCCCCCCCCCC(CCCCCCCCCC)C1CCCCC1	{11: 5, 1: 2, 2: 18, 3: 1, 12: 1}
OK	67037-37-0	C(CC(C(F)F)(C(=O)O)N)CN	{2: 3, 3: 1, 4: 1, 16: 2, 27: 1, 30: 2}
OK	6704-00-3	CCCCCCCCCCC(CCCCCCCCCC)CC1CCCCC1	{11: 5, 1: 2, 2: 19, 3: 1, 12: 1}
OK	6704-15-0	CC(CSCC(C)O)O	{40: 1, 1: 2, 2: 2, 3: 2, 20: 2}
OK	6704-31-0	C1C(=O)CO1	{25: 1, 11: 2, 23: 1}
OK	6705-49-3	C1CC2C(O2)C(=O)C1	{25: 1, 11: 3, 12: 2, 23: 1}
OK	6705-50-6	C1CC2C=CC1O2	{11: 2, 12: 2, 14: 2, 23: 1}
OK	67050-04-8	CC/C=C/C1(C(=O)NC(=O)NC1=O)C(C)C	{32: 2, 1: 3, 2: 1, 3: 1, 6: 2, 13: 1, 25: 3}
OK	67050-26-4	CCC(C)C1(C(=O)NC(=O)N(C1=O)C)CC	{32: 1, 1: 4, 2: 2, 3: 1, 33: 1, 13: 1, 25: 3}
OK	67050-97-9	CCC/C(=C\CC)/C1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 3, 2: 4, 6: 1, 7: 1, 13: 1, 25: 3}
OK	67051-25-6	CC(C)/C=C/C1(C(=O)NC(=O)NC1=O)C(C)C	{32: 2, 1: 4, 3: 2, 6: 2, 13: 1, 25: 3}
OK	67051-27-8	CC(C)C1(C(=O)NC(=O)N(C1=O)C)CC=C(C)C	{32: 1, 1: 5, 2: 1, 3: 1, 33: 1, 6: 1, 7: 1, 13: 1, 25: 3}
OK	67055-59-8	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)OCC5CCCCC5)C)C	{1: 5, 2: 4, 3: 2, 11: 14, 12: 7, 13: 2, 22: 1}
OK	6706-53-2	C1CC23CCC2(C1)C=CC=C3	{11: 5, 13: 2, 14: 4}
OK	6707-12-6	C1C2CC(C1C=C2)(CO)CO	{2: 2, 11: 2, 12: 2, 13: 1, 14: 2, 20: 2}
OK	6707-60-4	C1CCCCCOCCCCOC(=O)CCCC1	{11: 14, 28: 1, 23: 1}
OK	6708-14-1	C1CC(=C2CCC2)C1	{11: 6, 15: 2}
OK	6708-17-4	C1CCCC(CCC1)C2CCCCCCC2	{11: 14, 12: 2}
OK	67084-43-9	CN(C(=O)NCCNC(=O)N(C)N=O)N=O	{1: 2, 2: 2, 33: 2, 34: 2, 24: 2, 29: 2, 31: 2}
OK	6709-22-4	CC1=CCC(C1(C)C)C(=O)O	{1: 3, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 27: 1}
OK	6709-39-3	CC(=CCCC(=C)C)C	{1: 3, 2: 2, 5: 1, 6: 1, 7: 2}
OK	67092-87-9	CC(C)N1CCN1C(C)C	{11: 2, 1: 4, 3: 2, 33: 2}
OK	67092-88-0	CN(C)N1CCC1	{1: 2, 11: 3, 33: 2}
OK	67092-89-1	CCCN(CCC)N1CCC1	{1: 2, 2: 4, 11: 3, 33: 2}
OK	67092-90-4	C1CCN(CC1)N2CCC2	{33: 2, 11: 8}
OK	67092-91-5	C1CN(C1)N2CCC2	{33: 2, 11: 6}
OK	671-36-3	CC1CCCCN1C	{1: 2, 11: 4, 12: 1, 33: 1}
OK	671-42-1	C1CCNC(=O)C(C1)N	{32: 1, 25: 1, 11: 4, 12: 1, 30: 1}
OK	671-51-2	CCOC(=O)N1CC1	{1: 1, 2: 1, 11: 2, 28: 1, 33: 1}
OK	671-56-7	C=CC(CCl)O	{2: 1, 3: 1, 5: 1, 6: 1, 17: 1, 20: 1}
OK	67105-55-9	C1CC2C3(C1OO2)CC3	{11: 4, 12: 2, 13: 1, 23: 2}
OK	6711-48-4	CN(C)CCCNCCCN(C)C	{1: 4, 2: 6, 33: 2, 31: 1}
OK	6712-79-4	CC1([C@@H]2C[C@H]1C(=C)[C@@H](C2)O)C	{1: 2, 5: 1, 11: 2, 12: 3, 13: 1, 15: 1, 20: 1}
OK	6712-98-7	CC(CN(CCO)CCO)O	{1: 1, 2: 5, 3: 1, 20: 3, 33: 1}
OK	6713-03-7	CC(CSCCO)O	{40: 1, 1: 1, 2: 3, 3: 1, 20: 2}
OK	67137-81-9	CC(C)(C)N1CCCO1	{1: 3, 11: 3, 4: 1, 33: 1, 23: 1}
OK	67139-52-0	CNC(=O)OC1CC2CCC(C1)N2C	{1: 2, 33: 1, 11: 4, 12: 3, 28: 1, 31: 1}
OK	67139-56-4	CCCNC1CC2CCC(C1)N2C	{1: 2, 2: 2, 33: 1, 11: 4, 12: 3, 31: 1}
OK	6714-00-7	CC=CCCC(=O)C	{24: 1, 1: 2, 2: 2, 6: 2}
OK	6714-29-0	C1CN2C(=N1)C=CN2	{32: 1, 33: 1, 35: 1, 11: 2, 14: 2, 15: 1}
OK	67144-63-2	CN1C2C3CCC(C3)C2N1C	{1: 2, 11: 3, 12: 4, 33: 2}
OK	67144-64-3	CN1C2CC(N1C)C3C2C=C3	{1: 2, 11: 1, 12: 4, 14: 2, 33: 2}
OK	67151-63-7	CC(CN(CCCN(C)C)CCCN(C)C)O	{1: 5, 2: 7, 3: 1, 20: 1, 33: 3}
OK	67161-18-6	CC(C)CN=CN(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 33: 1, 34: 1}
OK	672-15-1	C(CO)[C@@H](C(=O)O)N	{27: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	67210-36-0	CCCCCCCC[C@@H]1CO1	{1: 1, 2: 7, 11: 1, 12: 1, 23: 1}
OK	6723-30-4	C1CCOC(C1)ON	{11: 4, 12: 1, 30: 1, 22: 1, 23: 1}
OK	67233-91-4	CCOC(=O)CCCCCCCC=C	{1: 1, 2: 8, 28: 1, 5: 1, 6: 1}
OK	6724-53-4	C1CCC(CC1)C(CC2CCCCN2)C3CCCCC3.C(=C\C(=O)O)\C(=O)O	{32: 1, 2: 1, 3: 1, 6: 2, 11: 14, 12: 3, 27: 2}
OK	6725-64-0	C(S)S	{2: 1, 39: 2}
OK	67254-49-3	C=C1CC2C1C=C2	{11: 1, 12: 2, 5: 1, 14: 2, 15: 1}
OK	6728-26-3	CCCC=CC=O	{1: 1, 2: 2, 26: 1, 6: 2}
OK	6728-31-0	CCC=CCCC=O	{1: 1, 2: 3, 26: 1, 6: 2}
OK	67280-25-5	C1=CC(=O)C(=O)C(=O)C=C1	{25: 3, 14: 4}
OK	67282-24-0	CCCCC(C)(CCCC)Cl	{1: 3, 2: 6, 4: 1, 17: 1}
OK	67282-66-0	C1CC2CCCC(C1)N2N=NN3C4CCCC3CCC4	{33: 2, 34: 2, 11: 12, 12: 4}
OK	67291-83-2	CCCC(C)(C)C#CC	{1: 4, 2: 2, 4: 1, 10: 2}
OK	673-33-6	CC(=CN1CCCCC1)C	{1: 2, 11: 5, 33: 1, 6: 1, 7: 1}
OK	673-66-5	C1CCCNC(=O)CC1	{32: 1, 25: 1, 11: 6}
OK	673-79-0	CCOC(=O)CCSCCC(=O)OCC	{40: 1, 1: 2, 2: 6, 28: 2}
OK	673-84-7	CC=C(C)C=CC=C(C)C	{1: 4, 6: 4, 7: 2}
OK	673-93-8	C(#CCl)C(F)(F)F	{16: 3, 17: 1, 10: 2, 4: 1}
OK	67305-72-0	CCC(=O)NCCS	{24: 1, 1: 1, 2: 3, 39: 1, 31: 1}
OK	6731-21-1	C1CCC=CCC=CC1	{11: 5, 14: 4}
OK	6731-36-8	CC1CC(CC(C1)(OOC(C)(C)C)OOC(C)(C)C)(C)C	{1: 9, 4: 2, 11: 3, 12: 1, 13: 2, 22: 4}
OK	67313-66-0	C1C=CC=CC23C1(C2)CC=C3	{11: 3, 13: 2, 14: 6}
OK	67317-62-8	CCCCCCCCCC(=O)OCCl	{1: 1, 2: 9, 28: 1, 17: 1}
OK	67318-95-0	CN1CCCC2N1CCCC2	{1: 1, 11: 7, 12: 1, 33: 2}
OK	67329-11-7	CC(CCl)(CCl)C(=O)O	{1: 1, 2: 2, 27: 1, 4: 1, 17: 2}
OK	6733-01-3	C1(=C(C2(C1(C(=C2F)F)F)F)F)F	{16: 6, 13: 2, 15: 4}
OK	6734-98-1	CCC(C=CC)Cl	{1: 2, 2: 1, 3: 1, 6: 2, 17: 1}
OK	67342-98-7	CCCCCCCC(=O)C(C(=O)C)C(=O)OCC	{24: 2, 1: 3, 2: 7, 3: 1, 28: 1}
OK	6735-35-9	CCCN(CCO)CCO	{1: 1, 2: 6, 20: 2, 33: 1}
OK	6735-59-7	CN\1C=CC=C/C1=C\[NH+]=O	{1: 1, 6: 1, 33: 1, 14: 4, 15: 1, 29: 1, 31: 1}
OK	6737-11-7	CC(C=C)OC(=O)C	{1: 2, 3: 1, 28: 1, 5: 1, 6: 1}
OK	6737-24-2	C=CC(=O)NC(C(=O)O)O	{3: 1, 5: 1, 6: 1, 20: 1, 24: 1, 27: 1, 31: 1}
OK	6738-27-8	CC=C1C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C	{1: 7, 4: 2, 6: 1, 14: 2, 15: 3, 25: 1}
OK	67385-09-5	CC(C)(C)OC(=O)NCCS	{1: 3, 2: 2, 4: 1, 39: 1, 28: 1, 31: 1}
OK	67385-21-1	CCC(CC=COC)(CC=COC)COC(=O)C	{1: 4, 2: 4, 4: 1, 6: 4, 22: 2, 28: 1}
OK	6739-34-0	CCCOC(=O)C1CCCCC1	{1: 1, 2: 2, 11: 5, 12: 1, 28: 1}
OK	67398-96-3	CN(C)C1C2CCC(C2)C1OC	{1: 3, 11: 3, 12: 4, 22: 1, 33: 1}
OK	674-26-0	CC1(CCOC(=O)C1)O	{1: 1, 11: 3, 20: 1, 13: 1, 28: 1}
OK	674-65-7	C(COCCC(F)(F)F)C(F)(F)F	{16: 6, 2: 4, 4: 2, 22: 1}
OK	674-76-0	C/C=C/C(C)C	{1: 3, 3: 1, 6: 2}
OK	674-81-7	C(=NN=O)(N)N	{34: 2, 29: 1, 30: 2, 7: 1}
OK	674-82-8	C=C1CC(=O)O1	{11: 1, 28: 1, 5: 1, 15: 1}
OK	67401-91-6	COC1C2CCC1C3C2C4CC3C=C4	{1: 1, 11: 3, 12: 7, 22: 1, 14: 2}
OK	67411-25-0	CC12C(CCO1)SCS2	{1: 1, 41: 2, 11: 3, 12: 1, 13: 1, 23: 1}
OK	67428-02-8	C=CCCON=O	{34: 1, 5: 1, 6: 1, 2: 2, 22: 1, 29: 1}
OK	6746-94-7	C#CC1CC1	{9: 1, 10: 1, 11: 2, 12: 1}
OK	67465-27-4	CC[C@H]1CC(C1(C)C)C(=O)C	{1: 4, 2: 1, 11: 1, 12: 2, 13: 1, 24: 1}
OK	67483-72-1	C#CC#CC#CC#CC#N	{9: 1, 10: 7, 37: 1}
OK	67487-86-9	CC1=CC=CC12CC2	{1: 1, 11: 2, 13: 1, 14: 3, 15: 1}
OK	67497-82-9	CC12CCCCC1(C=CCC2)O	{1: 1, 11: 6, 20: 1, 13: 2, 14: 2}
OK	675-20-7	C1CCNC(=O)C1	{32: 1, 25: 1, 11: 4}
OK	6750-34-1	CC(C)CCCC(C)CCCC(C)CCO	{1: 4, 2: 8, 3: 3, 20: 1}
OK	6750-60-3	C[C@@]1(CC[C@@H]2[C@@H]1[C@H]3[C@H](C3(C)C)CCC2=C)O	{1: 3, 5: 1, 11: 4, 12: 4, 13: 2, 15: 1, 20: 1}
OK	6752-33-6	CCCCCCN(CCO)CCO	{1: 1, 2: 9, 20: 2, 33: 1}
OK	6752-80-3	CC(C)CC(=O)/C=C(\C)/C=C	{1: 3, 2: 1, 3: 1, 5: 1, 6: 2, 7: 1, 24: 1}
OK	67526-05-0	CCC/C=C(\C)/C1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 3, 2: 3, 6: 1, 7: 1, 13: 1, 25: 3}
OK	67526-95-8	CCCCCCCC(=O)OC1C2C(=C(C1OC(=O)C(=CC)C)C)C3C(C(CC2(C)OC(=O)C)OC(=O)CCC)(C(C(=O)O3)(C)O)O	{1: 8, 2: 8, 6: 1, 7: 1, 11: 1, 12: 5, 13: 3, 15: 2, 20: 2, 28: 5}
OK	6753-98-6	CC1=CCC(C=CCC(=CCC1)C)(C)C	{1: 4, 11: 4, 13: 1, 14: 4, 15: 2}
OK	6754-13-8	C[C@@H]1C[C@@H]2[C@H]([C@@H]([C@]3([C@H]1C=CC3=O)C)O)C(=C)C(=O)O2	{1: 2, 5: 1, 11: 1, 12: 5, 13: 1, 14: 2, 15: 1, 20: 1, 25: 1, 28: 1}
OK	67557-56-6	CCCC(=O)OCN(C)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 28: 1, 29: 1}
OK	67599-05-7	CCCCCCCCC=CCCCCCCCC(=O)NCCNCCNCCNCCN	{1: 1, 2: 22, 6: 2, 24: 1, 30: 1, 31: 4}
OK	67599-30-8	CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C(CCO)CO	{1: 3, 2: 5, 34: 2, 8: 2, 11: 3, 12: 1, 13: 2, 20: 2, 29: 2}
OK	67599-31-9	CC1(CC(CC(C1)(C)CN)N)C.C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O	{1: 3, 2: 2, 34: 2, 8: 2, 11: 16, 12: 5, 13: 2, 28: 1, 29: 2, 30: 2}
OK	6760-99-2	C1CC2CCC(C1)N2.Cl	{32: 1, 17: 1, 11: 5, 12: 2}
OK	67616-77-7	CCCCC=CCCCCCCCCC#CCCOC1CCCCO1	{1: 1, 2: 13, 6: 2, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	67624-45-7	CCC=CC1(CCC(=O)OC1)CC	{1: 2, 2: 2, 6: 2, 11: 3, 13: 1, 28: 1}
OK	6763-46-8	CC(=O)OC[C@H]([C@@H]([C@@H]([C@H](C=O)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C	{1: 5, 2: 1, 3: 4, 28: 5, 26: 1}
OK	6763-93-5	CCOC(=O)CCN1CCCCCC1	{1: 1, 2: 3, 11: 6, 28: 1, 33: 1}
OK	67633-50-5	CC(=C)C(=O)OCCO.C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O	{1: 1, 2: 3, 5: 1, 7: 1, 8: 2, 11: 13, 12: 4, 34: 2, 20: 1, 28: 2, 29: 2}
OK	67633-84-5	CCCCCCCC/C=C\CCCCCCCC(=O)O.CN(C1CCCCC1)C2CCCCC2	{1: 2, 2: 14, 6: 2, 33: 1, 11: 10, 12: 2, 27: 1}
OK	67633-85-6	CCCCCCCC/C=C\CCCCCCCC(=O)O.C1CN2CCN1CC2	{1: 1, 2: 14, 6: 2, 33: 2, 11: 6, 27: 1}
OK	67633-97-0	CCC(C(=O)C)S	{24: 1, 1: 2, 2: 1, 3: 1, 39: 1}
OK	67634-05-3	CC1CC(C(C(C1)C)COC(=O)C)C	{1: 4, 2: 1, 11: 2, 12: 4, 28: 1}
OK	67634-13-3	CCC(C)(C)C(=C(C)C)C	{1: 6, 2: 1, 4: 1, 7: 2}
OK	67634-18-8	CCC(=C)C(=O)OCCC(C)C	{1: 3, 2: 3, 3: 1, 5: 1, 7: 1, 28: 1}
OK	67634-19-9	CCC(=C)C(=O)OCC(C)C	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1, 28: 1}
OK	67634-22-4	CC1CCC(C(C1)C)COC(=O)C	{1: 3, 2: 1, 11: 3, 12: 3, 28: 1}
OK	6765-39-5	CCCCCCCCCCCCCCCC=C	{1: 1, 2: 14, 5: 1, 6: 1}
OK	67662-97-9	CC(C)C1CC2CCC1C(C2)C=O	{11: 4, 1: 2, 26: 1, 3: 1, 12: 4}
OK	67662-98-0	CCCC1CC(CC(=O)C1)C	{1: 2, 2: 2, 11: 3, 12: 2, 25: 1}
OK	67662-99-1	CC(=O)C=CC1CC=CC(C1)(C)C	{1: 3, 6: 2, 11: 2, 12: 1, 13: 1, 14: 2, 24: 1}
OK	67663-01-8	CCCCCCC1C(CC(=O)O1)C	{1: 2, 2: 5, 11: 1, 12: 2, 28: 1}
OK	67663-02-9	CCC1C(O1)CCO	{1: 1, 2: 3, 12: 2, 20: 1, 23: 1}
OK	67663-04-1	CCCCCCC=CC(=O)OCCCCC	{1: 2, 2: 9, 28: 1, 6: 2}
OK	67664-94-2	C(C1(C(O1)Cl)Cl)Cl	{17: 3, 2: 1, 12: 1, 13: 1, 23: 1}
OK	67674-19-5	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 18, 6: 4, 33: 1, 20: 3, 27: 1}
OK	67674-35-5	CC(C)C1CCC(OC1=O)(C)C	{1: 4, 3: 1, 11: 2, 12: 1, 13: 1, 28: 1}
OK	67674-37-7	CCC=CCCC=CC(OCC)OCC	{1: 3, 2: 5, 3: 1, 22: 2, 6: 4}
OK	67674-38-8	CCOC(=O)C1(CC=C(CC1C)C)C(=O)C	{1: 4, 2: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1, 28: 1}
OK	67674-39-9	CC(C)(C)C1CCC(=CC1)CC#N	{1: 3, 2: 1, 4: 1, 37: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	67674-43-5	CC(=C)CCCC(=CC#N)C	{1: 2, 2: 3, 37: 1, 6: 1, 7: 2, 5: 1}
OK	67674-44-6	CC(=CCC1CCCC1(C=C)OC(=O)C)C	{1: 3, 2: 1, 5: 1, 6: 2, 7: 1, 11: 3, 12: 1, 13: 1, 28: 1}
OK	67674-45-7	CCC1(CCCC1CC=C(C)C)O	{1: 3, 2: 2, 6: 1, 7: 1, 11: 3, 12: 1, 13: 1, 20: 1}
OK	67674-49-1	C1CCCCC(=O)OCCCCCC2C(O2)CCC1	{28: 1, 11: 13, 12: 2, 23: 1}
OK	67674-50-4	C1CCCCCC=CCCC(=O)CCCCC1	{25: 1, 11: 13, 14: 2}
OK	67674-52-6	C(COC(=O)CO)N	{28: 1, 2: 3, 20: 1, 30: 1}
OK	67674-54-8	CCCCCCCCC(=O)NCCNCCNCCNCCN.CC(=O)O	{1: 2, 2: 15, 24: 1, 27: 1, 30: 1, 31: 4}
OK	67674-61-7	C=CCOCC(CO)O.C(COCCO)O.C(CSCCO)O	{2: 11, 3: 1, 5: 1, 6: 1, 40: 1, 20: 6, 22: 2}
OK	67674-65-1	CCCCOC(=O)/C=C/C(=O)OCCCC.CC(=C)C(=O)O.CC(=O)OC=C	{1: 4, 2: 6, 5: 2, 6: 3, 7: 1, 27: 1, 28: 3}
OK	677-21-4	C=CC(F)(F)F	{16: 3, 4: 1, 5: 1, 6: 1}
OK	677-41-8	CN(C)C(F)(F)F	{16: 3, 1: 2, 4: 1, 33: 1}
OK	677-56-5	C(C(C(F)(F)F)(F)F)F	{16: 6, 2: 1, 4: 2}
OK	677-69-0	C(C(F)(F)F)(C(F)(F)F)(F)I	{16: 7, 19: 1, 4: 3}
OK	677-70-3	C(C(F)(Cl)Cl)(C(F)(Cl)Cl)(O)O	{16: 2, 17: 4, 4: 3, 20: 2}
OK	677-71-4	C(C(F)(F)F)(C(F)(F)F)(O)O	{16: 6, 20: 2, 4: 3}
OK	677-93-0	C(C(C(C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 23, 19: 1, 4: 11}
OK	67700-24-7	CCCCC(CCCO)Cl	{1: 1, 2: 6, 3: 1, 20: 1, 17: 1}
OK	67700-99-6	CCCCCCCCCCCCCCCCN(C)CCCCCCCCCCCCCCCC	{1: 3, 2: 30, 33: 1}
OK	67707-85-1	CN1CCCNCCN(CCCN(CC1)C)C	{32: 1, 1: 3, 11: 10, 33: 3}
OK	67712-01-0	C1CC(CCC1CO)CO.C(CO)COCCCO.C(=C/C(=O)O)\C(=O)O	{2: 8, 6: 2, 11: 4, 12: 2, 20: 4, 22: 1, 27: 2}
OK	67712-10-1	CCCCCCCCCCCCCCCCCCOC(=O)C=C.C=CC(=O)O.C=CC(=O)OC1CCCCC1	{1: 1, 2: 17, 5: 3, 6: 3, 11: 5, 12: 1, 27: 1, 28: 2}
OK	67712-16-7	CCOC(=O)C(=C)C.CC(C)(C)NC(=O)C=C	{1: 5, 2: 1, 4: 1, 5: 2, 6: 1, 7: 1, 24: 1, 28: 1, 31: 1}
OK	67746-25-2	CCCCOC(=O)CSC	{40: 1, 1: 2, 2: 4, 28: 1}
OK	67746-26-3	CC1=CCC(C1(C)C)CCC2CCCC2O	{1: 3, 2: 2, 11: 4, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	67746-27-4	CC(=O)C1CCC2=C(C1)C(CCC2)(C)C	{1: 3, 11: 6, 12: 1, 13: 1, 15: 2, 24: 1}
OK	67746-28-5	CC(=C)CCCC1=CCC(CC1)(C)C=O	{1: 2, 2: 3, 5: 1, 7: 1, 11: 3, 13: 1, 14: 1, 15: 1, 26: 1}
OK	67746-30-9	CCCC=CC(OCC)OCC	{1: 3, 2: 4, 3: 1, 22: 2, 6: 2}
OK	67746-31-0	CCCC(=CC(C)CC)CO	{1: 3, 2: 4, 3: 1, 6: 1, 7: 1, 20: 1}
OK	67746-32-1	CCCC(=CC(C)CC)COC(=O)C	{1: 4, 2: 4, 3: 1, 6: 1, 7: 1, 28: 1}
OK	67749-11-5	CCCCCCCCCCCCCCCCOC(=O)C(C)(C)CCCCCC	{1: 4, 2: 20, 4: 1, 28: 1}
OK	67754-23-8	CC(=O)OCC(COCC(COC(=O)C)(COC(=O)C)COC(=O)C)(COC(=O)C)COC(=O)C	{1: 6, 2: 8, 4: 2, 22: 1, 28: 6}
OK	67755-97-9	CC(C)C(C=O)O	{1: 2, 26: 1, 3: 2, 20: 1}
OK	67760-89-8	CCC(CC(=C)C)O	{1: 2, 2: 2, 3: 1, 5: 1, 7: 1, 20: 1}
OK	67760-91-2	CC(C)C(CC(=C)C)O	{1: 3, 2: 1, 3: 2, 5: 1, 7: 1, 20: 1}
OK	67762-65-6	CCCCCCCCCCCCCCC(C/C=C/C(CC=O)C(=O)O)NC(C)(C)CCCCCCCCC.CCCCCCCCCC(C)(C)N	{1: 7, 2: 31, 3: 2, 4: 2, 6: 2, 26: 1, 27: 1, 30: 1, 31: 1}
OK	67762-68-9	CCCCCCCCC=CCCCCCCCC(=O)OCC(CC)(CO)COC(=O)CCCCCCCC	{1: 3, 2: 25, 4: 1, 6: 2, 20: 1, 28: 2}
OK	67763-08-0	CCCCCCCCCCCCCCCCCCCCOCC	{1: 2, 2: 20, 22: 1}
OK	67763-12-6	C1=C/C(=C\NN=C(N)N)/C(=O)C=C1	{34: 1, 6: 1, 7: 1, 14: 4, 15: 1, 25: 1, 30: 2, 31: 1}
OK	67763-16-0	CCCCCCCCCCCCC1=CC(=O)N(C1=O)C(=O)CCCCCCCC=CCCCCCCCC	{1: 2, 2: 25, 6: 2, 33: 1, 14: 1, 15: 1, 24: 1, 25: 2}
OK	67763-17-1	CC(C)CCCCCCCCCCCCCCCOC(=O)C(C(C(=O)OCCCCCCCCCCCCCCCC(C)C)O)O	{1: 4, 2: 30, 3: 4, 20: 2, 28: 2}
OK	67763-19-3	CCCCCCC(=O)OCC(CO)(CO)COC(=O)CCCCCC	{1: 2, 2: 14, 4: 1, 20: 2, 28: 2}
OK	67774-31-6	CC1CN(CC(N1)C)N=O	{32: 1, 1: 2, 34: 1, 33: 1, 11: 2, 12: 2, 29: 1}
OK	67784-41-2	CC1(CCCC1(C)C)C	{1: 4, 11: 3, 13: 2}
OK	67784-94-5	C(CCC(=O)O)CC(=O)O.C(COCCO)O.C(C(CO)(CO)CO)O	{20: 6, 2: 12, 27: 2, 4: 1, 22: 1}
OK	67785-35-7	CCOC(=O)C=C.CC(=C)C(=O)O.COC(=O)C=C.C=C(CC(=O)O)C(=O)O	{1: 3, 2: 2, 5: 4, 6: 2, 7: 2, 27: 3, 28: 2}
OK	67785-38-0	CC(=C)C(=O)O.C=CC(=O)NCO.C=CC(=O)O	{1: 1, 2: 1, 5: 3, 6: 2, 7: 1, 20: 1, 24: 1, 27: 2, 31: 1}
OK	67785-65-3	CCCCCCCCCC(C)C(OCC)OCC	{1: 4, 2: 10, 3: 2, 22: 2}
OK	67785-66-4	CC(C)C(=O)OCCC(C)CC(C)(C)C	{1: 6, 2: 3, 3: 2, 4: 1, 28: 1}
OK	67785-67-5	CC(CCC=C(C)C)CCOC(CCCCCCCCC=C)OCCC(C)CCC=C(C)C	{1: 6, 2: 16, 3: 3, 5: 1, 6: 3, 7: 2, 22: 2}
OK	67785-68-6	C=CCCCCCCCCCOC(CCCCCCCCC=C)O	{2: 17, 3: 1, 5: 2, 6: 2, 20: 1, 22: 1}
OK	67785-70-0	CC1CCC(C2(C1)OCC(CO2)O)C(C)C	{1: 3, 3: 1, 11: 5, 12: 3, 13: 1, 20: 1, 23: 2}
OK	67785-73-3	CCCCCCCCC(OCC=C(C)CCC=C(C)C)OCC=C(C)CCC=C(C)C	{1: 7, 2: 13, 3: 1, 6: 4, 7: 4, 22: 2}
OK	67785-74-4	CC(=CCCC(=CCOC(CCCCCCCCC=C)OCC=C(C)CCC=C(C)C)C)C	{1: 6, 2: 14, 3: 1, 5: 1, 6: 5, 7: 4, 22: 2}
OK	67785-79-9	CCCCCCCCCCCCCCC/C=C/C1=NCCN1CCO.Cl	{1: 1, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 17: 1, 20: 1}
OK	67785-98-2	C1COCCN1.C(C(=O)O)O	{32: 1, 2: 1, 11: 4, 20: 1, 23: 1, 27: 1}
OK	67792-55-6	C1C2C=CC1C3C2C(=O)C3=O	{25: 2, 11: 1, 12: 4, 14: 2}
OK	678-26-2	C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F	{16: 12, 4: 5}
OK	678-74-0	C(C(C(C(C(F)F)(F)F)(F)F)(F)F)I	{16: 8, 19: 1, 2: 1, 3: 1, 4: 3}
OK	678-77-3	C(=O)(C(C(C(C(=O)Cl)(F)F)(F)F)(F)F)Cl	{16: 6, 17: 2, 4: 3, 24: 2}
OK	678-78-4	C(=O)(C(C(C(C(=O)F)(F)F)(F)F)(F)F)F	{16: 8, 24: 2, 4: 3}
OK	678-95-5	C=CC(=O)OCC(C(C(COC(=O)C=C)(F)F)(F)F)(F)F	{2: 2, 4: 3, 5: 2, 6: 2, 16: 6, 28: 2}
OK	67800-82-2	CCC(C1CC2C(C2(C)C)C=C1C)O	{1: 4, 2: 1, 3: 1, 11: 1, 12: 3, 13: 1, 14: 1, 15: 1, 20: 1}
OK	67800-83-3	CCCC=C(CC)C(CCC(C)C)O	{1: 4, 2: 5, 3: 2, 6: 1, 7: 1, 20: 1}
OK	67800-85-5	CC(C)C=C(C)C1CCC(=O)O1	{1: 3, 3: 1, 6: 1, 7: 1, 11: 2, 12: 1, 28: 1}
OK	67800-87-7	CC(=C)CCCC(=C)CC#N	{1: 1, 2: 4, 37: 1, 5: 2, 7: 2}
OK	67801-11-0	CC1=CCC(C1(C)C)C=CCC(C)O	{1: 4, 2: 1, 3: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	67801-12-1	CCC(C=CCC1CC=C(C1(C)C)C)O	{1: 4, 2: 2, 3: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	67801-13-2	CC(=CC1C(=C)CCCC1(C)C)C=O	{1: 3, 5: 1, 6: 1, 7: 1, 11: 3, 12: 1, 13: 1, 15: 1, 26: 1}
OK	67801-14-3	CC1=CCCC(C1C=C(C)C=O)(C)C	{1: 4, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 26: 1}
OK	67801-15-4	CC1=CCC(C1(C)C)C=CC(C)C(=O)C	{1: 5, 3: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	67801-19-8	CCC(C(=CCC1CC=C(C1(C)C)C)C)O	{1: 5, 2: 2, 3: 1, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	67801-20-1	CC1=CCC(C1(C)C)/C=C\C(C)C(C)O	{1: 5, 3: 2, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	67801-24-5	CCC(=C)C(=O)OC1CC(CCC1C(C)C)C	{1: 4, 2: 1, 3: 1, 5: 1, 7: 1, 11: 3, 12: 3, 28: 1}
OK	67801-25-6	CCC(C(C)C=CC1CC=C(C1(C)C)C)O	{1: 5, 2: 1, 3: 2, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	67801-28-9	CCC(=C)C(=O)OCC(=C)C	{1: 2, 2: 2, 28: 1, 5: 2, 7: 2}
OK	67801-38-1	CC1CC(=CC(C1C=CC(=O)C)C)C	{1: 4, 6: 2, 11: 1, 12: 3, 14: 1, 15: 1, 24: 1}
OK	67801-61-0	CCCCCCCCC=CCCCCCCCC(=O)NCCCN(C)C.CCC(=O)O	{1: 4, 2: 18, 6: 2, 33: 1, 24: 1, 27: 1, 31: 1}
OK	67801-62-1	CCCCCCCCCCCC(=O)NCCCN(C)C.CCC(=O)O	{1: 4, 2: 14, 33: 1, 24: 1, 27: 1, 31: 1}
OK	67801-67-6	CCCCCCCCC(CCCCCC)C(=O)OCC(C)(C)COC(=O)C(CCCCCC)CCCCCCCC	{1: 6, 2: 26, 3: 2, 4: 1, 28: 2}
OK	67801-69-8	CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCC(CCCCCCCCC)O	{1: 2, 2: 36, 3: 1, 20: 1, 28: 1}
OK	67809-15-8	CCCN(C(=O)C)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 24: 1, 29: 1}
OK	67810-86-0	CC(C1CCCCC1)OC	{11: 5, 1: 2, 3: 1, 12: 1, 22: 1}
OK	67814-48-6	CC1C(=O)CCC2(C13CCCC2(CC3)C)C	{1: 3, 11: 7, 12: 1, 13: 3, 25: 1}
OK	67815-89-8	CCCCCCCCC=CCCCCCCCC(=O)NCC(C)OC(=O)C=CC(=O)O	{1: 2, 2: 15, 3: 1, 6: 4, 24: 1, 27: 1, 28: 1, 31: 1}
OK	67815-92-3	COCCCOCCCOCC=C	{1: 1, 2: 7, 22: 3, 5: 1, 6: 1}
OK	67816-12-0	CCCCCCC(CCCCC1CCCCC1)C(CC(=O)O)C(=O)O	{1: 1, 2: 10, 3: 2, 11: 5, 12: 1, 27: 2}
OK	67816-13-1	CCCCCCC1CCC(C(C1)C(=O)OCC(CC)CCCC)CCCCCCCC(=O)OCC(CC)CCCC	{1: 5, 2: 22, 3: 2, 11: 3, 12: 3, 28: 2}
OK	67827-82-1	CCCCC(CC)CC(=C)C(=O)O.CCCCOC(=O)C(=C)C.C=CC(=O)O	{1: 4, 2: 8, 3: 1, 5: 3, 6: 1, 7: 2, 27: 2, 28: 1}
OK	67828-13-1	CCCCCCCCOC(=O)/C=C\C(=O)O.CC(=O)OC=C	{1: 2, 2: 7, 5: 1, 6: 3, 27: 1, 28: 2}
OK	67828-15-3	CNC.CN(C)CCCN.C1C(O1)CCl	{1: 4, 2: 4, 33: 1, 11: 1, 12: 1, 17: 1, 23: 1, 30: 1, 31: 1}
OK	6784-47-0	C1CSC(S1)C2SCCS2	{41: 4, 11: 4, 12: 2}
OK	67843-61-2	C1CC2CC1C3C2C(=O)C3=O	{25: 2, 11: 3, 12: 4}
OK	67843-74-7	C1[C@H](O1)CCl	{17: 1, 2: 1, 11: 1, 12: 1, 23: 1}
OK	67844-46-6	CCCCCCC(CCC(=O)OCC(CC)CCCC)C(CCCC1CCCC=C1)C(=O)OCC(CC)CCCC	{1: 5, 2: 20, 3: 4, 11: 3, 12: 1, 14: 2, 28: 2}
OK	67845-27-6	CCC(=O)OCCCCCCCC(C)C	{1: 3, 2: 8, 3: 1, 28: 1}
OK	67845-29-8	CCOC(=O)C1C(C2CC1C=C2)C	{1: 2, 2: 1, 11: 1, 12: 4, 14: 2, 28: 1}
OK	67845-31-2	CCCC(=O)OC1C(C2CCC1(C2)C)(C)C	{1: 4, 2: 2, 11: 3, 12: 2, 13: 2, 28: 1}
OK	67845-32-3	CC(C)C(=O)OC1C(C2CCC1(C2)C)(C)C	{1: 5, 3: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	67845-35-6	CC1CC(CC2(C1)OCCCO2)(C)C	{1: 3, 11: 6, 12: 1, 13: 2, 23: 2}
OK	67845-41-4	CCCCCCCCC(C(CCCCCCCC(=O)OCC1(COCC(C1O)(COC(=O)CCCCCCCC(C(CCCCCCCC)Br)Br)COC(=O)CCCCCCCC(C(CCCCCCCC)Br)Br)CO)Br)Br	{1: 3, 2: 46, 3: 6, 11: 2, 12: 1, 13: 2, 18: 6, 20: 2, 23: 1, 28: 3}
OK	67845-43-6	CCCCCCCCCCOCCOCCOCCOCCOCCOCCOC(=O)C=CC(=O)O	{1: 1, 2: 21, 6: 2, 22: 6, 27: 1, 28: 1}
OK	67845-44-7	CCC=CCCC=CCCO	{1: 1, 2: 5, 20: 1, 6: 4}
OK	67845-45-8	CC1CCC2C13CCC(C(C3)C2(C)C)(C)OCC=C(C)C	{1: 6, 2: 1, 6: 1, 7: 1, 11: 5, 12: 3, 13: 3, 22: 1}
OK	67845-47-0	CCCOC1CCCCCCCCCCC1	{1: 1, 2: 2, 11: 11, 12: 1, 22: 1}
OK	67845-50-5	CC(C=C(C)CCC=C(C)C)O	{1: 4, 2: 2, 3: 1, 6: 2, 7: 2, 20: 1}
OK	67845-54-9	CCC(C=C(C)CCC=C(C)C)O	{1: 4, 2: 3, 3: 1, 6: 2, 7: 2, 20: 1}
OK	67845-56-1	CCCCCC(COC(=O)CC)O	{1: 2, 2: 6, 3: 1, 20: 1, 28: 1}
OK	67845-57-2	CC(C)CCC=C1CCCC1=O	{1: 2, 2: 2, 3: 1, 6: 1, 11: 3, 15: 1, 25: 1}
OK	67845-58-3	CCCC1CCC(C(C1)OC)OC(=O)C	{1: 3, 2: 2, 11: 3, 12: 3, 22: 1, 28: 1}
OK	67845-62-9	CC1CO1.C(CO)N.C(CO)NCCO	{1: 1, 2: 6, 11: 1, 12: 1, 20: 3, 23: 1, 30: 1, 31: 1}
OK	67845-89-0	CC1(CC(CC(N1)(C)C)Br)C	{32: 1, 1: 4, 11: 2, 12: 1, 13: 2, 18: 1}
OK	67845-90-3	CC1(CC(CC(N1)(C)C)C#N)C	{32: 1, 1: 4, 37: 1, 11: 2, 12: 1, 13: 2}
OK	67845-92-5	CC1(CC(CC(N1)(C)C)C(=O)OCCCCCCCCOC(=O)C2CC(NC(C2)(C)C)(C)C)C	{32: 2, 1: 8, 2: 8, 11: 4, 12: 2, 13: 4, 28: 2}
OK	67845-94-7	CCCCCCCCCCCCCCCCC=C1C(C(=O)O1)CCCCCCCCCCCCCC	{1: 2, 2: 28, 6: 1, 12: 1, 15: 1, 28: 1}
OK	67845-95-8	CCCCCCCCCCCCCCCCC1C(=CCCCCCCCCCCCCCC)OC1=O	{1: 2, 2: 28, 6: 1, 12: 1, 15: 1, 28: 1}
OK	67846-00-8	CC1(CC(CC(N1)(C)C)C(=O)Cl)C	{32: 1, 1: 4, 11: 2, 12: 1, 13: 2, 17: 1, 24: 1}
OK	67846-04-2	CCCCCCCCC=CCCCCCCCC1=[N+](CCN1CCO)CCO.[Cl-]	{1: 1, 2: 18, 6: 2, 33: 2, 11: 2, 15: 1, 17: 1, 20: 2}
OK	67846-20-2	CCCN(CCC)CCC.CC(=O)O	{1: 4, 2: 6, 27: 1, 33: 1}
OK	67846-26-8	CCCCCCCCCCCCCCCC(=O)O.C(C(CO)(CO)CO)O.C1(C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C(=O)O	{1: 1, 2: 18, 4: 1, 12: 2, 13: 3, 15: 2, 17: 6, 20: 4, 27: 3}
OK	67846-39-3	CCOC(=O)C=C.COC(=O)C=C.C=CC(=O)NCO	{1: 2, 2: 2, 5: 3, 6: 3, 20: 1, 24: 1, 28: 2, 31: 1}
OK	67846-63-3	C(COCN1C2C(N(C1=O)COCCO)N(C(=O)N2COCCO)COCCO)O	{33: 4, 2: 12, 12: 2, 20: 4, 22: 4, 25: 2}
OK	67846-67-7	CCCCCCCCC=CCCCCCCCCN(CC(=O)O)C1CCCCC1	{1: 1, 2: 16, 6: 2, 33: 1, 11: 5, 12: 1, 27: 1}
OK	6785-23-5	CCCCCCCCCCCC1CCCC1	{1: 1, 2: 10, 11: 4, 12: 1}
OK	6785-70-2	C[C@]12CC[C@@H](C[C@]1(CC[C@@H]3C2C(C[C@]4([C@@]3(CCC4C5=CC(=O)OC5)O)C=O)O)O)O	{1: 1, 11: 9, 12: 5, 13: 4, 14: 1, 15: 1, 20: 4, 26: 1, 28: 1}
OK	67856-65-9	COCCN(CCOC)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 22: 2, 29: 1}
OK	67856-66-0	CCOCCN(CCOCC)N=O	{1: 2, 2: 6, 33: 1, 34: 1, 22: 2, 29: 1}
OK	67856-68-2	C(CCl)N(CCCl)N=O	{17: 2, 2: 4, 34: 1, 29: 1, 33: 1}
OK	67859-52-3	CCCCCC(O)O.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 9, 3: 1, 8: 2, 11: 8, 12: 4, 34: 2, 20: 2, 27: 2, 29: 2}
OK	67859-54-5	CCCCCCSCCC(=O)OC	{40: 1, 1: 2, 2: 7, 28: 1}
OK	67859-56-7	CCCCCCSCCC(=O)OCC(CO)O	{1: 1, 2: 9, 3: 1, 40: 1, 20: 2, 28: 1}
OK	67859-57-8	CCCCC(CC)C(=O)OCCS	{1: 2, 2: 6, 3: 1, 28: 1, 39: 1}
OK	67859-58-9	CC(CC(=O)OCCS)CC(C)(C)C	{1: 4, 2: 4, 3: 1, 4: 1, 39: 1, 28: 1}
OK	67859-77-2	CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO	{1: 1, 2: 24, 33: 2, 11: 1, 12: 3, 14: 2, 20: 6, 27: 2}
OK	67859-81-8	CC(C)NC(=O)C=C.CC(=C)C(=O)OCCNC(C)(C)C.CC(=C)C(=O)OCCO	{1: 7, 2: 4, 3: 1, 4: 1, 5: 3, 6: 1, 7: 2, 20: 1, 24: 1, 28: 2, 31: 2}
OK	67859-83-0	CCCCOC(=O)C=C.CC(=O)OC=C.COC(=O)/C=C\C(=O)OC	{1: 4, 2: 3, 28: 4, 5: 2, 6: 4}
OK	67860-10-0	CCC(CC)C=C1CCCC1=O	{1: 2, 2: 2, 3: 1, 6: 1, 11: 3, 15: 1, 25: 1}
OK	67860-11-1	CCC(=O)OC1C(C2CCC1(C2)C)(C)C	{1: 4, 2: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	67873-92-1	CC1(CC2(CC(C1)(CNC2)N)C)C	{32: 1, 1: 3, 11: 5, 13: 3, 30: 1}
OK	67873-93-2	CCCCCCCCCCOC(=O)CC(C)(C)CC(C)C(=O)OCCCCCCCC	{1: 5, 2: 18, 3: 1, 4: 1, 28: 2}
OK	67873-94-3	CCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOC(=O)C	{1: 2, 2: 24, 28: 1, 22: 6}
OK	67873-95-4	CCCCCCCCCCCC(=O)OCC(C)(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC	{1: 4, 2: 33, 4: 1, 28: 3}
OK	67873-96-5	CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)C)OC(=O)CCCCCCCC=CCCCCCCCC	{1: 3, 2: 30, 3: 1, 28: 3, 6: 4}
OK	67873-97-6	CCCCCCCCCCCCCCCCCC(=O)O.CC(C)N	{27: 1, 1: 3, 2: 16, 3: 1, 30: 1}
OK	67874-04-8	CCCCCCCCCCCC(=O)OCC(CO)(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC	{1: 3, 2: 34, 4: 1, 20: 1, 28: 3}
OK	67874-05-9	CCCCCCCCCC(=O)OCC(C)(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCCC	{1: 4, 2: 27, 4: 1, 28: 3}
OK	67874-06-0	CCCCCCCC(=O)OCC(C)(COC(=O)CCCCCCC)COC(=O)CCCCCCC	{1: 4, 2: 21, 4: 1, 28: 3}
OK	67874-35-5	CC(C)CCCCCC(CN)N	{1: 2, 2: 6, 3: 2, 30: 2}
OK	67874-38-8	CCCCCC=CCC=CCCCCCCCC(=O)OCCCCCC(C)C	{1: 3, 2: 17, 3: 1, 28: 1, 6: 4}
OK	67874-44-6	C(CSCCC(=O)OCCS)C(=O)OCCS	{40: 1, 2: 8, 28: 2, 39: 2}
OK	67874-65-1	C(CS)C(=O)OCC(CO)O	{28: 1, 2: 4, 3: 1, 20: 2, 39: 1}
OK	67874-72-0	CCC(C)(C)C1CCCCC1OC(=O)C	{1: 4, 2: 1, 4: 1, 11: 4, 12: 2, 28: 1}
OK	67874-74-2	CCC(=O)OC1CCC(CC1)C(C)(C)CC	{1: 4, 2: 2, 4: 1, 11: 4, 12: 2, 28: 1}
OK	67874-80-0	CCCC(=O)OCCC(C)CCCC(C)C	{1: 4, 2: 7, 3: 2, 28: 1}
OK	67874-81-1	C[C@@H]1CC[C@@H]2C13CC[C@@]([C@H](C3)C2(C)C)(C)OC	{1: 5, 11: 5, 12: 3, 13: 3, 22: 1}
OK	67874-90-2	CCCCCCCCCCCCS.C=CC=C.C=CC(=O)O	{1: 1, 2: 11, 5: 3, 6: 3, 39: 1, 27: 1}
OK	67874-93-5	CC(=C)C(=O)O.CC(=C)C(=O)OC.C1CN1CCO	{1: 3, 2: 2, 5: 2, 7: 2, 11: 2, 20: 1, 33: 1, 27: 1, 28: 1}
OK	67874-96-8	CCCCC(CC)COC(=O)C=C.CCN(CC)CCOC(=O)C(=C)C.CC(=C)C(=O)OC	{1: 7, 2: 9, 3: 1, 5: 3, 6: 1, 7: 2, 33: 1, 28: 3}
OK	67875-41-6	C(CCC=NCCOCCO)CC=NCCOCCO	{2: 12, 34: 2, 20: 2, 22: 2, 6: 2}
OK	67879-60-1	CC1COC(O1)C(C)C	{11: 1, 1: 3, 3: 1, 12: 2, 23: 2}
OK	6788-84-7	C1COO1	{11: 2, 23: 2}
OK	6788-85-8	C1CN=C1	{35: 1, 11: 2, 14: 1}
OK	67883-79-8	CCC=CCCOC(=O)C(=CC)C	{1: 3, 2: 3, 28: 1, 6: 3, 7: 1}
OK	6789-38-4	C1=CC2C=CC(N2)C=C1	{32: 1, 12: 2, 14: 6}
OK	6789-80-6	CC/C=C\CC=O	{1: 1, 2: 2, 26: 1, 6: 2}
OK	6789-94-2	CCN1CCCC(C1)N	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 30: 1}
OK	67890-79-3	CC(C)C12CCC(C=C1)(C(C2)C=O)C	{1: 3, 3: 1, 11: 3, 12: 1, 13: 2, 14: 2, 26: 1}
OK	67892-94-8	CCCCCCCCCCCCCCCCCCNC(=O)OCCN(CCCC)CCOC(=O)NCCCCCCNC(=O)OCCN(CCCC)CCOC(=O)NCCCCCCCCCCCCCCCCCC	{1: 4, 2: 54, 28: 4, 33: 2, 31: 4}
OK	67892-99-3	C=CC(=O)OCCOCCOCCOCCOCCOCC1CCCO1	{2: 11, 5: 1, 6: 1, 11: 3, 12: 1, 22: 5, 23: 1, 28: 1}
OK	67893-05-4	CCCC(=O)C(C)CC(=O)OCC	{24: 1, 1: 3, 2: 4, 3: 1, 28: 1}
OK	67893-06-5	CC1CCC2C3CCC(C2C1)C3(C)C	{1: 3, 11: 5, 12: 5, 13: 1}
OK	67893-07-6	CC1C=C(CCC1C2OCCO2)C	{1: 2, 11: 4, 12: 3, 14: 1, 15: 1, 23: 2}
OK	67893-27-0	CCCCCC(C)(C)OC(=O)/C=C\C(=O)OC(C)(C)CCCCC.CCOC(=O)/C=C\C(=O)O.CC(=O)OC=C	{1: 8, 2: 9, 4: 2, 5: 1, 6: 5, 27: 1, 28: 4}
OK	67893-28-1	CCCCOC(=O)C=C.CCC(COC(=O)/C=C(/C(=O)OCC)\N1CCNC1=O)O.CC(=O)OC=C	{32: 1, 1: 4, 2: 6, 3: 1, 5: 2, 6: 3, 7: 1, 11: 2, 20: 1, 25: 1, 33: 1, 28: 4}
OK	679-86-7	C(C(C(F)F)(F)F)F	{16: 5, 2: 1, 3: 1, 4: 1}
OK	679-87-8	C(C(C(F)F)(F)F)I	{16: 4, 19: 1, 2: 1, 3: 1, 4: 1}
OK	6790-27-8	CCCCCCCCC#CCC	{1: 2, 2: 8, 10: 2}
OK	67905-08-2	CCCC(C(CC)COC(=O)C=C)OC(=O)C=C	{1: 2, 2: 4, 3: 2, 5: 2, 6: 2, 28: 2}
OK	67905-09-3	CCCC(C)(C)COC(=O)C(=C)C	{1: 4, 2: 3, 4: 1, 5: 1, 7: 1, 28: 1}
OK	67905-19-5	C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 31, 27: 1, 4: 15}
OK	67905-23-1	CCC(CO)(CO)COC(=O)CCS	{1: 1, 2: 6, 4: 1, 39: 1, 20: 2, 28: 1}
OK	67905-42-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C(=C)C	{1: 2, 2: 33, 28: 1, 5: 1, 7: 1}
OK	67905-43-5	CC(=C)C(=O)OCC#CCOC(=O)C(=C)C	{1: 2, 2: 2, 5: 2, 7: 2, 10: 2, 28: 2}
OK	67905-44-6	CCC(COC(=O)C(=C)C)OC	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1, 22: 1, 28: 1}
OK	67905-46-8	CCCCCCC(C)COC(=O)C(=C)C	{1: 3, 2: 6, 3: 1, 5: 1, 7: 1, 28: 1}
OK	67905-48-0	C=CC(=O)OCCCCC(COC(=O)C=C)O	{2: 5, 3: 1, 5: 2, 6: 2, 20: 1, 28: 2}
OK	67905-49-1	CCCCCCCC(C)COC(=O)C(=C)C	{1: 3, 2: 7, 3: 1, 5: 1, 7: 1, 28: 1}
OK	67905-50-4	CCCCCCCCC(C)CCNCCOC(=O)C(=C)C	{1: 3, 2: 11, 3: 1, 5: 1, 7: 1, 28: 1, 31: 1}
OK	67905-51-5	CC(=C)C(=O)OCC1C(C(C(=C(C1(Cl)Cl)Cl)Cl)(Cl)Cl)COC(=O)C(=C)C	{1: 2, 2: 2, 5: 2, 7: 2, 12: 2, 13: 2, 15: 2, 17: 6, 28: 2}
OK	67905-77-5	C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(COCCO)O	{2: 9, 8: 2, 11: 8, 12: 4, 34: 2, 20: 2, 22: 1, 27: 2, 29: 2}
OK	67905-86-6	CCCCCCCC/C=C\CCCCCCCCN.C(CNCCN)N.C(CCl)Cl	{1: 1, 2: 21, 6: 2, 17: 2, 30: 3, 31: 1}
OK	67906-92-7	CC(C)COC(=O)C=CC(=O)O	{1: 2, 2: 1, 3: 1, 6: 2, 27: 1, 28: 1}
OK	67907-32-8	CC1CC(C(C1N)CN)(C)C	{1: 3, 2: 1, 11: 1, 12: 3, 13: 1, 30: 2}
OK	67920-94-9	CC(C)C12CCC(CC1C=O)(C=C2)C	{1: 3, 3: 1, 11: 3, 12: 1, 13: 2, 14: 2, 26: 1}
OK	67922-65-0	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O	{1: 2, 2: 24, 27: 2, 6: 8}
OK	67923-51-7	CCCCCCCCC(=O)OCCC(C)CC(C)(C)C	{1: 5, 2: 10, 3: 1, 4: 1, 28: 1}
OK	67923-53-9	CC1CC(=CC(C1C=CC(C)O)C)C	{1: 4, 3: 1, 6: 2, 11: 1, 12: 3, 14: 1, 15: 1, 20: 1}
OK	67923-54-0	CC(=O)OC1CCCC=CCCC=CCC1	{1: 1, 11: 7, 12: 1, 14: 4, 28: 1}
OK	67923-55-1	CCOC1=C(CCC1=O)C	{1: 2, 2: 1, 11: 2, 15: 2, 22: 1, 25: 1}
OK	67923-56-2	CCCCCCCCCCOC(CCCCCCCCC)O	{1: 2, 2: 17, 3: 1, 20: 1, 22: 1}
OK	67923-75-5	C/C=C/C=C.CC(=C)CC(C)(C)C.C1CC=CC1	{1: 5, 2: 1, 4: 1, 5: 2, 6: 3, 7: 1, 11: 3, 14: 2}
OK	67923-77-7	CCCCCCCC/C=C\CCCCCCCC(=O)O.CCN(CC)CCO	{1: 3, 2: 18, 6: 2, 33: 1, 20: 1, 27: 1}
OK	67923-79-9	CCCCCCC(C)(OCCCCCCCCCCC(C)C)OCCCCCCCCCCC(C)C	{1: 6, 2: 25, 3: 2, 4: 1, 22: 2}
OK	67923-83-5	CCOC(CCCCCC(C)C)OCC	{1: 4, 2: 7, 3: 2, 22: 2}
OK	67923-86-8	CC=C(C)CC=C(C)CC(OCCCCCCCCCCC(C)C)OCCCCCCCCCCC(C)C	{1: 7, 2: 22, 3: 3, 6: 2, 7: 2, 22: 2}
OK	67924-04-3	C(CO)N(CCO)CCO.C(C(=O)O)O	{33: 1, 2: 7, 27: 1, 20: 4}
OK	67924-06-5	C(CCC#N)CC#N.C(CCl)Cl	{17: 2, 2: 6, 37: 2}
OK	67924-07-6	C(CCCNCCCCCCN)CCN.C(CCl)Cl	{17: 2, 2: 14, 30: 2, 31: 1}
OK	67924-08-7	CCC1(CCC(CC1)CN)CN.C(CCl)Cl	{1: 1, 2: 5, 11: 4, 12: 1, 13: 1, 17: 2, 30: 2}
OK	67924-09-8	C(CCC(=O)N)CCN.C(CCl)Cl	{24: 1, 17: 2, 2: 7, 30: 2}
OK	67924-10-1	C(CCC#N)CCN.C(CCl)Cl	{17: 2, 2: 7, 37: 1, 30: 1}
OK	67924-15-6	CC(=O)O.C(CNCCNCCNCCNCCN)N	{1: 1, 2: 10, 27: 1, 30: 2, 31: 4}
OK	67931-79-7	CC1CC(C(C1CN)N)(C)C	{1: 3, 2: 1, 11: 1, 12: 3, 13: 1, 30: 2}
OK	67939-14-4	CC(CC(C)(C)O)O.CC(=O)OC=C	{1: 4, 2: 1, 3: 1, 4: 1, 5: 1, 6: 1, 20: 2, 28: 1}
OK	67939-18-8	CCCCOC(=O)/C=C\C(=O)OCCCC.CC(CC(C)(C)O)O.CC(=O)OC=C	{1: 6, 2: 7, 3: 1, 4: 1, 5: 1, 6: 3, 20: 2, 28: 3}
OK	67939-32-6	CCCCCCCCCCCCCCCCCCOC(=O)CC(C(CCCC)C(=O)OCCCCCCCCCCCCCCCCCC)(C(=O)O)O	{1: 3, 2: 38, 3: 1, 4: 1, 20: 1, 27: 1, 28: 2}
OK	67939-48-4	C1CN2CCN(C2=N1)/C=N/N=C(/N)\N3CCN4C3=NCC4.Cl	{33: 4, 34: 2, 35: 2, 6: 1, 7: 1, 11: 8, 15: 2, 17: 1, 30: 1}
OK	67939-53-1	CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.C(CO)N	{1: 1, 2: 14, 11: 1, 12: 3, 14: 2, 20: 1, 27: 2, 30: 1}
OK	67939-54-2	CC=C(Cl)Br	{1: 1, 18: 1, 17: 1, 6: 1, 7: 1}
OK	67939-55-3	CC(=CBr)Cl	{1: 1, 18: 1, 17: 1, 6: 1, 7: 1}
OK	67939-68-8	CC(CO)O.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 6, 3: 1, 8: 2, 11: 8, 12: 4, 34: 2, 20: 2, 27: 2, 29: 2}
OK	67939-73-5	C=C(CC(=O)O)C(=O)O.C(CCC(=O)O)CCN.C(CNCCN)N	{2: 10, 5: 1, 7: 1, 27: 3, 30: 3, 31: 1}
OK	67939-86-0	CCCCCCCCCC(=O)O.CC(C)N(CCO)CCO	{1: 3, 2: 12, 3: 1, 33: 1, 20: 2, 27: 1}
OK	67939-99-5	CCC(CC)COC(=O)C=CC(=O)OCC(CC)CC	{1: 4, 2: 6, 3: 2, 28: 2, 6: 2}
OK	6794-95-2	CN1CN1C	{1: 2, 11: 1, 33: 2}
OK	6794-96-3	CC1N2N1CCC2	{1: 1, 11: 3, 12: 1, 33: 2}
OK	67945-22-6	CCOC(=O)[C@H]1[C@@H](C1(C)C)C(=O)OCC	{1: 4, 2: 2, 12: 2, 13: 1, 28: 2}
OK	6795-60-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C=C)O)CCC4=CC(=O)CC[C@H]34	{1: 1, 5: 1, 6: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	6795-75-1	C(=C(/Cl)\Br)\Cl	{17: 2, 18: 1, 6: 1, 7: 1}
OK	6795-87-5	CCC(C)OC	{1: 3, 2: 1, 3: 1, 22: 1}
OK	6795-88-6	CCCC(C)OC	{1: 3, 2: 2, 3: 1, 22: 1}
OK	67952-29-8	C1COCCN1.C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O	{32: 1, 33: 2, 2: 6, 11: 4, 23: 1, 27: 4}
OK	67952-34-5	CC(CN(CC(C)O)CC(C)O)O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 3, 2: 5, 3: 3, 4: 1, 33: 1, 20: 4, 27: 3}
OK	67952-37-8	CCC(C)COC(=O)CCCCCCCCC=C	{1: 2, 2: 10, 3: 1, 5: 1, 6: 1, 28: 1}
OK	67952-44-7	CC(C)OCCOC(=O)NCO	{1: 2, 2: 3, 3: 1, 20: 1, 22: 1, 28: 1, 31: 1}
OK	67952-46-9	CC(C)OCCOC(=O)N	{1: 2, 2: 2, 3: 1, 22: 1, 28: 1, 30: 1}
OK	67952-49-2	CCCCCC(C)COC(=O)C=C	{1: 2, 2: 5, 3: 1, 5: 1, 6: 1, 28: 1}
OK	67952-52-7	CC1CC(C(CC1C2C(C(CC(C2OC(=O)C=C)O)C)C(=O)OC)OC(=O)C=C)O	{1: 3, 5: 2, 6: 2, 11: 3, 12: 9, 20: 2, 28: 3}
OK	67952-54-9	CC(=C(C)CCC=C(C)CC#N)C	{1: 4, 2: 3, 37: 1, 6: 1, 7: 3}
OK	67952-55-0	CC(C)C(C=C)C1CCC=CC1C=O	{1: 2, 3: 2, 5: 1, 6: 1, 11: 2, 12: 2, 14: 2, 26: 1}
OK	67952-57-2	CC(C)CCCC(C)OC(=O)C	{1: 4, 2: 3, 3: 2, 28: 1}
OK	67952-60-7	CC(C)(C=O)SSC	{40: 2, 1: 3, 26: 1, 4: 1}
OK	67952-61-8	CCCCCCCCC=CCBr	{1: 1, 2: 8, 18: 1, 6: 2}
OK	67952-76-5	CCCC(C(CC)COC(=O)C(=C)C)OC(=O)C(=C)C	{1: 4, 2: 4, 3: 2, 5: 2, 7: 2, 28: 2}
OK	67952-92-5	CCCCCCCCCCCCCCC/C=C/C1=NCCN1CCOC(=O)CCCCCCC/C=C\CCCCCCCC.C(C(=O)O)O	{1: 2, 2: 31, 35: 1, 6: 4, 33: 1, 11: 2, 15: 1, 20: 1, 27: 1, 28: 1}
OK	67952-95-8	CCNCCCN(CC)CCCNCC	{1: 3, 2: 9, 33: 1, 31: 2}
OK	67952-96-9	CC(CN(C)C)CN(C)C	{1: 5, 2: 2, 3: 1, 33: 2}
OK	67952-98-1	CCCCCCCCC(=O)O.C1COCCN1	{32: 1, 1: 1, 2: 7, 11: 4, 23: 1, 27: 1}
OK	67952-99-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O.CC(CN(CC(C)O)CC(C)O)O	{1: 4, 2: 29, 3: 3, 33: 1, 20: 3, 27: 1}
OK	67953-00-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O.CC(CNCC(C)O)O	{1: 3, 2: 28, 3: 2, 20: 2, 27: 1, 31: 1}
OK	67953-01-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O.CC(CN)O	{1: 2, 2: 27, 3: 1, 20: 1, 27: 1, 30: 1}
OK	67953-02-0	CC(C(CO)CO)O	{1: 1, 2: 2, 3: 2, 20: 3}
OK	67953-04-2	CCCC(C)CCC(C)N	{1: 3, 2: 4, 3: 2, 30: 1}
OK	67953-05-3	CCC(C)CC(CC)N	{1: 3, 2: 3, 3: 2, 30: 1}
OK	67953-13-3	CCCCCCCCCCCCCCCCCC(=O)OCC1(COCC(C1O)(CO)CO)CO	{1: 1, 2: 20, 11: 2, 12: 1, 13: 2, 20: 4, 23: 1, 28: 1}
OK	67953-14-4	CCCCCCCCCCCCCCCCCC(=O)OCC1(COCC(C1O)(CO)COC(=O)CCCCCCCCCCCCCCCCC)CO	{1: 2, 2: 36, 11: 2, 12: 1, 13: 2, 20: 3, 23: 1, 28: 2}
OK	67953-15-5	CCCCCCCCC(=O)OCC(C)(CO)CO	{1: 2, 2: 10, 4: 1, 20: 2, 28: 1}
OK	67953-19-9	CC(C)CC(C)OC(=O)C=CC(=O)OC(C)CC(C)C	{1: 6, 2: 2, 3: 4, 28: 2, 6: 2}
OK	67953-29-1	CCCCCCCC/C=C/CCCCCCCC(=O)N(CCO)CCOC(=O)/C=C\C(=O)O.C(CO)NCCO	{1: 1, 2: 22, 6: 4, 33: 1, 20: 3, 24: 1, 27: 1, 28: 1, 31: 1}
OK	67953-32-6	CC(C)COC(=O)NCO	{1: 2, 2: 2, 3: 1, 20: 1, 28: 1, 31: 1}
OK	67953-33-7	C(N1C2C(NC(=O)N2)N(C1=O)CO)O	{32: 2, 33: 2, 2: 2, 12: 2, 20: 2, 25: 2}
OK	67953-34-8	CCCCCCCCCCCCCCCCCC1=NCCN1CCNCCN2CCN=C2CCCCCCCCCCCCCCCCC.CC(=O)O	{1: 3, 2: 36, 35: 2, 33: 2, 11: 4, 15: 2, 27: 1, 31: 1}
OK	67953-37-1	CCCCCCC1C=CC(CC1C(=O)OCC(CC)CCCC)CCCCCCCC(=O)OCC(CC)CCCC	{1: 5, 2: 22, 3: 2, 11: 1, 12: 3, 14: 2, 28: 2}
OK	67953-53-1	C(CCCO)CCO.C(CCC(=O)O)CC(=O)O.C(C(CO)O)O	{27: 2, 2: 12, 3: 1, 20: 5}
OK	67953-54-2	C1C(O1)CCl.C(CNCCN)N.C(#N)N=C(N)N	{2: 5, 37: 1, 7: 1, 11: 1, 12: 1, 34: 1, 17: 1, 23: 1, 30: 4, 31: 1}
OK	67953-55-3	C1C(O1)CCl.C(CNCCNCCNCCN)N.C(#N)N=C(N)N	{2: 9, 37: 1, 7: 1, 11: 1, 12: 1, 34: 1, 17: 1, 23: 1, 30: 4, 31: 3}
OK	67953-77-9	CCCCN(CCCC)CO	{1: 2, 2: 7, 20: 1, 33: 1}
OK	67953-84-8	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(=O)CC(C)(C)NC(=O)C=C.C=CC#N	{1: 5, 2: 18, 4: 1, 5: 3, 6: 2, 7: 1, 24: 2, 28: 1, 37: 1, 31: 1}
OK	67953-86-0	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)O.C=CC#N	{1: 3, 2: 17, 5: 3, 6: 1, 7: 2, 27: 1, 28: 1, 37: 1}
OK	67969-59-9	CCC(C)C1OCCC(O1)C	{1: 3, 2: 1, 3: 1, 11: 2, 12: 2, 23: 2}
OK	67969-64-6	CC(CC1CC2CCC1C2)CO	{1: 1, 2: 2, 3: 1, 11: 4, 12: 3, 20: 1}
OK	67969-81-7	CC(C)COCC(C)OC(=O)C(C)Cl	{1: 4, 2: 2, 3: 3, 17: 1, 22: 1, 28: 1}
OK	67969-84-0	CCC(CC)(CBr)CBr	{1: 2, 2: 4, 4: 1, 18: 2}
OK	67970-04-1	CC(=C)C(=O)OCCCCOC(=O)C(=C)C.CC(=O)OC=C	{1: 3, 2: 4, 5: 3, 6: 1, 7: 2, 28: 3}
OK	67970-23-4	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCO)C(=O)N	{1: 1, 2: 20, 33: 1, 20: 1, 24: 2, 30: 1, 31: 1}
OK	67989-19-9	CC(=O)OCCCCCCCCOC(=O)C.C(CCC(=O)O)CC(=O)O	{1: 2, 2: 12, 27: 2, 28: 2}
OK	67989-20-2	CC(CCOC(=O)C)OC(=O)C.C(CCC(=O)O)CC(=O)O	{27: 2, 1: 3, 2: 6, 3: 1, 28: 2}
OK	67989-85-9	CC(=O)C1(CCC=CC1(C)C)C	{24: 1, 1: 4, 11: 2, 13: 2, 14: 2}
OK	67989-86-0	CCCCCCCCC=CCCCCCCCCOC(=O)CCCCCCCCCCCCCCC(C)C	{1: 3, 2: 29, 3: 1, 28: 1, 6: 2}
OK	67990-01-6	CC1CCC(CC1C(=O)O)Cl	{27: 1, 1: 1, 11: 3, 12: 3, 17: 1}
OK	67990-02-7	CC1CC(CCC1C(=O)O)Cl	{27: 1, 1: 1, 11: 3, 12: 3, 17: 1}
OK	67990-04-9	C(CNCCNCCNCCNCCC#N)C#N	{2: 10, 37: 2, 31: 4}
OK	67990-15-2	CC[N+]1=C(CCC1)C.[O-]Cl(=O)(=O)=O	{1: 2, 2: 1, 33: 1, 11: 3, 15: 1, 17: 1, 29: 4}
OK	67990-16-3	CC(C)CNC(C)(C)CC(C)NC1CCCCC1	{1: 5, 2: 2, 3: 2, 4: 1, 11: 5, 12: 1, 31: 2}
OK	67990-20-9	CC1CCCN(C1)CCN2CCCC(C2)C	{1: 2, 2: 2, 11: 8, 12: 2, 33: 2}
OK	67990-21-0	CCCN(C)C1CC1	{1: 2, 2: 2, 11: 2, 12: 1, 33: 1}
OK	67990-29-8	CCC(=O)OC1CC2CCC13C2C=CC3	{1: 1, 2: 1, 11: 4, 12: 3, 13: 1, 14: 2, 28: 1}
OK	68-11-1	C(C(=O)O)S	{2: 1, 27: 1, 39: 1}
OK	68-12-2	CN(C)C=O	{1: 2, 26: 1, 33: 1}
OK	68-22-4	CC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34	{1: 1, 9: 1, 10: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	68-23-5	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3CCC(=O)C4	{1: 1, 9: 1, 10: 1, 11: 9, 12: 3, 13: 2, 15: 2, 20: 1, 25: 1}
OK	68-26-8	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/CO)/C)/C	{1: 5, 2: 1, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 20: 1}
OK	68-41-7	C1[C@H](C(=O)NO1)N	{32: 1, 11: 1, 12: 1, 23: 1, 25: 1, 30: 1}
OK	68-76-8	C1CN1C2=CC(=O)C(=C(C2=O)N3CC3)N4CC4	{25: 2, 11: 6, 33: 3, 14: 1, 15: 3}
OK	68-95-1	CC(=O)N1CCC[C@H]1C(=O)O	{1: 1, 33: 1, 11: 3, 12: 1, 24: 1, 27: 1}
OK	68-96-2	CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)O	{1: 3, 11: 8, 12: 3, 13: 3, 14: 1, 15: 1, 20: 1, 24: 1, 25: 1}
OK	68003-27-0	CCCCCCCCCCCCCCCCCC(=O)NCCNCCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 38, 37: 1, 33: 1, 24: 2, 31: 2}
OK	68003-29-2	CCCCCCCCN(CCOCCO)CCOCCO	{1: 1, 2: 15, 20: 2, 22: 2, 33: 1}
OK	68003-53-2	CCCCCCCC1(CCCC1=O)C(=O)OC	{1: 2, 2: 6, 11: 3, 13: 1, 25: 1, 28: 1}
OK	68003-54-3	CC(C)(C)C=NCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 2, 34: 1}
OK	68003-65-6	C/C=C/N=CC(C)(C)C	{1: 4, 34: 1, 4: 1, 6: 3}
OK	68015-84-9	CCN.C(=O)(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)O	{1: 1, 2: 1, 4: 6, 16: 13, 27: 1, 30: 1}
OK	68015-85-0	CCN.C(=O)(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{1: 1, 2: 1, 4: 10, 16: 21, 27: 1, 30: 1}
OK	68015-99-6	CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O.C1COCCN1	{32: 1, 1: 1, 2: 18, 6: 2, 11: 4, 23: 1, 27: 1}
OK	68016-02-4	CCCCCCCCCCCCCCCCCC(=O)NCCNCCO.CC(C(=O)O)O	{1: 2, 2: 20, 3: 1, 20: 2, 24: 1, 27: 1, 31: 2}
OK	68017-33-4	CC(C#CC(=C)C)O	{1: 2, 3: 1, 5: 1, 7: 1, 10: 2, 20: 1}
OK	6802-75-1	CCOC(=O)C(=C(C)C)C(=O)OCC	{1: 4, 2: 2, 28: 2, 7: 2}
OK	68025-17-2	CCCCCCCCCCCCCCCCCC(=O)NCCNCCN(CCC#N)C(=O)CCCCCCCCCCCCCCCCC.CC(=O)O.CC(=O)O.CC(=O)O	{1: 5, 2: 38, 37: 1, 33: 1, 24: 2, 27: 3, 31: 2}
OK	68025-28-5	C(CCCCCC(C(=O)O)C(=O)O)CCCCC(C(=O)O)C(=O)O	{27: 4, 2: 10, 3: 2}
OK	68036-94-2	CC1CC2CCC1(C2(C)C)CC3CCCCC3=O	{1: 3, 2: 1, 11: 7, 12: 3, 13: 2, 25: 1}
OK	68037-30-9	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(=C/C(=O)O)\C(=O)O	{1: 1, 2: 12, 27: 3, 6: 6}
OK	68039-02-1	CCCCOC(=O)CCC(C)(C)C	{1: 4, 2: 5, 4: 1, 28: 1}
OK	68039-03-2	CC1=C(C(C(C1)C/C=C/C(=O)C)(C)C)C	{1: 5, 2: 1, 6: 2, 11: 1, 12: 1, 13: 1, 15: 2, 24: 1}
OK	68039-25-8	CC1=CCC=C(C2CC(C2CC1)(C)C)CCO	{1: 3, 2: 2, 11: 4, 12: 2, 13: 1, 14: 2, 15: 2, 20: 1}
OK	68039-26-9	CCCCCOC(=O)C(C)CC	{1: 3, 2: 5, 3: 1, 28: 1}
OK	68039-27-0	CCCC(=O)C(CC)C(=O)OC	{24: 1, 1: 3, 2: 3, 3: 1, 28: 1}
OK	68039-28-1	CCCCCC(CC(C(=O)OCC)(Cl)Cl)Cl	{1: 2, 2: 6, 3: 1, 4: 1, 17: 3, 28: 1}
OK	68039-30-5	CCCCCC1CC(C(=O)O1)(Cl)Cl	{1: 1, 2: 4, 11: 1, 12: 1, 13: 1, 17: 2, 28: 1}
OK	68039-31-6	CC(COCC=C)OCC(C)OC	{1: 3, 2: 3, 3: 2, 5: 1, 6: 1, 22: 3}
OK	68039-32-7	COCNC(=NCOC)NC#N	{1: 2, 2: 2, 37: 1, 7: 1, 34: 1, 22: 2, 31: 2}
OK	68039-37-2	C1C=CC2C1C3CC2C(C3)OCCO	{2: 2, 11: 3, 12: 5, 14: 2, 20: 1, 22: 1}
OK	68039-38-3	CC=CC(=O)OCCC(C)CCC=C(C)C	{1: 4, 2: 4, 3: 1, 6: 3, 7: 1, 28: 1}
OK	68039-70-3	CCCC=CCCC=CC(=O)OCC	{1: 2, 2: 5, 28: 1, 6: 4}
OK	68039-71-4	CC(C)CC(C)(C)CC=O	{1: 4, 2: 2, 3: 1, 4: 1, 26: 1}
OK	68039-72-5	CC(=O)OCCC1(OCCO1)C	{1: 2, 2: 2, 11: 2, 13: 1, 23: 2, 28: 1}
OK	68039-74-7	CCCCCCCC=CC#N	{1: 1, 2: 6, 37: 1, 6: 2}
OK	68039-76-9	CC(CC(C)(C)C)C(=C)CO	{1: 4, 2: 2, 3: 1, 4: 1, 5: 1, 7: 1, 20: 1}
OK	68039-77-0	CCC=CCCCCC#N	{1: 1, 2: 5, 37: 1, 6: 2}
OK	6805-41-0	CC=C(C)C(=O)OC1C(C2(C(CC1(C)C)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)OC7C(C(C(C(O7)CO)O)O)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)CO)OC(=O)C	{1: 9, 2: 4, 6: 1, 7: 1, 11: 7, 12: 22, 13: 6, 14: 1, 15: 1, 20: 12, 22: 3, 23: 3, 27: 1, 28: 2}
OK	68051-97-8	CCCCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCOC(=O)C(=C)C.CC(C)CCCCCCCOC(=O)C(=C)C.C=CN1CCCC1=O	{1: 11, 2: 61, 3: 1, 5: 6, 6: 1, 7: 5, 11: 3, 25: 1, 33: 1, 28: 5}
OK	68052-04-0	CCCCC(CC)COC(=O)CCCCC(=O)OCCCCCCCC(C)C	{1: 4, 2: 16, 3: 2, 28: 2}
OK	68052-21-1	C(CCC(=O)N(CCO)CCO)CCO	{24: 1, 33: 1, 2: 9, 20: 3}
OK	68052-35-7	CCCCCCCC(=O)O.CCN(CC)CCO	{1: 3, 2: 10, 27: 1, 20: 1, 33: 1}
OK	68052-38-0	C=CCCCCCCCCC(=O)OCCNCCO	{2: 12, 5: 1, 6: 1, 20: 1, 28: 1, 31: 1}
OK	68052-40-4	CC(CN)OC(=O)CCCCCCCCC=C	{1: 1, 2: 9, 3: 1, 5: 1, 6: 1, 28: 1, 30: 1}
OK	68052-41-5	CC(CNC(=O)CCCCCCCCC=C)O	{1: 1, 2: 9, 3: 1, 5: 1, 6: 1, 20: 1, 24: 1, 31: 1}
OK	68052-42-6	CC(CN)O.C=CCCCCCCCCC(=O)O	{1: 1, 2: 9, 3: 1, 5: 1, 6: 1, 20: 1, 27: 1, 30: 1}
OK	68052-68-6	CCN.C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{1: 1, 2: 1, 4: 14, 16: 29, 27: 1, 30: 1}
OK	68058-53-7	CCOC(C)(OCC)SCC	{40: 1, 1: 4, 2: 3, 4: 1, 22: 2}
OK	68058-56-0	CCOC(C(F)(F)F)(OCC)SCC	{1: 3, 2: 3, 4: 2, 40: 1, 16: 3, 22: 2}
OK	68067-33-4	CCCCCCCCCC(=O)OCC(C)CC	{1: 3, 2: 10, 3: 1, 28: 1}
OK	68071-23-8	CC1CCC2=C1CC3(CCC2C)C(O3)(C)C	{1: 4, 11: 5, 12: 2, 13: 2, 15: 2, 23: 1}
OK	68071-27-2	COCOC(=O)CCC(=O)O	{1: 1, 2: 3, 27: 1, 28: 1, 22: 1}
OK	68083-45-4	CCCCCCCCC=CCCCCCCCC1=NCCN1CCN.C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{1: 1, 2: 18, 35: 1, 4: 1, 6: 2, 33: 1, 11: 2, 15: 1, 20: 1, 27: 3, 30: 1}
OK	68083-46-5	CCCCCCCCC=CCCCCCCCC1=NCCN1CCN.C(C(=O)O)O	{1: 1, 2: 17, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 20: 1, 27: 1, 30: 1}
OK	68083-48-7	CCC(=NOC(=O)NCC1(CC(CC(C1)(C)C)NC(=O)ON=C(C)CC)C)C	{1: 7, 2: 3, 34: 2, 7: 2, 11: 3, 12: 1, 13: 2, 28: 2, 31: 2}
OK	68083-50-1	CCC(C(=O)OC)N1CC1	{1: 2, 2: 1, 3: 1, 33: 1, 11: 2, 28: 1}
OK	68083-57-8	CCCCCCCCC=CCC=O	{1: 1, 2: 8, 26: 1, 6: 2}
OK	68083-76-1	CNCCO.C(CCCN=C=O)CCN=C=O	{1: 1, 2: 8, 8: 2, 34: 2, 20: 1, 29: 2, 31: 1}
OK	68083-83-0	CN(CCO)C(=O)CCCO	{24: 1, 1: 1, 2: 5, 20: 2, 33: 1}
OK	68084-02-6	CCCCCCCC=CC(OCC)OCC	{1: 3, 2: 8, 3: 1, 22: 2, 6: 2}
OK	68084-04-8	CC(=CCCC1=CCCC(C1)C#N)C	{1: 2, 2: 2, 37: 1, 6: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	68084-05-9	CC(=CCCC1C=CCCC1C#N)C	{1: 2, 2: 2, 37: 1, 6: 1, 7: 1, 11: 2, 12: 2, 14: 2}
OK	68084-06-0	CCOC(CCC=CC)OCC	{1: 3, 2: 4, 3: 1, 22: 2, 6: 2}
OK	68084-08-2	CCOC(CC=O)C(C)C	{1: 3, 2: 2, 3: 2, 26: 1, 22: 1}
OK	68084-20-8	CCC(CO)(CO)COC(=O)CCCCCN	{1: 1, 2: 9, 4: 1, 20: 2, 28: 1, 30: 1}
OK	68092-54-6	CC1C(CC2CC1C2(C)C)CN.Cl	{1: 3, 2: 1, 11: 2, 12: 4, 13: 1, 17: 1, 30: 1}
OK	68092-57-9	C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O.C(CO)COCCCO	{2: 7, 34: 2, 8: 2, 11: 2, 13: 2, 14: 8, 20: 2, 22: 1, 29: 2}
OK	68092-67-1	CCN(CC)CCOC(C)CO	{1: 3, 2: 5, 3: 1, 33: 1, 20: 1, 22: 1}
OK	681-01-6	CCC(C)(N=O)Cl	{1: 2, 2: 1, 4: 1, 34: 1, 17: 1, 29: 1}
OK	681-57-2	CC(C)(CCC(=O)O)C(=O)O	{1: 2, 2: 2, 27: 2, 4: 1}
OK	68109-02-4	C1C2C3C=CC4C2C=CC15C3C54	{11: 1, 12: 6, 13: 1, 14: 4}
OK	68109-71-7	CCCCCCCCCCCCCNCC(=O)O	{1: 1, 2: 13, 27: 1, 31: 1}
OK	68109-74-0	CC(=NOC(=O)C)CC(C)(C)NC(=O)C=C	{1: 4, 2: 1, 4: 1, 5: 1, 6: 1, 7: 1, 34: 1, 24: 1, 28: 1, 31: 1}
OK	68109-75-1	C1CCC(CC1)N2CC=CC2	{33: 1, 11: 7, 12: 1, 14: 2}
OK	68109-99-9	CC(C)COC(=O)C=CC(=O)OC1CCCCC1	{1: 2, 2: 1, 3: 1, 6: 2, 11: 5, 12: 1, 28: 2}
OK	68110-20-3	NO.F.F	{16: 2, 20: 1, 30: 1}
OK	68110-23-6	CCCCCCCC/C=C\CCCCCCCC(=O)O.CN1CCOCC1	{1: 2, 2: 14, 6: 2, 33: 1, 11: 4, 23: 1, 27: 1}
OK	6812-38-0	CCCCCCCCCCCCCCCCC1CCCCC1	{1: 1, 2: 15, 11: 5, 12: 1}
OK	6812-39-1	CCCCCCCCCCCCCCCCC1CCCC1	{1: 1, 2: 15, 11: 4, 12: 1}
OK	6812-78-8	C[C@@H](CCCC(=C)C)CCO	{1: 2, 2: 5, 3: 1, 5: 1, 7: 1, 20: 1}
OK	68123-05-7	CCCCCCCCCCCCOCCCN.CC(=O)O	{1: 2, 2: 14, 27: 1, 30: 1, 22: 1}
OK	68123-06-8	CCCCCCCCOCCCNCCCN	{1: 1, 2: 13, 30: 1, 22: 1, 31: 1}
OK	68123-10-4	COCCCNCCCN	{1: 1, 2: 6, 30: 1, 22: 1, 31: 1}
OK	68123-11-5	CCCCCCCCCCCCCCCOCCCNCCCN	{1: 1, 2: 20, 30: 1, 22: 1, 31: 1}
OK	68127-22-0	CC1CCC(C(C1)OC(=O)C2CCC(=O)N2)C(C)C	{32: 1, 1: 3, 3: 1, 11: 5, 12: 4, 25: 1, 28: 1}
OK	68128-23-4	C=CCCCCCCCCCCC(CC(=O)OCCOCCOC(=O)CC(CCCCCCCCCCC=C)C(=O)O)C(=O)O	{2: 26, 3: 2, 5: 2, 6: 2, 22: 1, 27: 2, 28: 2}
OK	68128-58-5	CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.CC(C)(CO)N	{1: 3, 2: 13, 4: 1, 11: 1, 12: 3, 14: 2, 20: 1, 27: 2, 30: 1}
OK	68130-23-4	CCCCCCCCCC(=O)OOC(=O)CCCCCCC.CCCCCCCC/C=C/CCCCCCCC=O.C(C(CO)O)O	{1: 3, 2: 30, 3: 1, 6: 2, 20: 3, 26: 1, 28: 2}
OK	68130-24-5	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O	{1: 3, 2: 25, 4: 2, 20: 6, 22: 1, 27: 3}
OK	68130-29-0	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)COCC(CO)(CO)CO)O	{1: 3, 2: 31, 4: 3, 20: 8, 22: 2, 27: 3}
OK	68130-33-6	CCCCCCCC/C=C/CCCCCCCC(=O)OCC(CO)(CO)CO.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 22, 4: 1, 6: 2, 20: 3, 27: 2, 28: 1}
OK	68130-51-8	CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCC)(COC(=O)CCCCCCC)COC(=O)CC(C)C	{1: 5, 2: 26, 3: 1, 4: 1, 28: 4}
OK	68130-52-9	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCC(=O)O.CCC(CO)(CO)CO	{1: 4, 2: 22, 27: 3, 4: 1, 20: 3}
OK	68130-55-2	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCC(=O)O.CCC(CO)(CO)CO.C(CCC(=O)O)CC(=O)O	{1: 4, 2: 26, 27: 5, 4: 1, 20: 3}
OK	68132-29-6	CCCCCCCC(=O)OC[C@H](CO)O	{1: 1, 2: 8, 3: 1, 20: 2, 28: 1}
OK	68132-80-9	CCC(C)(C)CCCC(=O)OCC=C	{1: 3, 2: 5, 4: 1, 5: 1, 6: 1, 28: 1}
OK	68133-36-8	CCCCCCCCCCCCCCCCCC1=NC(CO1)(CC)COC(=O)CCCCCCCCCCCCCCCCC	{1: 3, 2: 34, 35: 1, 11: 1, 13: 1, 15: 1, 23: 1, 28: 1}
OK	68133-58-4	CCCCCCCCCCCCCCCCCC(=O)O.CC(C)(CO)N	{1: 3, 2: 17, 4: 1, 20: 1, 27: 1, 30: 1}
OK	68133-62-0	CCCCCCCC/C=C\CCCCCCCC(=O)O.CCNCCO	{1: 2, 2: 17, 6: 2, 20: 1, 27: 1, 31: 1}
OK	68133-72-2	CCC=CCCOCC=O	{1: 1, 2: 4, 26: 1, 22: 1, 6: 2}
OK	68133-73-3	CC(C)CCOC(=O)C=C(C)CCC=C(C)C	{1: 5, 2: 4, 3: 1, 6: 2, 7: 2, 28: 1}
OK	68133-74-4	CCC=CCCC1CCCC1=O	{1: 1, 2: 3, 6: 2, 11: 3, 12: 1, 25: 1}
OK	68133-80-2	CCCCCC=CCCC(OC)OC	{1: 3, 2: 6, 3: 1, 22: 2, 6: 2}
OK	68134-02-1	CCCCCC[C@H](C/C=C\CCCCCCCC(=O)O)O.C1COCCN1	{32: 1, 1: 1, 2: 13, 3: 1, 6: 2, 11: 4, 20: 1, 23: 1, 27: 1}
OK	68134-03-2	C(N=C(N)NC(=NCO)N)O.Cl	{2: 2, 7: 2, 34: 2, 17: 1, 20: 2, 30: 2, 31: 1}
OK	68134-05-4	CCCCCCCCC=CCCCCCCCC(=O)OCCOCC	{1: 2, 2: 17, 28: 1, 22: 1, 6: 2}
OK	68134-06-5	CC(C)CC(C)OCC1CO1	{1: 3, 2: 2, 3: 2, 11: 1, 12: 1, 22: 1, 23: 1}
OK	68134-07-6	CC(C)CCCCCOCC1CO1	{1: 2, 2: 6, 3: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	68134-23-6	CCCCOC(=O)CCC1CCCCC1=O	{1: 1, 2: 5, 11: 4, 12: 1, 25: 1, 28: 1}
OK	68134-24-7	CCCCOCCOC(C)(C)C	{1: 4, 2: 5, 4: 1, 22: 2}
OK	68134-62-3	C1C(O1)CCl.C(C(COCC(CO)O)O)O	{2: 5, 3: 2, 11: 1, 12: 1, 17: 1, 20: 4, 22: 1, 23: 1}
OK	68139-00-4	CC1CCOC(O1)(C)CCC=C(C)C	{1: 4, 2: 2, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 23: 2}
OK	68140-11-4	C1CN(C=N1)CCN	{33: 1, 2: 2, 35: 1, 11: 2, 14: 1, 30: 1}
OK	68140-18-1	C(CS)C(C(F)(F)F)(F)F	{16: 5, 2: 2, 4: 2, 39: 1}
OK	68140-30-7	CC1CO1.CC1(C(=O)NC(=O)N1)C.C1C(O1)CCl	{32: 2, 1: 3, 2: 1, 11: 2, 12: 2, 13: 1, 17: 1, 23: 2, 25: 2}
OK	68140-40-9	CCCCCCCC/C=C\CCCCCCCC(=O)N(C)CC(=O)O.CC(C)(CO)N	{1: 4, 2: 16, 4: 1, 6: 2, 33: 1, 20: 1, 24: 1, 27: 1, 30: 1}
OK	68140-44-3	CC(=CCCC(=CCOC(C(Cl)(Cl)Cl)OCC=C(C)CCC=C(C)C)C)C	{1: 6, 2: 6, 3: 1, 4: 1, 6: 4, 7: 4, 17: 3, 22: 2}
OK	68140-46-5	CCCCCCCCCCCCCOC(=O)CC(C=CCCCCCCCCCC)C(=O)O	{1: 2, 2: 22, 3: 1, 6: 2, 27: 1, 28: 1}
OK	68140-49-8	CC1=CCCC(C1C=C(C)C(C)C=O)(C)C	{1: 5, 3: 1, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 26: 1}
OK	68140-51-2	CC1C(OC(O1)C=C(C)CCC=C(C)C)C	{1: 5, 2: 2, 6: 2, 7: 2, 12: 3, 23: 2}
OK	68140-54-5	CCCC1C(C=C(CC1C=O)C)C	{1: 3, 2: 2, 11: 1, 12: 3, 14: 1, 15: 1, 26: 1}
OK	68140-58-9	CC1CC(=CC(C1(CC=C)C=O)C)C	{1: 3, 2: 1, 5: 1, 6: 1, 11: 1, 12: 2, 13: 1, 14: 1, 15: 1, 26: 1}
OK	68140-59-0	CC(=C)C1C=CCCC1(C)C=O	{1: 2, 5: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 2, 26: 1}
OK	68140-60-3	CCCCC(CC)(C=C=C(C)CC(C)C)C=O	{1: 5, 2: 5, 3: 1, 4: 1, 6: 1, 7: 1, 8: 1, 26: 1}
OK	68140-75-0	CN(CC(CCl)O)CC(CCl)O	{1: 1, 2: 4, 3: 2, 33: 1, 17: 2, 20: 2}
OK	68140-96-5	CCCCOCCOCCC#N	{1: 1, 2: 7, 37: 1, 22: 2}
OK	68141-17-3	CCCCCCCCCC(C)C(OC)OC	{1: 4, 2: 8, 3: 2, 22: 2}
OK	68153-95-7	CCCCCCCCCCCCCCCNCCCCCCCCCCCCCCC	{1: 2, 2: 28, 31: 1}
