* LIGAND DATABASE FILE (OPLS2001)
*
GLYZ     10     9     15     16      39
    1     0 M   N3   _N__     1    22.52791    69.24409  -113.85235
    2     1 S   H    _H1_     8     1.01049    49.40687  -156.26768
    3     1 S   H    _H2_     9     1.01076   142.84233   -90.22614
    4     1 S   H    _H3_    10     1.00913   106.92904   102.32708
    5     1 M   CT   _CA_     2     1.45533    64.18447    -1.63183
    6     5 S   HC   _HA2     6     1.11328   108.86545   -79.69459
    7     5 S   HC   _HA3     7     1.11345   108.84707    39.41422
    8     5 M   C    _C__     3     1.52864   112.03336   159.84677
    9     8 S   O2   _O__     4     1.22883   119.74041     0.00000
   10     8 S   O2   _OXT     5     1.36448   116.10487  -179.96574
   9   6   5   4   5   4   3   2   1   1
    5     8     9    10     6     7     2     3     4  
    3     4     5     6     7     8  
    4     5     6     7     8  
    5     6     7     8  
    8     9    10     6     7  
    7     8     9    10  
    8     9    10  
    9    10  
   10  
    0  
NBON
    1   3.2500   0.1700  -0.3520   2.1000   1.6250  -0.100907100   4.805719700
    2   0.5000   0.0300   0.3170   0.9960   0.8600   0.079817800  -1.129220000
    3   0.5000   0.0300   0.3170   0.9960   0.8600   0.079817800  -1.129220000
    4   0.5000   0.0300   0.3170   0.9960   0.8600   0.079817800  -1.129220000
    5   3.5000   0.0660  -0.0290   1.9750   1.7500   0.000085900  -0.754493700
    6   2.5000   0.0300   0.0740   1.4250   1.2500   0.008394800   0.285390400
    7   2.5000   0.0300   0.0740   1.4250   1.2500   0.008394800   0.285390400
    8   3.7500   0.1050   0.7000   2.1120   1.8750  -0.026933700  -0.722204000
    9   2.9600   0.2100  -0.7090   1.6780   1.4800  -0.350477400  15.005156000
   10   2.9600   0.2100  -0.7090   1.6780   1.4800  -0.350477400  15.005156000
BOND
    1     5   367.000  1.471
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    5     8   317.000  1.522
    5     6   340.000  1.090
    5     7   340.000  1.090
    8     9   656.000  1.250
    8    10   656.000  1.250
THET
    1     5     8    80.00000  109.26000
    1     5     6    35.00000  109.50000
    1     5     7    35.00000  109.50000
    5     8     9    70.00000  117.00000
    5     8    10    70.00000  117.00000
   10     8     9    80.00000  126.00000
    6     5     8    35.00000  109.50000
    7     5     8    35.00000  109.50000
    7     5     6    33.00000  107.80000
    2     1     5    35.00000  109.50000
    3     1     5    35.00000  109.50000
    3     1     2    35.00000  109.50000
    4     1     5    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
PHI
    1     5     8     9   0.30150 -1.0 2.0
    1     5     8    10   0.30150 -1.0 2.0
    6     5     8     9   0.00000  1.0 1.0
    6     5     8    10   0.00000  1.0 1.0
    7     5     8     9   0.00000  1.0 1.0
    7     5     8    10   0.00000  1.0 1.0
    2     1     5     8   0.17350  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.13050  1.0 3.0
    3     1     5     8   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.13050  1.0 3.0
    4     1     5     8   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.13050  1.0 3.0
IPHI
   10     5     8     9  10.50000 -1.0 2.0
END
