 Structure and Dynamics of Argon
         2         1     15000    0.1000000000E-02
       17.3952969480        0.0000000000        0.0000000000
        0.0000000000       17.3952969480        0.0000000000
        0.0000000000        0.0000000000       17.3952969480
Ar               1
     4.023972884         2.257201511         2.476523008    
    0.7345153305         1.682592971         1.434504742    
    -808.1553733        -36.32789404         156.6931151    
Ar               2
     4.292150107        0.7419384499        -1.542184218    
     2.569541089       -0.6454596442        -1.305776580    
    -45.76813433         67.88115320         251.8019810    
Ar               3
    0.8343615755         4.894827872         5.031917310    
     1.026957189        -2.565293172        0.2256776665    
    -58.65859925         8.445986010         287.6795767    
Ar               4
    -7.896036906       -0.9147643014       -0.1863251743    
    0.4802350998         1.454614470        0.4418013843    
     133.2800364        -444.7701416         897.2346087    
Ar               5
    -5.921119813        -1.280009325         5.918613476    
    0.7698958580        0.2597761648         1.283637075    
     247.9430172         187.9502818         341.6864150    
Ar               6
     5.880498041         4.569509408        -3.757611951    
   -0.5979536761E-01    -1.992305655         1.804328217    
    -83.40733053        -1206.385784        -40.95066834    
Ar               7
    -1.882758769         3.208250917       -0.2715317145    
    0.5484857064       -0.6868584940        -1.615051197    
     824.3558274        -541.9026700        -82.44069580    
Ar               8
    -2.796942048        -1.518776165        -2.707974938    
    -2.771371950       -0.6510043051         1.060403156    
     361.4785902        -578.3906922         33.35110919    
Ar               9
    -3.911558285        -5.828348723        -3.649270635    
   -0.9307927334       -0.8216161731        -1.877301451    
    -42.80139046        -6.680877874        -299.3379530    
Ar              10
    -3.787128772         7.886827705        -1.869619664    
     3.697523800        -1.278493304        0.3670072339    
     11.06428253         325.9453236        -446.2785539    
Ar              11
    -7.346399196        -5.684901235        -5.996109019    
     1.264529420         1.776650317         1.565385129    
     87.67819965         16.16827047        -2.622516819    
Ar              12
     5.802571725        -1.506628485         3.103120176    
     1.907617938       -0.2762796914        0.4710606628    
     196.8484649         120.2396694        -122.1340178    
Ar              13
     3.235299522        -6.170569925         7.148909997    
    0.5872574531       -0.9524456518         2.542891825    
    -373.8953545        -98.49366532         97.74016880    
Ar              14
    -5.278691710        -5.020176285         3.342151924    
    0.3672107855       -0.4434389390        -1.483089587    
     343.3109567        -191.9833348        -55.25172799    
Ar              15
     3.557784813         3.410446763         7.248749006    
     1.716805851        0.7196330248        -1.337238262    
    -30.96692162        -76.37201105        -61.53198412    
Ar              16
    -4.786381055        0.7950372717        -8.407658180    
    -1.571406426         1.668824013        -1.053618945    
     9.199655502        -8.347995228        -79.68850899    
Ar              17
   -0.8008202348        -1.747510484         2.159870483    
    -1.697465610       -0.8611208946        -2.356667142    
     199.6160664        -298.1661990         440.8812179    
Ar              18
    -5.275063412         6.751914538         4.543261503    
    -2.589559928        -1.063895069         1.692572501    
    -437.6102699         273.8373158        -388.5406785    
Ar              19
    0.8055795068         5.806758744        -2.596560170    
    -1.088416818         1.275465612         1.186409760    
     13.87086146        0.3406320486         128.3851181    
Ar              20
    -4.446765516         5.281767043        0.2282228218    
    -1.232007661        0.9457243770        0.9353676837    
    -636.6442067         219.0696636         571.1174218    
Ar              21
    -4.214583298         4.142481107        -3.338442545    
   -0.9104974011        -1.100329514         2.538166249    
    -50.32810778         117.5938851         493.2444638    
Ar              22
     1.969054006         2.421877918        -4.223009520    
     1.728268139         1.311570460        0.3012176129    
     618.2246166         2140.820559         278.7738499    
Ar              23
    -7.590172316        -5.103293697        0.1268097678    
    0.2942377740         1.696743318       -0.5789816750    
     374.8946668        -38.40532471        -195.8531107    
Ar              24
     3.482452444         7.263893445         7.050955775    
   -0.1735752094        -2.121639446         2.405644420    
    -62.68326589         90.51086528        -14.17021830    