OK	68155-08-8	CCCC/C=C/CCCCCCCCCCCCN(CCO)CCO	{1: 1, 2: 19, 20: 2, 6: 2, 33: 1}
OK	68155-52-2	CCCCCCCCCCCCCCCCCCNC(=O)CCCCCCCCCCC(CCCCCC)O	{1: 2, 2: 32, 3: 1, 20: 1, 24: 1, 31: 1}
OK	68155-54-4	C1(C(C(OC(C1(F)F)(F)F)(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)(F)F)(F)F	{16: 28, 4: 9, 13: 5, 23: 1}
OK	68155-57-7	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCN)C(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 36, 33: 1, 24: 2, 30: 1, 31: 1}
OK	68156-16-1	C(CN)COCCOCCO.Cl	{17: 1, 2: 7, 20: 1, 30: 1, 22: 2}
OK	68162-93-6	CC1CCCCC1C(=O)N2CCCCC2C	{24: 1, 1: 2, 11: 8, 12: 3, 33: 1}
OK	68165-06-0	CN1CCC(=O)C1	{1: 1, 11: 3, 33: 1, 25: 1}
OK	68165-37-7	CCC(=C(C)C)C(=O)C(C)(C)C	{24: 1, 1: 6, 2: 1, 4: 1, 7: 2}
OK	68170-63-8	CCOC(=O)CC(=O)C.CC(CCCCN=C=O)C(C)(C)N=C=O	{1: 5, 2: 6, 3: 1, 4: 1, 8: 2, 34: 2, 24: 1, 28: 1, 29: 2}
OK	68171-35-7	CCC(CC(=O)Cl)C(CC)CC(=O)Cl	{24: 2, 1: 2, 2: 4, 3: 2, 17: 2}
OK	68171-51-7	CCCCCC/C=C\CCCCCCCC(=O)O.C(CO)NCCO	{1: 1, 2: 16, 6: 2, 20: 2, 27: 1, 31: 1}
OK	68171-52-8	CCCCCC=CCC=CCCCCCCCC(=O)NCCO	{1: 1, 2: 14, 6: 4, 20: 1, 24: 1, 31: 1}
OK	68171-53-9	CCCCCCCC(=O)O.CC(CN)O	{1: 2, 2: 7, 3: 1, 20: 1, 27: 1, 30: 1}
OK	68177-00-4	C1CC#CCCC=C1	{10: 2, 11: 4, 14: 2}
OK	6818-07-1	CC(CCC(=O)O)C(=O)C	{24: 1, 1: 2, 2: 2, 3: 1, 27: 1}
OK	68186-66-3	CCCCOCCOC(=O)CCCCCCCCC(=O)O	{1: 1, 2: 13, 27: 1, 28: 1, 22: 1}
OK	68186-70-9	CC(C)CCCCCCCOC(=O)C=CC(=O)O	{1: 2, 2: 7, 3: 1, 6: 2, 27: 1, 28: 1}
OK	68186-72-1	CCCCCCOC(=O)C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O	{1: 1, 2: 5, 12: 2, 13: 3, 15: 2, 17: 6, 27: 1, 28: 1}
OK	68187-07-5	CCCCCCCC/C=C\CCCCCCCC(=O)N/C(=C\C(=O)O)/C(=O)OCC	{1: 2, 2: 15, 6: 3, 7: 1, 24: 1, 27: 1, 28: 1, 31: 1}
OK	68187-26-8	CCCCOC(=O)/C=C/C(=O)O.C1CCC(CC1)OC(=O)/C=C/C(=O)O	{1: 1, 2: 3, 6: 4, 11: 5, 12: 1, 27: 2, 28: 2}
OK	68189-10-6	CC(C)CCCCCCCCCCCCCCC(=O)NCCNCCO.CC(=O)O	{1: 3, 2: 18, 3: 1, 20: 1, 24: 1, 27: 1, 31: 2}
OK	68189-45-7	CCCCCCCCCCCCCCOCCCNCCCN.CC(=O)O	{1: 2, 2: 19, 22: 1, 27: 1, 30: 1, 31: 1}
OK	68189-46-8	CCCCCCCCCCCCCCOCCCNCCCN.CCC(=O)O	{1: 2, 2: 20, 22: 1, 27: 1, 30: 1, 31: 1}
OK	6819-09-6	CCCCCOC(=O)CCCCCCCCC(=O)OCCCCC	{1: 2, 2: 16, 28: 2}
OK	68199-28-0	CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.CC1CO1.C1CO1	{1: 2, 2: 12, 11: 4, 12: 4, 14: 2, 23: 2, 27: 2}
OK	682-08-6	CCC(COCC=C)(COCC=C)COCC=C	{1: 1, 2: 7, 4: 1, 5: 3, 6: 3, 22: 3}
OK	682-09-7	CCC(CO)(COCC=C)COCC=C	{1: 1, 2: 6, 4: 1, 5: 2, 6: 2, 20: 1, 22: 2}
OK	682-11-1	CCC(CO)(CO)COCC=C	{1: 1, 2: 5, 4: 1, 5: 1, 6: 1, 20: 2, 22: 1}
OK	68201-21-8	CCCCCCCC/C=C\CCCCCCCC(=O)OCCC(C)CC(CCC(CC)CC(C)C(CC)CC(C)CCCC(C)CCCCCC)C(C)C	{1: 10, 2: 31, 3: 8, 28: 1, 6: 2}
OK	68201-87-6	CC1CO1.C1CO1.C1C(O1)CCl.C(CCCN)CCN	{1: 1, 2: 7, 11: 4, 12: 2, 17: 1, 23: 3, 30: 2}
OK	68211-36-9	C1CC2(CCC1C=C2)O	{20: 1, 11: 4, 12: 1, 13: 1, 14: 2}
OK	68211-38-1	CC12CCCCC1(C=CCC2)OC	{1: 2, 22: 1, 11: 6, 13: 2, 14: 2}
OK	68211-39-2	CC(C)(C)C1CCC(=C)C(C1)OC	{1: 4, 4: 1, 5: 1, 11: 3, 12: 2, 15: 1, 22: 1}
OK	68213-73-0	CCCCCCCC(=O)O.CC(CNCC(C)O)O	{1: 3, 2: 8, 3: 2, 20: 2, 27: 1, 31: 1}
OK	68213-98-9	CN(CCO)CCOCCO	{1: 1, 2: 6, 20: 2, 22: 1, 33: 1}
OK	68214-09-5	CCCCOC(CC)(COC(=O)C)O	{1: 3, 2: 5, 4: 1, 20: 1, 22: 1, 28: 1}
OK	68214-17-5	C1CCC(C(C1)N)N.C(CCl)Cl	{17: 2, 2: 2, 11: 4, 12: 2, 30: 2}
OK	68214-23-3	C=C(F)F.C(=C(/C(F)(F)F)\F)\F.C(=C(F)F)(C(F)(F)F)F	{16: 13, 4: 2, 5: 1, 6: 1, 7: 4}
OK	68214-48-2	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC(=O)N)CCN(CCC(=O)N)CCC(=O)N.CC(=O)O	{1: 2, 2: 26, 33: 2, 24: 4, 27: 1, 30: 3, 31: 1}
OK	68214-50-6	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC(=O)N)CCN(CCC(=O)N)C(=O)CCCCCCCCCCCCCCCCC.CC(=O)O	{1: 3, 2: 40, 33: 2, 24: 4, 27: 1, 30: 2, 31: 1}
OK	68214-52-8	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCN(CCC(=O)N)CCC(=O)N)C(=O)CCCCCCCCCCCCCCCCC.CC(=O)O	{1: 3, 2: 40, 33: 2, 24: 4, 27: 1, 30: 2, 31: 1}
OK	68214-54-0	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCN(CCC(=O)N)C(=O)CCCCCCCCCCCCCCCCC)C(=O)CCCCCCCCCCCCCCCCC.CC(=O)O	{1: 4, 2: 54, 33: 2, 24: 4, 27: 1, 30: 1, 31: 1}
OK	68214-77-7	CCCCCCCC/C=C\CCCCCCCC(=O)O.COCCCN	{1: 2, 2: 17, 6: 2, 22: 1, 27: 1, 30: 1}
OK	68214-84-6	CCOC(=O)C=C.C=CC(=O)OCC(CBr)Br	{1: 1, 2: 3, 3: 1, 5: 2, 6: 2, 18: 2, 28: 2}
OK	68217-17-4	C1=CC2C3C1C4C5C3C(C2C(=O)C4=O)C=C5	{25: 2, 12: 8, 14: 4}
OK	68217-18-5	C1CC2C3C1C4C5C3C(C2C(=O)C4=O)C=C5	{25: 2, 11: 2, 12: 8, 14: 2}
OK	68217-19-6	C1CC2C3C1C4C5C3C(C2C(=O)C4=O)CC5	{25: 2, 11: 4, 12: 8}
OK	68217-20-9	C1C2C1C3C4C2C5C6C4C(C3C(=O)C5=O)C7C6C7	{25: 2, 11: 2, 12: 12}
OK	68227-09-8	CC(C)COC(=O)C=C.CC(=C)C(=O)OCCN(C)C	{1: 5, 2: 3, 3: 1, 5: 2, 6: 1, 7: 1, 33: 1, 28: 2}
OK	68227-12-3	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CN(CCCN)CCCN	{1: 2, 2: 18, 6: 4, 33: 1, 27: 1, 30: 2}
OK	68227-25-8	CCCCCCCC/C=C\CCCCCCCC(=O)O.C1N(CN(CN1CCO)CCO)CCO	{1: 1, 2: 20, 6: 2, 33: 3, 11: 3, 20: 3, 27: 1}
OK	68227-48-5	CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 18, 33: 1, 11: 1, 12: 3, 14: 2, 20: 3, 27: 2}
OK	68227-51-0	CCCC(=O)OC1=C(CCC1=O)C	{1: 2, 2: 2, 11: 2, 15: 2, 25: 1, 28: 1}
OK	68228-05-7	CC(C)CCC/C(=C/C=C/C(=O)C)/C	{1: 4, 2: 3, 3: 1, 6: 3, 7: 1, 24: 1}
OK	68238-87-9	CC(C)CCCCCCCCCCCCCCC(=O)OCC(C1C(C(CO1)O)O)OC(=O)CCCCCCCCCCCCCCC(C)C	{1: 4, 2: 29, 3: 3, 11: 1, 12: 3, 20: 2, 23: 1, 28: 2}
OK	68238-91-5	CCCCCCCCC(CCCCCC)C(=O)OCC(COC(=O)C(CCCCCC)CCCCCCCC)OC(=O)C(CCCCCC)CCCCCCCC	{1: 6, 2: 38, 3: 4, 28: 3}
OK	68238-96-0	CC(COCC(COCC(C)O)(COCC(C)O)COCC(C)O)O.C(CCC(=O)O)CC(=O)O	{1: 4, 2: 12, 3: 4, 4: 1, 20: 4, 22: 4, 27: 2}
OK	68239-02-1	C(C1C(O1)(C#N)N(F)F)Cl	{33: 1, 2: 1, 37: 1, 12: 1, 13: 1, 16: 2, 17: 1, 23: 1}
OK	68239-05-4	CCCCCCCCCCCCCCCC(=O)O.CC(C)(CO)N	{1: 3, 2: 15, 4: 1, 20: 1, 27: 1, 30: 1}
OK	68239-13-4	CCN(CC)C1CCCCC1.C(CC(=O)O)CC(=O)O	{1: 2, 2: 5, 33: 1, 11: 5, 12: 1, 27: 2}
OK	68239-19-0	CCCCCCCCCCCCCOCCC#N	{1: 1, 2: 14, 37: 1, 22: 1}
OK	68239-20-3	CCCCCCCCCCCCCOCCCNCCC#N	{1: 1, 2: 17, 37: 1, 22: 1, 31: 1}
OK	68239-28-1	C1COCCN1C2=C(C(=O)C2(Cl)Cl)Cl	{33: 1, 11: 4, 13: 1, 15: 2, 17: 3, 23: 1, 25: 1}
OK	68239-30-5	C1C(O1)CCl.C(CCCNCCCCCCN)CCN.Cl	{2: 13, 11: 1, 12: 1, 17: 2, 23: 1, 30: 2, 31: 1}
OK	68239-89-4	COC(=O)C=C.C=CC(=O)NCO.C=CC(=O)O	{1: 1, 2: 1, 5: 3, 6: 3, 20: 1, 24: 1, 27: 1, 28: 1, 31: 1}
OK	68239-91-8	CC(C)(CO)CO.C1CC(CCC1CO)CO.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 4, 4: 1, 6: 2, 11: 4, 12: 2, 20: 4, 27: 2}
OK	68239-92-9	CC(C)(CO)CO.COC(=O)CCCCC(=O)OC.COC(=O)CCCC(=O)OC	{1: 6, 2: 9, 4: 1, 20: 2, 28: 4}
OK	6824-60-8	CC1=CCC(CC1)C#N	{1: 1, 37: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	68240-10-8	CC1=CCC(CC1)C(=C)C.CC(C)C1CCC(=C)C=C1	{1: 4, 3: 1, 5: 2, 7: 1, 11: 5, 12: 2, 14: 3, 15: 2}
OK	68240-11-9	CN(CC=C)CC=C.C=CC(=O)N.Cl	{1: 1, 2: 2, 5: 3, 6: 3, 33: 1, 17: 1, 24: 1, 30: 1}
OK	68240-13-1	CC(=O)O.CN(CC=C)CC=C.C=CC(=O)N	{1: 2, 2: 2, 5: 3, 6: 3, 33: 1, 24: 1, 27: 1, 30: 1}
OK	68252-17-5	COC(=O)C1CCCC1C(=O)OC	{1: 2, 11: 3, 12: 2, 28: 2}
OK	68258-69-5	CCCCCCCC/C=C\CCCCCCCC(=O)O.C1=C/C(=C\N=C(N)N)/C(=O)C=C1	{1: 1, 2: 14, 6: 3, 7: 1, 34: 1, 14: 4, 15: 1, 25: 1, 27: 1, 30: 2}
OK	68258-72-0	CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)(CO)COC(=O)CCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 44, 4: 1, 20: 2, 28: 2}
OK	68258-75-3	CCOC(=O)C=C.CC(=O)OC=C.C=CC(=O)N	{1: 2, 2: 1, 5: 3, 6: 3, 24: 1, 28: 2, 30: 1}
OK	68258-78-6	C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CO)COCCCO	{2: 11, 8: 2, 11: 8, 12: 4, 34: 2, 20: 2, 22: 1, 27: 2, 29: 2}
OK	68258-90-2	C1(C(C(C(C1(Cl)Cl)Cl)(Cl)Cl)Cl)Cl	{17: 7, 12: 3, 13: 2}
OK	68258-91-3	C1C(C(C(C1(Cl)Cl)Cl)(Cl)Cl)Cl	{17: 6, 11: 1, 12: 2, 13: 2}
OK	68259-41-6	CCC(C=CC1=C(CCCC1(C)C)C)O	{1: 4, 2: 1, 3: 1, 6: 2, 11: 3, 13: 1, 15: 2, 20: 1}
OK	68274-97-5	CCCCC#CCCCCO	{1: 1, 2: 7, 20: 1, 10: 2}
OK	68278-23-9	C(CC(C(F)F)(C(=O)O)N)CN.Cl	{2: 3, 3: 1, 4: 1, 16: 2, 17: 1, 27: 1, 30: 2}
OK	6829-40-9	CCOC(=O)C(C(=O)OCC)N	{1: 2, 2: 2, 3: 1, 28: 2, 30: 1}
OK	6829-41-0	CCOC(=O)C(=NO)C(=O)OCC	{1: 2, 2: 2, 7: 1, 34: 1, 20: 1, 28: 2}
OK	6829-42-1	CCOC(=O)CC(C)CC(=O)OCC	{1: 3, 2: 4, 3: 1, 28: 2}
OK	68298-25-9	CC=CCSC(=N)N.Cl	{1: 1, 2: 1, 36: 1, 6: 2, 7: 1, 40: 1, 17: 1, 30: 1}
OK	68298-26-0	CCCCSCCC(=O)OCC	{40: 1, 1: 2, 2: 6, 28: 1}
OK	68298-28-2	CCOC(COCCC(C)CCC=C(C)C)OCC	{1: 5, 2: 7, 3: 2, 6: 1, 7: 1, 22: 3}
OK	68298-41-9	CCCCCCSCCC(=O)O	{40: 1, 1: 1, 2: 7, 27: 1}
OK	68298-49-7	CC1CCC(C(=C1)OC(=O)C)C(C)C	{1: 4, 3: 1, 11: 2, 12: 2, 14: 1, 15: 1, 28: 1}
OK	68298-50-0	CCCCCCCCCC(C)(OC)OC	{1: 4, 2: 8, 4: 1, 22: 2}
OK	68298-86-2	CCCCCCCCC=CCCCCCCCCC1=NC(CO1)(C)CO.F	{1: 2, 2: 16, 35: 1, 6: 2, 11: 1, 13: 1, 15: 1, 16: 1, 20: 1, 23: 1}
OK	68298-99-7	CCCCCCC(C)(C)C(=O)O.C(CO)N	{1: 3, 2: 7, 4: 1, 20: 1, 27: 1, 30: 1}
OK	68299-11-6	CCCCC(CC)COC=C.CC(=O)OC=C	{1: 3, 2: 5, 3: 1, 5: 2, 6: 2, 22: 1, 28: 1}
OK	68299-13-8	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C(N)CO	{1: 2, 2: 26, 6: 8, 20: 1, 27: 2, 30: 1}
OK	68299-16-1	CCC(C)(C)OOC(=O)CCCCCC(C)(C)C	{1: 6, 2: 6, 4: 2, 22: 1, 28: 1}
OK	683-50-1	CC(C=O)Cl	{1: 1, 26: 1, 3: 1, 17: 1}
OK	683-57-8	C(C(=O)N)Br	{24: 1, 2: 1, 18: 1, 30: 1}
OK	683-58-9	CC(=NO)Cl	{1: 1, 34: 1, 17: 1, 20: 1, 7: 1}
OK	683-68-1	C(C(Cl)Br)(Cl)Br	{17: 2, 18: 2, 3: 2}
OK	683-72-7	C(C(=O)N)(Cl)Cl	{24: 1, 17: 2, 3: 1, 30: 1}
OK	6830-83-7	CC(C)(C)C(=O)NC	{24: 1, 1: 4, 4: 1, 31: 1}
OK	68307-90-4	C1CN1.C1C(O1)CCl.Cl	{32: 1, 2: 1, 11: 3, 12: 1, 17: 2, 23: 1}
OK	68307-92-6	C1C=CCC(C1C(=O)O)C(=O)O	{27: 2, 11: 2, 12: 2, 14: 2}
OK	68308-13-4	CCCCCCCCCCCC(/C=N/N=C/C(CCCCCCCCCC)O)O	{1: 2, 2: 19, 3: 2, 6: 2, 34: 2, 20: 2}
OK	68310-10-1	CCCCCCCCC=CCCCCCCCC(=O)OC(C)CN(CCN(CC(C)O)CC(C)O)CC(C)OC(=O)CCCCCCCC=CCCCCCCCC	{1: 6, 2: 34, 3: 4, 6: 4, 33: 2, 20: 2, 28: 2}
OK	68310-11-2	CCCCCCCCC=CCCCCCCCC(=O)OC(C)CN(CCN(CC(C)O)CC(C)OC(=O)CCCCCCCC=CCCCCCCCC)CC(C)O	{1: 6, 2: 34, 3: 4, 6: 4, 33: 2, 20: 2, 28: 2}
OK	68310-12-3	C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 39, 27: 1, 4: 19}
OK	68310-25-8	CCCCCCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#N)CCNCCC#N	{1: 1, 2: 28, 37: 2, 33: 1, 24: 1, 31: 2}
OK	68310-43-0	CCCCCCCC/C=C\CCCCCCCC(=O)NCCNCCO.CC(=O)O	{1: 2, 2: 18, 6: 2, 20: 1, 24: 1, 27: 1, 31: 2}
OK	68310-61-2	CC(CNCCNCCNCC(C)O)O	{1: 2, 2: 6, 3: 2, 20: 2, 31: 3}
OK	68310-62-3	CC(CNCCNCCNCCNCC(C)O)O	{1: 2, 2: 8, 3: 2, 20: 2, 31: 4}
OK	68310-63-4	CC(CNCCNCCNCCNCCNCC(C)O)O	{1: 2, 2: 10, 3: 2, 20: 2, 31: 5}
OK	68310-64-5	CC(CNCCN1CCN(CC1)CC(C)O)O	{1: 2, 2: 4, 3: 2, 33: 2, 11: 4, 20: 2, 31: 1}
OK	68310-65-6	C(CNCCNCCNCCNCCN)C#N	{2: 10, 37: 1, 30: 1, 31: 4}
OK	68310-66-7	C1CN(CCN1)CCNCCC#N	{32: 1, 33: 1, 2: 4, 37: 1, 11: 4, 31: 1}
OK	68310-68-9	C(CNCCNCCNCCN)C#N	{2: 8, 37: 1, 30: 1, 31: 3}
OK	68310-74-7	CCCCCCCCCCOCCCN.CC(=O)O	{1: 2, 2: 12, 27: 1, 30: 1, 22: 1}
OK	68310-85-0	C1CCC(CC1)SN2C(=O)C3CCCCC3C2=O	{40: 1, 25: 2, 11: 9, 12: 3, 33: 1}
OK	68310-95-2	CCCCOC(=O)C=C.CCOC(=O)/C(=C/C(=O)OCC(C)O)/N1CCNC1=O.CC(=O)OC=C	{32: 1, 1: 4, 2: 5, 3: 1, 5: 2, 6: 3, 7: 1, 11: 2, 20: 1, 25: 1, 33: 1, 28: 4}
OK	68311-06-8	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCC/C=C\CCCCCCCC(=O)O	{1: 2, 2: 30, 27: 2, 6: 2}
OK	68311-16-0	CCC(=O)C1CC2C=CCC(C2CC1C)(C)C	{1: 4, 2: 1, 11: 3, 12: 4, 13: 1, 14: 2, 24: 1}
OK	68318-23-0	CCCCOC(=O)/C=C\C(=O)OCCCC.CCOC(=O)/C=C\C(=O)O.CC(=O)OC=C	{1: 4, 2: 7, 5: 1, 6: 5, 27: 1, 28: 4}
OK	68318-38-7	C1COCCN1C(C(C(=C(Cl)Cl)N2CCOCC2)Cl)N3CCOCC3	{33: 3, 3: 2, 7: 2, 11: 12, 17: 3, 23: 3}
OK	68318-43-4	C=CC(=O)OCCCO.C=CCl	{2: 3, 5: 2, 6: 2, 17: 1, 20: 1, 28: 1}
OK	68324-22-1	CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.C(CO)NCCO	{1: 1, 2: 16, 11: 1, 12: 3, 14: 2, 20: 2, 27: 2, 31: 1}
OK	68332-79-6	CCCCCCCC(=O)OCC(C)O	{1: 2, 2: 7, 3: 1, 20: 1, 28: 1}
OK	68332-80-9	CCCCCCCCCCCCCCCCCCOC(=O)CC(CC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)O)(C(=O)O)O	{1: 2, 2: 35, 3: 1, 4: 1, 6: 2, 20: 2, 27: 1, 28: 3}
OK	68334-51-0	CCCCCCCCC(=O)NCCNCCNCCNCCNC(=O)CCCCCCCC	{24: 2, 1: 2, 2: 22, 31: 5}
OK	68334-53-2	CCN(CC)CC(COCCCCCCOCC(CN(CC)CC)O)O.Cl.Cl	{1: 4, 2: 14, 3: 2, 33: 2, 17: 2, 20: 2, 22: 2}
OK	68334-56-5	CCCCCCCCCCCCCOCC(CCl)O	{1: 1, 2: 14, 3: 1, 17: 1, 20: 1, 22: 1}
OK	68334-67-8	CC(C)OC(=C(C(=C(Cl)Cl)Cl)Cl)Cl	{1: 2, 3: 1, 17: 5, 22: 1, 7: 4}
OK	68334-69-0	CCCCCCCCCCCCCCCCCCN1CCN(C1=O)CCO	{1: 1, 2: 19, 33: 2, 11: 2, 20: 1, 25: 1}
OK	68334-74-7	C1C(O1)CCl.C(CNCCO)N	{2: 5, 11: 1, 12: 1, 17: 1, 20: 1, 23: 1, 30: 1, 31: 1}
OK	68334-83-8	CC1CO1.CC(CO)O.C=CCOCC1CO1.C1CO1	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 11: 4, 12: 2, 20: 2, 22: 1, 23: 3}
OK	68334-86-1	CC1CO1.C=CCO.C=CCOCC1CO1.C1CO1	{1: 1, 2: 3, 5: 2, 6: 2, 11: 4, 12: 2, 20: 1, 22: 1, 23: 3}
OK	6834-98-6	CCCCC[C@H]([C@@H]1[C@H](C[C@H](C[C@H](C[C@H](C[C@H](C[C@H]([C@H]([C@@H](/C(=C/C=C/C=C/C=C/C=C/[C@@H]([C@H](OC1=O)C)O)/C)O)O)O)O)O)O)O)O)O	{1: 3, 2: 4, 3: 1, 11: 5, 12: 11, 14: 9, 15: 1, 20: 10, 28: 1}
OK	68344-46-7	C1CC=CC#CC=C1	{10: 2, 11: 2, 14: 4}
OK	68345-17-5	CC(C)CCCC(C)(C=C)OC(=O)C	{1: 4, 2: 3, 3: 1, 4: 1, 5: 1, 6: 1, 28: 1}
OK	68345-18-6	CC(C)CCCC(=CCCC(=CCCC(=O)C)C)C	{1: 5, 2: 7, 3: 1, 6: 2, 7: 2, 24: 1}
OK	68347-26-2	C1CC2C=CC(C1)C(=O)C2=O	{25: 2, 11: 3, 12: 2, 14: 2}
OK	68347-39-7	CC1(CCCC(C(=O)C1=O)(C)C)C	{1: 4, 11: 3, 13: 2, 25: 2}
OK	6836-11-9	CCN1CC2(CCC(C34C2C(C5(C31)C6(CC(C7CC4(C6C7OC)O)OC)OCO5)OC(=O)C)OC)C	{1: 6, 2: 1, 33: 1, 11: 6, 12: 8, 13: 5, 20: 1, 22: 3, 23: 2, 28: 1}
OK	6836-34-6	CCCCCCCCCCCCCCC1CCC(CC1)CCCCCC	{1: 2, 2: 18, 11: 4, 12: 2}
OK	6836-35-7	CCCCCCCCCCCCC1CCC(CC1)CCCCCCCC	{1: 2, 2: 18, 11: 4, 12: 2}
OK	6836-38-0	CCCCCCC(CCCCC)O	{1: 2, 2: 9, 3: 1, 20: 1}
OK	6836-39-1	CCCCCCCCC(CCCCC)O	{1: 2, 2: 11, 3: 1, 20: 1}
OK	6836-40-4	CCCCCCCCCC(CCCCC)O	{1: 2, 2: 12, 3: 1, 20: 1}
OK	6836-42-6	CCCCCCCCC(=O)CCCCC	{24: 1, 1: 2, 2: 11}
OK	68366-65-4	CC1CCC(C(C1)OC(=O)C(C)C)C(C)C	{11: 3, 1: 5, 3: 2, 12: 3, 28: 1}
OK	68367-53-3	CC(C)(CN(C)C)N(C)C	{1: 6, 2: 1, 4: 1, 33: 2}
OK	68368-46-7	CCCCCCCCCCCCCCCCCC(=O)N(CCO)CCO.C(=O)(N)N	{1: 1, 2: 20, 33: 1, 20: 2, 24: 2, 30: 2}
OK	68368-54-7	CCC(C)C(=O)OCCC(C)CCCC(C)C	{1: 5, 2: 6, 3: 3, 28: 1}
OK	6837-24-7	C1CCC(CC1)N2CCCC2=O	{25: 1, 11: 8, 12: 1, 33: 1}
OK	68378-18-7	CCCCC(CC)COC(=O)C=C.CC(C)CCCCCOC(=O)C=C.C=CC(=O)O	{1: 4, 2: 10, 3: 2, 5: 3, 6: 3, 27: 1, 28: 2}
OK	68378-19-8	CC(C)CCCCCOC(=O)C=C.C=CC(=O)O.C=CC(=O)O.C(CO)N(CCO)CCO	{1: 2, 2: 11, 3: 1, 5: 3, 6: 3, 33: 1, 20: 3, 27: 2, 28: 1}
OK	68379-11-3	CC(C)CCCCCOCCC#N	{1: 2, 2: 7, 3: 1, 37: 1, 22: 1}
OK	68379-12-4	CC(C)CCCCCOCCCN.CC(=O)O	{1: 3, 2: 8, 3: 1, 22: 1, 27: 1, 30: 1}
OK	68384-70-3	CCOC(=O)CC(C)NC	{1: 3, 2: 2, 3: 1, 28: 1, 31: 1}
OK	68389-49-1	CCCCCCCCC=CCCCCCCCC(=O)OCCN=C=NCCO	{1: 1, 2: 18, 6: 2, 8: 1, 34: 2, 20: 1, 28: 1}
OK	68389-73-1	C1CN(C=N1)CCN.C(C(=O)O)O	{33: 1, 2: 3, 35: 1, 11: 2, 14: 1, 20: 1, 27: 1, 30: 1}
OK	68391-07-1	CCCCCCCC/C=C/CCCCCCN(C)C	{1: 3, 2: 13, 6: 2, 33: 1}
OK	68391-40-2	CC(=O)OCC1COCCO1	{1: 1, 2: 1, 11: 3, 12: 1, 23: 2, 28: 1}
OK	68391-53-7	CCC(COCC=C)(COCC=C)COC(=O)NC1CCC(CC1)CC2CCC(CC2)NC(=O)OCC(CC)(COCC=C)COCC=C	{1: 2, 2: 13, 4: 2, 5: 4, 6: 4, 11: 8, 12: 4, 22: 4, 28: 2, 31: 2}
OK	68391-60-6	CCCCCCC(CCCC)(C(=O)CCCC)O	{24: 1, 1: 3, 2: 11, 4: 1, 20: 1}
OK	68391-64-0	CC1CC(CCC1=O)C(C)C	{11: 3, 1: 3, 3: 1, 12: 2, 25: 1}
OK	684-16-2	C(=O)(C(F)(F)F)C(F)(F)F	{16: 6, 24: 1, 4: 2}
OK	684-22-0	C(=C(C(F)(F)F)C(F)(F)F)=O	{8: 1, 16: 6, 4: 2, 29: 1, 7: 1}
OK	684-78-6	C(=O)(C(F)(F)F)NOC(=O)C(F)(F)F	{16: 6, 24: 1, 4: 2, 28: 1, 31: 1}
OK	684-84-4	CC(CO)C(C)O	{1: 2, 2: 1, 3: 2, 20: 2}
OK	684-93-5	CN(C(=O)N)N=O	{1: 1, 34: 1, 33: 1, 24: 1, 29: 1, 30: 1}
OK	684-94-6	CC(=C(C)C(=O)C)C	{24: 1, 1: 4, 7: 2}
OK	68400-57-7	CCCCCCCCCCCCCCCCCC(=O)NC(CO)(CO)CO	{1: 1, 2: 19, 4: 1, 20: 3, 24: 1, 31: 1}
OK	68400-65-7	CC1CO1.C=CC#N.C(CNCCNCCN)N	{1: 1, 2: 6, 5: 1, 6: 1, 11: 1, 12: 1, 23: 1, 37: 1, 30: 2, 31: 2}
OK	68409-58-5	CCCCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCC.CC1CO1.C1CO1	{1: 3, 2: 32, 11: 3, 12: 1, 22: 1, 23: 2}
OK	68409-62-1	CCCCCCCCCCCCCCCCCC(=O)O.C(CCCC(=O)O)CCCC(=O)O.C(CN)N	{1: 1, 2: 25, 27: 3, 30: 2}
OK	68411-17-6	C(CCl)OCCCl.C(C#CCO)O	{17: 2, 2: 6, 20: 2, 10: 2, 22: 1}
OK	68411-69-8	C1CN(C=N1)CCNCCN	{33: 1, 2: 4, 35: 1, 11: 2, 14: 1, 30: 1, 31: 1}
OK	68411-73-4	CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCC)OC(=O)CCCCCCCCC	{1: 3, 2: 25, 3: 1, 28: 3}
OK	68411-85-8	C1=C/C(=C/N=C(N)NN)/C(=O)C=C1	{34: 1, 6: 1, 7: 1, 14: 4, 15: 1, 25: 1, 30: 2, 31: 1}
OK	68411-89-2	CCCCCCCCCCCCCCCCCC(=O)NCCNCCO.CC(=O)O.C(CCC(=O)O)CC(=O)O.C(=O)(N)N	{1: 2, 2: 24, 20: 1, 24: 2, 27: 3, 30: 2, 31: 2}
OK	68412-03-3	C(CCCC(=O)Cl)CCCCl	{24: 1, 17: 2, 2: 7}
OK	68412-05-5	CCCCCCCC/C=C\CCCCCCCC(=O)OCCC	{1: 2, 2: 16, 28: 1, 6: 2}
OK	68412-08-8	CCCCCCCC/C=C\CCCCCCCC(=O)O.C(CN(CCN)CCN)N	{1: 1, 2: 20, 6: 2, 33: 1, 27: 1, 30: 3}
OK	68412-09-9	CCCCCCCC/C=C\CCCCCCCC(=O)O.C(CNCCNCCN)N	{1: 1, 2: 20, 6: 2, 27: 1, 30: 2, 31: 2}
OK	68412-10-2	CCCCCCCC/C=C\CCCCCCCC(=O)O.C(CNCCNCCNCCN)N	{1: 1, 2: 22, 6: 2, 27: 1, 30: 2, 31: 3}
OK	68412-15-7	CCCCCCCCCCCCCCCCCC(=O)O.C(CNCCNCCN)N	{1: 1, 2: 22, 27: 1, 30: 2, 31: 2}
OK	68412-41-9	C#CCO.C1C(O1)CCl	{2: 2, 9: 1, 10: 1, 11: 1, 12: 1, 17: 1, 20: 1, 23: 1}
OK	68412-44-2	C=CC#N.C1C2(COC(O1)CCCN)COC(OC2)CCCN	{2: 6, 5: 1, 6: 1, 11: 4, 12: 2, 13: 1, 23: 4, 30: 2, 37: 1}
OK	68412-45-3	C=CC#N.C(CNCCN(CCN)CCN)N	{33: 1, 2: 8, 5: 1, 6: 1, 37: 1, 30: 3, 31: 1}
OK	68412-46-4	C=CC#N.C1C(O1)CO.C(CNCCNCCNCCN)N	{2: 9, 5: 1, 6: 1, 11: 1, 12: 1, 20: 1, 23: 1, 37: 1, 30: 2, 31: 3}
OK	68412-47-5	CC(=O)CC(C)(C)NC(=O)C=C.C(CNCCN)N	{1: 3, 2: 5, 4: 1, 5: 1, 6: 1, 24: 2, 30: 2, 31: 2}
OK	68412-49-7	C1C(O1)CCl.C(CO)COCCCO	{2: 7, 11: 1, 12: 1, 17: 1, 20: 2, 22: 1, 23: 1}
OK	68413-34-3	CCCC(CCCCCC(C)N(CCO)CCO)O	{1: 2, 2: 11, 3: 2, 20: 3, 33: 1}
OK	68413-35-4	CCCC(CCCCCC(C)N(C)C)O	{1: 4, 2: 7, 3: 2, 20: 1, 33: 1}
OK	68413-36-5	CCC(CCCCCCC(C)NCCCN(C)C)O	{1: 4, 2: 10, 3: 2, 33: 1, 20: 1, 31: 1}
OK	68413-38-7	CCCCC(CCCCC(C)NCCN)O	{1: 2, 2: 9, 3: 2, 20: 1, 30: 1, 31: 1}
OK	68413-39-8	CCC(CCCCCCC(C)OCCO)O	{1: 2, 2: 9, 3: 2, 20: 2, 22: 1}
OK	68413-93-4	CCN(CC)CCNCCCNCCN(CC)CC	{1: 4, 2: 11, 33: 2, 31: 2}
OK	68422-03-7	CC1CCC(NC1)C(C)C2C(CC3C2(CCC4C3CC=C5C4(CCC(C5)O)C)C)O	{32: 1, 1: 4, 3: 1, 11: 10, 12: 8, 13: 2, 14: 1, 15: 1, 20: 2}
OK	68424-12-4	CCCCCCCCCC(=O)O.C(CNCCNCCNCCN)N	{1: 1, 2: 16, 27: 1, 30: 2, 31: 3}
OK	68424-30-6	CCCCC(=O)OCC(CO)(CO)CO	{1: 1, 2: 7, 4: 1, 20: 3, 28: 1}
OK	68425-63-8	CC1CC(=CC(C1C)C=CC(=O)C)C	{1: 4, 6: 2, 11: 1, 12: 3, 14: 1, 15: 1, 24: 1}
OK	68425-96-7	CCCCCCCCOC(=O)CC(C)(C)CC(C)C(=O)OCCCCCCCC	{1: 5, 2: 16, 3: 1, 4: 1, 28: 2}
OK	68425-98-9	CC1CCC(CC1CNC(=O)ON=C(C)C)(C)CNC(=O)ON=C(C)C	{1: 6, 2: 2, 34: 2, 7: 2, 11: 3, 12: 2, 13: 1, 28: 2, 31: 2}
OK	68426-01-7	CCCCCCCCCCOC(=O)CC(C)CC(C)(C)C(=O)OCCCCCCCCCC	{1: 5, 2: 20, 3: 1, 4: 1, 28: 2}
OK	68426-06-2	CC(C)C(CCC1CCCCC1)O	{1: 2, 2: 2, 3: 2, 11: 5, 12: 1, 20: 1}
OK	68427-36-1	CC1=NNC(=O)C1C=C2C(=NNC2=O)C	{32: 2, 1: 2, 35: 2, 6: 1, 12: 1, 15: 3, 25: 2}
OK	6843-45-4	CN1C(=O)CNC1=O	{32: 1, 1: 1, 11: 1, 33: 1, 25: 2}
OK	68435-07-4	COC(=O)C12CC3CC(C1)CC(C3)(C2)O	{1: 1, 11: 6, 12: 2, 13: 2, 20: 1, 28: 1}
OK	68439-58-7	CCCCCCCCCC(C)NC	{1: 3, 2: 8, 3: 1, 31: 1}
OK	68439-59-8	CCCCCCCC/C=C/CCCCCC(=O)N(CCO)CCO	{1: 1, 2: 16, 6: 2, 33: 1, 20: 2, 24: 1}
OK	68439-60-1	CCCCCCCCCC/C=C/CCCCCC(=O)NCCO	{1: 1, 2: 16, 6: 2, 20: 1, 24: 1, 31: 1}
OK	68439-62-3	CCCCCCCCCCCCCC(=O)N(CCO)CCO	{24: 1, 1: 1, 2: 16, 20: 2, 33: 1}
OK	68439-71-4	CCCCCCCCCCCCCCN(CCC)CCC	{1: 3, 2: 17, 33: 1}
OK	68439-83-8	CCCCCCCCN(CCCC(CC)C(C)C)CC(C)C(CC)CC	{1: 7, 2: 14, 3: 4, 33: 1}
OK	68439-88-3	CCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 52, 28: 2}
OK	68441-03-2	CC[C@H](CC[C@@H](C)[C@H]1CCC2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	68441-68-9	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.C(C(CO)(CO)CO)O	{1: 2, 2: 18, 27: 2, 4: 1, 20: 4}
OK	68442-24-0	CCCCCCCCCCCCCCN(CCCOCC)CCCOCC	{1: 3, 2: 21, 22: 2, 33: 1}
OK	68442-89-7	CCCCCCCCCCCCCCCCCCCCCC(=O)O.C(CNCCNCCNCCN)N	{1: 1, 2: 28, 27: 1, 30: 2, 31: 3}
OK	68443-48-1	CCCCCC1=C(CC(C1=O)C(=O)OC)C	{1: 3, 2: 4, 11: 1, 12: 1, 15: 2, 25: 1, 28: 1}
OK	68443-50-5	CCCCCC(COC(=O)C(C)C)O	{1: 3, 2: 5, 3: 2, 20: 1, 28: 1}
OK	68443-63-0	CCCCC(CC)C(=O)OCCCC	{1: 3, 2: 7, 3: 1, 28: 1}
OK	68443-72-1	CC1C=C(CC(C1C)C(=C)C)C	{1: 4, 5: 1, 7: 1, 11: 1, 12: 3, 14: 1, 15: 1}
OK	68443-73-2	CC1CC(=CC(C1C(=C)C)C)C	{1: 4, 5: 1, 7: 1, 11: 1, 12: 3, 14: 1, 15: 1}
OK	68443-85-6	CC(C)CCCCCCCCCCCCCCC(=O)N(CCN)CCO	{1: 2, 2: 18, 3: 1, 33: 1, 20: 1, 24: 1, 30: 1}
OK	68444-11-1	C(CNCCN)N.F.F.F	{16: 3, 2: 4, 30: 2, 31: 1}
OK	68444-13-3	C(CNCCNCCN)N.F.F.F.F	{16: 4, 2: 6, 30: 2, 31: 2}
OK	68444-14-4	CCCCCC(=O)CC(=O)OCC(COC(=O)CC(=O)CCCCC)OC(=O)CC(=O)CCCCC	{24: 3, 1: 3, 2: 17, 3: 1, 28: 3}
OK	68444-28-0	CCCCCCCCCCCCCCC/C=C/C(=O)O.C(CO)NCCO	{1: 1, 2: 18, 6: 2, 20: 2, 27: 1, 31: 1}
OK	68444-33-7	CC(C)CCCCCCCCCCCCCCCCCCCCCCCO	{1: 2, 2: 23, 3: 1, 20: 1}
OK	6846-50-0	CC(C)C(C(C)(C)COC(=O)C(C)C)OC(=O)C(C)C	{1: 8, 2: 1, 3: 4, 4: 1, 28: 2}
OK	68475-65-0	CCCCCC(=O)NCCCO	{24: 1, 1: 1, 2: 7, 20: 1, 31: 1}
OK	68476-48-2	CCCCCCCCCCCCCCCCCC1CO1	{1: 1, 2: 16, 11: 1, 12: 1, 23: 1}
OK	68478-35-3	CCCCCCCCCCCCCCCCCCCCOC(=O)C	{1: 2, 2: 19, 28: 1}
OK	68479-01-6	CCCC(COCCCN(CCCNOC(=C)C)OC(=C)C)C(C)CCC(C)CC	{1: 6, 2: 12, 3: 3, 5: 2, 7: 2, 22: 3, 33: 1, 31: 1}
OK	68479-02-7	CCCC(C)C(CCC)COCCCNCCCN	{1: 3, 2: 11, 3: 2, 22: 1, 30: 1, 31: 1}
OK	68479-05-0	CCC(CO)(CO)CO.CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C	{1: 4, 2: 5, 34: 2, 4: 1, 8: 2, 11: 3, 12: 1, 13: 2, 20: 3, 29: 2}
OK	68479-07-2	CC1(CCCC(C1)N=C=O)N=C=O.C=CC(=O)OCCO	{1: 1, 2: 2, 34: 2, 5: 1, 6: 1, 8: 2, 11: 4, 12: 1, 13: 1, 20: 1, 28: 1, 29: 2}
OK	68479-77-6	C(COC(=O)C(CBr)Br)O	{28: 1, 2: 3, 3: 1, 20: 1, 18: 2}
OK	6848-84-6	C(CC[N+](=O)[O-])CC[N+](=O)[O-]	{2: 5, 38: 2}
OK	68480-04-6	CC1=CCC(C1(C)C)CC=C(C)C(C)O	{1: 5, 2: 1, 3: 1, 6: 1, 7: 1, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	68480-05-7	CCC(CC=CC1CC=C(C1(C)C)C)O	{1: 4, 2: 2, 3: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	68480-17-1	CCC(=O)CCC1C(=CCCC1(C)C)C	{1: 4, 2: 3, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	68480-24-0	CCC(=O)CC=CC1CC=C(C1(C)C)C	{1: 4, 2: 2, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	68480-25-1	CCCCCCCCCCC=CCO	{1: 1, 2: 10, 20: 1, 6: 2}
OK	68480-26-2	CCCCCCCCCCC=CCOC(=O)C	{1: 2, 2: 10, 28: 1, 6: 2}
OK	68480-27-3	CCCCCCCCC=CCOC(=O)C	{1: 2, 2: 8, 28: 1, 6: 2}
OK	68480-29-5	CCCCCCC#CC(=O)OCCC=CCC	{1: 2, 2: 8, 28: 1, 10: 2, 6: 2}
OK	68482-78-0	CC(=NCC1(CC(CC(C1)(C)C)N=C(C)C)C)C	{1: 7, 2: 1, 34: 2, 7: 2, 11: 3, 12: 1, 13: 2}
OK	6849-18-9	CCOC(=O)CC=C(C)C	{1: 3, 2: 2, 28: 1, 6: 1, 7: 1}
OK	6849-92-9	COCCNC(=O)NCCOC	{24: 1, 1: 2, 2: 4, 22: 2, 31: 2}
OK	685-09-6	COC(=O)C(=C(F)F)C(F)(F)F	{16: 5, 1: 1, 4: 1, 28: 1, 7: 2}
OK	685-27-8	CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F	{16: 6, 1: 1, 4: 2, 24: 2, 33: 1}
OK	685-63-2	C(=C(F)F)(C(=C(F)F)F)F	{16: 6, 7: 4}
OK	685-73-4	C(=O)[C@@H]([C@H]([C@H]([C@@H](C(=O)O)O)O)O)O	{27: 1, 26: 1, 3: 4, 20: 4}
OK	685-87-0	CCOC(=O)C(C(=O)OCC)Br	{1: 2, 2: 2, 3: 1, 28: 2, 18: 1}
OK	685-88-1	CCOC(=O)C(C(=O)OCC)F	{16: 1, 1: 2, 2: 2, 3: 1, 28: 2}
OK	685-91-6	CCN(CC)C(=O)C	{24: 1, 1: 3, 2: 2, 33: 1}
OK	6850-35-7	CC1CCCC(C1)N	{1: 1, 11: 4, 12: 2, 30: 1}
OK	6850-38-0	C1CCC(C(C1)N)O	{20: 1, 11: 4, 12: 2, 30: 1}
OK	6851-81-6	CC1(C(=O)NC(=O)N1C)C	{32: 1, 1: 3, 33: 1, 13: 1, 25: 2}
OK	68511-40-0	CC(C)CC(C)CCCCCCCOCCCN	{1: 3, 2: 11, 3: 2, 30: 1, 22: 1}
OK	68511-47-7	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCC/C=C\CCCCCCCCO.C(C(=O)O)C(CC(=O)O)(C(=O)O)O.C(C(CO)(CO)CO)O	{1: 2, 2: 37, 4: 2, 6: 2, 20: 6, 27: 4}
OK	68511-89-7	CCCCCCCC/C=C\CCCCCCCC(=O)O.C(COCCO)O.C(C(CO)O)O	{1: 1, 2: 20, 3: 1, 6: 2, 20: 5, 22: 1, 27: 1}
OK	68512-10-7	CCCCCCOC(=O)/C=C/C(=O)O	{1: 1, 2: 5, 27: 1, 28: 1, 6: 2}
OK	68513-04-2	CCCCC/C=C/CCC/C=C/C=C/CC#N	{1: 1, 2: 8, 37: 1, 6: 6}
OK	68514-33-0	C/C=C/C/C=C/C=C/C/C=C/C	{1: 2, 2: 2, 6: 8}
OK	68514-40-9	CC(C)C12CCC(CC1C(=O)OC)(C=C2)C	{1: 4, 3: 1, 11: 3, 12: 1, 13: 2, 14: 2, 28: 1}
OK	68515-69-5	CNCCN(CCN)CCN	{1: 1, 2: 6, 33: 1, 30: 2, 31: 1}
OK	68515-87-7	CC1=CC=CC1.C1C=CC=C1	{1: 1, 11: 2, 14: 7, 15: 1}
OK	68516-29-0	CC=CCC#CCCCCCCCCOC1CCCCO1	{1: 1, 2: 9, 6: 2, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	68516-31-4	CCCCCCCCCCCCCCCCOC(=O)CCCCl	{1: 1, 2: 18, 28: 1, 17: 1}
OK	68516-32-5	CCC=CC#CCCCCCCCCO	{1: 1, 2: 9, 20: 1, 10: 2, 6: 2}
OK	68516-35-8	CCCCCCCCCCCCCCC#CCCCCCCCCCCCCC	{1: 2, 2: 25, 10: 2}
OK	68516-38-1	CC(C)CCCC(C)CC=C(C(=CC(=O)O)C)C(=O)O	{1: 4, 2: 4, 3: 2, 6: 2, 7: 2, 27: 2}
OK	68519-95-9	CCC(OCC)OCC(C)OC(CC)OCC	{1: 5, 2: 5, 3: 3, 22: 4}
OK	68525-35-9	C1CCC2CC(C1)OO2	{11: 5, 12: 2, 23: 2}
OK	68526-44-3	CCCCCCCCC=CCCCCCCCC(=O)O.C1CN(C=N1)CCN	{1: 1, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 14: 1, 27: 1, 30: 1}
OK	68526-56-7	CC/C=C/CC/C=C/C=C	{1: 1, 2: 3, 5: 1, 6: 5}
OK	68526-86-3	CC(C)CCCCCCCCCCO	{1: 2, 2: 10, 3: 1, 20: 1}
OK	68526-87-4	CCCCCCCCCCCCCCC(C)CO	{1: 2, 2: 14, 3: 1, 20: 1}
OK	68527-33-3	CCCCCCCCCCCCOCCOCCOCCOC(=O)/C=C\C(=O)O	{1: 1, 2: 17, 6: 2, 22: 3, 27: 1, 28: 1}
OK	68527-45-7	CCCCCCCCCCCCCCCCCC(=O)NCCNCCNC(=O)C	{24: 2, 1: 2, 2: 20, 31: 3}
OK	68527-65-1	CN(C)CCCN(CCCN)CCCNCCCN	{1: 2, 2: 12, 33: 2, 30: 2, 31: 1}
OK	68527-73-1	CC(CCCC(C(C)(C)Br)OC)CO	{1: 4, 2: 4, 3: 2, 4: 1, 18: 1, 20: 1, 22: 1}
OK	68527-75-3	CC(CCCC(=C(C)C)OC)CO	{1: 4, 2: 4, 3: 1, 7: 2, 20: 1, 22: 1}
OK	68527-83-3	CCCCCCCCCCCCCCOCCC#N	{1: 1, 2: 15, 37: 1, 22: 1}
OK	68528-80-3	C1CC(=O)N(C1=O)OC(=O)CCCCCCC(=O)ON2C(=O)CCC2=O	{25: 4, 2: 6, 11: 4, 28: 2, 33: 2}
OK	68539-16-2	CC1(OC[C@H]2[C@@H](O1)[C@H]3[C@@](O2)(OC(O3)(C)C)C(=O)O)C	{1: 4, 11: 1, 12: 3, 13: 3, 23: 5, 27: 1}
OK	6854-84-8	C(C(=O)NN)SSCC(=O)NN	{24: 2, 40: 2, 2: 2, 30: 2, 31: 2}
OK	68555-34-0	CC1CC=CCC1COC(=O)CCCCC(=O)OCC2CC=CCC2C	{1: 2, 2: 6, 11: 4, 12: 4, 14: 4, 28: 2}
OK	68555-41-9	CCCN(CCC)CCN(CCC)CCC	{1: 4, 2: 10, 33: 2}
OK	68555-53-3	CC/C=C\CCCCC(OC)OC	{1: 3, 2: 5, 3: 1, 22: 2, 6: 2}
OK	68555-59-9	CC1CCCC(C1CCC(C)OC(=O)C)(C)C	{1: 5, 2: 2, 3: 1, 11: 3, 12: 2, 13: 1, 28: 1}
OK	68555-60-2	CCCCCC#CC(=O)OCCC(C)C	{1: 3, 2: 6, 3: 1, 28: 1, 10: 2}
OK	68555-61-3	CC1=CCCC(C1C=C(C)C(C)OC(=O)C)(C)C	{1: 6, 3: 1, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 28: 1}
OK	6856-01-5	C/C/1=C\[C@@H]2[C@@H]([C@@H](C/C(=C/CC1)/C)OC(=O)/C(=C/CO)/CO)C(=C)C(=O)O2	{1: 2, 2: 2, 5: 1, 6: 1, 7: 1, 11: 3, 12: 3, 14: 2, 15: 3, 20: 2, 28: 2}
OK	68568-81-0	CC1CC(OC(O1)CCC(C)CCC=C(C)C)(C)C	{1: 6, 2: 4, 3: 1, 6: 1, 7: 1, 11: 1, 12: 2, 13: 1, 23: 2}
OK	68575-73-5	CCCCOC(C(=O)OCCCC)O	{1: 2, 2: 6, 3: 1, 20: 1, 22: 1, 28: 1}
OK	68585-01-3	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCC(=O)O.CC(C)(CO)CO	{1: 4, 2: 30, 27: 2, 4: 1, 20: 2}
OK	68594-17-2	C1=NN=NN1N(Cl)Cl	{17: 2, 35: 3, 14: 1, 33: 2}
OK	686-43-1	CC(C)C(C(=O)NCC(=O)O)N	{1: 2, 2: 1, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	686-50-0	CC(C)C[C@@H](C(=O)NCC(=O)O)N	{1: 2, 2: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	686-96-4	CC(C)(C)C(=O)NC(C)(C)C	{24: 1, 1: 6, 4: 2, 31: 1}
OK	68601-97-8	CCCCCCCCCCCCCCCC(C(C(=O)O)O)O	{27: 1, 1: 1, 2: 14, 3: 2, 20: 2}
OK	68603-39-4	CCOCCCCCCCCN	{1: 1, 2: 9, 30: 1, 22: 1}
OK	68604-39-7	COC(=O)C/C=C/C=C/C=C/C=C/C=C/C=C	{1: 1, 2: 1, 28: 1, 5: 1, 6: 11}
OK	68604-84-2	COC(=O)/C=C/CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/C=C/C(=O)OC	{1: 2, 2: 30, 28: 2, 6: 4}
OK	68607-67-0	CC(C)(C)CCCCCCCCN=C	{1: 3, 2: 8, 34: 1, 4: 1, 5: 1}
OK	68609-09-6	CCCCCCCCCCCCCCCCCCCCCC(=O)O.CC(C)(CO)N	{1: 3, 2: 21, 4: 1, 20: 1, 27: 1, 30: 1}
OK	68609-89-2	C1CN(C=N1)CCO.C1CN(C=N1)CCO.C(CCCC(=O)O)CCCC(=O)O	{33: 2, 2: 11, 35: 2, 11: 4, 14: 2, 20: 2, 27: 2}
OK	68629-07-2	CC(C)CCCC(C)CCCC(C)CCCCC(C)CC=CC(C)CCCC(C)C	{1: 8, 2: 14, 3: 6, 6: 2}
OK	6863-58-7	CCC(C)OC(C)CC	{1: 4, 2: 2, 3: 2, 22: 1}
OK	68630-94-4	CCCCCCCCCCCCCCCCCCNC(CC(=O)OC)C(=O)OC	{1: 3, 2: 18, 3: 1, 28: 2, 31: 1}
OK	68631-03-8	CC(C)CCCCCOCC(CCl)O	{1: 2, 2: 7, 3: 2, 17: 1, 20: 1, 22: 1}
OK	68631-06-1	CCCCOCCCC.F.F	{16: 2, 1: 2, 2: 6, 22: 1}
OK	6864-37-5	CC1CC(CCC1N)CC2CCC(C(C2)C)N	{1: 2, 2: 1, 11: 6, 12: 6, 30: 2}
OK	68648-31-7	CCCCCCCC#N.CCC/C=C\CCCCCC#N	{1: 2, 2: 13, 37: 2, 6: 2}
OK	6865-92-5	C1N(CN(CN1CC#N)CC#N)CC#N	{33: 3, 2: 3, 11: 3, 37: 3}
OK	68650-93-1	CCCCCCCCC=CCCCCCCCC(=O)O.CC(C)N	{1: 3, 2: 14, 3: 1, 6: 2, 27: 1, 30: 1}
OK	68683-27-2	CCCCCCC1C=CC(CC1C(=O)OCC(CC)CCCC)CCCCCCCC(=O)O	{1: 3, 2: 17, 3: 1, 11: 1, 12: 3, 14: 2, 27: 1, 28: 1}
OK	68683-29-4	C=CC=C.C=CC#N	{5: 3, 6: 3, 37: 1}
OK	68683-33-0	CC(=O)OCC(COCC(COC(=O)C)(COC(=O)C)COC(=O)C)(COCC(COC(=O)C)(COC(=O)C)COC(=O)C)COC(=O)C	{1: 8, 2: 12, 4: 3, 22: 2, 28: 8}
OK	6869-17-6	C[C@@H]1[C@H]([C@H](C[C@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@@H](CCC5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O)O)O	{1: 2, 11: 11, 12: 8, 13: 4, 14: 1, 15: 1, 20: 4, 22: 1, 23: 1, 26: 1, 28: 1}
OK	6869-51-8	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3([C@@H]4[C@@H](CC[C@@]3(C2)O)[C@]5(CC[C@@H]([C@]5(C[C@H]4O)C)C6=CC(=O)OC6)O)C)O)O)O	{1: 3, 11: 9, 12: 10, 13: 4, 14: 1, 15: 1, 20: 6, 22: 1, 23: 1, 28: 1}
OK	68698-57-7	CC1=C(C2CC(C1(C2)C)C(=O)OC)C(=C)C	{1: 4, 5: 1, 7: 1, 11: 2, 12: 2, 13: 1, 15: 2, 28: 1}
OK	68698-58-8	CCCCCC#CC(=O)OCCC=CCC	{1: 2, 2: 7, 28: 1, 10: 2, 6: 2}
OK	687-38-7	C(C(C(=O)O)NC(=O)CN)O	{2: 2, 3: 1, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	687-46-7	CCOC(=O)C(=C)Cl	{1: 1, 2: 1, 5: 1, 7: 1, 17: 1, 28: 1}
OK	687-47-8	CCOC(=O)[C@H](C)O	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	687-48-9	CCOC(=O)N(C)C	{1: 3, 2: 1, 28: 1, 33: 1}
OK	687-63-8	C(C(C(=O)NCC(=O)O)N)O	{2: 2, 3: 1, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	687-68-3	CC(=C(C)CCC(=O)C)C	{24: 1, 1: 4, 2: 2, 7: 2}
OK	6870-67-3	C[C@@H]1C[C@]2([C@@H](O2)C)C(=O)O[C@@H]3CCN4[C@@H]3C(=CC4)COC(=O)[C@]1(C)O	{1: 3, 33: 1, 11: 5, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 23: 1, 28: 2}
OK	68715-87-7	CCCCCCCCC=CCCCCCCCCN(C)CCCN(C)C	{1: 4, 2: 18, 6: 2, 33: 2}
OK	6873-77-4	CCCCC(CC)C(C(=NO)C(CC)CCCC)O	{1: 4, 2: 8, 3: 3, 7: 1, 34: 1, 20: 2}
OK	68737-65-5	CN[C@@H]1CCCC[C@H]1NC	{1: 2, 11: 4, 12: 2, 31: 2}
OK	68738-47-6	CN1C=CN(C1=C)C	{1: 2, 33: 2, 5: 1, 14: 2, 15: 1}
OK	6874-10-8	CC(=C)CCC=C(C)C=C	{1: 2, 2: 2, 5: 2, 6: 2, 7: 2}
OK	6874-35-7	CC(CCCC(=C)C)C=C	{1: 2, 2: 3, 3: 1, 5: 2, 6: 1, 7: 1}
OK	6874-43-7	CC(CCC=C)C=C(C)C	{1: 3, 2: 2, 3: 1, 5: 1, 6: 2, 7: 1}
OK	6874-80-2	CC(=O)C1CCC(C23C1CC(CC2)(CC3)C)(C)C	{24: 1, 1: 4, 11: 7, 12: 2, 13: 3}
OK	68743-79-3	CC(C1CCC(C(O1)OC2C(CC(C(C2O)N(C)C(=O)CN)OC)N)N)N	{1: 3, 2: 1, 3: 1, 33: 1, 11: 3, 12: 8, 20: 1, 22: 2, 23: 1, 24: 1, 30: 4}
OK	68750-16-3	CC(C)(CNCCO)N	{1: 2, 2: 3, 4: 1, 20: 1, 30: 1, 31: 1}
OK	68757-58-4	CCCCCCOCCOC(=O)C(C)(C)C	{1: 4, 2: 7, 4: 1, 22: 1, 28: 1}
OK	68758-63-4	CCOC(=O)C(=C1C=CC(=O)C=C1)N.Cl	{1: 1, 2: 1, 7: 1, 14: 4, 15: 1, 17: 1, 25: 1, 28: 1, 30: 1}
OK	68758-70-3	COC(=O)C(=C1C=CC(=O)C=C1)N.Cl	{1: 1, 7: 1, 14: 4, 15: 1, 17: 1, 25: 1, 28: 1, 30: 1}
OK	68758-73-6	C1CN(CN1)CCNCCN	{32: 1, 33: 1, 2: 4, 11: 3, 30: 1, 31: 1}
OK	68758-86-1	CNC(=O)CCC(=O)OC	{24: 1, 1: 2, 2: 2, 28: 1, 31: 1}
OK	68758-89-4	CN1C(=O)C(=CCC=CC=C2C(=O)N(C(=O)N(C2=O)C)C)C(=O)N(C1=O)C	{1: 4, 2: 1, 6: 4, 33: 4, 15: 2, 25: 6}
OK	6876-10-4	CC(=C1CCC(=C)CC1)C	{15: 2, 1: 2, 11: 4, 5: 1, 7: 1}
OK	6876-18-2	CCCCC(C(C)C)C(C)C	{1: 5, 2: 3, 3: 3}
OK	6876-23-9	C[C@@H]1CCCC[C@H]1C	{1: 2, 11: 4, 12: 2}
OK	68766-96-1	CCOC(=O)[C@H]1CCC(=O)N1	{32: 1, 1: 1, 2: 1, 11: 2, 12: 1, 25: 1, 28: 1}
OK	68777-98-0	CC(=O)OC(C)(C)N([N+](=O)C(C)(C)OC(=O)C)[O-]	{1: 6, 4: 2, 29: 2, 28: 2, 33: 2}
OK	68777-99-1	CC(=O)CC(C)(C)N([N+](=O)C(C)(C)CC(=O)C)[O-]	{1: 6, 2: 2, 4: 2, 33: 2, 24: 2, 29: 2}
OK	68784-18-9	CC(C)C[C@@H](C(=O)O)N.C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O	{1: 2, 2: 2, 3: 6, 20: 5, 26: 1, 27: 1, 30: 1}
OK	68784-39-4	CCCCCCCCCOCCC#N	{1: 1, 2: 10, 37: 1, 22: 1}
OK	68784-90-7	CCCCCCCCCCCCCCCC(=O)OC(CC(C)C)CC(C)CC(C)C	{1: 6, 2: 17, 3: 4, 28: 1}
OK	68784-91-8	CCCCCCCCCCCCCCCCCC(=O)OC(CC(C)C)CC(C)CC(C)C	{1: 6, 2: 19, 3: 4, 28: 1}
OK	68789-89-9	CN(SSN(C(=O)O/N=C\1/SCCSC1)C)C(=O)O/N=C\2/SCCSC2	{1: 2, 34: 2, 33: 2, 40: 2, 41: 4, 11: 6, 15: 2, 28: 2}
OK	68789-90-2	C/C(=N/OC(=O)N(SSN(C(=O)O/N=C(\SC)/C)C)C)/SC	{1: 6, 34: 2, 33: 2, 40: 4, 7: 2, 28: 2}
OK	68789-93-5	C/C(=N/OC(=O)N(SSN(C(=O)O/N=C(\SCCC#N)/C)C)C)/SCCC#N	{1: 4, 2: 4, 37: 2, 33: 2, 40: 4, 7: 2, 34: 2, 28: 2}
OK	6879-74-9	C[C@H]1CCC[C@@H](N1C)C=C[C@@H]2[C@H]3CCCC[C@@H]3C[C@H]4[C@@H]2[C@@H](OC4=O)C	{1: 3, 6: 2, 33: 1, 11: 8, 12: 8, 28: 1}
OK	68795-10-8	C(C([N+](=O)[O-])[N+](=O)[O-])F	{16: 1, 2: 1, 3: 1, 38: 2}
OK	68797-53-5	C1=CC=[N+](C=C1)CC=CC[N+]2=CC=CC=C2.[Cl-].[Cl-]	{17: 2, 2: 2, 14: 10, 6: 2, 33: 2}
OK	68797-62-6	CCCCCCCCCCCCCCCCCC(=O)O.C(CO)NCCO.C(=O)(N)N	{1: 1, 2: 20, 20: 2, 24: 1, 27: 1, 30: 2, 31: 1}
OK	68797-66-0	CCCN(CCC)CCC.CCC(=O)O	{1: 4, 2: 7, 27: 1, 33: 1}
OK	68797-68-2	CC(CCCC(C)(C)O)CC#N	{1: 3, 2: 4, 3: 1, 4: 1, 37: 1, 20: 1}
OK	68797-69-3	CCCCCCC1OCC#CCO1	{1: 1, 2: 5, 10: 2, 11: 2, 12: 1, 23: 2}
OK	68797-72-8	CCCCCC1=C(CC(C1=O)C(=O)OCC)C	{1: 3, 2: 5, 11: 1, 12: 1, 15: 2, 25: 1, 28: 1}
OK	68797-74-0	CCCCCC(=O)OC1CCC(CC1)C(C)(C)C	{1: 4, 2: 4, 4: 1, 11: 4, 12: 2, 28: 1}
OK	688-14-2	CC(C)CC(C(=O)O)NC(=O)CN	{1: 2, 2: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	688-82-4	CCCCCCC(OCC)OCC	{1: 3, 2: 7, 3: 1, 22: 2}
OK	688-84-6	CCCCC(CC)COC(=O)C(=C)C	{1: 3, 2: 5, 3: 1, 5: 1, 7: 1, 28: 1}
OK	688-99-3	CCC(CC=C)O	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 20: 1}
OK	6881-94-3	CCCOCCOCCO	{1: 1, 2: 6, 20: 1, 22: 2}
OK	68814-95-9	CCCCCCCCCC(CCCCCCCC)N(C(CCCCCCCC)CCCCCCCCC)C(CCCCCCCC)CCCCCCCCC	{1: 6, 2: 45, 3: 3, 33: 1}
OK	68815-44-1	CCCCCCCCCC(=O)O.C=CC(=O)O.C=CC(=O)O.C(CNCCO)N	{1: 1, 2: 12, 5: 2, 6: 2, 20: 1, 27: 3, 30: 1, 31: 1}
OK	68815-50-9	CCCCCCCCCCCCCCCCCC(=O)O.C(CNCCO)N	{1: 1, 2: 20, 20: 1, 27: 1, 30: 1, 31: 1}
OK	68815-51-0	CCCCCCCC/C=C\CCCCCCCC(=O)O.C(CNCCO)N	{1: 1, 2: 18, 6: 2, 20: 1, 27: 1, 30: 1, 31: 1}
OK	68815-53-2	CCC(=O)C.CC(=CCC/C(=C/C=O)/C)C.CO	{1: 6, 2: 3, 6: 2, 7: 2, 20: 1, 24: 1, 26: 1}
OK	68815-54-3	CCCCCCC(=O)O.CC(=O)C=C.C(CNCCO)N	{1: 2, 2: 9, 5: 1, 6: 1, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	68815-69-0	CC(C(=O)O)O.C(CO)N	{1: 1, 2: 2, 3: 1, 20: 2, 27: 1, 30: 1}
OK	68820-32-6	CCCCCCC=CCCC=O	{1: 1, 2: 7, 26: 1, 6: 2}
OK	68820-33-7	CCCCCCC=CCCCC=O	{1: 1, 2: 8, 26: 1, 6: 2}
OK	68832-13-3	C1C[C@@H](NC1)CO	{32: 1, 20: 1, 2: 1, 11: 3, 12: 1}
OK	68833-92-1	CCCCC(CC)CCC(=O)C=C(C)C	{1: 4, 2: 6, 3: 1, 6: 1, 7: 1, 24: 1}
OK	68833-94-3	CCCCCCCCCCCCCCCCCCCCCC(=O)O.CCN(CC)CC	{1: 4, 2: 23, 27: 1, 33: 1}
OK	68834-09-3	CCCCCCCCCC(=O)NCCNCCNCCNCCN	{24: 1, 1: 1, 2: 16, 30: 1, 31: 4}
OK	68842-05-7	C(N=O)(Br)(Br)Br	{18: 3, 34: 1, 4: 1, 29: 1}
OK	68844-99-5	CC(C)SSSC	{40: 3, 1: 3, 3: 1}
OK	68845-30-7	CC(C)CCCCCCCOC(=O)CS	{1: 2, 2: 8, 3: 1, 28: 1, 39: 1}
OK	68856-30-4	CCCCCCCC/C=C\CCCCCCCCNCCCN.CC(=O)O	{1: 2, 2: 18, 6: 2, 27: 1, 30: 1, 31: 1}
OK	68856-37-1	CCCCCCCCC=CCCCCCCCCNCCCN.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 22, 6: 2, 27: 2, 30: 1, 31: 1}
OK	68856-43-9	CC(=C)C(=O)OCC(COCCOCC(COC(=O)C(=C)C)O)O	{1: 2, 2: 6, 3: 2, 5: 2, 7: 2, 20: 2, 22: 2, 28: 2}
OK	6886-16-4	CC(C)CCC(C)CO	{1: 3, 2: 3, 3: 2, 20: 1}
OK	68867-57-2	CC1CCC23CC1C(C2C(C=C3C)C(=O)C)(C)C	{1: 5, 11: 3, 12: 4, 13: 2, 14: 1, 15: 1, 24: 1}
OK	68867-66-3	CCCCCCCCCCCCCCCCCCOCCCNCCCN	{1: 1, 2: 23, 30: 1, 22: 1, 31: 1}
OK	68876-80-2	CCC/C=C/C/C=C/CC	{1: 2, 2: 4, 6: 4}
OK	68876-96-0	C1C(O1)CCl.C(C#CCO)O	{2: 3, 10: 2, 11: 1, 12: 1, 17: 1, 20: 2, 23: 1}
OK	68877-34-9	CCCCC(CC)COCCCNCCCN	{1: 2, 2: 11, 3: 1, 22: 1, 30: 1, 31: 1}
OK	68877-35-0	CCCCC(CC)COCCCNCCCN.CC(=O)O	{1: 3, 2: 11, 3: 1, 22: 1, 27: 1, 30: 1, 31: 1}
OK	68877-57-6	C#COC1CCCCC1	{9: 1, 10: 1, 11: 5, 12: 1, 22: 1}
OK	68880-55-7	C[C@@H]1C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)O)N(C)C)O)CC=O)C)OC4CC[C@@H]([C@H](O4)C)N(C)C.C(CCC(=O)O)CC(=O)O	{1: 11, 2: 5, 33: 2, 11: 6, 12: 18, 13: 1, 14: 4, 20: 4, 22: 4, 23: 3, 26: 1, 27: 2, 28: 1}
OK	68882-69-9	C1CC2C1C(=O)CCC2=O	{25: 2, 11: 4, 12: 2}
OK	68889-71-4	C1CC2CC1C3C2C(C(C3)CN)CN	{2: 2, 11: 4, 12: 6, 30: 2}
OK	68889-96-3	CC1CCC(C(C1)OC(=O)C(=O)OC2CC(CCC2C(C)C)C)C(C)C	{11: 6, 1: 6, 3: 2, 12: 6, 28: 2}
OK	6889-41-4	C12C(C(=O)NC1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl	{32: 1, 12: 2, 13: 3, 15: 2, 17: 6, 25: 2}
OK	68891-50-9	C=CC=C.C=CC#N.C=CC(=O)O	{27: 1, 5: 4, 6: 4, 37: 1}
OK	68891-88-3	CC(CCC1=CCC(CC1)C=O)C(C)(C)O	{1: 3, 2: 2, 3: 1, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1, 26: 1}
OK	68891-89-4	CC1=CCC2C(C1C3(OCCO3)C)C2(C)C	{1: 4, 11: 3, 12: 3, 13: 2, 14: 1, 15: 1, 23: 2}
OK	68891-90-7	CCC(=CCC(C)(C)C(=O)OC)C	{1: 5, 2: 2, 4: 1, 6: 1, 7: 1, 28: 1}
OK	68891-91-8	CC1CCCC(C2C1CC(C2)C(=C)C)COC(=O)C	{1: 3, 2: 1, 5: 1, 7: 1, 11: 5, 12: 5, 28: 1}
OK	68891-92-9	C(CS)C(=O)OCCOCCOCCOCCOC(=O)CCS	{2: 12, 28: 2, 22: 3, 39: 2}
OK	68891-95-2	CC1CCC2C13CC(C2(C)C)C(C(=O)C3)C	{1: 4, 11: 4, 12: 4, 13: 2, 25: 1}
OK	68891-98-5	CC(CN(CCN)CCN)O	{1: 1, 2: 5, 3: 1, 33: 1, 20: 1, 30: 2}
OK	68892-05-7	CC(=CCCC(=CCOC(=O)CCCCCCCCC=C)C)C	{1: 3, 2: 11, 5: 1, 6: 3, 7: 2, 28: 1}
OK	68892-06-8	CN(CC(=O)OC)C=O	{1: 2, 2: 1, 28: 1, 26: 1, 33: 1}
OK	68892-15-9	CC(C)C1(CCC(O1)(C)C=C)O	{1: 3, 3: 1, 5: 1, 6: 1, 11: 2, 13: 2, 20: 1, 23: 1}
OK	68892-25-1	CCC(C)(C=CCC(C)C)O	{1: 4, 2: 2, 3: 1, 4: 1, 6: 2, 20: 1}
OK	689-00-9	CCCC(=O)C#C	{24: 1, 1: 1, 2: 2, 10: 1, 9: 1}
OK	689-11-2	CCC(C)NC(=O)N	{1: 2, 2: 1, 3: 1, 24: 1, 30: 1, 31: 1}
OK	689-12-3	CC(C)OC(=O)C=C	{1: 2, 3: 1, 28: 1, 5: 1, 6: 1}
OK	689-13-4	C(C(=O)O)N(C=O)O	{33: 1, 2: 1, 27: 1, 20: 1, 26: 1}
OK	689-39-4	CC(C)CC(=CCCC(=O)C)C	{1: 4, 2: 3, 3: 1, 6: 1, 7: 1, 24: 1}
OK	689-66-7	CC(C)CCCC(=CCCC(=O)C)C	{1: 4, 2: 5, 3: 1, 6: 1, 7: 1, 24: 1}
OK	689-67-8	CC(=CCCC(=CCCC(=O)C)C)C	{24: 1, 1: 4, 2: 4, 6: 2, 7: 2}
OK	689-89-4	C/C=C/C=C/C(=O)OC	{1: 2, 28: 1, 6: 4}
OK	689-97-4	C=CC#C	{9: 1, 10: 1, 5: 1, 6: 1}
OK	689-98-5	C(CCl)N	{17: 1, 2: 2, 30: 1}
OK	689-99-6	C(#CF)F	{16: 2, 10: 2}
OK	6890-62-6	C1=CN(C=CC1=O)O	{25: 1, 21: 1, 14: 4, 33: 1}
OK	68900-86-7	CCCCCCCCCCC=CCCO	{1: 1, 2: 11, 20: 1, 6: 2}
OK	68900-88-9	CC(C)CC=CCCO	{1: 2, 2: 3, 3: 1, 20: 1, 6: 2}
OK	68900-94-7	CCCCCCCCCCCCCCCCCC(=O)NCCNCCOC(=O)CCCCCCCCCCCCCCCCC	{24: 1, 1: 2, 2: 36, 28: 1, 31: 2}
OK	68900-96-9	CCCCC/C=C/C/C=C/CCCCCCCC(=O)O.CCCCC/C=C/C/C=C/CCCCCCCC(=O)O.CCCCC/C=C/C/C=C/CCCCCCCC(=O)O.CCCCC/C=C/C/C=C/CCCCCCCC(=O)O.CCCCC/C=C/C/C=C/CCCCCCCC(=O)O.CCCCC/C=C/C/C=C/CCCCCCCC(=O)O.CCCCC/C=C/C/C=C/C=C/C/C=C/CCC(=O)O.CCCC/C=C/C/C=C/CCCC/C=C/C=C/CCC(=O)O.CCC/C=C/C=C/C/C=C/C=C/CCCCCC(=O)O.CCC/C=C/C=C/C/C=C/C=C/C=C/CCCC(=O)O.CC/C=C/CCCCCCC/C=C/C=C/CCCC(=O)O.C(O)C(O)CO.C(O)C(O)CO.C(O)C(O)CO	{1: 11, 2: 121, 3: 3, 6: 64, 20: 9, 27: 11}
OK	68901-06-4	CC(=C)C(=O)OCCCOCCCOCCCOC(=O)C(=C)C	{1: 2, 2: 9, 5: 2, 7: 2, 22: 2, 28: 2}
OK	68901-23-5	C1CCC(C(C1)C(=O)O)C(=O)OCC(COC(=O)C2CCCCC2C(=O)O)OC(=O)C3CCCCC3C(=O)O	{2: 2, 3: 1, 11: 12, 12: 6, 27: 3, 28: 3}
OK	68908-14-5	CC(C)CCCCCCCOC(=O)CCS	{1: 2, 2: 9, 3: 1, 28: 1, 39: 1}
OK	68909-31-9	CCCNCCCCCCCCCCC(C)C	{1: 3, 2: 12, 3: 1, 31: 1}
OK	68909-99-9	C=CC#N.C(CN)N	{2: 2, 30: 2, 5: 1, 6: 1, 37: 1}
OK	68921-49-3	CCCCCCCCCCCCCCCCCCOC(=O)CCC(=O)O	{1: 1, 2: 19, 27: 1, 28: 1}
OK	68921-51-7	CCCCCCCCCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCCCCCCCCC	{1: 2, 2: 28, 28: 2, 6: 2}
OK	68921-52-8	CCCCCCCCCCCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCCCCCCCCCCC	{1: 2, 2: 32, 28: 2, 6: 2}
OK	68921-54-0	CCCCCCCCCCCCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCC	{1: 2, 2: 24, 28: 2, 6: 2}
OK	68921-78-8	CN1CCSC1=CC=CC2=[N+](CCS2)C.[I-]	{1: 2, 6: 3, 33: 2, 41: 2, 11: 4, 15: 2, 19: 1}
OK	68921-82-4	CC(=C)C1CCC(CC1)(C)S	{1: 2, 5: 1, 7: 1, 11: 4, 12: 1, 13: 1, 39: 1}
OK	68922-00-9	CCCCCCC=CCOC(=O)CCC	{1: 2, 2: 8, 28: 1, 6: 2}
OK	68922-03-2	CCCCCCCCCCC1CCC(=O)OC1	{1: 1, 2: 9, 11: 3, 12: 1, 28: 1}
OK	68922-10-1	CC(C)CC(=O)OCCC(C)CCC=C(C)C	{1: 5, 2: 5, 3: 2, 6: 1, 7: 1, 28: 1}
OK	68922-15-6	CCCCCCC(CC(=O)O)COC(=O)C	{27: 1, 1: 2, 2: 7, 3: 1, 28: 1}
OK	68922-16-7	CCCCCC(C(C)CC(=O)O)OC(=O)C	{27: 1, 1: 3, 2: 5, 3: 2, 28: 1}
OK	68922-17-8	CC1CCCN(C1)CN2CCCC(C2)C	{1: 2, 2: 1, 11: 8, 12: 2, 33: 2}
OK	68928-35-8	C(CSSCCC(=O)OCC(CO)O)C(=O)OCC(CO)O	{40: 2, 28: 2, 2: 8, 3: 2, 20: 4}
OK	68928-36-9	C(CSCCC(=O)OCC(CO)O)C(=O)OCC(CO)O	{40: 1, 28: 2, 2: 8, 3: 2, 20: 4}
OK	68928-46-1	C(CS)C(=O)OCC(C(C(C(COC(=O)CCS)O)O)O)O	{28: 2, 2: 6, 3: 4, 20: 4, 39: 2}
OK	68928-51-8	C1(SC(SC(S1)C(=O)O)C(=O)O)C(=O)O	{41: 3, 27: 3, 12: 3}
OK	68928-65-4	CCC(CO)(CO)CO.C(CSCCC(=O)O)C(=O)O.C(COCCO)O	{1: 1, 2: 12, 4: 1, 40: 1, 20: 5, 22: 1, 27: 2}
OK	68928-66-5	CC1CO1.C1CO1.C(CCCN)CCN	{1: 1, 2: 6, 11: 3, 12: 1, 23: 2, 30: 2}
OK	68928-67-6	CC1CO1.C1CCC(C(C1)N)N.C1CO1	{1: 1, 11: 7, 12: 3, 30: 2, 23: 2}
OK	68928-72-3	CC(=O)OC=C.C=CN1CCCC1=O.C=C(CC(=O)O)C(=O)O	{1: 1, 2: 1, 5: 3, 6: 2, 7: 1, 11: 3, 25: 1, 33: 1, 27: 2, 28: 1}
OK	68928-75-6	CCC(=O)OCCCCCC(C)C	{1: 3, 2: 6, 3: 1, 28: 1}
OK	68928-77-8	CCC(COCCCSCCC(=O)OCCCCCCCCCCC(C)C)(COCCCSCCC(=O)OCCCCCCCCCCC(C)C)COC(=O)CCSCCC(=O)OCCCCCCCCCCC(C)C	{1: 7, 2: 48, 3: 3, 4: 1, 40: 3, 22: 2, 28: 4}
OK	68928-90-5	CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)OC(=O)C(=O)C	{24: 1, 1: 4, 2: 5, 4: 1, 28: 4}
OK	68928-93-8	CC1CO1.C(COCCO)O.C(C(CO)O)O	{1: 1, 2: 6, 3: 1, 11: 1, 12: 1, 20: 5, 22: 1, 23: 1}
OK	68928-96-1	CC1CO1.C1CO1.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O.C(CCO)CO	{1: 1, 2: 5, 34: 2, 8: 2, 11: 5, 12: 1, 13: 2, 14: 8, 20: 2, 23: 2, 29: 2}
OK	68928-98-3	CCCCOC(=O)C=C.CCC(=C)C(=O)O.CC(=C)C(=O)O.CC(=C)C(=O)OCC1CO1	{1: 4, 2: 5, 5: 4, 6: 1, 7: 3, 11: 1, 12: 1, 23: 1, 27: 2, 28: 2}
OK	68929-16-8	CCCCCCCCCCCCCCCCCC(=O)O.CCN(CC)CCO	{1: 3, 2: 20, 27: 1, 20: 1, 33: 1}
OK	68929-20-4	CC(C)(CO)N.C=CC(=O)O	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 20: 1, 27: 1, 30: 1}
OK	6893-26-1	C(CC(=O)O)[C@H](C(=O)O)N	{27: 2, 2: 2, 3: 1, 30: 1}
OK	68936-89-0	CCCCCC[C@H](C/C=C\CCCCCCCC(=O)O)O.C(C(CO)O)O	{1: 1, 2: 15, 3: 2, 6: 2, 20: 4, 27: 1}
OK	68937-11-1	CCCCCCCCCCCCCCCCCCCOC(=O)/C=C\C(=O)O	{1: 1, 2: 18, 27: 1, 28: 1, 6: 2}
OK	68937-14-4	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCC(=O)O.C(C(CO)(CO)CO)O	{1: 3, 2: 21, 27: 3, 4: 1, 20: 4}
OK	68937-22-4	CCCCCCC(=O)O.CCCC(=O)O.C(C(CO)(CO)CO)O	{1: 2, 2: 11, 27: 2, 4: 1, 20: 4}
OK	68937-32-6	CC(CO)O.CSCC[C@@H](C(=O)O)N	{1: 2, 2: 3, 3: 2, 40: 1, 20: 2, 27: 1, 30: 1}
OK	68938-56-7	CC(=O)C1(CC=CC(C1)(C)C)C	{24: 1, 1: 4, 11: 2, 13: 2, 14: 2}
OK	68938-71-6	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.C1CCC(CC1)NC2CCCCC2.C1CCC(CC1)NC2CCCCC2	{1: 2, 2: 24, 6: 8, 11: 20, 12: 4, 27: 2, 31: 2}
OK	68938-75-0	CCCC(CC)COCC(CN(CC)CC)OCC(CN(CC)CC)O.Cl.Cl	{1: 6, 2: 12, 3: 3, 33: 2, 17: 2, 20: 1, 22: 2}
OK	68938-76-1	CCCC(CC)COCC(CCl)OCC(CCl)O	{1: 2, 2: 8, 3: 3, 17: 2, 20: 1, 22: 2}
OK	68938-83-0	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CC1CO1.C1CO1	{1: 2, 2: 12, 6: 4, 11: 3, 12: 1, 23: 2, 27: 1}
OK	68938-98-7	CCCCCCCCCCCCC/C=C/C=C/C(=O)O.C(CO)N(CCO)CCO	{1: 1, 2: 18, 6: 4, 33: 1, 20: 3, 27: 1}
OK	68951-61-1	CC(C)C[C@@H](C(=O)O)N.C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O.C(C(CO)O)O	{1: 2, 2: 4, 3: 7, 20: 8, 26: 1, 27: 1, 30: 1}
OK	68952-18-1	C=CC/C=C/N	{2: 1, 30: 1, 5: 1, 6: 3}
OK	68954-02-9	C(CCCC(=O)O)CCCC(=O)O.C(CO)N(CCO)CCO	{33: 1, 2: 13, 27: 2, 20: 3}
OK	68954-57-4	CCCCCCCCCCCCCCCCCC(=O)O.C(CNCCN)N.C(CNCCNCCN)N	{1: 1, 2: 26, 27: 1, 30: 4, 31: 3}
OK	68955-15-7	CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C.CCC(CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H]([C@H]4C)O)C)C)C(C)C.C[C@H](CC[C@@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C	{1: 19, 2: 8, 3: 9, 11: 24, 12: 17, 13: 6, 14: 2, 15: 2, 20: 3}
OK	68955-39-5	C/C=C/CC/C=C/CCCCO	{1: 1, 2: 6, 20: 1, 6: 4}
OK	68955-44-2	CCCCCCCC(=O)N(CCO)CCO	{24: 1, 1: 1, 2: 10, 20: 2, 33: 1}
OK	68955-45-3	CCCCCCCCCCCCCCCC(=O)N/C=C/NC(=O)CCCCCCCCCCCCCCC	{24: 2, 1: 2, 2: 28, 6: 2, 31: 2}
OK	68955-46-4	CCCCCCCCC/C=C/CC/C=C/CCC(=O)N/C=C/NC(=O)CCCCC/C=C/CCC/C=C/CCCCC	{24: 2, 1: 2, 2: 24, 6: 10, 31: 2}
OK	68955-56-6	CCCCCCCCCCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCNCCCCCCCCCCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCC	{1: 2, 2: 62, 6: 8, 31: 1}
OK	68957-79-9	CC(C)CCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCC(C)C	{1: 6, 2: 38, 3: 4, 28: 3}
OK	68957-80-2	CC(C)CCCCCCCCCCCCC(=O)OCC(C)(C)COC(=O)CCCCCCCCCCCCC(C)C	{1: 6, 2: 26, 3: 2, 4: 1, 28: 2}
OK	68957-81-3	CC(C)CCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCC(C)C)(COC(=O)CCCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCCC(C)C	{1: 8, 2: 52, 3: 4, 4: 1, 28: 4}
OK	68957-99-3	CC(=O)OC=C.COC(=O)/C=C\C(=O)OC.C=CO	{1: 3, 20: 1, 5: 2, 6: 4, 28: 3}
OK	68958-01-0	CC(=C)C(=O)NC.CC(=C)C(=O)OC	{1: 4, 5: 2, 7: 2, 24: 1, 28: 1, 31: 1}
OK	68958-08-7	C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCCO)CCO	{2: 7, 8: 2, 11: 13, 12: 4, 34: 2, 20: 2, 28: 1, 29: 2}
OK	68958-39-4	CC1CO1.C(CNCCNCCNCCN)N	{1: 1, 2: 8, 11: 1, 12: 1, 23: 1, 30: 2, 31: 3}
OK	68958-54-3	CC(C)CCCCCCCCCCCCCCC(=O)OCC(C)OC(=O)CCCCCCCCCCCCCCC(C)C	{1: 5, 2: 29, 3: 3, 28: 2}
OK	68958-79-2	CCCC(O)O.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 7, 3: 1, 8: 2, 11: 8, 12: 4, 34: 2, 20: 2, 27: 2, 29: 2}
OK	68959-08-0	CCCCCCCCCCCCCCCCCC1=NCCN1CCNC(=O)CCCCCCCCCCCCCCCCC.CC(=O)O	{1: 3, 2: 34, 35: 1, 33: 1, 11: 2, 15: 1, 24: 1, 27: 1, 31: 1}
OK	68959-23-9	C1C(O1)COCCCCC(COCC2CO2)OCC3CO3	{2: 8, 3: 1, 11: 3, 12: 3, 22: 3, 23: 3}
OK	68959-24-0	CC(C)C(C(C)(C)COCCOCCO)OCCO	{1: 4, 2: 7, 3: 2, 4: 1, 20: 2, 22: 3}
OK	68959-25-1	CC(C)C(C(C)(C)COCCO)O	{1: 4, 2: 3, 3: 2, 4: 1, 20: 2, 22: 1}
OK	68959-31-9	CCCCCCCCCCCCCCCCCC(=O)N1CCN(C(=O)N(CCN(C1=O)C(=O)CCCCCCCCCCCCCCCCC)CCO)CCO	{1: 2, 2: 36, 33: 4, 11: 4, 20: 2, 24: 2, 25: 2}
OK	68966-35-8	CC(C(CO)(CO)C(C)(C)NC(=O)C=C)O	{1: 3, 2: 2, 3: 1, 4: 2, 5: 1, 6: 1, 20: 3, 24: 1, 31: 1}
OK	68966-42-7	CCCCCCC1=NCCN1CCO	{1: 1, 2: 7, 35: 1, 33: 1, 11: 2, 15: 1, 20: 1}
OK	68966-71-2	CC(C)C(C(C)(C)COCCO)OCCO	{1: 4, 2: 5, 3: 2, 4: 1, 20: 2, 22: 2}
OK	68969-35-7	CCCCOC(=O)C=CC(=O)OCC=C	{1: 1, 2: 4, 28: 2, 5: 1, 6: 3}
OK	68970-04-7	CC(C)CN(C)N(C)C	{1: 5, 2: 1, 3: 1, 33: 2}
OK	68970-05-8	CC(C)CN(C)N(C)CC(C)C	{1: 6, 2: 2, 3: 2, 33: 2}
OK	68970-06-9	CC(C)CN(C)N(CC(C)C)CC(C)C	{1: 7, 2: 3, 3: 3, 33: 2}
OK	68970-07-0	CC(C)CN(CC(C)C)N(CC(C)C)CC(C)C	{1: 8, 2: 4, 3: 4, 33: 2}
OK	68970-08-1	CC(C)(C)CN(C)N(C)C	{1: 6, 2: 1, 4: 1, 33: 2}
OK	68970-09-2	CC(C)(C)CN(C)N(C)CC(C)(C)C	{1: 8, 2: 2, 4: 2, 33: 2}
OK	68970-10-5	CCCCCCCN(CCCCCCC)N(C)C	{1: 4, 2: 12, 33: 2}
OK	68970-11-6	CN(C)N1CCCCCCC1	{1: 2, 11: 7, 33: 2}
OK	68973-20-6	CCCCCC=CC=CC(=O)C	{24: 1, 1: 2, 2: 4, 6: 4}
OK	68975-45-1	CCCCCCCCOC(C)C	{1: 3, 2: 7, 3: 1, 22: 1}
OK	68975-76-8	CCCCCCCCCCCCCOCOCCCCCCCCCCCCC	{1: 2, 2: 25, 22: 2}
OK	68975-77-9	CCC(C(=CC1CC2CC1C=C2)C)O	{1: 2, 2: 1, 3: 1, 6: 1, 7: 1, 11: 2, 12: 3, 14: 2, 20: 1}
OK	68975-78-0	CC1CN(C(=N1)C)C(=O)NCC2(CC(CC(C2)(C)C)NC(=O)N3CC(N=C3C)C)C	{1: 7, 2: 1, 35: 2, 33: 2, 11: 5, 12: 3, 13: 2, 15: 2, 24: 2, 31: 2}
OK	68975-81-5	CCCCCCCCOC(=O)CC(C)CC(C)(C)C(=O)OCCCCCCCC	{1: 5, 2: 16, 3: 1, 4: 1, 28: 2}
OK	68975-82-6	CCC(COC(=O)NCC1(CC(CC(C1)(C)C)N=C=O)C)(COC(=O)NCC2(CC(CC(C2)(C)C)N=C=O)C)COC(=O)NCC3(CC(CC(C3)(C)C)N=C=O)C	{1: 10, 2: 7, 34: 3, 4: 1, 8: 3, 11: 9, 12: 3, 13: 6, 28: 3, 29: 3, 31: 3}
OK	68975-84-8	CC1(CC(CC(C1)(C)CNC(=O)OCCOCCOC(=O)NCC2(CC(CC(C2)(C)C)N=C=O)C)N=C=O)C	{1: 6, 2: 6, 34: 2, 8: 2, 11: 6, 12: 2, 13: 4, 22: 1, 28: 2, 29: 2, 31: 2}
OK	68975-86-0	C(CCCN=C=O)CCN=C=O.C(CCCN=C=O)CCN=C=O.C(CCCN=C=O)CCN=C=O.C(CCC(=O)O)CC(=O)O.C(CO)COCCCO	{2: 28, 8: 6, 34: 6, 20: 2, 22: 1, 27: 2, 29: 6}
OK	6898-75-5	CCCCN=CC(C)C	{1: 3, 2: 3, 3: 1, 34: 1, 6: 1}
