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Text File  |  1996-09-01  |  2.5 KB  |  150 lines
  1. "  6  2    25.00   27.92800   72.07200  [itraj,v,angle,Evib,Etrans]"                    
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  6. 0                    
  7. 23                    
  8. 6.975    0    0.968    0.451    -0.051    -0.024
  9. 6.724    0    1.015    0.473    -0.054    -0.025
  10. 6.473    0    1.004    0.468    -0.053    -0.025
  11. 6.223    0    0.936    0.436    -0.05    -0.023
  12. 5.972    0    0.819    0.382    -0.043    -0.02
  13. 5.721    0    0.692    0.323    -0.037    -0.017
  14. 5.471    0    0.649    0.303    -0.034    -0.016
  15. 5.22    0    0.737    0.344    -0.039    -0.018
  16. 4.969    0    0.868    0.405    -0.046    -0.021
  17. 4.719    0    0.968    0.451    -0.051    -0.024
  18. 4.468    0    1.015    0.473    -0.054    -0.025
  19. 4.217    0    1.004    0.468    -0.053    -0.025
  20. 3.967    0    0.935    0.436    -0.05    -0.023
  21. 3.717    0    0.819    0.382    -0.043    -0.02
  22. 3.467    0    0.692    0.323    -0.037    -0.017
  23. 3.217    0    0.649    0.304    -0.034    -0.016
  24. 2.967    0    0.736    0.345    -0.039    -0.018
  25. 2.719    -0.001    0.866    0.408    -0.046    -0.022
  26. 2.472    -0.001    0.965    0.456    -0.051    -0.024
  27. 2.228    -0.002    1.012    0.48    -0.054    -0.025
  28. 1.986    -0.002    1.011    0.481    -0.054    -0.026
  29. 1.749    0    0.976    0.461    -0.052    -0.024
  30. 1.53    0.001    0.917    0.432    -0.049    -0.023
  31. 1.365    -0.016    0.834    0.418    -0.044    -0.022
  32. 1.29    -0.071    0.727    0.446    -0.039    -0.024
  33. 1.307    -0.167    0.61    0.527    -0.032    -0.028
  34. 1.386    -0.294    0.504    0.664    -0.027    -0.035
  35. 1.492    -0.438    0.404    0.831    -0.021    -0.044
  36. 1.607    -0.588    0.289    0.982    -0.015    -0.052
  37. 1.726    -0.742    0.158    1.087    -0.008    -0.058
  38. 1.846    -0.897    0.018    1.131    -0.001    -0.06
  39. 1.965    -1.052    -0.124    1.113    0.007    -0.059
  40. 2.086    -1.207    -0.259    1.032    0.014    -0.055
  41. 2.206    -1.362    -0.38    0.894    0.02    -0.047
  42. 2.326    -1.518    -0.485    0.718    0.026    -0.038
  43. 2.447    -1.674    -0.595    0.544    0.032    -0.029
  44. 2.568    -1.829    -0.735    0.399    0.039    -0.021
  45. 2.689    -1.985    -0.894    0.265    0.047    -0.014
  46. 2.81    -2.141    -1.026    0.124    0.054    -0.007
  47. 2.931    -2.297    -1.104    -0.023    0.059    0.001
  48. 3.052    -2.453    -1.119    -0.168    0.059    0.009
  49. 3.173    -2.609    -1.071    -0.304    0.057    0.016
  50. 3.294    -2.765    -0.962    -0.423    0.051    0.022
  51. 3.415    -2.921    -0.8    -0.519    0.042    0.028
  52. 3.536    -3.077    -0.609    -0.596    0.032    0.032
  53. 3.657    -3.232    -0.424    -0.684    0.022    0.036
  54. 3.778    -3.388    -0.263    -0.808    0.014    0.043
  55. 3.899    -3.544    -0.107    -0.944    0.006    0.05
  56. 4.02    -3.7    0.051    -1.047    -0.003    0.056
  57. 4.141    -3.856    0.207    -1.092    -0.011    0.058
  58. 4.262    -4.012    0.35    -1.076    -0.019    0.057
  59. 4.383    -4.168    0.474    -0.999    -0.025    0.053
  60. 4.504    -4.324    0.571    -0.865    -0.03    0.046
  61. 4.625    -4.48    0.638    -0.685    -0.034    0.036
  62. 4.746    -4.636    0.686    -0.483    -0.036    0.026
  63. 4.867    -4.792    0.751    -0.291    -0.04    0.015
  64. 4.988    -4.948    0.857    -0.115    -0.045    0.006
  65. 5.109    -5.104    0.966    0.059    -0.051    -0.003
  66. 5.23    -5.26    1.036    0.229    -0.055    -0.012
  67. 5.351    -5.416    1.049    0.387    -0.056    -0.021
  68. 5.472    -5.572    1.003    0.522    -0.053    -0.028
  69. 5.593    -5.728    0.899    0.628    -0.048    -0.033
  70. 5.714    -5.883    0.745    0.698    -0.04    -0.037
  71. 5.835    -6.039    0.552    0.733    -0.029    -0.039
  72. 5.956    -6.195    0.345    0.752    -0.018    -0.04
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