Ar              25
     2.407589655        -8.316661056        0.6316669584    
   -0.1105604732        0.2876052056        0.1163139917    
     25.47723226        -149.4746164         504.7199586    
Ar              26
    0.9780061340        -7.550768610         4.113570434    
     1.565732910        -2.891043204         1.027743810    
     166.4297024        -71.42355094         41.75417814    
Ar              27
    -3.851939920         5.312243115         7.463079523    
     2.683519098       -0.7646301115       -0.7466233717    
    -328.3427529         496.2273463        -530.7768849    
Ar              28
     6.157670263         1.372462719         5.136956255    
    -1.331105035        0.4466886628         1.653469409    
    -42.68397164         744.0819192         21.07196514    
Ar              29
    -2.774408810         4.517274297         3.761368230    
     1.236929397        -1.125826385        -1.146233015    
     569.7568588         221.4091224        -179.2366007    
Ar              30
     6.066744559         7.888356227        -3.719033355    
    -1.351860294       -0.1847267203        -1.483475872    
     274.5475897         747.8063633        -10.70088202    
Ar              31
     8.682535481        -7.736540984         3.202368606    
    -1.987284358        -3.667008795         2.013613984    
    -574.2618269         531.8728085         576.3345335    
Ar              32
    -7.700695533        0.3467913496         3.317643665    
    0.1141308744         1.123094186         1.197342097    
    -662.9904136        -632.7695051         677.6659380    
Ar              33
    -8.300097537        0.5249268590        -3.178625805    
   -0.2106244424         1.452070930         2.394404213    
    -235.4062354         617.2594419        -798.9156613    
Ar              34
     1.598297616         4.837479179         1.573687054    
    0.5790095409        0.7040134060         3.526803796    
    -909.5004655        -465.1510700        -801.5843041    
Ar              35
     6.183541092        -8.568610841       -0.5878364274E-01
     1.983437045        0.5317230324       -0.7300723990    
     220.0678535         305.8066904         165.6650124    
Ar              36
    -3.132959201        -5.055477181       -0.2573603030    
     1.944104920         2.630067966        0.7418614850    
    -174.1856038        -9.736423998         208.8468433    
Ar              37
   -0.9509410292E-01    -4.728060222        -2.886484181    
   -0.8965560790       -0.8986890273        -2.204624499    
     65.88584102         30.54624998         122.8322631    
Ar              38
   -0.2924180243        0.1766858162         8.600576525    
    -2.891025435       -0.9856018697       -0.4922400197    
     259.9658478         15.61494808         471.0707597    
Ar              39
     7.285836962         1.440562347        -7.913205417    
    -1.549073272        0.6046217429       -0.1979464915    
    -422.7110416         499.7918870        -108.5687176    
Ar              40
     4.234923461        -3.897950439        -4.497983286    
   -0.4256001475        -2.034008248        -2.559478777    
    -242.8519817        -189.7939493        -49.47055131    
Ar              41
     7.798052712         5.819438726         2.793343651    
    0.9990537732       -0.6708828334       -0.9244210423    
     154.0377655        -35.22870874        -162.2662088    
Ar              42
    -2.432560770        -7.197059366         3.154037595    
    -1.762630833        -1.382772916         1.979433525    
    -231.9261453         247.0701711        -81.99194589    
Ar              43
    -7.098016308        -8.021394797        -2.552962938    
     2.534167903         1.866572528       -0.3761087115E-01
    -312.1725265         166.6333063         337.7734960    
Ar              44
    -1.062749403         7.487483077        -5.364289613    
     1.680475599       -0.1074634542        -2.742013874    
    -234.6162011         111.1768244         234.6368891    
Ar              45
     4.137222498         6.221748526         3.220837685    
    -4.031075353        0.3756415349       -0.9672347884    
     623.9432538         496.4655949         499.9562740    
Ar              46
   -0.7349520330        -7.842590389        -1.142150538    
    0.5076521594       -0.1141927430         1.323784992    
     134.2838356         153.1332831        -510.5815365    
Ar              47
    -4.735805478        -4.609299853         7.647202066    
    -1.106668983       -0.6837220563       -0.6034897122    
     1343.167282        -222.0658682        -140.8412430    
Ar              48
     5.388031382        -2.100489575        -7.524913230    
    0.8825959592        0.6722886167         2.679875041    
     120.1407889        -559.1529379        -839.2359141    
Ar              49
    -6.894073822        -2.793554914        -3.421401580    
    0.3799986877        -1.491831428        -2.155136841    
    -25.85306541        -242.7947449         280.1772593    
Ar              50
   -0.5370418408        -4.146804554         4.870917680    