OK	68987-96-2	CCCCC(=O)OC[C@H](CO)O	{1: 1, 2: 5, 3: 1, 20: 2, 28: 1}
OK	68989-90-2	CCCCCCCCCCO.CCCCCCCCO.CCCCCCO.C(CCC(=O)O)CC(=O)O.C(CCC(=O)O)CC(=O)O.C(CC(=O)O)C(=O)O	{1: 3, 2: 31, 27: 6, 20: 3}
OK	68991-95-7	CCC(=O)OCCC(C)(C)CC(C)C	{1: 5, 2: 4, 3: 1, 4: 1, 28: 1}
OK	68992-06-3	CCOC(=O)C1CCC2C1C3CCC2C3	{1: 1, 2: 1, 11: 5, 12: 5, 28: 1}
OK	68992-08-5	CC(=CCCC(C)(OC)OC)C	{1: 5, 2: 2, 4: 1, 6: 1, 7: 1, 22: 2}
OK	68992-12-1	CCCC=C.CC/C=C/C	{1: 3, 2: 3, 5: 1, 6: 3}
OK	69-65-8	C([C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)O	{2: 2, 3: 4, 20: 6}
OK	69-79-4	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
OK	690-02-8	COOC	{1: 2, 22: 2}
OK	690-21-1	CN=NC(F)(F)F	{16: 3, 1: 1, 34: 2, 4: 1}
OK	690-27-7	C(=C(F)F)C(F)(F)F	{16: 5, 4: 1, 6: 1, 7: 1}
OK	690-37-9	CC(C)(C)CC(C)(C)O	{1: 5, 2: 1, 4: 2, 20: 1}
OK	690-39-1	C(C(F)(F)F)C(F)(F)F	{16: 6, 2: 1, 4: 2}
OK	690-92-6	CC/C=C\C(C)(C)C	{1: 4, 2: 1, 4: 1, 6: 2}
OK	690-93-7	CC/C=C/C(C)(C)C	{1: 4, 2: 1, 4: 1, 6: 2}
OK	690-94-8	CC(C)(C#CC=C)O	{1: 2, 4: 1, 5: 1, 6: 1, 10: 2, 20: 1}
OK	6900-06-7	C#CCOC(=O)CCCCC(=O)OCC#C	{9: 2, 2: 6, 28: 2, 10: 2}
OK	6902-77-8	COC(=O)C1=CO[C@H]([C@H]2[C@@H]1CC=C2CO)O	{1: 1, 2: 1, 11: 1, 12: 3, 14: 2, 15: 2, 20: 2, 23: 1, 28: 1}
OK	6902-91-6	C/C/1=C\CC(=C(C)C)C(=O)C/C(=C/CC1)/C	{1: 4, 7: 1, 11: 4, 14: 2, 15: 3, 25: 1}
OK	69029-26-1	CCCCCCCCCCCCCCCC(=O)OCCC(C)OC(=O)CCCCCCCCCCCCC.C(CCC(=O)O)CC(=O)O	{27: 2, 1: 3, 2: 32, 3: 1, 28: 2}
OK	69029-32-9	CC(CN(C)C)CO.C=C.C=CC(=O)O	{1: 3, 2: 2, 3: 1, 5: 3, 6: 1, 33: 1, 20: 1, 27: 1}
OK	69045-73-4	CC(C)(C)C(C1=CCCCC1)C(C2=CCCCC2)C(C)(C)C	{1: 6, 3: 2, 4: 2, 11: 8, 14: 2, 15: 2}
OK	69056-67-3	CC(=CC(=O)O)C(F)(F)F	{1: 1, 4: 1, 6: 1, 7: 1, 16: 3, 27: 1}
OK	6906-32-7	CC(=CN(C)C)C	{1: 4, 33: 1, 6: 1, 7: 1}
OK	6907-37-5	C1CCCCCCCCC(=O)CCCCCCCC1	{25: 1, 11: 17}
OK	6907-39-7	C1CCCCCCCCCC(=O)CCCCCCCCC1	{25: 1, 11: 19}
OK	69070-61-7	CCC(C)C(=O)OC(C)(CCC=C(C)C)C=C	{1: 5, 2: 3, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	69082-76-4	CCN(CC)C(=[N+](CC)CC)N(CC)CC.[Cl-]	{1: 6, 2: 6, 17: 1, 33: 3, 7: 1}
OK	69087-46-3	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(C(=O)O)(F)F)(F)F)F)(F)F)F	{16: 13, 27: 1, 4: 5, 22: 2, 7: 2}
OK	69087-47-4	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(C(=O)O)(F)F)(F)F)F)(F)F)F.C(=C(F)F)(F)F	{16: 17, 27: 1, 4: 5, 22: 2, 7: 4}
OK	69089-45-8	CC(C)(CO)CO.C1CCC(=O)OCC1	{1: 2, 2: 2, 4: 1, 11: 5, 20: 2, 28: 1}
OK	6909-30-4	CC(=C)[C@@H]1CC[C@]2([C@@H](C1)O2)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 2, 13: 1, 23: 1}
OK	6909-37-1	C1=CC2C3C2C1C=C3	{12: 4, 14: 4}
OK	69091-16-3	C[C@@H]1CN(C[C@@H](O1)C)N=O	{1: 2, 34: 1, 33: 1, 11: 2, 12: 2, 23: 1, 29: 1}
OK	69094-18-4	C(C([N+](=O)[O-])(Br)Br)O	{20: 1, 2: 1, 4: 1, 18: 2, 38: 1}
OK	691-24-7	CC(C)(C)N=C=NC(C)(C)C	{8: 1, 1: 6, 34: 2, 4: 2}
OK	691-37-2	CC(C)CC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1}
OK	691-38-3	C/C=C\C(C)C	{1: 3, 3: 1, 6: 2}
OK	691-60-1	CC(C)NC(=O)N	{24: 1, 1: 2, 3: 1, 30: 1, 31: 1}
OK	691-83-8	CCOC(=O)C=C(C)C(=O)OCC	{1: 3, 2: 2, 28: 2, 6: 1, 7: 1}
OK	691-93-0	CC(C)OC(=O)CCCl	{1: 2, 2: 2, 3: 1, 28: 1, 17: 1}
OK	69112-21-6	CC/C=C/CC=O	{1: 1, 2: 2, 26: 1, 6: 2}
OK	69112-96-5	CC(CN(CC(C)Cl)N=O)Cl	{33: 1, 2: 2, 3: 2, 1: 2, 34: 1, 17: 2, 29: 1}
OK	69112-98-7	C(CF)N(C(=O)N)N=O	{33: 1, 2: 2, 34: 1, 16: 1, 24: 1, 29: 1, 30: 1}
OK	69112-99-8	CN(C(=O)N(CCCl)CCCl)N=O	{1: 1, 2: 4, 33: 2, 34: 1, 17: 2, 24: 1, 29: 1}
OK	69113-00-4	CCN(CC)C(=O)N(CCCl)N=O	{1: 2, 2: 4, 33: 2, 34: 1, 17: 1, 24: 1, 29: 1}
OK	69113-01-5	C(CCl)N(CCCl)C(=O)N(CCCl)N=O	{33: 2, 2: 6, 34: 1, 17: 3, 24: 1, 29: 1}
OK	69113-02-6	C(CBr)N(C(=O)N)N=O	{33: 1, 2: 2, 34: 1, 18: 1, 24: 1, 29: 1, 30: 1}
OK	69116-71-8	COC(=O)C(C(=O)F)(F)F	{16: 3, 1: 1, 4: 1, 24: 1, 28: 1}
OK	69116-72-9	COC(=O)C(C(OC(C(=O)F)(C(F)(F)F)F)(F)F)(F)F	{1: 1, 4: 4, 16: 9, 22: 1, 24: 1, 28: 1}
OK	69116-73-0	COC(=O)C(C(OC(C(OC(C(=O)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F	{1: 1, 4: 7, 16: 15, 22: 2, 24: 1, 28: 1}
OK	6912-07-8	CCCCCCCCCCCC(CCCC)CCCC	{1: 3, 2: 16, 3: 1}
OK	69122-46-9	CC(C)COC(=O)C(C)Br	{1: 3, 2: 1, 3: 2, 28: 1, 18: 1}
OK	6914-71-2	COC(=O)C1(CC1)C(=O)OC	{1: 2, 11: 2, 28: 2, 13: 1}
OK	6914-74-5	C1CC1(C(=O)N)C(=O)O	{24: 1, 27: 1, 11: 2, 13: 1, 30: 1}
OK	6914-76-7	CC1(CC1)C(=O)O	{27: 1, 1: 1, 11: 2, 13: 1}
OK	6914-79-0	C1CC1(C#N)C(=O)O	{27: 1, 11: 2, 13: 1, 37: 1}
OK	6915-15-7	C(C(C(=O)O)O)C(=O)O	{27: 2, 2: 1, 3: 1, 20: 1}
OK	69155-29-9	CC1=C(CC(C(C1)(C#N)C#N)(C#N)C#N)C	{1: 2, 37: 4, 11: 2, 13: 2, 15: 2}
OK	69155-37-9	CCCCCCCCCCCCCCCCCCCCSSSSCCCCCCCCCCCCCCCCCCCC	{40: 4, 1: 2, 2: 38}
OK	69178-35-4	CCC(CO)(COC(=O)CCCCCN)COC(=O)C1C2CC(C(C2)C1C(=O)O)C	{1: 2, 2: 9, 4: 1, 11: 2, 12: 5, 20: 1, 27: 1, 28: 2, 30: 1}
OK	69178-39-8	CCC(CO)(COC(=O)CCCCCN)COC(=O)C1CCCCC1C(=O)O	{1: 1, 2: 9, 4: 1, 11: 4, 12: 2, 20: 1, 27: 1, 28: 2, 30: 1}
OK	6919-62-6	CCOC(=O)N(C)OC	{1: 3, 2: 1, 28: 1, 22: 1, 33: 1}
OK	692-04-6	CC(=O)NCCCC[C@@H](C(=O)O)N	{1: 1, 2: 4, 3: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	692-13-7	CCCCN=C(N)N=C(N)N	{1: 1, 2: 3, 34: 2, 30: 3, 7: 2}
OK	692-24-0	CC/C=C/C(C)C	{1: 3, 2: 1, 3: 1, 6: 2}
OK	692-35-3	CCCOC(C)Cl	{1: 2, 2: 2, 3: 1, 22: 1, 17: 1}
OK	692-48-8	CC(C)(C)/C=C/C(C)(C)C	{1: 6, 4: 2, 6: 2}
OK	692-50-2	C(#CC(F)(F)F)C(F)(F)F	{16: 6, 10: 2, 4: 2}
OK	692-70-6	CC(C)/C=C/C(C)C	{1: 4, 3: 2, 6: 2}
OK	692-86-4	CCOC(=O)CCCCCCCCC=C	{1: 1, 2: 9, 28: 1, 5: 1, 6: 1}
OK	692-96-6	CCC/C=C/C(C)C	{1: 3, 2: 2, 3: 1, 6: 2}
OK	692-98-8	CC(C)NCCC#N	{1: 2, 2: 2, 3: 1, 37: 1, 31: 1}
OK	6920-22-5	CCCCC(CO)O	{1: 1, 2: 4, 3: 1, 20: 2}
OK	6920-24-7	CCCCCCCCCCCCCCC(CO)O	{1: 1, 2: 14, 3: 1, 20: 2}
OK	69205-08-9	CCCCCCCCC(=O)OCC(C)CC	{1: 3, 2: 9, 3: 1, 28: 1}
OK	69205-12-5	CCCCCCCCC=CCCCCCCCC(=O)NC(C)(C)CO	{1: 3, 2: 15, 4: 1, 6: 2, 20: 1, 24: 1, 31: 1}
OK	6921-05-7	CC(C)(COCCCN)COCCCN	{1: 2, 2: 8, 4: 1, 30: 2, 22: 2}
OK	6921-17-1	CC1(C(=O)NC(=O)N1Cl)C	{32: 1, 1: 2, 33: 1, 13: 1, 17: 1, 25: 2}
OK	6921-27-3	C#CCOCC#C	{9: 2, 2: 2, 10: 2, 22: 1}
OK	6921-28-4	C#CCNCC#C	{9: 2, 2: 2, 10: 2, 31: 1}
OK	6921-29-5	C#CCN(CC#C)CC#C	{9: 3, 2: 3, 10: 3, 33: 1}
OK	6921-35-3	CC1(COC1)C	{1: 2, 11: 2, 13: 1, 23: 1}
OK	6921-98-8	C(NC=O)NC=O	{2: 1, 26: 2, 31: 2}
OK	69221-99-4	CC#CCCCCCCCCCO	{1: 1, 2: 9, 20: 1, 10: 2}
OK	69225-98-5	CC(=O)NC(=O)NCC(Cl)Cl	{1: 1, 2: 1, 3: 1, 17: 2, 24: 2, 31: 2}
OK	69226-06-8	CCC1(C(=O)NCCS1)CC	{32: 1, 1: 2, 2: 2, 41: 1, 11: 2, 13: 1, 25: 1}
OK	69226-90-0	CCCCCCCCCCCCCCCCC(C(=O)O)O.CC(=C)C(=O)OCC(CO)O	{1: 2, 2: 17, 3: 2, 5: 1, 7: 1, 20: 3, 27: 1, 28: 1}
OK	69227-17-4	CCCCC[C@@H](CCCOC(=O)CCCCC(=O)OCCCC[C@H](CCCC)CCC(C)C)C[C@H](C)CC	{1: 6, 2: 22, 3: 4, 28: 2}
OK	69242-00-8	CCCCCCCCC(=O)NCCCCCC(=O)O	{24: 1, 1: 1, 2: 12, 27: 1, 31: 1}
OK	6926-39-2	CN=C(N(C)C)N(C)Cl	{1: 4, 34: 1, 17: 1, 33: 2, 7: 1}
OK	69277-21-0	CCC(=CCl)C	{1: 2, 2: 1, 17: 1, 6: 1, 7: 1}
OK	69278-65-5	CCC(=O)N(CCO)CCO	{24: 1, 1: 1, 2: 5, 20: 2, 33: 1}
OK	6928-85-4	CN1CCN(CC1)N	{1: 1, 11: 4, 30: 1, 33: 2}
OK	69288-63-7	CCCCOC(=O)C=C.CCOC(=O)C=C.C=CC(=O)OCCO	{1: 2, 2: 6, 5: 3, 6: 3, 20: 1, 28: 3}
OK	6929-04-0	CC(C)CCCCCCCCCCCCCC(=O)OC	{1: 3, 2: 13, 3: 1, 28: 1}
OK	6929-08-4	CCCCCCCCC(CC)O	{1: 2, 2: 8, 3: 1, 20: 1}
OK	6929-94-8	C#CC=CC#C	{9: 2, 10: 2, 6: 2}
OK	693-02-7	CCCCC#C	{1: 1, 2: 3, 10: 1, 9: 1}
OK	693-05-0	CNCCC#N	{1: 1, 2: 2, 37: 1, 31: 1}
OK	693-06-1	C(CO)NC=O	{2: 2, 20: 1, 26: 1, 31: 1}
OK	693-07-2	CCSCCCl	{40: 1, 1: 1, 2: 3, 17: 1}
OK	693-13-0	CC(C)N=C=NC(C)C	{8: 1, 1: 4, 34: 2, 3: 2}
OK	693-16-3	CCCCCCC(C)N	{1: 2, 2: 5, 3: 1, 30: 1}
OK	693-23-2	C(CCCCCC(=O)O)CCCCC(=O)O	{2: 10, 27: 2}
OK	693-30-1	C(CSCCCl)O	{40: 1, 17: 1, 2: 4, 20: 1}
OK	693-36-7	CCCCCCCCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCCCCCCCC	{40: 1, 1: 2, 2: 38, 28: 2}
OK	693-38-9	CCCCCCCCCCCCCCCC(=O)OC=C	{1: 1, 2: 14, 28: 1, 5: 1, 6: 1}
OK	693-39-0	CCCCCCC[N+](=O)[O-]	{1: 1, 2: 6, 38: 1}
OK	693-51-6	CCCCNCCC#N	{1: 1, 2: 5, 37: 1, 31: 1}
OK	693-54-9	CCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 7}
OK	693-55-0	CCOC(=O)CCCCCCCCC(=O)O	{1: 1, 2: 9, 27: 1, 28: 1}
OK	693-57-2	C(CCCCCC(=O)O)CCCCCN	{2: 11, 27: 1, 30: 1}
OK	693-58-3	CCCCCCCCCBr	{1: 1, 2: 8, 18: 1}
OK	693-62-9	CCCCCC/C=C/CCC	{1: 2, 2: 7, 6: 2}
OK	693-65-2	CCCCCOCCCCC	{1: 2, 2: 8, 22: 1}
OK	693-67-4	CCCCCCCCCCCBr	{1: 1, 2: 10, 18: 1}
OK	693-72-1	CCCCCC/C=C/CCCCCCCCCC(=O)O	{1: 1, 2: 14, 27: 1, 6: 2}
OK	693-83-4	CCCCCCCCCCSCCCCCCCCCC	{40: 1, 1: 2, 2: 18}
OK	693-85-6	C1(N=N1)(F)F	{16: 2, 35: 2, 13: 1}
OK	693-86-7	C=CC1CC1	{11: 2, 12: 1, 5: 1, 6: 1}
OK	693-89-0	CC1=CCCC1	{1: 1, 11: 3, 14: 1, 15: 1}
OK	69300-17-0	CC(CCCC(C)(C)OC)CC#N	{1: 4, 2: 4, 3: 1, 4: 1, 37: 1, 22: 1}
OK	6931-05-1	CC(=O)C(C)(C)N=O	{24: 1, 1: 3, 34: 1, 4: 1, 29: 1}
OK	6931-54-0	CC1([C@H]2CC[C@]3([C@@H]1C2)CO3)C	{1: 2, 11: 4, 12: 2, 13: 2, 23: 1}
OK	6931-71-1	CCC(CC)(C(CC)(CC)O)O	{1: 4, 2: 4, 4: 2, 20: 2}
OK	6932-49-6	CN1CCCCCCCC1=O	{1: 1, 11: 7, 33: 1, 25: 1}
OK	6932-50-9	CN1CCCCCCCCCC1=O	{1: 1, 11: 9, 33: 1, 25: 1}
OK	69340-58-5	CC1(CCC2(CCC(N=C2N1)(C)C)C)C	{32: 1, 1: 5, 35: 1, 11: 4, 13: 3, 15: 1}
OK	69352-90-5	C1CC(=O)NC(=O)C1N2C(=O)C3CC=CCC3C2=O	{32: 1, 33: 1, 11: 4, 12: 3, 14: 2, 25: 4}
OK	6936-48-7	CNC(=O)C=CC(=O)O	{24: 1, 1: 1, 27: 1, 6: 2, 31: 1}
OK	69376-38-1	CC1CC2CC1C=C2.C1C=CC2C1C3CC2C=C3	{1: 1, 11: 4, 12: 7, 14: 6}
OK	6938-26-7	CCCC(C(=O)OCC)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 1}
OK	6938-60-9	CCCCCCCCCCCCOC(=O)CCCCC	{1: 2, 2: 15, 28: 1}
OK	6938-66-5	CCCCCCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 21, 18: 1}
OK	6938-94-9	CC(C)OC(=O)CCCCC(=O)OC(C)C	{1: 4, 2: 4, 3: 2, 28: 2}
OK	6939-31-7	C1CCN(C1)C(=O)CC2CC(=O)NC(=O)C2	{32: 1, 33: 1, 2: 1, 11: 6, 12: 1, 24: 1, 25: 2}
OK	694-01-9	C1C=CC2C1C2	{11: 2, 12: 2, 14: 2}
OK	694-05-3	C1CNCC=C1	{32: 1, 11: 3, 14: 2}
OK	694-28-0	C1CC(C(=O)C1)Cl	{17: 1, 11: 3, 12: 1, 25: 1}
OK	694-32-6	CN1CCNC1=O	{32: 1, 1: 1, 11: 2, 33: 1, 25: 1}
OK	694-34-8	C=CC1CC1(F)F	{5: 1, 6: 1, 11: 1, 12: 1, 13: 1, 16: 2}
OK	694-35-9	CCC1CCC=C1	{1: 1, 2: 1, 11: 2, 12: 1, 14: 2}
OK	694-54-2	C1CCOC(C1)O	{20: 1, 11: 4, 12: 1, 23: 1}
OK	694-55-3	CN1CCC=CC1	{1: 1, 11: 3, 14: 2, 33: 1}
OK	694-56-4	C[N+]1=CC=CC=C1	{1: 1, 14: 5, 33: 1}
OK	694-59-7	C1=CC=[N+](C=C1)[O-]	{33: 1, 29: 1, 14: 5}
OK	694-62-2	C1C(=C(C1(F)F)F)Cl	{16: 3, 17: 1, 11: 1, 13: 1, 15: 2}
OK	694-70-2	C1CC2C=CC1C2O	{20: 1, 11: 2, 12: 3, 14: 2}
OK	694-71-3	C1CC2C=CC1C2=O	{25: 1, 11: 2, 12: 2, 14: 2}
OK	694-72-4	C1CC2CCCC2C1	{11: 6, 12: 2}
OK	694-83-7	C1CCC(C(C1)N)N	{11: 4, 12: 2, 30: 2}
OK	694-85-9	CN1C=CC=CC1=O	{1: 1, 33: 1, 14: 4, 25: 1}
OK	694-91-7	C=C1CC2CC1C=C2	{11: 2, 12: 2, 5: 1, 14: 2, 15: 1}
OK	694-92-8	CC1=CC2CCC1C2	{1: 1, 11: 3, 12: 2, 14: 1, 15: 1}
OK	694-98-4	C1C2CC(=O)C1C=C2	{25: 1, 11: 2, 12: 2, 14: 2}
OK	6940-09-6	CCCCCCCCCCCCCCCCCC(=O)OCC1CCCO1	{1: 1, 2: 17, 11: 3, 12: 1, 23: 1, 28: 1}
OK	6940-76-7	C(CCl)CI	{17: 1, 2: 3, 19: 1}
OK	6940-78-9	C(CCBr)CCl	{17: 1, 2: 4, 18: 1}
OK	6941-69-1	C(COC(=O)CCl)OC(=O)CCl	{17: 2, 2: 4, 28: 2}
OK	69416-69-9	CCCCOC(=O)CCN1CCC1	{1: 1, 2: 5, 11: 3, 28: 1, 33: 1}
OK	6942-02-5	CCCCCCCCCCCCCC1=NCCN1CCO	{1: 1, 2: 14, 35: 1, 33: 1, 11: 2, 15: 1, 20: 1}
OK	6942-59-2	CCC(=O)OCCOCCOC(=O)CC	{1: 2, 2: 6, 28: 2, 22: 1}
OK	6943-47-1	C/C=C\C=NC(C)(C)C	{1: 4, 34: 1, 4: 1, 6: 3}
OK	6943-58-4	CCCOCC(CCl)O	{1: 1, 2: 4, 3: 1, 17: 1, 20: 1, 22: 1}
OK	6943-65-3	C(CSC(=N)N)SC(=N)N.Br.Br	{2: 2, 36: 2, 7: 2, 40: 2, 18: 2, 30: 2}
OK	6943-87-9	CC(CSC)O	{40: 1, 1: 2, 2: 1, 3: 1, 20: 1}
OK	6943-94-8	CN1C(=O)NC(=O)C=N1	{32: 1, 1: 1, 35: 1, 33: 1, 14: 1, 25: 2}
OK	6946-24-3	CCCCCCCCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 23, 18: 1}
OK	6946-88-9	CCCOC(=O)CCC(=O)O	{1: 1, 2: 4, 27: 1, 28: 1}
OK	69460-11-3	C[C@@H]1[C@H]2C[C@H](C2(C)C)C[C@H]1N	{1: 3, 11: 2, 12: 4, 13: 1, 30: 1}
OK	69462-43-7	CC1CCCCN1C(=O)C2CCC=CC2	{1: 1, 33: 1, 11: 7, 12: 2, 14: 2, 24: 1}
OK	69462-47-1	CC1CCCCC1C(=O)N2C(CCCC2C)C	{24: 1, 1: 3, 11: 7, 12: 4, 33: 1}
OK	69462-48-2	CC1CCCCC1C(=O)N2CCC=CC2	{1: 1, 33: 1, 11: 7, 12: 2, 14: 2, 24: 1}
OK	69462-51-7	CC1CCCCN1C(=O)C2CC=CCC2C	{1: 2, 33: 1, 11: 6, 12: 3, 14: 2, 24: 1}
OK	69462-52-8	CC1CCCN(C1)C(=O)C2CC=CCC2C	{1: 2, 33: 1, 11: 6, 12: 3, 14: 2, 24: 1}
OK	69462-53-9	CC1CCN(CC1)C(=O)C2CC=CCC2C	{1: 2, 33: 1, 11: 6, 12: 3, 14: 2, 24: 1}
OK	69462-56-2	CC1CC=CCC1C(=O)N2CCC=CC2	{1: 1, 33: 1, 11: 5, 12: 2, 14: 4, 24: 1}
OK	6947-02-0	CC(=O)CC(=O)OC1CCCCC1	{1: 1, 2: 1, 11: 5, 12: 1, 24: 1, 28: 1}
OK	69472-23-7	CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)CO	{1: 2, 2: 31, 3: 1, 20: 1}
OK	6948-86-3	CCOC(CN(C)CC(OCC)OCC)OCC	{1: 5, 2: 6, 3: 2, 22: 4, 33: 1}
OK	6949-28-6	CCCCCCN(CCCCCC)N=O	{1: 2, 2: 10, 34: 1, 29: 1, 33: 1}
OK	69492-24-6	C1CCC2CC(CC1)OO2	{11: 6, 12: 2, 23: 2}
OK	69498-28-8	CC(CCBr)CBr	{1: 1, 2: 3, 3: 1, 18: 2}
OK	695-02-3	C1C2CC3C1C3C2Br	{18: 1, 11: 2, 12: 5}
OK	695-05-6	C1C2CC3C1C3C2=O	{25: 1, 11: 2, 12: 4}
OK	695-06-7	CCC1CCC(=O)O1	{1: 1, 2: 1, 11: 2, 12: 1, 28: 1}
OK	695-12-5	C=CC1CCCCC1	{11: 5, 12: 1, 5: 1, 6: 1}
OK	695-15-8	CC1CCN(CC1)C	{1: 2, 11: 4, 12: 1, 33: 1}
OK	695-19-2	CN1C=CC(=O)C=C1	{1: 1, 33: 1, 14: 4, 25: 1}
OK	695-28-3	CC1(CCCC=C1)C	{1: 2, 11: 3, 13: 1, 14: 2}
OK	695-30-7	CC1(OCCCO1)C	{1: 2, 11: 3, 13: 1, 23: 2}
OK	695-35-2	CC1CCCN(C1)C	{1: 2, 11: 4, 12: 1, 33: 1}
OK	695-53-4	CC1(C(=O)NC(=O)O1)C	{32: 1, 1: 2, 28: 1, 13: 1, 25: 1}
OK	695-56-7	C1CC2(C=C1)OCCO2	{11: 4, 13: 1, 14: 2, 23: 2}
OK	695-77-2	C1C(=C(C(=C1Cl)Cl)Cl)Cl	{17: 4, 11: 1, 15: 4}
OK	695-88-5	CC1CN2CCC1CC2	{1: 1, 11: 5, 12: 2, 33: 1}
OK	695-90-9	C1CCC2=C(C1)CCC2	{11: 7, 15: 2}
OK	695-99-8	C1=CC(=O)C(=CC1=O)Cl	{17: 1, 25: 2, 14: 3, 15: 1}
OK	69500-64-7	C1C[C@H](NC1)CN	{32: 1, 2: 1, 11: 3, 12: 1, 30: 1}
OK	6952-93-8	C1CC1C(=O)NN	{24: 1, 11: 2, 12: 1, 30: 1, 31: 1}
OK	69542-91-2	CC1CCC(C(C1)C)O	{1: 2, 11: 3, 12: 3, 20: 1}
OK	69556-70-3	COC1=CC(=O)OC1	{1: 1, 11: 1, 14: 1, 15: 1, 22: 1, 28: 1}
OK	6959-06-4	CC(C(C)O)NC(C)C(C)O	{1: 4, 3: 4, 20: 2, 31: 1}
OK	6959-71-3	CCCCOCCC#N	{1: 1, 2: 5, 37: 1, 22: 1}
OK	696-04-8	CC1CNC(=O)NC1=O	{32: 2, 1: 1, 11: 1, 12: 1, 25: 2}
OK	696-29-7	CC(C)C1CCCCC1	{11: 5, 1: 2, 3: 1, 12: 1}
OK	696-32-2	C1CCC(=C(F)F)CC1	{15: 1, 16: 2, 11: 5, 7: 1}
OK	696-54-8	C1=CNC=CC1=CN=O	{32: 1, 34: 1, 6: 1, 14: 4, 15: 1, 29: 1}
OK	696-57-1	C=CCN1CCOCC1	{33: 1, 2: 1, 5: 1, 6: 1, 11: 4, 23: 1}
OK	696-59-3	COC1CCC(O1)OC	{1: 2, 11: 2, 12: 2, 22: 2, 23: 1}
OK	696-68-4	CN(C)C=C1C=CC=C1	{1: 2, 33: 1, 14: 4, 6: 1, 15: 1}
OK	696-71-9	C1CCCC(CCC1)O	{20: 1, 11: 7, 12: 1}
OK	696-79-7	CC1CCOC(O1)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 23: 2}
OK	696-86-6	C/1/C=C\C/C=C\C/C=C1	{11: 3, 14: 6}
OK	69610-40-8	CC(C)(C)OC(=O)N1CCC[C@H]1CO	{1: 3, 2: 1, 4: 1, 33: 1, 11: 3, 12: 1, 20: 1, 28: 1}
OK	69610-41-9	CC(C)(C)OC(=O)N1CCC[C@H]1C=O	{1: 3, 4: 1, 33: 1, 11: 3, 12: 1, 26: 1, 28: 1}
OK	6962-92-1	CC(=O)OCCCCCl	{1: 1, 2: 4, 28: 1, 17: 1}
OK	6963-44-6	CC(=O)OCCCCCOC(=O)C	{1: 2, 2: 5, 28: 2}
OK	6964-04-1	CCCC(C(C)C(C)O)O	{1: 3, 2: 2, 3: 3, 20: 2}
OK	6964-23-4	CCCCCCCCSCCC(=O)O	{40: 1, 1: 1, 2: 9, 27: 1}
OK	6966-22-9	COC(=O)C1CC2(CC(C1=O)(CC(C2=O)C(=O)OC)C(=O)OC)C(=O)OC	{1: 4, 11: 3, 12: 2, 13: 2, 25: 2, 28: 4}
OK	6966-40-1	CCCC1(C(=O)NC(=O)NC1=O)C(=CCC)C	{32: 2, 1: 3, 2: 3, 6: 1, 7: 1, 13: 1, 25: 3}
OK	69668-83-3	CCCC/C=C/CCOC(=O)C	{1: 2, 2: 5, 28: 1, 6: 2}
OK	69668-85-5	CCCC/C=C\CC(=O)OC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	69668-88-8	CCC/C=C\C(=O)C	{24: 1, 1: 2, 2: 2, 6: 2}
OK	69669-42-7	CCCCCCCCCCCCCCC[CH2].CCCCCCCCCCCCCCCCC[CH2].CCCCCCCCCC(=O)O.CCCCCCCC(=O)O	{1: 4, 2: 44, 27: 2, 5: 2}
OK	6967-43-7	CCC(CNCCO)O	{1: 1, 2: 4, 3: 1, 20: 2, 31: 1}
OK	6968-75-8	CC1C2CCC(C2)C1CO	{1: 1, 2: 1, 11: 3, 12: 4, 20: 1}
OK	69697-81-0	CC1CC(=C)C=C(C1)OC	{1: 2, 5: 1, 11: 2, 12: 1, 14: 1, 15: 2, 22: 1}
OK	697-11-0	C1(=C(C(C1(F)F)(F)F)F)F	{16: 6, 13: 2, 15: 2}
OK	697-17-6	C1C(C(C1(Cl)Cl)(F)Cl)(F)F	{16: 3, 17: 3, 11: 1, 13: 3}
OK	697-91-6	C1=C(C(=O)C(=CC1=O)Cl)Cl	{17: 2, 25: 2, 14: 2, 15: 2}
OK	6970-56-5	CC1=CC(=O)OC(C1)(C)C	{1: 3, 11: 1, 13: 1, 14: 1, 15: 1, 28: 1}
OK	6970-60-1	CN(C)C1CCCCC1=O	{1: 2, 11: 4, 12: 1, 33: 1, 25: 1}
OK	69704-44-5	CCN(CC)CCCCN(CC)CC	{1: 4, 2: 8, 33: 2}
OK	6971-63-7	CC1CC(=O)OC1C	{1: 2, 11: 1, 12: 2, 28: 1}
OK	6971-86-4	CCCCCCCCCCCCCCCC(=O)NN(C)C	{24: 1, 1: 3, 2: 14, 33: 1, 31: 1}
OK	6972-76-5	CN(CCCN(C)N=O)N=O	{1: 2, 2: 3, 34: 2, 29: 2, 33: 2}
OK	69725-37-7	CC(C)CC(=O)CC(=O)C(C)(C)C	{24: 2, 1: 5, 2: 2, 3: 1, 4: 1}
OK	69725-52-6	C(CCC(=O)O)CC(=O)O.C(/C(=C(/CO)\Br)/Br)O	{2: 6, 27: 2, 20: 2, 18: 2, 7: 2}
OK	69727-41-9	CCCC(=O)OCCCC=CC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	6973-55-3	C1C(CC(=O)NC1=O)C(=O)O	{27: 1, 25: 2, 11: 2, 12: 1, 32: 1}
OK	6973-79-1	CCCCOC(=O)CCBr	{1: 1, 2: 5, 28: 1, 18: 1}
OK	6974-05-6	CCCCCCCCCCOC(=O)CCl	{1: 1, 2: 10, 28: 1, 17: 1}
OK	6974-29-4	C(CO)NC(=O)C(F)(F)F	{2: 2, 4: 1, 16: 3, 20: 1, 24: 1, 31: 1}
OK	6974-30-7	CCC(CBr)(CBr)CBr	{1: 1, 2: 4, 4: 1, 18: 3}
OK	6974-77-2	CC(CCl)CBr	{1: 1, 2: 2, 3: 1, 18: 1, 17: 1}
OK	6974-80-7	CCCCCCCCC1OCC(CO1)(C)C	{1: 3, 2: 7, 11: 2, 12: 1, 13: 1, 23: 2}
OK	6974-85-2	CCCCCCCCC(C(=O)OCC)Br	{1: 2, 2: 8, 3: 1, 28: 1, 18: 1}
OK	6975-31-1	CCCCOC(=O)CCSCCC(=O)OCCCC	{40: 1, 1: 2, 2: 10, 28: 2}
OK	6975-71-9	C1CCC(=CC1)CC#N	{2: 1, 11: 4, 37: 1, 14: 1, 15: 1}
OK	6975-85-5	CC(=O)CCOC	{24: 1, 1: 2, 2: 2, 22: 1}
OK	6975-92-4	CC(C)CCC(=C)C	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1}
OK	6975-98-0	CCCCCCCCC(C)C	{1: 3, 2: 7, 3: 1}
OK	6975-99-1	CCCCCC#CCCCCC	{1: 2, 2: 8, 10: 2}
OK	6976-00-7	CCCCC(CC)CCC(=O)CC(C)C	{24: 1, 1: 4, 2: 7, 3: 2}
OK	6976-27-8	CC(C)C(C)C1CC1	{11: 2, 1: 3, 3: 2, 12: 1}
OK	6976-28-9	CCCCC(C)C1CC1	{11: 2, 1: 2, 2: 3, 3: 1, 12: 1}
OK	6976-37-0	C(CO)N(CCO)C(CO)(CO)CO	{20: 5, 2: 7, 4: 1, 33: 1}
OK	6976-50-7	CCCN(CCC)C(=O)OCC	{1: 3, 2: 5, 28: 1, 33: 1}
OK	6976-72-3	CCCCCCCOC(=O)CCCCC	{1: 2, 2: 10, 28: 1}
OK	6976-91-6	CC(=C)C(=O)N(C)C	{24: 1, 1: 3, 33: 1, 5: 1, 7: 1}
OK	6976-93-8	CC(=C)C(=O)OCCOC	{1: 2, 2: 2, 5: 1, 7: 1, 22: 1, 28: 1}
OK	698-10-2	CCC1C(=C(C(=O)O1)O)C	{1: 2, 2: 1, 12: 1, 15: 2, 20: 1, 28: 1}
OK	698-76-0	CCCC1CCCC(=O)O1	{1: 1, 2: 2, 11: 3, 12: 1, 28: 1}
OK	6980-18-3	C[C@@H]1[C@H](C[C@@H]([C@H](O1)OC2[C@@H]([C@H](C([C@@H]([C@@H]2O)O)O)O)O)N)N=C(C(=O)O)N	{1: 1, 34: 1, 7: 1, 11: 1, 12: 10, 20: 5, 22: 1, 23: 1, 27: 1, 30: 2}
OK	69804-18-8	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(C(=O)N)(F)F)(F)F)F)(F)F)F	{4: 5, 7: 2, 16: 13, 22: 2, 24: 1, 30: 1}
OK	69804-19-9	C(#N)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F	{16: 13, 4: 5, 37: 1, 22: 2, 7: 2}
OK	69815-57-2	CC1=C(CC(CC1)C(=O)Cl)C	{1: 2, 11: 3, 12: 1, 15: 2, 17: 1, 24: 1}
OK	6982-46-3	C(CBr)S	{2: 2, 18: 1, 39: 1}
OK	69826-42-2	CC1(C(=[NH+]C(N1O)(C)C)N)C	{32: 1, 1: 4, 33: 1, 13: 2, 15: 1, 20: 1, 30: 1}
OK	6983-79-5	CC(=CC=CC=C(C)C=CC=C(C)C=CC(=O)OC)C=CC=C(C)C=CC(=O)O	{1: 5, 27: 1, 28: 1, 6: 14, 7: 4}
OK	69834-09-9	CC1CCCC(C1(C)CCC(C)O)(C)C	{1: 5, 2: 2, 3: 1, 11: 3, 12: 1, 13: 2, 20: 1}
OK	69847-38-7	CCCCOC(=O)CCC(C)O	{1: 2, 2: 5, 3: 1, 20: 1, 28: 1}
OK	69847-51-4	CCCCCCCCCCCCCCCCCCCC(=O)O.C1COCCN1	{32: 1, 1: 1, 2: 18, 11: 4, 23: 1, 27: 1}
OK	69852-45-5	CN(C)CCCNCCC#N	{1: 2, 2: 5, 37: 1, 33: 1, 31: 1}
OK	69853-71-0	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(C4=CC(=O)CC[C@]34C)O)C	{1: 5, 2: 3, 3: 2, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	69856-01-5	CCCCCCCC1=NCCN1CCN(CCC(=O)O)CCC(=O)O	{1: 1, 2: 12, 35: 1, 33: 2, 11: 2, 15: 1, 27: 2}
OK	69856-06-0	CC1CO1.C1CO1.C(CN)N.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)CO)O)O)O)O	{1: 1, 2: 5, 11: 3, 12: 9, 13: 1, 20: 8, 22: 1, 23: 4, 30: 2}
OK	69868-05-9	CCCCCCCCCCCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 17, 3: 1}
OK	69868-07-1	CCCCCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 11, 3: 1}
OK	69868-08-2	CCCCCCCCCCCCCCCC(CC)C(=O)O	{27: 1, 1: 2, 2: 15, 3: 1}
OK	69868-16-2	CCCCCCCCNCCN(CCCCCCCC)CCN(CCCCCCCC)CCCCCCCC	{1: 4, 2: 32, 33: 2, 31: 1}
OK	69878-18-8	C(CCN=C=O)CC(C(=O)OCCN=C=O)N=C=O	{34: 3, 3: 1, 8: 3, 2: 6, 28: 1, 29: 3}
OK	69882-13-9	CC(COCC(C)O)O.C(=C/C(=O)O)\C(=O)O	{1: 2, 2: 2, 3: 2, 6: 2, 20: 2, 22: 1, 27: 2}
OK	69882-14-0	CCCCC(CC)CO.CC(COCC(C)O)O	{1: 4, 2: 7, 3: 3, 20: 3, 22: 1}
OK	69884-58-8	C(O[O])(Cl)(Cl)Cl	{17: 3, 4: 1, 29: 1, 22: 1}
OK	69898-17-5	CCC(=O)C.CC\1(C2CCC(C2)/C1=C\C=O)C	{1: 4, 2: 1, 6: 1, 11: 3, 12: 2, 13: 1, 15: 1, 24: 1, 26: 1}
OK	69898-43-7	CCCCCCCCCCCC(=O)NCCCN(C)C.CC(C(=O)O)O	{1: 4, 2: 13, 3: 1, 33: 1, 20: 1, 24: 1, 27: 1, 31: 1}
OK	69898-44-8	CCCCCCCC/C=C\CCCCCCCC(=O)NCCCN(C)C.CC(C(=O)O)O	{1: 4, 2: 17, 3: 1, 6: 2, 33: 1, 20: 1, 24: 1, 27: 1, 31: 1}
OK	69898-48-2	CC1CC(=C(C1=O)OC)C	{1: 3, 11: 1, 12: 1, 15: 2, 22: 1, 25: 1}
OK	699-06-9	C1=CC(=O)C=CC1=CNO	{6: 1, 14: 4, 15: 1, 20: 1, 25: 1, 31: 1}
OK	699-14-9	C/C=C/CN1CCCCC1	{1: 1, 2: 1, 11: 5, 6: 2, 33: 1}
OK	699-35-4	C1(=O)C(C(C1(F)F)(F)F)(F)F	{16: 6, 25: 1, 13: 3}
OK	699-51-4	C1CCC2(C1)C(=O)NC(=O)N2	{32: 2, 25: 2, 11: 4, 13: 1}
OK	699-55-8	C1CC2(CCC1CC2)C(=O)O	{27: 1, 11: 6, 12: 1, 13: 1}
OK	6990-06-3	C[C@H]1[C@@H]2CC[C@]3([C@H]([C@]2(CC[C@H]1O)C)[C@@H](C[C@@H]\4[C@@]3(C[C@@H](/C4=C(/CCC=C(C)C)\C(=O)O)OC(=O)C)C)O)C	{1: 7, 2: 2, 6: 1, 7: 2, 11: 6, 12: 7, 13: 3, 15: 1, 20: 2, 27: 1, 28: 1}
OK	69912-96-5	C=CC=O.C(CCCN)CCN	{30: 2, 2: 6, 26: 1, 5: 1, 6: 1}
OK	69929-08-4	C/C(=C/C(CC(=O)OC)C(=O)OC)/CC(C)(C)C	{1: 6, 2: 2, 3: 1, 4: 1, 6: 1, 7: 1, 28: 2}
OK	69929-16-4	CCOCCC(C)CCC=C(C)C	{1: 4, 2: 5, 3: 1, 6: 1, 7: 1, 22: 1}
OK	69929-23-3	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CC(=O)O.C(CN)N	{1: 2, 2: 14, 27: 2, 30: 2, 6: 4}
OK	6993-66-4	CC1=CCC2CC1C2(C)C.CC1=CCC2CC1C2(C)C	{1: 6, 11: 4, 12: 4, 13: 2, 14: 2, 15: 2}
OK	69943-69-7	CCCCCCCCCCCC(=O)NCCCCCCCC	{24: 1, 1: 2, 2: 17, 31: 1}
OK	69978-45-6	CN1CCOCCOCCOCC1	{1: 1, 11: 8, 33: 1, 23: 3}
OK	69991-61-3	C(C(OC(F)(F)F)(F)F)(OC(OC(F)(F)F)(F)F)(F)F	{16: 12, 4: 5, 22: 3}
OK	70-18-8	C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C(=O)O)N	{2: 4, 3: 2, 39: 1, 24: 2, 27: 2, 30: 1, 31: 2}
OK	70-22-4	C1CCN(C1)CC#CCN2CCCC2=O	{25: 1, 2: 2, 11: 7, 10: 2, 33: 2}
OK	70-23-5	CCOC(=O)C(=O)CBr	{24: 1, 1: 1, 2: 2, 28: 1, 18: 1}
OK	70-25-7	CN(/C(=N/[N+](=O)[O-])/N)N=O	{1: 1, 34: 2, 38: 1, 33: 1, 7: 1, 29: 1, 30: 1}
OK	70-26-8	C(C[C@@H](C(=O)O)N)CN	{27: 1, 2: 3, 3: 1, 30: 2}
OK	70-47-3	C([C@@H](C(=O)O)N)C(=O)N	{24: 1, 27: 1, 2: 1, 3: 1, 30: 2}
OK	70-49-5	C(C(C(=O)O)S)C(=O)O	{27: 2, 2: 1, 3: 1, 39: 1}
OK	70-51-9	CC(=O)N(CCCCCNC(=O)CCC(=O)N(CCCCCNC(=O)CCC(=O)N(CCCCCN)O)O)O	{1: 1, 2: 19, 33: 3, 20: 3, 24: 5, 30: 1, 31: 2}
OK	70-54-2	C(CCN)CC(C(=O)O)N	{27: 1, 2: 4, 3: 1, 30: 2}
OK	700-18-5	C1[C@H]([C@H]1C(=O)O)C(=O)O	{27: 2, 11: 1, 12: 2}
OK	700-56-1	CC1C2CC3CC(C2)CC1C3	{1: 1, 11: 5, 12: 5}
OK	700-57-2	C1C2CC3CC1CC(C2)C3O	{20: 1, 11: 5, 12: 5}
OK	700-58-3	C1C2CC3CC1CC(C2)C3=O	{25: 1, 11: 5, 12: 4}
OK	7000-79-5	CC12CC3(SC(S1)(CC(S2)(S3)C)C)C	{1: 4, 11: 2, 13: 4, 41: 4}
OK	70005-88-8	C(CO)[C@H](CO)O	{2: 3, 3: 1, 20: 3}
OK	70024-57-6	CCCCCCCCC=CCCCCCCCC(=O)OCC(CC)(CO)CO	{1: 2, 2: 18, 4: 1, 6: 2, 20: 2, 28: 1}
OK	70024-61-2	CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.CCCCC/C=C/C/C=C/CCCCCCCC(=O)O.CC1CO1.C1CO1	{1: 3, 2: 24, 6: 4, 11: 4, 12: 4, 14: 2, 23: 2, 27: 3}
OK	70024-80-5	CCCCCCCC/C=C\CCCCCCCC(=O)O.COC(=O)C=C.C(CNCCO)N	{1: 2, 2: 18, 5: 1, 6: 3, 20: 1, 27: 1, 28: 1, 30: 1, 31: 1}
OK	70024-81-6	CCCCCCCC/C=C\CCCCCCCC(=O)O.C(CN)N	{1: 1, 2: 16, 27: 1, 30: 2, 6: 2}
OK	7003-32-9	CC1CCCCC1N	{1: 1, 11: 4, 12: 2, 30: 1}
OK	7003-42-1	C1=CC=CC#CC=CC#CC=C1	{10: 4, 14: 8}
OK	70042-58-9	CC(C)(C)C1(CCCCC1)OC(=O)Cl	{1: 3, 4: 1, 11: 5, 13: 1, 17: 1, 28: 1}
OK	7005-47-2	CC(C)(CO)N(C)C	{1: 4, 2: 1, 4: 1, 20: 1, 33: 1}
OK	70055-52-6	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#N)CCNC(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 38, 37: 1, 33: 1, 24: 2, 31: 2}
OK	70058-00-3	CCCCCC#CC(=C)C	{1: 2, 2: 4, 10: 2, 5: 1, 7: 1}
OK	70058-01-4	CCC(=CC#CC)CC	{1: 3, 2: 2, 10: 2, 6: 1, 7: 1}
OK	70058-02-5	CC/C(=C/C)/C#CC	{1: 3, 2: 1, 10: 2, 6: 1, 7: 1}
OK	70058-03-6	CC/C(=C\C)/C#CC	{1: 3, 2: 1, 10: 2, 6: 1, 7: 1}
OK	70058-04-7	CC#CC(=C(C)C)C(C)C	{1: 5, 10: 2, 3: 1, 7: 2}
OK	70069-04-4	C1COCCOCCOC(COCCOCCO1)CO	{20: 1, 2: 1, 11: 11, 12: 1, 23: 6}
OK	70069-12-4	CCCCCCCCCCCCCCCCCCN(C)C.CCCCCCCCC=CCCCCCCCC(=O)O	{1: 4, 2: 31, 27: 1, 6: 2, 33: 1}
OK	70069-81-7	CC(C)CCCCCOC(=O)C=C.CC(C)(C)CC(C)(C)NC(=O)C=C	{1: 7, 2: 6, 3: 1, 4: 2, 5: 2, 6: 2, 24: 1, 28: 1, 31: 1}
OK	70092-23-8	CC1=CCCC(C1C=CC(=O)CC(C)C)(C)C	{1: 5, 2: 1, 3: 1, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	701-58-6	CC1(CC(=CC(=O)C1)NC)C	{1: 3, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1, 31: 1}
OK	701-97-3	C1CCC(CC1)CCC(=O)O	{27: 1, 2: 2, 11: 5, 12: 1}
OK	70103-77-4	CC(=O)OCCN(COC(=O)C)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 28: 2, 29: 1}
OK	70103-78-5	CC(=O)OCCCN(COC(=O)C)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 28: 2, 29: 1}
OK	70103-79-6	CC(=O)OCCCCN(COC(=O)C)N=O	{1: 2, 2: 5, 33: 1, 34: 1, 28: 2, 29: 1}
OK	70103-80-9	CC(=O)OCN(CC(=O)OC)N=O	{1: 2, 2: 2, 33: 1, 34: 1, 28: 2, 29: 1}
OK	70103-81-0	CC(=O)OCN(CCC(=O)OC)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 28: 2, 29: 1}
OK	70103-82-1	CC(=O)OCN(CCCC(=O)OC)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 28: 2, 29: 1}
OK	7011-83-8	CCCCCCC1(CCC(=O)O1)C	{1: 2, 2: 5, 11: 2, 28: 1, 13: 1}
OK	7013-11-8	CC(C(=C)Cl)Cl	{1: 1, 3: 1, 17: 2, 5: 1, 7: 1}
OK	70138-31-7	COC(CC#N)(OC)OC	{1: 3, 2: 1, 4: 1, 37: 1, 22: 3}
OK	70146-01-9	CC(=C)C(=O)OC.C=CC(=O)O.C1CN1	{32: 1, 1: 2, 5: 2, 6: 1, 7: 1, 11: 2, 27: 1, 28: 1}
OK	70159-87-4	C=C.C=CO.C1CO1	{11: 2, 20: 1, 5: 3, 6: 1, 23: 1}
OK	70167-57-6	C1CCC2(CC1)OC[C@@H](O2)[C@@H]3[C@H](OC4(O3)CCCCC4)[C@H]5COC6(O5)CCCCC6	{11: 17, 12: 4, 13: 3, 23: 6}
OK	70179-76-9	C=CCC(CC=C)(C(=O)OCCOC(=O)C=C)C(CC=C)(CC=C)C(=O)OCC(COC(=O)C=C)O	{2: 8, 3: 1, 4: 2, 5: 6, 6: 6, 20: 1, 28: 4}
OK	70179-82-7	CCCCCCC1C=CC(C(C1CC=CCCCCC)CCCCCCCC2=NCCN2CCNCCN)CCCCCCCC3=NCCN3CCNCCN	{1: 2, 2: 32, 35: 2, 6: 2, 33: 2, 11: 4, 12: 4, 14: 2, 15: 2, 30: 2, 31: 2}
OK	70187-91-6	CC(=C)CC(CC(=C)C)O.CC(=O)O	{1: 3, 2: 2, 3: 1, 5: 2, 7: 2, 20: 1, 27: 1}
OK	70198-23-1	C(CCN)CC(C(=O)OCCN)N.Cl.Cl.Cl	{17: 3, 2: 6, 3: 1, 28: 1, 30: 3}
OK	70198-24-2	C(CCC(CCCCCN=C=O)N=C=O)CCN=C=O	{8: 3, 34: 3, 2: 10, 3: 1, 29: 3}
OK	70199-34-7	CCCCCCCC(=O)NCCCCCCNC(=O)CCCCCCC	{24: 2, 1: 2, 2: 18, 31: 2}
OK	702-28-3	COC(=O)C1CC1C(=O)OC	{1: 2, 11: 1, 12: 2, 28: 2}
OK	702-32-9	C1CCCCC#CCCCC1	{10: 2, 11: 9}
OK	702-50-1	CC1(CC(=O)C(C(=O)C1)(C)C)C	{1: 4, 11: 2, 13: 2, 25: 2}
OK	702-54-5	CCC1(COC(=O)NC1=O)CC	{32: 1, 1: 2, 2: 2, 11: 1, 13: 1, 25: 1, 28: 1}
OK	702-62-5	C1CCC2(CC1)C(=O)NC(=O)N2	{32: 2, 25: 2, 11: 5, 13: 1}
OK	702-67-0	CC12CCC(CC1)(CC2)C(=O)O	{27: 1, 1: 1, 11: 6, 13: 2}
OK	702-75-0	CC1(COC2(CCCC2)OC1)C	{1: 2, 11: 6, 13: 2, 23: 2}
OK	702-79-4	CC12CC3CC(C1)CC(C3)(C2)C	{1: 2, 11: 6, 12: 2, 13: 2}
OK	702-92-1	CC1(CC1C(=O)OC)C(=O)OC	{1: 3, 11: 1, 12: 1, 13: 1, 28: 2}
OK	702-96-5	CC1(CC(C(N1)(C)C)C(=O)N)C	{32: 1, 1: 4, 11: 1, 12: 1, 13: 2, 24: 1, 30: 1}
OK	702-98-7	CC1(C2CC3CC(C2)CC1C3)O	{1: 1, 11: 5, 12: 4, 13: 1, 20: 1}
OK	7020-80-6	CC=NC(C)(C)C	{1: 4, 34: 1, 4: 1, 6: 1}
OK	70214-77-6	CC(C)CC(C)CCCC(C)O	{1: 4, 2: 4, 3: 3, 20: 1}
OK	70220-06-3	CCC=CCCOC	{1: 2, 2: 3, 22: 1, 6: 2}
OK	70220-95-0	C1CC2C3CC(C=C3)C(C1)C2O	{20: 1, 11: 4, 12: 5, 14: 2}
OK	70220-96-1	CC1(C2CCCC1C3CC2C=C3)O	{1: 1, 11: 4, 12: 4, 13: 1, 14: 2, 20: 1}
OK	70222-88-7	CC1(C2CCC(O1)(C(=O)C2)C)C	{1: 3, 11: 3, 12: 1, 13: 2, 23: 1, 25: 1}
OK	70224-28-1	CC[C@@H](C)CCO	{1: 2, 2: 3, 3: 1, 20: 1}
OK	7023-01-0	CCCCCCCCC(C(CCCCCCCCO)O)O	{1: 1, 2: 15, 3: 2, 20: 3}
OK	7024-09-1	CCC(CO)(CO)COC(=O)C(=C)C	{1: 2, 2: 4, 4: 1, 5: 1, 7: 1, 20: 2, 28: 1}
OK	70247-79-9	CC(C)(CO)COC(=O)CCCCC(=O)O	{1: 2, 2: 6, 4: 1, 20: 1, 27: 1, 28: 1}
OK	7027-11-4	CC1(CC(=O)CC(C1)(C)C#N)C	{1: 3, 37: 1, 11: 3, 13: 2, 25: 1}
OK	70288-86-7	CCC(C)C1C(CCC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C	{1: 10, 2: 1, 3: 1, 11: 8, 12: 17, 13: 2, 14: 5, 15: 3, 20: 3, 22: 4, 23: 5, 28: 1}
OK	70288-98-1	CCCCCC(=O)OC1=CCC(CC1)C(C)(C)C	{1: 4, 2: 4, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 28: 1}
OK	70288-99-2	CCCN(CCC)CCCC#N	{1: 2, 2: 7, 37: 1, 33: 1}
OK	70289-01-9	CCCCC(C)(CC)CC(=O)O	{1: 3, 2: 5, 27: 1, 4: 1}
OK	70289-02-0	CCCC(C)(CC)C(C#N)C(=O)OCC	{1: 4, 2: 4, 3: 1, 4: 1, 37: 1, 28: 1}
OK	70289-07-5	CCC(C)SCC=C	{1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 40: 1}
OK	70289-14-4	CC1CC=CCC1COC(=O)C	{1: 2, 2: 1, 11: 2, 12: 2, 14: 2, 28: 1}
OK	70289-15-5	CCCCN1CCCC(C1)CC(=O)O	{1: 1, 2: 4, 33: 1, 11: 4, 12: 1, 27: 1}
OK	70289-17-7	CCCN(CCC)CCCCO	{1: 2, 2: 8, 20: 1, 33: 1}
OK	70289-26-8	CCC(C(C1CCCCC1)O)O	{1: 1, 2: 1, 3: 2, 11: 5, 12: 1, 20: 2}
OK	70289-31-5	C(C(CBr)(Cl)Br)Cl	{17: 2, 2: 2, 4: 1, 18: 2}
OK	70289-32-6	CC1CCCC(C1CO)C	{1: 2, 2: 1, 11: 3, 12: 3, 20: 1}
OK	70289-33-7	CC(C)CN(CCCCO)CC(C)C	{1: 4, 2: 6, 3: 2, 20: 1, 33: 1}
OK	70289-34-8	CCCCCOC(=O)CC(CC(=O)OCCCCC)(C(=O)OCCCCC)O	{1: 3, 2: 14, 4: 1, 20: 1, 28: 3}
OK	70289-37-1	CCCCCCCCCOC(=O)C1CCCCC1	{1: 1, 2: 8, 11: 5, 12: 1, 28: 1}
OK	70289-40-6	CCCN1CC(OC(C1)C)C	{1: 3, 2: 2, 33: 1, 11: 2, 12: 2, 23: 1}
OK	70289-41-7	CCCCCCCCCCOCCOCCOCCC#N	{1: 1, 2: 15, 37: 1, 22: 3}
OK	70289-42-8	CCCN(CCC)N/C=C\1/C=C(C=CC1=O)[N+](=O)[O-]	{1: 2, 2: 4, 38: 1, 6: 1, 33: 1, 14: 3, 15: 2, 25: 1, 31: 1}
OK	70289-47-3	CC(C)(C)CCCCCC(=O)O.CC(C)(C1CCC(CC1)O)C2CCC(CC2)O.C1C(O1)CCl	{1: 5, 2: 6, 4: 2, 11: 9, 12: 5, 17: 1, 20: 2, 23: 1, 27: 1}
OK	7029-09-6	CC(=O)CCCCCCCCC(=O)C	{24: 2, 1: 2, 2: 8}
OK	703-13-9	C1CCC(C1)OC(=O)C(F)(F)F	{16: 3, 12: 1, 11: 4, 4: 1, 28: 1}
OK	703-34-4	C1CCC2C3CCC(C2C1)CC3	{11: 8, 12: 4}
OK	70321-11-8	COCCCN(CN1C(=O)CCC1=O)CN2C(=O)CCC2=O	{1: 1, 2: 5, 33: 3, 11: 4, 22: 1, 25: 4}
OK	70321-83-4	CCCCCCCCCCCCN(C)C.CCCCCCCC/C=C\CCCCCCCC(=O)O	{1: 4, 2: 25, 27: 1, 6: 2, 33: 1}
OK	70333-06-1	CC1CCCC(OC(=O)C1)(C)C	{1: 3, 11: 4, 12: 1, 13: 1, 28: 1}
OK	7034-04-0	CC1CC2NC(CC3N2C(N1)CC(N3)C)C	{32: 3, 1: 3, 11: 3, 12: 6, 33: 1}
OK	70348-66-2	CCCC1=NN1	{32: 1, 1: 1, 2: 2, 35: 1, 15: 1}
OK	7036-98-8	CCCC(=CC(=O)CCC)C	{24: 1, 1: 3, 2: 4, 6: 1, 7: 1}
OK	7037-49-2	C1CNCCC1CCCO	{32: 1, 20: 1, 2: 3, 11: 4, 12: 1}
OK	70384-51-9	COCCOCCN(CCOCCOC)CCOCCOC	{1: 3, 2: 12, 22: 6, 33: 1}
OK	70394-23-9	CN(C)C1CCCCNC1=O	{32: 1, 1: 2, 33: 1, 11: 4, 12: 1, 25: 1}
OK	70394-25-1	CN(C)C1CCCCNC1=O.C1CCC(=O)NCC1	{32: 2, 1: 2, 33: 1, 11: 9, 12: 1, 25: 2}
OK	704-02-9	C1C2C3C4CC5C3C1C6C2C4C56	{11: 2, 12: 10}
OK	704-15-4	C1CC(N(C1)C(=O)CN)C(=O)O	{33: 1, 2: 1, 11: 3, 12: 1, 24: 1, 27: 1, 30: 1}
OK	7040-23-5	COC(=O)COCC(=O)OC	{1: 2, 2: 2, 28: 2, 22: 1}
OK	70412-52-1	CC1=CC=C2C(CCC(=O)C(O1)(O2)C)(C)C	{1: 4, 11: 2, 13: 2, 14: 2, 15: 2, 23: 2, 25: 1}
OK	70415-58-6	C=CC=CO	{20: 1, 5: 1, 6: 3}
OK	70419-10-2	C[C@@H](CCCC(C)C)N	{1: 3, 2: 3, 3: 2, 30: 1}
OK	70419-11-3	C[C@H](CCCC(C)C)N	{1: 3, 2: 3, 3: 2, 30: 1}
OK	70423-38-0	C[C@@H](CCO)CO	{1: 1, 2: 3, 3: 1, 20: 2}
OK	7044-96-4	CCC(=O)OCOC(=O)CC	{1: 2, 2: 3, 28: 2}
OK	7045-70-7	CC(C)C1CCCC(C1)C(C)C	{11: 4, 1: 4, 3: 2, 12: 2}
OK	7045-71-8	CCCCCCCCCC(C)C	{1: 3, 2: 8, 3: 1}
OK	7045-89-8	CC1(C2(OC(C(O1)(O2)C)(C)C)C)C	{1: 6, 13: 4, 23: 3}
OK	7046-61-9	C(CN(CCN=C=O)[N+](=O)[O-])N=C=O	{33: 1, 2: 4, 38: 1, 8: 2, 34: 2, 29: 2}
OK	70477-21-3	CC(C)C(C#N)Cl	{1: 2, 3: 2, 37: 1, 17: 1}
OK	7049-68-5	CCCCCCCC/C=C\CCCCCCCC(=O)O.CCCCCCCC/C=C\CCCCCCCC(=O)O	{1: 2, 2: 28, 27: 2, 6: 4}
OK	70495-38-4	C(CNCO)NCO	{2: 4, 20: 2, 31: 2}
OK	70495-41-9	C(CCCNCCCCCCN)CCN.C(CNCCN)N.C(#N)N=C(N)N	{2: 16, 37: 1, 7: 1, 34: 1, 30: 6, 31: 2}
OK	705-86-2	CCCCCC1CCCC(=O)O1	{1: 1, 2: 4, 11: 3, 12: 1, 28: 1}
OK	70501-82-5	C1CC=CN(C1)N=O	{33: 1, 34: 1, 11: 3, 29: 1, 14: 2}
OK	7051-34-5	C1CC1CBr	{2: 1, 11: 2, 12: 1, 18: 1}
OK	70517-23-6	CC1(OC(=C)C(=C)O1)C	{23: 2, 1: 2, 15: 2, 5: 2, 13: 1}
OK	70517-24-7	C=C1C(=C)OCCO1	{23: 2, 11: 2, 5: 2, 15: 2}
OK	70517-50-9	CN1CN2CCCN2CN1C	{1: 2, 11: 5, 33: 4}
OK	70542-46-0	CCOC(=O)C1C2CC(C1C=O)C=C2	{1: 1, 2: 1, 11: 1, 12: 4, 14: 2, 26: 1, 28: 1}
OK	7058-01-7	CCC(C)C1CCCCC1	{11: 5, 1: 2, 2: 1, 3: 1, 12: 1}
OK	7059-49-6	CCCCCCC(CCCCCCCCCCC(=O)N)O	{1: 1, 2: 15, 3: 1, 20: 1, 24: 1, 30: 1}
OK	706-14-9	CCCCCCC1CCC(=O)O1	{1: 1, 2: 5, 11: 2, 12: 1, 28: 1}
OK	706-19-4	CCCCCCCC1NCCS1	{32: 1, 1: 1, 2: 6, 41: 1, 11: 2, 12: 1}
OK	706-31-0	C1CC=CCCC=CCCC=C1	{11: 6, 14: 6}
OK	706-78-5	C1(=C(C(C(C1(Cl)Cl)(Cl)Cl)(Cl)Cl)Cl)Cl	{17: 8, 13: 3, 15: 2}
OK	706-79-6	C1(=C(C(C(C1(F)F)(F)F)(F)F)Cl)Cl	{16: 6, 17: 2, 13: 3, 15: 2}
OK	70606-00-7	C1CC(=O)OC1C=O	{28: 1, 26: 1, 11: 2, 12: 1}
OK	70615-16-6	C1CC(CCC1CC2CCC(CC2)NC3CCC(CC3)CC4CCC(CC4)NC5CCC(CC5)CC6CCC(CC6)N)N	{2: 3, 11: 24, 12: 12, 30: 2, 31: 2}
OK	70629-19-5	CC1N(CCS1)N=O	{1: 1, 34: 1, 33: 1, 41: 1, 11: 2, 12: 1, 29: 1}
OK	70632-12-1	C1CC(CCC1CO)CO.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{27: 2, 20: 4, 2: 10, 11: 4, 12: 2}
OK	70632-13-2	CC(C)CCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OC	{1: 5, 2: 7, 3: 1, 5: 2, 7: 2, 28: 2}
OK	70644-49-4	CCOC(=O)CCN1CCCC(C1)C	{1: 2, 2: 3, 33: 1, 11: 4, 12: 1, 28: 1}
OK	7065-46-5	CC(C)(C)CC(=O)Cl	{24: 1, 1: 3, 2: 1, 4: 1, 17: 1}
OK	70655-40-2	CCCCCCCCSCCC(=O)OC	{40: 1, 1: 2, 2: 9, 28: 1}
OK	70657-70-4	CC(COC(=O)C)OC	{1: 3, 2: 1, 3: 1, 28: 1, 22: 1}
OK	70660-49-0	CC(C)(CO)CO.C(CCC(=O)O)CC(=O)O.C(CO)O	{1: 2, 2: 8, 27: 2, 4: 1, 20: 4}
OK	7068-83-9	CCCCN(C)N=O	{1: 2, 2: 3, 34: 1, 29: 1, 33: 1}
OK	70681-41-3	COC(=O)C[C@H](C(=O)OC)O	{1: 2, 2: 1, 3: 1, 20: 1, 28: 2}
OK	70682-66-5	CCCCC=CCCC#CCCCCCCCl	{1: 1, 2: 11, 10: 2, 6: 2, 17: 1}
OK	70682-67-6	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#N)CCNCCC#N	{1: 1, 2: 24, 37: 2, 33: 1, 24: 1, 31: 2}
OK	70682-70-1	CCCCCCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#N)CCNC(=O)CCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 46, 37: 1, 33: 1, 24: 2, 31: 2}
OK	70682-78-9	C=CCON1C(=O)N(C(=O)N(C1=O)OCC=C)OCC=C.C=CC=C	{33: 3, 2: 3, 5: 5, 6: 5, 22: 3, 25: 3}
OK	70688-47-0	CC1CCC(=CC1)C	{1: 2, 11: 3, 12: 1, 14: 1, 15: 1}
OK	7069-38-7	C/C(=C\Cl)/Cl	{1: 1, 17: 2, 6: 1, 7: 1}
OK	7069-41-2	CCCCCCCCC/C=C/C(=O)C	{24: 1, 1: 2, 2: 8, 6: 2}
OK	70690-24-3	CCCCC(CCCBr)Br	{1: 1, 2: 6, 3: 1, 18: 2}
OK	70693-21-9	CCCCCCCCCCCCOC(=O)[C@H]1CCCC=C1	{1: 1, 2: 11, 11: 3, 12: 1, 14: 2, 28: 1}
OK	70693-34-4	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)COCC(CO)(CO)CO)O	{1: 3, 2: 29, 4: 3, 20: 8, 22: 2, 27: 3}
OK	70693-35-5	CCCCCCCCCCCC(=O)O.CCCCC(CC)C(=O)O.C(C(CO)(CO)CO)O	{1: 3, 2: 18, 3: 1, 4: 1, 20: 4, 27: 2}
OK	70693-36-6	CCCCCCCCCCCC(=O)OCC(C)(C)[C@H](C(C)C)OC(=O)CCCC	{1: 6, 2: 14, 3: 2, 4: 1, 28: 2}
OK	70693-37-7	CCCCCCC(=O)OCC(CO)(CO)COC(=O)CCCCCC(C)C	{1: 3, 2: 14, 3: 1, 4: 1, 20: 2, 28: 2}
OK	70693-38-8	CC(C)CCCCCC(=O)OCCCCC(=O)OCC(CO)(CO)CO	{1: 2, 2: 13, 3: 1, 4: 1, 20: 3, 28: 2}
OK	70693-40-2	CCCCCCCCC(=O)OCC(COC(=O)CCCC)OC(=O)CCCCCC	{1: 3, 2: 17, 3: 1, 28: 3}
OK	70693-41-3	CCCCCCCCC(=O)OCC(C)(C)[C@@H](C(C)C)OC(=O)CCCC	{1: 6, 2: 11, 3: 2, 4: 1, 28: 2}
OK	70693-74-2	CCCCCCCCCCCCC/C=C/C=C/C(=O)O.CCCCCCCCCCCCC/C=C/C=C/C(=O)O	{1: 2, 2: 24, 27: 2, 6: 8}
OK	707-35-7	CC12CC3CC(C1)(CC(C3)(C2)C)C	{1: 3, 11: 6, 12: 1, 13: 3}
OK	70703-42-3	CC(CN1C(=O)C(N(C1=O)C2CO2)(C)C)OC3CO3.CC1(C(=O)N(C(=O)N1C2CO2)C3CO3)C.C=CC(=O)O	{1: 5, 2: 1, 3: 1, 5: 1, 6: 1, 33: 4, 11: 4, 12: 4, 13: 2, 22: 1, 23: 4, 25: 4, 27: 1}
OK	70703-47-8	CCCCCCC(CCCCCCCCCCC(=O)OCCOC)OC(=O)C	{1: 3, 2: 17, 3: 1, 28: 2, 22: 1}
OK	70705-73-6	C1CC2C(=O)C(=O)C1C23CC3	{25: 2, 11: 4, 12: 2, 13: 1}
OK	70714-62-4	CCCCCCC1C=CC(CC1C(=O)O)CCCCCCCC(=O)O.CCC(CO)(CO)CO	{1: 2, 2: 16, 4: 1, 11: 1, 12: 3, 14: 2, 20: 3, 27: 2}
OK	70714-77-1	C=CC(=O)NC(CC(=O)O)C(=O)O	{2: 1, 3: 1, 5: 1, 6: 1, 24: 1, 27: 2, 31: 1}
OK	70714-94-2	CC(C)CCCCCOC(=O)C=C.C=CC(=O)N[C@@H](CC(=O)O)C(=O)O	{1: 2, 2: 6, 3: 2, 5: 2, 6: 2, 24: 1, 27: 2, 28: 1, 31: 1}
OK	70714-95-3	CC(C)CCCCCOC(=O)C=C.C=CC(=O)N.C=CC(=O)N[C@@H](CC(=O)O)C(=O)O	{1: 2, 2: 6, 3: 2, 5: 3, 6: 3, 24: 2, 27: 2, 28: 1, 30: 1, 31: 1}
OK	70715-05-8	CC1CN1.CC(=C)C(=O)O.CC(=C)C(=O)OC	{32: 1, 1: 4, 5: 2, 7: 2, 11: 1, 12: 1, 27: 1, 28: 1}
OK	70715-07-0	CCCCCCSSSSCCCCCC	{40: 4, 1: 2, 2: 10}
OK	70715-12-7	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCN(C)C	{1: 4, 2: 27, 27: 1, 33: 1}
OK	70715-18-3	C1CN(CCC1CCCC2CCN(CC2)C(=O)N)C(=O)N	{33: 2, 2: 3, 11: 8, 12: 2, 24: 2, 30: 2}
OK	70715-91-2	CC(C)N(COC(=O)C)N=O	{1: 3, 2: 1, 3: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	70715-92-3	CC(C)CN(COC(=O)C)N=O	{1: 3, 2: 2, 3: 1, 33: 1, 34: 1, 28: 1, 29: 1}
OK	70729-68-9	CCCCCCC(=O)OCCOCCOCCOCCOC(=O)CCCCCC	{1: 2, 2: 18, 28: 2, 22: 3}
OK	70729-73-6	CC1(CC(CC(N1)(C)C)NCCCCCCNC2CC(NC(C2)(C)C)(C)C)C.C1C(O1)CCl	{32: 2, 1: 8, 2: 7, 11: 5, 12: 3, 13: 4, 17: 1, 23: 1, 31: 2}
OK	70729-74-7	C[C@@H]1CCC[C@H](C1)C.C1C=CC2C1C3CC2C=C3	{1: 2, 11: 6, 12: 6, 14: 4}
OK	70729-87-2	CCCCCCCCCCCCN(C)C.CC(C)CCCCCCCCCCCCCCC(=O)O	{27: 1, 1: 5, 2: 25, 3: 1, 33: 1}
OK	70732-43-3	CCCC#CCCC(C)C	{1: 3, 2: 4, 3: 1, 10: 2}
OK	70732-45-5	CCCCCC#CC(C)(C)CC	{1: 4, 2: 5, 4: 1, 10: 2}
OK	70750-10-6	CCCCCCCCCCCCCCCCCC(=O)O.CCN(CC)CCO.C1COCCN1	{32: 1, 1: 3, 2: 20, 33: 1, 11: 4, 20: 1, 23: 1, 27: 1}
OK	70750-12-8	CCCCCCCC(=O)O.C(CNCCO)N	{1: 1, 2: 10, 20: 1, 27: 1, 30: 1, 31: 1}
OK	7077-05-6	CC(C)C1CCC(CC1)C(=O)O	{11: 4, 1: 2, 3: 1, 12: 2, 27: 1}
OK	70775-88-1	CCCCCCCCCCCCCCCCCCNCC[C@H](CCCCC)C(C)(C)C	{1: 5, 2: 23, 3: 1, 4: 1, 31: 1}
OK	70776-01-1	CCCCCCCCCC(=O)OCC(CO)(COCC(CO)(COC(=O)CCCC)COC(=O)CCCCCCC)COC(=O)CCCCC	{1: 4, 2: 29, 4: 2, 20: 2, 22: 1, 28: 4}
OK	70776-02-2	CCCCCCCCCC(=O)OCC(COC(=O)CCCC)(COC(=O)CCCCC)COC(=O)CCCCCCC	{1: 4, 2: 25, 4: 1, 28: 4}
OK	70776-14-6	CCCCCCCCCCCCCOCCCNCCCN.CCCCCCCCCCCC(=O)N(C)CC(=O)O	{1: 3, 2: 29, 33: 1, 22: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	70776-15-7	CCCCC(C)CCOCC(CCl)OCC(CCl)OCC(CCl)O	{1: 2, 2: 11, 3: 4, 17: 3, 20: 1, 22: 3}
OK	70776-24-8	C(COCN(COCCN)COCCN)N.Cl	{17: 1, 2: 9, 30: 3, 22: 3, 33: 1}
OK	70776-25-9	CCCCCCCCCCCCCOCCCNCCCNCCC(=O)OCC(CC)CCCC	{1: 3, 2: 25, 3: 1, 22: 1, 28: 1, 31: 2}
OK	70776-26-0	CCCCCCC(CSSCC(CCCCCC)Cl)Cl	{40: 2, 1: 2, 2: 12, 3: 2, 17: 2}
OK	70776-27-1	CCCCC(CSSCC(CCCC)Cl)Cl	{40: 2, 1: 2, 2: 8, 3: 2, 17: 2}
OK	70776-31-7	C(CCC(=O)OCC(CO)(CO)CBr)CC(=O)OCC(CO)(CO)CBr	{20: 4, 2: 12, 4: 2, 18: 2, 28: 2}
OK	70776-34-0	C(CCC(=O)OCC(CO)(CBr)CBr)CC(=O)OCC(CO)(CBr)CBr	{20: 2, 2: 12, 4: 2, 18: 4, 28: 2}
OK	70776-45-3	CCCCC(CC)COC(=O)C=C.CCOC(=O)C=C.CC(=O)OC=C.C=CC(=O)NCO	{1: 4, 2: 7, 3: 1, 5: 4, 6: 4, 20: 1, 24: 1, 28: 3, 31: 1}
OK	70776-76-0	C(=C(F)F)(OC(C(C(F)(F)F)(OC(C(=O)O)(F)F)F)(F)F)F.C(=C(F)F)(F)F	{16: 15, 27: 1, 4: 4, 22: 2, 7: 4}
OK	70776-82-8	CC(C)(CO)COC(=O)C(C)(C)CO.C1CCC(=O)OCC1	{1: 4, 2: 3, 4: 2, 11: 5, 20: 2, 28: 2}
OK	70776-85-1	CC(C)(CO)CO.C(CCC(=O)O)CC(=O)O.C(CS)C(=O)O	{1: 2, 2: 8, 4: 1, 39: 1, 20: 2, 27: 3}
OK	70779-90-7	CCOC(=O)C(CC(C)C)NC(=O)NC(CC(C)C)C(=O)OCC	{1: 6, 2: 4, 3: 4, 24: 1, 28: 2, 31: 2}
OK	7078-34-4	C1CCC2CC(C1)C2	{11: 6, 12: 2}
OK	70788-45-3	CC(=C)C(=O)OCCNC(C)(C)C.C=CC(=O)O	{1: 4, 2: 2, 4: 1, 5: 2, 6: 1, 7: 1, 27: 1, 28: 1, 31: 1}
OK	70788-64-6	CCCCOC(=O)C(=C)C.CC(C)COCNC(=O)C=C	{1: 4, 2: 5, 3: 1, 5: 2, 6: 1, 7: 1, 22: 1, 24: 1, 28: 1, 31: 1}
OK	70801-04-6	C[C@@H]1CC/C=C(/[C@H](C[C@H]2[C@H]1C[C@H]2C)C(=O)C)\C	{1: 4, 11: 4, 12: 5, 14: 1, 15: 1, 24: 1}
OK	70807-90-8	COC(C)CN.Cl	{1: 2, 2: 1, 3: 1, 17: 1, 22: 1, 30: 1}
OK	7081-78-9	CCOC(C)Cl	{1: 2, 2: 1, 3: 1, 22: 1, 17: 1}
OK	70810-19-4	CC1CC(CC(C1)(C)C)(C)C	{1: 5, 11: 3, 12: 1, 13: 2}
OK	70811-78-8	C(CCCC(=O)O)CCCC(=O)O.C(CO)COCCCO	{2: 13, 27: 2, 20: 2, 22: 1}
OK	70815-11-1	CCCCCCCCC=CCCCCCCCC(=O)N(CCNCCNCCO)CCO	{1: 1, 2: 22, 6: 2, 33: 1, 20: 2, 24: 1, 31: 2}
OK	70815-28-0	C(CCO)CO.C(CSCCO)O	{40: 1, 2: 8, 20: 4}
OK	70833-49-7	CCCCCCCCCCCC=C[N+](=O)[O-]	{1: 1, 2: 10, 38: 1, 6: 2}
OK	70833-52-2	CCCCCCCCCCCC(C[N+](=O)[O-])O	{1: 1, 2: 11, 3: 1, 20: 1, 38: 1}
OK	7085-85-0	CCOC(=O)C(=C)C#N	{1: 1, 2: 1, 37: 1, 7: 1, 28: 1, 5: 1}
OK	70851-04-6	CCCCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O	{1: 3, 2: 29, 4: 2, 20: 6, 22: 1, 27: 3}
OK	70851-05-7	CCCCCCCCC(=O)O.CCCCCCC(=O)O.CCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O	{1: 3, 2: 23, 4: 2, 20: 6, 22: 1, 27: 3}
OK	70851-18-2	CCO[I-](O)(O)SOC(=O)C	{1: 2, 2: 1, 40: 1, 19: 1, 20: 2, 22: 1, 28: 1}
OK	70851-59-1	CC1(CC(CC(N1)(C)C)C(=O)OCC2CCC(CC2)COC(=O)C3CC(NC(C3)(C)C)(C)C)C	{32: 2, 1: 8, 2: 2, 11: 8, 12: 4, 13: 4, 28: 2}
OK	70851-63-7	C(CO)N1C(C(N(C1=O)CN2C(C(N(C2=O)CCO)O)O)O)O	{20: 6, 2: 5, 12: 4, 33: 4, 25: 2}
OK	7087-36-7	CC(=C1CCCCCC1)C	{15: 1, 1: 2, 11: 6, 7: 1}
OK	7087-68-5	CCN(C(C)C)C(C)C	{1: 5, 2: 1, 3: 2, 33: 1}
OK	70873-22-2	CN1CCC2CCCN1C2	{1: 1, 11: 6, 12: 1, 33: 2}
OK	70873-23-3	CN1CC2CCCN1C2	{1: 1, 11: 5, 12: 1, 33: 2}
OK	70873-24-4	C1CC2C(C1)C3C4C5CC6C4C2N7C6C5N37	{33: 2, 11: 4, 12: 10}
OK	70879-36-6	CCCCCCCCCCCCOC(=O)/C=C\C(=O)O	{1: 1, 2: 11, 27: 1, 28: 1, 6: 2}
OK	70892-19-2	CCCCCCCCCCCCCCCCCC(=O)OCC(C)O.COC(=O)CCCCC(=O)OC.COC(=O)CCCC(=O)OC	{1: 6, 2: 24, 3: 1, 20: 1, 28: 5}
OK	70892-79-4	CCC(=O)OCCS	{1: 1, 2: 3, 28: 1, 39: 1}
OK	7090-88-2	CC(C)C(=C(C(C)C)C(C)C)C(C)C	{1: 8, 3: 4, 7: 2}
OK	70900-46-8	CCCCOCCOCCOC(=O)CCCCCCCCC(=O)OCCOCCOCCCC	{1: 2, 2: 22, 28: 2, 22: 4}
OK	70900-47-9	CCCCOCCOCCOC(=O)CCCCCCCC(=O)OCCOCCOCCCC	{1: 2, 2: 21, 28: 2, 22: 4}
OK	70912-52-6	CC1(OC(=O)C(=C2CCCN2)C(=O)O1)C	{32: 1, 1: 2, 11: 3, 13: 1, 15: 2, 28: 2}
OK	70913-83-6	CCCCC(CC)C(=O)OCC(CO)(CO)CO	{1: 2, 2: 8, 3: 1, 4: 1, 20: 3, 28: 1}
OK	70913-84-7	CCC(CO)(CO)COC(=O)CCCCCCCCCCCCCCC(C)C	{1: 3, 2: 18, 3: 1, 4: 1, 20: 2, 28: 1}
OK	7092-01-5	C1=CSS1	{41: 2, 14: 2}
OK	7092-05-9	C1C2C1C3C=CC2C=C3	{11: 1, 12: 4, 14: 4}
OK	7092-24-2	C1CC2(CC=C1)OCCO2	{11: 5, 13: 1, 14: 2, 23: 2}
OK	7092-57-1	C1CC12C3C=CC2C=C3	{11: 2, 12: 2, 13: 1, 14: 4}
OK	7092-58-2	C1CC2C=CC1C3C2C3	{11: 3, 12: 4, 14: 2}
OK	7093-67-6	C(C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)O)N	{24: 4, 2: 5, 27: 1, 30: 1, 31: 4}
OK	7093-70-1	C[C@H]([C@@H](C(=O)O)NC(=O)CN)O	{1: 1, 2: 1, 3: 2, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	7094-27-1	CC1CCC(CC1)(C)C	{1: 3, 11: 4, 12: 1, 13: 1}
OK	70942-03-9	CCCCC(=O)N(CCO)CCO	{24: 1, 1: 1, 2: 7, 20: 2, 33: 1}
OK	70942-32-4	COC(=O)CCCC(=O)OCCS	{1: 1, 2: 5, 28: 2, 39: 1}
OK	70942-33-5	COC(=O)CCCCC(=O)OCCS	{1: 1, 2: 6, 28: 2, 39: 1}
OK	70942-41-5	CCCCCCCCCCCCCCCOC(=O)CCS	{1: 1, 2: 16, 28: 1, 39: 1}
OK	70942-45-9	CCCCCCCCCCCCCCOC(=O)CCS	{1: 1, 2: 15, 28: 1, 39: 1}
OK	7095-65-0	C1CC2C1CC=C2	{11: 3, 12: 2, 14: 2}
OK	70969-57-2	CCCCCCCCCCCCCCCCCC(=O)OCC(COCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC	{1: 6, 2: 104, 4: 2, 22: 1, 28: 6}
OK	70969-58-3	CC(C)COC(=O)C1CCCCC1C(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 11: 4, 12: 2, 28: 2}
OK	70969-64-1	CCCCCCCC(=O)OCC(C)(CC)COC(=O)CCCCC(C)C	{1: 5, 2: 13, 3: 1, 4: 1, 28: 2}
OK	70969-65-2	CC(C)CCCCCOCC(COCC(C)(COC(=O)CCCCC(C)C)COC(=O)CCCCC(C)C)(COC(=O)CCCCC(C)C)COC(=O)CCCCC(C)C	{1: 11, 2: 28, 3: 5, 4: 2, 22: 2, 28: 4}
OK	70969-71-0	CCCCCCCC(=O)OC(COC(=O)C)COC(=O)C	{1: 3, 2: 8, 3: 1, 28: 3}
OK	7098-07-9	CCN1C=CN=C1	{1: 1, 2: 1, 35: 1, 14: 3, 33: 1}
OK	7098-20-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 40}
OK	7098-21-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 41}
OK	7098-22-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 42}
OK	7098-23-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 43}
OK	7098-24-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 44}
OK	7098-25-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 45}
OK	7098-26-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 46}
OK	7098-27-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 47}
OK	7098-80-8	CC(=C)C(=O)OCC1COC(O1)(C)C	{1: 3, 2: 1, 5: 1, 7: 1, 11: 1, 12: 1, 13: 1, 23: 2, 28: 1}
OK	70983-42-5	CCCCC(CC)CC(CCC(=O)OC)C(=O)OC.CC(CCO)O.COC(=O)CCCCC(=O)OC	{1: 7, 2: 13, 3: 3, 20: 2, 28: 4}
OK	70983-57-2	CCCCOCCO.C(CCC(=O)O)CC(=O)O.C(CC(=O)O)CC(=O)O	{1: 1, 2: 12, 27: 4, 20: 1, 22: 1}
OK	71-23-8	CCCO	{1: 1, 2: 2, 20: 1}
OK	71-33-0	C1=NC(=O)NC(=O)N1	{32: 2, 25: 2, 35: 1, 14: 1}
OK	71-36-3	CCCCO	{1: 1, 2: 3, 20: 1}
OK	71-41-0	CCCCCO	{1: 1, 2: 4, 20: 1}
OK	71-43-2	C1=CC=CC=C1	{14: 6}
OK	71-44-3	C(CCNCCCN)CNCCCN	{2: 10, 30: 2, 31: 2}
OK	71-55-6	CC(Cl)(Cl)Cl	{1: 1, 4: 1, 17: 3}
OK	71-63-6	CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)O)O	{1: 5, 11: 13, 12: 17, 13: 3, 14: 1, 15: 1, 20: 5, 22: 3, 23: 3, 28: 1}
OK	710-04-3	CCCCCCC1CCCC(=O)O1	{1: 1, 2: 5, 11: 3, 12: 1, 28: 1}
OK	710-14-5	C1CCOC(C1)OCC2CCCO2	{2: 1, 11: 7, 12: 2, 22: 1, 23: 2}
OK	710-43-0	CCOC(=O)[C@@H]1C[C@@H]1C(=O)OCC	{1: 2, 2: 2, 11: 1, 12: 2, 28: 2}
OK	71002-13-6	C1CC(CCC1N=C=O)N=C=O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O	{2: 10, 8: 2, 11: 4, 12: 2, 34: 2, 20: 2, 27: 2, 29: 2}
OK	71010-53-2	CCCCCCCCCCCC(=O)OC[C@H](CO)COCOCC(CO)CO	{1: 1, 2: 17, 3: 2, 20: 3, 22: 2, 28: 1}
OK	71010-54-3	CCCCCCCCC/C=C/CCCCCCCC(=O)OC[C@H](CO)COCOCC(CO)CO	{1: 1, 2: 22, 3: 2, 6: 2, 20: 3, 22: 2, 28: 1}
OK	71010-57-6	C=CC(=O)OCCOCCO.C(CCC(=O)O)CC(=O)O	{2: 8, 5: 1, 6: 1, 20: 1, 22: 1, 27: 2, 28: 1}
OK	71010-66-7	CC(C)CCCCCCCCCCCCCCC(=O)OCC(CO)(CO)CO	{1: 2, 2: 18, 3: 1, 4: 1, 20: 3, 28: 1}
OK	71010-73-6	CCCCCCCCCC(=O)OCC(COCC(COC(=O)CCCC)(COC(=O)CCCCCCCC)COC(=O)CC(C)C)(COC(=O)CCCCCC)COC(=O)CCCCCCC	{1: 7, 2: 38, 3: 1, 4: 2, 22: 1, 28: 6}
OK	71010-74-7	CCCCCCCCCC(=O)OCC(COC(=O)CCCC)(COC(=O)CCCCCC)COC(=O)CCCCCCC	{1: 4, 2: 26, 4: 1, 28: 4}
OK	71010-75-8	CCCCCCCCCC(=O)OCC(COCC(CO)(CO)COC(=O)CCCC)(COC(=O)CCCCCC)COC(=O)CCCCCCC	{1: 4, 2: 30, 4: 2, 20: 2, 22: 1, 28: 4}
OK	71010-76-9	CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCC(=O)O.CCCCC(=O)O.C(C(CO)(CO)CO)O	{1: 4, 2: 26, 27: 4, 4: 1, 20: 4}
OK	71010-83-8	CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O	{1: 2, 2: 29, 4: 2, 20: 6, 22: 1, 27: 2}
OK	71010-94-1	CN1CCOCC1.CN(C)CCCN.C1C(O1)CCl	{1: 3, 2: 4, 33: 2, 11: 5, 12: 1, 17: 1, 23: 2, 30: 1}
OK	71016-15-4	CC(C)CCN(C(C)C(=O)C)N=O	{1: 4, 2: 2, 3: 2, 33: 1, 34: 1, 24: 1, 29: 1}
OK	71017-41-9	C1CNC2CC1C=C2	{32: 1, 11: 3, 12: 2, 14: 2}
OK	71017-44-2	COC(=O)N1CCC2CCC1C2	{1: 1, 11: 5, 12: 2, 28: 1, 33: 1}
OK	71017-51-1	CC(C)(C)N1C=CC2CC1C=C2	{1: 3, 4: 1, 33: 1, 11: 1, 12: 2, 14: 4}
OK	71017-52-2	CC(C)(C)N1CCC2CCC1C2	{1: 3, 11: 5, 4: 1, 12: 2, 33: 1}
OK	71017-55-5	C1CC2CC1C=CS2	{41: 1, 11: 3, 12: 2, 14: 2}
OK	71032-67-2	CCC1CC1CC	{1: 2, 2: 2, 11: 1, 12: 2}
OK	71032-90-1	CCCCCCCCC=CCCCCCCCCOC(CO)COCC(CO)O	{1: 1, 2: 19, 3: 2, 6: 2, 20: 3, 22: 2}
OK	71042-71-2	CCCCOC(=O)CCN(CCCO)CCC(=O)OCCCC	{1: 2, 2: 13, 20: 1, 28: 2, 33: 1}
OK	71042-96-1	CC1=CCC(C1(C)C)C=CCC#N	{1: 3, 2: 1, 37: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1}
OK	71042-97-2	CC1=CCC(C1(C)C)CC=CC#N	{1: 3, 2: 1, 37: 1, 6: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1}
OK	71046-96-3	CCC=CCC=CCC=CCCCCCC=C	{1: 1, 2: 8, 5: 1, 6: 7}
OK	71057-15-3	CCSCCCC(=O)O	{40: 1, 1: 1, 2: 4, 27: 1}
OK	71058-67-8	C1CCN2CCCCN(C1)CCCC2	{33: 2, 11: 12}
OK	71060-76-9	CC1CO1.C=CC(=O)O	{1: 1, 5: 1, 6: 1, 11: 1, 12: 1, 23: 1, 27: 1}
OK	71073-91-1	C=CC(=O)O.C(=O)(C(Cl)(Cl)Cl)O	{17: 3, 27: 2, 4: 1, 5: 1, 6: 1}
OK	71076-95-4	C(CCCCCCCCCCCCCCCCCCNCCCN)CCCCCCCCCCCCCCCCCNCCCN	{2: 42, 30: 2, 31: 2}
OK	71077-02-6	CCCCCCCCCCCC(=O)O.CCCCC(CC)C(=O)O.C(C(CO)O)O	{27: 2, 1: 3, 2: 16, 3: 2, 20: 3}
OK	71077-07-1	CCCCCCCC/C=C\CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)COCC(CO)(CO)CO)O	{1: 2, 2: 27, 4: 2, 6: 2, 20: 6, 22: 1, 27: 2}
OK	71077-08-2	CCCCCCCC/C=C\CCCCCCCC(=O)O.CCCCCCC(=O)O.C(C(CO)(CO)CO)O	{1: 2, 2: 23, 4: 1, 6: 2, 20: 4, 27: 2}
OK	71077-30-0	CCCCOCCC(C)CCC=C(C)C	{1: 4, 2: 7, 3: 1, 6: 1, 7: 1, 22: 1}
OK	71077-32-2	CC1CCCC(OC1CO)(C)C	{1: 3, 2: 1, 11: 3, 12: 2, 13: 1, 20: 1, 23: 1}
OK	71084-06-5	CCC#CCCCCCCCCCCOC1CCCCO1	{1: 1, 2: 11, 10: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71084-07-6	C#CCCCCCCCCCCOC1CCCCO1	{2: 10, 9: 1, 10: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71084-08-7	CCC#CCCCCCCCCO	{1: 1, 2: 9, 20: 1, 10: 2}
