208
#symbol   rx   ry   rz   vx   vy   vz   charge   damp   ---  Molecular Workbench
Ar  13.6796713  -8.1824875  -9.3067875  -0.00385  -0.00031  0.0014  0  0
Ar  23.8145123  7.9720302  -22.5270309  0.00155  0.00312  0.0002  0  0
N  -19.9639397  18.7854309  22.2111092  0.00136  -0.00225  0.01095  0  0
N  -20.701807  18.3848  21.4215527  -0.00218  0.00576  -0.00132  0  0
N  15.7411804  -22.5404129  13.7208824  0.0027  -0.00616  -0.0009  0  0
N  15.6369095  -23.629509  14.25842  -0.00259  -0.00647  -0.0005  0  0
N  14.0198298  15.34342  -0.7128699  0.00231  0.00196  0.00387  0  0
N  14.1190701  15.0983295  -1.6963216  0.00189  -0.00599  -0.00256  0  0
N  16.1662369  18.4284  20.9693527  -0.00061  0.00586  -0.00528  0  0
N  17.0827599  18.0275707  20.7372589  0.0067  0.00046  0.00391  0  0
N  -13.5303202  6.20787  -0.46772  -0.01277  0.00444  -0.00434  0  0
N  -13.1365309  6.9743748  -0.88055  -0.00094  0.00619  0.00292  0  0
N  -4.6231399  23.816885  12.6340714  -0.00199  0.00898  0.00552  0  0
N  -5.0763001  23.0470505  11.6601496  0.00912  0.00198  -0.00733  0  0
N  -4.4475617  -3.44153  -4.5113101  -0.00007  0.00407  -0.00359  0  0
N  -4.2829247  -2.75315  -5.5141048  -0.00614  -0.00136  0.00117  0  0
N  15.1712484  21.4796829  4.7548432  0.00645  0.00272  0.00148  0  0
N  14.66049  21.5823498  3.6773977  -0.00685  0.00355  -0.01203  0  0
N  23.9384995  -10.9700203  10.21276  -0.00084  -0.00077  0.00383  0  0
N  23.7117901  -10.09377  10.8772497  0.00032  0.00529  -0.00334  0  0
N  -3.4300301  20.2985191  -6.1544337  0.00412  -0.00464  -0.00254  0  0
N  -3.7463701  19.487093  -6.97226  -0.00341  0.0042  0.00574  0  0
N  23.1620407  -19.4434605  -20.1922169  -0.0071  0.00539  -0.00481  0  0
N  22.9570904  -20.6779804  -20.4790897  0.00237  -0.00373  -0.00566  0  0
N  -12.56987  -6.6061301  -20.1689396  0.00084  0.00589  -0.00845  0  0
N  -11.7694235  -5.7434793  -20.0828896  0.00675  0.0072  -0.0081  0  0
N  7.2729073  -0.48857  1.60429  -0.00219  -0.00663  0.00809  0  0
N  7.07972  -0.3258  0.45946  -0.00683  -0.0029  -0.00009  0  0
N  -14.32549  -13.63902  18.9014301  0.00202  -0.00429  0.00877  0  0
N  -14.3544111  -13.8533134  17.8387127  -0.00028  -0.01123  -0.00485  0  0
N  14.02847  21.1974049  -17.6611519  0.00544  0.0053  0.005  0  0
N  12.8943624  21.0106907  -17.804615  -0.00388  -0.00339  -0.00022  0  0
N  19.8554401  -19.380455  -2.1212499  0.00116  -0.00176  -0.00648  0  0
N  19.478035  -20.4426498  -2.2947099  -0.00201  -0.00219  -0.00288  0  0
N  19.7812729  -23.0984592  23.0545406  0.00112  -0.00263  -0.01168  0  0
N  19.0954704  -23.8510952  23.4485493  0.00614  0.00253  0.00559  0  0
N  9.9826899  -5.3095922  -23.1475849  0.00527  0.00218  0.01028  0  0
N  10.5117664  -5.8353548  -22.4101391  0.00642  -0.00061  -0.00699  0  0
N  -16.3464069  -19.6260509  10.6810064  0.00909  -0.0036  0.00579  0  0
N  -16.1403809  -18.825037  9.7976065  0.00296  0.00963  -0.00154  0  0
