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Text File  |  1996-09-01  |  2.5 KB  |  150 lines
  1. "  9  1    40.00   17.12700   82.87300  [itraj,v,angle,Evib,Etrans]"                    
  2.  
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  6. 2                    
  7. 25                    
  8. 6.973    0    0.776    0.651    -0.041    -0.035
  9. 6.704    0    0.807    0.677    -0.043    -0.036
  10. 6.435    0    0.793    0.665    -0.042    -0.035
  11. 6.167    0    0.736    0.618    -0.039    -0.033
  12. 5.898    0    0.652    0.547    -0.035    -0.029
  13. 5.629    0    0.58    0.487    -0.031    -0.026
  14. 5.36    0    0.581    0.488    -0.031    -0.026
  15. 5.091    0    0.654    0.549    -0.035    -0.029
  16. 4.822    0    0.738    0.62    -0.039    -0.033
  17. 4.554    0    0.794    0.666    -0.042    -0.035
  18. 4.285    0    0.806    0.677    -0.043    -0.036
  19. 4.016    0    0.775    0.65    -0.041    -0.034
  20. 3.748    0    0.704    0.591    -0.037    -0.031
  21. 3.479    0    0.617    0.519    -0.033    -0.028
  22. 3.211    0    0.569    0.479    -0.03    -0.025
  23. 2.943    0    0.604    0.509    -0.032    -0.027
  24. 2.676    -0.001    0.687    0.581    -0.036    -0.031
  25. 2.41    -0.001    0.761    0.646    -0.04    -0.034
  26. 2.147    -0.003    0.798    0.681    -0.042    -0.036
  27. 1.89    -0.005    0.79    0.681    -0.042    -0.036
  28. 1.644    -0.01    0.74    0.65    -0.039    -0.034
  29. 1.424    -0.022    0.652    0.6    -0.035    -0.032
  30. 1.254    -0.053    0.546    0.567    -0.029    -0.03
  31. 1.158    -0.115    0.454    0.611    -0.024    -0.032
  32. 1.134    -0.215    0.388    0.757    -0.021    -0.04
  33. 1.151    -0.344    0.315    0.948    -0.017    -0.05
  34. 1.172    -0.488    0.226    1.131    -0.012    -0.06
  35. 1.173    -0.631    0.124    1.288    -0.007    -0.068
  36. 1.14    -0.761    0.015    1.423    -0.001    -0.075
  37. 1.066    -0.868    -0.098    1.542    0.005    -0.082
  38. 0.947    -0.942    -0.212    1.656    0.011    -0.088
  39. 0.781    -0.974    -0.329    1.767    0.017    -0.094
  40. 0.575    -0.959    -0.448    1.881    0.024    -0.1
  41. 0.346    -0.912    -0.568    1.997    0.03    -0.106
  42. 0.128    -0.902    -0.688    2.111    0.037    -0.112
  43. -0.08    -0.986    -0.807    2.221    0.043    -0.118
  44. -0.287    -1.101    -0.927    2.331    0.049    -0.124
  45. -0.48    -1.175    -1.046    2.442    0.055    -0.13
  46. -0.642    -1.191    -1.163    2.556    0.062    -0.136
  47. -0.768    -1.151    -1.279    2.673    0.068    -0.142
  48. -0.851    -1.06    -1.393    2.793    0.074    -0.148
  49. -0.886    -0.922    -1.504    2.915    0.08    -0.155
  50. -0.868    -0.742    -1.613    3.038    0.086    -0.161
  51. -0.8    -0.531    -1.719    3.164    0.091    -0.168
  52. -0.716    -0.311    -1.825    3.29    0.097    -0.175
  53. -0.701    -0.099    -1.934    3.416    0.103    -0.181
  54. -0.77    0.118    -2.047    3.541    0.109    -0.188
  55. -0.838    0.333    -2.16    3.667    0.115    -0.195
  56. -0.857    0.519    -2.271    3.792    0.12    -0.201
  57. -0.822    0.666    -2.379    3.914    0.126    -0.208
  58. -0.738    0.768    -2.485    4.035    0.132    -0.214
  59. -0.609    0.82    -2.589    4.153    0.137    -0.22
  60. -0.442    0.817    -2.691    4.269    0.143    -0.226
  61. -0.242    0.755    -2.791    4.381    0.148    -0.232
  62. -0.023    0.648    -2.89    4.492    0.153    -0.238
  63. 0.197    0.554    -2.99    4.603    0.159    -0.244
  64. 0.423    0.551    -3.089    4.719    0.164    -0.25
  65. 0.662    0.602    -3.187    4.837    0.169    -0.257
  66. 0.886    0.629    -3.286    4.954    0.174    -0.263
  67. 1.07    0.607    -3.387    5.069    0.18    -0.269
  68. 1.206    0.537    -3.491    5.181    0.185    -0.275
  69. 1.29    0.426    -3.597    5.292    0.191    -0.281
  70. 1.317    0.278    -3.705    5.4    0.197    -0.286
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