OK	711-01-3	COC(=O)C12CC3CC(C1)CC(C3)C2	{1: 1, 11: 6, 12: 3, 13: 1, 28: 1}
OK	71108-02-6	CC(N=C1SC(/C(=N\OC(=O)N(SN(C(=O)O/N=C\2/SC(=NC(C)C)SC2(C)C)C)C)/S1)(C)C)C	{1: 10, 34: 4, 3: 2, 33: 2, 40: 1, 41: 4, 13: 2, 15: 4, 28: 2}
OK	71108-04-8	CCN=C1S/C(=N/OC(=O)NC)/C(S1)(C)C	{1: 4, 2: 1, 34: 2, 41: 2, 13: 1, 15: 2, 28: 1, 31: 1}
OK	71108-05-9	CC(C)N=C1S/C(=N/OC(=O)NC)/C(S1)(C)C	{1: 5, 34: 2, 3: 1, 41: 2, 13: 1, 15: 2, 28: 1, 31: 1}
OK	71108-06-0	CC(C)N=C1S/C(=N/OC(=O)N(C)SC(Cl)(Cl)Cl)/C(S1)(C)C	{1: 5, 34: 2, 3: 1, 4: 1, 33: 1, 40: 1, 41: 2, 13: 1, 15: 2, 17: 3, 28: 1}
OK	71108-08-2	CC1(/C(=N\OC(=O)NC)/SC(=NC(C)(C)C)S1)C	{1: 6, 34: 2, 4: 1, 41: 2, 13: 1, 15: 2, 28: 1, 31: 1}
OK	71108-14-0	CC1(/C(=N\OC(=O)N(C)SC(Cl)(Cl)Cl)/S/C(=N\N(C)C)/S1)C	{1: 5, 34: 2, 4: 1, 33: 2, 40: 1, 41: 2, 13: 1, 15: 2, 17: 3, 28: 1}
OK	71108-21-9	CC1(/C(=N\OC(=O)N(C)SC(Cl)(Cl)Cl)/SC(=C(C#N)C#N)S1)C	{1: 3, 34: 1, 4: 1, 33: 1, 7: 1, 40: 1, 41: 2, 13: 1, 15: 2, 17: 3, 28: 1, 37: 2}
OK	71112-89-5	CCCCCCCOCCC	{1: 2, 2: 8, 22: 1}
OK	71113-20-7	C(C=C(F)F)N1C(=O)N(C(=O)N(C1=O)CC=C(F)F)CC=C(F)F	{33: 3, 2: 3, 6: 3, 7: 3, 16: 6, 25: 3}
OK	71113-96-7	C1CC(CCC1CO)CO.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O	{27: 2, 20: 4, 2: 12, 11: 4, 12: 2}
OK	71113-97-8	C(CCCC(=O)O)CCCC(=O)O.C(C(CO)O)O.C(/C(=C(/CO)\Br)/Br)O	{2: 11, 3: 1, 7: 2, 18: 2, 20: 5, 27: 2}
OK	71119-46-5	CCOCCCCCCCCCCCCCCNCCCNCCCCCCCCCCCCCCOCC	{1: 2, 2: 33, 22: 2, 31: 2}
OK	71121-92-1	CC(C)(C)C12CCC(O1)(OO2)C(C)(C)C	{1: 6, 11: 2, 4: 2, 13: 2, 23: 3}
OK	71130-09-1	CC1=C(C(=O)C(=C(C1=O)C)N(C)C)C	{1: 5, 25: 2, 33: 1, 15: 4}
OK	71130-13-7	CC(C)C12CCC(CC1)(C3C2C(=O)OCCOC3=O)C	{1: 3, 3: 1, 11: 6, 12: 2, 13: 2, 28: 2}
OK	71153-30-5	CC1(C=C1)C=C	{1: 1, 14: 2, 5: 1, 6: 1, 13: 1}
OK	71153-31-6	CC(=C)C1(C=C1)C	{1: 2, 13: 1, 5: 1, 14: 2, 7: 1}
OK	71153-32-7	C1CC2(C1)C=C2	{11: 3, 13: 1, 14: 2}
OK	71155-95-8	CCN(CC)C1=C(C(=O)C(=C(C1=O)C)C)C	{1: 5, 2: 2, 25: 2, 33: 1, 15: 4}
OK	71155-98-1	CCC(C)NC(=O)NC(C)CC	{24: 1, 1: 4, 2: 2, 3: 2, 31: 2}
OK	71156-07-5	C(CCCC(=O)O)CCCC(=O)O.C(CCCO)CCO.C(CCO)CO	{2: 17, 27: 2, 20: 4}
OK	71159-90-5	CC1=CCC(CC1)C(C)(C)S	{1: 3, 4: 1, 39: 1, 11: 3, 12: 1, 14: 1, 15: 1}
OK	7116-86-1	CC(C)(C)CCC=C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 1}
OK	71162-62-4	CN(C)C(=O)NCCCl	{1: 2, 2: 2, 33: 1, 17: 1, 24: 1, 31: 1}
OK	71172-48-0	C(COCCO)NC=O	{2: 4, 20: 1, 26: 1, 22: 1, 31: 1}
OK	71172-57-1	CCC(C(C)C)C(=O)C	{24: 1, 1: 4, 2: 1, 3: 2}
OK	71172-59-3	CCOC(=O)C1CCN(CC1)CC(=O)OC	{1: 2, 2: 2, 33: 1, 11: 4, 12: 1, 28: 2}
OK	71172-71-9	CCOC(=O)C(C#N)C1CC2CCC1C2	{1: 1, 2: 1, 3: 1, 37: 1, 11: 4, 12: 3, 28: 1}
OK	71172-75-3	CC(C)CCOC(=O)CCC(=O)C	{24: 1, 1: 3, 2: 4, 3: 1, 28: 1}
OK	71173-08-5	CC(C)(C)C1=CC(=O)[C@@](O1)(CC(=O)C(C)(C)C)O	{1: 6, 2: 1, 4: 2, 13: 1, 14: 1, 15: 1, 20: 1, 23: 1, 24: 1, 25: 1}
OK	71173-62-1	CC(=O)O.C(C[C@@H](C(=O)O)N)CN=C(N)N	{1: 1, 2: 3, 3: 1, 7: 1, 34: 1, 27: 2, 30: 3}
OK	71173-65-4	CC(C)C(C)CCCCl	{1: 3, 2: 3, 3: 2, 17: 1}
OK	71173-66-5	CC(C)CC(C)CCCl	{1: 3, 2: 3, 3: 2, 17: 1}
OK	71173-67-6	CC(=CCCC(=CCSC(=O)C)C)C	{1: 4, 2: 3, 6: 2, 7: 2, 40: 1, 24: 1}
OK	71173-77-8	C1C(=NNC1=O)C(=O)O	{32: 1, 35: 1, 11: 1, 15: 1, 25: 1, 27: 1}
OK	71185-86-9	CCCCCCCCCCCC/C=C/C=C/O	{1: 1, 2: 11, 20: 1, 6: 4}
OK	7119-27-9	CC(=O)/C=C/Cl	{24: 1, 1: 1, 6: 2, 17: 1}
OK	7119-89-3	C([N+](=O)[O-])(Cl)Cl	{17: 2, 3: 1, 38: 1}
OK	7119-91-7	CC(C)(N=O)Br	{1: 2, 18: 1, 34: 1, 4: 1, 29: 1}
OK	7119-92-8	CCN(CC)[N+](=O)[O-]	{1: 2, 2: 2, 38: 1, 33: 1}
OK	7119-94-0	C1CCN(CC1)[N+](=O)[O-]	{33: 1, 11: 5, 38: 1}
OK	712-25-4	C1CC2C3C4C1C5C2C(=O)C3C4C5=O	{25: 2, 11: 2, 12: 8}
OK	71200-79-8	C(=C(C#N)Cl)C#N	{17: 1, 37: 2, 6: 1, 7: 1}
OK	71215-76-4	C(COC(=O)Cl)OCCOC(=O)Cl.C(CS)S	{17: 2, 2: 6, 28: 2, 22: 1, 39: 2}
OK	71215-77-5	C(COC(=O)Cl)OC(=O)Cl.C(CS)S	{17: 2, 2: 4, 28: 2, 39: 2}
OK	71215-78-6	C(C(CO)(Br)Br)O.C(=O)(Cl)Cl	{2: 2, 4: 1, 17: 2, 18: 2, 20: 2, 24: 1}
OK	7123-92-4	C1CC2CC(=O)CC(C1)N2[O]	{25: 1, 11: 5, 12: 2, 29: 1, 33: 1}
OK	7124-86-9	C1CC2CCC(C1)C=C2	{11: 5, 12: 2, 14: 2}
OK	71242-69-8	CC12CCC(CC1O2)C(C)(C)O	{1: 3, 4: 1, 11: 3, 12: 2, 13: 1, 20: 1, 23: 1}
OK	71245-79-9	C1CCC2C(C(CC1)OO2)Br	{18: 1, 11: 5, 12: 3, 23: 2}
OK	7125-60-2	C1CCC2=C(CC1)CCC2	{11: 8, 15: 2}
OK	7125-83-9	C(C(C(F)(F)F)(Cl)Cl)Cl	{16: 3, 17: 3, 2: 1, 4: 2}
OK	7125-84-0	C(C(F)(F)F)C(Cl)(Cl)Cl	{16: 3, 17: 3, 2: 1, 4: 2}
OK	71251-30-4	CCCC(=O)O[C@@H]1[C@H](O[C@@H](C[C@]1(C)O)O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2N(C)C)OC(=O)C)O[C@@H]3[C@@H](C[C@@H]([C@@H](/C=C/C=C/C[C@@H](OC(=O)C[C@@H]([C@H]3OC)OC(=O)C)C)O)C)CC=O)C)C	{1: 11, 2: 3, 33: 1, 11: 4, 12: 15, 13: 1, 14: 4, 20: 2, 22: 3, 23: 2, 26: 1, 28: 4}
OK	7127-18-6	C(#N)N(F)F	{16: 2, 33: 1, 37: 1}
OK	71278-36-9	C(CCCO)CCO.C(CCC(=O)O)CC(=O)O.C(COCCO)O	{2: 14, 27: 2, 20: 4, 22: 1}
OK	7129-31-9	C1CC2C=CC=CC1N2	{32: 1, 11: 2, 12: 2, 14: 4}
OK	713-95-1	CCCCCCCC1CCCC(=O)O1	{1: 1, 2: 6, 11: 3, 12: 1, 28: 1}
OK	71302-52-8	CCCCCCCC/C=C\CCCCCCCC(=O)N(C)C.CCCCCCCC/C=C\CCCCCCCC(=O)N(C)C	{24: 2, 1: 6, 2: 28, 6: 4, 33: 2}
OK	71302-72-2	C1(C(C(C(O1)(F)F)(F)F)(F)F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F	{16: 15, 12: 1, 4: 4, 13: 3, 23: 1}
OK	71310-16-2	CC12C=CC(=O)C13N2CCS3	{1: 1, 33: 1, 41: 1, 11: 2, 13: 2, 14: 2, 25: 1}
OK	71317-61-8	CCC(C)CCCCC#CCCCCCCCl	{1: 2, 2: 11, 3: 1, 10: 2, 17: 1}
OK	71317-62-9	CCC#CCCCCCCCCCCl	{1: 1, 2: 10, 10: 2, 17: 1}
OK	71317-63-0	CCCCC#CCCCCCCCCl	{1: 1, 2: 10, 10: 2, 17: 1}
OK	71317-64-1	CCCCC#CCCCCCCCCCC(OC)OC	{1: 3, 2: 12, 3: 1, 10: 2, 22: 2}
OK	71317-65-2	C(CCCCl)CCC#CCCO	{17: 1, 2: 8, 20: 1, 10: 2}
OK	71317-66-3	CCCCC=CCCCCCCCCCCl	{1: 1, 2: 12, 6: 2, 17: 1}
OK	71317-67-4	CCC=CC=CCCCCCCCCCCl	{1: 1, 2: 10, 6: 4, 17: 1}
OK	71317-68-5	CCC#CC#CCCCCCCCCCCl	{1: 1, 2: 10, 10: 4, 17: 1}
OK	71317-69-6	CCCCCCCCC#CCCCCCCl	{1: 1, 2: 12, 10: 2, 17: 1}
OK	71317-70-9	CCCCCCC#CCCCCCCCCl	{1: 1, 2: 12, 10: 2, 17: 1}
OK	71317-71-0	C1CCOC(C1)OCCCCCCCCCCCl	{2: 10, 11: 4, 12: 1, 17: 1, 22: 1, 23: 1}
OK	71317-72-1	C#CCCCCCCCCCBr	{9: 1, 2: 9, 18: 1, 10: 1}
OK	71317-73-2	CCC=CC=CCCCCCCCCCC=O	{1: 1, 2: 10, 26: 1, 6: 4}
OK	71317-74-3	CCC=CCCCC(C)(OC)OC	{1: 4, 2: 4, 4: 1, 22: 2, 6: 2}
OK	71317-76-5	CCC#CCCCC(C)(OC)OC	{1: 4, 2: 4, 4: 1, 10: 2, 22: 2}
OK	7132-64-1	CCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 13, 28: 1}
OK	7133-36-0	CSC1CCCC1	{40: 1, 1: 1, 11: 4, 12: 1}
OK	7133-37-1	CSC1CCCCC1	{40: 1, 1: 1, 11: 5, 12: 1}
OK	7133-46-2	C1CCC(CC1)SC2CCCCC2	{40: 1, 11: 10, 12: 2}
OK	71348-43-1	CCOC(=O)C1(COC2(CCCCC2)OC1)C(=O)OCC	{1: 2, 2: 2, 11: 7, 13: 2, 23: 2, 28: 2}
OK	7138-40-1	CCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O	{1: 1, 2: 25, 27: 1}
OK	71383-07-8	CC(C)CCCC(C)CCOC(=O)C=C(C)C	{1: 5, 2: 5, 3: 2, 6: 1, 7: 1, 28: 1}
OK	71387-71-8	CCC1CC(=O)C(=C1C)O	{1: 2, 2: 1, 11: 1, 12: 1, 15: 2, 20: 1, 25: 1}
OK	71393-89-0	CCCCC=CCCCCCCCCCC(OC)OC	{1: 3, 2: 12, 3: 1, 22: 2, 6: 2}
OK	71393-90-3	CCCCCCC=CCCCCCCCC(OC)OC	{1: 3, 2: 12, 3: 1, 22: 2, 6: 2}
OK	71393-91-4	CCCCCCCCC=CCCCCCC(OC)OC	{1: 3, 2: 12, 3: 1, 22: 2, 6: 2}
OK	71393-92-5	CCCCC=CCCCCCCCCCC(OCC)OCC	{1: 3, 2: 14, 3: 1, 22: 2, 6: 2}
OK	71393-94-7	C#CCCCCCCCCC#CCCOC1CCCCO1	{2: 10, 9: 1, 10: 3, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71393-95-8	CCCCC=CCCCCCCCC(OCC)OCC	{1: 3, 2: 12, 3: 1, 22: 2, 6: 2}
OK	71393-96-9	CCCCC=CCCCCCCCC(OC)OC	{1: 3, 2: 10, 3: 1, 22: 2, 6: 2}
OK	71393-97-0	CCCCC#CCCCCCCCC(OC)OC	{1: 3, 2: 10, 3: 1, 10: 2, 22: 2}
OK	71393-98-1	CCCCC#CCCCCCCCC(OCC)OCC	{1: 3, 2: 12, 3: 1, 10: 2, 22: 2}
OK	71393-99-2	CCCCC#CCCCCCCCCC=CCCOC(=O)C	{1: 2, 2: 13, 28: 1, 10: 2, 6: 2}
OK	71394-01-9	CC=CCC#CCCCCCCCCOC(=O)C	{1: 2, 2: 9, 28: 1, 10: 2, 6: 2}
OK	71394-10-0	CCCCCCC(CCCCCCCCCCC(=O)O)O.CC(C)(C1CCC(CC1)O)C2CCC(CC2)O.C1C(O1)CCl	{1: 3, 2: 16, 3: 1, 4: 1, 11: 9, 12: 5, 17: 1, 20: 3, 23: 1, 27: 1}
OK	71394-30-4	CCCCCCCCCCCCCCCCCCN(C)C.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O	{1: 5, 2: 41, 27: 2, 6: 8, 33: 1}
OK	714-53-4	COC(=O)C12C3C1C4C2(C4C3)C(=O)OC	{1: 2, 11: 1, 12: 4, 13: 2, 28: 2}
OK	7140-63-8	C1=CC2C=CC(O2)C=C1	{12: 2, 14: 6, 23: 1}
OK	71412-32-3	CCCCCCCCCCCCCCCCCCN(C)C.CCCCCCCCCCCCCCCCCCN(C)C.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCCCC/C=C\C/C=C\CCCCCCCC(=O)O	{1: 8, 2: 58, 27: 2, 6: 8, 33: 2}
OK	71426-94-3	CCCCCCC(=O)OCC(CC)(COC(=O)CCCC)COC(=O)CCCCCC	{1: 4, 2: 17, 4: 1, 28: 3}
OK	71426-97-6	CCCCOC(=O)C=C.CCOCCOC(=O)C=C.C=C(Cl)Cl	{1: 2, 2: 6, 5: 3, 6: 2, 7: 1, 17: 2, 22: 1, 28: 2}
OK	7143-09-1	CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)O)C(=O)OC	{1: 2, 33: 1, 11: 3, 12: 4, 20: 1, 28: 1}
OK	7143-18-2	CCCCCCCCCCCC(=O)OC(C)(C)C	{1: 4, 2: 10, 4: 1, 28: 1}
OK	7144-05-0	C1CNCCC1CN	{32: 1, 2: 1, 11: 4, 12: 1, 30: 1}
OK	7144-08-3	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)Cl)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 17: 1, 28: 1}
OK	7145-20-2	CCCC(=C(C)C)C	{1: 4, 2: 2, 7: 2}
OK	7145-23-5	CC/C=C(\C)/C(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1}
OK	7145-35-9	CCOC(=O)CNC(=O)NCCCl	{1: 1, 2: 4, 17: 1, 24: 1, 28: 1, 31: 2}
OK	7146-60-3	CCCCCC(C)C(C)C	{1: 4, 2: 4, 3: 2}
OK	7146-82-9	CCCCCCCCCCCCCCCCCC(=O)CC(=O)OCC	{24: 1, 1: 2, 2: 18, 28: 1}
OK	71463-60-0	CC(C)CCCCCOC(=O)C=C.C=CN1CCCC1=O	{1: 2, 2: 5, 3: 1, 5: 2, 6: 2, 33: 1, 11: 3, 25: 1, 28: 1}
OK	71463-62-2	CCC1CN1C(=O)CC(C)CC(C)(C)C(=O)N2CC2CC	{1: 5, 2: 4, 3: 1, 4: 1, 33: 2, 11: 2, 12: 2, 24: 2}
OK	71463-68-8	C1CC(CCC1CO)CO.C1C(O1)CCl	{2: 3, 11: 5, 12: 3, 17: 1, 20: 2, 23: 1}
OK	7147-29-7	COC(=O)CCCCCCCCCCCCO	{1: 1, 2: 12, 20: 1, 28: 1}
OK	71477-76-4	CC1CC2(CCC1C(O2)CC=C)C	{1: 2, 2: 1, 5: 1, 6: 1, 11: 3, 12: 3, 13: 1, 23: 1}
OK	71477-77-5	C[C@@H]1CC(=CC[C@H]1[C@@H](CC=C)O)C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 1}
OK	71477-78-6	CCCC[C@H]([C@@H]1CCC(=C[C@H]1C)C)O	{1: 3, 2: 3, 3: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 1}
OK	71477-84-4	C(COCCOC(=O)N(CO)CO)O	{28: 1, 2: 6, 20: 3, 22: 1, 33: 1}
OK	7148-06-3	CN(C)CC(=O)OC	{1: 3, 2: 1, 28: 1, 33: 1}
OK	7148-07-4	C1CCN(C1)C2=CCCC2	{33: 1, 11: 7, 14: 1, 15: 1}
OK	7148-74-5	CC(C(=O)Cl)Br	{24: 1, 1: 1, 18: 1, 3: 1, 17: 1}
OK	71487-06-4	CC(C)CCCCCOC(=O)C=C.CC(=C)C(=O)OCC1CO1	{1: 3, 2: 6, 3: 1, 5: 2, 6: 1, 7: 1, 11: 1, 12: 1, 23: 1, 28: 2}
OK	71487-08-6	C1COCCN1CCC(=O)OCCOCCOCCOCCOC(=O)CCN2CCOCC2	{33: 2, 2: 12, 11: 8, 22: 3, 23: 2, 28: 2}
OK	71487-11-1	CCC=CCCCCCCCCCC(OCC)OCC	{1: 3, 2: 12, 3: 1, 22: 2, 6: 2}
OK	71487-12-2	C(CCCCl)CCC#CBr	{17: 1, 2: 6, 18: 1, 10: 2}
OK	71487-13-3	C(CCCCC#CBr)CCCCCl	{17: 1, 2: 9, 18: 1, 10: 2}
OK	71487-14-4	CCCCCCC#CCCCCCCCC(OCC)OCC	{1: 3, 2: 14, 3: 1, 10: 2, 22: 2}
OK	71487-15-5	CCCCCCC#CCCCCCCCC(OC)OC	{1: 3, 2: 12, 3: 1, 10: 2, 22: 2}
OK	71487-17-7	CCCCC=CCCCCCCCCl	{1: 1, 2: 10, 6: 2, 17: 1}
OK	7149-18-0	CCOC(=O)C1=C(CCC1)N	{1: 1, 2: 1, 11: 3, 15: 2, 28: 1, 30: 1}
OK	7149-65-7	CCOC(=O)[C@@H]1CCC(=O)N1	{32: 1, 1: 1, 2: 1, 11: 2, 12: 1, 25: 1, 28: 1}
OK	7150-72-3	CC(C)(C)OC(=O)NC=C	{1: 3, 4: 1, 5: 1, 6: 1, 28: 1, 31: 1}
OK	7150-75-6	CNC(=O)NCCC#N	{24: 1, 1: 1, 2: 2, 37: 1, 31: 2}
OK	71500-21-5	CC(CC(=O)OCC=C)CC(C)(C)C	{1: 4, 2: 3, 3: 1, 4: 1, 5: 1, 6: 1, 28: 1}
OK	71507-79-4	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CCC45[C@@]3(C[C@H](C(=O)[C@]4(O5)C)C#N)C	{1: 4, 37: 1, 11: 7, 12: 4, 13: 5, 20: 1, 23: 1, 25: 1}
OK	71512-38-4	CN1CCCC(=O)CCC1	{1: 1, 11: 6, 33: 1, 25: 1}
OK	71519-96-5	CCCCCCCCCCCCSC(C)(CCC(=O)O)SCCCCCCCCCCCC.C(CO)NCCO	{1: 3, 2: 28, 4: 1, 40: 2, 20: 2, 27: 1, 31: 1}
OK	7152-15-0	CCOC(=O)CC(=O)C(C)C	{24: 1, 1: 3, 2: 2, 3: 1, 28: 1}
OK	7152-32-1	CC(=O)C=CC1CCCCC1	{24: 1, 1: 1, 11: 5, 12: 1, 6: 2}
OK	7152-51-4	C[C@]12CCCC[C@@H]1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CCC4=O)C)O	{1: 2, 11: 9, 12: 5, 13: 2, 20: 1, 25: 1}
OK	71522-78-6	CC(C)(C)SCCSC(C)(C)C	{40: 2, 1: 6, 2: 2, 4: 2}
OK	7153-14-2	CCCC=C1CCCCC1=O	{1: 1, 2: 2, 6: 1, 11: 4, 15: 1, 25: 1}
OK	7154-73-6	C1CCN(C1)CCN	{33: 1, 2: 2, 11: 4, 30: 1}
OK	7154-75-8	CC(C)CC#C	{1: 2, 2: 1, 3: 1, 10: 1, 9: 1}
OK	7154-79-2	CCC(C)(C)C(C)(C)C	{1: 6, 2: 1, 4: 2}
OK	7154-80-5	CCC(C)CC(C)(C)CC	{1: 5, 2: 3, 3: 1, 4: 1}
OK	71547-63-2	CC(C)CC(=O)CC(C)(C=C)O	{1: 3, 2: 2, 3: 1, 4: 1, 5: 1, 6: 1, 20: 1, 24: 1}
OK	71549-83-2	CCCCCCCCCCC(=O)OCC(COC(=O)CCCCC(=O)O)OC(=O)CCCCCCCC	{27: 1, 1: 2, 2: 22, 3: 1, 28: 3}
OK	71549-96-7	CCCCCCCCCCC(=O)OCC(CO)(COCC(CO)(CO)COC(=O)CCCCCCCC)COC(=O)CCCCCC	{1: 3, 2: 29, 4: 2, 20: 3, 22: 1, 28: 3}
OK	71549-97-8	CCCCCCCCCCC(=O)OCC(CO)(COC[C@](CO)(COC(=O)CCCCCCCC)COC(=O)[C@H](CCCCCC)CCCCCCCC)COC(=O)CCCCCC	{1: 5, 2: 41, 3: 1, 4: 2, 20: 2, 22: 1, 28: 4}
OK	71549-98-9	CCCCCCCCCCC(=O)OCC(COC(=O)CCCCCC)(COC(=O)CCCCCCCC)COC(=O)[C@H](CCCCCC)CCCCCCCC	{1: 5, 2: 37, 3: 1, 4: 1, 28: 4}
OK	71550-32-8	CCCCCCCCCCCC(CCCCCCCCCCC)N(C)C	{1: 4, 2: 20, 3: 1, 33: 1}
OK	71550-59-9	CC(C)(COC(=O)C=CC(=O)O)COC(=O)C(C)(C)COC(=O)C=CC(=O)O	{1: 4, 2: 3, 4: 2, 6: 4, 27: 2, 28: 3}
OK	71550-60-2	CC(C)C1C(COC(=O)C=CC(=O)O1)(C)C	{1: 4, 3: 1, 11: 1, 12: 1, 13: 1, 14: 2, 28: 2}
OK	71550-61-3	CC1COC(=O)/C=C\C(=O)O1	{1: 1, 11: 1, 12: 1, 14: 2, 28: 2}
OK	71555-64-1	CC(C)(C)C1CCC(C=C1)OC	{1: 4, 4: 1, 11: 2, 12: 2, 14: 2, 22: 1}
OK	71563-31-0	CCC(OCCOC)OCCOC	{1: 3, 2: 5, 3: 1, 22: 4}
OK	71566-49-9	CCCCC(CC)COC(=O)CCCCCC(C)C	{1: 4, 2: 10, 3: 2, 28: 1}
OK	71566-57-9	CC/C=C/CCCCCCCCO[C@@H]1CCCCO1	{1: 1, 2: 9, 6: 2, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71566-58-0	C#CCCCCCCCC/C=C/CCO[C@@H]1CCCCO1	{2: 10, 6: 2, 9: 1, 10: 1, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71566-59-1	CCCCCCCCC=CCCCCCCl	{1: 1, 2: 12, 6: 2, 17: 1}
OK	71566-60-4	CCCCC#CCCCCCCCCCCl	{1: 1, 2: 12, 10: 2, 17: 1}
OK	71566-61-5	CCC#CCCCCCCCCCC(OC)OC	{1: 3, 2: 10, 3: 1, 10: 2, 22: 2}
OK	71566-62-6	CCCCCCC=CCCCCCCCCl	{1: 1, 2: 12, 6: 2, 17: 1}
OK	71566-63-7	CCC=CCCCCCCCCCC(OC)OC	{1: 3, 2: 10, 3: 1, 22: 2, 6: 2}
OK	71566-65-9	CCC(C)CCCCC#C	{1: 2, 2: 5, 3: 1, 10: 1, 9: 1}
OK	71566-66-0	CC[C@@H](C)CCCCC#CCCCCCCC(OC)OC	{1: 4, 2: 11, 3: 2, 10: 2, 22: 2}
OK	71566-67-1	CC[C@@H](C)CCCCC#CCCCCCCC(OCC)OCC	{1: 4, 2: 13, 3: 2, 10: 2, 22: 2}
OK	71566-68-2	CC[C@@H](C)CCCC/C=C/CCCCCCC(OC)OC	{1: 4, 2: 11, 3: 2, 22: 2, 6: 2}
OK	71566-69-3	CC[C@@H](C)CCCC/C=C/CCCCCCC(OCC)OCC	{1: 4, 2: 13, 3: 2, 22: 2, 6: 2}
OK	71566-70-6	C=C(CCC(=C)Br)Br	{2: 2, 18: 2, 5: 2, 7: 2}
OK	71566-71-7	C(CCCC[C@H](CCl)Cl)CCCCO	{17: 2, 2: 10, 3: 1, 20: 1}
OK	7158-25-0	C1C=CC2C1C3CC2C4C3C5CC4C=C5	{11: 3, 12: 8, 14: 4}
OK	71598-10-2	CCCN(/C(=N/N=O)/N)[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 33: 1, 7: 1, 34: 2, 29: 1, 30: 1}
OK	71598-29-3	CCC#CCCCCCCCCCC(OCC)OCC	{1: 3, 2: 12, 3: 1, 10: 2, 22: 2}
OK	71605-85-1	CCCCCCCCC(=O)OCCCCCCC	{1: 2, 2: 13, 28: 1}
OK	71606-02-5	CC1COC(=O)C=CC(=O)OCC(O1)C	{1: 2, 11: 2, 12: 2, 14: 2, 23: 1, 28: 2}
OK	71608-50-9	CCCCCCCCCCC1CO1.C(CNCCN)N.C(#N)N=C(N)N	{1: 1, 2: 13, 37: 1, 7: 1, 11: 1, 12: 1, 34: 1, 23: 1, 30: 4, 31: 1}
OK	71608-55-4	CCCCCCCCCCCCCCCCCC(=O)O.C1C(O1)CCl.C(CCC(=O)O)CC(=O)O.C(CNCCN)N	{1: 1, 2: 25, 11: 1, 12: 1, 17: 1, 23: 1, 27: 3, 30: 2, 31: 1}
OK	71608-56-5	CCCCCCCCC1CO1.C(CCC(=O)O)CC(=O)O.C(CNCCN)N	{1: 1, 2: 15, 11: 1, 12: 1, 23: 1, 27: 2, 30: 2, 31: 1}
OK	71608-71-4	CCCCCCCCCCCCCCOCC1CO1.CCCCCCCCCCCCOCC1CO1.C(CNCCNCCN)N	{1: 2, 2: 32, 11: 2, 12: 2, 22: 2, 23: 2, 30: 2, 31: 2}
OK	71608-72-5	CCCCCCCCCCCCCCOCC1CO1.CCCCCCCCCCCCOCC1CO1.C(CNCCN)N	{1: 2, 2: 30, 11: 2, 12: 2, 22: 2, 23: 2, 30: 2, 31: 1}
OK	71608-73-6	CCCCCCCCCCCCCCCCCC(=O)O.C(CCC(=O)O)CC(=O)O.C(CNCCN)N	{1: 1, 2: 24, 27: 3, 30: 2, 31: 1}
OK	7161-35-5	C1CC=CCC=C1	{11: 3, 14: 4}
OK	71630-98-3	CCCCC(=O)OCC[C@@H](CCO)CO	{1: 1, 2: 8, 3: 1, 20: 2, 28: 1}
OK	7164-08-1	C1CC2C=CC(C1)C=C2	{11: 3, 12: 2, 14: 4}
OK	71647-32-0	C=CC12CCC(CC1)N=N2	{35: 2, 5: 1, 6: 1, 11: 4, 12: 1, 13: 1}
OK	71648-41-4	COC(=O)CCC1(CCCCC1)[N+](=O)[O-]	{1: 1, 2: 2, 38: 1, 11: 5, 13: 1, 28: 1}
OK	71648-42-5	CCC(CC)C=CC(=O)C	{24: 1, 1: 3, 2: 2, 3: 1, 6: 2}
OK	71655-21-5	CCCC/C=C/CCCCCCCC/C=C/CCO[C@@H]1CCCCO1	{1: 1, 2: 13, 6: 4, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71655-36-2	COC(=O)CCCCCCCCCCCO	{1: 1, 2: 11, 20: 1, 28: 1}
OK	71662-45-8	CCC(COC(=O)/C=C\C(=O)O)(COC(=O)/C=C\C(=O)O)CO.C1CCOC(=O)CC1	{1: 1, 2: 4, 4: 1, 6: 4, 11: 5, 20: 1, 27: 2, 28: 3}
OK	71662-47-0	CCCCCCCCCC(=O)OCC(CO)(COCC(CO)(CO)CO)COC(=O)CCCCCCC	{1: 2, 2: 22, 4: 2, 20: 4, 22: 1, 28: 2}
OK	71662-48-1	CCCCCCC(=O)OCC(COCCC)(COCC(CO)(CO)CO)COC(=O)CCCCC	{1: 3, 2: 19, 4: 2, 20: 3, 22: 2, 28: 2}
OK	71662-49-2	CCCC[C@H](CCC)CC[C@@H](CCCC)COC(=O)CCCCC(=O)OCCC[C@@H](CCCC)[C@@H](CCC)CCCC	{1: 6, 2: 26, 3: 4, 28: 2}
OK	71662-51-6	CCCCCCCCCCCCCCCCCC(=O)OCC[C@@H](CCC)[C@H](CCC)CCCCCC	{1: 4, 2: 27, 3: 2, 28: 1}
OK	71662-52-7	CCCCCCCCCCCCCCCCCC(=O)OCC[C@@H]([C@@H](CC)CCCCC)[C@@H](CCC)CCC[C@H](CC)CCC	{1: 6, 2: 31, 3: 4, 28: 1}
OK	71662-59-4	CC(CN(CC(C)O)CC(C)O)O.CN(C)C/C=C/CN(C)C.C(/C=C/CCl)Cl	{1: 7, 2: 7, 3: 3, 6: 4, 33: 3, 17: 2, 20: 3}
OK	71662-61-8	CCCCCCCCCCCCCCCC[C@H](C)Cl	{1: 2, 2: 15, 3: 1, 17: 1}
OK	71662-62-9	CCCCCCCCCCCCCCCCCCCC[C@H](C)Cl	{1: 2, 2: 19, 3: 1, 17: 1}
OK	71662-63-0	CCCCCCCCCCCCCCCC[C@@H](C)N(C)C	{1: 4, 2: 15, 3: 1, 33: 1}
OK	71662-67-4	CCCCCCCCCCNCCNCCNC(=O)C=CC(=O)O	{1: 1, 2: 13, 6: 2, 24: 1, 27: 1, 31: 3}
OK	71671-89-1	C1=CC=C2C=CC=CC(=C1)C2F	{16: 1, 12: 1, 14: 8, 15: 2}
OK	71673-22-8	CCCCCCCCC=CCCCCCC(OCC)OCC	{1: 3, 2: 14, 3: 1, 22: 2, 6: 2}
OK	71673-23-9	CCC=CC=CCCCCCCCCCC(OCC)OCC	{1: 3, 2: 12, 3: 1, 22: 2, 6: 4}
OK	71673-24-0	CCCCCCC=CCCCCCl	{1: 1, 2: 9, 6: 2, 17: 1}
OK	71673-25-1	CCCCC#CCCCCCCCCC#CCCO[C@@H]1CCCCO1	{1: 1, 2: 13, 10: 4, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71673-26-2	CCCCC#CCCCCCCCCC#CCCOC(=O)C	{1: 2, 2: 13, 28: 1, 10: 4}
OK	71673-27-3	C=C(CC[C@@H](CBr)Br)Br	{18: 3, 2: 3, 3: 1, 5: 1, 7: 1}
OK	71673-28-4	CCCCC=CCCCCCl	{1: 1, 2: 7, 6: 2, 17: 1}
OK	71673-29-5	C1CCO[C@@H](C1)OCCC#CCCCCCCCl	{2: 8, 10: 2, 11: 4, 12: 1, 17: 1, 22: 1, 23: 1}
OK	71673-30-8	CCC#CC#CCCCCCCCl	{1: 1, 2: 7, 10: 4, 17: 1}
OK	71673-31-9	CCC#CC#CCCCCCCCCCC(OCC)OCC	{1: 3, 2: 12, 3: 1, 10: 4, 22: 2}
OK	71673-32-0	CCCCC#CCCCCCCCCC#C	{1: 1, 2: 11, 10: 3, 9: 1}
OK	71673-33-1	CCC#CC#CCCCCCCCCCCO[C@@H]1CCCCO1	{1: 1, 2: 11, 10: 4, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71677-48-0	CC1CN(CCC1=O)N=O	{1: 1, 34: 1, 33: 1, 11: 3, 12: 1, 25: 1, 29: 1}
OK	71685-56-8	CC/C=C/C=C/CCCCCCCCCCO[C@@H]1CCCCO1	{1: 1, 2: 11, 6: 4, 11: 4, 12: 1, 22: 1, 23: 1}
OK	71685-99-9	CCCCCC[C@H](CC=CCCCCCCCC(=O)OC(C)C)O	{1: 3, 2: 13, 3: 2, 6: 2, 20: 1, 28: 1}
OK	71686-26-5	CC(C)CCCCCCCOCCCN(CC(C)O)CC(C)O	{1: 4, 2: 12, 3: 3, 33: 1, 20: 2, 22: 1}
OK	71692-95-0	CCCCCCCCCCCCCCCCCC(=O)OCC(CO)(COCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC	{1: 5, 2: 88, 4: 2, 20: 1, 22: 1, 28: 5}
OK	717-69-1	COC(=O)C1C(C1C(=O)OC)C(=O)OC	{1: 3, 12: 3, 28: 3}
OK	71701-09-2	CCC=CC=CCCCCCCCl	{1: 1, 2: 7, 6: 4, 17: 1}
OK	71701-10-5	CCCCCCC=CCCCCCCCC(OCC)OCC	{1: 3, 2: 14, 3: 1, 22: 2, 6: 2}
OK	7173-67-3	CCCCCCCC/C=C/CCCCCCCCNCCCN.CC(=O)O.CC(=O)O	{1: 3, 2: 18, 6: 2, 27: 2, 30: 1, 31: 1}
OK	71735-32-5	C1=CN(C=N1)C(=O)C(C(F)(F)F)(F)F	{33: 1, 35: 1, 4: 2, 14: 3, 16: 5, 24: 1}
OK	71735-66-5	CC[C@@H](CO[C@@H](C)CO[C@@H](C)CO[C@@H](C)CO[C@@H](C)COC)O	{1: 6, 2: 6, 3: 5, 20: 1, 22: 5}
OK	71735-67-6	CC[C@@H](CO[C@@H](C)CO[C@@H](C)CO[C@@H](C)COC)O	{1: 5, 2: 5, 3: 4, 20: 1, 22: 4}
OK	71735-69-8	CC(=O)C[C@@](C)(C(=O)Cl)S	{1: 2, 2: 1, 4: 1, 39: 1, 17: 1, 24: 2}
OK	71735-72-3	CC1=CCC[C@](C1)(C)CCC=O	{1: 2, 2: 2, 11: 3, 13: 1, 14: 1, 15: 1, 26: 1}
OK	71735-73-4	CC(=CCC[C@@]1(CC[C@H](O1)O)C)C	{1: 3, 2: 2, 6: 1, 7: 1, 11: 2, 12: 1, 13: 1, 20: 1, 23: 1}
OK	71735-77-8	C[C@@H]/1C/C(=C/CC/C(=C/CC/C=C1)/C(=O)C)/C	{1: 3, 11: 5, 12: 1, 14: 4, 15: 2, 24: 1}
OK	71735-78-9	C/C=C/C(=O)/C/1=C\C[C@@H](/C=C/CC/C=C(/CC1)\C)C	{1: 3, 6: 2, 11: 5, 12: 1, 14: 4, 15: 2, 24: 1}
OK	71735-80-3	CC=CC(=O)C1=CCCC=C(CCC=CCC1)C	{1: 2, 6: 2, 11: 6, 14: 4, 15: 2, 24: 1}
OK	71735-81-4	CC1=CCCC=C(CCC=CCC1)C(=O)C	{24: 1, 1: 2, 11: 6, 14: 4, 15: 2}
OK	71735-82-5	C/C/1=C\CC/C=C(/[C@@H](C/C(=C/CC1)/C)C(=O)C)\C	{1: 4, 11: 5, 12: 1, 14: 3, 15: 3, 24: 1}
OK	71735-83-6	C/C/1=C\CC/C=C(/CC/C(=C(/CC1)\C)/C)\CO	{1: 3, 2: 1, 11: 6, 14: 2, 15: 4, 20: 1}
OK	71735-84-7	C/C=C/C(=O)[C@@H]\1C/C(=C/CC/C(=C/CC/C=C1\C)/C)/C	{1: 4, 6: 2, 11: 5, 12: 1, 14: 3, 15: 3, 24: 1}
OK	71735-85-8	C[C@@H]\1CCCCC/C(=C/[C@H](C/C=C1\C)C)/C#N	{1: 3, 37: 1, 11: 6, 12: 2, 14: 2, 15: 2}
OK	71735-86-9	C[C@@H]1C/C=C(/CC/C(=C/CCC[C@@H]1O)/C)\C	{1: 3, 11: 6, 12: 2, 14: 2, 15: 2, 20: 1}
OK	71735-87-0	C[C@@H]1CC/C(=C/CC/C=C(\CC[C@@H]1C)/C=O)/C	{1: 3, 11: 6, 12: 2, 14: 2, 15: 2, 26: 1}
OK	71742-94-4	C(CN(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{33: 1, 2: 3, 4: 2, 38: 7}
OK	7175-49-7	CCN(C1CCCCC1)C2CCCCC2	{1: 1, 2: 1, 11: 10, 12: 2, 33: 1}
OK	7175-81-7	C1C[C@H](OC1)CN	{2: 1, 11: 3, 12: 1, 30: 1, 23: 1}
OK	71750-72-6	CCCCCCCCCCC[C@H](CCC)Br	{1: 2, 2: 12, 3: 1, 18: 1}
OK	71751-41-2	CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C	{1: 10, 2: 1, 3: 1, 11: 6, 12: 17, 13: 2, 14: 7, 15: 3, 20: 3, 22: 4, 23: 5, 28: 1}
OK	71752-66-4	CCC(C)N(C(=O)N)N=O	{1: 2, 2: 1, 3: 1, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	71752-67-5	CCCCCCCCCCCN(C(=O)N)N=O	{1: 1, 2: 10, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	71752-68-6	CCCCCCCCCCCCCN(C(=O)N)N=O	{1: 1, 2: 12, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	71752-69-7	CC(CN(C(=O)N)N=O)O	{1: 1, 2: 1, 3: 1, 33: 1, 34: 1, 20: 1, 24: 1, 29: 1, 30: 1}
OK	71752-70-0	C(CN(C(=O)N)N=O)CO	{33: 1, 2: 3, 34: 1, 20: 1, 24: 1, 29: 1, 30: 1}
OK	71784-01-5	C(CSCCCl)CCl	{40: 1, 17: 2, 2: 5}
OK	71785-87-0	C1CN(CC2C1O2)N=O	{33: 1, 34: 1, 11: 3, 12: 2, 23: 1, 29: 1}
OK	7179-49-9	CCC[C@@H]1C[C@H](N(C1)C)C(=O)N[C@@H]([C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)SC)O)O)O)[C@@H](C)O.Cl	{1: 4, 2: 2, 3: 2, 33: 1, 40: 1, 11: 2, 12: 7, 17: 1, 20: 4, 23: 1, 24: 1, 31: 1}
OK	71799-77-4	CCOC(=O)C=C.CC(C)COCNC(=O)C=C.C=CC(=O)NCO	{1: 3, 2: 4, 3: 1, 5: 3, 6: 3, 20: 1, 22: 1, 24: 2, 28: 1, 31: 2}
OK	71805-64-6	CC1(C2C1CC2)C	{1: 2, 11: 2, 12: 2, 13: 1}
OK	71808-33-8	CCOCCCCCCCCCCCCCCN	{1: 1, 2: 15, 30: 1, 22: 1}
OK	71808-34-9	CCCCCCCCCCCCCCCCCCCCCN	{1: 1, 2: 20, 30: 1}
OK	71808-59-8	CC(C)C(OCCOC)OCCOC	{1: 4, 2: 4, 3: 2, 22: 4}
OK	71808-60-1	CC(=O)C(C)(OCCOC)OCCOC	{24: 1, 1: 4, 2: 4, 4: 1, 22: 4}
OK	71808-62-3	CC(C)CC(OCCOC)OCCOC	{1: 4, 2: 5, 3: 2, 22: 4}
OK	71808-63-4	CCCC(OCCOC)OCCOC	{1: 3, 2: 6, 3: 1, 22: 4}
OK	71808-71-4	CCCCOC(=O)C=C.CC(=O)OC=C.COC(=O)/C=C\C(=O)O	{1: 3, 2: 3, 5: 2, 6: 4, 27: 1, 28: 3}
OK	7182-08-3	C1CCC=C(CC1)N2CCOCC2	{23: 1, 33: 1, 11: 9, 14: 1, 15: 1}
OK	7182-09-4	C/C=C/N1CCCCC1	{1: 1, 11: 5, 6: 2, 33: 1}
OK	7182-10-7	CC/C=C/N1CCCCC1	{1: 1, 2: 1, 11: 5, 6: 2, 33: 1}
OK	7182-87-8	C([N+](=O)[O-])([N+](=O)[O-])F	{16: 1, 3: 1, 38: 2}
OK	71820-40-1	CCCCC[C@H]1CC(=O)[C@@H](O1)C	{1: 2, 2: 4, 11: 1, 12: 2, 23: 1, 25: 1}
OK	71820-42-3	CC1CC(CC(C1O)C)CCC(C)C	{1: 4, 2: 2, 3: 1, 11: 2, 12: 4, 20: 1}
OK	71820-43-4	C[C@@H]1CC(C[C@H](C1=O)C)CCC(C)C	{1: 4, 2: 2, 3: 1, 11: 2, 12: 3, 25: 1}
OK	71820-44-5	C[C@H]1CC(=O)C[C@@H](C1CC=C(C)C)C	{1: 4, 2: 1, 6: 1, 7: 1, 11: 2, 12: 3, 25: 1}
OK	71820-45-6	CC1=CC[C@H](C1(C)C)C/C=C\2/CCC[C@H]2O	{1: 3, 2: 1, 6: 1, 11: 4, 12: 2, 13: 1, 14: 1, 15: 2, 20: 1}
OK	71820-47-8	CCCC(=O)C1C(C=CCC1(C)C)C	{1: 4, 2: 2, 11: 1, 12: 2, 13: 1, 14: 2, 24: 1}
OK	71820-48-9	CC1=CCCC([C@H]1CS)(C)C	{1: 3, 2: 1, 39: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1}
OK	71820-50-3	C[C@H]1CC(=O)C=C[C@@H]1CC=C(C)C	{1: 3, 2: 1, 6: 1, 7: 1, 11: 1, 12: 2, 14: 2, 25: 1}
OK	71820-51-4	CC1CC(CC(C1)O)CC2CC=C(C2(C)C)C	{1: 4, 2: 1, 11: 4, 12: 4, 13: 1, 14: 1, 15: 1, 20: 1}
OK	71820-52-5	C[C@@H]1CC2(CCC(=C(C)C)C2)C[C@H](C1=O)C	{1: 4, 7: 1, 11: 5, 12: 2, 13: 1, 15: 1, 25: 1}
OK	71820-53-6	CC1CC(CC(C1CC=C(C)C)C)O	{1: 4, 2: 1, 6: 1, 7: 1, 11: 2, 12: 4, 20: 1}
OK	71820-54-7	CC1=C[C@@H](C[C@@H](C1)C[C@@H]2CC=C(C2(C)C)C)O	{1: 4, 2: 1, 11: 3, 12: 3, 13: 1, 14: 2, 15: 2, 20: 1}
OK	71820-55-8	CCCC(=O)[C@H]1[C@H]2C[C@@H](C1(C)C)C=C2	{1: 3, 2: 2, 11: 1, 12: 3, 13: 1, 14: 2, 24: 1}
OK	71820-56-9	CCCC(=O)OCC=C(C)C	{1: 3, 2: 3, 28: 1, 6: 1, 7: 1}
OK	71830-07-4	C1C[C@H](C[C@H]1C(=O)O)N	{27: 1, 11: 3, 12: 2, 30: 1}
OK	71830-08-5	C1C[C@@H](C[C@@H]1C(=O)O)N	{27: 1, 11: 3, 12: 2, 30: 1}
OK	71832-60-5	CCCCOC(=O)C=C.CCCCOC(=O)C(=C)C.C=CC(=O)OCCO	{1: 3, 2: 8, 5: 3, 6: 2, 7: 1, 20: 1, 28: 3}
OK	71832-66-1	C(#N)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F.C(=C(F)F)(OC(F)(F)F)F.C(=C(F)F)(F)F	{16: 23, 4: 6, 37: 1, 22: 3, 7: 6}
OK	71832-74-1	CCCCC=CCCCCCCCCC#CCCOC(=O)C	{1: 2, 2: 13, 28: 1, 10: 2, 6: 2}
OK	71832-78-5	CC1C=C(CCC1(C)C=O)C	{1: 3, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 26: 1}
OK	71839-40-2	CCCCCCCCC(=O)OCC(C)(C)[C@@H](C(C)C)O	{1: 5, 2: 8, 3: 2, 4: 1, 20: 1, 28: 1}
OK	71839-56-0	CC(CO)(CO)CO.C=CCOCC1CO1	{1: 1, 2: 5, 4: 1, 5: 1, 6: 1, 11: 1, 12: 1, 20: 3, 22: 1, 23: 1}
OK	71839-66-2	CCCCC(CC)COC(=O)C=C.CC(C)COC(=O)C(=C)C.C=CC(=O)OCCO	{1: 5, 2: 8, 3: 2, 5: 3, 6: 2, 7: 1, 20: 1, 28: 3}
OK	7184-60-3	CC1CC(CC(C(C(=CC=CCC(OC(=O)CC(C(C1)C)O)C2CCCC2C(=O)O)C#N)O)C)C	{1: 4, 37: 1, 11: 8, 12: 9, 14: 3, 15: 1, 20: 2, 27: 1, 28: 1}
OK	71850-03-8	COCCOC(=O)CCCCCCCCC(=O)OCCOC	{1: 2, 2: 12, 28: 2, 22: 2}
OK	71850-60-7	CC1CC(=CC(O1)C2C3CCC(C3)C2(C)C)C	{1: 4, 11: 4, 12: 5, 13: 1, 14: 1, 15: 1, 23: 1}
OK	71850-74-3	CCCCC(=O)OCC(C)(C)COC(=O)C(C)(C)COC(=O)CCCC	{1: 6, 2: 9, 4: 2, 28: 3}
OK	71850-76-5	COC(=O)CCSC(=O)Cl	{1: 1, 2: 2, 40: 1, 17: 1, 24: 1, 28: 1}
OK	71856-48-9	CN=[N+](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)[O-]	{1: 1, 2: 1, 33: 1, 12: 5, 34: 1, 20: 3, 22: 1, 23: 1, 27: 1, 29: 1}
OK	71871-56-2	C=C1C2C3CC4C1C5C2CC3C45	{11: 2, 12: 8, 5: 1, 15: 1}
OK	71899-35-9	CC1N(N(C(N(N1C)C)C)C)C	{1: 6, 12: 2, 33: 4}
OK	71899-42-8	CCCCCCCCCCCCC#CCCCC	{1: 2, 2: 14, 10: 2}
OK	719-22-2	CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C	{1: 6, 4: 2, 25: 2, 14: 2, 15: 2}
OK	71902-01-7	CC(C)CCCCCCCCCCCCCCC(=O)O.C([C@@H]([C@H]([C@@H](C(O)O)O)O)O)O	{27: 1, 1: 2, 2: 15, 3: 5, 20: 6}
OK	71932-97-3	CCC(CC)C#CC=O	{26: 1, 1: 2, 2: 2, 3: 1, 10: 2}
OK	71932-98-4	CCCC(=O)C#CC	{24: 1, 1: 2, 2: 2, 10: 2}
OK	71932-99-5	CC#CC(=O)C(C)(C)C	{24: 1, 1: 4, 10: 2, 4: 1}
OK	7194-84-5	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 35}
OK	7194-85-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 36}
OK	7194-86-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 37}
OK	7194-87-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 39}
OK	71963-77-4	C[C@@H]1CC[C@H]2[C@H]([C@H](O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)OC)C	{1: 4, 11: 4, 12: 6, 13: 2, 22: 1, 23: 4}
OK	71965-26-9	CC1CCCCC1(C2CC3CCC2(C3(C)C)C)O	{1: 4, 11: 7, 12: 3, 13: 3, 20: 1}
OK	72-18-4	CC(C)[C@@H](C(=O)O)N	{27: 1, 1: 2, 3: 2, 30: 1}
OK	72-19-5	C[C@H]([C@@H](C(=O)O)N)O	{27: 1, 1: 1, 3: 2, 20: 1, 30: 1}
OK	72-20-8	C1C2C3C(C1C4C2O4)C5(C(=C(C3(C5(Cl)Cl)Cl)Cl)Cl)Cl	{11: 1, 12: 6, 13: 3, 15: 2, 17: 6, 23: 1}
OK	72-23-1	CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4C(=O)CO)C	{1: 2, 2: 1, 11: 7, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 24: 1, 25: 2}
OK	72-63-9	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CCC4=CC(=O)C=C[C@]34C	{1: 3, 11: 6, 12: 3, 13: 3, 14: 3, 15: 1, 20: 1, 25: 1}
OK	7200-25-1	C(CC(C(=O)O)N)CN=C(N)N	{2: 3, 3: 1, 7: 1, 34: 1, 27: 1, 30: 3}
OK	72008-46-9	CC1=C(C(CCC1=O)(C)C)CCC(=O)C	{1: 4, 2: 2, 11: 2, 13: 1, 15: 2, 24: 1, 25: 1}
OK	72014-90-5	CC(C(=C)C)C(=C)C	{1: 3, 3: 1, 5: 2, 7: 2}
OK	72018-10-1	CC(CO)(CO)C(=O)O.C1CCC(=O)OCC1	{1: 1, 2: 2, 4: 1, 11: 5, 20: 2, 27: 1, 28: 1}
OK	72018-11-2	CC(C)C(C(C)(C)CO)O.C1CCC(=O)OCC1	{1: 4, 2: 1, 3: 2, 4: 1, 11: 5, 20: 2, 28: 1}
OK	72018-18-9	CCCCCCCCCCCCCCCCCC(=O)O.CC(CN(CCCN(C)C)CC(C)O)O	{1: 5, 2: 21, 3: 2, 33: 2, 20: 2, 27: 1}
OK	72018-19-0	CCCCCCCC/C=C\CCCCCCCC(=O)O.CC(CN(CCCN(C)C)CC(C)O)O	{1: 5, 2: 19, 3: 2, 6: 2, 33: 2, 20: 2, 27: 1}
OK	7202-43-9	C1C[C@@H](OC1)CN	{2: 1, 11: 3, 12: 1, 30: 1, 23: 1}
OK	72033-37-5	CC1CSC(CS1)C	{1: 2, 11: 2, 12: 2, 41: 2}
OK	7206-13-5	C/C=C/CCCCCCCCC	{1: 2, 2: 8, 6: 2}
OK	7206-19-1	CCCCCCCCCCCCCCC=CCC	{1: 2, 2: 14, 6: 2}
OK	7206-20-4	CCCCCCCCCCCCCC=CCCC	{1: 2, 2: 14, 6: 2}
OK	7206-22-6	CCCCCCCCCCCC=CCCCCC	{1: 2, 2: 14, 6: 2}
OK	7206-24-8	CCCCCCCCCC=CCCCCCCC	{1: 2, 2: 14, 6: 2}
OK	7206-26-0	C/C=C\CCCCCCCCC	{1: 2, 2: 8, 6: 2}
OK	7206-28-2	CCCCCCC=CCCCC	{1: 2, 2: 8, 6: 2}
OK	7206-29-3	CCCCC/C=C\CCCCC	{1: 2, 2: 8, 6: 2}
OK	7206-33-9	CCCCCCCCCCCCC=CCCCC	{1: 2, 2: 14, 6: 2}
OK	72064-79-0	CCCCC(=O)O[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)C(=O)COC(=O)C	{1: 4, 2: 4, 11: 5, 12: 4, 13: 3, 14: 3, 15: 1, 20: 1, 24: 1, 25: 1, 28: 2}
OK	72065-23-7	CN(CC(=O)OC)C(=O)C=C	{1: 2, 2: 1, 5: 1, 6: 1, 33: 1, 24: 1, 28: 1}
OK	72066-76-3	C[C@@H](CO[C@@H](C)COCCOCCOC(=O)[C@@H]1[C@@H]([C@]2(C(=C([C@@]1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)OC[C@H](C)O)O	{1: 3, 2: 7, 3: 3, 12: 2, 13: 3, 15: 2, 17: 6, 20: 2, 22: 3, 28: 2}
OK	72066-93-4	CC(C)CCCCCCOC(=O)CCCCCN	{1: 2, 2: 11, 3: 1, 28: 1, 30: 1}
OK	7207-49-0	CCCCCCC(=NO)C	{1: 2, 2: 5, 20: 1, 34: 1, 7: 1}
OK	7207-50-3	CCCCC/C(=N/O)/CC	{1: 2, 2: 5, 20: 1, 34: 1, 7: 1}
OK	7207-51-4	CCCCC(=NO)CCC	{1: 2, 2: 5, 20: 1, 34: 1, 7: 1}
OK	72076-41-6	CCCCN1C(CC(CC1(C)C)N)(C)C.CC1(CC(CC(N1)(C)C)NCCCCCCNC2CC(NC(C2)(C)C)(C)C)C.CC1(CC(CC(N1)(C)C)NCCCNC2CC(NC(C2)(C)C)(C)C)C	{32: 4, 1: 21, 2: 12, 33: 1, 11: 10, 12: 5, 13: 10, 30: 1, 31: 4}
OK	7208-92-6	C(CCl)OC(=O)C(=O)OCCCl	{17: 2, 2: 4, 28: 2}
OK	72088-85-8	CC(C)(C)OC(=O)C(=C)Cl	{1: 3, 4: 1, 5: 1, 7: 1, 17: 1, 28: 1}
OK	72088-90-5	CCCCOC(=O)C(=C)Cl.COC(=O)C(=C)Cl	{1: 2, 2: 3, 5: 2, 7: 2, 17: 2, 28: 2}
OK	72088-91-6	CCOC(=O)C(=C)Cl.CC(C)(C)OC(=O)C(=C)Cl	{1: 4, 2: 1, 4: 1, 5: 2, 7: 2, 17: 2, 28: 2}
OK	72089-00-0	CCCCOC(=O)C=C.C=CC(=O)O.C1CCC(C(C1)N)N	{1: 1, 2: 3, 5: 2, 6: 2, 11: 4, 12: 2, 27: 1, 28: 1, 30: 2}
OK	72089-02-2	CCCCOC(=O)C=C.CC1(CC(CC(C1)(C)CN)N)C.C=CC(=O)O	{1: 4, 2: 4, 5: 2, 6: 2, 11: 3, 12: 1, 13: 2, 27: 1, 28: 1, 30: 2}
OK	72089-03-3	CCCCOC(=O)C=C.C=CC(=O)O.C(CNCCNCCNCCN)N	{1: 1, 2: 11, 5: 2, 6: 2, 27: 1, 28: 1, 30: 2, 31: 3}
OK	72089-04-4	CCCCCCCCCC1=NCCN1CCOCCC(=O)O.C=CC(=O)O	{1: 1, 2: 12, 35: 1, 5: 1, 6: 1, 33: 1, 11: 2, 15: 1, 22: 1, 27: 2}
OK	72089-05-5	CCCCCCCC1=NCCN1CCOCCC(=O)O.C=CC(=O)O	{1: 1, 2: 10, 35: 1, 5: 1, 6: 1, 33: 1, 11: 2, 15: 1, 22: 1, 27: 2}
OK	72089-07-7	CC(=O)OC1(CCCC2C1C3CC2C=C3)C	{1: 2, 11: 4, 12: 4, 13: 1, 14: 2, 28: 1}
OK	7209-00-9	CCOC(=O)CCC(C(=O)OCC)Br	{1: 2, 2: 4, 3: 1, 28: 2, 18: 1}
OK	7209-38-3	C1CN(CCN1CCCN)CCCN	{33: 2, 2: 6, 11: 4, 30: 2}
OK	7210-64-2	CC1C=CC(=O)S1	{1: 1, 12: 1, 41: 1, 14: 2, 25: 1}
OK	72102-75-1	CCC=CC=CC(OCC)OCC	{1: 3, 2: 3, 3: 1, 22: 2, 6: 4}
OK	7212-40-0	CC(=C)[C@@H]1CC[C@@](C=C1)(C)O	{1: 2, 5: 1, 7: 1, 11: 2, 12: 1, 13: 1, 14: 2, 20: 1}
OK	7212-44-4	CC(=CCC/C(=C/CCC(C)(C=C)O)/C)C	{1: 4, 2: 4, 4: 1, 5: 1, 6: 3, 7: 2, 20: 1}
OK	7212-53-5	CCC(C)CCCCO	{1: 2, 2: 5, 3: 1, 20: 1}
OK	72120-50-4	CC1=CCCC(C=CC(CC1)C(C)C)(C)O	{1: 4, 3: 1, 11: 4, 12: 1, 13: 1, 14: 3, 15: 1, 20: 1}
OK	72121-84-7	C=C(CCC#C)Br	{2: 2, 5: 1, 7: 1, 9: 1, 10: 1, 18: 1}
OK	72121-89-2	CCCCCCCCCCCCCCCCCC(=O)NCCNCCNCCNC(=O)CCCCCCCCCCCCCCCCC.C1C(O1)CCl	{1: 2, 2: 39, 11: 1, 12: 1, 17: 1, 23: 1, 24: 2, 31: 4}
OK	72122-60-2	C1COCCN1NC(=O)N(CCCl)N=O	{33: 2, 2: 2, 11: 4, 34: 1, 17: 1, 23: 1, 24: 1, 29: 1, 31: 1}
OK	72138-75-1	CCCCCCCCCCCCCCCCCC(=O)O.CCCCNCCCCCCN.CCCCNCCCCCCNCCCC.C(CCCCCC(=O)O)CCCCC(=O)O	{1: 4, 2: 47, 27: 3, 30: 1, 31: 3}
OK	7214-50-8	CC1CC=CC(=O)C1	{1: 1, 11: 2, 12: 1, 14: 2, 25: 1}
OK	72152-74-0	CCC(C)(CC(OCC)OCC)OCC	{1: 5, 2: 5, 3: 1, 4: 1, 22: 3}
OK	72152-75-1	CCCCC/C=C/[C@@H](CC(OCC)OCC)OCC	{1: 4, 2: 8, 3: 2, 22: 3, 6: 2}
OK	72152-76-2	CCCC/C=C/[C@@H](CC(OCC)OCC)OCC	{1: 4, 2: 7, 3: 2, 22: 3, 6: 2}
OK	72152-77-3	CCCCCC/C=C/[C@@H](CC(OCC)OCC)OCC	{1: 4, 2: 9, 3: 2, 22: 3, 6: 2}
OK	72152-78-4	CC/C=C/C=C/[C@@H](CC(OCC)OCC)OCC	{1: 4, 2: 5, 3: 2, 22: 3, 6: 4}
OK	72152-79-5	CCC=CC(CC(OCC)OCC)OCC	{1: 4, 2: 5, 3: 2, 22: 3, 6: 2}
OK	72152-80-8	CC1=CCCC(C1CBr)(C)C	{1: 3, 2: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 18: 1}
OK	72152-83-1	CCCCC1CC(=O)CC2C1CCC2	{1: 1, 2: 3, 11: 5, 12: 3, 25: 1}
OK	72152-84-2	CC1=C(C(CC=C1)(C)C)C#N	{1: 3, 37: 1, 11: 1, 13: 1, 14: 2, 15: 2}
OK	72152-85-3	CCCCCCCCC[C@](C)(C#C)OC(=O)C	{1: 3, 2: 8, 4: 1, 9: 1, 10: 1, 28: 1}
OK	72152-95-5	CCCCOCCOC(=O)NC[C@]1(C[C@H](CC(C1)(C)C)N=C=O)C	{1: 4, 2: 6, 34: 1, 8: 1, 11: 3, 12: 1, 13: 2, 22: 1, 28: 1, 29: 1, 31: 1}
OK	7216-56-0	C/C=C(/C)\C=C\C=C(C)C	{1: 4, 6: 4, 7: 2}
OK	72162-35-7	CC(CO)(CO)C(=O)O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O	{1: 1, 2: 12, 27: 3, 4: 1, 20: 4}
OK	72162-43-7	CC(CCO)O.C(CCC(=O)O)CC(=O)O.C(COCCO)O	{1: 1, 2: 10, 3: 1, 20: 4, 22: 1, 27: 2}
OK	72162-46-0	CC(C)CCCCCCCOCCCNCCCN	{1: 2, 2: 13, 3: 1, 22: 1, 30: 1, 31: 1}
OK	72162-47-1	CC(C)CCCCCCCCOCCCNCCC#N	{1: 2, 2: 13, 3: 1, 37: 1, 22: 1, 31: 1}
OK	7217-83-6	CCCCCCCCCCCCCCCCC(C)C(=O)O	{27: 1, 1: 2, 2: 15, 3: 1}
OK	72175-26-9	CC1CO1.CC(C)CC(C)C1CO1	{1: 4, 2: 1, 3: 2, 11: 2, 12: 2, 23: 2}
OK	72175-30-5	COC(=O)CCCCC(=O)OC.COC(=O)CCCC(=O)OC.C(CNCCNCCNCCN)N	{1: 4, 2: 15, 28: 4, 30: 2, 31: 3}
OK	72175-31-6	COC(=O)CCCCC(=O)OC.COC(=O)CCCC(=O)OC.C(CNCCNCCN)N	{1: 4, 2: 13, 28: 4, 30: 2, 31: 2}
OK	72175-32-7	CCCCCCCCCCCCCCCCCC(=O)NCCNCCN.CC(=O)O	{1: 2, 2: 20, 24: 1, 27: 1, 30: 1, 31: 2}
OK	72175-39-4	CCO.COC1[C@@H]([C@H]([C@@H]([C@H](O1)CO)OCCCCCCCCCCCCCCCCCC(=O)O)O)O	{1: 2, 2: 19, 12: 5, 20: 4, 22: 2, 23: 1, 27: 1}
OK	72187-16-7	CCCCCCCCCCOCC1CO1.CCCCCCCCOCC1CO1.CCCCCCC1CO1.CC1CO1	{1: 4, 2: 23, 11: 4, 12: 4, 22: 2, 23: 4}
OK	72187-23-6	CCCCCCC1=CCC(C1=O)C(C(=O)OC)C(=O)OC	{1: 3, 2: 5, 3: 1, 11: 1, 12: 1, 14: 1, 15: 1, 25: 1, 28: 2}
OK	72187-24-7	CCCC[C@H]1CC(=O)C=C2[C@@H]1CCC2	{1: 1, 2: 3, 11: 4, 12: 2, 14: 1, 15: 1, 25: 1}
OK	72187-25-8	CCC(COC(C)COC(C)COC(C)COC(C)COC(C)COC)O	{1: 7, 2: 7, 3: 6, 20: 1, 22: 6}
OK	72187-26-9	C[C@@H](CO[C@@H](C)CO[C@H](C)CSC)O	{1: 4, 2: 3, 3: 3, 40: 1, 20: 1, 22: 2}
OK	72187-28-1	CCC(COC(C)COC(C)COC(C)COC(C)COC(C)COC(C)COC)O	{1: 8, 2: 8, 3: 7, 20: 1, 22: 7}
OK	72187-29-2	CC(COC(C)COC(C)COC(C)CSC)O	{1: 5, 2: 4, 3: 4, 40: 1, 20: 1, 22: 3}
OK	72187-30-5	CC(COC(C)COC(C)COC(C)COC(C)COC(C)CSC)O	{1: 7, 2: 6, 3: 6, 40: 1, 20: 1, 22: 5}
OK	72187-31-6	CC(COC(C)COC(C)COC(C)COC(C)CSC)O	{1: 6, 2: 5, 3: 5, 40: 1, 20: 1, 22: 4}
OK	72187-32-7	CC(COC(C)COC(C)COC(C)COC(C)COC(C)COC(C)CSC)O	{1: 8, 2: 7, 3: 7, 40: 1, 20: 1, 22: 6}
OK	72187-34-9	C[C@@H](CO[C@H](C)CSC)O	{1: 3, 2: 2, 3: 2, 40: 1, 20: 1, 22: 1}
OK	7220-26-0	CCC(C)C(CC)C(C)C	{1: 5, 2: 2, 3: 3}
OK	72207-67-1	CCCCCCCCCC(=O)OCC(COC(=O)CCCCC)OC(=O)CCCC	{1: 3, 2: 17, 3: 1, 28: 3}
OK	72214-32-5	CC(=CC(C=C(C)C)OC(=O)C)C	{1: 5, 3: 1, 28: 1, 6: 2, 7: 2}
OK	72214-40-5	CC1CCC2C(C2(C1)/C=C/C#N)(C)C	{1: 3, 37: 1, 6: 2, 11: 3, 12: 2, 13: 2}
OK	72214-41-6	C[C@H]1CC[C@@H](C[C@H]1/C=C/C#N)C(C)C	{1: 3, 3: 1, 37: 1, 6: 2, 11: 3, 12: 3}
OK	72221-03-5	CC(C)C1(CO1)C	{11: 1, 1: 3, 3: 1, 13: 1, 23: 1}
OK	7223-38-3	CN(C)CC#C	{1: 2, 2: 1, 33: 1, 10: 1, 9: 1}
OK	72230-58-1	CCCCCCCCCCCCCCCCCC(=O)OC.CC1CO1.C1CO1	{1: 3, 2: 16, 11: 3, 12: 1, 23: 2, 28: 1}
OK	72230-89-8	CCCCC1(CC(=O)OC1)CC	{1: 2, 2: 4, 11: 2, 28: 1, 13: 1}
OK	72230-90-1	CCCC[C@@H]1[C@H]2CC[C@@](O1)(C[C@@H]2C)C	{1: 3, 2: 3, 11: 3, 12: 3, 13: 1, 23: 1}
OK	72230-91-2	CC/C=C(\C)/[C@H]1C=C(CCO1)C	{1: 3, 2: 1, 6: 1, 7: 1, 11: 2, 12: 1, 14: 1, 15: 1, 23: 1}
OK	72230-96-7	CCCCCCCCC=CCCCCCCCC(=O)OCCSCCO	{1: 1, 2: 18, 6: 2, 40: 1, 20: 1, 28: 1}
OK	72231-01-7	C1CO1.C(CSCCO)O	{40: 1, 2: 4, 11: 2, 20: 2, 23: 1}
OK	72244-94-1	CC1CO1.CC(C)CCCCCCCCCCCCCCC(=O)O.C1CO1	{1: 3, 2: 14, 3: 1, 11: 3, 12: 1, 23: 2, 27: 1}
OK	72245-39-7	CCCCCC[C@H]1CC[C@@H](C[C@H]1C(=O)OC[C@@H](CC)CCCC)CCCCCCCC(=O)OC[C@@H](CC)CCCC	{1: 5, 2: 22, 3: 2, 11: 3, 12: 3, 28: 2}
OK	72245-40-0	CCCCCCCCCCCCOC(=O)CCCCCCC[C@H]1C[C@H]([C@@H](C=C1)CCCCCC)C(=O)OCCCCCCCCCCCC	{1: 3, 2: 34, 11: 1, 12: 3, 14: 2, 28: 2}
OK	72245-41-1	CCCCCCCCCCCCOC(=O)CCCCCCC[C@H]1CC[C@@H]([C@@H](C1)C(=O)OCCCCCCCCCCCC)CCCCCC	{1: 3, 2: 34, 11: 3, 12: 3, 28: 2}
OK	7225-66-3	CCCCCCC(CCCCCC)CCCCCC	{1: 3, 2: 15, 3: 1}
OK	7225-68-5	CCCCCCCCC(CCCC1CCCC1)CCCC2CCCC2	{11: 8, 1: 1, 2: 13, 3: 1, 12: 2}
OK	72252-41-6	C1CCOC1.C1CO1.C(CO)O	{2: 2, 11: 6, 20: 2, 23: 2}
OK	72252-46-1	CCOC(=O)CCC(=O)[C@H]1CC(=O)OC1	{1: 1, 2: 3, 11: 2, 12: 1, 24: 1, 28: 2}
OK	72252-47-2	C1C2(COC(O1)OC2)CO	{2: 1, 11: 3, 12: 1, 13: 1, 20: 1, 23: 3}
OK	72252-55-2	CCCCC(CC)COC(=O)C=C.CCCCOC(=O)C(=C)C.CC(=C)C(=O)O	{1: 5, 2: 8, 3: 1, 5: 3, 6: 1, 7: 2, 27: 1, 28: 2}
OK	72255-35-7	CCCCCC=CCC=CCC=CC=CC(CCCC(=O)O)O	{1: 1, 2: 9, 3: 1, 6: 8, 20: 1, 27: 1}
OK	72257-53-5	CC(=O)OC1CC2CCC1(OC2(C)C)C	{1: 4, 11: 3, 12: 2, 13: 2, 23: 1, 28: 1}
OK	72258-28-7	CCCCCC[C@@H]1C=C[C@H](C[C@@H]1C(=O)O)CCCCCCCC(=O)OC[C@@H](CC)CCCC	{1: 3, 2: 17, 3: 1, 11: 1, 12: 3, 14: 2, 27: 1, 28: 1}
OK	72258-29-8	CCCCCCCCCCCCOC(=O)[C@H]1C[C@@H](C=C[C@H]1CCCCCC)CCCCCCCC(=O)O	{1: 2, 2: 23, 11: 1, 12: 3, 14: 2, 27: 1, 28: 1}
OK	72259-73-5	CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.CC(C)(CO)CO.C(CCC(=O)O)CC(=O)O	{1: 5, 2: 7, 34: 2, 4: 1, 8: 2, 11: 3, 12: 1, 13: 2, 20: 2, 27: 2, 29: 2}
OK	7226-23-5	CN1CCCN(C1=O)C	{1: 2, 11: 3, 33: 2, 25: 1}
OK	72269-48-8	CCCCCCCCC=CCCCOC(=O)C	{1: 2, 2: 10, 28: 1, 6: 2}
OK	72269-51-3	CCCCCCCCCCCCCCCCCC(=O)OCCOCC	{1: 2, 2: 19, 28: 1, 22: 1}
OK	72269-52-4	CCCCC(CC)C(=O)OCCOCCOC(=O)C(CC)CCCC	{1: 4, 2: 12, 3: 2, 28: 2, 22: 1}
OK	72269-64-8	CC(=O)CC(=O)OCCOC[C@H](COCC=C)O	{1: 1, 2: 6, 3: 1, 5: 1, 6: 1, 20: 1, 22: 2, 24: 1, 28: 1}
OK	72269-65-9	CC(=O)[C@@H]1C[C@H](OC1=O)COCC=C	{1: 1, 2: 2, 5: 1, 6: 1, 11: 1, 12: 2, 22: 1, 24: 1, 28: 1}
OK	72275-79-7	CCCCCCCCCCOCC1CO1.CCCCCCCCOCC1(CO1)CCCCCC	{1: 3, 2: 23, 11: 2, 12: 1, 13: 1, 22: 2, 23: 2}
OK	72275-99-1	CC(C)CCCCCOC(=O)C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)OCCCCCC(C)C	{1: 4, 2: 10, 3: 2, 12: 2, 13: 3, 15: 2, 17: 6, 28: 2}
OK	72282-72-5	C1CCN2C3CCC(N2C1)CC3	{33: 2, 11: 8, 12: 2}
OK	72282-73-6	C1CC2CCC1N3N2CC=CC3	{33: 2, 11: 6, 12: 2, 14: 2}
OK	72282-74-7	C1CCN2C3CCC(C3)N2C1	{33: 2, 11: 7, 12: 2}
OK	72282-76-9	CCC1(CN2C3CCC(N2C1)C=C3)CC	{1: 2, 2: 2, 33: 2, 11: 4, 12: 2, 13: 1, 14: 2}
OK	72283-36-4	CCCCCCCC/C=C/CCCCCCCC(=O)OC.CC1CO1.C1CO1	{1: 3, 2: 14, 6: 2, 11: 3, 12: 1, 23: 2, 28: 1}
OK	72283-37-5	CCCCCCCCCCCC(=O)OCCCCCCCCCC.CC1CO1.C1CO1	{1: 3, 2: 19, 11: 3, 12: 1, 23: 2, 28: 1}
OK	7229-10-9	C1CCN(C1)N/N=C/2\C(=NN=N2)C(=O)N	{33: 1, 34: 1, 35: 3, 11: 4, 15: 2, 24: 1, 30: 1, 31: 1}
OK	7229-50-7	C[C@H]1[C@@H]2C=C[C@]3(CO3)[C@@](O2)(O[C@H]1[C@H](C)/C=C(\C)/C=C/C(=C/4\C(=O)[C@@H](N(C4=O)[C@@H]5CC[C@@H]([C@@H](O5)C)O)[C@H](C)C(=O)NC)/O)C	{1: 7, 3: 2, 33: 1, 6: 3, 7: 2, 11: 3, 12: 7, 13: 2, 14: 2, 15: 1, 20: 2, 23: 4, 24: 1, 25: 2, 31: 1}
OK	72299-02-6	CC1CC=CCC1C(=O)N2CCCCC2	{1: 1, 33: 1, 11: 7, 12: 2, 14: 2, 24: 1}
OK	723-78-4	C/C=C(/C)\C(=O)O[C@H]1CCN2[C@@H]1C(=CC2)CO	{1: 2, 2: 1, 33: 1, 6: 1, 7: 1, 11: 3, 12: 2, 14: 1, 15: 1, 20: 1, 28: 1}
OK	72302-11-5	CCCCCCCCCCCCCC1C(O1)C.C=CCl	{1: 2, 2: 12, 5: 1, 6: 1, 12: 2, 17: 1, 23: 1}
OK	72319-17-6	CN(C)CCCN(C)C.C1C(O1)CCl.Cl	{1: 4, 2: 4, 33: 2, 11: 1, 12: 1, 17: 2, 23: 1}
OK	72323-66-1	C#CC1(CC1)C#C	{9: 2, 10: 2, 11: 2, 13: 1}
OK	72333-08-5	CC(C)C=O.C1CN(CCN1)CCO	{32: 1, 1: 2, 2: 2, 3: 1, 33: 1, 11: 4, 20: 1, 26: 1}
OK	72333-10-9	C=CC=O.C(=N)(N)N.Cl	{36: 1, 5: 1, 6: 1, 7: 1, 17: 1, 26: 1, 30: 2}
OK	72333-11-0	CCC(C)(C)C[C@@H](C)CC=O	{1: 4, 2: 3, 3: 1, 4: 1, 26: 1}
OK	72333-12-1	CC/C=C(\C)/[C@H]1CC(=CCO1)C	{1: 3, 2: 1, 6: 1, 7: 1, 11: 2, 12: 1, 14: 1, 15: 1, 23: 1}
OK	72333-15-4	CC(=O)CC(=O)[C@@H](C(=O)N)N	{24: 3, 1: 1, 2: 1, 3: 1, 30: 2}
OK	72345-23-4	C[C@@H](C[C@H](C)O)O	{1: 2, 2: 1, 3: 2, 20: 2}
OK	72347-89-8	CCCCCCCCCCCCCCCCCC(=O)OC(CCOCCC(OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC	{1: 4, 2: 68, 3: 2, 28: 4, 22: 1}
OK	7235-40-7	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(CCCC2(C)C)C)\C)\C)/C)/C	{1: 10, 6: 14, 7: 4, 11: 6, 13: 2, 15: 4}
OK	72361-41-2	CC1C2CC(C2(C)C)CC1S	{1: 3, 11: 2, 12: 4, 13: 1, 39: 1}
OK	72379-15-8	CCCCCCCCCOC(=O)CCCC(=O)OCCCCCCCCC	{1: 2, 2: 19, 28: 2}
OK	7239-24-9	CC(C)CN(C)C	{1: 4, 2: 1, 3: 1, 33: 1}
OK	72403-52-2	CCC(CO)(COCC=C)COCC=C.CC1CO1	{1: 2, 2: 6, 4: 1, 5: 2, 6: 2, 11: 1, 12: 1, 20: 1, 22: 2, 23: 1}
OK	72403-68-0	CC(=CCCC1=CCC[C@@H](C1)CO)C	{1: 2, 2: 3, 6: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	72409-06-4	CCC(C)C(C)(OC)OC	{1: 5, 2: 1, 3: 1, 4: 1, 22: 2}
OK	72409-07-5	CC(C)(C)CC(C)(OC)OC	{1: 6, 2: 1, 4: 2, 22: 2}
OK	72429-04-0	CCCC[C@@H](CC(=O)OC)[C@@H]1CCCC1=O	{1: 2, 2: 4, 3: 1, 11: 3, 12: 1, 25: 1, 28: 1}
OK	72437-52-6	CCCCCSSCCCC	{40: 2, 1: 2, 2: 7}
OK	72437-53-7	CCCCSSC(C)C	{40: 2, 1: 3, 2: 3, 3: 1}
OK	72437-64-0	CCCCSSCCC	{40: 2, 1: 2, 2: 5}
OK	72437-68-4	CCCCCSSC	{40: 2, 1: 2, 2: 4}
OK	72443-11-9	CC1(C(=NC)C(N=N1)(C)C)C	{1: 5, 34: 1, 35: 2, 13: 2, 15: 1}
OK	72450-34-1	CC(=O)C(C)(C(=O)OC)O	{24: 1, 1: 3, 4: 1, 20: 1, 28: 1}
OK	7247-89-4	CC1CCCCN1N=O	{1: 1, 34: 1, 33: 1, 11: 4, 12: 1, 29: 1}
OK	72479-13-1	CCNC(=O)N(C)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 24: 1, 29: 1, 31: 1}
OK	72479-23-3	CCN(C(=O)NC)N=O	{1: 2, 2: 1, 33: 1, 34: 1, 24: 1, 29: 1, 31: 1}
OK	72479-98-2	CCCCCCCCCC(=O)OC[C@@H](COC[C@@H](COC[C@@H](COC[C@@H](COC[C@@H](COC[C@@H](COC[C@@H](COC[C@@H](COC[C@@H](COC[C@@H](CO)O)O)O)O)O)O)OC(=O)CCCCCCC)O)O)O	{1: 2, 2: 34, 3: 10, 20: 10, 22: 9, 28: 2}
OK	7249-87-8	CCCNCCC#N	{1: 1, 2: 4, 37: 1, 31: 1}
OK	7250-48-8	C(C(COC(=O)CCl)O)OC(=O)CCl	{17: 2, 2: 4, 3: 1, 20: 1, 28: 2}
OK	7250-55-7	COC(=O)CC(CC(=O)OC)O	{1: 2, 2: 2, 3: 1, 20: 1, 28: 2}
OK	72505-63-6	CCC1N(CCS1)N=O	{1: 1, 2: 1, 33: 1, 41: 1, 11: 2, 12: 1, 34: 1, 29: 1}
OK	72505-65-8	CC(C)C1N(CCS1)N=O	{1: 2, 34: 1, 3: 1, 33: 1, 41: 1, 11: 2, 12: 1, 29: 1}
OK	72505-67-0	CC(C)CC1N(CCS1)N=O	{1: 2, 2: 1, 3: 1, 33: 1, 41: 1, 11: 2, 12: 1, 34: 1, 29: 1}
OK	7251-06-1	CCOC(=O)N1CCN(CC1)CCCCl	{1: 1, 2: 4, 33: 2, 11: 4, 17: 1, 28: 1}
OK	7251-90-3	CCCCOCCOC(=O)C=C	{1: 1, 2: 5, 5: 1, 6: 1, 22: 1, 28: 1}
OK	7252-83-7	COC(CBr)OC	{1: 2, 2: 1, 3: 1, 18: 1, 22: 2}
OK	72536-23-3	C1CC2C(C1OO2)Br	{18: 1, 11: 2, 12: 3, 23: 2}
OK	72569-84-7	C=C1CC(=C)C2CC1C=C2	{11: 2, 12: 2, 5: 2, 14: 2, 15: 2}
OK	72569-85-8	C=C1CCC(=C)C2CC1C=C2	{11: 3, 12: 2, 5: 2, 14: 2, 15: 2}
OK	72569-86-9	C=C1CCC(=C)C2CCC1C2	{11: 5, 12: 2, 5: 2, 15: 2}
OK	72590-52-4	C1CC2C=CC1C3C2C(=O)C3=O	{25: 2, 11: 2, 12: 4, 14: 2}
OK	72590-77-3	CCCC(=O)O[C@@]1(CC[C@@H]2[C@@]1(C[C@@H](C3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)C(=O)COC(=O)CC	{1: 4, 2: 4, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 1, 24: 1, 25: 1, 28: 2}
OK	72593-07-8	C1CC(=NN=C2CCC2)C1	{34: 2, 11: 6, 15: 2}
OK	72598-54-0	COC(=O)C1C2C=CC(C1C(=O)OC)C(C2C(=O)OC)C(=O)OC	{1: 4, 12: 6, 14: 2, 28: 4}
OK	72607-53-5	CC(=C)C(=O)NCCCN.Cl	{1: 1, 2: 3, 5: 1, 7: 1, 17: 1, 24: 1, 30: 1, 31: 1}
OK	7261-70-3	CCCCCCNCCN	{1: 1, 2: 7, 30: 1, 31: 1}
OK	72622-74-3	CC(C)(CNC(C)(C)CO)N	{1: 4, 2: 2, 4: 2, 20: 1, 30: 1, 31: 1}
OK	72623-70-2	CCCC(C(C(C(C(=O)Cl)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 4, 16: 8, 17: 1, 24: 1}
OK	72657-23-9	C[C@H](CO)C(=O)OC	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	7270-50-0	CC(=CCCC=C)C	{1: 2, 2: 2, 5: 1, 6: 2, 7: 1}
OK	72726-18-2	CCCCOC(=O)C(CCl)Cl	{1: 1, 2: 4, 3: 1, 28: 1, 17: 2}
OK	72727-55-0	CC(C)COC(=O)C1(CCC(=CC1)CCC=C(C)C)C	{1: 5, 2: 3, 3: 1, 6: 1, 7: 1, 11: 3, 13: 1, 14: 1, 15: 1, 28: 1}
OK	72727-56-1	CC(C)COC(=O)C1(CCC=C(C1)CCC=C(C)C)C	{1: 5, 2: 3, 3: 1, 6: 1, 7: 1, 11: 3, 13: 1, 14: 1, 15: 1, 28: 1}
OK	72727-57-2	CCCCCC(C(=O)OCC)C1(OCCO1)C	{1: 3, 2: 5, 3: 1, 11: 2, 13: 1, 23: 2, 28: 1}
OK	72727-60-7	CC(C(C)(C)CC1CCCCC1)O	{1: 3, 2: 1, 3: 1, 4: 1, 11: 5, 12: 1, 20: 1}
OK	72727-61-8	CC(COC1CCCCC1)OC(=O)C	{1: 2, 2: 1, 3: 1, 11: 5, 12: 1, 22: 1, 28: 1}
OK	72727-64-1	CCOC(C)(C)C1CCCCC1	{1: 3, 2: 1, 4: 1, 11: 5, 12: 1, 22: 1}
OK	72727-65-2	CC(C1CCC2CCCCC2C1)O	{11: 7, 1: 1, 3: 1, 12: 3, 20: 1}
OK	72727-66-3	CC(CC1CC2CCC1C2)C=NO	{1: 1, 2: 1, 3: 1, 6: 1, 11: 4, 12: 3, 34: 1, 20: 1}
OK	72727-67-4	CC(=CC1CC2CCC1C2)C(=O)C	{1: 2, 6: 1, 7: 1, 11: 4, 12: 3, 24: 1}
OK	72727-71-0	CCCCOC(=O)CC(C)(C=CC1C(=CCCC1(C)C)C)O	{1: 5, 2: 4, 4: 1, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1, 28: 1}
OK	7274-88-6	C(CCN)C[C@H](C(=O)O)N.Cl	{27: 1, 17: 1, 2: 4, 3: 1, 30: 2}
OK	727411-24-7	C1C=CC[C@H]([C@@H]1C(=O)N)N	{24: 1, 11: 2, 12: 2, 30: 2, 14: 2}
OK	72748-99-3	COC[C@H]1CCCN1N	{1: 1, 2: 1, 33: 1, 11: 3, 12: 1, 22: 1, 30: 1}
OK	72749-65-6	CCCCCCCCCCCCCCCCCCNC(=O)N(CO)CO	{1: 1, 2: 19, 33: 1, 20: 2, 24: 1, 31: 1}
OK	7275-43-6	C1=CC(=C2C=CC=C[N+]2=O)N(C=C1)[O-]	{33: 2, 29: 2, 14: 8, 15: 2}
OK	72764-21-7	C1CC2(CCC1C(C2)C#N)C(=O)O	{27: 1, 11: 5, 12: 2, 13: 1, 37: 1}
OK	72764-23-9	C1CC2(CCC1CC2C#N)C(=O)O	{27: 1, 11: 5, 12: 2, 13: 1, 37: 1}
OK	72765-50-5	C=C1CC(=C(C1=O)O)N2CCCCC2	{33: 1, 5: 1, 11: 6, 15: 3, 20: 1, 25: 1}
OK	72779-07-8	CC[C@@H](CCCC(=O)OC)CCC(=O)OC	{1: 3, 2: 6, 3: 1, 28: 2}
OK	72779-08-9	CC[C@@H](CC(=O)OC)[C@@H](CC)CC(=O)OC	{1: 4, 2: 4, 3: 2, 28: 2}
OK	7278-65-1	CCC(C)(CCCC(C)CCCC(C)C)O	{1: 5, 2: 7, 3: 2, 4: 1, 20: 1}
OK	72783-16-5	CCCCC(CC)COC(=O)C=C.CC(=C)C(=O)OC.CC(=C)C(=O)OCCN(C)C	{1: 7, 2: 7, 3: 1, 5: 3, 6: 1, 7: 2, 33: 1, 28: 3}
OK	72785-14-9	CC1CC=CCCCCCCCCCCC(=O)C1	{1: 1, 11: 12, 12: 1, 14: 2, 25: 1}
OK	72785-15-0	CC1CCCCCCCCCC(=O)OCCOC(=O)C1	{1: 1, 11: 12, 12: 1, 28: 2}
OK	72785-16-1	C1CCCC(=O)CCCCCCC=CCC1	{25: 1, 11: 12, 14: 2}
OK	72797-15-0	CCCCCCCCCCC[C@H]1CC(=O)C(=C1[N+](=O)[O-])O	{1: 1, 2: 10, 38: 1, 11: 1, 12: 1, 15: 2, 20: 1, 25: 1}
OK	72797-24-1	CC1CN1C(=O)CCCCCCCC(=O)N2CC2C	{1: 2, 2: 7, 33: 2, 11: 2, 12: 2, 24: 2}
OK	72797-25-2	CC(=O)NC.C1N(CN(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{1: 2, 38: 4, 33: 4, 11: 4, 24: 1, 31: 1}
OK	72804-49-0	C(=C(C(F)(F)F)F)(C(C(F)(F)F)(F)F)F	{16: 10, 4: 3, 7: 2}
OK	72812-40-9	CC1C=C(CCC1(C)CO)C	{1: 3, 2: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 20: 1}
OK	72812-41-0	CCCCCCCCCCCCCC(=O)OCCCCCC(C)C	{1: 3, 2: 17, 3: 1, 28: 1}
OK	72812-43-2	CCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OCC1CO1.CC(=O)OC=C	{1: 4, 2: 12, 5: 3, 6: 1, 7: 2, 11: 1, 12: 1, 23: 1, 28: 3}
OK	72828-12-7	CC(=O)OC=C.C=COC(=O)/C=C/C(=O)O	{1: 1, 27: 1, 28: 2, 5: 2, 6: 4}
OK	72828-50-3	CCCC[C@@H](CC)CCOC(=O)CCCCC(=O)OCCC(CCC)CCC	{1: 4, 2: 16, 3: 2, 28: 2}
OK	72828-54-7	CCCCCC[C@@H](CC)OC(=O)CCCC(=O)OC[C@H](CCC)CCCC	{1: 4, 2: 15, 3: 2, 28: 2}
OK	72828-80-9	CCCCC(=O)OCC(C(C(C(CCC)(F)F)(F)F)(F)F)(F)F	{16: 8, 1: 2, 2: 6, 4: 4, 28: 1}
OK	72829-16-4	CC(CO)(CO)COC(=O)C=CC(=O)OCC(C)(CO)CO	{1: 2, 2: 6, 4: 2, 6: 2, 20: 4, 28: 2}
OK	7283-68-3	CCCCCCCCCCCCCCCCCCOC(=O)C=CC(=O)OCCCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 28: 2, 6: 2}
OK	72845-35-3	CC/C(=C/CC[C@H](C)C=O)/C	{1: 3, 2: 3, 3: 1, 6: 1, 7: 1, 26: 1}
OK	72845-38-6	CCC(=O)OCCC(=CC)C	{1: 3, 2: 3, 28: 1, 6: 1, 7: 1}
OK	72845-40-0	C/C=C(\C)/COC(=O)/C(=C/C)/C	{1: 4, 2: 1, 28: 1, 6: 2, 7: 2}
OK	72845-44-4	C[C@@H]1CC(=CC(C1)(C)C)CC#N	{1: 3, 2: 1, 37: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1}
OK	72845-78-4	C[C@@H]1C=C(CC[C@H]1C(OC)OC)C	{1: 4, 3: 1, 11: 2, 12: 2, 14: 1, 15: 1, 22: 2}
OK	72845-79-5	CCC(=O)OCC(=O)C	{24: 1, 1: 2, 2: 2, 28: 1}
OK	72845-80-8	CCCC(=O)OC(C)(CC)CCC(C)CC	{1: 5, 2: 6, 3: 1, 4: 1, 28: 1}
OK	72845-82-0	CCCCCCOC(=O)C1CCCC1=O	{1: 1, 2: 5, 11: 3, 12: 1, 25: 1, 28: 1}
OK	72845-83-1	CC=CC=CC1OCC(CO1)(C)C	{1: 3, 6: 4, 11: 2, 12: 1, 13: 1, 23: 2}
OK	72845-84-2	CC1CC(C(=O)O1)CC(C)C	{1: 3, 2: 1, 3: 1, 11: 1, 12: 2, 28: 1}
OK	72845-95-5	C[C@H](CC(=O)OC1CCCCC1)C(=O)O	{1: 1, 2: 1, 3: 1, 11: 5, 12: 1, 27: 1, 28: 1}
OK	72845-96-6	CC=CC=CCOC(=O)CC(C)C	{1: 3, 2: 2, 3: 1, 28: 1, 6: 4}
OK	72854-42-3	CCCCCCCOCC(=O)CO	{24: 1, 1: 1, 2: 8, 20: 1, 22: 1}
OK	72866-42-3	CC(C)(C)C1=CC2=C(N=C(C2=C1)N(C)C)N(C)C	{1: 7, 35: 1, 4: 1, 33: 2, 14: 2, 15: 5}
OK	72867-23-3	COC(=O)CSCC=C	{1: 1, 2: 2, 5: 1, 6: 1, 40: 1, 28: 1}