N  4.9623499  -16.0152893  3.9619501  0.00068  -0.00123  0.00754  0  0
N  4.0554547  -16.5419598  3.6361196  -0.00061  -0.00676  0.01119  0  0
N  -22.2740097  17.01124  -20.5178127  -0.00695  0.00637  0.00476  0  0
N  -22.79533  17.379303  -21.4964504  0.00276  -0.00913  0.00545  0  0
N  -6.1506  18.556139  14.0912895  0.00076  0.00087  0.00673  0  0
N  -6.4868612  17.4063702  14.6212111  0.00221  0.00018  0.0004  0  0
N  0.38784  20.0342007  11.7112894  0.00387  -0.00352  -0.00421  0  0
N  0.70407  20.7216606  10.8490896  -0.00753  0.01092  0.00857  0  0
N  -19.5979404  13.1279297  9.0882244  -0.0006  0.0047  0.00206  0  0
N  -18.7390594  13.4266415  8.3715401  0.00567  0.00371  0.00167  0  0
N  8.2781096  -10.6915302  1.7810317  0.00503  0.00576  -0.01002  0  0
N  7.20787  -10.7664509  1.3854789  -0.00172  0.00052  0.00783  0  0
N  -12.6523294  9.7012901  4.4086099  0.00073  0.00473  -0.00203  0  0
N  -13.5944815  9.1169701  5.06358  -0.00378  -0.00595  -0.00599  0  0
N  -14.6181774  20.9722099  15.3734875  -0.00774  0.01289  0.00406  0  0
N  -15.7617903  20.5391369  15.2326803  0.00342  0.00177  0.00237  0  0
N  13.7689514  21.2464447  -0.18078  -0.00419  0.00759  -0.0038  0  0
N  13.8281574  20.4291  0.80975  0.00052  0.00051  0.00179  0  0
N  -7.7302198  22.51157  9.2885513  0.00389  0.00766  0.00267  0  0
N  -7.8661942  21.9044991  10.0097275  -0.00501  -0.00235  -0.00138  0  0
N  23.7024269  12.1715202  -2.94137  -0.00022  -0.00012  -0.00052  0  0
N  23.6708126  11.9392509  -1.83662  -0.00322  0.00445  0.00349  0  0
N  -22.2187901  -4.8906407  7.0146217  -0.00335  0.00879  0.00154  0  0
N  -22.7702808  -4.3631001  6.1433578  -0.00635  0.00102  -0.00649  0  0
N  -9.3730097  0.9895502  10.0986814  0.00551  -0.00221  0.00673  0  0
N  -9.5570297  0.21594  9.2378311  0.00144  0.00494  0.00401  0  0
N  -16.8960495  -13.1031895  -20.1245193  -0.0063  -0.00201  0.00784  0  0
N  -16.5257397  -14.2931404  -19.5596809  -0.00362  0.00045  0.00161  0  0
N  -20.3306503  18.0513172  3.06531  0.00151  0.00352  0.00396  0  0
N  -20.1037102  17.988739  4.11832  0.00123  0.00092  0.00595  0  0
N  9.8440695  -3.9646301  -3.6404898  0.00176  0.00205  0.01142  0  0
N  10.0836  -2.8357601  -3.2152421  0.00198  0.0002  0.00238  0  0
N  -0.62509  -16.5731525  20.8123894  -0.00265  0.00272  -0.0015  0  0
N  0.01761  -16.1249809  20.0157795  0.00087  0.00334  0.00234  0  0
N  -23.474205  0.83465  19.1249409  -0.00078  0.00198  0.00903  0  0
N  -23.635149  0.89847  20.2250195  -0.00096  -0.00912  0.00997  0  0
N  18.0558014  13.3270044  4.7690268  0.00274  0.00042  0.00323  0  0
N  18.3415394  14.22054  5.5606799  0.00145  -0.00696  -0.0059  0  0
N  23.1789093  11.0485401  -4.3355556  0.0031  0.00812  -0.00482  0  0
N  23.6708794  11.9491425  -4.9384727  0.00297  -0.00042  0.01017  0  0
N  -24.4596729  -23.15271  8.5910234  0.00148  -0.00285  -0.00088  0  0
