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Text File  |  1996-09-01  |  2.4 KB  |  150 lines
  1. "  9  2    40.00   27.92800   72.07200  [itraj,v,angle,Evib,Etrans]"                    
  2.  
  3.  
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  5.  
  6. 2                    
  7. 23                    
  8. 6.975    0    0.818    0.687    -0.043    -0.036
  9. 6.724    0    0.858    0.72    -0.046    -0.038
  10. 6.473    0    0.848    0.712    -0.045    -0.038
  11. 6.223    0    0.791    0.664    -0.042    -0.035
  12. 5.972    0    0.692    0.581    -0.037    -0.031
  13. 5.721    0    0.585    0.491    -0.031    -0.026
  14. 5.471    0    0.549    0.461    -0.029    -0.024
  15. 5.22    0    0.623    0.522    -0.033    -0.028
  16. 4.969    0    0.733    0.615    -0.039    -0.033
  17. 4.719    0    0.818    0.687    -0.043    -0.036
  18. 4.468    0    0.858    0.72    -0.045    -0.038
  19. 4.217    0    0.848    0.712    -0.045    -0.038
  20. 3.967    0    0.791    0.664    -0.042    -0.035
  21. 3.716    0    0.692    0.581    -0.037    -0.031
  22. 3.466    0    0.585    0.491    -0.031    -0.026
  23. 3.216    0    0.548    0.461    -0.029    -0.024
  24. 2.966    0    0.621    0.524    -0.033    -0.028
  25. 2.717    -0.001    0.731    0.618    -0.039    -0.033
  26. 2.47    -0.001    0.814    0.691    -0.043    -0.037
  27. 2.224    -0.003    0.852    0.726    -0.045    -0.039
  28. 1.983    -0.004    0.842    0.722    -0.045    -0.038
  29. 1.749    -0.007    0.786    0.681    -0.042    -0.036
  30. 1.533    -0.014    0.69    0.613    -0.037    -0.032
  31. 1.354    -0.032    0.568    0.545    -0.03    -0.029
  32. 1.234    -0.073    0.472    0.548    -0.025    -0.029
  33. 1.186    -0.144    0.432    0.678    -0.023    -0.036
  34. 1.192    -0.246    0.402    0.88    -0.021    -0.047
  35. 1.215    -0.368    0.35    1.079    -0.019    -0.057
  36. 1.224    -0.497    0.279    1.255    -0.015    -0.067
  37. 1.2    -0.62    0.196    1.408    -0.01    -0.075
  38. 1.133    -0.726    0.106    1.549    -0.006    -0.082
  39. 1.015    -0.805    0.013    1.685    -0.001    -0.089
  40. 0.845    -0.848    -0.084    1.82    0.004    -0.097
  41. 0.631    -0.851    -0.183    1.957    0.01    -0.104
  42. 0.402    -0.84    -0.282    2.096    0.015    -0.111
  43. 0.202    -0.893    -0.38    2.232    0.02    -0.118
  44. 0.026    -1.039    -0.478    2.364    0.025    -0.125
  45. -0.146    -1.193    -0.575    2.496    0.03    -0.132
  46. -0.309    -1.295    -0.671    2.63    0.036    -0.14
  47. -0.453    -1.332    -0.767    2.768    0.041    -0.147
  48. -0.572    -1.308    -0.862    2.909    0.046    -0.154
  49. -0.658    -1.224    -0.955    3.053    0.051    -0.162
  50. -0.708    -1.085    -1.046    3.199    0.055    -0.17
  51. -0.715    -0.895    -1.135    3.348    0.06    -0.178
  52. -0.686    -0.671    -1.223    3.498    0.065    -0.186
  53. -0.676    -0.455    -1.311    3.648    0.07    -0.194
  54. -0.762    -0.271    -1.404    3.797    0.074    -0.201
  55. -0.906    -0.096    -1.5    3.945    0.08    -0.209
  56. -1.021    0.074    -1.595    4.093    0.085    -0.217
  57. -1.076    0.228    -1.686    4.241    0.089    -0.225
  58. -1.067    0.358    -1.775    4.387    0.094    -0.233
  59. -0.998    0.457    -1.86    4.531    0.099    -0.24
  60. -0.874    0.52    -1.943    4.674    0.103    -0.248
  61. -0.696    0.542    -2.024    4.815    0.107    -0.255
  62. -0.474    0.52    -2.102    4.954    0.112    -0.263
  63. -0.237    0.48    -2.18    5.092    0.116    -0.27
  64. -0.024    0.503    -2.258    5.233    0.12    -0.278
  65. 0.168    0.622    -2.338    5.379    0.124    -0.285
  66. 0.358    0.752    -2.418    5.525    0.128    -0.293
  67. 0.536    0.831    -2.498    5.669    0.133    -0.301
  68. 0.692    0.848    -2.58    5.81    0.137    -0.308
  69. 0.818    0.804    -2.663    5.948    0.141    -0.316
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