OK	7289-37-4	CCCCCCCCCCCCOCC	{1: 2, 2: 12, 22: 1}
OK	7289-44-3	CCCCCCCCCCCSC	{40: 1, 1: 2, 2: 10}
OK	7289-45-4	CCCCCCCCCCCCCCSC	{40: 1, 1: 2, 2: 13}
OK	7289-51-2	CCCCCCCCCOC	{1: 2, 2: 8, 22: 1}
OK	7289-52-3	CCCCCCCCCCOC	{1: 2, 2: 9, 22: 1}
OK	7289-53-4	CCCCCCCCCCCOC	{1: 2, 2: 10, 22: 1}
OK	72894-10-1	CCCCCOCC(=O)OCC=CC	{1: 2, 2: 6, 28: 1, 22: 1, 6: 2}
OK	72901-31-6	CCCCCCCCC=CCCCCCCCCNC(=O)CCCCCCCC=CCCCCCCCC	{24: 1, 1: 2, 2: 29, 6: 4, 31: 1}
OK	72905-87-4	CCCCCCCCCCCCCOCC	{1: 2, 2: 13, 22: 1}
OK	72906-29-7	C(CNCCNC(=O)CC#N)NCCNC(=O)CC#N.Cl.Cl	{24: 2, 17: 2, 2: 8, 37: 2, 31: 4}
OK	72906-41-3	CCCCCCCC/C=C/CCCCCCCC(=O)N(C)CC(=O)O.C1CCC(CC1)N	{1: 2, 2: 15, 6: 2, 33: 1, 11: 5, 12: 1, 24: 1, 27: 1, 30: 1}
OK	72906-44-6	CCCCCCCCCCCCCCCCCCOC(=O)CCC(=O)OC(C)C	{1: 3, 2: 19, 3: 1, 28: 2}
OK	7291-30-7	CC(=O)/C=C(/C(F)(F)F)\O	{1: 1, 4: 1, 6: 1, 7: 1, 16: 3, 20: 1, 24: 1}
OK	7291-33-0	CN(C)C(=O)C(Cl)(Cl)Cl	{24: 1, 1: 2, 4: 1, 33: 1, 17: 3}
OK	72912-01-7	C1COCCOCCN(CCOCCOCCN1CC(=O)O)CC(=O)O	{27: 2, 33: 2, 2: 2, 11: 12, 23: 4}
OK	72918-28-6	C12=C(C(=C(C(=O)C1=C(C(=C(C2=O)Br)Br)N)Br)Br)N	{25: 2, 18: 4, 30: 2, 15: 8}
OK	72918-29-7	C1=C(C(=O)C2=C(C(=C(C(=O)C2=C1N)Br)Br)N)Br	{25: 2, 18: 3, 30: 2, 14: 1, 15: 7}
OK	72927-82-3	CC(=CCC=C(C)CC=CC(=O)CCC=C)C	{1: 3, 2: 4, 5: 1, 6: 5, 7: 2, 24: 1}
OK	72927-97-0	CC(C)(C=C1CC(CC=C1)C=O)O	{1: 2, 4: 1, 6: 1, 11: 2, 12: 1, 14: 2, 15: 1, 20: 1, 26: 1}
OK	72928-00-8	CC(CCC=C(C)CC(C)C=O)C=C	{1: 3, 2: 3, 3: 2, 5: 1, 6: 2, 7: 1, 26: 1}
OK	72928-01-9	CC1=CCC(CC1C(=C)C(C)C)C#N	{1: 3, 3: 1, 5: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 37: 1}
OK	72928-04-2	CCOC(C)OCCC(=C)C1CCC(=CC1)C	{1: 3, 2: 3, 3: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 22: 2}
OK	72928-05-3	CC(=C1CC2CCC1C2)CC#N	{1: 1, 2: 1, 37: 1, 7: 1, 11: 4, 12: 2, 15: 1}
OK	72928-06-4	C=C(CC#N)C1CC2CCC1C2	{2: 1, 37: 1, 7: 1, 11: 4, 12: 3, 5: 1}
OK	72928-07-5	CC(=CC#N)C1CC2CCC1C2	{1: 1, 37: 1, 6: 1, 7: 1, 11: 4, 12: 3}
OK	72928-15-5	C[C@H]1C[C@@H]([C@@H]([C@@H]2[C@@H]1CC=C2)C)OC(=O)C	{1: 3, 11: 2, 12: 5, 14: 2, 28: 1}
OK	72928-22-4	CC1=CCCC(C1C(=C)C(C)C)C#N	{1: 3, 3: 1, 5: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 37: 1}
OK	72928-23-5	CC1=CCC(CC1CC=C(C)C)C(=O)C	{1: 4, 2: 1, 6: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 24: 1}
OK	72928-24-6	CCC(=O)OCCCCCCCCCC=C	{1: 1, 2: 10, 28: 1, 5: 1, 6: 1}
OK	72928-25-7	CCC(C)C(=O)OCCC(=C)C1CCC(=CC1)C	{1: 3, 2: 3, 3: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 28: 1}
OK	72928-26-8	CCCCCC12C(C(C1CCC2=O)OCC)C	{1: 3, 2: 5, 11: 2, 12: 3, 13: 1, 22: 1, 25: 1}
OK	72928-27-9	CC(CCC=C(C)CCCO)C=C	{1: 2, 2: 5, 3: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	72928-28-0	CC1=CCC(CC1C(C)C=O)C(=C)C	{1: 3, 3: 1, 5: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 26: 1}
OK	72928-34-8	CCCC=CC(=O)OCCC(C)C	{1: 3, 2: 4, 3: 1, 28: 1, 6: 2}
OK	72928-37-1	CCCCCCCCC[C@@](C)(CC=C)C=O	{1: 2, 2: 9, 4: 1, 5: 1, 6: 1, 26: 1}
OK	72928-41-7	COCCCCCCCCC=C	{1: 1, 2: 8, 22: 1, 5: 1, 6: 1}
OK	72928-42-8	CC(COCC(COC(=O)C=C)O)OCC(COC(=O)C=C)O	{1: 1, 2: 5, 3: 3, 5: 2, 6: 2, 20: 2, 22: 2, 28: 2}
OK	72928-47-3	CCCC=C(CC)C=CC(=O)O	{1: 2, 2: 3, 27: 1, 6: 3, 7: 1}
OK	72928-96-2	C1CC(CCC1C(=O)O)C(=O)O.C(CCCCCN)CCCCCN.C(CCCN)CCN	{27: 2, 2: 17, 11: 4, 12: 2, 30: 4}
OK	72929-00-1	CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CC(=C)C(=O)OCCN(C)C.CC(=C)C(=O)OCCO	{1: 6, 2: 21, 5: 3, 7: 3, 20: 1, 33: 1, 28: 3}
OK	7293-34-7	CN\1C=CC=C/C1=C\[NH+]=O.[O-]Cl(=O)(=O)=O	{1: 1, 6: 1, 33: 1, 14: 4, 15: 1, 17: 1, 29: 5, 31: 1}
OK	72939-50-5	CC(=CC(=O)C(=O)C)C(=O)C	{24: 3, 1: 3, 6: 1, 7: 1}
OK	72939-53-8	CC(C)(C=C1C=CCCC1C=O)O	{1: 2, 4: 1, 6: 1, 11: 2, 12: 1, 14: 2, 15: 1, 20: 1, 26: 1}
OK	72939-68-5	CCCC(=O)OCCC(C)CC(C)(C)C	{1: 5, 2: 5, 3: 1, 4: 1, 28: 1}
OK	7294-05-5	CCC(C)(C(C)(C)C)O	{1: 5, 2: 1, 4: 2, 20: 1}
OK	7294-84-0	C1CNCCC1CCCC2CCNCC2.C(#N)S.C(#N)S	{32: 2, 2: 3, 37: 2, 39: 2, 11: 8, 12: 2}
OK	72968-62-8	CC/C(=N\O)/C.CCC(CO)(CO)CO.C(CCCN=C=O)CCN=C=O	{1: 3, 2: 11, 4: 1, 7: 1, 8: 2, 34: 3, 20: 4, 29: 2}
OK	72968-70-8	C(CCCCCN)CCCCCN.C(CCCCCC(=O)O)CCCCC(=O)O	{2: 21, 27: 2, 30: 2}
OK	7297-11-2	CCCCCOCC1CO1	{1: 1, 2: 5, 11: 1, 12: 1, 22: 1, 23: 1}
OK	7298-84-2	C[C@@H](C(=O)O)NC(=O)[C@H](CC(C)C)N	{1: 3, 2: 1, 3: 3, 24: 1, 27: 1, 30: 1, 31: 1}
OK	72983-68-7	CC1=CCC(CC1CC=O)C(=C)C	{1: 2, 2: 1, 5: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 26: 1}
OK	72985-54-7	C(C(OF)(OF)F)(C(F)(F)F)(F)F	{16: 8, 4: 3, 22: 2}
OK	72986-57-3	CCCCC(CC)COC(=O)C(=C)C.CC(=C)C(=O)OC.C=CC#N	{1: 5, 2: 5, 3: 1, 5: 3, 6: 1, 7: 2, 28: 2, 37: 1}
OK	72987-34-9	CCCCCCC=CC=CCCCCCCCCN	{1: 1, 2: 13, 30: 1, 6: 4}
OK	72987-41-8	CCCCCCCCCCCCCCCCCCOCC(CC(C(=O)O)C(CC(=O)O)(C(=O)O)O)O.C(CO)N(CCO)CCO	{1: 1, 2: 26, 3: 2, 4: 1, 33: 1, 20: 5, 22: 1, 27: 3}
OK	72987-58-7	CC(=C)C1CC2CCCC1O2	{1: 1, 5: 1, 7: 1, 11: 4, 12: 3, 23: 1}
OK	72987-60-1	CC1CC(CCC1O)C2CCCC2	{1: 1, 11: 7, 12: 4, 20: 1}
OK	72987-61-2	CC1CCCC(C1O)C2CCCC2	{1: 1, 11: 7, 12: 4, 20: 1}
OK	7299-55-0	CC#CC(=O)C	{24: 1, 1: 2, 10: 2}
OK	7299-91-4	CCCCOC(=O)/C=C/C	{1: 2, 2: 3, 28: 1, 6: 2}
OK	7299-98-1	CCCC(=O)OCC(COC(=O)CCC)(COC(=O)CCC)COC(=O)CCC	{1: 4, 2: 12, 4: 1, 28: 4}
OK	73-32-5	CC[C@H](C)[C@@H](C(=O)O)N	{27: 1, 1: 2, 2: 1, 3: 2, 30: 1}
OK	73-34-7	CC1C(C(C(C(O1)O)O)O)O	{1: 1, 12: 5, 20: 4, 23: 1}
OK	730-46-1	CCCCCCCCCCCCC1CCC(=O)O1	{1: 1, 2: 11, 11: 2, 12: 1, 28: 1}
OK	7300-03-0	CCC/C=C(/CC)\C.CCC/C=C(/CC)\C	{1: 6, 2: 6, 6: 2, 7: 2}
OK	7300-34-7	C(CCOCCCN)COCCCN	{2: 10, 30: 2, 22: 2}
OK	73003-75-5	CC(C)CCCC(=O)OCC=C(C)C	{1: 4, 2: 4, 3: 1, 6: 1, 7: 1, 28: 1}
OK	73003-76-6	CC=C(C)COC(=O)C(=CC)C	{1: 4, 2: 1, 28: 1, 6: 2, 7: 2}
OK	73003-77-7	CCOC(C)OCC=C(C)CCC=C(C)C	{1: 5, 2: 4, 3: 1, 6: 2, 7: 2, 22: 2}
OK	73003-78-8	CCC(COC(=O)CCN1CCCCCC1)(COC(=O)C=C)COC(=O)C=C	{1: 1, 2: 6, 4: 1, 5: 2, 6: 2, 33: 1, 11: 6, 28: 3}
OK	73003-80-2	C(=O)(C(C(=O)N)(Br)Br)N	{24: 2, 18: 2, 4: 1, 30: 2}
OK	73003-91-5	CCCC(=O)OC(C)(C)[C@@H]1CC[C@@H](C2=C(C1)[C@H](CC2)C)C	{1: 5, 2: 2, 4: 1, 11: 5, 12: 3, 15: 2, 28: 1}
OK	73018-31-2	CC1CO1.CC(C)CCCCCCCCCCCCCCCC1CO1	{1: 3, 2: 15, 3: 1, 11: 2, 12: 2, 23: 2}
OK	73018-32-3	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCC1CO1.CC1CO1	{1: 2, 2: 22, 11: 2, 12: 2, 23: 2, 28: 1}
OK	73018-33-4	CCCCCCCCCCCCCCC1CO1.CCCCCCCC(=O)O.CC1CO1	{1: 3, 2: 19, 11: 2, 12: 2, 23: 2, 27: 1}
OK	73019-11-1	CCCCCCCCC=CCCCCCCCC(=O)NCO	{1: 1, 2: 15, 6: 2, 20: 1, 24: 1, 31: 1}
OK	73019-13-3	CCCCCCCC/C=C/CCCCCCCC(=O)N(C)CC(=O)O.C(CO)N(CCO)CCO	{1: 2, 2: 21, 6: 2, 33: 2, 20: 3, 24: 1, 27: 1}
OK	73019-15-5	CCCCCCC(=O)OCC=C(C)CCC=C(C)C	{1: 4, 2: 8, 28: 1, 6: 2, 7: 2}
OK	73019-16-6	CCCCCC(=O)OCCC(C)CC(C)(C)C	{1: 5, 2: 7, 3: 1, 4: 1, 28: 1}
OK	73019-21-3	CC1=CCCC(C1CC=C(C)C)C(=O)C	{1: 4, 2: 1, 6: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 24: 1}
OK	73037-35-1	C1CC2CC1C3C2C(CC3)C#N	{11: 5, 12: 5, 37: 1}
OK	73045-26-8	C1=CC2C=CC1C2=C=C3C4C=CC3C=C4	{8: 1, 12: 4, 14: 8, 15: 2}
OK	73045-27-9	C1C2(C13C4C=CC3C=C4)C5C=CC2C=C5	{11: 1, 12: 4, 13: 2, 14: 8}
OK	73045-98-4	C1CC[C@@H]([C@@H](C1)C(=O)N)O	{24: 1, 20: 1, 11: 4, 12: 2, 30: 1}
OK	73046-16-9	CC(C)(C)C1=CC(=CC1)C(C)(C)C	{1: 6, 11: 1, 4: 2, 14: 2, 15: 2}
OK	73049-34-0	CCCCCCCCCCCCCCCCOCC	{1: 2, 2: 16, 22: 1}
OK	73049-40-8	CCCCCCCCCCCCCCCCCCCCCCCC[C@H]1CO1	{1: 1, 2: 23, 11: 1, 12: 1, 23: 1}
OK	73050-57-4	C(=C1C2C3C2C4C3C41)=C5C6C7C6C8C7C85	{8: 1, 12: 12, 15: 2}
OK	73050-58-5	C1C2(C13C4C5C4C6C5C36)C7C8C7C9C8C29	{11: 1, 12: 12, 13: 2}
OK	73059-87-7	CC(=CC(=O)C)S	{24: 1, 1: 2, 39: 1, 6: 1, 7: 1}
OK	7307-02-0	CCCC(=O)CC(=O)C	{24: 2, 1: 2, 2: 3}
OK	7307-03-1	CC(C)C(=O)CC(=O)C	{24: 2, 1: 3, 2: 1, 3: 1}
OK	7307-04-2	CC(=O)CC(=O)C(C)(C)C	{24: 2, 1: 4, 2: 1, 4: 1}
OK	7307-53-1	CCCCCCCCCCCCCCCCOC	{1: 2, 2: 15, 22: 1}
OK	7307-55-3	CCCCCCCCCCCN	{1: 1, 2: 10, 30: 1}
OK	7309-43-5	CCCCSC(C)C	{40: 1, 1: 3, 2: 3, 3: 1}
OK	7309-44-6	CCCCCCSCC	{40: 1, 1: 2, 2: 6}
OK	7309-84-4	C1(=O)C(OC(C(O1)(C(F)(F)F)F)(F)F)(C(F)(F)F)F	{16: 10, 28: 1, 4: 2, 13: 3, 23: 1}
OK	7310-92-1	CCSCC#C	{40: 1, 1: 1, 2: 2, 10: 1, 9: 1}
OK	7311-29-7	CCCCCCCCCCCCCCCC(=O)OO	{1: 1, 2: 14, 20: 1, 28: 1}
OK	7311-30-0	CCCCCCCCCCCCNC	{1: 2, 2: 11, 31: 1}
OK	73112-99-9	C[C@H](CCCC(C)C)[C@H]1C[C@@H]([C@H]2[C@]1(CC[C@H]3[C@H]2CC=C4[C@]3(CCCC4)C)C)OC(=O)CCCCl	{1: 5, 2: 6, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 17: 1, 28: 1}
OK	73117-10-9	CCC#CCN(CC)CC	{1: 3, 2: 4, 10: 2, 33: 1}
OK	73120-52-2	COCCCCCCCCCCCCOC	{1: 2, 2: 12, 22: 2}
OK	7314-85-4	C1C2CC3CC1CC(C2)C3Br	{18: 1, 11: 5, 12: 5}
OK	73170-89-5	CCCCCCCC/C=C\CCCCCCCCCCCC#N	{1: 1, 2: 18, 37: 1, 6: 2}
OK	73179-35-8	CCCCCCOCC(O)OC(C)COCC(C)OC(COCCCCCC)O	{1: 4, 2: 14, 3: 4, 20: 2, 22: 5}
OK	7318-00-5	CCOC(=O)C=C(C)N	{1: 2, 2: 1, 6: 1, 7: 1, 28: 1, 30: 1}
OK	73180-00-4	CCCCCC(C=CC=CCC=CCC=CCCCC(=O)O)O	{1: 1, 2: 9, 3: 1, 6: 8, 20: 1, 27: 1}
OK	7319-38-2	C=CCC=O	{2: 1, 26: 1, 5: 1, 6: 1}
OK	7320-37-8	CCCCCCCCCCCCCCC1CO1	{1: 1, 2: 13, 11: 1, 12: 1, 23: 1}
OK	7321-48-4	CCCC=C(CCC)Cl	{1: 2, 2: 4, 17: 1, 6: 1, 7: 1}
OK	7321-55-3	CC(C)(C#N)C#N	{1: 2, 4: 1, 37: 2}
OK	73210-25-0	CC1CCC(C(C1)O)(C)C	{1: 3, 11: 3, 12: 2, 13: 1, 20: 1}
OK	7322-47-6	CCCCCCCCC(=O)O.CCCCCCC(=O)O.CCCCC(=O)O.C(C(CO)(CO)CO)O	{1: 3, 2: 19, 27: 3, 4: 1, 20: 4}
OK	73239-98-2	CC1CN(CC(O1)(C)OC)N=O	{1: 3, 34: 1, 33: 1, 11: 2, 12: 1, 13: 1, 22: 1, 23: 1, 29: 1}
OK	73246-45-4	C[C@@H](C(=O)OC)Cl	{1: 2, 3: 1, 28: 1, 17: 1}
OK	7326-44-5	C1CCC(=CC1)N2CCC2	{33: 1, 11: 7, 14: 1, 15: 1}
OK	7326-46-7	CC1(CCCO1)O	{1: 1, 11: 3, 20: 1, 13: 1, 23: 1}
OK	73263-30-6	CCCC(C(CC)COC(=O)C)OC(=O)C.C(CCC(=O)O)CC(=O)O	{27: 2, 1: 4, 2: 8, 3: 2, 28: 2}
OK	7327-60-8	C(C#N)N(CC#N)CC#N	{33: 1, 2: 3, 37: 3}
OK	7328-07-6	CC1CC=CCC1(CO)CO	{1: 1, 2: 2, 11: 2, 12: 1, 13: 1, 14: 2, 20: 2}
OK	7328-17-8	CCOCCOCCOC(=O)C=C	{1: 1, 2: 5, 5: 1, 6: 1, 22: 2, 28: 1}
OK	7328-91-8	CC(C)(CN)CN	{1: 2, 2: 2, 4: 1, 30: 2}
OK	73286-70-1	CC(C)(C)OC(=O)N1CC=CC1	{1: 3, 4: 1, 33: 1, 11: 2, 14: 2, 28: 1}
OK	73287-35-1	CC(C)(C1CCC(CC1)O)C2CCC(CC2)OC(=O)CCCCC(=O)O.C(COCCO)O.C1(C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C(=O)O	{1: 2, 2: 8, 4: 1, 11: 8, 12: 6, 13: 3, 15: 2, 17: 6, 20: 3, 22: 1, 27: 3, 28: 1}
OK	73287-52-2	CCN(CC)CCC(=O)OCCOCCOC(=O)C=C	{1: 2, 2: 8, 5: 1, 6: 1, 33: 1, 22: 1, 28: 2}
OK	73296-86-3	CC(C)CCCCCCCCCCCCCCC(=O)O.C(C(COCC(CO)O)O)O	{1: 2, 2: 18, 3: 3, 20: 4, 22: 1, 27: 1}
OK	7330-31-6	CSSSSSC	{40: 5, 1: 2}
OK	7331-52-4	C1[C@@H](COC1=O)O	{20: 1, 11: 2, 12: 1, 28: 1}
OK	73311-40-7	C=CC=N	{36: 1, 5: 1, 6: 2}
OK	7332-93-6	CCCC(=O)C=O	{24: 1, 1: 1, 2: 2, 26: 1}
OK	73320-99-7	CCCN1C2CCCC1CCC2	{1: 1, 2: 2, 11: 6, 12: 2, 33: 1}
OK	73321-04-7	CON1C2CCCC1CCC2	{1: 1, 11: 6, 12: 2, 22: 1, 33: 1}
OK	73321-24-1	C1CC2C=CC1C3=CCC=C23	{11: 3, 12: 2, 14: 4, 15: 2}
OK	73321-28-5	C1CC2CC1C3=C2C4CCC3C4	{11: 6, 12: 4, 15: 2}
OK	73322-95-9	C1CC2CCCC(C1)N2Cl	{17: 1, 11: 6, 12: 2, 33: 1}
OK	73322-99-3	CC(C)N=NC(C)(C)CCC[C](C)C	{1: 6, 2: 3, 3: 1, 4: 1, 7: 1, 34: 2}
OK	7333-23-5	CC(C)C(=O)CC(=O)C(C)(C)C	{24: 2, 1: 5, 2: 1, 3: 1, 4: 1}
OK	7333-25-7	CCCCCC#CC#CCCCCCCCCC(=O)O	{1: 1, 2: 12, 27: 1, 10: 4}
OK	7333-84-8	CCCCCCCCC=CCCCCCCCCN.F	{16: 1, 1: 1, 2: 15, 30: 1, 6: 2}
OK	73346-74-4	CC1(O[C@@H]([C@H](O1)CO)CO)C	{1: 2, 2: 2, 12: 2, 13: 1, 20: 2, 23: 2}
OK	73347-75-8	C[C@H]1CC[C@]2(O1)CCCC(C2)(C)C	{1: 3, 11: 6, 12: 1, 13: 2, 23: 1}
OK	7335-01-5	CCCCCCN1CCCCC1	{1: 1, 2: 5, 11: 5, 33: 1}
OK	7335-02-6	CCCCCCCCN1CCCCC1	{1: 1, 2: 7, 11: 5, 33: 1}
OK	7335-04-8	C1CCN(CC1)C2CCCC2	{33: 1, 11: 9, 12: 1}
OK	7335-06-0	CCN1CCCC1	{1: 1, 2: 1, 11: 4, 33: 1}
OK	7335-65-1	CC(=O)O.NN	{1: 1, 27: 1, 30: 2}
OK	7336-27-8	CC(C)CCOC(=O)C(=C)C	{1: 3, 2: 2, 3: 1, 5: 1, 7: 1, 28: 1}
OK	73361-36-1	C[C@H]1C[C@@H]([C@@H]([C@@H]2[C@@H]1[C@]\3([C@@H](C=C2)/C(=C\C[C@@H](/C(=C/[C@@H]4[C@H](CC(=CC45C(=O)/C(=C3\O)/C(=O)O5)C=O)O)/C)O[C@H]6C[C@]([C@H]([C@H](O6)C)NC(=O)OC)(C)[N+](=O)[O-])/C)C)O[C@H]7C[C@H]([C@H]([C@@H](O7)C)OC(=O)C)O[C@H]8CC[C@H]([C@@H](O8)C)O[C@H]9C[C@H]([C@H]([C@@H](O9)C)O[C@H]1CC[C@H]([C@@H](O1)C)O)O)C	{1: 13, 38: 1, 11: 10, 12: 26, 13: 3, 14: 5, 15: 5, 20: 4, 22: 5, 23: 5, 25: 1, 26: 1, 28: 3, 31: 1}
OK	73365-02-3	CC(C)(C)OC(=O)N1CCC[C@@H]1C=O	{1: 3, 4: 1, 33: 1, 11: 3, 12: 1, 26: 1, 28: 1}
OK	7338-43-4	CCCCC(C1CCCCC1)O	{1: 1, 2: 3, 3: 1, 11: 5, 12: 1, 20: 1}
OK	73384-68-6	C1=C(C(=O)C2=C(C=C(C(=O)C2=C1N)Br)N)Br	{25: 2, 18: 2, 30: 2, 14: 2, 15: 6}
OK	7339-06-2	C[C@]12CC(=O)[C@H]3[C@H]([C@@H]1CCC2=O)CC[C@@H]4[C@@]3(C=CC(=O)C4)C	{1: 2, 11: 6, 12: 4, 13: 2, 14: 2, 25: 3}
OK	7339-53-9	CNN.Cl	{1: 1, 31: 1, 30: 1, 17: 1}
OK	73398-15-9	CCC(CC=C)C(=C)C	{1: 2, 2: 2, 3: 1, 5: 2, 6: 1, 7: 1}
OK	73398-85-3	CC1=CCCC(C1CCC(C)C=O)(C)C	{1: 4, 2: 2, 3: 1, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 26: 1}
OK	73398-98-8	CCCCCC=CC=CC(=C)C	{1: 2, 2: 4, 5: 1, 6: 4, 7: 1}
OK	73398-99-9	CCCCC=CC=CC=C(C)C	{1: 3, 2: 3, 6: 5, 7: 1}
OK	7341-17-5	CCCCC(CC)CS	{1: 2, 2: 5, 3: 1, 39: 1}
OK	7341-96-0	C#CC(=O)N	{24: 1, 9: 1, 10: 1, 30: 1}
OK	73411-12-8	C(N=O)(Cl)(Cl)Br	{17: 2, 18: 1, 34: 1, 4: 1, 29: 1}
OK	73411-13-9	C(N=O)(Cl)(Br)Br	{17: 1, 18: 2, 34: 1, 4: 1, 29: 1}
OK	7344-02-7	CCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@@H](C=CCCCCCCCCCCCCC)O	{1: 2, 2: 31, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	73448-66-5	CCCC(C)OC(=O)CBr	{1: 2, 2: 3, 3: 1, 28: 1, 18: 1}
OK	7345-49-5	C1(=O)C(OC(O1)(C(=O)F)C(F)(F)F)(C(F)(F)F)F	{4: 2, 13: 2, 16: 8, 23: 1, 24: 1, 28: 1}
OK	73454-79-2	CCCCNNC.Cl.Cl	{1: 2, 2: 3, 31: 2, 17: 2}
OK	7346-14-7	CCN(CCN(CC)N=O)N=O	{1: 2, 2: 4, 34: 2, 29: 2, 33: 2}
OK	7346-41-0	C1C2CC3CC1CC(C2)C3Cl	{17: 1, 11: 5, 12: 5}
OK	73487-24-8	CCCCN(C1CCC(=O)O1)N=O	{1: 1, 2: 3, 33: 1, 11: 2, 12: 1, 34: 1, 28: 1, 29: 1}
OK	73495-63-3	C1CC2C3CCCC3C(C(C2C1)N)O	{20: 1, 11: 6, 12: 6, 30: 1}
OK	73507-49-0	CC1=CCCC([C@H]1C/C(=C(\C)/C=O)/C)(C)C	{1: 5, 2: 1, 7: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 26: 1}
OK	7352-01-4	CCCCCSCCC(C)C	{40: 1, 1: 3, 2: 6, 3: 1}
OK	73545-13-8	CCCCCC[C@@H]1C(=O)[C@H](CC1(C(=O)OC)C(=O)OC)C(=O)OC	{1: 4, 2: 5, 11: 1, 12: 2, 13: 1, 25: 1, 28: 3}
OK	73545-19-4	CCCCCC=CCCC(OCC)OCC	{1: 3, 2: 8, 3: 1, 22: 2, 6: 2}
OK	73545-25-2	CCC(C)COC(=O)C=C.CC(=C)C(=O)OCC1CO1.C=CC(=O)O	{1: 3, 2: 3, 3: 1, 5: 3, 6: 2, 7: 1, 11: 1, 12: 1, 23: 1, 27: 1, 28: 2}
OK	73545-27-4	CCCCOC(=O)C=C.CC(=C)C(=O)OC.C=CC(=O)O.C1CN1	{32: 1, 1: 3, 2: 3, 5: 3, 6: 2, 7: 1, 11: 2, 27: 1, 28: 2}
OK	73548-72-8	CC=CCCC(C)C	{1: 3, 2: 2, 3: 1, 6: 2}
OK	7355-58-0	CC(=O)NCCCl	{24: 1, 1: 1, 2: 2, 31: 1, 17: 1}
OK	73551-02-7	C(N(C(F)F)C(F)(F)F)(F)F	{16: 7, 33: 1, 3: 2, 4: 1}
OK	73551-03-8	C(N(C(F)F)C(F)F)(F)F	{16: 6, 33: 1, 3: 3}
OK	7356-00-5	CC(CNCC(C)N)N	{1: 2, 2: 2, 3: 2, 30: 2, 31: 1}
OK	73563-15-2	C(N(C(F)(F)F)C(F)(F)F)(F)F	{16: 8, 33: 1, 3: 1, 4: 2}
OK	73569-74-1	C1CCN2COCCN2C1	{33: 2, 11: 7, 23: 1}
OK	7357-93-9	CCC(=C)C(C)C	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1}
OK	7358-46-5	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(CC=C)O)CCC4=CC(=O)CC[C@H]34	{1: 1, 2: 1, 5: 1, 6: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	73586-31-9	C1C2CC3CC1C45C3(C4)C5C2	{11: 5, 12: 4, 13: 2}
OK	7359-79-7	CC#C[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)O	{1: 2, 10: 2, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	7359-80-0	C[C@H](C=C)[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)O	{1: 2, 3: 1, 5: 1, 6: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	73597-26-9	CC(=C)C(=O)OCCOC(=O)NCC1(CC(CC(C1)(C)C)N=C=O)C	{1: 4, 2: 3, 34: 1, 5: 1, 7: 1, 8: 1, 11: 3, 12: 1, 13: 2, 28: 2, 29: 1, 31: 1}
OK	73599-90-3	C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)CO	{2: 1, 11: 6, 12: 2, 13: 2, 17: 1, 20: 1, 24: 1}
OK	73599-91-4	C1C2CC3(CC1CC(C2)(C3)Br)C(=O)CO	{2: 1, 11: 6, 12: 2, 13: 2, 18: 1, 20: 1, 24: 1}
OK	73599-92-5	C1C2CC3(CC1CC(C2)(C3)I)C(=O)CO	{2: 1, 11: 6, 12: 2, 13: 2, 19: 1, 20: 1, 24: 1}
OK	73599-94-7	CCOCC(=O)C12CC3CC(C1)CC(C3)(C2)Cl	{1: 1, 2: 2, 11: 6, 12: 2, 13: 2, 17: 1, 22: 1, 24: 1}
OK	73599-95-8	CCOCC(=O)C12CC3CC(C1)CC(C3)(C2)Br	{1: 1, 2: 2, 11: 6, 12: 2, 13: 2, 18: 1, 22: 1, 24: 1}
OK	73602-61-6	CCN(CC)CC.F.F.F	{16: 3, 1: 3, 2: 3, 33: 1}
OK	7361-43-5	C([C@@H](C(=O)O)NC(=O)CN)O	{2: 2, 3: 1, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	73612-26-7	CC[N+]1=C(CCC1)C.[I-]	{1: 2, 2: 1, 33: 1, 11: 3, 15: 1, 19: 1}
OK	7362-81-4	CCCCC1(CCCCC1)C(=O)OC	{1: 2, 2: 3, 11: 5, 28: 1, 13: 1}
OK	73622-68-1	CC(C)CCC(C)NC(=O)CC(=O)C	{24: 2, 1: 4, 2: 3, 3: 2, 31: 1}
OK	73642-91-8	CCCCCCCC(CBr)Br	{1: 1, 2: 7, 3: 1, 18: 2}
OK	73665-15-3	CC[C@@H]1[C@H](C2C(O2)/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H](/C=C/C(=O)O1)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)C)C)CO[C@H]4[C@@H]([C@@H]([C@@H]([C@H](O4)C)O)OC)OC	{1: 10, 2: 2, 33: 1, 11: 2, 12: 17, 14: 4, 20: 2, 22: 4, 23: 3, 25: 1, 28: 1}
OK	7367-38-6	CCCCC(=CCCC)CCCC	{1: 3, 2: 8, 6: 1, 7: 1}
OK	7367-78-4	CCCCOC(=O)/C=C/C=C/C	{1: 2, 2: 3, 28: 1, 6: 4}
OK	7367-81-9	CCCCC/C=C/C(=O)OC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	7367-82-0	CCCCC/C=C/C(=O)OCC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	73671-86-0	CCN(CC)C(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)N4C)C)C	{1: 5, 2: 2, 33: 2, 11: 8, 12: 5, 13: 2, 24: 1, 25: 1}
OK	73676-23-0	CCN1CCCCCCC1	{1: 1, 2: 1, 11: 7, 33: 1}
OK	73684-69-2	CC[C@@H]1[C@]([C@@H]2[C@H](O2)/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H](/C=C/C(=O)O1)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)C)C)(CO[C@H]4[C@@H]([C@@H]([C@@H]([C@H](O4)C)O)OC)OC)O	{1: 10, 2: 2, 33: 1, 11: 2, 12: 16, 13: 1, 14: 4, 20: 3, 22: 4, 23: 3, 25: 1, 28: 1}
OK	73692-67-8	CCCCCCCCCCCCCCCCCCN(C)C.CCCCCCCCCCCCCC(=O)O	{1: 4, 2: 29, 27: 1, 33: 1}
OK	73692-68-9	CCCCCCCCCCCCCCCCCCN(C)C.CCCCCCCCCCCCCCCC(=O)O	{1: 4, 2: 31, 27: 1, 33: 1}
OK	73696-62-5	CN1CCSC1=NC(=O)CN	{1: 1, 2: 1, 33: 1, 41: 1, 11: 2, 34: 1, 15: 1, 24: 1, 30: 1}
OK	73696-64-7	CN\1CCS/C1=N/C(=O)/N=C\2/N(CCS2)C	{1: 2, 34: 2, 33: 2, 41: 2, 11: 4, 15: 2, 24: 1}
OK	73696-65-8	CCNC(=O)N=C1N(CCS1)C	{1: 2, 2: 1, 33: 1, 41: 1, 11: 2, 34: 1, 15: 1, 24: 1, 31: 1}
OK	7370-44-7	CCCCCCCCCCCC1CCCC(=O)O1	{1: 1, 2: 10, 11: 3, 12: 1, 28: 1}
OK	7371-67-7	COC(=O)[C@@H]1CC[C@H]1C(=O)OC	{1: 2, 11: 2, 12: 2, 28: 2}
OK	7371-86-0	CC(CC(C)OC(=O)C)OC(=O)C	{1: 4, 2: 1, 3: 2, 28: 2}
OK	7371-98-4	CCCCCCCCCCCCCCCCC(C)CCCCCCCCCCCC	{1: 3, 2: 26, 3: 1}
OK	7371-99-5	CCCCCCCCCCCCCCCCCCC(C)CCCCCCCCCC	{1: 3, 2: 26, 3: 1}
OK	7373-13-9	CCCCCCCCCCCCCCCCC(=O)C	{24: 1, 1: 2, 2: 15}
OK	7375-15-7	CN(C)CCCN1CCCC1=O	{1: 2, 2: 3, 11: 3, 33: 2, 25: 1}
OK	73758-54-0	CCC(C)(C(=O)O)Cl	{1: 2, 2: 1, 27: 1, 4: 1, 17: 1}
OK	73772-39-1	CCC(CCC(C)C)Cl	{1: 3, 2: 3, 3: 2, 17: 1}
OK	73772-40-4	CCCCCCCCCC(=O)NCCCN	{24: 1, 1: 1, 2: 11, 30: 1, 31: 1}
OK	73772-41-5	CCCCCCCC(=O)NCCCN	{24: 1, 1: 1, 2: 9, 30: 1, 31: 1}
OK	73772-42-6	CCCCCCCCCCCC(=O)NCCNCC(=O)O	{24: 1, 1: 1, 2: 13, 27: 1, 31: 2}
OK	73772-47-1	CCCCCCCCCCCC(=O)NCCNCCNCCNCCN	{24: 1, 1: 1, 2: 18, 30: 1, 31: 4}
OK	73772-48-2	CCCCCCCCCCCC(=O)N(CCN)CCN	{24: 1, 1: 1, 2: 14, 30: 2, 33: 1}
OK	7378-99-6	CCCCCCCCN(C)C	{1: 3, 2: 7, 33: 1}
OK	7379-12-6	CCCC(=O)C(C)C	{24: 1, 1: 3, 2: 2, 3: 1}
OK	7379-30-8	CC(SC)SC	{40: 2, 1: 3, 3: 1}
OK	73790-84-8	CC(C)C(=O)C(C)(C)C(=O)N1CCCCC1	{1: 4, 3: 1, 4: 1, 33: 1, 11: 5, 24: 2}
OK	73791-58-9	CCCCCCCCCCCCCC(=O)N(CCN)CCN	{24: 1, 1: 1, 2: 16, 30: 2, 33: 1}
OK	73791-65-8	CCCCCCCCC=CCCCCCCCC(=O)NCCNCCN(CCC(=O)O)CCNCCNC(=O)CCCCCCCC=CCCCCCCC	{1: 2, 2: 37, 6: 4, 33: 1, 24: 2, 27: 1, 31: 4}
OK	73813-61-3	CC(=O)CN(CC=C)CC=C	{1: 1, 2: 3, 5: 2, 6: 2, 33: 1, 24: 1}
OK	7382-32-3	CCCCOCCOCCOC	{1: 2, 2: 7, 22: 3}
OK	73825-59-9	C[C@H]1C[C@@H]2[C@H]([C@H](C3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5[C@@H]([C@@H]4[C@H]3C)O)C)O)C)NC1	{32: 1, 1: 4, 11: 8, 12: 11, 13: 2, 14: 1, 15: 1, 20: 2, 23: 1}
OK	7383-19-9	CCCCC(C#C)O	{1: 1, 2: 3, 3: 1, 9: 1, 10: 1, 20: 1}
OK	7383-20-2	CCCCCCC(C#C)O	{1: 1, 2: 5, 3: 1, 9: 1, 10: 1, 20: 1}
OK	7383-71-3	C=CC(=O)OCC(C(F)F)(F)F	{2: 1, 3: 1, 4: 1, 5: 1, 6: 1, 16: 4, 28: 1}
OK	7383-77-9	CCC#CCN(C)C	{1: 3, 2: 2, 10: 2, 33: 1}
OK	73840-20-7	CC(C)C(=O)C(C)(C)C(=O)NCCNC(=O)C(C)(C)C(=O)C(C)C	{1: 8, 2: 2, 3: 2, 4: 2, 24: 4, 31: 2}
OK	7385-65-1	C(=O)(C1(OC(C(O1)(F)F)(C(F)(F)F)F)C(F)(F)F)F	{16: 10, 24: 1, 4: 2, 13: 3, 23: 2}
OK	7385-78-6	CC(C)C(C)C=C	{1: 3, 3: 2, 5: 1, 6: 1}
OK	7385-82-2	C/C=C/CC(C)C	{1: 3, 2: 1, 3: 1, 6: 2}
OK	73870-33-4	C1CSCN1N=O	{33: 1, 34: 1, 11: 3, 29: 1, 41: 1}
OK	7388-44-5	COCN1COCN(C1=O)COC	{1: 2, 2: 2, 33: 2, 11: 2, 22: 2, 23: 1, 25: 1}
OK	7388-58-1	CCCCCCCCCCCCCCCC(=O)NC	{24: 1, 1: 2, 2: 14, 31: 1}
OK	73892-11-2	CCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)O	{1: 1, 2: 19, 27: 1, 28: 1}
OK	739-27-5	C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CCC4=O)C)O	{1: 2, 11: 8, 12: 5, 13: 2, 20: 1, 25: 2}
OK	7390-81-0	CCCCCCCCCCCCCCCCC1CO1	{1: 1, 2: 15, 11: 1, 12: 1, 23: 1}
OK	7391-39-1	CCCCC(C#N)C(=O)OCC	{1: 2, 2: 4, 3: 1, 28: 1, 37: 1}
OK	7391-67-5	CC1C(=O)NC(=O)N(C1=O)C	{32: 1, 1: 2, 12: 1, 33: 1, 25: 3}
OK	7392-19-0	CC1(CCCC(O1)(C)C=C)C	{1: 3, 5: 1, 6: 1, 11: 3, 13: 2, 23: 1}
OK	7393-45-5	C1CC1Cl	{17: 1, 11: 2, 12: 1}
OK	7397-62-8	CCCCOC(=O)CO	{1: 1, 2: 4, 20: 1, 28: 1}
OK	73987-00-5	C[C@@H]1[C@H]([C@H](C[C@H](O1)O[C@H]2C[C@H](O[C@@H]([C@H]2O[C@@H]3C[C@@H]([C@@H]([C@H](O3)C)O)O)C)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7(C6(CC([C@@H]7C8=CC(=O)OC8)OC(=O)C)O)C)C)O)O	{1: 6, 11: 12, 12: 18, 13: 3, 14: 1, 15: 1, 20: 5, 22: 3, 23: 3, 28: 2}
OK	73987-16-3	CC1CC(CC(C1)(C)C)OC(C)COCC(C)O	{1: 5, 2: 2, 3: 2, 11: 3, 12: 2, 13: 1, 20: 1, 22: 2}
OK	73989-17-0	C[C@H]1CCC2(CC3CC(O2)C/C=C(\[C@H](C(/C=C\C=C/4\COC5[C@@]4(C(C=C([C@H]5O)C)C(=O)O3)O)C)OC6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)/C)OC1	{1: 8, 11: 9, 12: 16, 13: 2, 14: 5, 15: 3, 20: 3, 22: 4, 23: 5, 28: 1}
OK	73991-95-4	CC1(O[C@H](C(=O)O1)CC(=O)O)C	{1: 2, 2: 1, 12: 1, 13: 1, 23: 1, 27: 1, 28: 1}
OK	74-55-5	CCC(CO)NCCNC(CC)CO	{1: 2, 2: 6, 3: 2, 20: 2, 31: 2}
OK	74-79-3	C(C[C@@H](C(=O)O)N)CN=C(N)N	{2: 3, 3: 1, 7: 1, 34: 1, 27: 1, 30: 3}
OK	74-80-6	CCCCCOO	{1: 1, 2: 4, 20: 1, 22: 1}
OK	74-83-9	CBr	{1: 1, 18: 1}
OK	74-84-0	CC	{1: 2}
OK	74-85-1	C=C	{5: 2}
OK	74-86-2	C#C	{9: 2}
OK	74-87-3	CCl	{1: 1, 17: 1}
OK	74-88-4	CI	{1: 1, 19: 1}
OK	74-89-5	CN	{1: 1, 30: 1}
OK	74-90-8	C#N	{37: 1}
OK	74-93-1	CS	{1: 1, 39: 1}
OK	74-95-3	C(Br)Br	{2: 1, 18: 2}
OK	74-96-4	CCBr	{1: 1, 2: 1, 18: 1}
OK	74-97-5	C(Cl)Br	{17: 1, 2: 1, 18: 1}
OK	74-98-6	CCC	{1: 2, 2: 1}
OK	74-99-7	CC#C	{1: 1, 10: 1, 9: 1}
OK	7400-45-5	COC(=O)CCSCC(=O)OC	{40: 1, 1: 2, 2: 3, 28: 2}
OK	7400-67-1	CC(=O)C1CC(=O)OC1	{24: 1, 1: 1, 11: 2, 12: 1, 28: 1}
OK	7402-61-1	CCOC(=O)C(=C1CCCCCC1)C#N	{1: 1, 2: 1, 37: 1, 7: 1, 11: 6, 15: 1, 28: 1}
OK	7403-22-7	O=C(O)C1CCC2CCCC21	{27: 1, 11: 5, 12: 3}
OK	7403-66-9	CC(C)N(C(C)C)C(=O)CCl	{1: 4, 2: 1, 3: 2, 33: 1, 17: 1, 24: 1}
OK	74032-60-3	COC(=O)/C(=C(\C(C(=O)OC)(C(F)(F)F)F)/F)/F	{16: 6, 1: 2, 4: 2, 28: 2, 7: 2}
OK	74038-78-1	CCCCCCCCCC1=NC(CN1C(C)C)(C)C	{1: 5, 2: 8, 3: 1, 33: 1, 11: 1, 13: 1, 15: 1, 35: 1}
OK	74051-80-2	CCCC(=C1C(=O)CC(CC1=O)CC(C)SCC)NOCC	{1: 4, 2: 5, 3: 1, 7: 1, 40: 1, 11: 2, 12: 1, 15: 1, 22: 1, 25: 2, 31: 1}
OK	74051-83-5	CCCCCCCCCCCCCC(=O)NCCNCCNCCNCCN	{24: 1, 1: 1, 2: 20, 30: 1, 31: 4}
OK	74051-84-6	CCCCCCCCCCC(CCCCCCCC)COC(=O)C	{1: 3, 2: 17, 3: 1, 28: 1}
OK	7408-18-6	C(C(C(=O)O)OC(CC(=O)O)C(=O)O)C(=O)O	{27: 4, 2: 2, 3: 2, 22: 1}
OK	74082-06-7	CCC(CC)C(=O)OCC(C)C	{1: 4, 2: 3, 3: 2, 28: 1}
OK	74082-27-2	CC(=C)C(=O)OC.COC(=O)C=C.C=CC(=O)NCO	{1: 3, 2: 1, 5: 3, 6: 2, 7: 1, 20: 1, 24: 1, 28: 2, 31: 1}
OK	74082-33-0	CCCCC(CC)COC(=O)C=C.CC(CC(C)(C)O)O.CC(=O)OC=C	{1: 6, 2: 6, 3: 2, 4: 1, 5: 2, 6: 2, 20: 2, 28: 2}
OK	7409-44-1	CCCCCCCOCCO	{1: 1, 2: 8, 20: 1, 22: 1}
OK	7409-48-5	CCN(CC)CC(=O)N	{24: 1, 1: 2, 2: 3, 30: 1, 33: 1}
OK	74094-60-3	CCCCC1OCC(O1)C	{1: 2, 2: 3, 11: 1, 12: 2, 23: 2}
OK	74119-36-1	CCN=CN(C)C	{1: 3, 2: 1, 34: 1, 6: 1, 33: 1}
OK	7412-78-4	C(CC(=O)O)[C@@H](C(=O)O)NC(=O)CN	{2: 3, 3: 1, 24: 1, 27: 2, 30: 1, 31: 1}
OK	7413-02-7	CC1C=CCC2C1C=CC2	{1: 1, 11: 2, 12: 3, 14: 4}
OK	74149-25-0	CCOC(C#CC=O)OCC	{1: 2, 2: 2, 3: 1, 10: 2, 22: 2, 26: 1}
OK	7416-48-0	CC(O)OC(=O)COO	{1: 1, 2: 1, 3: 1, 20: 2, 22: 1, 28: 1}
OK	7417-48-3	CCC(=C=C)C	{8: 1, 1: 2, 2: 1, 5: 1, 7: 1}
OK	7417-67-6	CC(=O)N(C)N=O	{24: 1, 1: 2, 34: 1, 29: 1, 33: 1}
OK	74181-34-3	CC1(OCC(=O)CO1)C	{1: 2, 11: 2, 25: 1, 13: 1, 23: 2}
OK	74186-19-9	CC1(CC(CC(C1)(C)CNC(=O)OCCOCCOC(=O)NCC2(CC(CC(C2)(C)C)NC(=O)N3CCCCCC3=O)C)NC(=O)N4CCCCCC4=O)C	{1: 6, 2: 6, 33: 2, 11: 16, 12: 2, 13: 4, 22: 1, 24: 2, 25: 2, 28: 2, 31: 4}
OK	74193-14-9	CC1=C(C(CCC1)(C)C)C#C/C(=C/C=C/C(=C/C(=O)O)/C)/C	{1: 5, 6: 4, 7: 2, 10: 2, 11: 3, 13: 1, 15: 2, 27: 1}
OK	7420-07-7	CCCCOCCOCCC(=O)O	{1: 1, 2: 7, 27: 1, 22: 2}
OK	7420-11-3	CCCCCCCCCCCCOCCC(=O)OC	{1: 2, 2: 13, 28: 1, 22: 1}
OK	74203-42-2	CN\1C=CC=C/C1=C\[NH+]=O.C1=CN(C=CC1=C[NH+]=O)CCCN2C=CC(=C[NH+]=O)C=C2.[Cl-].[Cl-].[Cl-]	{1: 1, 2: 3, 6: 3, 33: 3, 14: 12, 15: 3, 17: 3, 29: 3, 31: 3}
OK	7421-93-4	C1C(C2C3C1C4C5(C2(C(C3(C45Cl)Cl)(Cl)Cl)Cl)Cl)C=O	{17: 6, 26: 1, 11: 1, 12: 5, 13: 5}
OK	74217-57-5	C[C@@H]1C/C(=C/C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]1(C)O)/C	{1: 3, 33: 1, 11: 5, 12: 3, 13: 1, 14: 2, 15: 2, 20: 1, 28: 2}
OK	7422-80-2	CCCCN(CCCC)N	{1: 2, 2: 6, 30: 1, 33: 1}
OK	7422-90-4	CC=NN(C)C	{1: 3, 34: 1, 6: 1, 33: 1}
OK	7422-93-7	CC/C=N/N(C)C	{1: 3, 2: 1, 34: 1, 6: 1, 33: 1}
OK	7423-00-9	CCCNN=C(C)C	{1: 3, 2: 2, 31: 1, 34: 1, 7: 1}
OK	7423-01-0	CC(C)NN=C(C)C	{31: 1, 1: 4, 34: 1, 3: 1, 7: 1}
OK	7423-69-0	CC(C)CC(C)C=C	{1: 3, 2: 1, 3: 2, 5: 1, 6: 1}
OK	7424-54-6	CCC(=O)CC(=O)CC	{24: 2, 1: 2, 2: 3}
OK	7424-91-1	COC(CC(=O)OC)OC	{1: 3, 2: 1, 3: 1, 28: 1, 22: 2}
OK	74244-64-7	C1CCC/C=C\CCCCCCCC(=O)CCC1	{25: 1, 11: 14, 14: 2}
OK	7425-14-1	CCCCC(CC)COC(=O)C(CC)CCCC	{1: 4, 2: 9, 3: 2, 28: 1}
OK	7425-45-8	CCC(C(=O)OCC)Cl	{1: 2, 2: 2, 3: 1, 28: 1, 17: 1}
OK	7425-47-0	CCC(C(=O)OCC)I	{19: 1, 1: 2, 2: 2, 3: 1, 28: 1}
OK	7425-49-2	CCOC(=O)CC(C)Br	{1: 2, 2: 2, 3: 1, 28: 1, 18: 1}
OK	7425-60-7	CCCCCCCC(C(=O)OCC)Br	{1: 2, 2: 7, 3: 1, 28: 1, 18: 1}
OK	7425-93-6	C(CCSCCO)CSCCO	{40: 2, 2: 8, 20: 2}
OK	74252-65-6	CC(C)CC(OC)(OC)OC	{1: 5, 2: 1, 3: 1, 4: 1, 22: 3}
OK	74256-14-7	CC(=C)C(=O)OCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{1: 1, 2: 2, 4: 11, 5: 1, 7: 1, 16: 23, 28: 1}
OK	74283-25-3	CCC(/C=C/Cl)(C#C)OC(=O)N	{1: 1, 2: 1, 4: 1, 6: 2, 9: 1, 10: 1, 17: 1, 28: 1, 30: 1}
OK	74286-93-4	CCCC(C)(C)CC(C)(C)CCC	{1: 6, 2: 5, 4: 2}
OK	74286-94-5	CCC(C)(CC)CC(C)(CC)CC	{1: 6, 2: 5, 4: 2}
OK	74286-95-6	CCCCC(C)(C)CC(C)(C)CCCC	{1: 6, 2: 7, 4: 2}
OK	74286-96-7	CCCC(C)(CC)CC(C)(CC)CCC	{1: 6, 2: 7, 4: 2}
OK	7429-37-0	C1CC[C@H]([C@@H](C1)Br)Br	{18: 2, 11: 4, 12: 2}
OK	7429-44-9	COC1CCCCC1=O	{1: 1, 11: 4, 12: 1, 22: 1, 25: 1}
OK	7429-45-0	COC1CCCC1O	{1: 1, 11: 3, 12: 2, 22: 1, 20: 1}
OK	74306-03-9	CCCCCOC(=O)CCCl	{1: 1, 2: 6, 28: 1, 17: 1}
OK	74306-04-0	CCCCCCCOC(=O)CCCl	{1: 1, 2: 8, 28: 1, 17: 1}
OK	74306-05-1	CCCCCCCCCOC(=O)CCCl	{1: 1, 2: 10, 28: 1, 17: 1}
OK	74306-06-2	CCCCCCCCCCOC(=O)CCCl	{1: 1, 2: 11, 28: 1, 17: 1}
OK	74306-07-3	CCCCCCCCCCCOC(=O)CCCl	{1: 1, 2: 12, 28: 1, 17: 1}
OK	74313-63-6	CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C(COCCO)O	{1: 3, 2: 5, 34: 2, 8: 2, 11: 3, 12: 1, 13: 2, 20: 2, 22: 1, 29: 2}
OK	74316-16-8	CCCCCCCCCCCCOC(=O)CCCl	{1: 1, 2: 13, 28: 1, 17: 1}
OK	74328-57-7	C1C(O1)CC(C(F)(F)F)(C(F)(F)F)F	{2: 1, 4: 3, 11: 1, 12: 1, 16: 7, 23: 1}
OK	7433-56-9	CCCC/C=C/CCCC	{1: 2, 2: 6, 6: 2}
OK	74331-49-0	C1CC2CCC(=O)N(C1)C2	{25: 1, 11: 6, 12: 1, 33: 1}
OK	74332-85-7	CC(C)C(=O)C(C)(C)C(=O)N1CCCC1	{1: 4, 3: 1, 4: 1, 33: 1, 11: 4, 24: 2}
OK	74338-72-0	CC(C)C(=O)C(C)(C)CC=C(C)C	{1: 6, 2: 1, 3: 1, 4: 1, 6: 1, 7: 1, 24: 1}
OK	74338-98-0	CC(C)(C)OCC(O)CO	{1: 3, 2: 2, 3: 1, 4: 1, 20: 2, 22: 1}
OK	74339-50-7	CCCCCCCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 11, 4: 1, 28: 1, 17: 3}
OK	74339-51-8	CCCCCCCCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 12, 4: 1, 28: 1, 17: 3}
OK	74339-52-9	CCCCCCCCCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 13, 4: 1, 28: 1, 17: 3}
OK	74339-53-0	CCCCCCCCCCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 14, 4: 1, 28: 1, 17: 3}
OK	74339-54-1	CCCCCCCCCCCCCCCCOC(=O)C(Cl)(Cl)Cl	{1: 1, 2: 15, 4: 1, 28: 1, 17: 3}
OK	7434-40-4	CCCCCCC(=O)OCCOCCOCCOC(=O)CCCCCC	{1: 2, 2: 16, 28: 2, 22: 2}
OK	74359-02-7	C=C(C(=O)OCC(F)(F)F)Cl	{2: 1, 4: 1, 5: 1, 7: 1, 16: 3, 17: 1, 28: 1}
OK	74367-31-0	CCCC(C(CC)COC(=O)C(C)C)O	{1: 4, 2: 4, 3: 3, 20: 1, 28: 1}
OK	7438-05-3	CCCCCCCCN=[N+]=N	{1: 1, 2: 7, 36: 1, 34: 2}
OK	7438-09-7	CCCCCCCCCCCCCC(=O)NC	{24: 1, 1: 2, 2: 12, 31: 1}
OK	7439-02-3	CCCCCCCCCCOCC(C(=O)OC)OCC	{1: 3, 2: 11, 3: 1, 28: 1, 22: 2}
OK	74392-36-2	C/C=C/CCCCCCCCCCCC	{1: 2, 2: 11, 6: 2}
OK	74421-05-9	CCC=C(C)C=C(C)C	{1: 4, 2: 1, 6: 2, 7: 2}
OK	7443-52-9	C[C@@H]1CCCC[C@H]1O	{1: 1, 11: 4, 12: 2, 20: 1}
OK	7443-55-2	C[C@@H]1CCC[C@@H](O)C1	{1: 1, 11: 4, 12: 2, 20: 1}
OK	7443-70-1	C[C@@H]1CCCC[C@@H]1O	{1: 1, 11: 4, 12: 2, 20: 1}
OK	74437-38-0	COC1=C2CCC(=C1)C2	{1: 1, 11: 3, 22: 1, 14: 1, 15: 3}
OK	7445-18-3	CC1(COC(=O)CCC(=O)OC1)C	{1: 2, 11: 4, 28: 2, 13: 1}
OK	7446-09-5	O=S=O	{40: 1, 29: 2}
OK	7446-43-7	CCCN(CCC)O	{1: 2, 2: 4, 20: 1, 33: 1}
OK	7448-04-6	CCCCCCCCCCCCOCCOCCC(=O)OC	{1: 2, 2: 15, 28: 1, 22: 2}
OK	74485-37-3	C1COCOCCOCCOCOCCO1	{11: 10, 23: 6}
OK	74485-42-0	C1COCCOCOCCOCCOCCOCOCCO1	{11: 14, 23: 8}
OK	74485-43-1	C1COCCOCOCCOCCOCCOCOCCOCCOCOCCOCCO1	{11: 21, 23: 12}
OK	74485-47-5	C1COCCOCOCCOCCOCCOCCOCOCCOCCO1	{11: 18, 23: 10}
OK	74485-52-2	C1COCCOCCOCOCCOCCOCCOCCOCOCCOCCOCCO1	{11: 22, 23: 12}
OK	74499-33-5	CCCO/C=C/C	{1: 2, 2: 2, 22: 1, 6: 2}
OK	74499-57-3	CC/C=C(\C)/[C@@H](CCC(C)C)O	{1: 4, 2: 3, 3: 2, 6: 1, 7: 1, 20: 1}
OK	74499-58-4	CC1CC2C(C2(C)C)C(C1=O)CC=C(C)C	{1: 5, 2: 1, 6: 1, 7: 1, 11: 1, 12: 4, 13: 1, 25: 1}
OK	74499-59-5	CC(=CCC1(CC2C(C2(C)C)CC1=O)C)C	{1: 5, 2: 1, 6: 1, 7: 1, 11: 2, 12: 2, 13: 2, 25: 1}
OK	74499-62-0	C=CC(=O)N.C=CC(=O)NN	{24: 2, 30: 2, 5: 2, 6: 2, 31: 1}
OK	74499-68-6	C=C(F)F.C(=C(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F.C(=C(F)F)(F)F	{16: 16, 4: 3, 5: 1, 22: 1, 7: 5}
OK	74499-70-0	C=C.C=CCOC(C(F)F)(F)F.C(=C(F)F)(F)F	{2: 1, 3: 1, 4: 1, 5: 3, 6: 1, 7: 2, 16: 8, 22: 1}
OK	745-62-0	CCCCCC(C=CC1C(CC(C1CCCCCCC(=O)O)O)O)O	{1: 1, 2: 10, 3: 1, 6: 2, 11: 1, 12: 4, 20: 3, 27: 1}
OK	745-65-3	CCCCCC(C=CC1C(CC(=O)C1CCCCCCC(=O)O)O)O	{1: 1, 2: 10, 3: 1, 6: 2, 11: 1, 12: 3, 20: 2, 25: 1, 27: 1}
OK	74503-34-7	CC1(C2C1C=C2)C	{1: 2, 12: 2, 13: 1, 14: 2}
OK	74514-59-3	CCCCC(C)(C#CC)O	{1: 3, 2: 3, 4: 1, 10: 2, 20: 1}
OK	7452-59-7	CCCCCCCCOC(=O)Cl	{1: 1, 2: 7, 28: 1, 17: 1}
OK	7452-79-1	CCC(C)C(=O)OCC	{1: 3, 2: 2, 3: 1, 28: 1}
OK	74581-94-5	CCCC(C)C(CC)C(=O)O	{27: 1, 1: 3, 2: 3, 3: 2}
OK	7459-33-8	CCCCCC=CCC=CCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 12, 6: 4, 17: 1}
OK	7459-46-3	CCOC(=O)CC(C(=O)OCC)C(=O)OCC	{1: 3, 2: 4, 3: 1, 28: 3}
OK	7459-71-4	CC1CC(C=C1)C	{1: 2, 11: 1, 12: 2, 14: 2}
OK	7460-84-6	CCCCCCCCCCCCCCCCCC(=O)OCC1CO1	{1: 1, 2: 17, 11: 1, 12: 1, 23: 1, 28: 1}
OK	74601-20-0	C1C=CCC2C1CSC2	{41: 1, 11: 4, 12: 2, 14: 2}
OK	7461-19-0	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 35, 18: 1}
OK	7462-73-9	CCC(C(=O)N)Cl	{1: 1, 2: 1, 3: 1, 17: 1, 24: 1, 30: 1}
OK	7462-74-0	CC(C)(C(=O)N)Br	{24: 1, 1: 2, 18: 1, 4: 1, 30: 1}
OK	74630-40-3	CCCC(C)CCCCCC=C	{1: 2, 2: 7, 3: 1, 5: 1, 6: 1}
OK	74630-42-5	CCCCC(C)CCCCC=C	{1: 2, 2: 7, 3: 1, 5: 1, 6: 1}
OK	74630-91-4	CCCC(C)(CC)OC	{1: 4, 2: 3, 4: 1, 22: 1}
OK	74634-56-3	CC12CCC(=O)C=C1CCC3C2(C(=O)CC4(C3CCC4=O)C)SC#N	{1: 2, 37: 1, 40: 1, 11: 7, 12: 2, 13: 3, 14: 1, 15: 1, 25: 3}
OK	74648-17-2	CC1(C[C@@H](C(N1O)(C)C)NC(=O)CNC(=O)CI)C	{1: 4, 2: 2, 33: 1, 11: 1, 12: 1, 13: 2, 19: 1, 20: 1, 24: 2, 31: 2}
OK	747-90-0	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CCC=C4)C)C	{1: 5, 2: 3, 3: 2, 11: 7, 12: 4, 13: 2, 14: 3, 15: 1}
OK	74706-98-2	C#CC#CF	{16: 1, 9: 1, 10: 3}
OK	74713-58-9	CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)NC(=O)CCC)O	{1: 2, 2: 15, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	74713-59-0	CCCCCCCCCCCCCC=C[C@H]([C@H](CO)NC(=O)CCCCCCC)O	{1: 2, 2: 19, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	74713-60-3	CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)NC(=O)CCCCCCCCCCC)O	{1: 2, 2: 23, 3: 2, 6: 2, 20: 2, 24: 1, 31: 1}
OK	74725-75-0	C1CC2(CC1C2)I	{19: 1, 11: 4, 12: 1, 13: 1}
OK	74725-76-1	C1C2CC3C2(C1C3)I	{19: 1, 11: 3, 12: 3, 13: 1}
OK	74725-77-2	C12C3C4C1C5C2C3C45I	{19: 1, 12: 7, 13: 1}
OK	74733-99-6	COCCOCCOC1OCCO1	{1: 1, 2: 4, 11: 2, 12: 1, 22: 3, 23: 2}
OK	7474-05-7	C[C@H](C(=O)O)Cl	{27: 1, 1: 1, 3: 1, 17: 1}
OK	7474-10-4	CC1CC(C(=O)C=C1C)C	{1: 3, 11: 1, 12: 2, 14: 1, 15: 1, 25: 1}
OK	7474-90-0	C1CCC2=C(C1)C(=O)C=CC2=O	{25: 2, 11: 4, 14: 2, 15: 2}
OK	74744-28-8	CCCCCCCC#CC=C	{1: 1, 2: 6, 10: 2, 5: 1, 6: 1}
OK	74744-36-8	CCCCCCCCC#CC=C	{1: 1, 2: 7, 10: 2, 5: 1, 6: 1}
OK	74758-91-1	CCCCCC(=O)OCSC	{40: 1, 1: 2, 2: 5, 28: 1}
OK	7476-20-2	CCOC(=O)C(C)(OCC)OCC	{1: 4, 2: 3, 4: 1, 22: 2, 28: 1}
OK	7476-94-0	CCCC(=O)NCC(C)C	{24: 1, 1: 3, 2: 3, 3: 1, 31: 1}
OK	74772-12-6	C=C1C2C(=C)C(=C)C(C1=C)C(=C)C2=C	{12: 2, 5: 6, 15: 6}
OK	74773-73-2	C1CC2CC(=O)CC(C1)N2N3C4CCCC3CC(=O)C4	{25: 2, 11: 10, 12: 4, 33: 2}
OK	74773-74-3	C1CC2CCCC(C1)N2N3C4CCCC3CC(=O)C4	{25: 1, 11: 11, 12: 4, 33: 2}
OK	74773-76-5	CN(C)N1C2CCCC1CC(=O)C2	{1: 2, 11: 5, 12: 2, 33: 2, 25: 1}
OK	74773-77-6	CC(=O)CCN(C)N(C)C	{24: 1, 1: 4, 2: 2, 33: 2}
OK	74796-12-6	C1C2C(CC(C1SS2)Cl)Cl	{17: 2, 11: 2, 12: 4, 41: 2}
OK	74835-81-7	F.F.F.F.F	{16: 5}
OK	74835-82-8	F.F.F.F.F.F.F	{16: 7}
OK	7486-95-5	C1CC2CC1C3C2NC3=O	{32: 1, 25: 1, 11: 3, 12: 4}
OK	7487-28-7	CC1(CO1)COCC2(CO2)C	{1: 2, 2: 2, 11: 2, 13: 2, 22: 1, 23: 2}
OK	74879-18-8	C[C@H]1CNCCN1	{32: 2, 1: 1, 11: 3, 12: 1}
OK	7488-99-5	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2C(=CCCC2(C)C)C)/C)/C	{1: 10, 6: 14, 7: 4, 11: 5, 12: 1, 13: 2, 14: 1, 15: 3}
OK	74895-96-8	CCC1C2CCCCC2CC1=O	{1: 1, 2: 1, 11: 5, 12: 3, 25: 1}
OK	74895-97-9	CCC12CCCCC1CCC2=O	{1: 1, 2: 1, 11: 6, 12: 1, 13: 1, 25: 1}
OK	74896-14-3	C1CC2CC1C(=O)CC2=O	{25: 2, 11: 4, 12: 2}
OK	74896-15-4	C1CC2CCC1C(=O)CC2=O	{25: 2, 11: 5, 12: 2}
OK	74896-19-8	CC1(C(=O)CC(=O)C1(C)C)C	{1: 4, 11: 1, 13: 2, 25: 2}
OK	7491-74-9	C1CC(=O)N(C1)CC(=O)N	{33: 1, 2: 1, 11: 3, 24: 1, 25: 1, 30: 1}
OK	74912-42-8	CCCCCCCCCC(=O)OC(C)C(C(C)O)([N+](=O)[O-])Br	{1: 3, 2: 8, 3: 2, 4: 1, 38: 1, 18: 1, 20: 1, 28: 1}
OK	7492-38-8	CCCCC(=O)CC(C)C	{24: 1, 1: 3, 2: 4, 3: 1}
OK	7492-66-2	CCOC(C=C(C)CCC=C(C)C)OCC	{1: 5, 2: 4, 3: 1, 6: 2, 7: 2, 22: 2}
OK	7492-67-3	CC(CCC=C(C)C)CCOCC=O	{1: 3, 2: 5, 3: 1, 6: 1, 7: 1, 22: 1, 26: 1}
OK	7492-70-8	CCCCOC(=O)C(C)OC(=O)CCC	{1: 3, 2: 5, 3: 1, 28: 2}
OK	74920-78-8	CCN(C=O)N	{1: 1, 2: 1, 26: 1, 30: 1, 33: 1}
OK	7493-58-5	CC(C)C(=O)C(=O)C	{24: 2, 1: 3, 3: 1}
OK	7493-69-8	CCC(CC)C(=O)OCC=C	{1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 28: 1}
OK	7493-71-2	C/C=C(\C)/C(=O)OCC=C	{1: 2, 2: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	7493-72-3	CCCCCCCCC(=O)OCC=C	{1: 1, 2: 8, 28: 1, 5: 1, 6: 1}
OK	7493-75-6	CC=CC=CC(=O)OCC=C	{1: 1, 2: 1, 28: 1, 5: 1, 6: 5}
OK	7493-76-7	C=CCCCCCCCCC(=O)OCC=C	{2: 9, 28: 1, 5: 2, 6: 2}
OK	7493-82-5	CCCCCCC(=O)OCCCCC	{1: 2, 2: 9, 28: 1}
OK	74940-23-1	CCCCN(C(CCC)OO)N=O	{1: 2, 2: 5, 3: 1, 33: 1, 34: 1, 20: 1, 22: 1, 29: 1}
OK	74940-26-4	CN(COO)N=O	{1: 1, 2: 1, 33: 1, 34: 1, 20: 1, 22: 1, 29: 1}
OK	74955-23-0	CCCN(COO)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 20: 1, 22: 1, 29: 1}
OK	74963-96-5	C1CC2C3C=CC4C1C2C43	{11: 2, 12: 6, 14: 2}
OK	74974-54-2	COC(CCl)(OC)OC	{1: 3, 2: 1, 4: 1, 22: 3, 17: 1}
OK	74999-20-5	CC(=O)C(C(=O)C)NN=C1N=NN=N1	{1: 2, 34: 1, 3: 1, 15: 1, 35: 4, 24: 2, 31: 1}
OK	75-00-3	CCCl	{1: 1, 2: 1, 17: 1}
OK	75-01-4	C=CCl	{17: 1, 5: 1, 6: 1}
OK	75-02-5	C=CF	{16: 1, 5: 1, 6: 1}
OK	75-03-6	CCI	{1: 1, 2: 1, 19: 1}
OK	75-04-7	CCN	{1: 1, 2: 1, 30: 1}
OK	75-05-8	CC#N	{1: 1, 37: 1}
OK	75-07-0	CC=O	{1: 1, 26: 1}
OK	75-08-1	CCS	{1: 1, 2: 1, 39: 1}
OK	75-09-2	C(Cl)Cl	{17: 2, 2: 1}
OK	75-10-5	C(F)F	{16: 2, 2: 1}
OK	75-11-6	C(I)I	{2: 1, 19: 2}
OK	75-12-7	C(=O)N	{26: 1, 30: 1}
OK	75-13-8	C(=N)=O	{8: 1, 36: 1, 29: 1}
OK	75-17-2	C=NO	{34: 1, 20: 1, 5: 1}
OK	75-18-3	CSC	{40: 1, 1: 2}
OK	75-19-4	C1CC1	{11: 3}
OK	75-21-8	C1CO1	{11: 2, 23: 1}
OK	75-25-2	C(Br)(Br)Br	{18: 3, 3: 1}
OK	75-26-3	CC(C)Br	{1: 2, 18: 1, 3: 1}
OK	75-27-4	C(Cl)(Cl)Br	{17: 2, 18: 1, 3: 1}
OK	75-28-5	CC(C)C	{1: 3, 3: 1}
OK	75-29-6	CC(C)Cl	{1: 2, 3: 1, 17: 1}
OK	75-30-9	CC(C)I	{19: 1, 1: 2, 3: 1}
OK	75-31-0	CC(C)N	{1: 2, 3: 1, 30: 1}
OK	75-33-2	CC(C)S	{1: 2, 3: 1, 39: 1}
OK	75-34-3	CC(Cl)Cl	{1: 1, 3: 1, 17: 2}
OK	75-35-4	C=C(Cl)Cl	{17: 2, 5: 1, 7: 1}
OK	75-36-5	CC(=O)Cl	{24: 1, 1: 1, 17: 1}
OK	75-37-6	CC(F)F	{16: 2, 1: 1, 3: 1}
OK	75-38-7	C=C(F)F	{16: 2, 5: 1, 7: 1}
OK	75-43-4	C(F)(Cl)Cl	{16: 1, 17: 2, 3: 1}
OK	75-44-5	C(=O)(Cl)Cl	{24: 1, 17: 2}
OK	75-45-6	C(F)(F)Cl	{16: 2, 17: 1, 3: 1}
OK	75-46-7	C(F)(F)F	{16: 3, 3: 1}
OK	75-47-8	C(I)(I)I	{19: 3, 3: 1}
OK	75-50-3	CN(C)C	{1: 3, 33: 1}
OK	75-52-5	C[N+](=O)[O-]	{1: 1, 38: 1}
OK	75-55-8	CC1CN1	{32: 1, 1: 1, 11: 1, 12: 1}
OK	75-56-9	CC1CO1	{1: 1, 11: 1, 12: 1, 23: 1}
OK	75-61-6	C(F)(F)(Br)Br	{16: 2, 18: 2, 4: 1}
OK	75-62-7	C(Cl)(Cl)(Cl)Br	{17: 3, 18: 1, 4: 1}
OK	75-63-8	C(F)(F)(F)Br	{16: 3, 18: 1, 4: 1}
OK	75-64-9	CC(C)(C)N	{1: 3, 4: 1, 30: 1}
OK	75-65-0	CC(C)(C)O	{1: 3, 4: 1, 20: 1}
OK	75-66-1	CC(C)(C)S	{1: 3, 4: 1, 39: 1}
OK	75-68-3	CC(F)(F)Cl	{16: 2, 1: 1, 4: 1, 17: 1}
OK	75-69-4	C(F)(Cl)(Cl)Cl	{16: 1, 17: 3, 4: 1}
OK	75-71-8	C(F)(F)(Cl)Cl	{16: 2, 17: 2, 4: 1}
OK	75-72-9	C(F)(F)(F)Cl	{16: 3, 17: 1, 4: 1}
OK	75-73-0	C(F)(F)(F)F	{16: 4, 4: 1}
OK	75-80-9	C(C(Br)(Br)Br)O	{20: 1, 2: 1, 4: 1, 18: 3}
OK	75-81-0	C(C(Cl)(Cl)Br)Br	{17: 2, 2: 1, 4: 1, 18: 2}
OK	75-82-1	C(C(F)(F)Br)Br	{16: 2, 2: 1, 4: 1, 18: 2}
OK	75-83-2	CCC(C)(C)C	{1: 4, 2: 1, 4: 1}
OK	75-84-3	CC(C)(C)CO	{1: 3, 2: 1, 4: 1, 20: 1}
OK	75-85-4	CCC(C)(C)O	{1: 3, 2: 1, 4: 1, 20: 1}
OK	75-86-5	CC(C)(C#N)O	{1: 2, 4: 1, 37: 1, 20: 1}
OK	75-87-6	C(=O)C(Cl)(Cl)Cl	{17: 3, 26: 1, 4: 1}
OK	75-88-7	C(C(F)(F)F)Cl	{16: 3, 17: 1, 2: 1, 4: 1}
OK	75-89-8	C(C(F)(F)F)O	{16: 3, 20: 1, 2: 1, 4: 1}
OK	75-90-1	C(=O)C(F)(F)F	{16: 3, 26: 1, 4: 1}
OK	75-91-2	CC(C)(C)OO	{1: 3, 4: 1, 22: 1, 20: 1}
OK	75-95-6	C(C(Br)(Br)Br)(Br)Br	{18: 5, 3: 1, 4: 1}
OK	75-96-7	C(=O)(C(Br)(Br)Br)O	{18: 3, 27: 1, 4: 1}
OK	75-97-8	CC(=O)C(C)(C)C	{24: 1, 1: 4, 4: 1}
OK	75-98-9	CC(C)(C)C(=O)O	{1: 3, 27: 1, 4: 1}
OK	75-99-0	CC(C(=O)O)(Cl)Cl	{1: 1, 27: 1, 4: 1, 17: 2}
OK	7500-14-3	CN1CCCCCC1	{1: 1, 11: 6, 33: 1}
OK	7500-55-2	COC(=O)C1CC=CCC1C(=O)OC	{1: 2, 11: 2, 12: 2, 14: 2, 28: 2}
OK	7501-79-3	CCCCCCNC(=O)C	{24: 1, 1: 2, 2: 5, 31: 1}
OK	75029-45-7	C1CCC#C/C=C\C1	{10: 2, 11: 4, 14: 2}
OK	75039-84-8	CCCCCCCC/C=C/CO	{1: 1, 2: 8, 20: 1, 6: 2}
OK	7505-12-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC	{1: 2, 2: 29, 28: 1}
OK	7506-80-1	C(CO)NC(=O)OCCO	{28: 1, 2: 4, 20: 2, 31: 1}
OK	75067-64-0	CC/C=C(\C)/C1CC1	{1: 2, 2: 1, 6: 1, 7: 1, 11: 2, 12: 1}
OK	7507-68-8	CCOC(=O)C1(CCCC(C1=O)(C)C)C	{1: 4, 2: 1, 11: 3, 13: 2, 25: 1, 28: 1}
OK	75113-47-2	CCCCC(CC)C(=O)NCCCCCC(=O)O	{1: 2, 2: 9, 3: 1, 24: 1, 27: 1, 31: 1}
OK	75113-48-3	CCCCC(CC)C(=O)NCCCCCC(=O)O.C(CO)N	{1: 2, 2: 11, 3: 1, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	75113-49-4	CCCCC(CC)C(=O)NCCCCCC(=O)O.CC(CN)O	{1: 3, 2: 10, 3: 2, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	75125-57-4	C=CC(=O)N.C=CC(=O)O.C=CNC=O	{5: 3, 6: 3, 24: 1, 26: 1, 27: 1, 30: 1, 31: 1}
OK	75147-20-5	CCCCOC(=O)C(C(=C(Cl)Cl)Cl)(Cl)Cl	{1: 1, 2: 3, 4: 1, 7: 2, 17: 5, 28: 1}
OK	7515-29-9	CC(C1CCC1)O	{11: 3, 1: 1, 3: 1, 12: 1, 20: 1}
OK	7515-80-2	CC(C)NC(C)(C)C	{1: 5, 3: 1, 4: 1, 31: 1}
OK	7516-70-3	CCCCCCCCCCCCCCCCCCOC(=O)/C=C/C(=O)OCCCCCCCCCCCCCCCCCC	{1: 2, 2: 34, 28: 2, 6: 2}
OK	7516-82-7	CCCCCCCCCCNC	{1: 2, 2: 9, 31: 1}
OK	7517-76-2	C1CC(CCC1N=C=O)N=C=O	{8: 2, 34: 2, 11: 4, 12: 2, 29: 2}
OK	75172-85-9	C1CC2C(C1)C3CC2C4C3C5CCC4C5	{11: 7, 12: 8}
OK	75178-96-0	CC(C)(C)OC(=O)NCCCN	{1: 3, 2: 3, 4: 1, 28: 1, 30: 1, 31: 1}
OK	7519-36-0	C1C[C@H](N(C1)N=O)C(=O)O	{33: 1, 34: 1, 11: 3, 12: 1, 27: 1, 29: 1}
OK	75196-34-8	CC(C)CCCCCC(=O)NCCCCCC(=O)O.CC(CN)O	{1: 3, 2: 11, 3: 2, 20: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	75197-24-9	C1CCN2CCCCC(C1)CCCC2	{33: 1, 11: 12, 12: 1}
OK	75199-25-6	CC(CCN=C=O)CC(C)(C)CN=C=O.C=CC(=O)OCCO	{1: 3, 2: 6, 3: 1, 4: 1, 5: 1, 6: 1, 8: 2, 34: 2, 20: 1, 28: 1, 29: 2}
OK	752-61-4	CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)O)O)C)C)O)OC)OC7C(C(C(C(O7)CO)O)O)O	{1: 4, 2: 1, 11: 9, 12: 16, 13: 3, 14: 1, 15: 1, 20: 7, 22: 3, 23: 2, 28: 1}
OK	7522-44-3	CC(C)CC(CO)(C(=O)O)N	{1: 2, 2: 2, 3: 1, 4: 1, 20: 1, 27: 1, 30: 1}
OK	75225-51-3	CC[C@H](C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@H](C[C@H](CC(=O)O)O)O)C	{1: 4, 2: 5, 3: 3, 11: 1, 12: 5, 14: 3, 15: 1, 20: 2, 27: 1, 28: 1}
OK	75245-21-5	CCC(=C(CC)C(C)(C)C)C(C)(C)C	{1: 8, 2: 2, 4: 2, 7: 2}
OK	75268-05-2	CCN(C(C)C)N=C(C)C	{1: 5, 34: 1, 3: 1, 33: 1, 7: 1, 2: 1}
OK	7528-78-1	C(CN(CCC#N)CCC#N)C#N	{33: 1, 2: 6, 37: 3}
OK	7529-08-0	CCCCOC(=O)CC(C(=O)OCCCC)S	{1: 2, 2: 7, 3: 1, 28: 2, 39: 1}
OK	7529-27-3	C=CCOCCOCC=C	{2: 4, 22: 2, 5: 2, 6: 2}
OK	753-65-1	C(F)(Cl)(Br)I	{16: 1, 17: 1, 18: 1, 19: 1, 4: 1}
OK	753-66-2	C(F)(F)(Br)I	{16: 2, 18: 1, 19: 1, 4: 1}
OK	753-89-9	CC(C)(C)CCl	{1: 3, 2: 1, 4: 1, 17: 1}
OK	753-90-2	C(C(F)(F)F)N	{16: 3, 2: 1, 4: 1, 30: 1}
OK	7530-07-6	CCCCCCCCOOCCCCCCCC	{1: 2, 2: 14, 22: 2}
OK	7531-10-4	CC1(C(C(C1N)(C)C)N)C	{1: 4, 12: 2, 13: 2, 30: 2}
OK	7531-52-4	C1C[C@H](NC1)C(=O)N	{24: 1, 32: 1, 11: 3, 12: 1, 30: 1}
OK	7533-40-6	CC(C)C[C@@H](CO)N	{1: 2, 2: 2, 3: 2, 20: 1, 30: 1}
OK	75336-86-6	C[C@@H]1CNCCN1	{32: 2, 1: 1, 11: 3, 12: 1}
OK	7534-94-3	CC(=C)C(=O)OC1CC2CCC1(C2(C)C)C	{1: 4, 5: 1, 7: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	7535-34-4	CC(C)CCCC(C)NN	{1: 3, 2: 3, 3: 2, 30: 1, 31: 1}
OK	7536-55-2	CC(C)(C)OC(=O)N[C@@H](CC(=O)N)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
OK	754-10-9	CC(C)(C)C(=O)N	{24: 1, 1: 3, 4: 1, 30: 1}
OK	754-12-1	C=C(F)C(F)(F)F	{16: 4, 4: 1, 5: 1, 7: 1}
OK	754-17-6	C(C(Cl)(Br)Br)(F)(F)F	{16: 3, 17: 1, 18: 2, 4: 2}
OK	754-34-7	C(C(F)(F)F)(C(F)(F)I)(F)F	{16: 7, 19: 1, 4: 3}
OK	754-96-1	C(C(C(C(C(C(C(C(C(CO)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{16: 16, 20: 2, 2: 2, 4: 8}
OK	7540-51-4	C[C@@H](CCC=C(C)C)CCO	{1: 3, 2: 4, 3: 1, 6: 1, 7: 1, 20: 1}
OK	7540-53-6	CCCCC(=O)OCCC(C)CCC=C(C)C	{1: 4, 2: 7, 3: 1, 6: 1, 7: 1, 28: 1}
OK	7541-16-4	CN(C)C(=O)OC	{1: 3, 28: 1, 33: 1}
OK	75415-78-0	C1CC(=C(C1)Br)Br	{18: 2, 11: 3, 15: 2}
OK	7542-37-2	C1[C@H]([C@@H]([C@H](C([C@H]1N)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)N)OC3[C@@H]([C@@H]([C@H](O3)CO)O[C@@H]4[C@@H]([C@H]([C@@H]([C@@H](O4)CN)O)O)N)O)O)N	{2: 3, 11: 1, 12: 19, 20: 8, 22: 3, 23: 3, 30: 5}
OK	75453-80-4	C1=CC(C(C=C1)O)O	{20: 2, 12: 2, 14: 4}
OK	75455-41-3	C=CC(CO)Cl	{2: 1, 3: 1, 5: 1, 6: 1, 17: 1, 20: 1}
OK	75476-98-1	C=CCCCCCCCCC(=O)NCCOC(=O)C=CC(=O)O	{2: 10, 5: 1, 6: 3, 24: 1, 27: 1, 28: 1, 31: 1}
OK	7549-37-3	CC(=CCCC(=CC(OC)OC)C)C	{1: 5, 2: 2, 3: 1, 6: 2, 7: 2, 22: 2}
OK	75491-38-2	CCC1=[N+](C(N(C1(C)C)C)(C)C)[O-]	{1: 6, 2: 1, 33: 2, 13: 2, 15: 1, 29: 1}
OK	755-25-9	C(=C(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F	{16: 12, 4: 4, 7: 2}
OK	755-73-7	COC(=O)C(C(OC)(F)F)(F)F	{16: 4, 1: 2, 4: 2, 22: 1, 28: 1}
OK	75507-25-4	C1COCCOCC(OCCOCCO1)CO	{20: 1, 2: 1, 11: 9, 12: 1, 23: 5}
OK	75507-26-5	C1COCCOC(COCCO1)CO	{20: 1, 2: 1, 11: 7, 12: 1, 23: 4}
OK	75508-30-4	C(C(COC(=O)CCl)O)O	{17: 1, 2: 3, 3: 1, 20: 2, 28: 1}
OK	7553-56-2	[I]	{19: 1}
OK	7554-12-3	CCOC(=O)CC(C(=O)OCC)O	{1: 2, 2: 3, 3: 1, 20: 1, 28: 2}
OK	75579-88-3	CCC(C)CCCC=O	{1: 2, 2: 4, 3: 1, 26: 1}
OK	7559-04-8	CC1=C(C(=O)C(=C(C1=O)C)CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O)C	{1: 8, 2: 11, 3: 3, 4: 1, 15: 4, 20: 1, 25: 2}
OK	756-02-5	CC(=C)C(C)(C)C=C	{1: 3, 4: 1, 5: 2, 6: 1, 7: 1}
OK	756-09-2	C(C(C(=O)O)(F)F)(F)F	{16: 4, 27: 1, 3: 1, 4: 1}
OK	756-48-9	CC(C(C(F)F)(F)F)OC(=O)N	{1: 1, 3: 2, 4: 1, 16: 4, 28: 1, 30: 1}
OK	7560-64-7	CC1=CCC(CC1)C=O	{1: 1, 11: 3, 12: 1, 14: 1, 15: 1, 26: 1}
OK	7560-65-8	COC(C1CCC=CC1)OC	{1: 2, 3: 1, 11: 3, 12: 1, 14: 2, 22: 2}
OK	7560-76-1	CC(C)(C)C1OCCCO1	{1: 3, 11: 3, 4: 1, 12: 1, 23: 2}
OK	7560-83-0	CN(C1CCCCC1)C2CCCCC2	{1: 1, 11: 10, 12: 2, 33: 1}
OK	7561-04-8	C=COC(=O)C(Cl)Cl	{17: 2, 3: 1, 28: 1, 5: 1, 6: 1}
OK	7563-03-3	C(CCN)C[C@@H](C(=O)NCC(=O)O)N	{2: 5, 3: 1, 24: 1, 27: 1, 30: 2, 31: 1}
OK	7564-64-9	CC(CCO)(CCO)O	{1: 1, 2: 4, 4: 1, 20: 3}
OK	75647-01-7	CC(C)(C)OC(=O)N[C@H](CC(=O)N)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 24: 1, 27: 1, 28: 1, 30: 1, 31: 1}
OK	75659-26-6	CCN1CC2(CCC(C34C2C(C5(C31)C6(CC(C7CC4(C6C7OC(=O)C)O)OC)OCO5)OC(=O)C)OC)C	{1: 6, 2: 1, 33: 1, 11: 6, 12: 8, 13: 5, 20: 1, 22: 2, 23: 2, 28: 2}
OK	75662-22-5	CC(=C)C(=O)OCCOC1CC2CC1C3C2CC=C3	{1: 1, 2: 2, 5: 1, 7: 1, 11: 3, 12: 5, 14: 2, 22: 1, 28: 1}
OK	7567-22-8	C1=CC=CC(=CC=C1)Br	{18: 1, 14: 7, 15: 1}
OK	7568-58-3	CCCCOC(=O)CC(=CC(=O)OCCCC)C(=O)OCCCC	{1: 3, 2: 10, 28: 3, 6: 1, 7: 1}
OK	75680-27-2	C/C=C(/C)\C(=O)O[C@@H]1C[C@@]2([C@H](C[C@@](O2)(/C(=C\[C@@H]3[C@@H]1C(=C)C(=O)O3)/C)O)O)C	{1: 4, 5: 1, 6: 1, 7: 1, 11: 2, 12: 4, 13: 2, 14: 1, 15: 2, 20: 2, 23: 1, 28: 2}
OK	75694-39-2	C(CS)CBr	{2: 3, 18: 1, 39: 1}
OK	7570-26-5	C(C[N+](=O)[O-])[N+](=O)[O-]	{2: 2, 38: 2}
OK	75701-46-1	COC(=O)CCCCC(=O)OC.COC(=O)CCCC(=O)OC.C(CNCCN)N	{1: 4, 2: 11, 28: 4, 30: 2, 31: 1}
OK	75718-13-7	CCC(CC)CCC=O	{1: 2, 2: 4, 3: 1, 26: 1}
OK	7572-29-4	C(#CCl)Cl	{17: 2, 10: 2}
OK	75736-66-2	CC1CCC(CC1)C(C)(C)C	{1: 4, 11: 4, 4: 1, 12: 2}
OK	7575-82-8	C1C2CC3CC1CC(C2)(C3)[N+](=O)[O-]	{11: 6, 12: 3, 13: 1, 38: 1}
OK	75790-80-6	CC1(CC(CC(C1)(C)CN)N)C.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{1: 3, 2: 9, 11: 3, 12: 1, 13: 2, 20: 2, 27: 2, 30: 2}
OK	758-10-1	C(C(=O)S)N	{24: 1, 2: 1, 30: 1, 39: 1}
OK	758-17-8	CN(C=O)N	{1: 1, 26: 1, 30: 1, 33: 1}
OK	758-24-7	C(=C(Cl)Br)(F)F	{16: 2, 17: 1, 18: 1, 7: 2}
OK	758-42-9	C(=O)(C(F)(F)F)C(Cl)(Cl)Cl	{16: 3, 17: 3, 4: 2, 24: 1}
OK	758-48-5	C(C(F)(F)F)(N(C(C(F)(F)F)(F)F)C(F)(F)F)(F)F	{16: 13, 33: 1, 4: 5}
OK	758-86-1	CC(C=C)C(=C)C	{1: 2, 3: 1, 5: 2, 6: 1, 7: 1}
OK	758-96-3	CCC(=O)N(C)C	{24: 1, 1: 3, 2: 1, 33: 1}
OK	7580-12-3	CC(C)C1OC(OC(O1)C(C)C)C(C)C	{1: 6, 3: 3, 12: 3, 23: 3}
OK	7581-97-7	CC(C(C)Cl)Cl	{1: 2, 3: 2, 17: 2}
OK	7583-53-1	CN1CCCC(C1)CO	{1: 1, 2: 1, 33: 1, 11: 4, 12: 1, 20: 1}
OK	7585-39-9	C([C@@H]1[C@@H]2[C@@H]([C@H]([C@H](O1)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](O[C@@H]([C@@H](C6O)O)O[C@@H]7[C@H](O[C@@H]([C@@H]([C@H]7O)O)O[C@@H]8[C@H](O[C@H](O2)[C@@H]([C@H]8O)O)CO)CO)CO)CO)CO)CO)O)O)O	{20: 21, 2: 7, 12: 35, 23: 14}
OK	75881-16-2	CC1CN(CCO1)N=O	{1: 1, 34: 1, 33: 1, 11: 3, 12: 1, 23: 1, 29: 1}
OK	75881-17-3	CC1CN(CC(N1C(=O)C)C)N=O	{1: 3, 34: 1, 33: 2, 11: 2, 12: 2, 24: 1, 29: 1}
OK	75881-19-5	CCCCCCCCCNCN=O	{1: 1, 2: 9, 34: 1, 29: 1, 31: 1}
OK	75881-20-8	CCCCCCCCCCCCCCN(C)N=O	{1: 2, 2: 13, 34: 1, 29: 1, 33: 1}
OK	75891-10-0	C1CC2C/C=C\CC1C=C2	{11: 4, 12: 2, 14: 4}
OK	75896-33-2	CC(CN(CCO)N=O)O	{1: 1, 2: 3, 3: 1, 33: 1, 34: 1, 20: 2, 29: 1}
OK	759-05-7	CC(C)C(=O)C(=O)O	{24: 1, 1: 2, 3: 1, 27: 1}
OK	759-22-8	CC(C)N(C(C)C)C(=O)C	{24: 1, 1: 5, 3: 2, 33: 1}
OK	759-24-0	CCOC(=O)C(C(=O)OCC)C(C)(C)C	{1: 5, 2: 2, 3: 1, 4: 1, 28: 2}
OK	759-36-4	CCOC(=O)C(C(C)C)C(=O)OCC	{1: 4, 2: 2, 3: 2, 28: 2}
OK	759-58-0	CCOC(=O)C(=C(C)C)C#N	{1: 3, 2: 1, 28: 1, 37: 1, 7: 2}
OK	759-73-9	CCN(C(=O)N)N=O	{1: 1, 2: 1, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	759-94-4	CCCN(CCC)C(=O)SCC	{24: 1, 1: 3, 2: 5, 40: 1, 33: 1}
OK	759-97-7	COCC(C(OC)OC)Br	{1: 3, 2: 1, 3: 2, 18: 1, 22: 3}