N  -24.9264507  -22.3772526  7.8412199  0.00505  0.00415  -0.00201  0  0
N  0.25902  -11.0317497  11.1148901  0.00781  -0.00098  -0.00016  0  0
N  0.52445  -11.1854296  9.9395447  0.00221  0.00815  -0.00431  0  0
N  -16.466753  -23.4178391  16.899847  0.00066  -0.00047  0.0037  0  0
N  -17.4571457  -23.3179398  17.6315002  -0.00099  -0.0054  -0.00298  0  0
N  23.0300999  -0.34618  7.9918737  -0.0071  -0.00114  -0.00241  0  0
N  21.812849  -0.29077  7.8131537  -0.00424  0.01018  -0.00009  0  0
N  15.8548002  23.3319302  21.7031403  0.00325  0.00411  -0.00069  0  0
N  15.0200424  23.4866829  21.2335205  0.00822  0.00375  -0.00233  0  0
N  9.6856699  2.6424901  -13.8051214  0.00055  -0.00082  0.00963  0  0
N  9.2761078  3.13925  -14.77038  0.00644  0.00499  -0.00552  0  0
N  -22.5195599  20.2986603  -1.41737  -0.00061  0.00152  -0.00234  0  0
N  -22.3256092  21.1419849  -0.55528  -0.00202  0.00616  0.0076  0  0
N  -24.2625809  -12.6487474  14.3538074  -0.00718  -0.00281  0.00262  0  0
N  -24.1854897  -13.8434401  13.9583864  -0.00078  0.00962  -0.00595  0  0
N  -12.5663404  -2.5473099  4.8575349  0.00049  -0.00072  0.00076  0  0
N  -11.7367067  -2.4466221  4.0636783  0.00487  -0.00292  0.00732  0  0
N  -25.2698708  17.3715172  10.2676001  -0.00132  -0.00318  -0.00304  0  0
N  -25.178709  18.1620998  11.0658102  -0.00544  0.00181  0.00194  0  0
N  -21.8994198  -0.17649  -15.9363203  -0.00332  -0.00221  0.0065  0  0
N  -23.1407089  -0.5313299  -16.0666199  -0.00185  0.01074  -0.00186  0  0
N  -16.2990208  16.4913006  -4.97261  -0.00078  -0.00282  0.00147  0  0
N  -15.5055313  17.1030903  -4.8859601  0.00013  -0.00413  0.001  0  0
N  -24.4077702  -2.79053  10.9942465  -0.00424  0.00542  0.00492  0  0
N  -23.3797092  -2.2940099  10.8080244  -0.00271  0.00502  -0.00169  0  0
N  -8.8444605  -5.6850901  -7.18714  -0.00401  0.00463  0.00299  0  0
N  -9.0682297  -5.3455949  -8.3629303  -0.00129  -0.00612  -0.00372  0  0
N  -15.1735401  -19.9902802  -12.1971502  0.00734  0.00002  -0.0037  0  0
N  -14.9591885  -20.6797504  -13.0806713  0.00494  0.00103  -0.00188  0  0
N  22.0035896  -22.1808701  -14.2430601  -0.00251  0.00182  -0.00096  0  0
N  21.185133  -21.5195103  -14.0392075  0.00906  -0.01221  0.00032  0  0
N  -24.6198597  -16.983757  -7.2712798  -0.0012  0.00018  0.00169  0  0
N  -25.5068798  -17.6106892  -7.4769101  -0.00213  0.00114  0.00945  0  0
N  4.0833488  -8.5402403  4.9574022  -0.00257  0.00054  0.00372  0  0
N  4.7371101  -9.6254444  4.91961  0.0074  -0.00152  0.0047  0  0
N  -21.5751152  3.7018399  11.6180944  -0.00531  -0.00164  0.00388  0  0
N  -21.5962105  4.2948217  10.6083899  -0.00032  -0.00369  -0.0014  0  0
N  -6.8867302  -15.6075401  -8.9966888  -0.01584  -0.00842  0.00208  0  0
N  -7.8871202  -15.1205244  -8.4948912  0.00164  -0.00282  -0.00607  0  0
N  -6.0811901  20.0196495  -5.6633883  -0.00301  0.00072  0.00445  0  0