    -2.235964828        0.4399875664         3.424563747    
     195.1705866        -523.3475988         28.55209068    
Ar              51
     3.287251803         5.112870034        -6.665601015    
    -2.606173402         1.933468240        -1.581101657    
     562.6221616         127.1911284         127.7340629    
Ar              52
    -8.096430720        -3.167773013         3.891865907    
    0.3450759437         1.894029857        -1.222458754    
    -842.7629313        -93.13033164        -29.68135574    
Ar              53
     6.681290286        -7.452902727         7.062515606    
    -1.162947145        0.6881799721        0.3349462666    
     126.8649955        -86.12083475        -28.98674617    
Ar              54
     2.031049950       -0.7786220725        -4.277825599    
    0.5674350808        0.8002505205        -3.096278916    
     436.6345364        -1636.268045         442.2114795    
Ar              55
    -8.157495755        -1.115332498        -6.707328581    
   -0.3892729855       -0.8912582401         1.400196428    
     118.4319809        -305.5382382         185.0050390    
Ar              56
     6.639797665        -2.474829172        -2.191282602    
   -0.1641875067       -0.7468776764       -0.4383822348    
     597.3048755         480.5250829        -48.25809070    
Ar              57
   -0.6041166823        -2.394862158        -5.545191317    
    0.1209552239        0.6821852120        -1.339091141    
    -728.2353276        -174.3216384        -616.7187781    
Ar              58
    -2.314402446        -1.322995793         5.808641351    
    -1.197235816        0.5941005718        -3.131236303    
    -63.21423085         355.8162091         63.50917254    
Ar              59
     1.077395379        -3.055869672         8.366186506    
    -3.461541110       -0.2383984028       -0.9962617540    
     232.2210122        -338.6024073        -22.73796688    
Ar              60
     4.598935350        -7.860243492        -6.734169344    
    -1.556769264       -0.7355399604        0.4069517980    
     19.14254796        -8.712291841        -119.2811209    
Ar              61
     5.477932998       -0.9636580716E-01    -4.812284420    
   -0.8855324174         1.127216137       -0.7851348650    
     963.9752086         263.1297148         1013.704476    
Ar              62
     4.513324277        -7.122261669         3.622137642    
     1.738373590         1.727535246       -0.5944808233    
     286.1166906         26.73294003        -6.236121068    
Ar              63
    -5.287846508         8.462189561        -5.400044626    
     3.563721406         1.644505193         1.783661088    
     330.3873869        -158.1811306         244.2240466    
Ar              64
    -8.114278655         5.188332385        -1.333489727    
     2.432055779       -0.6815518876        -2.236573082    
    -7.586764699         39.72704031         55.80850035    
Ar              65
     4.258957984         5.879793235       -0.6876655497    
     1.312517352        -2.429615765        -1.367300286    
    -33.06901788        -135.9832197        -64.13221244    
Ar              66
     3.459454283        0.9504345274        -7.267074604    
     2.967935151       -0.2487880940       -0.1228545836    
    -672.1043517         420.3558190        -830.1567424    
Ar              67
    -1.577124915         7.739762167         5.809314593    
    0.1555558357         1.128248374        0.9027281138    
    -50.60644436        -53.51098841         59.80358265    
Ar              68
   -0.2663633952E-01     4.555224061        -7.358514336    
   -0.8901043132       -0.4045303077        -1.243748475    
    -58.14088757        -189.6078670        -378.6909847    
Ar              69
    -1.321904537         1.945612802        -4.984449599    
    0.9323520883       -0.6739824168       -0.7179150532    
    -530.3699425        -193.0807599        -105.2401770    
Ar              70
     3.198605443        -7.655401160        -2.697588631    
     1.082631648         2.055126162       -0.8027542332    
    -125.3793118         270.1755805        -360.7606033    
Ar              71
    0.2717989636        -5.008911521        0.9025353780    
    0.3947348490        0.9199139351        0.3202671437    
     322.6799489        -73.39948479         232.5979581    
Ar              72
    -1.686250309        -5.170981039        -7.675551267    
     1.126461367         1.090153565         2.117163027    
    -98.21897823         22.87499107        -20.52037907    
Ar              73
    -4.784520403        -2.234837367        -6.236586145    
   -0.3735368314        0.9154527312         1.254997111    
     446.7365491        -673.4822085        -406.4557642    
Ar              74
    -7.417184993         7.468148319        -7.996766521    
    0.1158627980        -1.937504222        -1.125391896    
    -190.8114682         4.436813685        -290.0227948    
Ar              75
    -3.269004887        -8.398208250        -8.217153607    
   -0.9543857478        0.7819847036        -1.499435023    