OK	75911-79-4	CC(=O)OC1C2(CCCC1(CC2)C)C	{1: 3, 11: 5, 12: 1, 13: 2, 28: 1}
OK	75949-74-5	C[C@H](CN)NCCNC[C@H](C)N	{1: 2, 2: 4, 3: 2, 30: 2, 31: 2}
OK	75949-76-7	C[C@@H]1CNCCN1CCN[C@@H](C)CN	{32: 1, 1: 2, 2: 3, 3: 1, 33: 1, 11: 3, 12: 1, 30: 1, 31: 1}
OK	75949-77-8	C[C@@H]1CNCCN1CCNC[C@H](C)N	{32: 1, 1: 2, 2: 3, 3: 1, 33: 1, 11: 3, 12: 1, 30: 1, 31: 1}
OK	7596-92-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCBr	{1: 1, 2: 31, 18: 1}
OK	75960-13-3	C=C1CC2C1=CCC2	{11: 3, 12: 1, 5: 1, 14: 1, 15: 2}
OK	75962-54-8	C[C@H]1CN(CCN1)CCNC[C@H](C)N	{32: 1, 1: 2, 2: 3, 3: 1, 33: 1, 11: 3, 12: 1, 30: 1, 31: 1}
OK	76-00-6	CC(C(Cl)(Cl)Cl)O	{1: 1, 3: 1, 4: 1, 20: 1, 17: 3}
OK	76-01-7	C(C(Cl)(Cl)Cl)(Cl)Cl	{17: 5, 3: 1, 4: 1}
OK	76-02-8	C(=O)(C(Cl)(Cl)Cl)Cl	{24: 1, 17: 4, 4: 1}
OK	76-03-9	C(=O)(C(Cl)(Cl)Cl)O	{17: 3, 27: 1, 4: 1}
OK	76-04-0	C(=O)(C(F)(F)Cl)O	{16: 2, 17: 1, 27: 1, 4: 1}
OK	76-05-1	C(=O)(C(F)(F)F)O	{16: 3, 27: 1, 4: 1}
OK	76-06-2	C([N+](=O)[O-])(Cl)(Cl)Cl	{17: 3, 4: 1, 38: 1}
OK	76-08-4	CC(C)(C(Br)(Br)Br)O	{1: 2, 18: 3, 4: 2, 20: 1}
OK	76-09-5	CC(C)(C(C)(C)O)O	{1: 4, 4: 2, 20: 2}
OK	76-11-9	C(C(Cl)(Cl)Cl)(F)(F)Cl	{16: 2, 17: 4, 4: 2}
OK	76-12-0	C(C(F)(Cl)Cl)(F)(Cl)Cl	{16: 2, 17: 4, 4: 2}
OK	76-13-1	C(C(F)(Cl)Cl)(F)(F)Cl	{16: 3, 17: 3, 4: 2}
OK	76-14-2	C(C(F)(F)Cl)(F)(F)Cl	{16: 4, 17: 2, 4: 2}
OK	76-15-3	C(C(F)(F)Cl)(F)(F)F	{16: 5, 17: 1, 4: 2}
OK	76-16-4	C(C(F)(F)F)(F)(F)F	{16: 6, 4: 2}
OK	76-17-5	C(C(F)(F)Cl)(C(F)(F)Cl)(F)Cl	{16: 5, 17: 3, 4: 3}
OK	76-18-6	C(C(F)(F)F)(C(F)(F)F)(F)Cl	{16: 7, 17: 1, 4: 3}
OK	76-19-7	C(C(F)(F)F)(C(F)(F)F)(F)F	{16: 8, 4: 3}
OK	76-21-1	C(C(C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{16: 16, 27: 1, 3: 1, 4: 7}
OK	76-22-2	CC1(C2CCC1(C(=O)C2)C)C	{1: 3, 11: 3, 12: 1, 13: 2, 25: 1}
OK	76-25-5	C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)CO)CCC5=CC(=O)C=C[C@@]53C)F)O	{1: 4, 2: 1, 11: 4, 12: 4, 13: 5, 14: 3, 15: 1, 16: 1, 20: 2, 23: 2, 24: 1, 25: 1}
OK	76-29-9	CC1(C2CCC1(C(=O)C2Br)C)C	{1: 3, 11: 2, 12: 2, 13: 2, 18: 1, 25: 1}
OK	76-30-2	C(=O)(C(C(C(=O)O)(O)O)(O)O)O	{20: 4, 27: 2, 4: 2}
OK	76-35-7	CC(C(C)(C)CO)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 2}
OK	76-36-8	CC(C(C=O)(Cl)Cl)Cl	{1: 1, 26: 1, 3: 1, 4: 1, 17: 3}
OK	76-37-9	C(C(C(F)F)(F)F)O	{16: 4, 20: 1, 2: 1, 3: 1, 4: 1}
OK	76-38-0	COC(C(Cl)Cl)(F)F	{1: 1, 3: 1, 4: 1, 16: 2, 17: 2, 22: 1}
OK	76-39-1	CC(C)(CO)[N+](=O)[O-]	{1: 2, 2: 1, 4: 1, 38: 1, 20: 1}
OK	76-43-7	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3CC[C@]4(C)O)C)O)F	{1: 3, 11: 7, 12: 3, 13: 4, 14: 1, 15: 1, 16: 1, 20: 2, 25: 1}
OK	76-44-8	C1=CC(C2C1C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl)Cl	{17: 7, 12: 3, 13: 3, 14: 2, 15: 2}
OK	76-45-9	C[C@H]1CC[C@H]2[C@@](C3[C@H]([C@@H]([C@@]4(C(C3CN2C1)C[C@@]56C4[C@@H]([C@@H](C7[C@@]5(CC[C@@H]([C@]7(O6)O)O)C)O)O)O)O)O)(C)O	{1: 3, 33: 1, 11: 7, 12: 12, 13: 5, 20: 8, 23: 1}
OK	76-47-1	CCN(CC)CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)O	{1: 4, 2: 4, 33: 1, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 2, 24: 1, 25: 1, 28: 1}
OK	76-49-3	CC(=O)OC1CC2CCC1(C2(C)C)C	{1: 4, 11: 3, 12: 2, 13: 2, 28: 1}
OK	76-68-6	C=CCC1(C(=O)NC(=O)NC1=O)C2CCC=C2	{32: 2, 2: 1, 5: 1, 6: 1, 11: 2, 12: 1, 13: 1, 14: 2, 25: 3}
OK	76-71-1	CCC(C)C(CC)(C(=O)OCC)C(=O)OCC	{1: 5, 2: 4, 3: 1, 4: 1, 28: 2}
OK	76-73-3	CCCC(C)C1(C(=O)NC(=O)NC1=O)CC=C	{32: 2, 1: 2, 2: 3, 3: 1, 5: 1, 6: 1, 13: 1, 25: 3}
OK	76-74-4	CCCC(C)C1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 3, 2: 3, 3: 1, 13: 1, 25: 3}
OK	76-76-6	CCC1(C(=O)NC(=O)NC1=O)C(C)C	{32: 2, 1: 3, 2: 1, 3: 1, 13: 1, 25: 3}
OK	76-78-8	C[C@@H]1C=C(C(=O)[C@]2([C@H]1C[C@@H]3[C@@]4([C@@H]2C(=O)C(=C([C@@H]4CC(=O)O3)C)OC)C)C)OC	{1: 6, 11: 2, 12: 5, 13: 2, 14: 1, 15: 3, 22: 2, 25: 2, 28: 1}
OK	760-20-3	CCC(C)C=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 1}
OK	760-21-4	CCC(=C)CC	{1: 2, 2: 2, 5: 1, 7: 1}
OK	760-23-6	C=CC(CCl)Cl	{17: 2, 2: 1, 3: 1, 5: 1, 6: 1}
OK	760-30-5	C(C(=O)NN)S	{24: 1, 2: 1, 39: 1, 30: 1, 31: 1}
OK	760-41-8	C(=O)(C(F)(F)F)NC(=O)N	{16: 3, 24: 2, 4: 1, 30: 1, 31: 1}
OK	760-54-3	CCCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 6, 3: 1}
OK	760-55-4	CCCCCCCCC(C(=O)O)C(=O)O	{27: 2, 1: 1, 2: 7, 3: 1}
OK	760-56-5	C=CCN(C(=O)N)N=O	{33: 1, 2: 1, 5: 1, 6: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	760-60-1	CC(C)CN(C(=O)N)N=O	{1: 2, 2: 1, 3: 1, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	760-67-8	CCCCC(CC)C(=O)Cl	{24: 1, 1: 2, 2: 4, 3: 1, 17: 1}
OK	760-78-1	CCCC(C(=O)O)N	{27: 1, 1: 1, 2: 2, 3: 1, 30: 1}
OK	760-79-2	CCCC(=O)N(C)C	{24: 1, 1: 3, 2: 2, 33: 1}
OK	760-90-7	COC(=O)CC(C(=O)OC)Br	{1: 2, 2: 1, 3: 1, 28: 2, 18: 1}
OK	760-94-1	COC(=O)CCC(C(=O)OC)Br	{1: 2, 2: 2, 3: 1, 28: 2, 18: 1}
OK	760-97-4	CC(CC=C(C)C)C(=O)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1, 24: 1}
OK	7601-87-8	CN(C(=O)C(=O)N(C)N=O)N=O	{24: 2, 1: 2, 34: 2, 29: 2, 33: 2}
OK	7601-90-3	OCl(=O)(=O)=O	{17: 1, 20: 1, 29: 3}
OK	7603-37-4	C1CC2=C(C1)CC=CC2	{11: 5, 14: 2, 15: 2}
OK	76043-70-4	C1CC(C(OC1)O)(Cl)Cl	{11: 3, 12: 1, 13: 1, 17: 2, 20: 1, 23: 1}
OK	76068-79-6	CCCCCCC(=O)OCCl	{1: 1, 2: 6, 28: 1, 17: 1}
OK	76086-05-0	CCC(=O)COCC	{24: 1, 1: 2, 2: 3, 22: 1}
OK	76089-59-3	CC1=C(C(=C)C(=C1C)C)C	{1: 4, 5: 1, 15: 5}
OK	761-06-8	COC(CO)CO	{1: 1, 2: 2, 3: 1, 20: 2, 22: 1}
OK	761-34-2	CCCC(CC)OC(=O)C(F)(F)F	{1: 2, 2: 3, 3: 1, 4: 1, 16: 3, 28: 1}
OK	761-40-0	CCCC(CCC)OO	{1: 2, 2: 4, 3: 1, 20: 1, 22: 1}
OK	761-60-4	CCCCCCCCCCCCCCCC(OCC)OCC	{1: 3, 2: 16, 3: 1, 22: 2}
OK	761-65-9	CCCCN(CCCC)C=O	{1: 2, 2: 6, 26: 1, 33: 1}
OK	761-70-6	CCCCC(CC)OO	{1: 2, 2: 4, 3: 1, 20: 1, 22: 1}
OK	7611-43-0	C([C@@H](C(=O)O)NCC(C(=O)O)NCC(=O)N)C(=O)O	{2: 3, 3: 2, 24: 1, 27: 3, 30: 1, 31: 2}
OK	7611-86-1	CC/C=C\Cl	{1: 1, 2: 1, 6: 2, 17: 1}
OK	7611-87-2	CC/C=C/Cl	{1: 1, 2: 1, 6: 2, 17: 1}
OK	7617-74-5	CCCCCCCCCCCCOCCCN	{1: 1, 2: 14, 30: 1, 22: 1}
OK	7617-75-6	CCCCCCCCCCCCCCCCCCOCCCN	{1: 1, 2: 20, 30: 1, 22: 1}
OK	7617-78-9	CCCCCCCCCCOCCCN	{1: 1, 2: 12, 30: 1, 22: 1}
OK	7617-82-5	CCCCCCCCCCCCCCOCCCN	{1: 1, 2: 16, 30: 1, 22: 1}
OK	76198-36-2	C1CC2CC1C(C2N)C(=O)O	{27: 1, 11: 3, 12: 4, 30: 1}
OK	762-12-9	CCCCCCCCCC(=O)OOC(=O)CCCCCCCCC	{1: 2, 2: 16, 28: 2}
OK	762-13-0	CCCCCCCCC(=O)OOC(=O)CCCCCCCC	{1: 2, 2: 14, 28: 2}
OK	762-16-3	CCCCCCCC(=O)OOC(=O)CCCCCCC	{1: 2, 2: 12, 28: 2}
OK	762-21-0	CCOC(=O)C#CC(=O)OCC	{1: 2, 2: 2, 28: 2, 10: 2}
OK	762-29-8	CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C	{24: 1, 1: 5, 2: 6, 6: 3, 7: 3}
OK	762-42-5	COC(=O)C#CC(=O)OC	{1: 2, 10: 2, 28: 2}
OK	762-46-9	CCCCCC(C)OO	{1: 2, 2: 4, 3: 1, 20: 1, 22: 1}
OK	762-49-2	C(CBr)F	{16: 1, 2: 2, 18: 1}
OK	762-50-5	C(CCl)F	{16: 1, 17: 1, 2: 2}
OK	762-51-6	C(CI)F	{16: 1, 2: 2, 19: 1}
OK	762-62-9	CC(C)(C)CC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1}
OK	762-84-5	CC(=O)NC(C)(C)C	{24: 1, 1: 4, 4: 1, 31: 1}
OK	762-98-1	CC(C)(C[N+](=O)[O-])C[N+](=O)[O-]	{1: 2, 2: 2, 4: 1, 38: 2}
OK	7623-09-8	CC(C(=O)Cl)Cl	{24: 1, 1: 1, 3: 1, 17: 2}
OK	7623-10-1	CC(CCl)C(=O)Cl	{24: 1, 1: 1, 2: 1, 3: 1, 17: 2}
OK	7623-11-2	CCC(C(=O)Cl)Cl	{24: 1, 1: 1, 2: 1, 3: 1, 17: 2}
OK	7623-13-4	C(C(C(=O)Cl)Cl)Cl	{24: 1, 17: 3, 2: 1, 3: 1}
OK	76257-73-3	CCCCCN(C)CCCCC	{1: 3, 2: 8, 33: 1}
OK	763-20-2	CCCCCC(C)(C)S	{1: 3, 2: 4, 4: 1, 39: 1}
OK	763-29-1	CCCC(=C)C	{1: 2, 2: 2, 5: 1, 7: 1}
OK	763-30-4	CC(=C)CC=C	{1: 1, 2: 1, 5: 2, 6: 1, 7: 1}
OK	763-32-6	CC(=C)CCO	{1: 1, 2: 2, 20: 1, 5: 1, 7: 1}
OK	763-35-9	C(CS)C(=O)N	{24: 1, 2: 2, 30: 1, 39: 1}
OK	763-57-5	CC(=O)CC(=O)NC(=O)N	{24: 3, 1: 1, 2: 1, 30: 1, 31: 1}
OK	763-69-9	CCOCCC(=O)OCC	{1: 2, 2: 4, 28: 1, 22: 1}
OK	763-88-2	CC(=CCC=C)C	{1: 2, 2: 1, 5: 1, 6: 2, 7: 1}
OK	763-89-3	CC(=CCCO)C	{1: 2, 2: 2, 20: 1, 6: 1, 7: 1}
OK	76319-15-8	CC(C)CC(=O)O[C@H]1[C@@H]2[C@@H](C[C@H]([C@H]2CO)O)C(=CO1)CO	{1: 2, 2: 3, 3: 1, 11: 1, 12: 5, 14: 1, 15: 1, 20: 3, 23: 1, 28: 1}
OK	76333-71-6	CCOC(=O)/C=C/1\N(C(=O)[C@H](S1)N2CCCCC2)C	{1: 2, 2: 1, 6: 1, 33: 2, 41: 1, 11: 5, 12: 1, 15: 1, 25: 1, 28: 1}
OK	76334-36-6	C=C(CCO)Br	{2: 2, 18: 1, 20: 1, 5: 1, 7: 1}
OK	76379-66-3	C#CCCC#CC#CCCCCO	{9: 1, 2: 6, 20: 1, 10: 5}
OK	76379-67-4	C(CCO)CC#CC#CCCC#CC#CCCCCO	{2: 10, 20: 2, 10: 8}
OK	764-01-2	CC#CCO	{1: 1, 2: 1, 20: 1, 10: 2}
OK	764-13-6	CC(=CC=C(C)C)C	{1: 4, 6: 2, 7: 2}
OK	764-33-0	CCCC#CC(=O)O	{1: 1, 2: 2, 27: 1, 10: 2}
OK	764-35-2	CCCC#CC	{1: 2, 2: 2, 10: 2}
OK	764-38-5	C/C=C\CCO	{1: 1, 2: 2, 20: 1, 6: 2}
OK	764-42-1	C(=C/C#N)\C#N	{37: 2, 6: 2}
OK	764-44-3	CS/C=C\SC	{40: 2, 1: 2, 6: 2}
OK	764-45-4	CS/C=C/SC	{40: 2, 1: 2, 6: 2}
OK	764-47-6	CCCOC=C	{1: 1, 2: 2, 22: 1, 5: 1, 6: 1}
OK	764-48-7	C=COCCO	{2: 2, 22: 1, 20: 1, 5: 1, 6: 1}
OK	764-60-3	CCCC#CCO	{1: 1, 2: 3, 20: 1, 10: 2}
OK	764-67-0	CCCCCCCCCCCCCCC(C(=O)O)O	{27: 1, 1: 1, 2: 13, 3: 1, 20: 1}
OK	764-73-8	CC#CCCC#CC	{1: 2, 2: 2, 10: 4}
OK	764-78-3	C=COCCOC=C	{2: 2, 22: 2, 5: 2, 6: 2}
OK	764-81-8	CCCCCCCOO	{1: 1, 2: 6, 20: 1, 22: 1}
OK	764-85-2	CCCCCCCCC(=O)Cl	{24: 1, 1: 1, 2: 7, 17: 1}
OK	764-89-6	C(CCCC(=O)O)CCCO	{2: 7, 27: 1, 20: 1}
OK	764-93-2	CCCCCCCCC#C	{1: 1, 2: 7, 10: 1, 9: 1}
OK	764-95-4	CCCCCCCOC=C	{1: 1, 2: 6, 22: 1, 5: 1, 6: 1}
OK	764-96-5	CCCCCC=CCCCC	{1: 2, 2: 7, 6: 2}
OK	764-99-8	C=COCCOCCOC=C	{2: 4, 22: 3, 5: 2, 6: 2}
OK	7641-77-2	CC1=C(C2(C1(C(=C2C)C)C)C)C	{1: 6, 13: 2, 15: 4}
OK	7642-04-8	C/C=C\CCCCC	{1: 2, 2: 4, 6: 2}
OK	7642-09-3	CC/C=C\CC	{1: 2, 2: 2, 6: 2}
OK	7642-10-6	CC/C=C\CCC	{1: 2, 2: 3, 6: 2}
OK	7642-15-1	CCC/C=C\CCC	{1: 2, 2: 4, 6: 2}
OK	76429-98-6	C(=O)(C1(N=N1)C(=O)O)O	{35: 2, 27: 2, 13: 1}
OK	7647-01-0	Cl	{17: 1}
OK	7647-57-6	C1CC=CC2(C1)CC2	{11: 5, 13: 1, 14: 2}
OK	76474-09-4	CC(C)(C#N)OC	{1: 3, 4: 1, 37: 1, 22: 1}
OK	76486-72-1	CC1=CC1(C)C2C=C2	{1: 2, 12: 1, 13: 1, 14: 3, 15: 1}
OK	765-03-7	CCCCCCCCCCC#C	{1: 1, 2: 9, 10: 1, 9: 1}
OK	765-04-8	C(CCCCCO)CCCCCO	{2: 11, 20: 2}
OK	765-05-9	CCCCCCCCCCOC=C	{1: 1, 2: 9, 22: 1, 5: 1, 6: 1}
OK	765-09-3	CCCCCCCCCCCCCBr	{1: 1, 2: 12, 18: 1}
OK	765-10-6	CCCCCCCCCCCCC#C	{1: 1, 2: 11, 10: 1, 9: 1}
OK	765-12-8	C=COCCOCCOCCOC=C	{2: 6, 22: 4, 5: 2, 6: 2}
OK	765-13-9	CCCCCCCCCCCCCC#C	{1: 1, 2: 12, 10: 1, 9: 1}
OK	765-14-0	CCCCCCCCCCCCOC=C	{1: 1, 2: 11, 22: 1, 5: 1, 6: 1}
OK	765-15-1	CCCCCCCCCCCCSC#N	{40: 1, 1: 1, 2: 11, 37: 1}
OK	765-27-5	CCCCCCCCCCCCCCCCCCC#C	{1: 1, 2: 17, 10: 1, 9: 1}
OK	765-30-0	C1CC1N	{11: 2, 12: 1, 30: 1}
OK	765-31-1	CC1N=N1	{1: 1, 35: 2, 12: 1}
OK	765-34-4	C1C(O1)C=O	{26: 1, 11: 1, 12: 1, 23: 1}
OK	765-38-8	CC1CCCN1	{32: 1, 1: 1, 11: 3, 12: 1}
OK	765-39-9	C1=CN(C=C1)N	{33: 1, 30: 1, 14: 4}
OK	765-42-4	CC(C1CC1)O	{11: 2, 1: 1, 3: 1, 12: 1, 20: 1}
OK	765-43-5	CC(=O)C1CC1	{24: 1, 1: 1, 11: 2, 12: 1}
OK	765-46-8	C1CC12C=CC=C2	{11: 2, 13: 1, 14: 4}
OK	765-47-9	CC1=C(CCC1)C	{1: 2, 11: 3, 15: 2}
OK	765-48-0	CC1CCCN1C	{1: 2, 11: 3, 12: 1, 33: 1}
OK	765-67-3	C1CC2(CCC1C2)Cl	{17: 1, 11: 5, 12: 1, 13: 1}
OK	765-69-5	CC1C(=O)CCC1=O	{1: 1, 11: 2, 12: 1, 25: 2}
OK	765-70-8	CC1CCC(=O)C1=O	{1: 1, 11: 2, 12: 1, 25: 2}
OK	765-72-0	C1C2C3C2C4C1C4C3	{11: 2, 12: 6}
OK	765-83-3	CC(=C1CCCC1)C	{15: 1, 1: 2, 11: 4, 7: 1}
OK	765-85-5	COC(=O)C1CCC1	{1: 1, 11: 3, 12: 1, 28: 1}
OK	765-87-7	C1CCC(=O)C(=O)C1	{25: 2, 11: 4}
OK	765-90-2	C[C@@H]1CC2CCC1C2	{1: 1, 11: 4, 12: 3}
OK	7651-02-7	CCCCCCCCCCCCCCCCCC(=O)NCCCN(C)C	{24: 1, 1: 3, 2: 19, 33: 1, 31: 1}
OK	7651-50-5	CC(C)C1OCC(CO1)(C)C	{1: 4, 3: 1, 11: 2, 12: 1, 13: 1, 23: 2}
OK	7651-91-4	CN(Cl)Cl	{1: 1, 33: 1, 17: 2}
OK	76549-16-1	COC1=C([C@@H](C2(CC(=NO2)C(=O)NCCC(=O)CNC(=O)C3=NOC4(C3)C=C(C(=C([C@@H]4O)Br)OC)Br)C=C1Br)O)Br	{1: 2, 2: 3, 35: 2, 11: 2, 12: 2, 13: 2, 14: 2, 15: 8, 18: 4, 20: 2, 22: 2, 23: 2, 24: 3, 31: 2}
OK	7658-08-4	C[C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O	{1: 1, 26: 1, 3: 4, 20: 4}
OK	76589-16-7	CCCCCC(C)(C)OC	{1: 4, 2: 4, 4: 1, 22: 1}
OK	7659-45-2	CC(CCl)C#N	{1: 1, 2: 1, 3: 1, 37: 1, 17: 1}
OK	7659-86-1	CCCCC(CC)COC(=O)CS	{1: 2, 2: 6, 3: 1, 28: 1, 39: 1}
OK	766-00-7	C1CCC(C1)CCO	{20: 1, 2: 2, 11: 4, 12: 1}
OK	766-03-0	C=CC1CCCC=C1	{14: 2, 11: 3, 12: 1, 5: 1, 6: 1}
OK	766-05-2	C1CCC(CC1)C#N	{11: 5, 12: 1, 37: 1}
OK	766-07-4	C1CCC(CC1)OO	{20: 1, 11: 5, 12: 1, 22: 1}
OK	766-09-6	CCN1CCCCC1	{1: 1, 2: 1, 11: 5, 33: 1}
OK	766-15-4	CC1(CCOCO1)C	{1: 2, 11: 3, 13: 1, 23: 2}
OK	766-17-6	C[C@@H]1CCC[C@@H](N1)C	{32: 1, 1: 2, 11: 3, 12: 2}
OK	766-20-1	CC1CCOC(O1)C	{1: 2, 11: 2, 12: 2, 23: 2}
OK	766-29-0	C1CCC2(C1)C=CC=C2	{11: 4, 13: 1, 14: 4}
OK	766-30-3	C1CC2(C=C1)C=CC=C2	{11: 2, 13: 1, 14: 6}
OK	766-32-5	CC12COC(OC1)OC2	{1: 1, 11: 3, 12: 1, 13: 1, 23: 3}
OK	766-38-1	C1(C(=C(C(=O)O1)Br)Br)O	{20: 1, 18: 2, 12: 1, 28: 1, 15: 2}
OK	766-66-5	C1CCC(C(=O)CC1)Cl	{17: 1, 11: 5, 12: 1, 25: 1}
OK	766-79-0	CC(C)N1CCCCC1	{11: 5, 1: 2, 3: 1, 33: 1}
OK	766-93-8	C1CCC(CC1)NC=O	{26: 1, 11: 5, 12: 1, 31: 1}
OK	7660-25-5	C1[C@H]([C@H]([C@@H]([C@](O1)(CO)O)O)O)O	{2: 1, 11: 1, 12: 3, 13: 1, 20: 5, 23: 1}
OK	7663-77-6	C1CC(=O)N(C1)CCCN	{25: 1, 2: 3, 11: 3, 30: 1, 33: 1}
OK	7664-39-3	F	{16: 1}
OK	7664-80-4	CCCCCCCCOC(=O)CS	{1: 1, 2: 8, 28: 1, 39: 1}
OK	76649-14-4	CCCCC=CC(C)O	{1: 2, 2: 3, 3: 1, 20: 1, 6: 2}
OK	76649-16-6	CCCCCC=CCCC(=O)OCC	{1: 2, 2: 7, 28: 1, 6: 2}
OK	76649-17-7	CCC=CCCOC(=O)C(=CCC)C	{1: 3, 2: 4, 28: 1, 6: 3, 7: 1}
OK	76649-18-8	CC(C)CCOC(=O)CCC=C	{1: 2, 2: 4, 3: 1, 5: 1, 6: 1, 28: 1}
OK	76649-19-9	CC1=C(C(CCC1)(C)C)CC(=C(C)OC(=O)C)C	{1: 6, 2: 1, 7: 2, 11: 3, 13: 1, 15: 2, 28: 1}
OK	76649-20-2	CCCCCC1C(CCC1O)C	{1: 2, 2: 4, 11: 2, 12: 3, 20: 1}
OK	76649-21-3	CCCCCC1C(CCC1OC(=O)C)C	{1: 3, 2: 4, 11: 2, 12: 3, 28: 1}
OK	76649-22-4	CCCCCC(=O)OCC=C(C)C	{1: 3, 2: 5, 28: 1, 6: 1, 7: 1}
OK	76649-23-5	CC(C)C(=O)OCC=C(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1, 28: 1}
OK	76649-24-6	CCCCC(=O)C1=C(CCCC1(C)C)C	{1: 4, 2: 3, 11: 3, 13: 1, 15: 2, 24: 1}
OK	76649-25-7	CCC=CCC=CCCO	{1: 1, 2: 4, 20: 1, 6: 4}
OK	76649-32-6	CN(CC=C)CC=C.C1C(O1)CCl.Cl	{1: 1, 2: 3, 5: 2, 6: 2, 33: 1, 11: 1, 12: 1, 17: 2, 23: 1}
OK	76649-33-7	CC(=O)O.CN(CC=C)CC=C.C1C(O1)CCl.Cl	{1: 2, 2: 3, 5: 2, 6: 2, 33: 1, 11: 1, 12: 1, 17: 2, 23: 1, 27: 1}
OK	7665-72-7	CC(C)(C)OCC1CO1	{1: 3, 2: 1, 4: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	7667-55-2	C[C@@H]1CCC[C@H](C1C)C	{1: 3, 11: 3, 12: 3}
OK	7667-76-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 49}
OK	7667-78-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 56}
OK	7667-80-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 58}
OK	7667-86-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 73}
OK	7667-88-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 78}
OK	767-03-3	C1C=CCC1CC(=O)O	{27: 1, 2: 1, 11: 2, 12: 1, 14: 2}
OK	767-05-5	C1CCC(C1)CCCO	{20: 1, 2: 3, 11: 4, 12: 1}
OK	767-08-8	C1CC(OC1)CCCO	{20: 1, 2: 3, 11: 3, 12: 1, 23: 1}
OK	767-10-2	CCCCN1CCCC1	{1: 1, 2: 3, 11: 4, 33: 1}
OK	767-12-4	CC1(CCCC(C1)O)C	{1: 2, 11: 4, 12: 1, 13: 1, 20: 1}
OK	767-55-5	CC1(COC(OC1)(C)C)C	{1: 4, 11: 2, 13: 2, 23: 2}
OK	767-92-0	C1CC[C@H]2[C@H](C1)CCCN2	{32: 1, 11: 7, 12: 2}
OK	7672-76-6	CC(CN1CCN(CC1)CC(C)O)O	{1: 2, 2: 2, 3: 2, 33: 2, 11: 4, 20: 2}
OK	7675-83-4	C(C[C@@H](C(=O)O)N)CN=C(N)N.C([C@@H](C(=O)O)N)C(=O)O	{2: 4, 3: 2, 7: 1, 34: 1, 27: 3, 30: 4}
OK	76754-43-3	CCCN(CCC)N=C(C)C	{1: 4, 2: 4, 34: 1, 33: 1, 7: 1}
OK	76754-44-4	CCCC(=NNCCC)CCC	{1: 3, 2: 6, 31: 1, 34: 1, 7: 1}
OK	76790-81-3	CCOC(=C=C(C(F)(F)F)C(F)(F)F)OCC	{1: 2, 2: 2, 4: 2, 7: 2, 8: 1, 16: 6, 22: 2}
OK	76792-22-8	CC(C)[C@H](C(=O)O)Br	{27: 1, 1: 2, 18: 1, 3: 2}
OK	768-46-7	C1CC2C3C2C=CC1C=C3	{11: 2, 12: 4, 14: 4}
OK	768-50-3	CC(=O)CC1=CCCCC1	{1: 1, 2: 1, 11: 4, 14: 1, 15: 1, 24: 1}
OK	768-66-1	CC1(CCCC(N1)(C)C)C	{32: 1, 1: 4, 11: 3, 13: 2}
OK	768-90-1	C1C2CC3CC1CC(C2)(C3)Br	{18: 1, 11: 6, 12: 3, 13: 1}
OK	768-91-2	CC12CC3CC(C1)CC(C3)C2	{1: 1, 11: 6, 12: 3, 13: 1}
OK	768-92-3	C1C2CC3CC1CC(C2)(C3)F	{16: 1, 11: 6, 12: 3, 13: 1}
OK	768-93-4	C1C2CC3CC1CC(C2)(C3)I	{19: 1, 11: 6, 12: 3, 13: 1}
OK	768-94-5	C1C2CC3CC1CC(C2)(C3)N	{11: 6, 12: 3, 13: 1, 30: 1}
OK	768-95-6	C1C2CC3CC1CC(C2)(C3)O	{20: 1, 11: 6, 12: 3, 13: 1}
OK	7680-73-1	C[N+]1=CC=CC=C1.[Cl-]	{1: 1, 33: 1, 14: 5, 17: 1}
OK	7681-84-7	C1CC(OC1)C=O	{26: 1, 11: 3, 12: 1, 23: 1}
OK	7681-93-8	CC1CC=CC=CC=CC=CC(CC2C(C(CC(O2)(CC(CC3C(O3)C=CC(=O)O1)O)O)O)C(=O)O)OC4C(C(C(C(O4)C)O)N)O	{1: 2, 11: 5, 12: 13, 13: 1, 14: 10, 20: 5, 22: 1, 23: 3, 27: 1, 28: 1, 30: 1}
OK	76822-93-0	CCCCC[C@@H](CCC)CC[C@H](CC)CC(=O)O	{27: 1, 1: 3, 2: 10, 3: 2}
OK	7685-44-1	C=CCC(C(=O)O)N	{2: 1, 3: 1, 5: 1, 6: 1, 27: 1, 30: 1}
OK	76858-53-2	CC(C)(C)SSN(C)C(=O)ON=C1SCCS1	{1: 4, 34: 1, 4: 1, 33: 1, 40: 2, 41: 2, 11: 2, 15: 1, 28: 1}
OK	7686-77-3	C1C=CCC1C(=O)O	{27: 1, 11: 2, 12: 1, 14: 2}
OK	7688-21-3	CCC/C=C\C	{1: 2, 2: 2, 6: 2}
OK	76899-35-9	CCCCCCCCCCCCCCCCCC=CC(=O)OC	{1: 2, 2: 16, 28: 1, 6: 2}
OK	769-42-6	CN1C(=O)CC(=O)N(C1=O)C	{1: 2, 11: 1, 33: 2, 25: 3}
OK	7694-45-3	CC(=C)C1CCC(=CC1)C(=O)O	{1: 1, 5: 1, 7: 1, 11: 3, 12: 1, 14: 1, 15: 1, 27: 1}
OK	7696-12-0	CC(=CC1C(C1(C)C)C(=O)OCN2C(=O)C3=C(C2=O)CCCC3)C	{1: 4, 2: 1, 33: 1, 6: 1, 7: 1, 11: 4, 12: 2, 13: 1, 15: 2, 25: 2, 28: 1}
OK	7697-09-8	C1CC2(CCC1CC2)Br	{18: 1, 11: 6, 12: 1, 13: 1}
OK	7697-14-5	COC12CCC(CC1)CC2	{1: 1, 11: 6, 12: 1, 13: 1, 22: 1}
OK	7699-31-2	CCNNCC.Cl.Cl	{1: 2, 2: 2, 31: 2, 17: 2}
OK	77-02-1	CC(C)C1(C(=O)NC(=O)NC1=O)CC=C	{32: 2, 1: 2, 2: 1, 3: 1, 5: 1, 6: 1, 13: 1, 25: 3}
OK	77-03-2	CCC1(C(=O)CCNC1=O)CC	{32: 1, 1: 2, 2: 2, 11: 2, 13: 1, 25: 2}
OK	77-04-3	CCC1(C(=O)C=CNC1=O)CC	{32: 1, 1: 2, 2: 2, 13: 1, 14: 2, 25: 2}
OK	77-06-5	C[C@@]12[C@H](C=C[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@](C4)(C(=C)C5)O)C(=O)O)OC2=O)O	{1: 1, 5: 1, 11: 4, 12: 4, 13: 4, 14: 2, 15: 1, 20: 2, 27: 1, 28: 1}
OK	77-16-7	C/C=C/1\[C@H]2[C@@]3(C=C[C@H]4[C@@H]3[C@@H](O2)OC=C4C(=O)OC)OC1=O	{1: 2, 6: 1, 12: 4, 13: 1, 14: 3, 15: 2, 23: 2, 28: 2}
OK	77-19-0	CCN(CC)CCOC(=O)C1(CCCCC1)C2CCCCC2	{1: 2, 2: 4, 33: 1, 11: 10, 12: 1, 13: 1, 28: 1}
OK	77-24-7	CCC(CCC(C)C)(C(=O)OCC)C(=O)OCC	{1: 5, 2: 5, 3: 1, 4: 1, 28: 2}
OK	77-25-8	CCC(CC)(C(=O)OCC)C(=O)OCC	{1: 4, 2: 4, 4: 1, 28: 2}
OK	77-26-9	CC(C)CC1(C(=O)NC(=O)NC1=O)CC=C	{32: 2, 1: 2, 2: 2, 3: 1, 5: 1, 6: 1, 13: 1, 25: 3}
OK	77-28-1	CCCCC1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 2, 2: 4, 13: 1, 25: 3}
OK	77-30-5	CCCCCCC1(C(=O)NC(=O)NC1=O)CC	{32: 2, 1: 2, 2: 6, 13: 1, 25: 3}
OK	77-47-4	C1(=C(C(C(=C1Cl)Cl)(Cl)Cl)Cl)Cl	{17: 6, 13: 1, 15: 4}
OK	77-48-5	CC1(C(=O)N(C(=O)N1Br)Br)C	{1: 2, 18: 2, 33: 2, 13: 1, 25: 2}
OK	77-49-6	CC(CO)(CO)[N+](=O)[O-]	{1: 1, 2: 2, 4: 1, 38: 1, 20: 2}
OK	77-52-1	C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O	{1: 7, 11: 9, 12: 6, 13: 5, 14: 1, 15: 1, 20: 1, 27: 1}
OK	77-53-2	C[C@@H]1CC[C@@H]2[C@]13CC[C@@]([C@H](C3)C2(C)C)(C)O	{1: 4, 11: 5, 12: 3, 13: 3, 20: 1}
OK	77-59-8	C[C@H]1CC[C@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O)C)C)C)NC1	{32: 1, 1: 4, 11: 11, 12: 9, 13: 3, 20: 1, 23: 1}
OK	77-60-1	C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1	{1: 4, 11: 11, 12: 9, 13: 3, 20: 1, 23: 2}
OK	77-65-6	CCC(CC)(C(=O)NC(=O)N)Br	{1: 2, 2: 2, 4: 1, 18: 1, 24: 2, 30: 1, 31: 1}
OK	77-66-7	CCC(CC)(C(=O)NC(=O)NC(=O)C)Br	{1: 3, 2: 2, 4: 1, 18: 1, 24: 3, 31: 2}
OK	77-67-8	CCC1(CC(=O)NC1=O)C	{32: 1, 1: 2, 2: 1, 11: 1, 13: 1, 25: 2}
OK	77-68-9	CC(C)C(C(C)(C)COC(=O)C(C)C)O	{1: 6, 2: 1, 3: 3, 4: 1, 20: 1, 28: 1}
OK	77-70-3	CCC(C)(C(=O)OCC)O	{1: 3, 2: 2, 4: 1, 20: 1, 28: 1}
OK	77-71-4	CC1(C(=O)NC(=O)N1)C	{32: 2, 1: 2, 13: 1, 25: 2}
OK	77-73-6	C1C=CC2C1C3CC2C=C3	{11: 2, 12: 4, 14: 4}
OK	77-74-7	CCC(C)(CC)O	{1: 3, 2: 2, 4: 1, 20: 1}
OK	77-75-8	CCC(C)(C#C)O	{1: 2, 2: 1, 4: 1, 9: 1, 10: 1, 20: 1}
OK	77-76-9	CC(C)(OC)OC	{1: 4, 4: 1, 22: 2}
OK	77-84-9	CCC(C)(CO)CO	{1: 2, 2: 3, 4: 1, 20: 2}
OK	77-85-0	CC(CO)(CO)CO	{1: 1, 2: 3, 4: 1, 20: 3}
OK	77-86-1	C(C(CO)(CO)N)O	{20: 3, 2: 3, 4: 1, 30: 1}
OK	77-89-4	CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)OC(=O)C	{1: 4, 2: 5, 4: 1, 28: 4}
OK	77-90-7	CCCCOC(=O)CC(CC(=O)OCCCC)(C(=O)OCCCC)OC(=O)C	{1: 4, 2: 11, 4: 1, 28: 4}
OK	77-92-9	C(C(=O)O)C(CC(=O)O)(C(=O)O)O	{20: 1, 2: 2, 27: 3, 4: 1}
OK	77-93-0	CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)O	{1: 3, 2: 5, 4: 1, 20: 1, 28: 3}
OK	77-94-1	CCCCOC(=O)CC(CC(=O)OCCCC)(C(=O)OCCCC)O	{1: 3, 2: 11, 4: 1, 20: 1, 28: 3}
OK	77-95-2	C1[C@H](C([C@@H](CC1(C(=O)O)O)O)O)O	{27: 1, 20: 4, 11: 2, 12: 3, 13: 1}
OK	77-99-6	CCC(CO)(CO)CO	{1: 1, 2: 4, 4: 1, 20: 3}
OK	770-69-4	CCC12CC3CC(C1)CC(C3)C2	{1: 1, 2: 1, 11: 6, 12: 3, 13: 1}
OK	770-71-8	C1C2CC3CC1CC(C2)(C3)CO	{20: 1, 2: 1, 11: 6, 12: 3, 13: 1}
OK	77027-84-0	C[C@@H](C(=O)OCC(C)C)O	{1: 3, 2: 1, 3: 2, 20: 1, 28: 1}
OK	77046-61-8	CCCCCCCCCCCCCCCCCCCCCCCCCCCC=C	{1: 1, 2: 26, 5: 1, 6: 1}
OK	7707-70-2	CCCN=CCC	{1: 2, 2: 3, 34: 1, 6: 1}
OK	77078-18-3	CCCOCCOC	{1: 2, 2: 4, 22: 2}
OK	771-10-8	CCOC(=O)C1C(C1(C)C)(C)C	{1: 5, 2: 1, 12: 1, 13: 2, 28: 1}
OK	7713-69-1	CCC(C)NC	{1: 3, 2: 1, 3: 1, 31: 1}
OK	77171-55-2	C[C@]1(CC[C@H]2[C@H]1[C@@H]3[C@@H](C3(C)C)CCC2=C)O	{1: 3, 5: 1, 11: 4, 12: 4, 13: 2, 15: 1, 20: 1}
OK	7719-79-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 50}
OK	7719-80-4	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 51}
OK	7719-83-7	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 60}
OK	7719-85-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 76}
OK	7719-87-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 62}
OK	7719-88-2	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 63}
OK	7719-89-3	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 64}
OK	7719-90-6	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 65}
OK	7719-93-9	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 68}
OK	7719-95-1	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 80}
OK	772-60-1	CC(=O)OC1CCCCCCC1	{1: 1, 11: 7, 12: 1, 28: 1}
OK	77209-76-8	C1=CC2C(O2)C(C1O)O	{20: 2, 12: 4, 14: 2, 23: 1}
OK	7722-84-1	OO	{20: 2}
OK	77251-49-1	CCCC(C)C(=O)N1CCC=CC1	{1: 2, 2: 2, 3: 1, 33: 1, 11: 3, 14: 2, 24: 1}
OK	7726-11-6	C(=O)Br	{18: 1, 26: 1}
OK	7726-95-6	BrBr	{18: 2}
OK	77287-29-7	C[C@H](C(=O)OC)Cl	{1: 2, 3: 1, 28: 1, 17: 1}
OK	773-14-8	C1(C(C(OC1(F)F)(F)F)(F)F)(F)F	{16: 8, 13: 4, 23: 1}
OK	773-34-2	COC12CCC(CC1)(CC2)C(=O)O	{27: 1, 1: 1, 11: 6, 13: 2, 22: 1}
OK	773-41-1	CC1OCC2(CO1)COC(OC2)C	{1: 2, 11: 4, 12: 2, 13: 1, 23: 4}
OK	7730-42-9	CCOC(=O)CCN1CCC1	{1: 1, 2: 3, 11: 3, 28: 1, 33: 1}
OK	7731-02-4	C1CCC(CC1)N2CCCC2	{33: 1, 11: 9, 12: 1}
OK	7731-28-4	C[C@H]1CC[C@@H](O)CC1	{1: 1, 11: 4, 12: 2, 20: 1}
OK	7731-29-5	C[C@H]1CC[C@H](O)CC1	{1: 1, 11: 4, 12: 2, 20: 1}
OK	77337-54-3	CCCN(C=O)N	{1: 1, 2: 2, 26: 1, 30: 1, 33: 1}
OK	7735-33-3	CCCCC(=O)OCCCl	{1: 1, 2: 5, 28: 1, 17: 1}
OK	7735-38-8	C(CCCCCCO)CCCCCC(=O)O	{2: 12, 27: 1, 20: 1}
OK	7735-42-4	C(CCCCCCCCO)CCCCCCCO	{2: 16, 20: 2}
OK	7735-43-5	C(CCCCCCCCCCO)CCCCCCCCCO	{2: 20, 20: 2}
OK	7735-44-6	C(CCCCCCC#N)CCCCCC#N	{2: 12, 37: 2}
OK	7736-35-8	CCC=CC1CC1	{1: 1, 2: 1, 11: 2, 12: 1, 6: 2}
OK	77379-00-1	C1CC2(CC1C2)Br	{18: 1, 11: 4, 12: 1, 13: 1}
OK	7738-93-4	C[C@]12CC(=O)[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)C=C[C@]34C	{1: 2, 11: 5, 12: 3, 13: 2, 14: 3, 15: 1, 25: 3}
OK	77392-54-2	CC(C)C(CO)[N+](=O)[O-]	{1: 2, 2: 1, 3: 2, 20: 1, 38: 1}
OK	774-05-0	CCOC(=O)C1CCCCCC1=O	{1: 1, 2: 1, 11: 5, 12: 1, 25: 1, 28: 1}
OK	774-64-1	CCCCC=C1C(=C(C(=O)O1)C)C	{1: 3, 2: 3, 28: 1, 6: 1, 15: 3}
OK	77402-03-0	COC(C(=O)OC)NC(=O)C=C	{1: 2, 3: 1, 5: 1, 6: 1, 22: 1, 24: 1, 28: 1, 31: 1}
OK	77422-57-2	C1CC2CCC1C34C2(CC3)CC4	{11: 8, 12: 2, 13: 2}
OK	77431-37-9	CC(=C)C(=O)O.CC(=O)CC(C)(C)NC(=O)C=C	{1: 4, 2: 1, 4: 1, 5: 2, 6: 1, 7: 1, 24: 2, 27: 1, 31: 1}
OK	77439-76-0	C1(C(=C(C(=O)O1)Cl)C(Cl)Cl)O	{3: 1, 12: 1, 15: 2, 17: 3, 20: 1, 28: 1}
OK	77464-06-3	CC(C)CN(CC(C)C)C(=O)N	{1: 4, 2: 2, 3: 2, 33: 1, 24: 1, 30: 1}
OK	77469-44-4	C(CSSCCNC(=O)N(CCCl)N=O)NC(=O)N(CCCl)N=O	{33: 2, 2: 8, 40: 2, 34: 2, 17: 2, 24: 2, 29: 2, 31: 2}
OK	7747-35-5	CCC12COCN1COC2	{33: 1, 2: 1, 1: 1, 11: 4, 13: 1, 23: 2}
OK	7747-84-4	CC#CCl	{1: 1, 10: 2, 17: 1}
OK	77471-71-7	C1CSCCC1=C(F)F	{15: 1, 16: 2, 11: 4, 41: 1, 7: 1}
OK	77471-73-9	C=C1CCC2CSCCC2C1	{41: 1, 11: 6, 12: 2, 5: 1, 15: 1}
OK	77495-66-0	CCCCCC[C@@H]1CO1	{1: 1, 2: 5, 11: 1, 12: 1, 23: 1}
OK	775-51-9	C1(=C(C(C(=C(C1(F)F)F)F)(F)F)F)F	{16: 8, 13: 2, 15: 4}
OK	775-75-7	CC1(CCCCC1)OC(=O)C(F)(F)F	{1: 1, 4: 1, 11: 5, 13: 1, 16: 3, 28: 1}
OK	7755-92-2	C1CN(CCN1)C=O	{32: 1, 33: 1, 26: 1, 11: 4}
OK	7759-35-5	CC(=O)[C@]1(C(=C)C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@H]34)C)OC(=O)C	{1: 3, 5: 1, 11: 7, 12: 4, 13: 2, 14: 1, 15: 2, 24: 1, 25: 1, 28: 1}
OK	776-19-2	C12C(N(C(=O)N1Cl)Cl)N(C(=O)N2Cl)Cl	{17: 4, 12: 2, 33: 4, 25: 2}
OK	77613-68-4	C1C=CCC1(F)F	{16: 2, 11: 2, 13: 1, 14: 2}
OK	77614-53-0	C=CC1CC(C1)C=C	{11: 2, 12: 2, 5: 2, 6: 2}
OK	77614-69-8	C1CC=CC2CCC2C=C1	{11: 4, 12: 2, 14: 4}
OK	77627-49-7	C1CC2=C1C(=O)C=CC2=O	{25: 2, 11: 2, 14: 2, 15: 2}
OK	77627-56-6	C1CC2C1C(=O)C=CC2=O	{25: 2, 11: 2, 12: 2, 14: 2}
OK	7763-77-1	C1C(O1)Cl	{17: 1, 11: 1, 12: 1, 23: 1}
OK	77635-32-6	CCCCCCCCCCCCC1=C/C(=C/NO)/C(=O)C=C1	{1: 1, 2: 11, 6: 1, 14: 3, 15: 2, 20: 1, 25: 1, 31: 1}
OK	7764-50-3	CC1CCC(CC1=O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 2, 25: 1}
OK	7764-95-6	C[C@H](C(=O)O)NC(=O)OC(C)(C)C	{1: 4, 3: 1, 4: 1, 27: 1, 28: 1, 31: 1}
OK	7766-48-5	C=CCCCI	{2: 3, 19: 1, 5: 1, 6: 1}
OK	7766-50-9	C=CCCCCCCCCCBr	{2: 9, 18: 1, 5: 1, 6: 1}
OK	7766-51-0	C=CCCI	{2: 2, 19: 1, 5: 1, 6: 1}
OK	7766-61-2	CC(C)CCCOC(=O)C(=C)C	{1: 3, 2: 3, 3: 1, 5: 1, 7: 1, 28: 1}
OK	77698-19-2	CCC(=O)CN(CC(=O)CC)N=O	{1: 2, 2: 4, 33: 1, 34: 1, 24: 2, 29: 1}
OK	77698-20-5	CCC(=O)CN(CC(=O)C)N=O	{1: 2, 2: 3, 33: 1, 34: 1, 24: 2, 29: 1}
OK	7771-44-0	CCCCCC=CCC=CCC=CCC=CCCCC(=O)O	{1: 1, 2: 10, 27: 1, 6: 8}
OK	7773-83-3	CCCCCCCCCCCCCCCCCCCCCCS	{1: 1, 2: 21, 39: 1}
OK	7774-65-4	CC1=CCC(CC1)C(C)(C)OC(=O)C(C)C	{1: 5, 3: 1, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 28: 1}
OK	7774-82-5	CCCCCCCCCCC=CC=O	{1: 1, 2: 9, 26: 1, 6: 2}
OK	7775-50-0	CCCCCCCCCCCCCCCCCCOC(=O)CC(CC(=O)OCCCCCCCCCCCCCCCCCC)(C(=O)OCCCCCCCCCCCCCCCCCC)O	{1: 3, 2: 53, 4: 1, 20: 1, 28: 3}
OK	77753-24-3	C(C(C(C(Cl)Cl)Cl)Cl)Cl	{17: 5, 2: 1, 3: 3}
OK	7778-85-0	CC(COC)OC	{1: 3, 2: 1, 3: 1, 22: 2}
OK	7778-87-2	CCCCCCC(=O)OCCC	{1: 2, 2: 7, 28: 1}
OK	7779-27-3	CCN1CN(CN(C1)CC)CC	{1: 3, 2: 3, 11: 3, 33: 3}
OK	7779-30-8	CCC(=O)/C=C/C1C(=CCCC1(C)C)C	{1: 4, 2: 1, 6: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	7779-31-9	CC1CC(CC(C1)(C)C)OC(=O)C(=C)C	{1: 4, 5: 1, 7: 1, 11: 3, 12: 2, 13: 1, 28: 1}
OK	7779-41-1	CCCCCCCCCC(OC)OC	{1: 3, 2: 8, 3: 1, 22: 2}
OK	7779-70-6	CCCCCCCCC(=O)OCCC(C)C	{1: 3, 2: 9, 3: 1, 28: 1}
OK	7779-73-9	CC(C)CC(=O)OC1CC2CCC1(C2(C)C)C	{1: 5, 2: 1, 3: 1, 11: 3, 12: 2, 13: 2, 28: 1}
OK	7779-75-1	CC(C)COC(=O)CC(=O)C	{24: 1, 1: 3, 2: 2, 3: 1, 28: 1}
OK	7779-80-8	CCCCCCC(=O)OCC(C)C	{1: 3, 2: 6, 3: 1, 28: 1}
OK	7779-81-9	CC=C(C)C(=O)OCC(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 7: 1, 28: 1}
OK	77791-69-6	CCOC(=O)CONC1=CC=CC=CO1	{1: 1, 2: 2, 14: 5, 15: 1, 22: 1, 23: 1, 28: 1, 31: 1}
OK	778-18-7	CC1(C(=O)C(C(=O)C(C1=O)(C)C)(C)C)C	{1: 6, 13: 3, 25: 3}
OK	7781-74-0	C1C2C=CC1C3C2C4C5C3C6C4C6C5	{11: 2, 12: 10, 14: 2}
OK	7782-41-4	FF	{16: 2}
OK	7782-44-7	O=O	{29: 2}
OK	7782-50-5	ClCl	{17: 2}
OK	7782-68-5	OI(=O)=O	{19: 1, 20: 1, 29: 2}
OK	7782-77-6	N(=O)O	{34: 1, 20: 1, 29: 1}
OK	7782-94-7	N[N+](=O)[O-]	{38: 1, 30: 1}
OK	7783-41-7	O(F)F	{16: 2, 22: 1}
OK	7783-44-0	O(OF)F	{16: 2, 22: 2}
OK	7783-54-2	N(F)(F)F	{16: 3, 33: 1}
OK	7783-66-6	FI(F)(F)(F)F	{16: 5, 19: 1}
OK	7785-26-4	CC1=CC[C@H]2C[C@@H]1C2(C)C	{1: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1}
OK	7785-33-3	CC=C(C)C(=O)OCC=C(C)CCC=C(C)C	{1: 5, 2: 3, 28: 1, 6: 3, 7: 3}
OK	7785-63-9	CCCCCOC(=O)C(=CC)C	{1: 3, 2: 4, 28: 1, 6: 1, 7: 1}
OK	7785-64-0	CCCCOC(=O)/C(=C\C)/C	{1: 3, 2: 3, 28: 1, 6: 1, 7: 1}
OK	7785-66-2	CCCCOC(=O)/C(=C/C)/C	{1: 3, 2: 3, 28: 1, 6: 1, 7: 1}
OK	7785-70-8	CC1=CC[C@@H]2C[C@H]1C2(C)C	{1: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1}
OK	77855-81-3	C[C@H]1CC[C@]2(C[C@@H]3C[C@H](O2)C/C=C(/C[C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)\C)O[C@@H]1C(C)C	{1: 6, 3: 1, 11: 7, 12: 8, 13: 2, 14: 5, 15: 3, 20: 2, 23: 3, 28: 1}
OK	7786-29-0	CCCCCCC(C)C=O	{1: 2, 2: 5, 3: 1, 26: 1}
OK	7786-58-5	CCCCCCCCOC(=O)CC(C)C	{1: 3, 2: 8, 3: 1, 28: 1}
OK	77877-19-1	CCC(=O)N1[C@H](COC1=O)C(C)C	{1: 3, 2: 1, 3: 1, 33: 1, 11: 1, 12: 1, 24: 1, 28: 1}
OK	77877-94-2	CCCCC(=O)OCCl	{1: 1, 2: 4, 28: 1, 17: 1}
OK	77877-95-3	CCCCCCCCC(=O)OCCl	{1: 1, 2: 8, 28: 1, 17: 1}
OK	77877-96-4	CCCCCCCCCCC(=O)OCCl	{1: 1, 2: 10, 28: 1, 17: 1}
OK	7789-25-5	N(=O)F	{16: 1, 34: 1, 29: 1}
OK	7789-31-3	OBr(=O)=O	{18: 1, 20: 1, 29: 2}
OK	7789-33-5	BrI	{18: 1, 19: 1}
OK	7789-90-4	C(C(C=O)(Cl)Cl)Cl	{17: 3, 2: 1, 4: 1, 26: 1}
OK	7789-92-6	CCOCCC(OCC)OCC	{1: 3, 2: 5, 3: 1, 22: 3}
OK	7789-99-3	CCCC(C)COC(=O)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	77893-24-4	CC1=C(NCN1)CSCCN=C(NC#N)N(C)N=O	{32: 2, 1: 2, 2: 3, 33: 1, 7: 1, 40: 1, 11: 1, 34: 2, 15: 2, 37: 1, 29: 1, 31: 1}
OK	7790-01-4	CC(=O)OC(C)(C#N)C#N	{1: 2, 4: 1, 37: 2, 28: 1}
OK	7790-03-6	CC(OCCC#N)OC(=O)C=C	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 22: 1, 28: 1, 37: 1}
OK	7790-07-0	CCC(CC)COCCOC(=O)CCCCC(=O)OCCOCC(CC)CC	{1: 4, 2: 14, 3: 2, 28: 2, 22: 2}
OK	7790-12-7	CC(C)OC(=O)CCCCCCN	{1: 2, 2: 6, 3: 1, 28: 1, 30: 1}
OK	7790-89-8	FCl	{16: 1, 17: 1}
OK	7790-92-3	OCl	{17: 1, 20: 1}
OK	7790-93-4	OCl(=O)=O	{17: 1, 20: 1, 29: 2}
OK	7790-99-0	ClI	{17: 1, 19: 1}
OK	7791-21-1	O(Cl)Cl	{17: 2, 22: 1}
OK	77922-38-4	CCCSCC(C)C(C)(C#CC(=C)C)O	{1: 4, 2: 3, 3: 1, 4: 1, 5: 1, 7: 1, 40: 1, 10: 2, 20: 1}
OK	77928-86-0	CCCCC(C(CCCC)Br)Br	{1: 2, 2: 6, 3: 2, 18: 2}
OK	77934-87-3	C[C@@H]1CCC(C(C1)O[C@H]2C=CC(=O)O2)C(C)C	{1: 3, 3: 1, 11: 3, 12: 4, 14: 2, 22: 1, 28: 1}
OK	7795-91-7	CCC(C)OCCO	{1: 2, 2: 3, 3: 1, 20: 1, 22: 1}
OK	7796-54-5	CC=CI	{1: 1, 19: 1, 6: 2}
OK	7796-72-7	CCOC(=O)CC(C)(C)C=C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 1, 28: 1}
OK	7796-73-8	CC(C)(CC(=O)O)C=C	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 27: 1}
OK	78-01-3	CCC1(CCCCC1)CC	{1: 2, 2: 2, 11: 5, 13: 1}
OK	78-09-1	CCOC(OCC)(OCC)OCC	{1: 4, 2: 4, 4: 1, 22: 4}
OK	78-12-6	C(C(COC(C(Cl)(Cl)Cl)O)(COC(C(Cl)(Cl)Cl)O)COC(C(Cl)(Cl)Cl)O)OC(C(Cl)(Cl)Cl)O	{2: 4, 3: 4, 4: 5, 17: 12, 20: 4, 22: 4}
OK	78-15-9	CCCCC(=O)OCC(CC)(COC(=O)CCCC)COC(=O)CCCC	{1: 4, 2: 13, 4: 1, 28: 3}
OK	78-17-1	CCCCCCCCCC(=O)OCC(CC)(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCCC	{1: 4, 2: 28, 4: 1, 28: 3}
OK	78-18-2	C1CCC(CC1)(O)OOC2(CCCCC2)OO	{11: 10, 20: 2, 13: 2, 22: 3}
OK	78-19-3	C=CC1OCC2(CO1)COC(OC2)C=C	{5: 2, 6: 2, 11: 4, 12: 2, 13: 1, 23: 4}
OK	78-24-0	C(C(CO)(CO)COCC(CO)(CO)COCC(CO)(CO)CO)O	{20: 8, 2: 12, 4: 3, 22: 2}
OK	78-26-2	CCCC(C)(CO)CO	{1: 2, 2: 4, 4: 1, 20: 2}
OK	78-27-3	C#CC1(CCCCC1)O	{9: 1, 10: 1, 11: 5, 20: 1, 13: 1}
OK	78-28-4	CCC(C)(CC)OC(=O)N	{1: 3, 2: 2, 4: 1, 30: 1, 28: 1}
OK	78-35-3	CC(C)C(=O)OC(C)(CCC=C(C)C)C=C	{1: 5, 2: 2, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	78-36-4	CCCC(=O)OC(C)(CCC=C(C)C)C=C	{1: 4, 2: 4, 4: 1, 5: 1, 6: 2, 7: 1, 28: 1}
OK	78-39-7	CCOC(C)(OCC)OCC	{1: 4, 2: 3, 4: 1, 22: 3}
OK	78-44-4	CCCC(C)(COC(=O)N)COC(=O)NC(C)C	{1: 4, 2: 4, 3: 1, 4: 1, 28: 2, 30: 1, 31: 1}
OK	78-54-6	C1CCC(CC1)(C#CC2(CCCCC2)O)O	{10: 2, 11: 10, 20: 2, 13: 2}
OK	78-59-1	CC1=CC(=O)CC(C1)(C)C	{1: 3, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	78-63-7	CC(C)(C)OOC(C)(C)CCC(C)(C)OOC(C)(C)C	{1: 10, 2: 2, 4: 4, 22: 4}
OK	78-66-0	CCC(C)(C#CC(C)(CC)O)O	{1: 4, 2: 2, 4: 2, 10: 2, 20: 2}
OK	78-67-1	CC(C)(C#N)N=NC(C)(C)C#N	{1: 4, 34: 2, 4: 2, 37: 2}
OK	78-69-3	CCC(C)(CCCC(C)C)O	{1: 4, 2: 4, 3: 1, 4: 1, 20: 1}
OK	78-70-6	CC(=CCCC(C)(C=C)O)C	{1: 3, 2: 2, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	78-71-7	C1C(CO1)(CCl)CCl	{17: 2, 2: 2, 11: 2, 13: 1, 23: 1}
OK	78-74-0	C(C(Br)Br)Br	{2: 1, 3: 1, 18: 3}
OK	78-75-1	CC(CBr)Br	{1: 1, 2: 1, 3: 1, 18: 2}
OK	78-76-2	CCC(C)Br	{1: 2, 2: 1, 3: 1, 18: 1}
OK	78-77-3	CC(C)CBr	{1: 2, 2: 1, 3: 1, 18: 1}
OK	78-78-4	CCC(C)C	{1: 3, 2: 1, 3: 1}
OK	78-79-5	CC(=C)C=C	{1: 1, 5: 2, 6: 1, 7: 1}
OK	78-80-8	CC(=C)C#C	{1: 1, 10: 1, 9: 1, 5: 1, 7: 1}
OK	78-81-9	CC(C)CN	{1: 2, 2: 1, 3: 1, 30: 1}
OK	78-82-0	CC(C)C#N	{1: 2, 3: 1, 37: 1}
OK	78-83-1	CC(C)CO	{1: 2, 2: 1, 3: 1, 20: 1}
OK	78-84-2	CC(C)C=O	{1: 2, 26: 1, 3: 1}
OK	78-85-3	CC(=C)C=O	{1: 1, 26: 1, 5: 1, 7: 1}
OK	78-86-4	CCC(C)Cl	{1: 2, 2: 1, 3: 1, 17: 1}
OK	78-87-5	CC(CCl)Cl	{1: 1, 2: 1, 3: 1, 17: 2}
OK	78-88-6	C=C(CCl)Cl	{17: 2, 2: 1, 5: 1, 7: 1}
OK	78-89-7	CC(CO)Cl	{1: 1, 2: 1, 3: 1, 20: 1, 17: 1}
OK	78-90-0	CC(CN)N	{1: 1, 2: 1, 3: 1, 30: 2}
OK	78-92-2	CCC(C)O	{1: 2, 2: 1, 3: 1, 20: 1}
OK	78-93-3	CCC(=O)C	{24: 1, 1: 2, 2: 1}
OK	78-94-4	CC(=O)C=C	{24: 1, 1: 1, 5: 1, 6: 1}
OK	78-95-5	CC(=O)CCl	{24: 1, 1: 1, 2: 1, 17: 1}
OK	78-96-6	CC(CN)O	{1: 1, 2: 1, 3: 1, 20: 1, 30: 1}
OK	78-97-7	CC(C#N)O	{1: 1, 3: 1, 20: 1, 37: 1}
OK	78-98-8	CC(=O)C=O	{24: 1, 1: 1, 26: 1}
OK	78-99-9	CCC(Cl)Cl	{1: 1, 2: 1, 3: 1, 17: 2}
OK	78024-33-6	CC(C(=O)OC(C)C(=O)OC(C)C(=O)O)O	{27: 1, 1: 3, 3: 3, 20: 1, 28: 2}
OK	7803-49-8	NO	{20: 1, 30: 1}
OK	78031-35-3	CCCC(C)OC(=O)C(Cl)(Cl)Cl	{1: 2, 2: 2, 3: 1, 4: 1, 17: 3, 28: 1}
OK	78104-88-8	CC1(CC1)C#N	{1: 1, 11: 2, 13: 1, 37: 1}
OK	78111-17-8	CC1CCC2(CCCCO2)OC1C(C)CC(C3C(=C)C(C4C(O3)CCC5(O4)CCC(O5)C=CC(C)C6CC(=CC7(O6)C(CCC(O7)CC(C)(C(=O)O)O)O)C)O)O	{1: 5, 2: 2, 3: 3, 4: 1, 5: 1, 6: 2, 11: 13, 12: 10, 13: 3, 14: 1, 15: 2, 20: 4, 23: 7, 27: 1}
OK	78128-80-0	CCCCC1=C(COC1=O)O	{1: 1, 2: 3, 11: 1, 15: 2, 20: 1, 28: 1}
OK	78128-81-1	C1CCC(CC1)C2=C(COC2=O)O	{20: 1, 11: 6, 12: 1, 28: 1, 15: 2}
OK	78128-84-4	CCCCCCCCC1C(=CC(=O)O1)O	{1: 1, 2: 7, 12: 1, 14: 1, 15: 1, 20: 1, 28: 1}
OK	78232-23-2	C1=C/C(=C\[NH+]=O)/N(C=C1)CCCCCCN2/C(=C/[NH+]=O)/C=CC=C2.[Br-].[Br-]	{33: 2, 2: 6, 6: 2, 14: 8, 15: 2, 18: 2, 29: 2, 31: 2}
OK	78263-32-8	CC(C)(C)CC(OC)OC	{1: 5, 2: 1, 3: 1, 4: 1, 22: 2}
OK	78266-08-7	CCOC(=O)C=C.C/C=C/C(=O)OC=C.CC(=C)C(=O)O	{1: 3, 2: 1, 5: 3, 6: 4, 7: 1, 27: 1, 28: 2}
OK	78280-50-9	CC(CO)OC(=O)C(=C)C.C=CC(=O)O	{1: 2, 2: 1, 3: 1, 5: 2, 6: 1, 7: 1, 20: 1, 27: 1, 28: 1}
OK	78307-76-3	CN(C)N1C=CC=C1	{1: 2, 14: 4, 33: 2}
OK	78338-32-6	CC1CC(CN(C1)N=O)C	{1: 2, 34: 1, 33: 1, 11: 3, 12: 2, 29: 1}
OK	78339-21-6	CCC1CO1.CC1CO1.C1CO1	{1: 2, 2: 1, 11: 4, 12: 2, 23: 3}
OK	78343-32-5	C(C(NF)(F)F)(C(F)(F)F)F	{16: 7, 3: 1, 4: 2, 31: 1}
OK	78352-82-6	C/C(=C\CC/C=C(\C)/CCCCCCC(=O)OC[C@H]1CO1)/CCCCCCC(=O)O	{1: 2, 2: 15, 6: 2, 7: 2, 11: 1, 12: 1, 23: 1, 27: 1, 28: 1}
OK	78355-52-9	C1CO1.C(CO)O.C(=O)(N)N	{2: 2, 11: 2, 20: 2, 23: 1, 24: 1, 30: 2}
OK	78385-26-9	CC1(COC1)CBr	{1: 1, 2: 1, 11: 2, 13: 1, 18: 1, 23: 1}
OK	78417-28-4	CCC=CCC=CC=CC(=O)OCC	{1: 2, 2: 3, 28: 1, 6: 6}
OK	78448-33-6	CC(C)COC(C)C	{1: 4, 2: 1, 3: 2, 22: 1}
OK	78455-93-3	CCCCN(C(=O)CCC)N=O	{1: 2, 2: 5, 33: 1, 34: 1, 24: 1, 29: 1}
OK	78497-35-5	C1CC2(CCC1CC2)N=NC34CCC(CC3)CC4	{34: 2, 11: 12, 12: 2, 13: 2}
OK	78497-36-6	C1CC2(CC1C2)N=NC34CCC(C3)C4	{34: 2, 11: 8, 12: 2, 13: 2}
OK	78508-96-0	C1=CC(=O)O[C@@H]1CO	{20: 1, 2: 1, 12: 1, 14: 2, 28: 1}
OK	78521-95-6	C1CCC2C(C(C1)OO2)Br	{18: 1, 11: 4, 12: 3, 23: 2}
OK	78535-39-4	C1CC2C(C(C1)OO2)Br	{18: 1, 11: 3, 12: 3, 23: 2}
OK	78543-39-2	CCCCCCCCCCCC(=O)O.C(COCCO)N	{1: 1, 2: 14, 20: 1, 22: 1, 27: 1, 30: 1}
OK	78596-31-3	C=C[CH]C#C	{9: 1, 10: 1, 5: 1, 6: 2}
OK	78631-45-5	CC(C)C(CCC=C)O	{1: 2, 2: 2, 3: 2, 5: 1, 6: 1, 20: 1}
OK	787-07-5	CCOC(=O)C1CC(=O)C(CC1=O)C(=O)OCC	{1: 2, 2: 2, 11: 2, 12: 2, 25: 2, 28: 2}
OK	78776-28-0	CCCCNNCCCC.Cl.Cl	{1: 2, 2: 6, 31: 2, 17: 2}
OK	78851-23-7	CC(C)CCCCCCCCCCCCCCC(=O)Cl	{24: 1, 1: 2, 2: 14, 3: 1, 17: 1}
OK	78888-18-3	CC(C)(C)OC(=O)NCC=C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 1, 28: 1, 31: 1}
OK	78950-25-1	C#CC#CC#CC#CC#CC#N	{9: 1, 10: 9, 37: 1}
OK	78957-08-1	CC=C=C=O	{8: 2, 1: 1, 29: 1, 6: 1}
OK	78957-21-8	C1=CC(C=C1)C(=O)Cl	{24: 1, 17: 1, 12: 1, 14: 4}
OK	78957-22-9	C(=C=O)Br	{8: 1, 18: 1, 29: 1, 6: 1}
OK	78989-37-4	CCC/C=C/CCC(=O)OCC	{1: 2, 2: 5, 28: 1, 6: 2}
OK	78995-60-5	C1C2CC3(C2C1C3)Br	{18: 1, 11: 3, 12: 3, 13: 1}
OK	79-00-5	C(C(Cl)Cl)Cl	{17: 3, 2: 1, 3: 1}
OK	79-01-6	C(=C(Cl)Cl)Cl	{17: 3, 6: 1, 7: 1}
OK	79-02-7	C(=O)C(Cl)Cl	{17: 2, 26: 1, 3: 1}
OK	79-03-8	CCC(=O)Cl	{24: 1, 1: 1, 2: 1, 17: 1}
OK	79-04-9	C(C(=O)Cl)Cl	{24: 1, 17: 2, 2: 1}
OK	79-05-0	CCC(=O)N	{24: 1, 1: 1, 2: 1, 30: 1}
OK	79-06-1	C=CC(=O)N	{24: 1, 30: 1, 5: 1, 6: 1}
OK	79-07-2	C(C(=O)N)Cl	{24: 1, 17: 1, 2: 1, 30: 1}
OK	79-08-3	C(C(=O)O)Br	{2: 1, 27: 1, 18: 1}
OK	79-09-4	CCC(=O)O	{1: 1, 2: 1, 27: 1}
OK	79-10-7	C=CC(=O)O	{27: 1, 5: 1, 6: 1}
OK	79-11-8	C(C(=O)O)Cl	{17: 1, 2: 1, 27: 1}
OK	79-14-1	C(C(=O)O)O	{2: 1, 27: 1, 20: 1}
OK	79-15-2	CC(=O)NBr	{24: 1, 1: 1, 18: 1, 31: 1}
OK	79-16-3	CC(=O)NC	{24: 1, 1: 2, 31: 1}
OK	79-17-4	C(=NN)(N)N	{34: 1, 30: 3, 7: 1}
OK	79-20-9	CC(=O)OC	{1: 2, 28: 1}
OK	79-21-0	CC(=O)OO	{1: 1, 20: 1, 28: 1}
OK	79-22-1	COC(=O)Cl	{1: 1, 28: 1, 17: 1}
OK	79-24-3	CC[N+](=O)[O-]	{1: 1, 2: 1, 38: 1}
OK	79-27-6	C(C(Br)Br)(Br)Br	{18: 4, 3: 2}
OK	79-28-7	C(=C(Br)Br)(Br)Br	{18: 4, 7: 2}
OK	79-29-8	CC(C)C(C)C	{1: 4, 3: 2}
OK	79-30-1	CC(C)C(=O)Cl	{24: 1, 1: 2, 3: 1, 17: 1}
OK	79-31-2	CC(C)C(=O)O	{27: 1, 1: 2, 3: 1}
OK	79-34-5	C(C(Cl)Cl)(Cl)Cl	{17: 4, 3: 2}
OK	79-35-6	C(=C(Cl)Cl)(F)F	{16: 2, 17: 2, 7: 2}
OK	79-36-7	C(C(=O)Cl)(Cl)Cl	{24: 1, 17: 3, 3: 1}
OK	79-37-8	C(=O)(C(=O)Cl)Cl	{24: 2, 17: 2}
OK	79-38-9	C(=C(F)Cl)(F)F	{16: 3, 17: 1, 7: 2}
OK	79-39-0	CC(=C)C(=O)N	{24: 1, 1: 1, 5: 1, 30: 1, 7: 1}
OK	79-41-4	CC(=C)C(=O)O	{1: 1, 27: 1, 5: 1, 7: 1}
OK	79-42-5	CC(C(=O)O)S	{27: 1, 1: 1, 3: 1, 39: 1}
OK	79-43-6	C(C(=O)O)(Cl)Cl	{27: 1, 17: 2, 3: 1}
OK	79-44-7	CN(C)C(=O)Cl	{24: 1, 1: 2, 33: 1, 17: 1}
OK	79-46-9	CC(C)[N+](=O)[O-]	{1: 2, 3: 1, 38: 1}
OK	79-47-0	C(=C(F)F)(C(F)(F)Cl)F	{16: 5, 17: 1, 4: 1, 7: 2}
OK	79-49-2	C(C(=O)C(Br)(Br)Br)(Br)Br	{24: 1, 18: 5, 3: 1, 4: 1}
OK	79-50-5	CC1(COC(=O)C1O)C	{1: 2, 11: 1, 12: 1, 13: 1, 20: 1, 28: 1}
OK	79-52-7	C(=O)(C(F)(F)Cl)C(F)(Cl)Cl	{16: 3, 17: 3, 4: 2, 24: 1}
OK	79-53-8	C(=O)(C(F)(F)F)C(F)(F)Cl	{16: 5, 17: 1, 4: 2, 24: 1}
OK	79-55-0	CC1(CCCC(N1C)(C)C)C	{1: 5, 11: 3, 13: 2, 33: 1}
OK	79-58-3	C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)CC4[C@@]3([C@H](C[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)O)C)C	{1: 4, 33: 1, 11: 9, 12: 10, 13: 2, 14: 1, 15: 1, 20: 2}
OK	79-63-0	CC(CCC=C(C)C)C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C	{1: 8, 2: 2, 3: 1, 6: 1, 7: 1, 11: 8, 12: 3, 13: 4, 15: 2, 20: 1}
OK	79-64-1	CC#C[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H](C4=CC(=O)CC[C@]34C)C)C)O	{1: 4, 10: 2, 11: 7, 12: 4, 13: 3, 14: 1, 15: 1, 20: 1, 25: 1}
OK	79-68-5	C[C@@H]1CCC(=C)[C@@H](C1(C)C)/C=C/C(=O)C	{1: 4, 5: 1, 6: 2, 11: 2, 12: 2, 13: 1, 15: 1, 24: 1}
OK	79-69-6	CC1CC=C(C(C1(C)C)C=CC(=O)C)C	{1: 5, 6: 2, 11: 1, 12: 2, 13: 1, 14: 1, 15: 1, 24: 1}
OK	79-70-9	CC1CCC(=C(C1(C)C)/C=C/C(=O)C)C	{1: 5, 6: 2, 11: 2, 12: 1, 13: 1, 15: 2, 24: 1}
OK	79-76-5	CC(=O)/C=C/C1C(=C)CCCC1(C)C	{1: 3, 5: 1, 6: 2, 11: 3, 12: 1, 13: 1, 15: 1, 24: 1}
OK	79-77-6	CC1=C(C(CCC1)(C)C)C=CC(=O)C	{1: 4, 6: 2, 11: 3, 13: 1, 15: 2, 24: 1}
OK	79-78-7	CC1=CCCC(C1C=CC(=O)CCC=C)(C)C	{1: 3, 2: 2, 5: 1, 6: 3, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 1}
OK	79-81-2	CCCCCCCCCCCCCCCC(=O)OC/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(CCCC1(C)C)C	{1: 6, 2: 15, 6: 6, 7: 2, 11: 3, 13: 1, 15: 2, 28: 1}
OK	79-83-4	CC(C)(CO)[C@H](C(=O)NCCC(=O)O)O	{1: 2, 2: 3, 3: 1, 4: 1, 20: 2, 24: 1, 27: 1, 31: 1}
OK	79-89-0	CC1=C(C(CCC1)(C)C)C=C(C)C(=O)C	{1: 5, 6: 1, 7: 1, 11: 3, 13: 1, 15: 2, 24: 1}
OK	79-91-4	CC1(C(CC(=O)O1)C(=O)O)C	{1: 2, 11: 1, 12: 1, 13: 1, 27: 1, 28: 1}
OK	79-92-5	CC1(C2CCC(C2)C1=C)C	{1: 2, 5: 1, 11: 3, 12: 2, 13: 1, 15: 1}
OK	79032-48-7	CC(=O)NC(C(=O)O)C(C)(C)SN=O	{1: 3, 34: 1, 3: 1, 4: 1, 40: 1, 24: 1, 27: 1, 29: 1, 31: 1}
OK	79042-54-9	CC1CC(C(C1C)C)C	{1: 4, 11: 1, 12: 4}
OK	79053-92-2	CCC[C@](C)(OO)OOC(C)(C)CCC(C)C	{1: 6, 2: 4, 3: 1, 4: 2, 20: 1, 22: 3}
OK	79069-14-0	CC(C)[C@@H](CO)NC(=O)OC(C)(C)C	{1: 5, 2: 1, 3: 2, 4: 1, 20: 1, 28: 1, 31: 1}
OK	79099-07-3	CC(C)(C)OC(=O)N1CCC(=O)CC1	{1: 3, 4: 1, 33: 1, 11: 4, 25: 1, 28: 1}
OK	79185-77-6	CCC12CO[C@H](N1[C@@H](OC2)C(C)C)C(C)C	{1: 5, 2: 1, 3: 2, 33: 1, 11: 2, 12: 2, 13: 1, 23: 2}
OK	79200-57-0	C1[C@@H]([C@H]([C@H]([C@@H]1N)O)O)CO.Cl	{2: 1, 11: 1, 12: 4, 17: 1, 20: 3, 30: 1}
OK	79274-28-5	CC1CO1.CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.CC(C)(CO)CO.C1CO1	{1: 6, 2: 3, 34: 2, 4: 1, 8: 2, 11: 6, 12: 2, 13: 2, 20: 2, 23: 2, 29: 2}
OK	79286-74-1	CC(=O)NC1CCNC1	{32: 1, 1: 1, 11: 3, 12: 1, 24: 1, 31: 1}
OK	79356-83-5	C1C2C1C3C2C=C3	{11: 1, 12: 4, 14: 2}
OK	79372-58-0	C=CC(=O)O.C1CCC(C(C1)C(=O)OCC2CO2)C(=O)OCC3CO3.C(CCCN=C=O)CCN=C=O	{2: 8, 5: 1, 6: 1, 8: 2, 11: 6, 12: 4, 34: 2, 23: 2, 27: 1, 28: 2, 29: 2}
OK	79392-43-1	CCCCCCCCCCCCCCCCCCOC(=O)C(F)(F)F	{16: 3, 1: 1, 2: 17, 4: 1, 28: 1}
OK	79424-03-6	CCOC(=O)C#CC(F)(F)F	{1: 1, 2: 1, 4: 1, 10: 2, 16: 3, 28: 1}
OK	79435-04-4	C[C@H](C(=O)OC(C)C)Cl	{1: 3, 3: 2, 28: 1, 17: 1}
OK	79448-03-6	CC(=O)OCCCCN(CCC(=O)OC)N=O	{1: 2, 2: 6, 33: 1, 34: 1, 28: 2, 29: 1}
OK	79504-02-2	C(C(Cl)(Cl)Br)(Cl)(Cl)Cl	{17: 5, 18: 1, 4: 2}
OK	79513-25-0	C1C[C@H](NC1)C(=O)NCC(=O)NCC(=O)O	{32: 1, 2: 2, 11: 3, 12: 1, 24: 2, 27: 1, 31: 2}
OK	79517-49-0	CC1C(C1(F)F)C=C	{1: 1, 5: 1, 6: 1, 12: 2, 13: 1, 16: 2}
OK	79517-52-5	C/C=C/C1CC1(F)F	{1: 1, 6: 2, 11: 1, 12: 1, 13: 1, 16: 2}
OK	79593-50-3	CC(C)(C)C(=C)C(=O)OC	{1: 4, 4: 1, 5: 1, 28: 1, 7: 1}
OK	79604-66-3	CC(=C)CC(C)(CC(=C)C)O	{1: 3, 2: 2, 4: 1, 5: 2, 7: 2, 20: 1}
OK	79605-62-2	C/C=C/C(C1CCCCC1)O	{1: 1, 3: 1, 6: 2, 11: 5, 12: 1, 20: 1}
OK	79637-74-4	C=CC(=O)OC1CCC2C1C3CCC2C3	{28: 1, 11: 5, 12: 5, 5: 1, 6: 1}
OK	79644-47-6	CC12C3=CC=C1C=CC2=CC=C3	{1: 1, 13: 1, 14: 7, 15: 3}
OK	79660-25-6	C=CCN(CC1OCCO1)C(=O)C(Cl)Cl	{33: 1, 2: 2, 3: 1, 5: 1, 6: 1, 11: 2, 12: 1, 17: 2, 23: 2, 24: 1}
OK	79676-97-4	CN1CCN(CCN(CCN(CCN(CCN(CC1)C)C)C)C)C	{1: 6, 11: 12, 33: 6}
OK	797-63-7	CCC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34	{1: 1, 2: 1, 9: 1, 10: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	797-64-8	CC[C@@]12CC[C@@H]3[C@@H]([C@H]1CC[C@@]2(C#C)O)CCC4=CC(=O)CC[C@@H]34	{1: 1, 2: 1, 9: 1, 10: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1, 25: 1}
OK	79710-86-4	C1COCC1C=O	{26: 1, 11: 3, 12: 1, 23: 1}
OK	79720-19-7	CCCCCCCCCCCCC1CC(=O)N(C1=O)C2CC(NC(C2)(C)C)(C)C	{32: 1, 1: 5, 2: 11, 33: 1, 11: 3, 12: 2, 13: 2, 25: 2}
OK	79771-03-2	CCCCCCCCCCCCCCCCCCOCCC	{1: 2, 2: 19, 22: 1}
OK	79771-22-5	CC1CO1.C=CC(=O)OCCO.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O.C1CO1	{1: 1, 2: 3, 5: 1, 6: 1, 8: 2, 11: 11, 12: 5, 34: 2, 20: 1, 23: 2, 28: 1, 29: 2}
OK	79808-30-3	CC(C)(C)OCC(O)COC(C)(C)C	{1: 6, 2: 2, 3: 1, 4: 2, 20: 1, 22: 2}
OK	79869-58-2	C1CCC(CC1)NC(=O)NC(=O)N	{24: 2, 11: 5, 12: 1, 30: 1, 31: 2}
OK	799-34-8	C1C(O1)COCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	{2: 2, 3: 1, 4: 5, 11: 1, 12: 1, 16: 12, 22: 1, 23: 1}
OK	79947-84-5	CCCCOC(=O)/C=C/CC	{1: 2, 2: 4, 28: 1, 6: 2}
OK	80-25-1	CC1CCC(CC1)C(C)(C)OC(=O)C	{1: 4, 11: 4, 4: 1, 12: 2, 28: 1}
OK	80-26-2	CC1=CCC(CC1)C(C)(C)OC(=O)C	{1: 4, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 28: 1}
OK	80-27-3	CCC(=O)OC(C)(C)C1CCC(=CC1)C	{1: 4, 2: 1, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 28: 1}
OK	80-47-7	CC1CCC(CC1)C(C)(C)OO	{1: 3, 4: 1, 11: 4, 12: 2, 20: 1, 22: 1}
OK	80-52-4	CC1(CCC(CC1)C(C)(C)N)N	{1: 3, 4: 1, 11: 4, 12: 1, 13: 1, 30: 2}
OK	80-53-5	CC1(CCC(CC1)C(C)(C)O)O	{1: 3, 4: 1, 11: 4, 12: 1, 13: 1, 20: 2}
OK	80-55-7	CCOC(=O)C(C)(C)O	{1: 3, 2: 1, 4: 1, 20: 1, 28: 1}
OK	80-56-8	CC1=CCC2CC1C2(C)C	{1: 3, 11: 2, 12: 2, 13: 1, 14: 1, 15: 1}
OK	80-57-9	CC1=CC(=O)C2CC1C2(C)C	{1: 3, 11: 1, 12: 2, 13: 1, 14: 1, 15: 1, 25: 1}
OK	80-58-0	CCC(C(=O)O)Br	{27: 1, 1: 1, 2: 1, 3: 1, 18: 1}
OK	80-59-1	C/C=C(\C)/C(=O)O	{1: 2, 27: 1, 6: 1, 7: 1}
OK	80-62-6	CC(=C)C(=O)OC	{1: 2, 28: 1, 5: 1, 7: 1}
OK	80-63-7	COC(=O)C(=C)Cl	{1: 1, 17: 1, 5: 1, 28: 1, 7: 1}
OK	80-68-2	CC(C(C(=O)O)N)O	{27: 1, 1: 1, 3: 2, 20: 1, 30: 1}
OK	80-69-3	C(C(=O)O)(C(=O)O)O	{27: 2, 3: 1, 20: 1}
OK	80-70-6	CN(C)C(=N)N(C)C	{1: 4, 36: 1, 33: 2, 7: 1}
OK	80-71-7	CC1=C(C(=O)CC1)O	{1: 1, 11: 2, 20: 1, 25: 1, 15: 2}
OK	80-72-8	C1CC(=O)C(=C1O)O	{25: 1, 11: 2, 20: 2, 15: 2}
OK	80-73-9	CN1CCN(C1=O)C	{1: 2, 11: 2, 33: 2, 25: 1}
OK	80-75-1	CC(=O)[C@H]1CC[C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C	{1: 3, 11: 7, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1, 24: 1, 25: 1}
OK	80-78-4	C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C)C	{1: 4, 33: 1, 11: 10, 12: 9, 13: 2, 14: 1, 15: 1, 20: 1}
OK	80-97-7	CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 9, 12: 6, 13: 2, 20: 1}
OK	80-99-9	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	800-24-8	COCCOC1=C(C(=O)C(=C(C1=O)N2CC2)OCCOC)N3CC3	{1: 2, 2: 4, 33: 2, 11: 4, 15: 4, 22: 4, 25: 2}
OK	8001-79-4	CCCCCCC(O)C/C=C\CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C\CC(O)CCCCCC)COC(=O)CCCCCCC/C=C\CC(O)CCCCCC	{1: 3, 2: 41, 3: 4, 6: 6, 20: 3, 28: 3}
OK	8003-19-8	CC(CCl)Cl.C(C=CCl)Cl	{1: 1, 2: 2, 3: 1, 6: 2, 17: 4}
OK	801-52-5	CC1=C(C(=O)C2=C(C1=O)N3C[C@H]4[C@@H]([C@@]3([C@@H]2COC(=O)N)OC)N4C)N	{1: 3, 2: 1, 33: 2, 11: 1, 12: 3, 13: 1, 15: 4, 22: 1, 25: 2, 28: 1, 30: 2}
OK	8013-17-0	C(C(C(C(C(C=O)O)O)O)O)O.C(C(C(C(C(=O)CO)O)O)O)O	{24: 1, 2: 3, 3: 7, 20: 10, 26: 1}
OK	80156-16-7	C1=CC(C=C1)O	{20: 1, 12: 1, 14: 4}
OK	8017-59-2	C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(CO)O.C[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(C=O)O	{1: 4, 2: 3, 34: 4, 7: 4, 12: 28, 13: 2, 20: 15, 22: 4, 23: 4, 26: 1, 30: 8, 31: 2}
OK	80192-56-9	CC(CC=C)C=C(C)CO	{1: 2, 2: 2, 3: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	80201-75-8	C1CC1N=NC2CC2	{34: 2, 11: 4, 12: 2}
OK	8025-81-8	CC1CC=CC=CC(C(CC(C(C(C(CC(=O)O1)O)OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)O)(C)O)N(C)C)O)CC=O)C)OC4CCC(C(O4)C)N(C)C	{1: 11, 2: 1, 33: 2, 11: 6, 12: 18, 13: 1, 14: 4, 20: 4, 22: 4, 23: 3, 26: 1, 28: 1}
OK	80308-82-3	C(C([N+](=O)[O-])([N+](=O)[O-])F)N(COCC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-]	{33: 1, 2: 3, 4: 2, 38: 5, 16: 2, 22: 1}
OK	80308-83-4	C(C([N+](=O)[O-])([N+](=O)[O-])F)N(COCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 1, 2: 3, 4: 2, 38: 6, 16: 1, 22: 1}
OK	80308-84-5	C(CC([N+](=O)[O-])([N+](=O)[O-])F)CN(COC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-]	{33: 1, 2: 4, 4: 2, 38: 5, 16: 2, 22: 1}
OK	80308-88-9	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OC(N[N+](=O)[O-])OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{2: 2, 3: 1, 4: 2, 38: 7, 22: 2, 31: 1}
OK	80308-90-3	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])OCN(CN(CN(COCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]	{33: 3, 2: 6, 4: 2, 38: 9, 22: 2}
OK	80308-92-5	C(CN(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{16: 1, 33: 1, 2: 3, 4: 2, 38: 6}
OK	80308-93-6	C(C([N+](=O)[O-])([N+](=O)[O-])F)N(CN(CC([N+](=O)[O-])([N+](=O)[O-])F)[N+](=O)[O-])[N+](=O)[O-]	{16: 2, 33: 2, 2: 3, 4: 2, 38: 6}
OK	80325-37-7	CC(CCC=C(C)C)Cl	{1: 3, 2: 2, 3: 1, 6: 1, 7: 1, 17: 1}
OK	80339-91-9	C\1C#CC/C=C\C=C1	{10: 2, 11: 2, 14: 4}
OK	80418-50-4	CCCC(C(=O)OCCl)Cl	{1: 1, 2: 3, 3: 1, 28: 1, 17: 2}
OK	80418-52-6	CC(CCC(=O)OCCl)Cl	{1: 1, 2: 3, 3: 1, 28: 1, 17: 2}
OK	80418-53-7	CCCCC(C(=O)OCCl)Cl	{1: 1, 2: 4, 3: 1, 28: 1, 17: 2}
OK	80418-54-8	CCCC(CC(=O)OCCl)Cl	{1: 1, 2: 4, 3: 1, 28: 1, 17: 2}
OK	80418-55-9	CCC(CCC(=O)OCCl)Cl	{1: 1, 2: 4, 3: 1, 28: 1, 17: 2}
OK	80418-56-0	CC(CCCC(=O)OCCl)Cl	{1: 1, 2: 4, 3: 1, 28: 1, 17: 2}
OK	80418-57-1	C(CCC(=O)OCCl)CCCl	{17: 2, 2: 6, 28: 1}
OK	80418-58-2	CCCCCC(C(=O)OCCl)Cl	{1: 1, 2: 5, 3: 1, 28: 1, 17: 2}
OK	80418-59-3	CCCCC(CC(=O)OCCl)Cl	{1: 1, 2: 5, 3: 1, 28: 1, 17: 2}
OK	80418-60-6	CCCC(CCC(=O)OCCl)Cl	{1: 1, 2: 5, 3: 1, 28: 1, 17: 2}