N  -5.0437598  20.1235809  -5.20611  0.00187  -0.00109  0.00983  0  0
N  24.664175  5.1358337  -6.4794912  -0.00176  0.00392  0.00687  0  0
N  24.070015  4.0760307  -6.8518248  0.01307  0.00516  0.00278  0  0
N  9.5437899  9.0268497  1.63587  0.00338  -0.00305  -0.00243  0  0
N  8.8839302  8.3391695  1.1585689  -0.00743  -0.00472  0.00173  0  0
N  20.7154408  -16.9337997  -7.0302801  -0.00654  -0.0029  -0.00538  0  0
N  20.5190449  -18.011879  -6.5571837  0.00446  -0.00063  0.00185  0  0
N  4.4758749  -6.0318217  17.653553  0.00499  0.0053  -0.00452  0  0
N  5.3074722  -6.5173802  17.7602901  -0.00734  -0.00175  -0.00483  0  0
N  -10.2697697  -17.8645077  -12.11975  0.00021  0.00226  -0.00287  0  0
N  -9.8021603  -18.99259  -12.0058403  -0.00998  0.00465  -0.00735  0  0
N  23.7753792  -6.8218722  9.0726709  0.00402  0.00112  0.00565  0  0
N  24.1447906  -7.26015  8.0425005  0.00119  -0.00148  0.00579  0  0
N  16.7824192  -15.4789696  19.098547  0.00435  0.00282  -0.00704  0  0
N  16.0937004  -15.9990845  18.5099449  -0.00136  -0.00027  -0.00335  0  0
N  -6.6251001  6.5372701  19.2091007  0.00556  0.00236  -0.00262  0  0
N  -6.8528848  7.6001  19.3505306  -0.00455  -0.0016  -0.01083  0  0
N  10.5173244  19.3433704  -7.3080502  -0.0029  -0.0032  0.00427  0  0
N  11.4383898  19.673811  -7.6963  0.00167  0.00131  -0.00409  0  0
N  -9.2427311  -22.2454929  11.7575455  -0.00241  -0.00521  0.00183  0  0
N  -8.2726603  -21.7042007  12.2572298  0.00635  0.00238  0.00576  0  0
N  21.6375809  -14.7023096  -1.8188589  0.01012  -0.01207  0.0016  0  0
N  21.1067505  -15.4918604  -2.1870699  -0.0006  -0.00106  -0.00364  0  0
N  10.7594509  14.5637474  -15.7583504  0.0003  0.00408  0.00234  0  0
N  10.7873201  13.775651  -15.08776  -0.00526  0.00564  0.01  0  0
N  23.8613701  -23.4014893  -4.0556302  0.00244  0.00029  0.00301  0  0
N  23.5439606  -22.6263409  -3.27876  -0.0046  -0.00303  0.00358  0  0
N  -0.00797  -15.3811502  14.1304255  -0.00843  -0.00126  0.00147  0  0
N  -0.60188  -15.9509697  13.2589302  0.00088  -0.00389  -0.00332  0  0
N  15.9014311  -0.52595  -21.7622108  0.00064  0.00624  0.00957  0  0
N  14.9570112  -0.68986  -22.0448704  0.00105  -0.00572  -0.00072  0  0
N  18.0735092  10.7266245  4.9198012  -0.00243  -0.003  0.00639  0  0
N  18.1356449  10.8514299  3.5697999  -0.00136  -0.00775  -0.00804  0  0
N  -2.9050901  -10.4890003  -17.7775707  -0.00013  0.0017  0.00175  0  0
N  -2.6435199  -10.0686102  -18.8460197  0.00612  -0.00031  -0.0039  0  0
N  2.111197  5.7822847  -12.0974865  0.00294  -0.00086  0.00181  0  0
N  2.6403599  6.5731101  -12.6713724  0.00236  -0.00117  -0.00135  0  0
N  -19.694809  4.2974501  -23.59618  0.00522  -0.00292  0.00179  0  0
N  -19.7405109  4.8370547  -22.7769508  0.00131  -0.00748  -0.01021  0  0
O  -10.51161  23.775507  -1.8401889  -0.00188  0.00154  0.00737  0  0
O  -11.4053402  23.6846905  -2.65627  -0.00564  0.00213  -0.00705  0  0