     61.48523736        -172.8684307        -333.5998113    
Ar              76
    -2.176307770         2.372644349         6.748387432    
     2.774737215         1.953464214        0.5502978351    
    -1.601495734        -7.880237840        -407.6533730    
Ar              77
     2.831219150        -3.484281938         3.390704146    
   -0.7511435678E-01     1.237490293        0.1078408766    
    -118.7528182        -215.7044526       -0.1117702092    
Ar              78
    -6.772941549         3.858917420        -7.699095909    
   -0.8322736326       -0.6125614930        -2.364269393    
    -128.3641257        -80.43712751         179.2690459    
Ar              79
    -7.814988920         2.327174522         6.610082378    
   -0.4114141545       -0.5171750909       -0.5144352450    
     68.98231225        -161.9397345        -192.3699247    
Ar              80
     7.641981285        -1.112340067         6.880833701    
   -0.2217389171        0.9285071194        0.2044937298    
     228.1598923         787.9800526         81.16825595    
Ar              81
    0.4066863000        0.1584702482       -0.4223393734    
   -0.3636188311        -2.545174707       -0.3132240998    
     217.8649920         306.8206097        -519.4309509    
Ar              82
     3.191667266       -0.7835919457         6.155280533    
   -0.6061059225E-01     1.078989159         1.720452403    
     81.62793356       -0.1340390791         65.57224496    
Ar              83
    0.6000913169         1.002752099         3.967797087    
   -0.8591709473        -1.424090990        -1.011278906    
    -2.483457731         259.3179871         141.8793375    
Ar              84
     7.093876245        -6.060843476        -3.004746173    
   -0.7727910953       -0.1809686010       -0.3585148530    
    -10.64984784         78.31537788         74.70707403    
Ar              85
     4.243317939        -4.410665154       -0.6765024321    
   -0.5373851478         1.346394625        -1.221577069    
    -1311.578032        -335.1633135        -462.3054343    
Ar              86
    -6.607190497         2.672213428         1.295328633    
    0.6654031389         1.351699247       -0.6933143473    
     172.8675635         953.4694999        -675.5195283    
Ar              87
    -3.433982361         4.709571373        -6.677879141    
   -0.8630407648        0.6833381612E-01     1.380161991    
    -41.50460072        -15.51314876         665.1927022    
Ar              88
    -4.768735158        0.7913529244        -4.584836372    
     1.286604314        -3.822088354       -0.5638151956    
    -353.0399787         357.2839036        -662.7482059    
Ar              89
    -7.847598963        -3.634826107         7.918307627    
    -3.141797386        0.4893801738        -2.511530554    
    -867.3929676        -526.9970142         475.1073737    
Ar              90
     5.822215087        -3.867671758         6.154066836    
     1.119086585         1.253327189        -2.304649732    
    -279.1129074        -430.4728296        -319.1492917    
Ar              91
    -1.028474032         7.395728952         1.529759562    
   -0.3622714630        -1.753017962       -0.3760799454E-01
    -42.07075347        -582.1716465         309.3041481    
Ar              92
    -6.696737333         8.029596715         1.070565814    
    -1.506480780        0.2194019472       -0.6602823405    
     464.5292653        -319.1017875        -549.8515965    
Ar              93
    -3.556750840         1.238083076         3.016957415    
   -0.9376538754         1.437741383         2.346718529    
    -18.62783011        -331.5836264         20.23180123    
Ar              94
    0.4809197965        -8.566106198        -8.322750538    
    0.5125161167        0.4753422788        0.2478684158    
    -87.21908357        -703.4243733        -1039.290689    
Ar              95
     6.988538854         2.364047942        0.8375602373    
    -1.420309972       -0.2106330347        0.2423336029    
     687.9769014         3.181747341        -351.0996448    
Ar              96
    -4.075514759        -1.784228344         1.190312906    
    0.5856206010        -1.070966014         1.421256250    
    -752.7366216        -256.8379371        -167.5796437    
Ar              97
     1.323942504        -6.360457058        -5.996290145    
     2.270499440         1.037300829         2.535390381    
     301.3058619         807.1366951         876.3476676    
Ar              98
    -6.016979247        -7.866977948         6.602597962    
    0.4568689091E-01    0.4788557394         1.526938710    
    -110.9673482         215.4442296         24.27863177    
Ar              99
    -4.691350254        0.9340725492        -1.183830211    
     1.325809401       -0.9075845503         1.738130366    
    -232.6377923         377.9150215         679.4534243    
Ar             100
     6.647767485        -4.695854104         1.576433182    
    -3.303244016       -0.7696610236        -1.424854253    
     485.1029699        -224.1952965         844.8042545    