OK	80418-62-8	CC(CCCCC(=O)OCCl)Cl	{1: 1, 2: 5, 3: 1, 28: 1, 17: 2}
OK	80418-63-9	C(CCCCl)CCC(=O)OCCl	{17: 2, 2: 7, 28: 1}
OK	80418-64-0	CCCCCCC(C(=O)OCCl)Cl	{1: 1, 2: 6, 3: 1, 28: 1, 17: 2}
OK	80418-65-1	CCCCCC(CC(=O)OCCl)Cl	{1: 1, 2: 6, 3: 1, 28: 1, 17: 2}
OK	80418-66-2	CCCCC(CCC(=O)OCCl)Cl	{1: 1, 2: 6, 3: 1, 28: 1, 17: 2}
OK	80418-67-3	CCCC(CCCC(=O)OCCl)Cl	{1: 1, 2: 6, 3: 1, 28: 1, 17: 2}
OK	80418-68-4	CCC(CCCCC(=O)OCCl)Cl	{1: 1, 2: 6, 3: 1, 28: 1, 17: 2}
OK	80418-69-5	CC(CCCCCC(=O)OCCl)Cl	{1: 1, 2: 6, 3: 1, 28: 1, 17: 2}
OK	80418-70-8	C(CCCC(=O)OCCl)CCCCl	{17: 2, 2: 8, 28: 1}
OK	80418-71-9	CCCCCCCC(C(=O)OCCl)Cl	{1: 1, 2: 7, 3: 1, 28: 1, 17: 2}
OK	80418-72-0	CCCCCCC(CC(=O)OCCl)Cl	{1: 1, 2: 7, 3: 1, 28: 1, 17: 2}
OK	80418-73-1	CCCCCC(CCC(=O)OCCl)Cl	{1: 1, 2: 7, 3: 1, 28: 1, 17: 2}
OK	80418-74-2	CCCCC(CCCC(=O)OCCl)Cl	{1: 1, 2: 7, 3: 1, 28: 1, 17: 2}
OK	80418-75-3	CCCC(CCCCC(=O)OCCl)Cl	{1: 1, 2: 7, 3: 1, 28: 1, 17: 2}
OK	80418-76-4	CCC(CCCCCC(=O)OCCl)Cl	{1: 1, 2: 7, 3: 1, 28: 1, 17: 2}
OK	80418-77-5	CC(CCCCCCC(=O)OCCl)Cl	{1: 1, 2: 7, 3: 1, 28: 1, 17: 2}
OK	80418-78-6	C(CCCCCl)CCCC(=O)OCCl	{17: 2, 2: 9, 28: 1}
OK	80418-79-7	CCCCCCCCC(C(=O)OCCl)Cl	{1: 1, 2: 8, 3: 1, 28: 1, 17: 2}
OK	80418-81-1	CCCCCCC(CCC(=O)OCCl)Cl	{1: 1, 2: 8, 3: 1, 28: 1, 17: 2}
OK	80418-82-2	CCCCCC(CCCC(=O)OCCl)Cl	{1: 1, 2: 8, 3: 1, 28: 1, 17: 2}
OK	80418-84-4	CCCC(CCCCCC(=O)OCCl)Cl	{1: 1, 2: 8, 3: 1, 28: 1, 17: 2}
OK	80418-85-5	CCC(CCCCCCC(=O)OCCl)Cl	{1: 1, 2: 8, 3: 1, 28: 1, 17: 2}
OK	80418-86-6	CC(CCCCCCCC(=O)OCCl)Cl	{1: 1, 2: 8, 3: 1, 28: 1, 17: 2}
OK	80418-88-8	CCCCCCCCCC(C(=O)OCCl)Cl	{1: 1, 2: 9, 3: 1, 28: 1, 17: 2}
OK	80418-91-3	CCCCCCC(CCCC(=O)OCCl)Cl	{1: 1, 2: 9, 3: 1, 28: 1, 17: 2}
OK	80418-92-4	CCCCCC(CCCCC(=O)OCCl)Cl	{1: 1, 2: 9, 3: 1, 28: 1, 17: 2}
OK	80418-93-5	CCCCC(CCCCCC(=O)OCCl)Cl	{1: 1, 2: 9, 3: 1, 28: 1, 17: 2}
OK	80418-94-6	CCCC(CCCCCCC(=O)OCCl)Cl	{1: 1, 2: 9, 3: 1, 28: 1, 17: 2}
OK	80418-95-7	CCC(CCCCCCCC(=O)OCCl)Cl	{1: 1, 2: 9, 3: 1, 28: 1, 17: 2}
OK	80418-96-8	CC(CCCCCCCCC(=O)OCCl)Cl	{1: 1, 2: 9, 3: 1, 28: 1, 17: 2}
OK	80418-97-9	C(CCCCCCl)CCCCC(=O)OCCl	{17: 2, 2: 11, 28: 1}
OK	80418-98-0	CCCCCCCCCCC(C(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80418-99-1	CCCCCCCCCC(CC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80419-00-7	CCCCCCCCC(CCC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80419-01-8	CCCCCCCC(CCCC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80419-02-9	CCCCCCC(CCCCC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80419-03-0	CCCCCC(CCCCCC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80419-04-1	CCCCC(CCCCCCC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80419-05-2	CCCC(CCCCCCCC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80419-06-3	CCC(CCCCCCCCC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80419-07-4	CC(CCCCCCCCCC(=O)OCCl)Cl	{1: 1, 2: 10, 3: 1, 28: 1, 17: 2}
OK	80482-35-5	C(CCCl)CC(=O)OCCl	{17: 2, 2: 5, 28: 1}
OK	8052-41-3	CC(=O)O.C(CCCBr)CCO	{1: 1, 2: 6, 27: 1, 20: 1, 18: 1}
OK	80555-73-3	CC(C)NC1=CC(=O)CC(C1)(C)C	{1: 4, 3: 1, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1, 31: 1}
OK	80584-96-9	CCCCCCCCCCCC(=O)Cl.F	{16: 1, 1: 1, 2: 10, 24: 1, 17: 1}
OK	80584-97-0	CCCCCCCCCCCCCC(=O)Cl.F	{16: 1, 1: 1, 2: 12, 24: 1, 17: 1}
OK	8063-77-2	C(=O)=O.O=O	{8: 1, 29: 4}
OK	8065-71-2	C(C(CF)O)F.C(C(CCl)O)F	{16: 3, 17: 1, 2: 4, 3: 2, 20: 2}
OK	80657-57-4	C[C@@H](CO)C(=O)OC	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	8067-82-1	CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C.CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C	{1: 6, 2: 1, 11: 16, 12: 12, 13: 4, 20: 2, 24: 2, 25: 2, 28: 1}
OK	8070-50-6	C1CO1.C(=O)=O	{8: 1, 11: 2, 29: 2, 23: 1}
OK	80748-58-9	CC1C2CCC(C2)(C1(C)C)C3(CCCCC3)O	{1: 3, 11: 8, 12: 2, 13: 3, 20: 1}
OK	80789-66-8	CNC1CCCCCCCCC1	{1: 1, 11: 9, 12: 1, 31: 1}
OK	808-48-0	CC12CCC3C(C1CCC2C(=O)COC(=O)C(C)(C)C)CCC4=CC(=O)CCC34C	{1: 5, 2: 1, 4: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 24: 1, 25: 1, 28: 1}
OK	80839-91-4	C/C=C/N1CC1	{1: 1, 11: 2, 6: 2, 33: 1}
OK	80839-92-5	CC/C=C/N1CC1	{1: 1, 2: 1, 11: 2, 6: 2, 33: 1}
OK	80839-93-6	CC(=CN1CC1)C	{1: 2, 11: 2, 33: 1, 6: 1, 7: 1}
OK	80839-94-7	CC/C=C\N1CC1	{1: 1, 2: 1, 11: 2, 6: 2, 33: 1}
OK	80864-10-4	CC(C)(CC(C)(C)O)CO	{1: 4, 2: 2, 4: 2, 20: 2}
OK	80866-93-9	CC1(CC(=O)C=C(O1)C(=O)O)C	{1: 2, 11: 1, 13: 1, 14: 1, 15: 1, 23: 1, 25: 1, 27: 1}
OK	80879-54-5	C=C(F)F.C1(=C(F)F)OC(C(O1)(F)F)(C(F)(F)F)F	{4: 1, 5: 1, 7: 2, 13: 2, 15: 1, 16: 10, 23: 2}
OK	80933-75-1	CCC(=O)C1=NCCCC1	{1: 1, 2: 1, 35: 1, 11: 4, 15: 1, 24: 1}
OK	80958-25-4	CC(C)(C)C#CC(F)(F)F	{16: 3, 1: 3, 10: 2, 4: 2}
OK	80997-84-8	CCCCCCC(=O)C#N	{24: 1, 1: 1, 2: 5, 37: 1}
OK	81-21-0	C1C2C3CC4C(C3C1C5C2O5)O4	{11: 2, 12: 8, 23: 2}
OK	81-23-2	CC(CCC(=O)O)C1CCC2C1(C(=O)CC3C2C(=O)CC4C3(CCC(=O)C4)C)C	{1: 3, 2: 2, 3: 1, 11: 7, 12: 5, 13: 2, 25: 3, 27: 1}
OK	81-25-4	C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C	{1: 3, 2: 2, 3: 1, 11: 7, 12: 8, 13: 2, 20: 3, 27: 1}
OK	811-93-8	CC(C)(CN)N	{1: 2, 2: 1, 4: 1, 30: 2}
OK	811-94-9	CC(CF)(F)F	{16: 3, 1: 1, 2: 1, 4: 1}
OK	811-95-0	C(C(F)(Cl)Cl)Cl	{16: 1, 17: 3, 2: 1, 4: 1}
OK	811-97-2	C(C(F)(F)F)F	{16: 4, 2: 1, 4: 1}
OK	81103-11-9	CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)OC)C)C)O)(C)O	{1: 14, 2: 1, 33: 1, 11: 3, 12: 15, 13: 3, 20: 4, 22: 4, 23: 2, 25: 1, 28: 1}
OK	81132-44-7	C[C@@](CO)(C(=O)O)N	{1: 1, 2: 1, 4: 1, 20: 1, 27: 1, 30: 1}
OK	81142-02-1	C=CSCCCl	{40: 1, 17: 1, 2: 2, 5: 1, 6: 1}
OK	81156-87-8	CC/C=C/N1CCC1	{1: 1, 2: 1, 11: 3, 6: 2, 33: 1}
OK	81156-88-9	CC(=CN1CCC1)C	{1: 2, 11: 3, 33: 1, 6: 1, 7: 1}
OK	81156-89-0	CCC(=CC)N1CCC1	{1: 2, 2: 1, 6: 1, 33: 1, 11: 3, 7: 1}
OK	81190-28-5	C1C(O1)CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	{2: 1, 4: 4, 11: 1, 12: 1, 16: 9, 23: 1}
OK	812-03-3	CC(C(Cl)(Cl)Cl)Cl	{1: 1, 3: 1, 4: 1, 17: 4}
OK	812-04-4	C(C(F)(Cl)Cl)(F)F	{16: 3, 17: 2, 3: 1, 4: 1}
OK	81228-87-7	C1CC(C1)OC(=O)Cl	{17: 1, 11: 3, 12: 1, 28: 1}
OK	81236-55-7	COC(=O)CCC(Cl)Cl	{1: 1, 2: 2, 3: 1, 28: 1, 17: 2}
OK	81280-12-8	CCC=C(C)C(CC)O	{1: 3, 2: 2, 3: 1, 6: 1, 7: 1, 20: 1}
OK	813-44-5	C(=O)(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(C(F)(F)F)F	{16: 14, 24: 1, 4: 6}
OK	813-46-7	COC(=O)C(C(Cl)(Cl)Cl)(Cl)Cl	{1: 1, 4: 2, 28: 1, 17: 5}
OK	813-58-1	CCC(CC)(CC)C(=O)O	{1: 3, 2: 3, 27: 1, 4: 1}
OK	813-60-5	CCC(C)C(C)(CO)CO	{1: 3, 2: 3, 3: 1, 4: 1, 20: 2}
OK	813-74-1	C(C(C#N)(Cl)Cl)Cl	{17: 3, 2: 1, 4: 1, 37: 1}
OK	81360-42-1	C1C(CN(CN1[N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{33: 2, 11: 3, 13: 1, 38: 4}
OK	814-67-5	CC(CS)S	{1: 1, 2: 1, 3: 1, 39: 2}
OK	814-68-6	C=CC(=O)Cl	{24: 1, 17: 1, 5: 1, 6: 1}
OK	814-75-5	CC(C(=O)C)Br	{24: 1, 1: 2, 18: 1, 3: 1}
OK	814-78-8	CC(=C)C(=O)C	{24: 1, 1: 2, 5: 1, 7: 1}
OK	81406-87-3	CCC=C.O=S=O	{1: 1, 2: 1, 5: 1, 6: 1, 40: 1, 29: 2}
OK	81424-67-1	CC(=O)N(C(=O)NC)OC(=O)NC	{24: 2, 1: 3, 28: 1, 33: 1, 31: 2}
OK	81478-74-2	CC1(C=CC(=C2C=CC(C=C2)(C)C)C=C1)C	{1: 4, 13: 2, 14: 8, 15: 2}
OK	815-06-5	CNC(=O)C(F)(F)F	{16: 3, 1: 1, 4: 1, 24: 1, 31: 1}
OK	815-17-8	CC(C)(C)C(=O)C(=O)O	{24: 1, 1: 3, 27: 1, 4: 1}
OK	815-24-7	CC(C)(C)C(=O)C(C)(C)C	{24: 1, 1: 6, 4: 2}
OK	815-57-6	CC(C(=O)C)C(=O)C	{24: 2, 1: 3, 3: 1}
OK	815-58-7	C(=C(Cl)Cl)(C(=O)Cl)Cl	{24: 1, 17: 4, 7: 2}
OK	815-62-3	CN(C)C(=C)N(C)C	{1: 4, 33: 2, 5: 1, 7: 1}
OK	815-66-7	CC(C)(C)C(C(=O)C(C)(C)C)O	{24: 1, 1: 6, 3: 1, 4: 2, 20: 1}
OK	815-68-9	CC(=O)C(C(=O)C)C(=O)C	{24: 3, 1: 3, 3: 1}
OK	816-11-5	CCC(CC)C(=O)OC	{1: 3, 2: 2, 3: 1, 28: 1}
OK	816-16-0	CCCC(CC)C(=O)OC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	816-19-3	CCCCC(CC)C(=O)OC	{1: 3, 2: 4, 3: 1, 28: 1}
OK	816-39-7	C(C(=O)CBr)Br	{24: 1, 2: 2, 18: 2}
OK	816-40-0	CCC(=O)CBr	{24: 1, 1: 1, 2: 2, 18: 1}
OK	816-50-2	CCCCOC(=O)C(C)(C)O	{1: 3, 2: 3, 4: 1, 20: 1, 28: 1}
OK	816-57-9	CCCN(C(=O)N)N=O	{1: 1, 2: 2, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	816-79-5	CCC(=CC)CC	{1: 3, 2: 2, 6: 1, 7: 1}
OK	81611-35-0	CC(C)CCCCCOCCCNCCC(=O)O	{1: 2, 2: 10, 3: 1, 22: 1, 27: 1, 31: 1}
OK	81634-99-3	CCCCCCC=CCCOC(=O)C	{1: 2, 2: 7, 28: 1, 6: 2}
OK	81640-22-4	C1C2CN(C1C=C2)[O]	{33: 1, 11: 2, 12: 2, 29: 1, 14: 2}
OK	81640-31-5	C1C2C1C(=O)C(=O)C2=O	{25: 3, 11: 1, 12: 2}
OK	81640-32-6	CC12CC1(C(=O)C(=O)C2=O)C	{1: 2, 11: 1, 13: 2, 25: 3}
OK	81643-01-8	CC=CCC(=O)OC(C)(C)C	{1: 4, 2: 1, 4: 1, 6: 2, 28: 1}
OK	81667-22-3	CC(C)COC(=O)C1CC=CCC1C(=O)OCC(C)C	{1: 4, 2: 2, 3: 2, 11: 2, 12: 2, 14: 2, 28: 2}
OK	817-09-4	C(CCl)N(CCCl)CCCl.Cl	{17: 4, 2: 6, 33: 1}
OK	817-46-9	CCCCC(CCC)CO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	817-60-7	CCCCCC(CC)CO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	817-76-5	CC(CC(=O)OC)Cl	{1: 2, 2: 1, 3: 1, 28: 1, 17: 1}
OK	817-77-6	COC(=O)CC(Cl)Cl	{1: 1, 2: 1, 3: 1, 28: 1, 17: 2}
OK	817-91-4	CCCC(C)CCCO	{1: 2, 2: 5, 3: 1, 20: 1}
OK	817-95-8	CCOCC(=O)OCC	{1: 2, 2: 3, 28: 1, 22: 1}
OK	81720-10-7	CC1CCC2(C(CCCO2)C)OC1C(C)CC(C3C(=C)C(C4C(O3)CCC5(O4)CCC(O5)/C=C/C(C)C6CC(=CC7(O6)C(CCC(O7)CC(C)(C(=O)O)O)O)C)O)O	{1: 6, 2: 2, 3: 3, 4: 1, 5: 1, 6: 2, 11: 12, 12: 11, 13: 3, 14: 1, 15: 2, 20: 4, 23: 7, 27: 1}
OK	81782-89-0	CC(C)C(=O)C(C)(C)CC=C(C)C=C	{1: 5, 2: 1, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 24: 1}
OK	81795-07-5	CC1N(C(SC(S1)C)C)N=O	{1: 3, 34: 1, 33: 1, 41: 2, 12: 3, 29: 1}
OK	818-23-5	CCCCCCCC(=O)CCCCCCC	{24: 1, 1: 2, 2: 12}
OK	818-38-2	CCOC(=O)CCCC(=O)OCC	{1: 2, 2: 5, 28: 2}
OK	818-41-7	C(CS)C(=O)NCCNC(=O)CCS	{24: 2, 2: 6, 39: 2, 31: 2}
OK	818-49-5	CCC(C)CCCO	{1: 2, 2: 4, 3: 1, 20: 1}
OK	818-56-4	CC(CCCO)OC	{1: 2, 2: 3, 3: 1, 20: 1, 22: 1}
OK	818-61-1	C=CC(=O)OCCO	{28: 1, 2: 2, 20: 1, 5: 1, 6: 1}
OK	818-72-4	CCCCCC(C#C)O	{1: 1, 2: 4, 3: 1, 9: 1, 10: 1, 20: 1}
OK	818-81-5	CCCCCCC(C)CO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	818-88-2	COC(=O)CCCCCCCCC(=O)O	{1: 1, 2: 8, 27: 1, 28: 1}
OK	818-92-8	C=CCF	{16: 1, 2: 1, 5: 1, 6: 1}
OK	81825-45-8	C=C1C2CCC(C1=C)C(=O)C2	{25: 1, 11: 3, 12: 2, 5: 2, 15: 2}
OK	81855-31-4	C[C@H]1C2(O1)C[C@]3(CO3)[C@@](C(=O)OCC4=CCN5[C@H]4[C@@H](CC5)OC2=O)(C)O	{1: 2, 33: 1, 11: 6, 12: 3, 13: 3, 14: 1, 15: 1, 20: 1, 23: 2, 28: 2}
OK	819-01-2	C(#CBr)C(F)(F)F	{16: 3, 10: 2, 4: 1, 18: 1}
OK	819-06-7	CN(C)CC(F)(F)F	{16: 3, 1: 2, 2: 1, 4: 1, 33: 1}
OK	819-07-8	C(C(F)(F)F)[N+](=O)[O-]	{16: 3, 2: 1, 4: 1, 38: 1}
OK	819-35-2	CN(CC(F)(F)F)N=O	{1: 1, 2: 1, 4: 1, 33: 1, 34: 1, 16: 3, 29: 1}
OK	819-41-0	CCCCOC(C)(C)C#CC=C	{1: 3, 2: 3, 4: 1, 5: 1, 6: 1, 10: 2, 22: 1}
OK	819-44-3	CC(C)(C#CC=C)Cl	{1: 2, 4: 1, 5: 1, 6: 1, 10: 2, 17: 1}
OK	819-46-5	C(CC(F)(F)F)CN	{16: 3, 2: 3, 4: 1, 30: 1}
OK	819-93-2	COC(=O)CC(CCl)Cl	{1: 1, 2: 2, 3: 1, 28: 1, 17: 2}
OK	819-97-6	CCCC(=O)OC(C)CC	{1: 3, 2: 3, 3: 1, 28: 1}
OK	81907-73-5	CCOC(=O)C[C@@H]1CC=C(C1(C)C)C	{1: 4, 2: 2, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 28: 1}
OK	81910-05-6	CC1C(COC1C(=O)C)OC	{1: 3, 11: 1, 12: 3, 22: 1, 23: 1, 24: 1}
OK	81925-81-7	CCC(C)C(=O)/C=C/C	{24: 1, 1: 3, 2: 1, 3: 1, 6: 2}
OK	81931-81-9	CC(C)C(C)(CO)C(C)(C)C	{1: 6, 2: 1, 3: 1, 4: 2, 20: 1}
OK	81967-88-6	C[C@@H](C=O)[C@@H]1CC[C@@](O1)(C)C=C	{1: 2, 3: 1, 5: 1, 6: 1, 11: 2, 12: 1, 13: 1, 23: 1, 26: 1}
OK	81969-71-3	C1CC2CC2C3CC3C1	{11: 5, 12: 4}
OK	81972-46-5	C1CC(CCC1CO)CO.C(CCC(=O)O)CC(=O)O.C(CO)O	{27: 2, 20: 4, 2: 8, 11: 4, 12: 2}
OK	820-05-3	CC(C)CC(C)CCCO	{1: 3, 2: 4, 3: 2, 20: 1}
OK	820-29-1	CCCCCC(=O)CCCC	{24: 1, 1: 2, 2: 7}
OK	820-54-2	CC(=C)C#CC=C	{1: 1, 10: 2, 5: 2, 6: 1, 7: 1}
OK	820-71-3	CC(=C)COC(=O)C	{1: 2, 2: 1, 28: 1, 5: 1, 7: 1}
OK	820-99-5	CCCC=CC(=O)N	{24: 1, 1: 1, 2: 2, 30: 1, 6: 2}
OK	82010-31-9	CC(C)C[C@@H](CO)NC(=O)OC(C)(C)C	{1: 5, 2: 2, 3: 2, 4: 1, 20: 1, 28: 1, 31: 1}
OK	82018-90-4	CCN(CC(F)(F)F)N=O	{1: 1, 2: 2, 4: 1, 33: 1, 34: 1, 16: 3, 29: 1}
OK	82038-92-4	CC1=C(NCN1)CSCCN(C(=NC#N)N(C)N=O)N=O	{32: 2, 1: 2, 2: 3, 33: 2, 7: 1, 40: 1, 11: 1, 34: 3, 15: 2, 29: 2, 37: 1}
OK	821-06-7	C(/C=C/CBr)Br	{2: 2, 18: 2, 6: 2}
OK	821-08-9	C=CC#CC=C	{10: 2, 5: 2, 6: 2}
OK	821-09-0	C=CCCCO	{2: 3, 20: 1, 5: 1, 6: 1}
OK	821-10-3	C(C#CCCl)Cl	{17: 2, 2: 2, 10: 2}
OK	821-11-4	C(/C=C/CO)O	{2: 2, 20: 2, 6: 2}
OK	821-14-7	CCN=NCC	{1: 2, 2: 2, 34: 2}
OK	821-25-0	CCCCCCC(Cl)Cl	{1: 1, 2: 5, 3: 1, 17: 2}
OK	821-33-0	CC(CCOCCC(C)O)O	{1: 2, 2: 4, 3: 2, 20: 2, 22: 1}
OK	821-38-5	C(CCCCCCC(=O)O)CCCCCC(=O)O	{2: 12, 27: 2}
OK	821-41-0	C=CCCCCO	{2: 4, 20: 1, 5: 1, 6: 1}
OK	821-48-7	C(CCl)NCCCl.Cl	{17: 3, 2: 4, 31: 1}
OK	821-55-6	CCCCCCCC(=O)C	{24: 1, 1: 2, 2: 6}
OK	821-57-8	C(CCCCl)CCC(=O)O	{17: 1, 2: 6, 27: 1}
OK	821-67-0	CCCN=NCCC	{1: 2, 2: 4, 34: 2}
OK	821-76-1	C(CCCCl)CCCCl	{17: 2, 2: 7}
OK	821-91-0	CCCCCCCCCCCCNCC(CO)O	{1: 1, 2: 13, 3: 1, 20: 2, 31: 1}
OK	821-93-2	CCCCCCCCCCCCC(Cl)Cl	{1: 1, 2: 11, 3: 1, 17: 2}
OK	821-95-4	CCCCCCCCCC=C	{1: 1, 2: 8, 5: 1, 6: 1}
OK	821-99-8	C(CCCCCl)CCCCCl	{17: 2, 2: 9}
OK	82110-70-1	C1C2C1C3C(C2)C4CC3C5C4C5	{11: 4, 12: 8}
OK	82148-18-3	CC(=C)C(=O)OC.C=CN1CCCC1=O	{1: 2, 5: 2, 6: 1, 7: 1, 11: 3, 25: 1, 33: 1, 28: 1}
OK	82153-75-1	C(#N)SF	{16: 1, 40: 1, 37: 1}
OK	82161-26-0	COC1C2CCC1C3C2C4CCC3C4	{1: 1, 11: 5, 12: 7, 22: 1}
OK	822-01-5	CCCCCCCCCCC(Cl)Cl	{1: 1, 2: 9, 3: 1, 17: 2}
OK	822-06-0	C(CCCN=C=O)CCN=C=O	{8: 2, 2: 6, 34: 2, 29: 2}
OK	822-08-2	C(CCCCCN)CCCCCN	{2: 11, 30: 2}
OK	822-13-9	CCCCCCCCCCCCCCl	{1: 1, 2: 12, 17: 1}
OK	822-20-8	CCCCCCCCCCCCCCCCCOC(=O)C	{1: 2, 2: 16, 28: 1}
OK	822-23-1	CCCCCCCCCCCCCCCCCCOC(=O)C	{1: 2, 2: 17, 28: 1}
OK	822-26-4	CCCCCCCCCCCCCCCCCCCCCCOC(=O)C	{1: 2, 2: 21, 28: 1}
OK	822-27-5	CCCCCCCCSSCCCCCCCC	{40: 2, 1: 2, 2: 14}
OK	822-28-6	CCCCCCCCCCCCCCCCOC=C	{1: 1, 2: 15, 22: 1, 5: 1, 6: 1}
OK	822-35-5	C1CC=C1	{11: 2, 14: 2}
OK	822-41-3	C1C2CC1C=C2	{11: 2, 12: 2, 14: 2}
OK	822-48-0	CC1(COC1)CCl	{1: 1, 2: 1, 11: 2, 13: 1, 17: 1, 23: 1}
OK	822-50-4	C[C@@H]1CCCC1C	{1: 2, 11: 3, 12: 2}
OK	822-66-2	C1CC(CC=C1)O	{20: 1, 11: 3, 12: 1, 14: 2}
OK	822-67-3	C1CC=CC(C1)O	{20: 1, 11: 3, 12: 1, 14: 2}
OK	822-80-0	C1=CC2C=CC1C2O	{20: 1, 12: 3, 14: 4}
OK	822-83-3	CC(C)C1OCCO1	{11: 2, 1: 2, 3: 1, 12: 1, 23: 2}
OK	822-85-5	C1CCC(=O)C(C1)Br	{25: 1, 18: 1, 11: 4, 12: 1}
OK	822-86-6	C1CC[C@H]([C@@H](C1)Cl)Cl	{17: 2, 11: 4, 12: 2}
OK	822-87-7	C1CCC(=O)C(C1)Cl	{17: 1, 11: 4, 12: 1, 25: 1}
OK	822-96-8	CC1CC2CC1C=C2	{1: 1, 11: 2, 12: 3, 14: 2}
OK	822-98-0	C1CC2CC1CC2N	{11: 4, 12: 3, 30: 1}
OK	82252-88-8	CC#C[CH2]	{1: 1, 10: 2, 5: 1}
OK	823-02-9	C1CC2CC1CC=C2	{11: 4, 12: 2, 14: 2}
OK	823-22-3	CC1CCCC(=O)O1	{1: 1, 11: 3, 12: 1, 28: 1}
OK	823-36-9	CCC1C(=O)CCC1=O	{1: 1, 2: 1, 11: 2, 12: 1, 25: 2}
OK	823-45-0	C1CCC(=O)C(=CO)C1	{25: 1, 11: 4, 20: 1, 6: 1, 15: 1}
OK	823-76-7	CC(=O)C1CCCCC1	{24: 1, 1: 1, 11: 5, 12: 1}
OK	82304-66-3	CC(C)(C)C1=CC2(CCC(=O)O2)C=C(C1=O)C(C)(C)C	{1: 6, 4: 2, 11: 2, 13: 1, 14: 2, 15: 2, 25: 1, 28: 1}
OK	82357-56-0	C(CN)N.C(COC(=O)N)OC(=O)N	{2: 4, 28: 2, 30: 4}
OK	824-62-4	C1CC2CC1CC2C(=O)O	{27: 1, 11: 4, 12: 3}
OK	824-93-1	C1CC(CCC1CCl)CCl	{17: 2, 2: 2, 11: 4, 12: 2}
OK	82407-81-6	C1CCN2CCCN(C1)CC2	{33: 2, 11: 9}
OK	82407-82-7	C1CCCN2CCCN(CC1)CCC2	{33: 2, 11: 12}
OK	82423-05-0	CC1=C(C(=O)C2=C(C1=O)C3C4C5C(CC(N5C)C(N4C2CO)C#N)C6N3CCO6)OC	{1: 3, 2: 1, 37: 1, 33: 3, 11: 3, 12: 8, 15: 4, 20: 1, 22: 1, 23: 1, 25: 2}
OK	82469-79-2	CCCCCCOC(=O)CC(CC(=O)OCCCCCC)(C(=O)OCCCCCC)OC(=O)CCC	{1: 4, 2: 19, 4: 1, 28: 4}
OK	825-03-6	CC1(CC2CC1C=C2)C(=O)O	{1: 1, 11: 2, 12: 2, 13: 1, 14: 2, 27: 1}
OK	825-24-1	C1C2C=CC1C(=C2C#N)C#N	{11: 1, 12: 2, 37: 2, 14: 2, 15: 2}
OK	825-25-2	C1CCC(=C2CCCC2=O)C1	{25: 1, 11: 7, 15: 2}
OK	825-51-4	C1CCC2CC(CCC2C1)O	{20: 1, 11: 7, 12: 3}
OK	82508-31-4	CC(=CC=CC1(C2CCC3(C2(CCC(=CC3)C(=O)OC)OC(=O)C)C(=O)O1)C)C(=O)O	{1: 4, 6: 3, 7: 1, 11: 5, 12: 1, 13: 3, 14: 1, 15: 1, 27: 1, 28: 3}
OK	82508-32-5	CC1=CCC23CCC([C@]2(CC1)OC(=O)C)C(OC3=O)(C)/C=C/C=C(\C)/C(=O)O	{1: 4, 6: 3, 7: 1, 11: 5, 12: 1, 13: 3, 14: 1, 15: 1, 27: 1, 28: 2}
OK	82554-97-0	CC(C)(C)O/N=N/OC(C)(C)C	{1: 6, 34: 2, 4: 2, 22: 2}
OK	82598-72-9	C(C(CCl)(O)O)Cl	{17: 2, 2: 2, 4: 1, 20: 2}
OK	826-34-6	COC(=O)[C@@H]1C[C@@H]1C(=O)OC	{1: 2, 11: 1, 12: 2, 28: 2}
OK	826-35-7	COC(=O)[C@@H]1C[C@H]1C(=O)OC	{1: 2, 11: 1, 12: 2, 28: 2}
OK	826-36-8	CC1(CC(=O)CC(N1)(C)C)C	{32: 1, 1: 4, 11: 2, 13: 2, 25: 1}
OK	826-39-1	CC1(C2CCC(C2)C1(C)NC)C.Cl	{1: 4, 11: 3, 12: 2, 13: 2, 17: 1, 31: 1}
OK	826-56-2	CC12CCCCC1=CC(=O)CC2	{1: 1, 11: 6, 13: 1, 14: 1, 15: 1, 25: 1}
OK	82663-49-8	CC(C)CNC1=CC(=O)CC(C1)(C)C	{1: 4, 2: 1, 3: 1, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1, 31: 1}
OK	82663-50-1	CCCCCNC1=CC(=O)CC(C1)(C)C	{1: 3, 2: 4, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1, 31: 1}
OK	82666-06-6	CC1(C2CCC(N1Cl)CC2)C	{1: 2, 33: 1, 11: 4, 12: 2, 13: 1, 17: 1}
OK	82666-07-7	CC1(C2CCC(N1N3C4CCC(C3(C)C)CC4)CC2)C	{1: 4, 11: 8, 12: 4, 13: 2, 33: 2}
OK	82666-10-2	CC1(C2CCC(N1N=NN3C4CCC(C3(C)C)CC4)CC2)C	{1: 4, 34: 2, 33: 2, 11: 8, 12: 4, 13: 2}
OK	827-16-7	CN1C(=O)N(C(=O)N(C1=O)C)C	{1: 3, 33: 3, 25: 3}
OK	827-61-2	CC(=O)OC1CN2CCC1CC2	{1: 1, 11: 5, 12: 2, 28: 1, 33: 1}
OK	82766-25-4	CCCCCCCCCCCCSC[C@@H](C)C(=O)NCCNCCN	{1: 2, 2: 16, 3: 1, 40: 1, 24: 1, 30: 1, 31: 2}
OK	828-00-2	CC1CC(OC(O1)C)OC(=O)C	{1: 3, 11: 1, 12: 3, 28: 1, 23: 2}
OK	828-26-2	CC1(SC(SC(S1)(C)C)(C)C)C	{1: 6, 13: 3, 41: 3}
OK	828-51-3	C1C2CC3CC1CC(C2)(C3)C(=O)O	{27: 1, 11: 6, 12: 3, 13: 1}
OK	82814-77-5	CC1(C(=C)N(C(N1O)(C)C)C=O)C	{1: 4, 5: 1, 33: 2, 13: 2, 15: 1, 20: 1, 26: 1}
OK	82834-02-4	C1CC2C(C1)C3=C2CCC3	{11: 6, 12: 2, 15: 2}
OK	82834-16-0	CCC[C@@H](C(=O)OCC)N[C@@H](C)C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)O	{1: 3, 2: 3, 3: 2, 33: 1, 11: 5, 12: 3, 24: 1, 27: 1, 28: 1, 31: 1}
OK	82865-42-7	C=CC1C(C(C1C=C)C=C)C=C	{12: 4, 5: 4, 6: 4}
OK	82937-00-6	CC=C(C)C=C(C)C	{1: 4, 6: 2, 7: 2}
OK	82937-01-7	C/C=C(\C)/C=C(C)C	{1: 4, 6: 2, 7: 2}
OK	82946-55-2	CCCC=CN=NCC	{1: 2, 2: 3, 34: 2, 6: 2}
OK	82951-81-3	CCCCCCCCCCCCCCC/C=C/C1=NCCN1CCNC(=O)C(C)O.CC(C(=O)O)O	{1: 3, 2: 16, 3: 2, 6: 2, 33: 1, 11: 2, 15: 1, 35: 1, 20: 2, 24: 1, 27: 1, 31: 1}
OK	82962-34-3	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)CCCCCCCCCCBr)C)C	{1: 5, 2: 13, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 18: 1, 28: 1}
OK	83-27-2	CCC(C)C(C(=O)OCC)C(=O)OCC	{1: 4, 2: 3, 3: 2, 28: 2}
OK	83-43-2	C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)CO)O	{1: 3, 2: 1, 11: 4, 12: 5, 13: 3, 14: 3, 15: 1, 20: 3, 24: 1, 25: 1}
OK	83-44-3	C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C	{1: 3, 2: 2, 3: 1, 11: 8, 12: 7, 13: 2, 20: 2, 27: 1}
OK	83-45-4	CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 9, 12: 6, 13: 2, 20: 1}
OK	83-46-5	CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	83-47-6	CC[C@@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	{1: 6, 2: 3, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	83-48-7	CC[C@H](C=C[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C	{1: 6, 2: 1, 3: 3, 6: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 20: 1}
OK	83-49-8	CC(CCC(=O)O)C1CCC2C1(CCC3C2C[C@@H](C4C3(CC[C@H](C4)O)C)O)C	{1: 3, 2: 2, 3: 1, 11: 8, 12: 7, 13: 2, 20: 2, 27: 1}
OK	830-13-7	C1CCCCCC(=O)CCCCC1	{25: 1, 11: 11}
OK	83004-92-6	CC(C)CCOC(=O)CBr	{1: 2, 2: 3, 3: 1, 28: 1, 18: 1}
OK	83004-97-1	CCCCCCCOC(=O)C(Cl)Cl	{1: 1, 2: 6, 3: 1, 28: 1, 17: 2}
OK	83004-98-2	CCCCCCCCOC(=O)C(Cl)Cl	{1: 1, 2: 7, 3: 1, 28: 1, 17: 2}
OK	83004-99-3	CCCCCCCCCOC(=O)C(Cl)Cl	{1: 1, 2: 8, 3: 1, 28: 1, 17: 2}
OK	83005-00-9	CCCCCCCCCCOC(=O)C(Cl)Cl	{1: 1, 2: 9, 3: 1, 28: 1, 17: 2}
OK	83005-01-0	CCCCCCCCCCCCOC(=O)C(Cl)Cl	{1: 1, 2: 11, 3: 1, 28: 1, 17: 2}
OK	83005-02-1	CCCCCCCCCCCCCCOC(=O)C(Cl)Cl	{1: 1, 2: 13, 3: 1, 28: 1, 17: 2}
OK	83060-75-7	COC(=O)N1C2C=CC1C=C2	{1: 1, 12: 2, 33: 1, 14: 4, 28: 1}
OK	831-67-4	C1CCCCCC(CCCC1)C(=O)O	{27: 1, 11: 10, 12: 1}
OK	83145-58-8	CC(=O)OC(CCC(=O)O)C=C	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 27: 1, 28: 1}
OK	83168-65-4	C(=C(\F)/C(F)(F)F)(\F)/C(=C(/F)\C(F)(F)F)/F	{16: 10, 4: 2, 7: 4}
OK	83168-66-5	C(=C(C(F)(F)F)F)(C(=C(C(F)(F)F)F)F)F	{16: 10, 4: 2, 7: 4}
OK	83168-67-6	C(=C(/F)\C(F)(F)F)(\F)/C(=C(\F)/C(F)(F)F)/F	{16: 10, 4: 2, 7: 4}
OK	832-06-4	CCCCOC(=O)C=C1NC(=O)CS1	{32: 1, 1: 1, 2: 3, 6: 1, 41: 1, 11: 1, 15: 1, 25: 1, 28: 1}
OK	832-10-0	C1CCCCCCC(=O)CCCCC1	{25: 1, 11: 12}
OK	83206-47-7	C(C(Br)Br)O	{2: 1, 3: 1, 20: 1, 18: 2}
OK	83314-01-6	CCCC=CC=CC(=O)OC1C(=CC(=O)OC)CC2CC(OC(=O)CC(CC3CC(C(C(O3)(CC4CC(=CC(=O)OC)CC(O4)C=CC(C1(O2)O)(C)C)O)(C)C)OC(=O)C)O)C(C)O	{1: 9, 2: 2, 3: 1, 6: 6, 11: 8, 12: 8, 13: 4, 14: 2, 15: 2, 20: 4, 23: 3, 28: 5}
OK	83335-32-4	C(CC(F)(F)F)CN(CCCC(F)(F)F)N=O	{33: 1, 2: 6, 4: 2, 34: 1, 16: 6, 29: 1}
OK	83346-49-0	CC(CSCCO)O.C(CSCCO)O	{40: 2, 1: 1, 2: 7, 3: 1, 20: 4}
OK	83416-06-2	C=COCCOCCOCCOCCOC=C	{2: 8, 22: 5, 5: 2, 6: 2}
OK	83463-62-1	C(#N)C(Cl)Br	{17: 1, 18: 1, 3: 1, 37: 1}
OK	83480-29-9	C1C(C(C(C(C1(CO)O)O)O)O)NC(CO)CO	{2: 3, 3: 1, 11: 1, 12: 4, 13: 1, 20: 7, 31: 1}
OK	83540-97-0	CC(C)OC(=O)C[C@H](C(=O)OC(C)C)O	{1: 4, 2: 1, 3: 3, 20: 1, 28: 2}
OK	83541-68-8	CC(C)OC(=O)C[C@@H](C(=O)OC(C)C)O	{1: 4, 2: 1, 3: 3, 20: 1, 28: 2}
OK	83585-56-2	C1COCCOCC(OCCOCCO1)CN	{2: 1, 11: 9, 12: 1, 30: 1, 23: 5}
OK	83585-61-9	C1COCCOCCOC(COCCOCCO1)CN	{2: 1, 11: 11, 12: 1, 30: 1, 23: 6}
OK	836-77-1	C1(C(C(N(C(C1(F)F)(F)F)F)(F)F)(F)F)(F)F	{16: 11, 33: 1, 13: 5}
OK	83615-93-4	CC(=C(C=C)C=C)C	{1: 2, 5: 2, 6: 2, 7: 2}
OK	83665-55-8	C1COC(O1)CCI	{19: 1, 2: 2, 11: 2, 12: 1, 23: 2}
OK	83670-21-7	CC(C)(C)C1=CC=CC=C(S1)C(C)(C)C	{1: 6, 4: 2, 41: 1, 14: 4, 15: 2}
OK	83682-72-8	C(CO)C(Cl)Cl	{17: 2, 2: 2, 3: 1, 20: 1}
OK	83712-00-9	CC1(CC(CC(N1C)(C)C)OC(=O)CCCCCCCCC(=O)O)C	{1: 5, 2: 8, 33: 1, 11: 2, 12: 1, 13: 2, 27: 1, 28: 1}
OK	83768-87-0	C=CSCCC(C(=O)O)N	{2: 2, 3: 1, 5: 1, 6: 1, 40: 1, 27: 1, 30: 1}
OK	83805-11-2	C[C@H](CCCC(C(F)(F)F)(C(F)(F)F)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C	{1: 2, 2: 3, 3: 1, 4: 3, 5: 1, 6: 2, 11: 7, 12: 4, 13: 1, 15: 3, 16: 6, 20: 3}
OK	83817-45-2	CC(C)C1=CC[C@H]2C(=C1)CCC3[C@@]2(CCC[C@@]3(C)C(=O)O)C	{1: 4, 3: 1, 11: 6, 12: 2, 13: 2, 14: 2, 15: 2, 27: 1}
OK	83878-01-7	C1CC(=O)C(C(C1)(Cl)Cl)(O)O	{17: 2, 11: 3, 20: 2, 13: 2, 25: 1}
OK	83909-79-9	CCCCCCCC(C(C)C)O	{1: 3, 2: 6, 3: 2, 20: 1}
OK	84-58-2	C(#N)C1=C(C(=O)C(=C(C1=O)Cl)Cl)C#N	{17: 2, 25: 2, 37: 2, 15: 4}
OK	84012-64-6	CCC(=O)OCC(C)(C)CC1=C(CCC1C(=C)C)C	{1: 5, 2: 3, 4: 1, 5: 1, 7: 1, 11: 2, 12: 1, 15: 2, 28: 1}
OK	84030-20-6	CN1CCCN2C1=NCCC2	{1: 1, 11: 6, 33: 2, 35: 1, 15: 1}
OK	84098-45-3	CC(C)OC(=O)CCO	{1: 2, 2: 2, 3: 1, 20: 1, 28: 1}
OK	841-73-6	CCCCC1C(=O)NC(=O)N(C1=O)C2CCCCC2	{32: 1, 1: 1, 2: 3, 33: 1, 11: 5, 12: 2, 25: 3}
OK	84256-19-9	CCC1(CCC1)O	{1: 1, 2: 1, 11: 3, 20: 1, 13: 1}
OK	84276-14-2	CCCCCCCC[C@@H](CO)O	{1: 1, 2: 8, 3: 1, 20: 2}
OK	84296-10-6	CCC(C)CCCC(C)CCCC(C)CCCC(C)CCC(C)CCCC(C)CCCC(C)CCCC(C)CC	{1: 10, 2: 22, 3: 8}
OK	84367-31-7	C(C#N)[C@H](CCl)O	{17: 1, 2: 2, 3: 1, 20: 1, 37: 1}
OK	84466-85-3	CN1CCC[C@H]1CN2CCCCC2	{1: 1, 2: 1, 11: 8, 12: 1, 33: 2}
OK	84468-52-0	CC1C(NCCN1)C	{32: 2, 1: 2, 11: 2, 12: 2}
OK	84477-43-0	CC1=CC=C(SC(=C1)C(C)(C)C)C(C)(C)C	{1: 7, 4: 2, 41: 1, 14: 3, 15: 3}
OK	84477-45-2	CC1=C(C=C(SC(=C1)C(C)(C)C)C(C)(C)C)C	{1: 8, 4: 2, 41: 1, 14: 2, 15: 4}
OK	84509-55-7	C1CCN2CCCCC(=CCCC2)C1	{33: 1, 11: 11, 14: 1, 15: 1}
OK	84534-29-2	CCCCCCCCCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 14}
OK	84560-00-9	CCCCCC1CCCC1O	{1: 1, 2: 4, 11: 3, 12: 2, 20: 1}
OK	846-46-8	C[C@]12CCC(=O)C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C	{1: 2, 11: 9, 12: 4, 13: 2, 25: 2}
OK	846-48-0	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)C=C[C@]34C	{1: 2, 11: 6, 12: 4, 13: 2, 14: 3, 15: 1, 20: 1, 25: 1}
OK	84612-71-5	CCC(C)C(CC)O.CC(=O)O	{27: 1, 1: 4, 2: 2, 3: 2, 20: 1}
OK	84612-74-8	CC(C)C(C(C)C)OC(=O)C	{1: 5, 3: 3, 28: 1}
OK	84696-83-3	CCC(C)C(=O)OC(C)C(C)C	{1: 5, 2: 1, 3: 3, 28: 1}
OK	84731-63-5	CC(C)CCCCCCCCCCOC(=O)CCCCCCCCCCC(=O)OCCCCCCCCCCC(C)C	{1: 4, 2: 30, 3: 2, 28: 2}
OK	848-21-5	C[C@]12C=CC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@]2(C#C)O	{1: 1, 9: 1, 10: 1, 11: 6, 12: 2, 13: 2, 14: 3, 15: 3, 20: 1, 25: 1}
OK	84802-91-5	C1(=C(O1)C(F)(F)F)C(F)(F)F	{16: 6, 23: 1, 4: 2, 15: 2}
OK	84886-38-4	C/C=C(\C)/C(=O)OC1[C@@H]2C(/C=C(\C(C/C=C(\C1O)/C)O)/C)OC(=O)C2=C	{1: 4, 5: 1, 6: 1, 7: 1, 11: 1, 12: 5, 14: 2, 15: 3, 20: 2, 28: 2}
OK	849-99-0	C1CCC(CC1)OC(=O)CCCCC(=O)OC2CCCCC2	{28: 2, 2: 4, 11: 10, 12: 2}
OK	84904-97-2	C1CCN2CCCN(CC1)CC2	{33: 2, 11: 10}
OK	84904-98-3	C1CCN2CCCN(CC1)CCC2	{33: 2, 11: 11}
OK	84904-99-4	C1CCN2CCCCN(CC1)CC2	{33: 2, 11: 11}
OK	84905-00-0	C1CCN2CCCCCN(CC1)CC2	{33: 2, 11: 12}
OK	84905-01-1	C1CCN2CCCCN(CC1)CCC2	{33: 2, 11: 12}
OK	84905-02-2	C1CCN2CCCCCN(CC1)CCC2	{33: 2, 11: 13}
OK	84905-03-3	C1CCCN2CCCCN(CC1)CCC2	{33: 2, 11: 13}
OK	84905-04-4	C1CCCN2CCCCCN(CC1)CCC2	{33: 2, 11: 14}
OK	84905-06-6	C1CCCN2CCCN(CC1)CC2	{33: 2, 11: 11}
OK	84954-88-1	C1CCC2CCC(C1)CCC3=C=C=C(CC2)CC3	{8: 2, 11: 12, 12: 2, 15: 2}
OK	85-39-2	C1C2C=CC1C(C2CO)CO	{20: 2, 2: 2, 11: 1, 12: 4, 14: 2}
OK	85-40-5	C1C=CCC2C1C(=O)NC2=O	{32: 1, 25: 2, 11: 2, 12: 2, 14: 2}
OK	850-52-2	CC12C=CC3=C4CCC(=O)C=C4CCC3C1CCC2(CC=C)O	{1: 1, 2: 1, 5: 1, 6: 1, 11: 6, 12: 2, 13: 2, 14: 3, 15: 3, 20: 1, 25: 1}
OK	850411-21-1	CCCC[C@H](CC(=O)O)C(=O)OC	{27: 1, 1: 2, 2: 4, 3: 1, 28: 1}
OK	85131-86-8	C(C(C(C(F)(F)Br)(F)Cl)(F)Cl)(C(C(F)(F)Br)(F)Cl)(F)F	{16: 9, 17: 3, 18: 2, 4: 6}
OK	85136-05-6	CCC(C(C)(CC=C(C)C)C=C)O	{1: 4, 2: 2, 3: 1, 4: 1, 5: 1, 6: 2, 7: 1, 20: 1}
OK	85136-06-7	CC/C=C/C(CC)(CC=C(C)C)CO	{1: 4, 2: 4, 4: 1, 6: 3, 7: 1, 20: 1}
OK	85136-07-8	CCC(CC=C)C=C(CC)C=O	{1: 2, 2: 3, 3: 1, 5: 1, 6: 2, 7: 1, 26: 1}
OK	85136-39-6	CCC(CC)C(=O)OCC=C(C)CCC=C(C)C	{1: 5, 2: 5, 3: 1, 6: 2, 7: 2, 28: 1}
OK	85152-89-2	CCOC(=C=C(OCC)OCC)OCC	{8: 1, 1: 4, 2: 4, 22: 4, 7: 2}
OK	85153-52-2	CCCCC(C(=O)OCC)Cl	{1: 2, 2: 4, 3: 1, 28: 1, 17: 1}
OK	85213-22-5	CC(=O)C1=NCCC1	{24: 1, 1: 1, 11: 3, 35: 1, 15: 1}
OK	85219-14-3	C1CC2C3CCC(C3)C(C1)C2N	{11: 6, 12: 5, 30: 1}
OK	85229-65-8	C1CC2C3CC(C=C3)C(C1)C2N	{11: 4, 12: 5, 30: 1, 14: 2}
OK	85237-78-1	CC(C)(C)C1CCCC(N1C)C(C)(C)C	{1: 7, 11: 3, 4: 2, 12: 2, 33: 1}
OK	85298-04-0	CC(C)C(C#N)C(C#N)C(C)C	{1: 4, 3: 4, 37: 2}
OK	853-23-6	CC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CCC4=O)C)C	{1: 3, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 28: 1}
OK	85363-04-8	CC(C)(C)OC(=O)NCC#N	{1: 3, 2: 1, 4: 1, 37: 1, 28: 1, 31: 1}
OK	85391-19-1	C1CCN(C1)CC(CO)O	{11: 4, 33: 1, 2: 2, 3: 1, 20: 2}
OK	85392-03-6	CCCCC=CCCCC(=O)O	{1: 1, 2: 6, 27: 1, 6: 2}
OK	85392-04-7	CCCC=CCCCCC(=O)O	{1: 1, 2: 6, 27: 1, 6: 2}
OK	85392-05-8	CCCCC=CCCCC(=O)OC(CCCC)CCCCC(=O)O	{1: 2, 2: 13, 3: 1, 6: 2, 27: 1, 28: 1}
OK	85392-06-9	CCCCC(CCCCC(=O)O)OC(=O)CCCCC=CCCC	{1: 2, 2: 13, 3: 1, 6: 2, 27: 1, 28: 1}
OK	85408-26-0	CC(=C)C.S(SCl)Cl	{40: 2, 1: 2, 17: 2, 5: 1, 7: 1}
OK	85440-70-6	CC(=O)OC1COCC1OC(=O)C	{1: 2, 11: 2, 12: 2, 28: 2, 23: 1}
OK	855-19-6	CC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C(C(=O)CC[C@]34C)Cl)C	{1: 3, 11: 8, 12: 4, 13: 2, 15: 2, 17: 1, 25: 1, 28: 1}
OK	855-22-1	CCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C	{1: 3, 2: 1, 11: 9, 12: 5, 13: 2, 25: 1, 28: 1}
OK	85514-84-7	CCCCCCCCCC[C@H](CO)O	{1: 1, 2: 10, 3: 1, 20: 2}
OK	85514-85-8	CCCCCCCCCC[C@@H](CO)O	{1: 1, 2: 10, 3: 1, 20: 2}
OK	85523-00-8	CC(C)N(C)C(C)(C)C	{1: 6, 3: 1, 4: 1, 33: 1}
OK	85523-04-2	C1CC2CC(C1)C3CC2C=C3	{11: 5, 12: 4, 14: 2}
OK	85523-06-4	C1CC2C3CCC(C3)C(C1)C2O	{20: 1, 11: 6, 12: 5}
OK	85523-07-5	COC1C2CCCC1C3CC2C=C3	{1: 1, 11: 4, 12: 5, 22: 1, 14: 2}
OK	85523-08-6	C1CCN(C1)C2C3CCCC2C4CC3C=C4	{33: 1, 11: 8, 12: 5, 14: 2}
OK	85523-25-7	CC1(C=C1)C#N	{1: 1, 13: 1, 14: 2, 37: 1}
OK	85538-50-7	COC1C2CCCC1C3CCC2C3	{1: 1, 11: 6, 12: 5, 22: 1}
OK	85538-51-8	C1CCN(C1)C2C3CCCC2C4CCC3C4	{33: 1, 11: 10, 12: 5}
OK	85567-21-1	C1C(O1)COC(C(F)F)(F)F	{2: 1, 3: 1, 4: 1, 11: 1, 12: 1, 16: 4, 22: 1, 23: 1}
OK	85571-85-3	CCOC(=O)C[C@H](C(F)(F)F)O	{1: 1, 2: 2, 3: 1, 4: 1, 16: 3, 20: 1, 28: 1}
OK	85599-92-4	CCC(C)N=CN(C)C	{1: 4, 2: 1, 3: 1, 6: 1, 33: 1, 34: 1}
OK	85599-94-6	CCCCCCN=CN(C)C	{1: 3, 2: 5, 34: 1, 6: 1, 33: 1}
OK	85618-21-9	CCCCCCCCSC1C(C(C(C(O1)CO)O)O)O	{1: 1, 2: 8, 40: 1, 12: 5, 20: 4, 23: 1}
OK	85688-86-4	CC(C)CC(CC(C)C)(C#N)C(CC(C)C)(CC(C)C)C#N	{1: 8, 2: 4, 3: 4, 4: 2, 37: 2}
OK	85688-95-5	CCC(C)(C)C(CC)(C#N)C#N	{1: 4, 2: 2, 4: 2, 37: 2}
OK	85688-96-6	CC(C)C(C)(C)C(C)(C#N)C#N	{1: 5, 3: 1, 4: 2, 37: 2}
OK	85689-01-6	C1CC2CC1CN2[O]	{33: 1, 11: 4, 12: 2, 29: 1}
OK	85694-31-1	COC(=O)C=CC(F)(F)F	{16: 3, 1: 1, 4: 1, 6: 2, 28: 1}
OK	85721-25-1	C=CCCCCCCC1CO1	{2: 6, 5: 1, 6: 1, 11: 1, 12: 1, 23: 1}
OK	85721-30-8	CC(C)N(CC(CO)O)C(C)C	{1: 4, 2: 2, 3: 3, 20: 2, 33: 1}
OK	85743-61-9	C(=C(Cl)Cl)(C(C(=O)O)(Cl)Cl)Cl	{17: 5, 27: 1, 4: 1, 7: 2}
OK	85761-30-4	CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O	{1: 6, 2: 10, 3: 3, 4: 1, 20: 1}
OK	85796-63-0	C[C@@H]1CCCN=C1	{1: 1, 11: 3, 12: 1, 14: 1, 35: 1}
OK	85880-10-0	C=C1C2C=CC1C3C2C3	{11: 1, 12: 4, 5: 1, 14: 2, 15: 1}
OK	85896-31-7	C=CCCCCCCCCCCCC=O	{2: 11, 26: 1, 5: 1, 6: 1}
OK	85909-08-6	CC(C)(C)OC(=O)N1CCCC1=O	{1: 3, 4: 1, 33: 1, 11: 3, 25: 1, 28: 1}
OK	85995-87-5	CCC[C@@H](CC)OC(=O)CCCCC(=O)OCC[C@H](C)CC	{1: 4, 2: 10, 3: 2, 28: 2}
OK	860-79-7	C[C@@H]([C@H]1[C@@H](CC2([C@@]1(CCC34[C@H]2CC[C@@H]5C3(C4)CC[C@@H](C5(C)C)NC)C)C)O)NC	{1: 7, 3: 1, 11: 8, 12: 5, 13: 5, 20: 1, 31: 2}
OK	86073-38-3	CCCCCCCCCC(C)CCCCCCCC(=O)O	{27: 1, 1: 2, 2: 15, 3: 1}
OK	86087-23-2	C1COC[C@H]1O	{20: 1, 11: 3, 12: 1, 23: 1}
OK	86087-24-3	C1COC[C@@H]1O	{20: 1, 11: 3, 12: 1, 23: 1}
OK	86146-57-8	C(N=O)O	{2: 1, 34: 1, 20: 1, 29: 1}
OK	86154-51-0	CC(F)(F)CC(C)(F)F	{16: 4, 1: 2, 2: 1, 4: 2}
OK	86217-01-8	C=CC(=O)OCCC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F	{2: 2, 4: 5, 5: 1, 6: 1, 16: 11, 28: 1}
OK	86240-21-3	CC1(CCC(=O)N1)C#N	{32: 1, 1: 1, 37: 1, 11: 2, 13: 1, 25: 1}
OK	86261-23-6	C=CCN(CCCC(=O)O)N=O	{33: 1, 2: 4, 5: 1, 6: 1, 34: 1, 27: 1, 29: 1}
OK	86290-98-4	CN(C)C(=O)NCNC(=O)N(C)C	{24: 2, 1: 4, 2: 1, 33: 2, 31: 2}
OK	86301-94-2	C1CC12C3CC3C4C2C5C6CC6C4C57CC7	{11: 6, 12: 8, 13: 2}
OK	86381-89-7	CSI	{40: 1, 1: 1, 19: 1}
OK	865-40-7	CN=O	{1: 1, 34: 1, 29: 1}
OK	865-44-1	ClI(Cl)Cl	{17: 3, 19: 1}
OK	865-58-7	CC(C)(C=C)Br	{1: 2, 18: 1, 4: 1, 5: 1, 6: 1}
OK	865-66-7	CC(=O)C(C)(C)C(C)(C)C	{24: 1, 1: 6, 4: 2}
OK	865-71-4	C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(C(F)(F)F)F	{16: 14, 4: 6}
OK	865-77-0	C(C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(C(F)(F)F)F	{16: 19, 19: 1, 4: 9}
OK	86629-72-3	CC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)CO)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C	{1: 9, 2: 2, 3: 1, 11: 6, 12: 17, 13: 2, 14: 7, 15: 3, 20: 4, 22: 4, 23: 5, 28: 1}
OK	86668-32-8	CC=CCCCC(C)C	{1: 3, 2: 3, 3: 1, 6: 2}
OK	86668-33-9	CCC=CCCC(C)C	{1: 3, 2: 3, 3: 1, 6: 2}
OK	867-49-2	C(C(=O)S)Cl	{24: 1, 17: 1, 2: 1, 39: 1}
OK	86711-71-9	CCCCCOC(=O)C(C)Cl	{1: 2, 2: 4, 3: 1, 28: 1, 17: 1}
OK	86711-73-1	CCCCCOC(=O)C(C)Br	{1: 2, 2: 4, 3: 1, 28: 1, 18: 1}
OK	86711-74-2	CC(C)CCOC(=O)C(C)Br	{1: 3, 2: 2, 3: 2, 28: 1, 18: 1}
OK	86711-78-6	CCCCCCCCCCOC(=O)C(C)Cl	{1: 2, 2: 9, 3: 1, 28: 1, 17: 1}
OK	86711-81-1	CCCCCCCCCCCCCCCCOC(=O)C(C)Cl	{1: 2, 2: 15, 3: 1, 28: 1, 17: 1}
OK	86711-82-2	CCCCCCCCCCCCCCOC(=O)C(C)Br	{1: 2, 2: 13, 3: 1, 28: 1, 18: 1}
OK	86728-85-0	CCOC(=O)C[C@@H](CCl)O	{1: 1, 2: 3, 3: 1, 17: 1, 20: 1, 28: 1}
OK	86770-74-3	C(COCCOCCOCCO)N	{2: 8, 20: 1, 30: 1, 22: 3}
OK	86770-88-9	C=C1CC1F	{16: 1, 11: 1, 12: 1, 5: 1, 15: 1}
OK	86770-89-0	C1CC1=CF	{16: 1, 11: 2, 6: 1, 15: 1}
OK	86799-85-1	CC(C)(CC(=C)Cl)C(=O)OC	{1: 3, 2: 1, 4: 1, 5: 1, 7: 1, 17: 1, 28: 1}
OK	868-26-8	COC(=O)C(C(=O)OC)Br	{1: 2, 18: 1, 3: 1, 28: 2}
OK	868-46-2	CCC(=C(CC)CC)CC	{1: 4, 2: 4, 7: 2}
OK	868-54-2	C(C#N)C(=C(C#N)C#N)N	{2: 1, 37: 3, 30: 1, 7: 2}
OK	868-57-5	CCC(C)C(=O)OC	{1: 3, 2: 1, 3: 1, 28: 1}
OK	868-72-4	COC(=O)C(CCC(C(=O)OC)Br)Br	{1: 2, 2: 2, 3: 2, 28: 2, 18: 2}
OK	868-73-5	COC(=O)C(CCCC(C(=O)OC)Br)Br	{1: 2, 2: 3, 3: 2, 28: 2, 18: 2}
OK	868-77-9	CC(=C)C(=O)OCCO	{1: 1, 2: 2, 5: 1, 7: 1, 20: 1, 28: 1}
OK	868-83-7	C(C(=O)NN)Cl.Cl	{24: 1, 17: 2, 2: 1, 30: 1, 31: 1}
OK	868-91-7	CC(C)(C)CC(=O)C(C)(C)C	{24: 1, 1: 6, 2: 1, 4: 2}
OK	86854-64-0	CC(=C)CCON=O	{1: 1, 2: 2, 5: 1, 7: 1, 34: 1, 22: 1, 29: 1}
OK	869-01-2	CCCCN(C(=O)N)N=O	{1: 1, 2: 3, 33: 1, 34: 1, 24: 1, 29: 1, 30: 1}
OK	869-10-3	CCOC(=O)C(CCC(C(=O)OCC)Br)Br	{1: 2, 2: 4, 3: 2, 28: 2, 18: 2}
OK	869-19-2	CC(C)C[C@@H](C(=O)O)NC(=O)CN	{1: 2, 2: 2, 3: 2, 24: 1, 27: 1, 30: 1, 31: 1}
OK	869-24-9	CCN(CC)CCCl.Cl	{1: 2, 2: 4, 33: 1, 17: 2}
OK	869-29-4	CC(=O)OC(C=C)OC(=O)C	{1: 2, 3: 1, 28: 2, 5: 1, 6: 1}
OK	86944-00-5	C1CSCC(CSC1)O	{20: 1, 11: 5, 12: 1, 41: 2}
OK	86953-79-9	CC(C)(C)OC(=O)N1CCCC1	{1: 3, 11: 4, 4: 1, 28: 1, 33: 1}
OK	86954-77-0	CC1CCCC2=C1C3CCC2C3	{1: 1, 11: 6, 12: 3, 15: 2}
OK	87-09-2	CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CSCC=C)C(=O)O)C	{1: 2, 2: 2, 5: 1, 6: 1, 33: 1, 40: 1, 41: 1, 12: 3, 13: 1, 24: 1, 25: 1, 27: 1, 31: 1}
OK	87-13-8	CCOC=C(C(=O)OCC)C(=O)OCC	{1: 3, 2: 3, 6: 1, 7: 1, 22: 1, 28: 2}
OK	87-39-8	C1(=NO)C(=O)NC(=O)NC1=O	{32: 2, 25: 3, 34: 1, 20: 1, 15: 1}
OK	87-44-5	C/C/1=C\CCC(=C)[C@H]2CC([C@@H]2CC1)(C)C	{1: 3, 5: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 2}
OK	87-56-9	C(=O)C(=C(C(=O)O)Cl)Cl	{17: 2, 26: 1, 27: 1, 7: 2}
OK	87-68-3	C(=C(Cl)Cl)(C(=C(Cl)Cl)Cl)Cl	{17: 6, 7: 4}
OK	87-69-4	[C@@H]([C@H](C(=O)O)O)(C(=O)O)O	{27: 2, 3: 2, 20: 2}
OK	87-72-9	C1C(C(C(C(O1)O)O)O)O	{20: 4, 11: 1, 12: 4, 23: 1}
OK	87-73-0	[C@H]([C@@H]([C@@H](C(=O)O)O)O)([C@H](C(=O)O)O)O	{27: 2, 3: 4, 20: 4}
OK	87-79-6	C(C(C(C(C(=O)CO)O)O)O)O	{24: 1, 2: 2, 3: 3, 20: 5}
OK	87-84-3	C1(C(C(C(C(C1Br)Br)Br)Br)Br)Cl	{17: 1, 18: 5, 12: 6}
OK	87-88-7	C1(=C(C(=O)C(=C(C1=O)Cl)O)Cl)O	{17: 2, 20: 2, 25: 2, 15: 4}
OK	87-89-8	C1(C(C(C(C(C1O)O)O)O)O)O	{20: 6, 12: 6}
OK	87-90-1	C1(=O)N(C(=O)N(C(=O)N1Cl)Cl)Cl	{17: 3, 33: 3, 25: 3}
OK	87-91-2	CCOC(=O)[C@@H]([C@H](C(=O)OCC)O)O	{1: 2, 2: 2, 3: 2, 20: 2, 28: 2}
OK	87-92-3	CCCCOC(=O)[C@@H]([C@H](C(=O)OCCCC)O)O	{1: 2, 2: 6, 3: 2, 20: 2, 28: 2}
OK	87-99-0	OCC(O)C(O)C(O)CO	{2: 2, 3: 3, 20: 5}
OK	870-23-5	C=CCS	{2: 1, 5: 1, 6: 1, 39: 1}
OK	870-24-6	C(CCl)N.Cl	{17: 2, 2: 2, 30: 1}
OK	870-46-2	CC(C)(C)OC(=O)NN	{1: 3, 4: 1, 30: 1, 28: 1, 31: 1}
OK	870-63-3	CC(=CCBr)C	{1: 2, 2: 1, 18: 1, 6: 1, 7: 1}
OK	870-74-6	CC(=N)CC(=O)C	{24: 1, 1: 2, 2: 1, 36: 1, 7: 1}
OK	870-93-9	C(CSSCCC(C(=O)O)N)C(C(=O)O)N	{27: 2, 40: 2, 2: 4, 3: 2, 30: 2}
OK	87047-20-9	CC(C)(C)OOC(C)(C)CCC(C)(C)O	{1: 7, 2: 2, 4: 3, 22: 2, 20: 1}
OK	87075-61-4	CCCCCCCCC=CCCCCCCCCCCCCNC(=O)CCCCCCCCCCCC=CCCCCCCCC	{24: 1, 1: 2, 2: 37, 6: 4, 31: 1}
OK	871-22-7	CCCCOC(C)OCCCC	{1: 3, 2: 6, 3: 1, 22: 2}
OK	871-28-3	C=CCC#C	{9: 1, 2: 1, 10: 1, 5: 1, 6: 1}
OK	871-70-5	C(CCCCCCCCC(=O)O)CCCCCCCC(=O)O	{2: 16, 27: 2}
OK	871-71-6	CCCCNC=O	{1: 1, 2: 3, 26: 1, 31: 1}
OK	871-76-1	C(CSCCN)N	{40: 1, 2: 4, 30: 2}
OK	871-83-0	CCCCCCCC(C)C	{1: 3, 2: 6, 3: 1}
OK	871-84-1	C#CCCCCC#C	{9: 2, 2: 4, 10: 2}
OK	871-91-0	C#CCCCCCCO	{9: 1, 2: 6, 20: 1, 10: 1}
OK	87112-48-9	C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(CC[C@H]7C8=CC(=O)OC8)O)C)C)C)C)O)O	{1: 5, 11: 13, 12: 17, 13: 3, 14: 1, 15: 1, 20: 5, 22: 3, 23: 3, 28: 1}
OK	872-05-9	CCCCCCCCC=C	{1: 1, 2: 7, 5: 1, 6: 1}
OK	872-06-0	C=CCCCCCCCCl	{17: 1, 2: 7, 5: 1, 6: 1}
OK	872-10-6	CCCCCSCCCCC	{40: 1, 1: 2, 2: 8}
OK	872-30-0	CC1(CO1)CO	{1: 1, 2: 1, 11: 1, 13: 1, 20: 1, 23: 1}
OK	872-32-2	CC1=NCCC1	{1: 1, 11: 3, 35: 1, 15: 1}
OK	872-50-4	CN1CCCC1=O	{1: 1, 11: 3, 33: 1, 25: 1}
OK	872-53-7	C1CCC(C1)C=O	{26: 1, 11: 4, 12: 1}
OK	872-56-0	CC(C)C1CCC1	{11: 3, 1: 2, 3: 1, 12: 1}
OK	872-78-6	CC1CC2CCC1C2	{1: 1, 11: 4, 12: 3}
OK	872-98-0	CC1(COCOC1)C	{1: 2, 11: 3, 13: 1, 23: 2}
OK	87206-44-8	CSCC[C@H](CO)N	{1: 1, 2: 3, 3: 1, 40: 1, 20: 1, 30: 1}
OK	87219-18-9	C(CCl)NC(=O)NCC(=O)O	{24: 1, 17: 1, 2: 3, 27: 1, 31: 2}
OK	87258-04-6	C1CC2C1C(=O)C3=C(C2=O)CC3	{25: 2, 11: 4, 12: 2, 15: 2}
OK	87258-06-8	C1CC2=C1C(=O)C3=C(C2=O)CC3	{25: 2, 11: 4, 15: 4}
OK	873-12-1	C1CCC2(C1)CCC=C2	{11: 6, 13: 1, 14: 2}
OK	873-69-8	C1=C/C(=C\N=O)/NC=C1	{32: 1, 34: 1, 6: 1, 14: 4, 15: 1, 29: 1}
OK	873-71-2	CCC[N+]1=CC=CC=C1.[Br-]	{1: 1, 2: 2, 18: 1, 14: 5, 33: 1}
OK	873-94-9	CC1CC(=O)CC(C1)(C)C	{1: 3, 11: 3, 12: 1, 13: 1, 25: 1}
OK	873-95-0	CC1(CC(=CC(=O)C1)N)C	{1: 2, 11: 2, 13: 1, 14: 1, 15: 1, 25: 1, 30: 1}
OK	87305-42-8	C1CC2C1C(=O)C3CCC3C2=O	{25: 2, 11: 4, 12: 4}
OK	87310-12-1	CCCCCCCCCOC(=O)CCCCCCCC	{1: 2, 2: 15, 28: 1}
OK	87324-44-5	C1C2CC(C1C3C2CC(C3)C(=O)O)C(=O)O	{27: 2, 11: 4, 12: 6}
OK	87340-27-0	C/C=C(/C)\C(=O)O[C@@H]1CCN2[C@@H]1C(=CC2)COC(=O)/C(=C\C)/CO	{1: 3, 2: 2, 33: 1, 6: 2, 7: 2, 11: 3, 12: 2, 14: 1, 15: 1, 20: 1, 28: 2}
OK	87362-54-7	C[C@@H]1CC[C@H]2C[C@@H]1CC[C@@H]2OC(=O)C	{1: 2, 11: 5, 12: 4, 28: 1}
OK	87365-91-1	COC(=O)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F.C(=C(F)F)(F)F	{1: 1, 4: 5, 7: 4, 16: 17, 22: 2, 28: 1}
OK	87373-47-5	C1CC1C23CCC(CC2)N=N3	{35: 2, 11: 6, 12: 2, 13: 1}
OK	87384-00-7	CC(=C(CC(=O)OC)C(=O)OC)C	{1: 4, 2: 1, 28: 2, 7: 2}
OK	87392-05-0	C1C[C@@H](OC1)C(=O)O	{27: 1, 11: 3, 12: 1, 23: 1}
OK	87392-07-2	C1C[C@H](OC1)C(=O)O	{27: 1, 11: 3, 12: 1, 23: 1}
OK	874-14-6	CN1C=CC(=O)N(C1=O)C	{1: 2, 33: 2, 14: 2, 25: 2}
OK	874-21-5	C=C1C(CCC1=O)C(=O)O	{5: 1, 11: 2, 12: 1, 15: 1, 25: 1, 27: 1}
OK	874-23-7	CC(=O)C1CCCCC1=O	{24: 1, 1: 1, 11: 4, 12: 1, 25: 1}
OK	874-68-0	CC(=O)C=C1CCCCC1	{24: 1, 1: 1, 11: 5, 6: 1, 15: 1}
OK	87421-23-6	CC(C)[C@@H]([C@H](C(=O)O)N)O	{27: 1, 1: 2, 3: 3, 20: 1, 30: 1}
OK	87424-91-7	C1CC2CC1C3C2C4CC3C5C4C6CC5C=C6	{11: 5, 12: 10, 14: 2}
OK	87453-54-1	C=CC(C1CCCC1)O	{3: 1, 5: 1, 6: 1, 11: 4, 12: 1, 20: 1}
OK	87459-26-5	C(CCl)C(C=O)(Cl)Cl	{17: 3, 2: 2, 4: 1, 26: 1}
OK	87470-41-5	CCCCCCCCCCCCCCCCCCOCC#N	{1: 1, 2: 18, 37: 1, 22: 1}
OK	875-22-9	C1CN2CC=C([C@H]2[C@H]1O)CO.Cl	{33: 1, 2: 1, 11: 3, 12: 2, 14: 1, 15: 1, 17: 1, 20: 2}
OK	875-72-9	C=C1C2CC3CC(C2)CC1C3	{11: 5, 12: 4, 5: 1, 15: 1}
OK	876-05-1	C1C[C@@H](C[C@@H]1C(=O)O)C(=O)O	{27: 2, 11: 3, 12: 2}
OK	876-18-6	C[C@@H]1CCO[C@H](C1)C=C(C)C	{1: 3, 6: 1, 7: 1, 11: 3, 12: 2, 23: 1}
OK	876-53-9	C1C2CC3(CC1CC(C2)(C3)Br)Br	{18: 2, 11: 6, 12: 2, 13: 2}
OK	87625-62-5	C[C@@H]1CC2(C=C(C3(CC3)[C@@]([C@H]2C1=O)(C)O)C)OC4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O	{1: 3, 2: 1, 11: 3, 12: 7, 13: 3, 14: 1, 15: 1, 20: 5, 22: 1, 23: 1, 25: 1}
OK	87641-23-4	C[C@@H]1CC([C@H]2[C@H]1C[C@@H](CC2)CC(=O)C)(C)C	{1: 4, 2: 1, 11: 4, 12: 4, 13: 1, 24: 1}
OK	87694-50-6	CC(C)C[C@@H](C(=O)NCOC)NC(=O)OC(C)(C)C	{1: 6, 2: 2, 3: 2, 4: 1, 22: 1, 24: 1, 28: 1, 31: 2}
OK	87694-52-8	CC(C)[C@@H](C(=O)N(C)OC)NC(=O)OC(C)(C)C	{1: 7, 3: 2, 4: 1, 33: 1, 22: 1, 24: 1, 28: 1, 31: 1}
OK	877-06-5	CC(C)(C)OC1C2C=CC1C=C2	{1: 3, 22: 1, 4: 1, 14: 4, 12: 3}
OK	877-31-6	C1CCC(CC1)N(C(=O)N)N=O	{33: 1, 34: 1, 11: 5, 12: 1, 24: 1, 29: 1, 30: 1}
OK	87777-46-6	CCCC(C)C(C#C)O	{1: 2, 2: 2, 3: 2, 9: 1, 10: 1, 20: 1}
OK	878-13-7	C1CCCCCC(=O)CCCC1	{25: 1, 11: 10}
OK	87827-60-9	CCCCCCCC[C@H](CO)O	{1: 1, 2: 8, 3: 1, 20: 2}
OK	87842-52-2	CC1(COC(OC1)(C)CCBr)C	{1: 3, 2: 2, 11: 2, 13: 2, 18: 1, 23: 2}
OK	87853-82-5	CCOC(=O)/C(=C(/C)\O)/C#N	{1: 2, 2: 1, 37: 1, 7: 2, 20: 1, 28: 1}
OK	87954-39-0	C[C@@H]1CC=C(C[C@H]1C)C	{1: 3, 11: 2, 12: 2, 14: 1, 15: 1}
OK	88-09-5	CCC(CC)C(=O)O	{27: 1, 1: 2, 2: 2, 3: 1}
OK	88-10-8	CCN(CC)C(=O)Cl	{24: 1, 1: 2, 2: 2, 33: 1, 17: 1}
OK	88-12-0	C=CN1CCCC1=O	{25: 1, 11: 3, 5: 1, 6: 1, 33: 1}
OK	88-41-5	CC(=O)OC1CCCCC1C(C)(C)C	{1: 4, 11: 4, 4: 1, 12: 2, 28: 1}
OK	88-84-6	CC1CCC(=C(C)C)CC2=C1CCC2C	{15: 3, 1: 4, 11: 5, 12: 2, 7: 1}
OK	880-09-1	C1CCN(CC1)CN2CCCCC2	{33: 2, 2: 1, 11: 10}
OK	880-52-4	CC(=O)NC12CC3CC(C1)CC(C3)C2	{1: 1, 11: 6, 12: 3, 13: 1, 24: 1, 31: 1}
OK	88057-40-3	CC1(C#CC(C#CC(C#CC(C#CC(C#C1)(C)C)(C)C)(C)C)(C)C)C	{1: 10, 10: 10, 13: 5}
OK	88090-34-0	C1=CC23C=CC2(C=C1)C=C3	{13: 2, 14: 8}
OK	88090-38-4	C1=CC2C=CC1C34C2(C=C3)C=C4	{12: 2, 13: 2, 14: 8}
OK	881-64-1	C1=CC2=NN3C=CC=CC3=NN2C=C1	{33: 2, 35: 2, 14: 8, 15: 2}
OK	88104-31-8	CCCCCCCCCCCCCCCCCCOC(=O)C(C)Cl	{1: 2, 2: 17, 3: 1, 28: 1, 17: 1}
OK	88109-73-3	CCCCCCC#CCCCCCCCCO	{1: 1, 2: 13, 20: 1, 10: 2}
OK	88168-99-4	CCCCCCCCCCCCCCCCCCOC(=O)CCCl	{1: 1, 2: 19, 28: 1, 17: 1}
OK	882-35-9	C1=CC=[N+](C=C1)CC[N+]2=CC=CC=C2.[Br-].[Br-]	{33: 2, 2: 2, 18: 2, 14: 10}
OK	88208-15-5	CC1CN(CC(C1C)C)N=O	{1: 3, 34: 1, 33: 1, 11: 2, 12: 3, 29: 1}
OK	88208-16-6	C=CCN(CC(CO)O)N=O	{33: 1, 2: 3, 3: 1, 5: 1, 6: 1, 34: 1, 20: 2, 29: 1}
OK	88288-20-4	C1CC23CCCC2(C1)C(=O)CC3	{25: 1, 11: 8, 13: 2}
OK	88312-71-4	C1=CSC(=CC=C2SC=CS2)S1	{41: 4, 14: 4, 6: 2, 15: 2}
OK	88371-89-5	C1C(CN(CC(CN1[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{33: 2, 11: 4, 13: 2, 38: 6}
OK	88381-75-3	C1C2CC3CC1CC(C2)C3([N+](=O)[O-])[N+](=O)[O-]	{11: 5, 12: 4, 13: 1, 38: 2}
OK	88472-61-1	CCCCCCC(=O)CCCCCCCCCCC(=O)OCC	{24: 1, 1: 2, 2: 16, 28: 1}
OK	88495-63-0	C[C@@H]1CC[C@H]2[C@H]([C@H](O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)OC(=O)CCC(=O)O)C	{1: 3, 2: 2, 11: 4, 12: 6, 13: 2, 23: 4, 27: 1, 28: 1}
OK	88551-98-8	C/C(=C/C(=O)C(C(F)F)(F)F)/S	{1: 1, 3: 1, 4: 1, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	88551-99-9	CC(=CC(=O)C(F)(F)F)S	{1: 1, 4: 1, 6: 1, 7: 1, 39: 1, 16: 3, 24: 1}
OK	88552-00-5	CCCC/C(=C/C(=O)C(C(F)F)(F)F)/S	{1: 1, 2: 3, 3: 1, 4: 1, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	88552-01-6	CC(C)/C(=C/C(=O)C(C(F)F)(F)F)/S	{1: 2, 3: 2, 4: 1, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	88552-02-7	CC(C)(C)/C(=C/C(=O)C(C(F)F)(F)F)/S	{1: 3, 3: 1, 4: 2, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	88552-04-9	CC(=CC(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F)S	{1: 1, 3: 1, 4: 3, 6: 1, 7: 1, 39: 1, 16: 8, 24: 1}
OK	88552-05-0	CCC(=CC(=O)C(C(F)F)(F)F)S	{1: 1, 2: 1, 3: 1, 4: 1, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	88552-06-1	CC(C)C(=CC(=O)C(C(F)F)(F)F)S	{1: 2, 3: 2, 4: 1, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	88566-61-4	C/C(=C/C(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F)/S	{1: 1, 3: 1, 4: 3, 6: 1, 7: 1, 39: 1, 16: 8, 24: 1}
OK	88566-62-5	CC/C(=C/C(=O)C(C(F)F)(F)F)/S	{1: 1, 2: 1, 3: 1, 4: 1, 6: 1, 7: 1, 39: 1, 16: 4, 24: 1}
OK	88571-73-7	CC1(C=[N+](C(C=[N+]1[O-])(C)C)[O-])C	{1: 4, 33: 2, 13: 2, 14: 2, 29: 2}
OK	88591-28-0	CCCCCCCCCCCCC(=O)OCCC	{1: 2, 2: 13, 28: 1}
OK	88635-76-1	CC1=C2CC(=C(C=C1)C)C(=CC=C2C)C	{1: 4, 11: 1, 14: 4, 15: 6}
OK	88635-77-2	CC(=C1C2=CC=CC=C1C=CC=C2)C	{1: 2, 15: 3, 14: 8, 7: 1}
OK	887-08-1	CC(C)[C@H]1CC[C@]2([C@]13CC[C@](O3)([C@H](C2)O)C)C	{1: 4, 3: 1, 11: 5, 12: 2, 13: 3, 20: 1, 23: 1}
OK	88718-31-4	C1CCC2C(C1)OCCCOCCOCCCO2	{11: 12, 12: 2, 23: 4}
OK	88736-68-9	CCCC(=O)OC(C)C(C)C	{1: 4, 2: 2, 3: 2, 28: 1}
OK	88752-37-8	CC(=C)C(=O)OCC(CC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	{1: 1, 2: 2, 3: 1, 4: 9, 5: 1, 7: 1, 16: 19, 20: 1, 28: 1}
OK	88885-89-6	C1CCN2CCCCN(C1)CC2	{33: 2, 11: 10}
OK	88885-91-0	C1CCN2CCCCN(CC1)CCCC2	{33: 2, 11: 13}
OK	88885-92-1	C1CCN2CCCCCN(CC1)CCCC2	{33: 2, 11: 14}
OK	88899-55-2	CC1CC(=CC=CC(C(OC(=O)C(=CC(=CC(C1O)C)C)OC)C(C)C(C(C)C2(CC(C(C(O2)C(C)C)C)O)O)O)OC)C	{1: 11, 3: 4, 11: 2, 12: 8, 13: 1, 14: 5, 15: 3, 20: 4, 22: 2, 23: 1, 28: 1}
OK	88915-94-0	CC=CCSC(C)C	{40: 1, 1: 3, 2: 1, 3: 1, 6: 2}
OK	88916-22-7	C/C=C/CSC(C)C	{40: 1, 1: 3, 2: 1, 3: 1, 6: 2}
OK	88917-22-0	COCC(C)OCC(C)OC(C)=O	{1: 4, 2: 2, 3: 2, 28: 1, 22: 2}
OK	88917-26-4	C(C(=O)O)C(CC(=O)O)(C(=O)O)O.OOO	{20: 3, 2: 2, 27: 3, 4: 1, 22: 1}
OK	88969-41-9	CCC(=C)CCCC(C)COC(=O)C	{1: 3, 2: 5, 3: 1, 5: 1, 7: 1, 28: 1}
OK	88973-36-8	CCOC(=O)CC(C=CC)O	{1: 2, 2: 2, 3: 1, 6: 2, 20: 1, 28: 1}
OK	88973-46-0	C(=C/C=O)\C=C\C(=O)O	{26: 1, 27: 1, 6: 4}
OK	88980-13-6	CC(CCCC=C)O	{1: 1, 2: 3, 3: 1, 5: 1, 6: 1, 20: 1}
OK	88984-08-1	C=CCOCC(COCC1C(C(C(C(O1)OC2C3COC2C(C(O3)O)O)O)O)O)O	{2: 4, 3: 1, 5: 1, 6: 1, 11: 1, 12: 10, 20: 6, 22: 3, 23: 3}
OK	88986-45-2	C=CCCOC(=O)Cl	{17: 1, 2: 2, 28: 1, 5: 1, 6: 1}
OK	89-48-5	CC1CCC(C(C1)OC(=O)C)C(C)C	{11: 3, 1: 4, 3: 1, 12: 3, 28: 1}
OK	89-49-6	CC1CCC(C(C1)OC(=O)C)C(=C)C	{1: 3, 5: 1, 7: 1, 11: 3, 12: 3, 28: 1}
OK	89-65-6	C([C@H]([C@@H]1C(=C(C(=O)O1)O)O)O)O	{2: 1, 3: 1, 12: 1, 15: 2, 20: 4, 28: 1}
OK	89-79-2	CC1CCC(C(C1)O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 3, 12: 3, 20: 1}
OK	89-81-6	CC1=CC(=O)C(CC1)C(C)C	{1: 3, 3: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	89-82-7	CC1CCC(=C(C)C)C(=O)C1	{1: 3, 7: 1, 11: 3, 12: 1, 15: 1, 25: 1}
OK	89-91-8	COC(C(=O)OC)OC	{1: 3, 3: 1, 28: 1, 22: 2}
OK	89-94-1	CC1CC=CCC1C=O	{1: 1, 26: 1, 11: 2, 12: 2, 14: 2}
OK	89021-88-5	C(CC(=O)N[C@@H](CSC(=C(C(=C(Cl)Cl)Cl)Cl)Cl)C(=O)NCC(=O)O)[C@@H](C(=O)O)N	{2: 4, 3: 2, 7: 4, 40: 1, 17: 5, 24: 2, 27: 2, 30: 1, 31: 2}
OK	89027-60-1	C=CCSCC#C	{2: 2, 5: 1, 6: 1, 40: 1, 9: 1, 10: 1}
OK	89033-26-1	C1C(C1[N+](=O)[O-])C(=O)O	{27: 1, 11: 1, 12: 2, 38: 1}
OK	89045-00-1	CCCCC(C)(C)OC	{1: 4, 2: 3, 4: 1, 22: 1}
OK	89045-01-2	CCC(C)C(C)OC	{1: 4, 2: 1, 3: 2, 22: 1}
OK	89045-02-3	CCC(C)C(C)(C)OC	{1: 5, 2: 1, 3: 1, 4: 1, 22: 1}
OK	89045-03-4	CC(C)CC(C)(C)OC	{1: 5, 2: 1, 3: 1, 4: 1, 22: 1}
OK	89045-04-5	CC(C)CC(C)OC	{1: 4, 2: 1, 3: 2, 22: 1}
OK	89190-98-7	CC(COCC(C)OC(=O)C=C)OCC(C)OC(=O)C=C	{1: 3, 2: 3, 3: 3, 5: 2, 6: 2, 22: 2, 28: 2}
OK	89216-54-6	CCCCCC(C)C1CCCC1	{11: 4, 1: 2, 2: 4, 3: 1, 12: 1}
OK	89223-57-4	CC1CCCC1C(C)C	{11: 3, 1: 3, 3: 1, 12: 2}
OK	89321-71-1	CCC[C@H]1[C@@H](O1)CO	{1: 1, 2: 3, 12: 2, 20: 1, 23: 1}
OK	89364-31-8	C1COCC1C(=O)O	{27: 1, 11: 3, 12: 1, 23: 1}
OK	89367-14-6	CCC(=O)CNCN=O	{1: 1, 2: 3, 34: 1, 24: 1, 29: 1, 31: 1}
OK	89381-13-5	C1CC(C(C1)O)N	{20: 1, 11: 3, 12: 2, 30: 1}
OK	89397-96-6	CCC(C)(C)OC(=O)C(C)(C)C	{1: 6, 2: 1, 4: 2, 28: 1}
OK	89422-42-4	CC(CC(=O)OC)OC(=O)C	{1: 3, 2: 1, 3: 1, 28: 2}
OK	89531-37-3	CC1CCC(N1)C(=O)O	{27: 1, 1: 1, 11: 2, 12: 2, 32: 1}
OK	89582-17-2	CC1CNCCNC1	{32: 2, 1: 1, 11: 4, 12: 1}
OK	89610-32-2	CCN(CC)C(=[N+](CC)CC)N(CC)CC.[Br-]	{1: 6, 2: 6, 33: 3, 18: 1, 7: 1}
OK	89614-32-4	CCCCCCCCNCCCS	{1: 1, 2: 10, 39: 1, 31: 1}
OK	89673-71-2	C[C@@H](C(=O)N)O	{24: 1, 1: 1, 3: 1, 20: 1, 30: 1}
OK	89683-62-5	C1C2C3C4CC5C3C1C67C28C49C56C1CC9C2C8CC7C12	{11: 4, 12: 12, 13: 4}
OK	89771-80-2	CC1(C2C3C4CC(C3C1N=N2)C=C4)C	{1: 2, 35: 2, 11: 1, 12: 6, 13: 1, 14: 2}
OK	89771-82-4	CC1(C2C3C4CCC(C4)C3C1N=N2)C	{1: 2, 11: 3, 12: 6, 13: 1, 35: 2}
OK	89796-76-9	CCCC(CCC)(Cl)Cl	{1: 2, 2: 4, 4: 1, 17: 2}
OK	89797-67-1	C(=O)(C(=O)O)NN=C(N)N	{34: 1, 7: 1, 24: 1, 27: 1, 30: 2, 31: 1}
OK	89837-93-4	CC(=O)CN(C(=O)N)N=O	{1: 1, 2: 1, 33: 1, 34: 1, 24: 2, 29: 1, 30: 1}
OK	89851-99-0	CNC(=O)C1CC(=O)N(C1)C	{1: 2, 33: 1, 11: 2, 12: 1, 24: 1, 25: 1, 31: 1}
OK	89876-55-1	CCCCCCCCCCCCCCCCCCOC(=O)C(C)Br	{1: 2, 2: 17, 3: 1, 28: 1, 18: 1}
OK	89896-73-1	CCCC=CCC=O	{1: 1, 2: 3, 26: 1, 6: 2}
OK	89896-78-6	CC1CC2CCC1O2	{1: 1, 11: 3, 12: 3, 23: 1}
OK	89909-08-0	CC(C)(C)C1=NSN=C(N=S=N1)C(C)(C)C	{1: 6, 35: 4, 4: 2, 41: 2, 15: 2}
OK	89911-79-5	CC(CN(CC(CO)O)N=O)O	{1: 1, 2: 3, 3: 2, 33: 1, 34: 1, 20: 3, 29: 1}
OK	89937-51-9	CC(C)CC(C(=O)O)NN	{1: 2, 2: 1, 3: 2, 27: 1, 30: 1, 31: 1}
OK	89942-12-1	CCCCCC=CBr	{1: 1, 2: 4, 18: 1, 6: 2}
OK	89982-04-7	C[C@H](CC(C)(C)CC(=O)Cl)C(=O)Cl	{1: 3, 2: 2, 3: 1, 4: 1, 17: 2, 24: 2}
OK	90-39-1	C1CCN2CC3CC(C2C1)CN4C3CCCC4	{33: 2, 11: 11, 12: 4}
OK	90-42-6	C1CCC(CC1)C2CCCCC2=O	{25: 1, 11: 9, 12: 2}
OK	90-65-3	CC(=C)C(=O)C(=CC(=O)O)OC	{1: 2, 5: 1, 6: 1, 7: 2, 22: 1, 24: 1, 27: 1}
OK	90-74-4	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OCC2[C@H]([C@@H]([C@@H]([C@@H](O2)O)O)O)O)O)O)O	{1: 1, 2: 1, 12: 10, 20: 7, 22: 1, 23: 2}
OK	90-80-2	C([C@@H]1[C@H]([C@@H]([C@H](C(=O)O1)O)O)O)O	{20: 4, 2: 1, 12: 4, 28: 1}
OK	90-89-1	CCN(CC)C(=O)N1CCN(CC1)C	{24: 1, 1: 3, 2: 2, 11: 4, 33: 3}
OK	90000-16-1	C(CSC(=N)N)NCCSC(=N)N.Br.Br	{2: 4, 36: 2, 7: 2, 40: 2, 18: 2, 30: 2, 31: 1}
OK	9002-01-1	C1CCC(CC1)C2CC(NC2)C(=O)O	{27: 1, 32: 1, 11: 7, 12: 3}
OK	9002-18-0	CC1[C@H]([C@H]2C(C(O1)CO2)OC3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)OC)O)O	{1: 2, 2: 1, 11: 1, 12: 10, 20: 4, 22: 2, 23: 3}