O  -4.7623568  -23.255619  19.9631004  -0.00196  -0.00472  0.00325  0  0
O  -6.0997601  -23.5300789  20.194315  -0.00764  0.00189  -0.008  0  0
O  11.0185699  -5.5528712  2.47821  -0.00556  0.00809  -0.00048  0  0
O  11.9607201  -6.4225702  2.18998  -0.00664  -0.00588  -0.00428  0  0
O  6.7772899  -2.0130401  14.8105698  0.00913  0.00943  -0.0019  0  0
O  7.0087199  -3.1640897  15.2173901  0.0054  0.00263  -0.00625  0  0
O  14.7132702  15.6855297  23.775219  -0.00091  0.00165  0.0009  0  0
O  13.6770601  15.1104403  23.1195869  -0.00166  0.00141  0.00162  0  0
O  0.4116  14.9343309  -19.0844193  0.00124  0.00351  -0.00759  0  0
O  -0.86107  15.2591  -18.7035389  0.00083  -0.00622  0.00504  0  0
O  -14.6832495  1.66203  1.0788212  0.00217  0.00546  -0.00648  0  0
O  -15.2501297  1.7316412  -0.08986  0.00491  -0.00907  0.00759  0  0
O  6.3081412  -18.0234203  -2.31093  0.00103  0.00388  -0.00895  0  0
O  6.0550017  -17.5406208  -1.15861  0.00461  -0.00055  -0.00607  0  0
O  10.6651096  -14.2383804  -23.4148407  -0.00832  0.00217  -0.00253  0  0
O  9.2542896  -14.72087  -23.3419895  0.00157  -0.01244  0.00511  0  0
O  -3.84584  13.3193903  -20.0299206  0.01185  0.00717  -0.00095  0  0
O  -2.9717  14.1026697  -19.2024593  -0.00042  -0.00121  -0.0099  0  0
O  15.7223854  -12.6192884  11.60359  0.00144  -0.00089  0.00207  0  0
O  15.8019094  -12.7011604  12.8869801  0.00509  -0.00308  -0.00255  0  0
O  -2.0552711  -23.6071396  -15.0021  0.0032  -0.00663  -0.00462  0  0
O  -1.0575087  -23.4847126  -13.8475695  -0.00174  0.00802  0.00233  0  0
O  -24.6146507  -13.1380224  9.0455885  0.00048  0.00251  -0.00006  0  0
O  -24.5597897  -14.4060078  9.2516603  0.00148  -0.00055  -0.00437  0  0
O  -0.71141  22.6712494  4.20403  -0.00418  -0.0054  0.00216  0  0
O  -1.8467689  22.1609898  3.6601396  -0.0027  -0.00681  0.0033  0  0
O  -10.7782803  -19.0964603  -6.0007901  0.00458  0.00184  -0.00049  0  0
O  -10.3187695  -18.1694889  -4.9885001  -0.00406  0.0031  0.00375  0  0
O  -13.2695065  -21.3392429  -19.7181091  -0.00551  -0.00114  -0.00268  0  0
O  -13.8474455  -20.2994289  -20.2466106  0.0041  0.00241  -0.00058  0  0
O  19.1008892  4.2406693  2.1416099  -0.00193  -0.00107  -0.00155  0  0
O  19.6307449  4.3871512  3.1977599  0.00931  -0.00412  0.00121  0  0
O  -8.1206474  -6.6578202  5.2090483  0.00169  -0.01385  -0.0008  0  0
O  -6.97825  -5.9472003  5.7212768  -0.00342  -0.00111  -0.00546  0  0
O  2.3053901  -17.7244606  4.9264402  0.00369  -0.00717  0.00067  0  0
O  1.9320104  -16.6113701  5.434865  -0.00421  -0.00506  -0.00445  0  0
O  14.8123503  1.5608  -2.3350701  0.00261  -0.00424  -0.00094  0  0
O  13.8479404  2.10237  -1.69911  0.00055  0.00265  -0.00644  0  0
C  6.3066101  -6.29039  10.5734911  -0.00238  0.00631  -0.00053  0  0
O  6.40628  -6.7343802  11.5078802  -0.00388  -0.00174  -0.0006  0  0
O  6.1721201  -5.8246822  9.5259304  -0.00322  0.0056  -0.00392  0  0