OK	9002-89-5	C=CO	{20: 1, 5: 1, 6: 1}
OK	9003-00-3	C=CC#N.C=CCl	{17: 1, 5: 2, 6: 2, 37: 1}
OK	9003-22-9	CC(=O)OC=C.C=CCl	{1: 1, 28: 1, 5: 2, 6: 2, 17: 1}
OK	9003-29-6	CCC=C.C/C=C/C	{1: 3, 2: 1, 5: 1, 6: 3}
OK	9004-48-2	CCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=O)CC)OC(=O)CC)OC(=O)CC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)CC)OC(=O)CC)OC(=O)CC)OC(=O)CC	{1: 8, 2: 10, 12: 10, 22: 1, 23: 2, 28: 8}
OK	9004-54-0	C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC(C(C(C(C=O)O)O)O)O)O)O)O)O)O)O)O	{2: 3, 3: 4, 12: 10, 20: 11, 22: 2, 23: 2, 26: 1}
OK	9004-83-5	CC(C)(C)CCCCCCCCSCCOCCO	{1: 3, 2: 12, 4: 1, 40: 1, 20: 1, 22: 1}
OK	9004-95-9	CCCCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO	{1: 1, 2: 55, 20: 1, 22: 20}
OK	9004-96-0	CCCCCCCC/C=C\CCCCCCCC(=O)OCCO	{1: 1, 2: 16, 20: 1, 6: 2, 28: 1}
OK	9004-98-2	CCCCCCCC/C=C\CCCCCCCCOCCO	{1: 1, 2: 17, 20: 1, 22: 1, 6: 2}
OK	9004-99-3	CCCCCCCCCCCCCCCCCC(=O)OCCO	{1: 1, 2: 18, 20: 1, 28: 1}
OK	9005-08-7	CCCCCCCCCCCCCCCCC(=O)O.C(CO)O	{1: 1, 2: 17, 27: 1, 20: 2}
OK	9005-27-0	C(COC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OCCO)OCCO)OCCO)OCCO)O.C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O)O	{20: 10, 2: 12, 12: 10, 22: 5, 23: 2}
OK	9005-64-5	CCCCCCCCCCCC(=O)OCCOCC(C1C(C(CO1)OCCO)OCCO)OCCO	{1: 1, 2: 19, 3: 1, 11: 1, 12: 3, 20: 3, 22: 4, 23: 1, 28: 1}
OK	9005-65-6	CCCCCCCCC=CCCCCCCCC(=O)OCCOCC(C1C(C(CO1)OCCO)OCCO)OCCO	{1: 1, 2: 23, 3: 1, 6: 2, 11: 1, 12: 3, 20: 3, 22: 4, 23: 1, 28: 1}
OK	9005-79-2	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O)CO)O)O)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O)O	{20: 14, 2: 4, 12: 20, 22: 3, 23: 4}
OK	9006-50-2	CC1(C(=O)N(C(=O)O1)C(=O)N)C	{1: 2, 33: 1, 13: 1, 24: 1, 25: 1, 28: 1, 30: 1}
OK	9008-22-4	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O	{20: 11, 2: 3, 12: 15, 22: 2, 23: 3}
OK	9008-54-2	CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)CC(C)C)CCN)NC(=O)[C@H](CCN)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCN)NC=O)[C@@H](C)O)CCN)CCN	{32: 7, 1: 6, 2: 12, 3: 7, 11: 2, 12: 7, 20: 2, 24: 3, 25: 7, 26: 1, 30: 5, 31: 4}
OK	90091-76-2	CCCCCCCCCCC[C@@H](CO)O	{1: 1, 2: 11, 3: 1, 20: 2}
OK	9010-85-9	CC(=C)C.CC(=C)C=C	{1: 3, 5: 3, 6: 1, 7: 2}
OK	9011-04-5	CN(C)CCCCCCN(C)C.C(CBr)CBr	{1: 4, 2: 9, 18: 2, 33: 2}
OK	9011-06-7	C=CCl.C=C(Cl)Cl	{17: 3, 5: 2, 6: 1, 7: 1}
OK	9011-09-0	CCCCOC(=O)C=C.C=C(Cl)Cl	{1: 1, 2: 3, 5: 2, 6: 1, 7: 1, 17: 2, 28: 1}
OK	9012-76-4	COC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)N)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)N)O)CO)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)N)O)N)O)N)O)N)O)N)O)N)O	{1: 1, 2: 9, 12: 45, 20: 20, 22: 8, 23: 9, 28: 1, 30: 8, 31: 1}
OK	90139-63-2	CC(C(=O)OCCO)(Cl)Cl	{1: 1, 2: 2, 4: 1, 17: 2, 20: 1, 28: 1}
OK	90162-24-6	CCCCC(CC(C)O)O	{1: 2, 2: 4, 3: 2, 20: 2}
OK	90196-91-1	C1CN2CCC1CC2C#N	{33: 1, 11: 5, 12: 2, 37: 1}
OK	90224-29-6	CC(C)C(C)(C)CCCl	{1: 4, 2: 2, 3: 1, 4: 1, 17: 1}
OK	90268-51-2	CCOC(=O)CC(=O)C.CC(CO)O	{1: 3, 2: 3, 3: 1, 20: 2, 24: 1, 28: 1}
OK	90290-05-4	COC[C@H]1CC[C@@H](N1)COC	{32: 1, 1: 2, 2: 2, 11: 2, 12: 2, 22: 2}
OK	90293-50-8	CC(=NOC)C(=NOC(=O)N(C)SSC(C)(C)C)C(=O)N(C)C	{1: 8, 34: 2, 4: 1, 33: 2, 7: 2, 40: 2, 22: 1, 24: 1, 28: 1}
OK	90293-52-0	C/C(=N\OC)/C(=N/OC(=O)N(C)SN(C)C(=O)O/N=C(\C)/SC)/C(=O)N(C)C	{1: 8, 34: 3, 33: 3, 40: 2, 7: 3, 22: 1, 24: 1, 28: 2}
OK	90293-56-4	CC(=NOC)C(=NOC(=O)N(C)SN(C)C(=O)ON=C(C(=NOC)C)C(=O)N(C)C)C(=O)N(C)C	{1: 10, 34: 4, 33: 4, 40: 1, 7: 4, 22: 2, 24: 2, 28: 2}
OK	903-30-0	CC(C=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C	{1: 3, 3: 1, 11: 8, 12: 4, 13: 2, 14: 1, 15: 1, 25: 1, 26: 1}
OK	90325-47-6	CCCC(C(CO)O)O	{1: 1, 2: 3, 3: 2, 20: 3}
OK	90357-58-7	CCCOC(=O)CO	{1: 1, 2: 3, 20: 1, 28: 1}
OK	9036-66-2	CC1C(C(C(C(O1)CO)O)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)OC)O)O)OC)O)O	{1: 3, 2: 2, 11: 1, 12: 14, 20: 7, 22: 4, 23: 3}
OK	90364-91-3	C/C=C\1/C[C@H]([C@](C(=O)OC/C/2=C/CN(CC[C@H](C2=O)OC1=O)C)(C)OC(=O)C)C	{1: 5, 6: 1, 33: 1, 11: 5, 12: 2, 13: 1, 14: 1, 15: 2, 25: 1, 28: 3}
OK	90365-63-2	CCCC[C@H](CCC)O	{1: 2, 2: 5, 3: 1, 20: 1}
OK	9038-95-3	CCCCO.CC(CO)O.C(CO)O	{1: 2, 2: 6, 3: 1, 20: 5}
OK	90380-52-2	CCCC(C)OC(=O)CCl	{1: 2, 2: 3, 3: 1, 28: 1, 17: 1}
OK	90380-55-5	CCCC(C)OC(=O)C(Cl)Cl	{1: 2, 2: 2, 3: 2, 28: 1, 17: 2}
OK	9041-33-2	CC1CO1.C=CCOCC=C.C1CO1	{1: 1, 2: 2, 5: 2, 6: 2, 11: 3, 12: 1, 22: 1, 23: 2}
OK	9046-38-2	[C@@H]1([C@H]([C@H](OC([C@@H]1O)O)C(=O)O)O)O	{20: 4, 27: 1, 12: 5, 23: 1}
OK	9049-76-7	CC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)OC)O)O)OC4C(C(C(C(O4)CO)OC)O)OCC(C)(CO)O)O)O)O)O	{1: 4, 2: 6, 4: 1, 12: 20, 20: 12, 22: 6, 23: 4}
OK	905-30-6	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC=C4[C@@]3(CCC(=C4)N5CCCC5)C	{1: 2, 33: 1, 11: 11, 12: 3, 13: 2, 14: 2, 15: 2, 25: 1}
OK	9050-18-4	C(CC(=O)OCCOCCO)C(=O)O	{28: 1, 2: 6, 27: 1, 20: 1, 22: 1}
OK	9050-36-6	C([C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O)O	{2: 1, 3: 4, 20: 5, 26: 1}
OK	90547-83-4	CCC12CCC(C1(C)C)(C(=O)C2)C	{1: 4, 2: 1, 11: 3, 13: 3, 25: 1}
OK	90566-09-9	C=CCOC1C(NC(=O)N1)OCC=C	{32: 2, 2: 2, 5: 2, 6: 2, 12: 2, 22: 2, 25: 1}
OK	90600-20-7	CC(C)(C)OC(=O)N[C@@H](CC=C)C(=O)O	{1: 3, 2: 1, 3: 1, 4: 1, 5: 1, 6: 1, 27: 1, 28: 1, 31: 1}
OK	90601-72-2	CC(C)(CCC=C)Br	{1: 2, 2: 2, 4: 1, 5: 1, 6: 1, 18: 1}
OK	90632-73-8	CNC(=O)C12C3C1C4C2(C4C3)C(=O)O	{1: 1, 11: 1, 12: 4, 13: 2, 24: 1, 27: 1, 31: 1}
OK	90676-25-8	CCCC1CCCCC1O	{1: 1, 2: 2, 11: 4, 12: 2, 20: 1}
OK	90722-14-8	CCCCCCCC#CCl	{1: 1, 2: 6, 10: 2, 17: 1}
OK	90729-15-0	CCCOC1C(NC(=O)N1)OCCC	{32: 2, 1: 2, 2: 4, 12: 2, 22: 2, 25: 1}
OK	9076-04-4	CC1CO1.C=CC(=O)O.C1CO1	{1: 1, 5: 1, 6: 1, 11: 3, 12: 1, 23: 2, 27: 1}
OK	9077-17-2	CC(CO)O.C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O	{1: 1, 2: 2, 3: 1, 8: 2, 11: 2, 13: 2, 14: 8, 34: 2, 20: 2, 29: 2}
OK	90777-42-7	CC1=C(C2CC1C(=C2C#N)C#N)C	{1: 2, 11: 1, 12: 2, 37: 2, 15: 4}
OK	90808-83-6	CCCC(C)(C)CC(=O)O	{1: 3, 2: 3, 27: 1, 4: 1}
OK	90817-44-0	C1CC2CCC1CCC3=CCC(=CC3)CC2	{11: 10, 12: 2, 14: 2, 15: 2}
OK	9082-00-2	CC(CO)O.C(CO)O.C(C(CO)O)O	{1: 1, 2: 5, 3: 2, 20: 7}
OK	90820-47-6	CC1(C2CCC1(COC2=O)C)C	{1: 3, 11: 3, 12: 1, 13: 2, 28: 1}
OK	9086-84-4	C1CCC(=O)OCC1.C(CO)COCCCO	{28: 1, 2: 6, 11: 5, 20: 2, 22: 1}
OK	90866-33-4	CCOC(=O)C[C@H](CCl)O	{1: 1, 2: 3, 3: 1, 17: 1, 20: 1, 28: 1}
OK	90921-11-2	C1CC2(C13C=CC(=O)O3)C=CC(=O)O2	{11: 2, 28: 2, 13: 2, 14: 4}
OK	90990-89-9	CC#CNC	{1: 2, 10: 2, 31: 1}
OK	91-09-8	CO[C@@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O	{1: 1, 11: 1, 12: 4, 20: 3, 22: 1, 23: 1}
OK	91-65-6	CCN(CC)C1CCCCC1	{1: 2, 2: 2, 11: 5, 12: 1, 33: 1}
OK	910-31-6	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)Cl)C)C	{1: 5, 2: 3, 3: 2, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 17: 1}
OK	91062-54-3	CCCC1(C(=O)NC(=O)NC1=O)CC(=C)Br	{32: 2, 1: 1, 2: 3, 5: 1, 7: 1, 13: 1, 18: 1, 25: 3}
OK	91069-39-5	CCC1CCC2(CC1)CCC(=O)O2	{1: 1, 2: 1, 11: 6, 12: 1, 13: 1, 28: 1}
OK	91103-47-8	C[C@H](C(=O)OC)NC(=O)OC(C)(C)C	{1: 5, 3: 1, 4: 1, 28: 2, 31: 1}
OK	91112-46-8	CC(CC/C=C/C(=O)O)/C=C/C(=O)O.CC(=C)C(=O)OC	{1: 3, 2: 2, 3: 1, 5: 1, 6: 4, 7: 1, 27: 2, 28: 1}
OK	91216-69-2	CC=CCOC1C(NC(=O)N1)OCC=CC	{32: 2, 1: 2, 2: 2, 6: 4, 12: 2, 22: 2, 25: 1}
OK	91266-48-7	C1CC2=C3CCC(=C4CCC(=C1CC2)CC4)CC3	{11: 12, 15: 6}
OK	91308-69-9	C=CCN(CCO)N=O	{33: 1, 2: 3, 5: 1, 6: 1, 34: 1, 20: 1, 29: 1}
OK	91308-71-3	CC(=O)CN(CC=C)N=O	{1: 1, 2: 2, 5: 1, 6: 1, 33: 1, 34: 1, 24: 1, 29: 1}
OK	91336-54-8	CC(C)CCCC(C)C/C(=N/N)/C	{1: 4, 2: 4, 3: 2, 7: 1, 34: 1, 30: 1}
OK	91423-46-0	CCC=CC=CC=CC=CC=COC[C@H](CO)O	{1: 1, 2: 3, 3: 1, 6: 10, 20: 2, 22: 1}
OK	91499-02-4	CC(=O)OC1CCC2(C1(CCC2)C)C	{1: 3, 11: 5, 12: 1, 13: 2, 28: 1}
OK	915-05-9	CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)C(C)C	{1: 7, 2: 3, 3: 3, 11: 8, 12: 5, 13: 2, 14: 1, 15: 1, 28: 1}
OK	91548-32-2	C(C(C(C(C(=O)C(=O)O)O)O)O)O	{24: 1, 27: 1, 2: 1, 3: 3, 20: 4}
OK	91632-94-9	C=C1C2C3CC4C2C(=O)C5C4C3C51	{25: 1, 11: 1, 12: 8, 5: 1, 15: 1}
OK	91648-24-7	C=CCOCC(CO)(CO)CO	{2: 5, 4: 1, 5: 1, 6: 1, 20: 3, 22: 1}
OK	917-92-0	CC(C)(C)C#C	{1: 3, 10: 1, 4: 1, 9: 1}
OK	917-93-1	CC(C)(C=O)Cl	{1: 2, 26: 1, 4: 1, 17: 1}
OK	917-95-3	CC(C)(C)N=O	{1: 3, 34: 1, 4: 1, 29: 1}
OK	918-00-3	CC(=O)C(Cl)(Cl)Cl	{24: 1, 1: 1, 4: 1, 17: 3}
OK	918-02-5	CC(C)(C)N(C)C	{1: 5, 4: 1, 33: 1}
OK	918-07-0	CC(C)(C)C(C)(C)Cl	{1: 5, 4: 2, 17: 1}
OK	918-09-2	CCC(C)(C(C)(C)C)Cl	{1: 5, 2: 1, 4: 2, 17: 1}
OK	918-22-9	C(C(C(C(F)(F)Br)(F)F)(F)F)(C(C(F)(F)Br)(F)F)(F)F	{16: 12, 18: 2, 4: 6}
OK	918-37-6	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{4: 2, 38: 6}
OK	918-52-5	CC(CO)([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 4: 1, 38: 2, 20: 1}
OK	918-54-7	C(C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])O	{20: 1, 2: 1, 4: 1, 38: 3}
OK	918-78-5	CC(CCl)(C(=O)OC)Cl	{1: 2, 2: 1, 4: 1, 28: 1, 17: 2}
OK	918-79-6	CC(C)C(C(C)(C)C=O)O	{1: 4, 26: 1, 3: 2, 4: 1, 20: 1}
OK	918-82-1	CCC(C)(C)C#C	{1: 3, 2: 1, 4: 1, 10: 1, 9: 1}
OK	918-84-3	CCC(C)(CC)Cl	{1: 3, 2: 2, 4: 1, 17: 1}
OK	918-85-4	CCC(C)(C=C)O	{1: 2, 2: 1, 4: 1, 5: 1, 6: 1, 20: 1}
OK	91819-58-8	CC1=CCC(C1(C)C)CC=O	{1: 3, 2: 1, 11: 1, 12: 1, 13: 1, 14: 1, 15: 1, 26: 1}
OK	919-12-0	CCC(C)(CC)C#C	{1: 3, 2: 2, 4: 1, 10: 1, 9: 1}
OK	919-94-8	CCC(C)(C)OCC	{1: 4, 2: 2, 4: 1, 22: 1}
OK	91913-99-4	CCOC(=O)C(C(C)C)Cl	{1: 3, 2: 1, 3: 2, 28: 1, 17: 1}
OK	91972-45-1	CCCC1CCCC2C1CCCC2	{1: 1, 2: 2, 11: 7, 12: 3}
OK	92-51-3	C1CCC(CC1)C2CCCCC2	{11: 10, 12: 2}
OK	920-35-4	CC(=C)CF	{16: 1, 1: 1, 2: 1, 5: 1, 7: 1}
OK	920-37-6	C=C(C#N)Cl	{17: 1, 37: 1, 5: 1, 7: 1}
OK	920-46-7	CC(=C)C(=O)Cl	{24: 1, 1: 1, 17: 1, 5: 1, 7: 1}
OK	920-64-9	C(C(=O)C(F)(F)Cl)(F)F	{16: 4, 17: 1, 3: 1, 4: 1, 24: 1}
OK	920-66-1	C(C(F)(F)F)(C(F)(F)F)O	{16: 6, 20: 1, 3: 1, 4: 2}
OK	92015-65-1	CC1CCC2C(C(=O)OC2C1)C	{1: 2, 11: 3, 12: 4, 28: 1}
OK	92042-21-2	CC1CCCC(C1=O)C(=O)C2CC(=O)NC(=O)C2	{32: 1, 1: 1, 11: 5, 12: 3, 24: 1, 25: 3}
OK	92078-92-7	C[15NH][15N]=O	{1: 1, 34: 1, 29: 1, 31: 1}
OK	921-03-9	C(C(=O)C(Cl)Cl)Cl	{24: 1, 17: 3, 2: 1, 3: 1}
OK	921-04-0	CCC(C)N(C)C	{1: 4, 2: 1, 3: 1, 33: 1}
OK	921-08-4	CC(C)C(C(=O)O)Cl	{27: 1, 1: 2, 3: 2, 17: 1}
OK	921-09-5	C=C(C(=C(Cl)Cl)Cl)Cl	{17: 4, 5: 1, 7: 3}
OK	921-11-9	CC(=O)C(=O)C(=O)C	{24: 3, 1: 2}
OK	921-13-1	C([N+](=O)[O-])([N+](=O)[O-])Cl	{17: 1, 3: 1, 38: 2}
OK	921-14-2	CC(C)N(C(C)C)N	{1: 4, 3: 2, 30: 1, 33: 1}
OK	921-20-0	CC(C(CO)C(C)O)O	{1: 2, 2: 1, 3: 3, 20: 3}
OK	921-47-1	CCC(C)C(C)C(C)C	{1: 5, 2: 1, 3: 3}
OK	921-74-4	CCC(C)[C@@H](C(=O)OCC)N	{1: 3, 2: 2, 3: 2, 28: 1, 30: 1}
OK	92168-98-4	CC(C)CCCCCCCCCC=O	{1: 2, 2: 9, 3: 1, 26: 1}
OK	922-09-8	CCCCC(CC)COC(=O)CCCCCC(CC)C(=O)OCC(CC)CCCC	{1: 5, 2: 16, 3: 3, 28: 2}
OK	922-17-8	CCC(C(CC)O)O	{1: 2, 2: 2, 3: 2, 20: 2}
OK	922-28-1	CCCC(C)C(C)CC	{1: 4, 2: 3, 3: 2}
OK	922-59-8	CCC(C)C#C	{1: 2, 2: 1, 3: 1, 10: 1, 9: 1}
OK	922-61-2	CCC(=CC)C	{1: 3, 2: 1, 6: 1, 7: 1}
OK	922-62-3	C/C=C(/C)CC	{1: 3, 2: 1, 6: 1, 7: 1}
OK	922-63-4	CCC(=C)C=O	{1: 1, 2: 1, 26: 1, 5: 1, 7: 1}
OK	922-64-5	C=C(C#N)C#N	{37: 2, 5: 1, 7: 1}
OK	922-65-6	C=CC(C=C)O	{3: 1, 20: 1, 5: 2, 6: 2}
OK	922-67-8	COC(=O)C#C	{1: 1, 10: 1, 28: 1, 9: 1}
OK	922-68-9	COC(=O)C=O	{1: 1, 26: 1, 28: 1}
OK	922-69-0	COC(=C)OC	{1: 2, 5: 1, 22: 2, 7: 1}
OK	922-89-4	CC(=O)N(CCN(C(=O)C)[N+](=O)[O-])[N+](=O)[O-]	{24: 2, 1: 2, 2: 2, 38: 2, 33: 2}
OK	92224-19-6	C1CSC=CC2C1CSC2	{41: 2, 11: 4, 12: 2, 14: 2}
OK	92234-54-3	C1C2CC3CC1CC(C2)(C3)N4C=CC=N4	{33: 1, 35: 1, 11: 6, 12: 3, 13: 1, 14: 3}
OK	923-01-3	C(C#N)C(C(=O)O)N	{27: 1, 2: 1, 3: 1, 37: 1, 30: 1}
OK	923-06-8	C(C(C(=O)O)Br)C(=O)O	{27: 2, 2: 1, 3: 1, 18: 1}
OK	923-26-2	C=C(C)C(=O)OCC(C)O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 20: 1, 28: 1}
OK	923-28-4	CCCCCC(=O)C(C)C	{24: 1, 1: 3, 2: 4, 3: 1}
OK	923-32-0	C(C(C(=O)O)N)SSCC(C(=O)O)N	{27: 2, 40: 2, 2: 2, 3: 2, 30: 2}
OK	923-37-5	C(C(C(=O)O)NC(=O)N)C(=O)O	{2: 1, 3: 1, 24: 1, 27: 2, 30: 1, 31: 1}
OK	923-42-2	C(CC(=O)O)C(CC(=O)O)C(=O)O	{27: 3, 2: 3, 3: 1}
OK	92369-80-7	CCCCC1CCCC2C1CCCC2	{1: 1, 2: 3, 11: 7, 12: 3}
OK	92369-82-9	CCC(C)C1CCCC2C1CCCC2	{11: 7, 1: 2, 2: 1, 3: 1, 12: 3}
OK	92369-83-0	CC(C)CC1CCCC2C1CCCC2	{11: 7, 1: 2, 2: 1, 3: 1, 12: 3}
OK	924-16-3	CCCCN(CCCC)N=O	{1: 2, 2: 6, 34: 1, 29: 1, 33: 1}
OK	924-41-4	C=CCC(C=C)O	{2: 1, 3: 1, 20: 1, 5: 2, 6: 2}
OK	924-42-5	C=CC(=O)NCO	{2: 1, 5: 1, 6: 1, 20: 1, 24: 1, 31: 1}
OK	924-43-6	CCC(C)ON=O	{1: 2, 34: 1, 3: 1, 2: 1, 22: 1, 29: 1}
OK	924-44-7	CCOC(=O)C=O	{1: 1, 2: 1, 28: 1, 26: 1}
OK	924-46-9	CCCN(C)N=O	{1: 2, 2: 2, 34: 1, 29: 1, 33: 1}
OK	924-49-2	C(C(CN)O)C(=O)O	{27: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	924-50-5	CC(=CC(=O)OC)C	{1: 3, 28: 1, 6: 1, 7: 1}
OK	924-83-4	CC(C)OC(=O)C=CC(=O)O	{27: 1, 1: 2, 3: 1, 28: 1, 6: 2}
OK	924-88-9	CC(C)OC(=O)CCC(=O)OC(C)C	{1: 4, 2: 2, 3: 2, 28: 2}
OK	924-99-2	CCOC(=O)/C=C/N(C)C	{1: 3, 2: 1, 28: 1, 6: 2, 33: 1}
OK	925-03-1	CCCOC(=O)C=CC(=O)O	{1: 1, 2: 2, 27: 1, 28: 1, 6: 2}
OK	925-06-4	CC(C)COC(=O)CCC(=O)OCC(C)C	{1: 4, 2: 4, 3: 2, 28: 2}
OK	925-15-5	CCCOC(=O)CCC(=O)OCCC	{1: 2, 2: 6, 28: 2}
OK	925-16-6	C=CCOC(=O)CCC(=O)OCC=C	{2: 4, 28: 2, 5: 2, 6: 2}
OK	925-21-3	CCCCOC(=O)C=CC(=O)O	{1: 1, 2: 3, 27: 1, 28: 1, 6: 2}
OK	925-49-5	CCCC(=O)NCCNC(=O)CCC	{24: 2, 1: 2, 2: 6, 31: 2}
OK	925-51-9	CCCCCCCCCCCC(=O)CCC	{24: 1, 1: 2, 2: 12}
OK	925-52-0	CC(C=C)C=CC=C	{1: 1, 3: 1, 5: 2, 6: 4}
OK	925-54-2	CCCCC(C)C=O	{1: 2, 2: 3, 3: 1, 26: 1}
OK	925-56-4	COC(=O)C=CC#N	{1: 1, 28: 1, 37: 1, 6: 2}
OK	925-60-0	CCCOC(=O)C=C	{1: 1, 2: 2, 28: 1, 5: 1, 6: 1}
OK	925-72-4	CC=C(C)CCOC(=O)C	{1: 3, 2: 2, 28: 1, 6: 1, 7: 1}
OK	925-76-8	CN(C)CCNC(=O)C=C	{1: 2, 2: 2, 5: 1, 6: 1, 33: 1, 24: 1, 31: 1}
OK	925-78-0	CCCCCCC(=O)CC	{24: 1, 1: 2, 2: 6}
OK	925-83-7	C(CCCCC(=O)NN)CCCC(=O)NN	{24: 2, 2: 8, 30: 2, 31: 2}
OK	925-89-3	CC=CS	{1: 1, 6: 2, 39: 1}
OK	925-91-7	CCN=O	{1: 1, 2: 1, 34: 1, 29: 1}
OK	92557-39-6	CCOC(=O)CCC(C)(OCC)OCC	{1: 4, 2: 5, 4: 1, 22: 2, 28: 1}
OK	926-02-3	CC(C)(C)OC=C	{1: 3, 22: 1, 4: 1, 5: 1, 6: 1}
OK	926-26-1	CC(C)(C)OC(=O)CCC(=O)OC(C)(C)C	{1: 6, 2: 2, 4: 2, 28: 2}
OK	926-41-0	CC(=O)OCC(C)(C)C	{1: 4, 2: 1, 4: 1, 28: 1}
OK	926-47-6	CCCCSC(C)(C)C	{40: 1, 1: 4, 2: 3, 4: 1}
OK	926-54-5	C=C(C)/C=C/C	{1: 2, 5: 1, 6: 2, 7: 1}
OK	926-55-6	CC#CC(=C)C	{1: 2, 10: 2, 5: 1, 7: 1}
OK	926-56-7	CC(=CC=C)C	{1: 2, 5: 1, 6: 2, 7: 1}
OK	926-57-8	C/C(=C/CCl)/Cl	{1: 1, 2: 1, 17: 2, 6: 1, 7: 1}
OK	926-63-6	CCCN(C)C	{1: 3, 2: 2, 33: 1}
OK	926-64-7	CN(C)CC#N	{1: 2, 2: 1, 37: 1, 33: 1}
OK	926-65-8	CC(C)OC=C	{1: 2, 22: 1, 3: 1, 5: 1, 6: 1}
OK	926-66-9	CCOC(=C)C	{1: 2, 2: 1, 5: 1, 22: 1, 7: 1}
OK	926-73-8	CC(C)SC(=O)C	{24: 1, 1: 3, 3: 1, 40: 1}
OK	926-77-2	CC(C(=O)O)NC(=O)CN	{1: 1, 2: 1, 3: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	926-79-4	CC(C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)C(=O)O)N	{1: 4, 3: 4, 24: 3, 27: 1, 30: 1, 31: 3}
OK	926-82-9	CCC(C)CC(C)CC	{1: 4, 2: 3, 3: 2}
OK	926-98-7	C/C=C/C(C=C(C)C)O	{1: 3, 3: 1, 20: 1, 6: 3, 7: 1}
OK	92600-11-8	CC(C)C(OC(=O)Cl)Cl	{1: 2, 3: 2, 28: 1, 17: 2}
OK	92687-41-7	CCOC(=O)C1=C(CCCC1)C(=O)OCC	{1: 2, 2: 2, 11: 4, 28: 2, 15: 2}
OK	92687-89-3	C1C2C3C4C1C5C2C(=CCl)C3C4C5=O	{6: 1, 11: 1, 12: 8, 15: 1, 17: 1, 25: 1}
OK	927-07-1	CC(C)(C)C(=O)OOC(C)(C)C	{1: 6, 4: 2, 22: 1, 28: 1}
OK	927-21-9	CC(C(=O)NCC(=O)NCC(=O)O)N	{1: 1, 2: 2, 3: 1, 24: 2, 27: 1, 30: 1, 31: 2}
OK	927-45-7	CCCCCCC(CCCCCC)O	{1: 2, 2: 10, 3: 1, 20: 1}
OK	927-49-1	CCCCCC(=O)CCCCC	{24: 1, 1: 2, 2: 8}
OK	927-54-8	CC(CCC=C)Cl	{1: 1, 2: 2, 3: 1, 5: 1, 6: 1, 17: 1}
OK	927-58-2	C(CC(=O)Cl)CBr	{24: 1, 17: 1, 2: 3, 18: 1}
OK	927-60-6	C(CC(=O)N)CO	{24: 1, 2: 3, 20: 1, 30: 1}
OK	927-62-8	CCCCN(C)C	{1: 3, 2: 3, 33: 1}
OK	927-63-9	CN(C)C=CC=O	{1: 2, 26: 1, 6: 2, 33: 1}
OK	927-68-4	CC(=O)OCCBr	{1: 1, 2: 2, 28: 1, 18: 1}
OK	927-70-8	CC(=O)SCCBr	{24: 1, 1: 1, 2: 2, 18: 1, 40: 1}
OK	927-73-1	C=CCCCl	{17: 1, 2: 2, 5: 1, 6: 1}
OK	927-74-2	C#CCCO	{9: 1, 2: 2, 20: 1, 10: 1}
OK	927-80-0	CCOC#C	{1: 1, 2: 1, 10: 1, 22: 1, 9: 1}
OK	927-83-3	CC(C)(C)N=NC(C)(C)C	{1: 6, 34: 2, 4: 2}
OK	927-84-4	C(OOC(F)(F)F)(F)(F)F	{16: 6, 4: 2, 22: 2}
OK	927-97-9	CC(=CCC(=C)C)C	{1: 3, 2: 1, 5: 1, 6: 1, 7: 2}
OK	927-99-1	CC(C)C#CC(C)C	{1: 4, 10: 2, 3: 2}
OK	92736-02-2	CCOC(=O)C(=O)CC(=O)C=C(C)C	{1: 3, 2: 2, 6: 1, 7: 1, 24: 2, 28: 1}
OK	928-40-5	CC(CCCCO)O	{1: 1, 2: 4, 3: 1, 20: 2}
OK	928-49-4	CCC#CCC	{1: 2, 2: 2, 10: 2}
OK	928-50-7	C=CCCCCl	{17: 1, 2: 3, 5: 1, 6: 1}
OK	928-51-8	C(CCCl)CO	{17: 1, 2: 4, 20: 1}
OK	928-53-0	C(=CC#N)C#N	{37: 2, 6: 2}
OK	928-55-2	CCOC=CC	{1: 2, 2: 1, 22: 1, 6: 2}
OK	928-56-3	CCO/C=C\Cl	{1: 1, 2: 1, 22: 1, 6: 2, 17: 1}
OK	928-57-4	C(CCl)SC#N	{40: 1, 17: 1, 2: 2, 37: 1}
OK	928-67-6	CC(=C)CC=CC(=C)C	{1: 2, 2: 1, 5: 2, 6: 2, 7: 2}
OK	928-68-7	CC(C)CCCC(=O)C	{24: 1, 1: 3, 2: 3, 3: 1}
OK	928-73-4	C(=NNC(=O)N)C(=O)O	{34: 1, 6: 1, 24: 1, 27: 1, 30: 1, 31: 1}
OK	928-80-3	CCCCCCCC(=O)CC	{24: 1, 1: 2, 2: 7}
OK	928-89-2	C=CCCCCCl	{17: 1, 2: 4, 5: 1, 6: 1}
OK	928-90-5	C#CCCCCO	{9: 1, 2: 4, 20: 1, 10: 1}
OK	928-91-6	CC=CCCCO	{1: 1, 2: 3, 20: 1, 6: 2}
OK	928-92-7	C/C=C/CCCO	{1: 1, 2: 3, 20: 1, 6: 2}
OK	928-95-0	CCCC=CCO	{1: 1, 2: 3, 20: 1, 6: 2}
OK	928-96-1	CC/C=C\CCO	{1: 1, 2: 3, 20: 1, 6: 2}
OK	928-97-2	CC/C=C/CCO	{1: 1, 2: 3, 20: 1, 6: 2}
OK	928-98-3	C(CCS)CCS	{2: 5, 39: 2}
OK	92857-33-5	CCCCC=CCCCCCCCC(=O)OC	{1: 2, 2: 10, 28: 1, 6: 2}
OK	92860-01-0	CCC(=O)C(=CC=C(C)CCC=C(C)C)C	{24: 1, 1: 5, 2: 3, 6: 3, 7: 3}
OK	92862-23-2	CCCCCCCCCCC(=O)CCCC	{24: 1, 1: 2, 2: 12}
OK	929-05-5	CCC=COCC	{1: 2, 2: 2, 22: 1, 6: 2}
OK	929-06-6	C(COCCO)N	{2: 4, 20: 1, 30: 1, 22: 1}
OK	929-16-8	CCCCCCCCCCCCCCCC(=O)OCCCl	{1: 1, 2: 16, 28: 1, 17: 1}
OK	929-17-9	C(CCCN)CCC(=O)O	{2: 6, 27: 1, 30: 1}
OK	929-37-3	C=COCCOCCO	{2: 4, 22: 2, 20: 1, 5: 1, 6: 1}
OK	929-53-3	CCCCCC#CCC#C	{1: 1, 2: 5, 10: 3, 9: 1}
OK	929-55-5	CCCCCCCC=NO	{1: 1, 2: 6, 20: 1, 34: 1, 6: 1}
OK	929-56-6	CCCCCCCCOC	{1: 2, 2: 7, 22: 1}
OK	929-59-9	C(COCCOCCN)N	{2: 6, 30: 2, 22: 2}
OK	929-62-4	CCCCCCCCOC=C	{1: 1, 2: 7, 22: 1, 5: 1, 6: 1}
OK	929-73-7	CCCCCCCCCCCCN.Cl	{1: 1, 2: 11, 30: 1, 17: 1}
OK	929-75-9	C(COCCOCCOCCN)N	{2: 8, 30: 2, 22: 3}
OK	929-77-1	CCCCCCCCCCCCCCCCCCCCCC(=O)OC	{1: 2, 2: 20, 28: 1}
OK	929-98-6	CCCCCCCCCSCCCCCCCCC	{40: 1, 1: 2, 2: 16}
OK	92973-40-5	CC1(OC[C@H](O1)[C@H](C(=O)OC)O)C	{1: 3, 3: 1, 11: 1, 12: 1, 13: 1, 20: 1, 23: 2, 28: 1}
OK	93-39-0	C[C@]12C[C@@H](C3([C@H]([C@@H]1C[C@H]4[C@]2(OC(O4)(C)C)C(=O)CO)CC=C5[C@@]3(C=CC(=C5)Cl)C)F)O	{1: 4, 2: 1, 11: 3, 12: 4, 13: 5, 14: 4, 15: 2, 16: 1, 17: 1, 20: 2, 23: 2, 24: 1}
OK	93-62-9	C(CO)N(CC(=O)O)CC(=O)O	{33: 1, 2: 4, 27: 2, 20: 1}
OK	93-71-0	C=CCN(CC=C)C(=O)CCl	{33: 1, 2: 3, 5: 2, 6: 2, 17: 1, 24: 1}
OK	93-81-2	CCCCCCCCC=CCCCCCCCC(=O)N(CCN)CCO	{1: 1, 2: 18, 6: 2, 33: 1, 20: 1, 24: 1, 30: 1}
OK	93-83-4	CCCCCCCC/C=C\CCCCCCCC(=O)N(CCO)CCO	{1: 1, 2: 18, 6: 2, 33: 1, 20: 2, 24: 1}
OK	930-02-9	CCCCCCCCCCCCCCCCCCOC=C	{1: 1, 2: 17, 22: 1, 5: 1, 6: 1}
OK	930-08-5	CCCCCCCCCCCCCOCCOCCOCCOCCO	{1: 1, 2: 20, 20: 1, 22: 4}
OK	930-21-2	C1CNC1=O	{32: 1, 25: 1, 11: 2}
OK	930-22-3	C=CC1CO1	{11: 1, 12: 1, 5: 1, 6: 1, 23: 1}
OK	930-25-6	CC12CC1(C2)C	{1: 2, 11: 2, 13: 2}
OK	930-26-7	C=C1CCC=C1	{11: 2, 5: 1, 14: 2, 15: 1}
OK	930-28-9	C1CCC(C1)Cl	{17: 1, 11: 4, 12: 1}
OK	930-29-0	C1CC=C(C1)Cl	{17: 1, 11: 3, 14: 1, 15: 1}
OK	930-30-3	C1CC(=O)C=C1	{25: 1, 11: 2, 14: 2}
OK	930-36-9	CN1C=CC=N1	{1: 1, 35: 1, 14: 3, 33: 1}
OK	930-37-0	COCC1CO1	{1: 1, 2: 1, 11: 1, 12: 1, 22: 1, 23: 1}
OK	930-51-8	C#CC1CCCC1	{9: 1, 10: 1, 11: 4, 12: 1}
OK	930-55-2	C1CCN(C1)N=O	{33: 1, 34: 1, 11: 4, 29: 1}
OK	930-56-3	CC1CC1C(=O)C	{24: 1, 1: 2, 11: 1, 12: 2}
OK	930-57-4	CCCCC1CC1	{1: 1, 2: 3, 11: 2, 12: 1}
OK	930-60-9	C1C(=O)C=CC1=O	{25: 2, 11: 1, 14: 2}
OK	930-61-0	CC1CN=C(N1)C	{32: 1, 1: 2, 35: 1, 11: 1, 12: 1, 15: 1}
OK	930-66-5	C1CCC(=CC1)Cl	{17: 1, 11: 4, 14: 1, 15: 1}
OK	930-68-7	C1CC=CC(=O)C1	{25: 1, 11: 3, 14: 2}
OK	930-73-4	C[N+]1=CC=CC=C1.[I-]	{1: 1, 19: 1, 14: 5, 33: 1}
OK	930-80-3	C1CC2(CCC1C2)I	{19: 1, 11: 5, 12: 1, 13: 1}
OK	930-88-1	CN1C(=O)C=CC1=O	{1: 1, 33: 1, 14: 2, 25: 2}
OK	930-90-5	CC[C@@H]1CCC[C@H]1C	{1: 2, 2: 1, 11: 3, 12: 2}
OK	93001-01-5	CC1=CC=C=CC=C1	{8: 1, 1: 1, 14: 5, 15: 1}
OK	931-10-2	C[C@@H]1CCCC[C@H]1N	{1: 1, 11: 4, 12: 2, 30: 1}
OK	931-17-9	C1CCC(C(C1)O)O	{20: 2, 11: 4, 12: 2}
OK	931-20-4	CN1CCCCC1=O	{1: 1, 11: 4, 33: 1, 25: 1}
OK	931-35-1	CCC1=NCC(N1)C	{32: 1, 1: 2, 2: 1, 35: 1, 11: 1, 12: 1, 15: 1}
OK	931-48-6	C#CC1CCCCC1	{9: 1, 10: 1, 11: 5, 12: 1}
OK	931-49-7	C#CC1=CCCCC1	{9: 1, 10: 1, 11: 4, 14: 1, 15: 1}
OK	931-56-6	COC1CCCCC1	{1: 1, 11: 5, 12: 1, 22: 1}
OK	931-57-7	COC1=CCCCC1	{1: 1, 11: 4, 22: 1, 14: 1, 15: 1}
OK	931-64-6	C1CC2CCC1C=C2	{11: 4, 12: 2, 14: 2}
OK	931-68-0	CC1CCC(CC1)Cl	{1: 1, 11: 4, 12: 2, 17: 1}
OK	931-77-1	CC1(CCCCC1)Br	{1: 1, 18: 1, 11: 5, 13: 1}
OK	931-78-2	CC1(CCCCC1)Cl	{1: 1, 11: 5, 13: 1, 17: 1}
OK	931-88-4	C1CCC/C=C\CC1	{11: 6, 14: 2}
OK	931-89-5	C1CCC/C=C/CC1	{11: 6, 14: 2}
OK	931-91-9	C1(C(C1(F)F)(F)F)(F)F	{16: 6, 13: 3}
OK	931-94-2	COC1(CCCC1)OC	{1: 2, 11: 4, 13: 1, 22: 2}
OK	931-97-5	C1CCC(CC1)(C#N)O	{11: 5, 20: 1, 13: 1, 37: 1}
OK	931-98-6	C1CC2(CCC1CC2)I	{19: 1, 11: 6, 12: 1, 13: 1}
OK	932-01-4	CC1(CCC(CC1)O)C	{1: 2, 11: 4, 12: 1, 13: 1, 20: 1}
OK	932-17-2	CC(=O)N1CCCC1=O	{24: 1, 1: 1, 11: 3, 33: 1, 25: 1}
OK	932-40-1	CC[C@@H]1CCC[C@H]1CC	{1: 2, 2: 2, 11: 3, 12: 2}
OK	932-43-4	CCCC1CCCC1C	{1: 2, 2: 2, 11: 3, 12: 2}
OK	932-51-4	CC1CCC(C(=O)C1)C	{1: 2, 11: 3, 12: 2, 25: 1}
OK	932-56-9	CC1CCCCCC1=O	{1: 1, 11: 5, 12: 1, 25: 1}
OK	932-66-1	CC(=O)C1=CCCCC1	{24: 1, 1: 1, 11: 4, 14: 1, 15: 1}
OK	932-67-2	C1CC(CC=C1)C(=O)Cl	{24: 1, 17: 1, 11: 3, 12: 1, 14: 2}
OK	932-83-2	C1CCCN(CC1)N=O	{33: 1, 34: 1, 11: 6, 29: 1}
OK	93206-60-1	C[C@]1(CC(=O)O1)C(Cl)(Cl)Cl	{1: 1, 4: 1, 11: 1, 13: 1, 17: 3, 28: 1}
OK	93222-97-0	CC(/C=C/C=C/C(C)(C)C)(C)C	{1: 6, 4: 2, 6: 4}
OK	93239-42-0	C[C@@]1(CC(=O)O1)C(Cl)(Cl)Cl	{1: 1, 4: 1, 11: 1, 13: 1, 17: 3, 28: 1}
OK	93248-08-9	CCSCC1CS1	{1: 1, 2: 2, 40: 1, 41: 1, 11: 1, 12: 1}
OK	93251-34-4	CC1=C(C(=C(C1(C(=O)OC)Cl)C(=O)OC)C(=O)OC)C(=O)OC	{1: 5, 17: 1, 13: 1, 28: 4, 15: 4}
OK	93257-19-3	CCC=CCCC1(CCC(=O)O1)C	{1: 2, 2: 3, 6: 2, 11: 2, 13: 1, 28: 1}
OK	933-04-0	C1CCC(C1)CC(=O)N	{24: 1, 2: 1, 11: 4, 12: 1, 30: 1}
OK	933-05-1	CC(=O)OC1CCCC1	{1: 1, 11: 4, 12: 1, 28: 1}
OK	933-11-9	CC1=CCCCCCC1	{1: 1, 11: 6, 14: 1, 15: 1}
OK	933-12-0	CC1CC(CC=C1)(C)C	{1: 3, 11: 2, 12: 1, 13: 1, 14: 2}
OK	933-21-1	C1CCC/C=C\CCC1	{11: 7, 14: 2}
OK	933-40-4	COC1(CCCCC1)OC	{1: 2, 11: 5, 13: 1, 22: 2}
OK	933-52-8	CC1(C(=O)C(C1=O)(C)C)C	{1: 4, 13: 2, 25: 2}
OK	93347-74-1	CCCCCCCCCCCCC(C(=O)O)(Cl)Cl	{1: 1, 2: 11, 27: 1, 4: 1, 17: 2}
OK	93381-28-3	C[C@H](CO)CBr	{1: 1, 2: 2, 3: 1, 20: 1, 18: 1}
OK	934-42-9	CCCCC1CCCC1=O	{1: 1, 2: 3, 11: 3, 12: 1, 25: 1}
OK	93431-23-3	C=CCCCOC1C(NC(=O)N1)OCCCC=C	{32: 2, 2: 6, 5: 2, 6: 2, 12: 2, 22: 2, 25: 1}
OK	935-12-6	C1CC(OC1)CCC(=O)O	{27: 1, 2: 2, 11: 3, 12: 1, 23: 1}
OK	935-30-8	C1CCCC(=O)NCCC1	{32: 1, 25: 1, 11: 7}
OK	935-31-9	C1CCCC/C=C\CCC1	{11: 8, 14: 2}
OK	935-56-8	C1C2CC3CC1CC(C2)(C3)Cl	{17: 1, 11: 6, 12: 3, 13: 1}
OK	935-92-2	CC1=CC(=O)C(=C(C1=O)C)C	{1: 3, 25: 2, 14: 1, 15: 3}
OK	93588-28-4	C1C2CC3CC1CC(C2)(C3)[N+]4=CC=CC=C4	{33: 1, 11: 6, 12: 3, 13: 1, 14: 5}
OK	936-13-0	CCOC(=O)C1CCOC1=O	{1: 1, 2: 1, 11: 2, 12: 1, 28: 2}
OK	936-52-7	C1CC=C(C1)N2CCOCC2	{23: 1, 33: 1, 11: 7, 14: 1, 15: 1}
OK	936-99-2	CC(C)(C)C1CCCC(=O)C1	{1: 3, 11: 4, 4: 1, 12: 1, 25: 1}
OK	93621-94-4	COC[C@@H]1CC[C@H](N1)COC	{32: 1, 1: 2, 2: 2, 11: 2, 12: 2, 22: 2}
OK	93644-76-9	CC=CF	{16: 1, 1: 1, 6: 2}
OK	93681-82-4	CC(=C)CC(CC=C)C(=O)O	{1: 1, 2: 2, 3: 1, 5: 2, 6: 1, 7: 1, 27: 1}
OK	937-51-9	C1CCCN(CC1)CCC#N	{33: 1, 2: 2, 11: 6, 37: 1}
OK	937-94-0	CCCCCCC1(OCCO1)C	{1: 2, 2: 5, 11: 2, 13: 1, 23: 2}
OK	93716-28-0	CCC1CCOC1	{1: 1, 2: 1, 11: 3, 12: 1, 23: 1}
OK	93738-41-1	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCCCCCCCCCCCC)CC(=O)O.Cl	{1: 2, 2: 37, 33: 1, 17: 1, 24: 2, 27: 1, 31: 2}
OK	93762-24-4	CCCCCCCC(CCCC(=O)OCC(CO)O)O	{1: 1, 2: 11, 3: 2, 20: 3, 28: 1}
OK	93882-22-5	CC(C)CCCC=C(C(C)(C)C)O	{1: 5, 2: 3, 3: 1, 4: 1, 6: 1, 7: 1, 20: 1}
OK	93882-38-3	CCCCCCCCC(C)C=CC#N	{1: 2, 2: 7, 3: 1, 37: 1, 6: 2}
OK	93920-27-5	CC(C)CCCCCCCCCCCCCCC(=O)O.CC(CNCC(C)O)O	{1: 4, 2: 16, 3: 3, 20: 2, 27: 1, 31: 1}
OK	93952-58-0	CC(C)OC(=O)CC1=CCCCC1	{1: 2, 2: 1, 3: 1, 11: 4, 14: 1, 15: 1, 28: 1}
OK	93972-93-1	CCC(C(C(C)O)O)O	{1: 2, 2: 1, 3: 3, 20: 3}
OK	93981-12-5	CCCCCCC(C)OC(=O)CC1CCC=C1	{1: 2, 2: 6, 3: 1, 11: 2, 12: 1, 14: 2, 28: 1}
OK	93981-63-6	CC(C)C1CCC(CC1)CC=O	{1: 2, 2: 1, 3: 1, 11: 4, 12: 2, 26: 1}
OK	94-04-2	CCCCC(CC)C(=O)OC=C	{1: 2, 2: 4, 3: 1, 5: 1, 6: 1, 28: 1}
OK	94-05-3	CCO/C=C(\C#N)/C(=O)OCC	{1: 2, 2: 2, 37: 1, 6: 1, 7: 1, 22: 1, 28: 1}
OK	94-28-0	CCCCC(CC)C(=O)OCCOCCOCCOC(=O)C(CC)CCCC	{1: 4, 2: 14, 3: 2, 28: 2, 22: 2}
OK	94-60-0	COC(=O)C1CCC(C(=O)OC)CC1	{1: 2, 11: 4, 12: 2, 28: 2}
OK	94-65-5	CCCC1CCCCC1=O	{1: 1, 2: 2, 11: 4, 12: 1, 25: 1}
OK	94-66-6	C=CCC1CCCCC1=O	{2: 1, 5: 1, 6: 1, 11: 4, 12: 1, 25: 1}
OK	94-67-7	C1=C/C(=C/NO)/C(=O)C=C1	{6: 1, 14: 4, 15: 1, 20: 1, 25: 1, 31: 1}
OK	94-72-4	CC1CN(CCN1CC(C)O)CC(C)O	{1: 3, 2: 2, 3: 2, 33: 2, 11: 3, 12: 1, 20: 2}
OK	94-88-2	CC1CCCCN1CCCO	{1: 1, 2: 3, 33: 1, 11: 4, 12: 1, 20: 1}
OK	94-91-7	CC(CN/C=C\1/C=CC=CC1=O)N/C=C\2/C=CC=CC2=O	{1: 1, 2: 1, 3: 1, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
OK	94-93-9	C1=CC(=CNCCN/C=C\2/C=CC=CC2=O)C(=O)C=C1	{2: 2, 6: 2, 14: 8, 15: 2, 25: 2, 31: 2}
OK	94-96-2	CCCC(C(CC)CO)O	{1: 2, 2: 4, 3: 2, 20: 2}
OK	940-69-2	C1CSSC1CCCCC(=O)N	{2: 4, 41: 2, 11: 2, 12: 1, 24: 1, 30: 1}
OK	94023-15-1	CC(CO)OC(C)(C)C	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1, 22: 1}
OK	94031-37-5	CC(CCO)O.C1CCC(=O)OCC1.C1CC(CCC1CC2CCC(CC2)N=C=O)N=C=O	{1: 1, 2: 3, 3: 1, 8: 2, 11: 13, 12: 4, 34: 2, 20: 2, 28: 1, 29: 2}
OK	94042-67-8	CCCCCCCCCCCCCCCCCCN.CCCCCCCCC=CCCCCCCCC(=O)O	{1: 2, 2: 31, 27: 1, 30: 1, 6: 2}
OK	94087-83-9	CC(C)(CCOC)S	{1: 3, 2: 2, 4: 1, 22: 1, 39: 1}
OK	94089-47-1	C[C@@]1(CCCCC1=O)CCC(=O)OC	{1: 2, 2: 2, 11: 4, 13: 1, 25: 1, 28: 1}
OK	941-43-5	CCOC(=O)CCC1(OCCO1)C	{1: 2, 2: 3, 11: 2, 13: 1, 23: 2, 28: 1}
OK	94115-41-0	CC(=O)ON=C(C1CC1)C2CC2	{1: 1, 34: 1, 7: 1, 11: 4, 12: 2, 28: 1}
OK	94133-41-2	C[C@H]1CC[C@@H]([C@H](C1)OCC(=O)O)C(C)C	{1: 3, 2: 1, 3: 1, 11: 3, 12: 3, 22: 1, 27: 1}
OK	94137-73-2	CC(C)(C)C=C=CI	{8: 1, 1: 3, 19: 1, 4: 1, 6: 2}
OK	94201-19-1	CC1CCC2(CC1)CCC(=O)O2	{1: 1, 11: 6, 12: 1, 13: 1, 28: 1}
OK	94236-90-5	CCCCCCCC(=O)CC(=O)OCC(COC(=O)CC(=O)CCCCCCC)OC(=O)CC(=O)CCCCCCC	{24: 3, 1: 3, 2: 23, 3: 1, 28: 3}
OK	94248-78-9	CC(C)CCCOC(=O)C=CC(=O)OCCCC(C)C	{1: 4, 2: 6, 3: 2, 28: 2, 6: 2}
OK	94278-09-8	CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCC(=O)OCCCCCCCCCCCCCCCCCCCCCC	{1: 2, 2: 45, 28: 2}
OK	943-29-3	CC(C)(C)C1CCC(CC1)C(=O)O	{27: 1, 1: 3, 11: 4, 4: 1, 12: 2}
OK	943-93-1	C1CC=CCCC2C(O2)CCC=C1	{11: 6, 12: 2, 14: 4, 23: 1}
OK	94324-23-9	CC1(OC2C(OC(=O)C2O1)CBr)C	{1: 2, 2: 1, 12: 3, 13: 1, 18: 1, 23: 2, 28: 1}
OK	94333-50-3	CCC1=C(C(CCC1C)(C)C)C(=O)OCC	{1: 5, 2: 2, 11: 2, 12: 1, 13: 1, 15: 2, 28: 1}
OK	94333-51-4	CCOC(=O)C1C(=CC)C(CCC1(C)C)C	{1: 5, 2: 1, 6: 1, 11: 2, 12: 2, 13: 1, 15: 1, 28: 1}
OK	94333-52-5	CCCCCCCCCCCCCCCCCC(=O)NCCN(CCNCCC#N)C(=O)CCCCCCCCCCCCCCCCC	{1: 2, 2: 38, 37: 1, 33: 1, 24: 2, 31: 2}
OK	94346-09-5	C[C@@H]1[C@@H](CC[C@]1(C)OC(=O)C)C(=C)C	{1: 4, 5: 1, 7: 1, 11: 2, 12: 2, 13: 1, 28: 1}
OK	94400-98-3	C[C@H]1CC(C2=C(C1(C)C)C[C@@]3([C@H](C2)O3)C)(C)C	{1: 6, 11: 3, 12: 2, 13: 3, 15: 2, 23: 1}
OK	94406-15-2	CC1(CC(C2=CCCCC21)(C)C=O)C	{1: 3, 11: 4, 12: 1, 13: 2, 14: 1, 15: 1, 26: 1}
OK	94408-08-9	CCCCNNCCCC.C(=O)(C(=O)O)O	{1: 2, 2: 6, 27: 2, 31: 2}
OK	94421-68-8	CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCO	{1: 1, 2: 12, 6: 8, 20: 1, 24: 1, 31: 1}
OK	94425-50-0	CCCCCCC(CC=CCCCCCCCC(=O)NCCNCCO)O	{1: 1, 2: 17, 3: 1, 6: 2, 20: 2, 24: 1, 31: 2}
OK	94499-50-0	C1CC2=C1C(=O)C3CC3C2=O	{25: 2, 11: 3, 12: 2, 15: 2}
OK	946-89-4	C1CCCCCC(=NO)CCCCC1	{34: 1, 11: 11, 20: 1, 15: 1}
OK	947-04-6	C1CCCCCC(=O)NCCCCC1	{32: 1, 25: 1, 11: 11}
OK	947-05-7	C1CCCCCC(=O)OCCCCC1	{11: 11, 28: 1}
OK	947-57-9	COC(=O)C1=C(C2CC1C=C2)C(=O)OC	{1: 2, 11: 1, 12: 2, 14: 2, 15: 2, 28: 2}
OK	947-92-2	C1CCC(CC1)N(C2CCCCC2)N=O	{33: 1, 34: 1, 11: 10, 12: 2, 29: 1}
OK	94736-77-3	CC(C=CC=C)O	{1: 1, 3: 1, 20: 1, 5: 1, 6: 3}
OK	94772-44-8	C1C=CC=CC1(CC2(CC=CC=C2)N=C=O)N=C=O.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 9, 34: 2, 8: 2, 11: 2, 13: 2, 14: 8, 20: 2, 27: 2, 29: 2}
OK	94793-23-4	CCCCCN=CN(C)C	{1: 3, 2: 4, 34: 1, 6: 1, 33: 1}
OK	94793-24-5	CCCCCN=C(C)N(C)C	{1: 4, 2: 4, 34: 1, 33: 1, 7: 1}
OK	94905-01-8	CC(C)(C)C1=CC(=O)C(=CC1=O)Cl	{1: 3, 4: 1, 14: 2, 15: 2, 17: 1, 25: 2}
OK	95-08-9	CCC(CC)C(=O)OCCOCCOCCOC(=O)C(CC)CC	{1: 4, 2: 10, 3: 2, 28: 2, 22: 2}
OK	95-11-4	C1C2CC(C1C=C2)C#N	{11: 2, 12: 3, 37: 1, 14: 2}
OK	95-12-5	C1C2CC(C1C=C2)CO	{20: 1, 2: 1, 11: 2, 12: 3, 14: 2}
OK	95-17-0	C1C2CC(C1C=C2)C(=O)N	{24: 1, 11: 2, 12: 3, 30: 1, 14: 2}
OK	95-19-2	CCCCCCCCCCCCCCCCCC1=NCCN1CCO	{1: 1, 2: 18, 35: 1, 33: 1, 11: 2, 15: 1, 20: 1}
OK	95-37-4	CCCCCCCCCCCC1=NCCN1CCN	{1: 1, 2: 12, 35: 1, 33: 1, 11: 2, 15: 1, 30: 1}
OK	95-38-5	CCCCCCCCC=CCCCCCCCC1=NCCN1CCO	{1: 1, 2: 16, 35: 1, 6: 2, 33: 1, 11: 2, 15: 1, 20: 1}
OK	95-39-6	C=CC(=O)OCC1CC2CC1C=C2	{2: 1, 5: 1, 6: 1, 11: 2, 12: 3, 14: 2, 28: 1}
OK	95-41-0	CCCCCCC1=CCCC1=O	{1: 1, 2: 5, 11: 2, 14: 1, 15: 1, 25: 1}
OK	95-43-2	C([C@H]([C@@H](C=O)O)O)O	{2: 1, 3: 2, 20: 3, 26: 1}
OK	95-45-4	CC(=C(C)N=O)NO	{1: 2, 34: 1, 7: 2, 20: 1, 29: 1, 31: 1}
OK	95-59-0	C1COC(C(O1)Cl)Cl	{17: 2, 11: 2, 12: 2, 23: 2}
OK	95-92-1	CCOC(=O)C(=O)OCC	{1: 2, 2: 2, 28: 2}
OK	95-96-5	CC1C(=O)OC(C(=O)O1)C	{1: 2, 12: 2, 28: 2}
OK	950-21-0	C1CCC2(CC1)C(=O)C3(C2=O)CCCCC3	{25: 2, 11: 10, 13: 2}
OK	951-78-0	C1[C@@H]([C@H](O[C@H]1N2C=CC(=O)NC2=O)CO)O	{32: 1, 33: 1, 2: 1, 11: 1, 12: 3, 14: 2, 20: 2, 23: 1, 25: 2}
OK	95111-49-2	CC1(C(=C(C(=O)C(=C1Br)Br)Br)Br)[N+](=O)[O-]	{1: 1, 38: 1, 13: 1, 15: 4, 18: 4, 25: 1}
OK	95135-87-8	CCCCCCCCCC1CCCC(C1)C2CCCCC2	{1: 1, 2: 8, 11: 9, 12: 3}
OK	95144-26-6	C(CO)N(CCO)CCO.C(C(COCC(COCC(COCC(COCC(COCC(CO)O)O)O)O)O)O)O	{33: 1, 2: 18, 3: 6, 20: 11, 22: 5}
OK	95177-47-2	CC1CCCC(C1=C)C	{1: 2, 11: 3, 12: 2, 5: 1, 15: 1}
OK	95237-86-8	C[C@H]([C@@H](C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N)N)O	{1: 13, 2: 18, 3: 22, 36: 1, 33: 1, 7: 1, 11: 3, 12: 1, 20: 2, 24: 19, 27: 4, 30: 5, 31: 17}
OK	95266-40-3	CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1	{1: 1, 2: 1, 7: 1, 11: 4, 12: 2, 15: 1, 20: 1, 25: 2, 28: 1}
OK	95282-98-7	CC(=O)OC[C@]12C=CC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C	{1: 2, 2: 1, 11: 6, 12: 3, 13: 2, 14: 3, 15: 1, 25: 2, 28: 1}
OK	95335-91-4	C1CCC2(CC1)OC[C@@H](O2)CO	{2: 1, 11: 6, 12: 1, 13: 1, 20: 1, 23: 2}
OK	95388-86-6	CC1(CC(N2N1N2C(F)(F)F)(C(F)(F)F)C(F)(F)F)C	{1: 2, 4: 3, 33: 3, 11: 1, 13: 2, 16: 9}
OK	95422-24-5	CC1(OCC(O1)CC(=O)OC)C	{1: 3, 2: 1, 11: 1, 12: 1, 13: 1, 23: 2, 28: 1}
OK	95481-62-2	COC(=O)CCCCC(=O)OC.COC(=O)CCCC(=O)OC.COC(=O)CCC(=O)OC	{1: 6, 2: 9, 28: 6}
OK	95491-05-7	CCCCCCCCCCCCCCCCCCCCCCC#N	{1: 1, 2: 21, 37: 1}
OK	95510-44-4	CCN1CCCN2C1=NCCC2	{1: 1, 2: 1, 35: 1, 33: 2, 11: 6, 15: 1}
OK	95524-59-7	CCC1CCCCN1C(=O)C=C(C)C	{1: 3, 2: 1, 33: 1, 6: 1, 7: 1, 11: 4, 12: 1, 24: 1}
OK	95530-58-8	CC(C)[C@@H]1COC(=O)N1	{32: 1, 1: 2, 3: 1, 11: 1, 12: 1, 28: 1}
OK	95540-87-7	CC=C(C=C)C=C	{1: 1, 5: 2, 6: 3, 7: 1}
OK	95548-49-5	CCCCCCCCCCCCCCCCCC(=O)NCCCCCCCCCCCCC=CCCCCCCCC	{24: 1, 1: 2, 2: 35, 6: 2, 31: 1}
OK	956-84-3	CC12C3=CC=C4C1(C(=CC=C4)C=CC2=CC=C3)C	{1: 2, 13: 2, 14: 10, 15: 4}
OK	957-18-6	CC1C(OC2(O1)CCCCCCCCCCC2)C	{1: 2, 11: 11, 12: 2, 13: 1, 23: 2}
OK	957-68-6	CC(=O)OCC1=C(N2C(C(C2=O)N)SC1)C(=O)O	{1: 1, 2: 1, 33: 1, 41: 1, 11: 1, 12: 2, 15: 2, 25: 1, 27: 1, 28: 1, 30: 1}
OK	95715-85-8	CC(C)(C)OC(=O)N[C@H](CO)C(=O)OC	{1: 4, 2: 1, 3: 1, 4: 1, 20: 1, 28: 2, 31: 1}
OK	95715-86-9	CC1(N([C@H](CO1)C(=O)OC)C(=O)OC(C)(C)C)C	{1: 6, 4: 1, 33: 1, 11: 1, 12: 1, 13: 1, 23: 1, 28: 2}
OK	95715-87-0	CC1(N([C@H](CO1)C=O)C(=O)OC(C)(C)C)C	{1: 5, 4: 1, 33: 1, 11: 1, 12: 1, 13: 1, 23: 1, 26: 1, 28: 1}
OK	95718-78-8	CC(CC(C)(C)OOC(=O)CCCCCC(C)(C)C)O	{1: 6, 2: 6, 3: 1, 4: 2, 20: 1, 22: 1, 28: 1}
OK	95746-44-4	CC(CCCCCCCCC(C)C1CCCCC1)C2CCCCC2	{11: 10, 1: 2, 2: 8, 3: 2, 12: 2}
OK	95764-76-4	CCC(C#CC(=C)C)O	{1: 2, 2: 1, 3: 1, 5: 1, 7: 1, 10: 2, 20: 1}
OK	95804-62-9	CCCCCCCCCCCCCCCCCCCCCCCC#N	{1: 1, 2: 22, 37: 1}
OK	95823-35-1	CCCCCCC=C.C(CS)C(=O)OCC(CO)(COC(=O)CCS)COC(=O)CCS.C(CS)C(=O)OCC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS	{1: 1, 2: 27, 4: 2, 5: 1, 6: 1, 39: 7, 20: 1, 28: 7}
OK	959-36-4	C1=C/C(=C\NN/C=C\2/C(=O)C=CC=C2)/C(=O)C=C1	{25: 2, 31: 2, 14: 8, 6: 2, 15: 2}
OK	959-52-4	C=CC(=O)N1CN(CN(C1)C(=O)C=C)C(=O)C=C	{24: 3, 33: 3, 11: 3, 5: 3, 6: 3}
OK	95910-36-4	C[C@@H]1CC[C@@H]2[C@@H](C2(C)C)C3=C1CC[C@H]3C	{1: 4, 11: 4, 12: 4, 13: 1, 15: 2}
OK	95935-43-6	CCCCCCCCCCC(=O)OC(C)(C)C	{1: 4, 2: 9, 4: 1, 28: 1}
OK	95960-95-5	CCCCCCCCCCCCCCCCCCCCCCCCC#N	{1: 1, 2: 23, 37: 1}
OK	96-00-4	C1CCCCC(=O)C(CCC1)O	{20: 1, 11: 8, 12: 1, 25: 1}
OK	96-01-5	C1CCCCC(=O)C(=O)CCC1	{25: 2, 11: 8}
OK	96-04-8	CCCCC(=O)C(=O)C	{24: 2, 1: 2, 2: 3}
OK	96-05-9	CC(=C)C(=O)OCC=C	{1: 1, 2: 1, 5: 2, 6: 1, 7: 1, 28: 1}
OK	96-06-0	CC1(C(O1)C(C)(C)C)C	{1: 5, 4: 1, 13: 1, 12: 1, 23: 1}
OK	96-07-1	CC(C)C1CCCCC1O	{11: 4, 1: 2, 3: 1, 12: 2, 20: 1}
OK	96-08-2	CC12CCC(CC1O2)C3(CO3)C	{1: 2, 11: 4, 12: 2, 13: 2, 23: 2}
OK	96-11-7	C(C(CBr)Br)Br	{2: 2, 3: 1, 18: 3}
OK	96-12-8	C(C(CBr)Br)Cl	{17: 1, 2: 2, 3: 1, 18: 2}
OK	96-13-9	C(C(CBr)Br)O	{2: 2, 3: 1, 20: 1, 18: 2}
OK	96-14-0	CCC(C)CC	{1: 3, 2: 2, 3: 1}
OK	96-15-1	CCC(C)CN	{1: 2, 2: 2, 3: 1, 30: 1}
OK	96-16-2	CC(CN)C#N	{1: 1, 2: 1, 3: 1, 37: 1, 30: 1}
OK	96-17-3	CCC(C)C=O	{1: 2, 2: 1, 3: 1, 26: 1}
OK	96-18-4	C(C(CCl)Cl)Cl	{17: 3, 2: 2, 3: 1}
OK	96-20-8	CCC(CO)N	{1: 1, 2: 2, 3: 1, 20: 1, 30: 1}
OK	96-21-9	C(C(CBr)O)Br	{2: 2, 3: 1, 20: 1, 18: 2}
OK	96-22-0	CCC(=O)CC	{24: 1, 1: 2, 2: 2}
OK	96-23-1	C(C(CCl)O)Cl	{17: 2, 2: 2, 3: 1, 20: 1}
OK	96-24-2	C(C(CCl)O)O	{17: 1, 2: 2, 3: 1, 20: 2}
OK	96-26-4	C(C(=O)CO)O	{24: 1, 2: 2, 20: 2}
OK	96-27-5	C(C(CS)O)O	{2: 2, 3: 1, 20: 2, 39: 1}
OK	96-29-7	CCC(=NO)C	{1: 2, 2: 1, 20: 1, 34: 1, 7: 1}
OK	96-30-0	CNC(=O)CCl	{24: 1, 1: 1, 2: 1, 31: 1, 17: 1}
OK	96-31-1	CNC(=O)NC	{24: 1, 1: 2, 31: 2}
OK	96-32-2	COC(=O)CBr	{1: 1, 2: 1, 28: 1, 18: 1}
OK	96-33-3	COC(=O)C=C	{1: 1, 28: 1, 5: 1, 6: 1}
OK	96-34-4	COC(=O)CCl	{1: 1, 2: 1, 28: 1, 17: 1}
OK	96-35-5	COC(=O)CO	{1: 1, 2: 1, 20: 1, 28: 1}
OK	96-37-7	CC1CCCC1	{1: 1, 11: 4, 12: 1}
OK	96-38-8	CC1C=CC=C1	{1: 1, 12: 1, 14: 4}
OK	96-40-2	C1CC(C=C1)Cl	{17: 1, 11: 2, 12: 1, 14: 2}
OK	96-41-3	C1CCC(C1)O	{20: 1, 11: 4, 12: 1}
OK	96-47-9	CC1CCCO1	{1: 1, 11: 3, 12: 1, 23: 1}
OK	96-48-0	C1CC(=O)OC1	{11: 3, 28: 1}
OK	96-54-8	CN1C=CC=C1	{1: 1, 14: 4, 33: 1}
OK	96-80-0	CC(C)N(CCO)C(C)C	{1: 4, 2: 2, 3: 2, 20: 1, 33: 1}
OK	96-81-1	CC(C)[C@@H](C(=O)O)NC(=O)C	{24: 1, 1: 3, 3: 2, 27: 1, 31: 1}
OK	96-82-2	C(C1C(C(C(C(O1)OC(C(CO)O)C(C(C(=O)O)O)O)O)O)O)O	{2: 2, 3: 4, 12: 5, 20: 8, 22: 1, 23: 1, 27: 1}
OK	96218-78-9	CC1(CN(C(=O)C(N1)(C)C)CCNC2CCCCC2)C	{32: 1, 1: 4, 2: 2, 33: 1, 11: 6, 12: 1, 13: 2, 25: 1, 31: 1}
OK	96244-68-7	CCOC(=O)C1C(O1)C(=O)NC(CC(C)C)C(=O)NCCC(C)C	{1: 5, 2: 4, 3: 3, 12: 2, 23: 1, 24: 2, 28: 1, 31: 2}
OK	96247-27-7	CCCCC(CC)COC(=O)C=C.CC(=O)OC=C.CC(C)(C)CCCCCC(=O)OC=C	{1: 6, 2: 10, 3: 1, 4: 1, 5: 3, 6: 3, 28: 3}
OK	96247-28-8	CC(=C)C(=O)OC.CC(=O)OC=C.CC(C)(C)CCCCCC(=O)OC=C	{1: 6, 2: 5, 4: 1, 5: 3, 6: 2, 7: 1, 28: 3}
OK	96294-08-5	CC(C)CCCCCCCC(C(C)(C)CO)O.C(CCC(=O)O)CC(=O)O	{1: 4, 2: 12, 3: 2, 4: 1, 20: 2, 27: 2}
OK	96294-11-0	CCCCCCCC/C=C/CCCCCCCC1=NC(CO1)(C)CO.CCCCCCCC/C=C\CCCCCCCC(=O)O	{1: 3, 2: 29, 35: 1, 6: 4, 11: 1, 13: 1, 15: 1, 20: 1, 23: 1, 27: 1}
OK	963-74-6	C[C@]12CCCC[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C	{1: 2, 11: 10, 12: 4, 13: 2, 25: 1}
OK	963-75-7	C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC[C@@H]4[C@@]3(CC=CC4)C	{1: 2, 11: 8, 12: 4, 13: 2, 14: 2, 25: 1}
OK	96311-27-2	CCCCC(CC)COC(=O)C=C.CCCCOCCOC(=O)C(=C)CCO.C=CC(=O)O	{1: 3, 2: 12, 3: 1, 5: 3, 6: 2, 7: 1, 20: 1, 22: 1, 27: 1, 28: 2}
OK	96317-90-7	C(CCC(=O)O)CC(=O)O.C(CNCCN)N.C(CNCCNCCNCCN)N	{2: 16, 27: 2, 30: 4, 31: 4}
OK	96328-89-1	CCCCCCCCC=C.C(CS)C(=O)OCC(CO)(COC(=O)CCS)COC(=O)CCS.C(CS)C(=O)OCC(COC(=O)CCS)(COC(=O)CCS)COC(=O)CCS	{1: 1, 2: 29, 4: 2, 5: 1, 6: 1, 39: 7, 20: 1, 28: 7}
OK	96346-76-8	CC=CC(C(C)C)O	{1: 3, 3: 2, 20: 1, 6: 2}
OK	96446-43-4	CCCC[C@@H](CC)/C=C/C(=O)CC(C)C	{24: 1, 1: 4, 2: 5, 3: 2, 6: 2}
OK	965-90-2	CCC1(CCC2C1(CCC3C2CCC4=CCCCC34)C)O	{1: 2, 2: 1, 11: 9, 12: 4, 13: 2, 14: 1, 15: 1, 20: 1}
OK	96508-09-7	CCC(=O)/C=C/C=C(\C)/CCC=C(C)C.CC1=CCCC(C1/C=C/C(=O)C)(C)C.CC(=O)C	{1: 10, 2: 3, 6: 6, 7: 2, 11: 2, 12: 1, 13: 1, 14: 1, 15: 1, 24: 3}
OK	96607-23-7	N(=O)OF	{16: 1, 34: 1, 29: 1, 22: 1}
OK	96611-22-2	C(CCCCCC(=O)O)CCCCC(=O)O.C(CCC(=O)O)CC(=O)O.C(CCO)CO	{2: 18, 27: 4, 20: 2}
OK	96721-08-3	CCCC=C(C)C(=O)C	{24: 1, 1: 3, 2: 2, 6: 1, 7: 1}
OK	96740-99-7	C1(OO1)(F)F	{16: 2, 13: 1, 23: 2}
OK	96801-44-4	CCCCCCCCOCC(CO)O	{1: 1, 2: 9, 3: 1, 20: 2, 22: 1}
OK	96806-34-7	C(CCl)NC(=O)N(CCO)N=O	{33: 1, 2: 4, 34: 1, 17: 1, 20: 1, 24: 1, 29: 1, 31: 1}
OK	96806-35-8	CC(CN(C(=O)NCCCl)N=O)O	{1: 1, 2: 3, 3: 1, 33: 1, 34: 1, 17: 1, 20: 1, 24: 1, 29: 1, 31: 1}
OK	96938-06-6	CCCCCCCCCCCCC[C@@H]1CO1	{1: 1, 2: 12, 11: 1, 12: 1, 23: 1}
OK	96943-88-3	C1CN2CCC1CC2Cl	{17: 1, 11: 5, 12: 2, 33: 1}
OK	96992-71-1	C(C=CCl)ON.Cl	{17: 2, 2: 1, 30: 1, 22: 1, 6: 2}
OK	97-11-0	CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)C3CCC=C3	{1: 5, 6: 1, 7: 1, 11: 3, 12: 4, 13: 1, 14: 2, 15: 2, 25: 1, 28: 1}
OK	97-13-2	CC(C)NCCN(C(C)C)C(C)C	{1: 6, 2: 2, 3: 3, 33: 1, 31: 1}
OK	97-25-6	C(C(Cl)(Cl)Cl)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O	{2: 1, 4: 1, 12: 5, 17: 3, 20: 3, 22: 1, 23: 1, 27: 1}
OK	97-41-6	CCOC(=O)C1C(C1(C)C)C=C(C)C	{1: 5, 2: 1, 6: 1, 7: 1, 12: 2, 13: 1, 28: 1}
OK	97-42-7	CC1=CCC(CC1OC(=O)C)C(=C)C	{1: 3, 5: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 28: 1}
OK	97-45-0	CCC(=O)OC1CC(CC=C1C)C(=C)C	{1: 3, 2: 1, 5: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 28: 1}
OK	97-59-6	C1(C(=O)NC(=O)N1)NC(=O)N	{32: 2, 12: 1, 24: 1, 25: 2, 30: 1, 31: 1}
OK	97-61-0	CCCC(C)C(=O)O	{27: 1, 1: 2, 2: 2, 3: 1}
OK	97-62-1	CCOC(=O)C(C)C	{1: 3, 2: 1, 3: 1, 28: 1}
OK	97-63-2	CCOC(=O)C(=C)C	{1: 2, 2: 1, 28: 1, 5: 1, 7: 1}
OK	97-64-3	CCOC(=O)C(C)O	{1: 2, 2: 1, 3: 1, 20: 1, 28: 1}
OK	97-65-4	C=C(CC(=O)O)C(=O)O	{2: 1, 27: 2, 5: 1, 7: 1}
OK	97-67-6	C([C@@H](C(=O)O)O)C(=O)O	{27: 2, 2: 1, 3: 1, 20: 1}
OK	97-81-4	CCOC(=O)C1CC2CC1C3C2O3	{1: 1, 2: 1, 11: 2, 12: 5, 23: 1, 28: 1}
OK	97-84-7	CC(CCN(C)C)N(C)C	{1: 5, 2: 2, 3: 1, 33: 2}
OK	97-85-8	CC(C)COC(=O)C(C)C	{1: 4, 2: 1, 3: 2, 28: 1}
OK	97-86-9	CC(C)COC(=O)C(=C)C	{1: 3, 2: 1, 3: 1, 5: 1, 7: 1, 28: 1}
OK	97-87-0	CCCCOC(=O)C(C)C	{1: 3, 2: 3, 3: 1, 28: 1}
OK	97-88-1	CCCCOC(=O)C(=C)C	{1: 2, 2: 3, 28: 1, 5: 1, 7: 1}
OK	97-89-2	CC(C)C(=O)OCCC(C)CCC=C(C)C	{1: 5, 2: 4, 3: 2, 6: 1, 7: 1, 28: 1}
OK	97-90-5	CC(=C)C(=O)OCCOC(=O)C(=C)C	{1: 2, 2: 2, 28: 2, 5: 2, 7: 2}
OK	97-95-0	CCC(CC)CO	{1: 2, 2: 3, 3: 1, 20: 1}
OK	97-96-1	CCC(CC)C=O	{1: 2, 2: 2, 3: 1, 26: 1}
OK	97-97-2	COC(CCl)OC	{1: 2, 2: 1, 3: 1, 22: 2, 17: 1}
OK	97-99-4	C1CC(OC1)CO	{20: 1, 2: 1, 11: 3, 12: 1, 23: 1}
OK	97073-23-9	CCC(=O)C1CCCCN1	{32: 1, 1: 1, 2: 1, 11: 4, 12: 1, 24: 1}
OK	972-46-3	CCOC1=CC2=CC[C@H]3[C@@H]4CCC(=O)[C@]4(CC[C@@H]3[C@]2(CC1)C)C	{1: 3, 2: 1, 11: 7, 12: 3, 13: 2, 14: 2, 15: 2, 22: 1, 25: 1}
OK	97229-07-7	C12C3C4C1(C5C2C3(C45)Cl)Cl	{17: 2, 12: 6, 13: 2}
OK	97229-08-8	C12C3C4C1(C5C2C3(C45)I)I	{19: 2, 12: 6, 13: 2}
OK	97253-51-5	C1C2C=CC1C3=C2C4CC3C=C4	{11: 2, 12: 4, 14: 4, 15: 2}
OK	97384-47-9	CC(=CCC(C)(C=C)C#N)C	{1: 3, 2: 1, 4: 1, 5: 1, 6: 2, 7: 1, 37: 1}
OK	97404-08-5	CC(C)CCCCCCCOCCOCCOCCOCCOCCO	{1: 2, 2: 17, 3: 1, 20: 1, 22: 5}
OK	97551-34-3	CI=O	{1: 1, 19: 1, 29: 1}
OK	97551-98-9	COC1CCCC(=C)C1	{1: 1, 5: 1, 11: 4, 12: 1, 15: 1, 22: 1}
OK	976-71-6	C[C@]12CCC(=O)C=C1C=C[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]45CCC(=O)O5)C	{1: 2, 11: 8, 12: 3, 13: 3, 14: 3, 15: 1, 25: 1, 28: 1}
OK	97628-11-0	C1CC2CCC1C3C2C(=O)C3=O	{25: 2, 11: 4, 12: 4}
OK	977-79-7	CC1=CC2C3CC[C@](C3(CCC2C4(C1=CC(=O)CC4)C)C)(C)C(=O)C	{1: 5, 11: 6, 12: 3, 13: 3, 14: 2, 15: 2, 24: 1, 25: 1}
OK	97812-31-2	CN(C)N(C)CCC#N	{1: 3, 2: 2, 37: 1, 33: 2}
OK	97953-23-6	CCC1CC(=C(O1)C)C(=O)OCC	{1: 3, 2: 2, 11: 1, 12: 1, 15: 2, 23: 1, 28: 1}
OK	98-52-2	CC(C)(C)C1CCC(CC1)O	{1: 3, 11: 4, 4: 1, 12: 2, 20: 1}
OK	98-53-3	CC(C)(C)C1CCC(=O)CC1	{1: 3, 11: 4, 4: 1, 12: 1, 25: 1}
OK	98-55-5	CC1=CCC(CC1)C(C)(C)O	{1: 3, 4: 1, 11: 3, 12: 1, 14: 1, 15: 1, 20: 1}
OK	98-78-2	C1CC(=O)CC1C(=O)O	{27: 1, 25: 1, 11: 3, 12: 1}
OK	98-79-3	C1CC(=O)N[C@@H]1C(=O)O	{27: 1, 25: 1, 11: 2, 12: 1, 32: 1}
OK	98-89-5	C1CCC(CC1)C(=O)O	{27: 1, 11: 5, 12: 1}
OK	98-94-2	CN(C)C1CCCCC1	{1: 2, 11: 5, 12: 1, 33: 1}
OK	98015-53-3	C(C(Cl)(Cl)Cl)(OC(=O)Cl)Cl	{17: 5, 3: 1, 4: 1, 28: 1}
OK	98028-64-9	CCC1(CCCCC1)CC2(CCCCC2)CC	{1: 2, 2: 3, 11: 10, 13: 2}
OK	98072-20-9	C[C@@H]1CC=CCC1C(=O)O	{27: 1, 1: 1, 11: 2, 12: 2, 14: 2}
OK	98127-90-3	CC1(C#CC(C#CC(C#CC(C#CC(C#CC(C#C1)(C)C)(C)C)(C)C)(C)C)(C)C)C	{1: 12, 10: 12, 13: 6}
OK	98190-85-3	C[C@H](CBr)C(=O)OC	{1: 2, 2: 1, 3: 1, 28: 1, 18: 1}
OK	98203-44-2	CC(C)[C@H]1CO[C@]2(N1C(=O)CC2)C	{1: 3, 3: 1, 33: 1, 11: 3, 12: 1, 13: 1, 23: 1, 25: 1}
OK	98225-48-0	C[C@@H]1C[C@H]2[C@@H](CC(=O)O2)O[C@H]3C[C@@H]4[C@H](C[C@@H]([C@@H]5[C@@H](O4)C/C=C\C[C@@H]6[C@@H](O5)C/C=C\[C@@H]7[C@@H](O6)CCC[C@@H]8[C@@H](O7)C[C@@H]9[C@@H](O8)C[C@@H]2[C@@H](O9)[C@H](C[C@H](O2)CC(=C)C=O)O)C)O[C@@]3(C1)C	{1: 3, 2: 1, 5: 1, 7: 1, 11: 14, 12: 21, 13: 1, 14: 4, 20: 1, 23: 9, 26: 1, 28: 1}
OK	98230-14-9	C12C3C4C1C5C6C4C(=O)C3C6C2C5=O	{25: 2, 12: 10}
OK	98573-25-2	C=CC(=O)OCC(CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)O	{2: 2, 3: 1, 4: 4, 5: 1, 6: 1, 16: 9, 20: 1, 28: 1}
OK	98593-79-4	CC1=C(C(=O)NC1(C)O)C(=O)C	{32: 1, 1: 3, 13: 1, 15: 2, 20: 1, 24: 1, 25: 1}
OK	98677-91-9	CC(C)OC1=CCCC=C1	{1: 2, 3: 1, 11: 2, 14: 3, 15: 1, 22: 1}
OK	98677-92-0	CCC(CC)OC1=CCCC=C1	{1: 2, 2: 2, 3: 1, 11: 2, 14: 3, 15: 1, 22: 1}
OK	98677-93-1	CCC(CC)OC1=CCC=CC1	{1: 2, 2: 2, 3: 1, 11: 2, 14: 3, 15: 1, 22: 1}
OK	98677-95-3	COC1=CCCCC=C1	{1: 1, 11: 3, 22: 1, 14: 3, 15: 1}
OK	98677-97-5	CC1=CC(=CCC1)OC	{1: 2, 11: 2, 22: 1, 14: 2, 15: 2}
OK	98677-98-6	CC1CC(=CC(=C1)OC)C	{1: 3, 11: 1, 12: 1, 14: 2, 15: 2, 22: 1}
OK	98705-35-2	CC1=CC=C(SC(C1)C(C)(C)C)C(C)(C)C	{1: 7, 4: 2, 41: 1, 11: 1, 12: 1, 14: 2, 15: 2}
OK	98800-90-9	CCC(=O)OC1(CCC(C1C)C(=C)C)C	{1: 4, 2: 1, 5: 1, 7: 1, 11: 2, 12: 2, 13: 1, 28: 1}
OK	98803-07-7	CCC1(CCCCC1)C(C)C2(CCCCC2)CC	{11: 10, 1: 3, 2: 2, 3: 1, 13: 2}
OK	98803-61-3	CCC1(CCCC(C1(CC)CC)(CC)CC)CC	{1: 6, 2: 6, 11: 3, 13: 3}
OK	98841-69-1	CCCCCCCCCOC(=O)CCCCCC	{1: 2, 2: 13, 28: 1}
OK	98930-89-3	CCCCCCCCCCC(C(C)C)O	{1: 3, 2: 9, 3: 2, 20: 1}
OK	98944-42-4	CCC(C)C(OC)(OC)OC	{1: 5, 2: 1, 3: 1, 4: 1, 22: 3}
OK	98952-13-7	CCN1CCN(C(C1)C)CC	{1: 3, 2: 2, 11: 3, 12: 1, 33: 2}
OK	98955-27-2	COCC1CCC(CC1)CO	{1: 1, 2: 2, 11: 4, 12: 2, 20: 1, 22: 1}
OK	99-14-9	C(C(CC(=O)O)C(=O)O)C(=O)O	{27: 3, 2: 2, 3: 1}
OK	99-16-1	C(C(=O)O)(NC(=O)N)NC(=O)N	{24: 2, 27: 1, 3: 1, 30: 2, 31: 2}
OK	99-20-7	C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)O	{20: 8, 2: 2, 12: 10, 22: 1, 23: 2}
OK	99-48-9	CC1=CCC(CC1O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 2, 14: 1, 15: 1, 20: 1}
OK	99-49-0	CC1=CCC(CC1=O)C(=C)C	{1: 2, 5: 1, 7: 1, 11: 2, 12: 1, 14: 1, 15: 1, 25: 1}
OK	99-66-1	CCCC(CCC)C(=O)O	{27: 1, 1: 2, 2: 4, 3: 1}
OK	99-68-3	C(C(C(=O)O)SCC(=O)O)C(=O)O	{27: 3, 40: 1, 2: 2, 3: 1}
OK	99-69-4	C(CN(CCC(=O)O)[N+](=O)[O-])C(=O)O	{33: 1, 2: 4, 27: 2, 38: 1}
OK	99-83-2	CC1=CCC(C(C)C)C=C1	{1: 3, 3: 1, 11: 1, 12: 1, 14: 3, 15: 1}
OK	99-84-3	CC(C)C1=CCC(=C)CC1	{1: 2, 3: 1, 5: 1, 11: 3, 14: 1, 15: 2}
OK	99-85-4	CC1=CCC(=CC1)C(C)C	{11: 2, 1: 3, 3: 1, 14: 2, 15: 2}
OK	99-86-5	CC1=CC=C(CC1)C(C)C	{11: 2, 1: 3, 3: 1, 14: 2, 15: 2}
OK	99089-17-5	CN1CCCCCCCCCCC1=O	{1: 1, 11: 10, 33: 1, 25: 1}
OK	99129-21-2	CCC(=C1C(=O)CC(CC1=O)CC(C)SCC)NOC/C=C/Cl	{1: 3, 2: 4, 3: 1, 6: 2, 7: 1, 40: 1, 11: 2, 12: 1, 15: 1, 17: 1, 22: 1, 25: 2, 31: 1}
OK	99148-55-7	CCCCC(CC)CCC(=O)CCC(CC)CC	{24: 1, 1: 4, 2: 10, 3: 2}
OK	99148-56-8	CCCCC(CC)C=CC(=O)CCC(CC)CC	{24: 1, 1: 4, 2: 8, 3: 2, 6: 2}
OK	99152-10-0	CC(C)[C@H](C(=O)N(CC(=O)O)N=O)NC(=O)C	{1: 3, 2: 1, 3: 2, 33: 1, 34: 1, 24: 2, 27: 1, 29: 1, 31: 1}
OK	99210-90-9	C[C@H](CC(C)(C)O)O	{1: 3, 2: 1, 3: 1, 4: 1, 20: 2}
OK	993-53-3	CC(C)(C)C(C)(C#C)O	{1: 4, 10: 1, 4: 2, 20: 1, 9: 1}
OK	99328-46-8	CCC(C)C(CC=C)O	{1: 2, 2: 2, 3: 2, 5: 1, 6: 1, 20: 1}
OK	99343-89-2	CCCCC(CC)COC(=O)C=C.COC(=O)C=C.C=CC(=O)OCCC(=O)O	{1: 3, 2: 7, 3: 1, 5: 3, 6: 3, 27: 1, 28: 3}
OK	99392-65-1	C1CCC(=O)NCC1.C(CCC(=O)O)CC(=O)O.C(CCN)CN	{32: 1, 2: 8, 11: 5, 25: 1, 27: 2, 30: 2}
OK	994-05-8	CCC(C)(C)OC	{1: 4, 2: 1, 4: 1, 22: 1}
OK	994-21-8	CC#CC(C)(C)C(C)C	{1: 5, 10: 2, 3: 1, 4: 1}
OK	994-25-2	CCC(CC)(CC)Cl	{1: 3, 2: 3, 4: 1, 17: 1}
OK	99446-75-0	CC=CC(C)C(C)C	{1: 4, 3: 2, 6: 2}
OK	99520-32-8	C1[C@H](OC(C(O1)O)O)[C@H]([C@H]2[C@H](OC(C(O2)O)O)CO)O	{2: 1, 3: 1, 11: 1, 12: 7, 20: 6, 23: 4}
OK	996-12-3	CCCCC(C)(C)C=O	{1: 3, 2: 3, 4: 1, 26: 1}
OK	996-35-0	CC(C)N(C)C	{1: 4, 3: 1, 33: 1}
OK	996-70-3	CN(C)C(=C(N(C)C)N(C)C)N(C)C	{1: 8, 33: 4, 7: 2}
OK	996-98-5	C(=O)(C(=O)NN)NN	{24: 2, 30: 2, 31: 2}
OK	99636-32-5	C[C@@H](COC)N	{1: 2, 2: 1, 3: 1, 30: 1, 22: 1}
OK	997-46-6	CC(=C)C(=O)OCCCCO	{1: 1, 2: 4, 5: 1, 7: 1, 20: 1, 28: 1}
OK	997-55-7	CC(=O)N[C@@H](CC(=O)O)C(=O)O	{1: 1, 2: 1, 3: 1, 24: 1, 27: 2, 31: 1}
OK	997-62-6	C(CCN)C[C@@H](C(=O)O)NC(=O)CN	{2: 5, 3: 1, 24: 1, 27: 1, 30: 2, 31: 1}
OK	997-69-3	CCCCC(CCCC)C(=O)C	{24: 1, 1: 3, 2: 6, 3: 1}
OK	997-76-2	C(=C(C#N)C#N)C#N	{37: 3, 6: 1, 7: 1}
OK	997-95-5	CC(C)CN(CC(C)C)N=O	{1: 4, 34: 1, 3: 2, 33: 1, 2: 2, 29: 1}
OK	99743-21-2	CC1CC(CC2(C1)OCCO2)(C)C	{1: 3, 11: 5, 12: 1, 13: 2, 23: 2}
OK	99799-10-7	COC1CCCC(C1)C(=O)O	{27: 1, 1: 1, 11: 4, 12: 2, 22: 1}
OK	998-35-6	CCCCC(CCC)CCCC	{1: 3, 2: 8, 3: 1}
OK	998-65-2	CCC(CC)CCCCO	{1: 2, 2: 6, 3: 1, 20: 1}
OK	998-91-4	CCOC(=CC(=O)OCC)C	{1: 3, 2: 2, 6: 1, 7: 1, 22: 1, 28: 1}
OK	998-93-6	CCCC(CCC)Br	{1: 2, 2: 4, 3: 1, 18: 1}
OK	998-94-7	CC=CC(C)CC=C	{1: 2, 2: 1, 3: 1, 5: 1, 6: 3}
OK	998-95-8	CCCC(CCC)Cl	{1: 2, 2: 4, 3: 1, 17: 1}
OK	99814-12-7	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)OC(=O)CCC(=O)O)CC[C@@H]4[C@@]3(C[C@](C4)(C#C)OC(=O)CCC(=O)O)C	{1: 2, 2: 4, 9: 2, 10: 2, 11: 8, 12: 4, 13: 4, 27: 2, 28: 2}
OK	99814-65-0	CCCCCCCCCCCCC(C=C)O	{1: 1, 2: 11, 3: 1, 5: 1, 6: 1, 20: 1}
OK	99838-33-2	CN1C2CCC1CC(=C)C2	{1: 1, 5: 1, 33: 1, 11: 4, 12: 2, 15: 1}
OK	999-06-4	CCCCC(CCC)Br	{1: 2, 2: 5, 3: 1, 18: 1}
OK	999-07-5	CCCCC(CCC)Cl	{1: 2, 2: 5, 3: 1, 17: 1}
OK	999-21-3	C=CCOC(=O)C=CC(=O)OCC=C	{2: 2, 28: 2, 5: 2, 6: 4}
OK	999-52-0	CCCCC(CC)Cl	{1: 2, 2: 4, 3: 1, 17: 1}
OK	999-55-3	C=CCOC(=O)C=C	{2: 1, 28: 1, 5: 2, 6: 2}
OK	999-61-1	CC(COC(=O)C=C)O	{1: 1, 2: 1, 3: 1, 5: 1, 6: 1, 20: 1, 28: 1}
OK	999-64-4	CCCCCC(CC)Br	{1: 2, 2: 5, 3: 1, 18: 1}
OK	999-65-5	CCCCOC(C)CC	{1: 3, 2: 4, 3: 1, 22: 1}
OK	999-72-4	CNC(=O)CCSSCCC(=O)NC	{24: 2, 1: 2, 2: 4, 40: 2, 31: 2}
OK	999-78-0	CC#CC(C)(C)C	{1: 4, 10: 2, 4: 1}
OK	999-79-1	CC#CC(C)(C)Cl	{1: 3, 10: 2, 4: 1, 17: 1}
OK	999-90-6	CC(=O)SC(C)(C)C	{24: 1, 1: 4, 4: 1, 40: 1}
OK	99916-30-0	CCCCCCCC(CCCCC)CN(C)C	{1: 4, 2: 11, 3: 1, 33: 1}
OK	99924-46-6	C1N2CN3CN1CN(C2)C3.C1=CC=NC=C1.C(C(=O)O)O	{33: 4, 2: 1, 35: 1, 11: 6, 14: 5, 20: 1, 27: 1}
OK	9998-90-7	CC(=O)OCC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]	{1: 1, 2: 1, 4: 1, 38: 3, 28: 1}