C  -2.4399421  -16.1896229  5.7657499  0.008  0.00008  0.00008  0  0
O  -3.3736  -16.6262207  4.9851727  -0.00787  -0.00362  0.00302  0  0
O  -1.66102  -15.7730885  6.3733802  0.00645  -0.00304  0.00718  0  0
Ar  -14.9686804  2.2794311  -20.6137104  0.00512  0.00188  -0.00174  0  0
Ar  -7.3976912  15.3496313  -8.3505697  -0.00092  -0.00319  -0.00196  0  0
bond 2 3 4.5 1.12998
bond 4 5 4.5 1.12998
bond 6 7 4.5 1.12998
bond 8 9 4.5 1.12998
bond 10 11 4.5 1.12998
bond 12 13 4.5 1.12998
bond 14 15 4.5 1.12998
bond 16 17 4.5 1.12998
bond 18 19 4.5 1.12998
bond 20 21 4.5 1.12998
bond 22 23 4.5 1.12998
bond 24 25 4.5 1.12998
bond 26 27 4.5 1.12998
bond 28 29 4.5 1.12998
bond 30 31 4.5 1.12998
bond 32 33 4.5 1.12998
bond 34 35 4.5 1.12998
bond 36 37 4.5 1.12998
bond 38 39 4.5 1.12998
bond 40 41 4.5 1.12998
bond 42 43 4.5 1.12998
bond 44 45 4.5 1.12998
bond 46 47 4.5 1.12998
bond 48 49 4.5 1.12998
bond 50 51 4.5 1.12998
bond 52 53 4.5 1.12998
bond 54 55 4.5 1.12998
bond 56 57 4.5 1.12998
bond 58 59 4.5 1.12998
bond 60 61 4.5 1.12998
bond 62 63 4.5 1.12998
bond 64 65 4.5 1.12998
bond 66 67 4.5 1.12998
bond 68 69 4.5 1.12998
bond 70 71 4.5 1.12998
bond 72 73 4.5 1.12998
bond 74 75 4.5 1.12998
bond 76 77 4.5 1.12998
bond 78 79 4.5 1.12998
bond 80 81 4.5 1.12998
bond 82 83 4.5 1.12998
bond 84 85 4.5 1.12998
bond 86 87 4.5 1.12998
bond 88 89 4.5 1.12998
bond 90 91 4.5 1.12998
bond 92 93 4.5 1.12998
bond 94 95 4.5 1.12998
bond 96 97 4.5 1.12998
bond 98 99 4.5 1.12998
bond 100 101 4.5 1.12998
bond 102 103 4.5 1.12998
bond 104 105 4.5 1.12998
bond 106 107 4.5 1.12998
bond 108 109 4.5 1.12998
bond 110 111 4.5 1.12998
bond 112 113 4.5 1.12998
bond 114 115 4.5 1.12998
bond 116 117 4.5 1.12998
bond 118 119 4.5 1.12998
bond 120 121 4.5 1.12998
bond 122 123 4.5 1.12998
bond 124 125 4.5 1.12998
bond 126 127 4.5 1.12998
bond 128 129 4.5 1.12998
bond 130 131 4.5 1.12998
bond 132 133 4.5 1.12998
bond 134 135 4.5 1.12998
bond 136 137 4.5 1.12998
bond 138 139 4.5 1.12998
bond 140 141 4.5 1.12998
bond 142 143 4.5 1.12998
bond 144 145 4.5 1.12998
bond 146 147 4.5 1.12998
bond 148 149 4.5 1.12998
bond 150 151 4.5 1.12998
bond 152 153 4.5 1.12998
bond 154 155 4.5 1.12998
bond 156 157 4.5 1.12998
bond 158 159 4.5 1.12998
bond 160 161 4.5 1.31603
bond 162 163 4.5 1.31603
bond 164 165 4.5 1.31603
bond 166 167 4.5 1.31603
bond 168 169 4.5 1.31603
bond 170 171 4.5 1.31603
bond 172 173 4.5 1.31603
bond 174 175 4.5 1.31603
bond 176 177 4.5 1.31603
bond 178 179 4.5 1.31603
bond 180 181 4.5 1.31603
bond 182 183 4.5 1.31603
bond 184 185 4.5 1.31603
bond 186 187 4.5 1.31603
bond 188 189 4.5 1.31603
bond 190 191 4.5 1.31603
bond 192 193 4.5 1.31603
bond 194 195 4.5 1.31603
bond 196 197 4.5 1.31603
bond 198 199 4.5 1.31603
bond 202 200 4.5 1.1598889
bond 200 201 4.5 1.1599689
bond 205 203 4.5 1.1598889
bond 203 204 4.5 1.1599689
angle 202 200 201 50.0 3.1414599
angle 205 203 204 50.0 3.1414599
