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Text File  |  1996-09-01  |  4.0 KB  |  150 lines
  1. "8  4    35.00   48.04500   51.95500  [itraj,v,angle,Evib,Etrans]"                    
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  3.  
  4.  
  5.  
  6. 0                    
  7. 24                    
  8. 6.979    0    0.957    0.67    -0.051    -0.036
  9. 6.766    0    1.012    0.709    -0.054    -0.038
  10. 6.553    0    1.016    0.711    -0.054    -0.038
  11. 6.34    0    0.967    0.677    -0.051    -0.036
  12. 6.127    0    0.866    0.606    -0.046    -0.032
  13. 5.914    0    0.719    0.504    -0.038    -0.027
  14. 5.702    0    0.579    0.405    -0.031    -0.022
  15. 5.489    0    0.573    0.401    -0.03    -0.021
  16. 5.276    0    0.709    0.496    -0.038    -0.026
  17. 5.063    0    0.858    0.601    -0.045    -0.032
  18. 4.85    0    0.962    0.674    -0.051    -0.036
  19. 4.637    0    1.014    0.71    -0.054    -0.038
  20. 4.425    0    1.014    0.71    -0.054    -0.038
  21. 4.212    0    0.962    0.674    -0.051    -0.036
  22. 3.999    0    0.857    0.6    -0.045    -0.032
  23. 3.787    0    0.708    0.496    -0.038    -0.026
  24. 3.574    0    0.572    0.402    -0.03    -0.021
  25. 3.362    0    0.579    0.407    -0.031    -0.022
  26. 3.15    -0.001    0.719    0.506    -0.038    -0.027
  27. 2.939    -0.001    0.864    0.61    -0.046    -0.032
  28. 2.729    -0.001    0.964    0.682    -0.051    -0.036
  29. 2.519    -0.002    1.012    0.717    -0.054    -0.038
  30. 2.311    -0.002    1.01    0.717    -0.054    -0.038
  31. 2.103    -0.001    0.963    0.683    -0.051    -0.036
  32. 1.899    0.001    0.873    0.615    -0.046    -0.033
  33. 1.705    0.002    0.741    0.52    -0.039    -0.028
  34. 1.537    -0.004    0.597    0.43    -0.032    -0.023
  35. 1.411    -0.02    0.537    0.429    -0.029    -0.023
  36. 1.343    -0.055    0.598    0.561    -0.032    -0.03
  37. 1.335    -0.113    0.672    0.747    -0.036    -0.04
  38. 1.37    -0.195    0.702    0.92    -0.037    -0.049
  39. 1.425    -0.298    0.684    1.063    -0.036    -0.056
  40. 1.479    -0.414    0.629    1.173    -0.033    -0.062
  41. 1.523    -0.536    0.546    1.25    -0.029    -0.066
  42. 1.558    -0.659    0.441    1.288    -0.023    -0.068
  43. 1.585    -0.782    0.318    1.282    -0.017    -0.068
  44. 1.608    -0.905    0.18    1.226    -0.01    -0.065
  45. 1.629    -1.027    0.033    1.11    -0.002    -0.059
  46. 1.65    -1.15    -0.116    0.936    0.006    -0.05
  47. 1.672    -1.273    -0.264    0.735    0.014    -0.039
  48. 1.694    -1.397    -0.441    0.599    0.023    -0.032
  49. 1.717    -1.522    -0.677    0.549    0.036    -0.029
  50. 1.74    -1.647    -0.916    0.505    0.049    -0.027
  51. 1.764    -1.772    -1.108    0.436    0.059    -0.023
  52. 1.788    -1.897    -1.241    0.344    0.066    -0.018
  53. 1.812    -2.022    -1.315    0.235    0.07    -0.012
  54. 1.835    -2.148    -1.332    0.116    0.071    -0.006
  55. 1.859    -2.273    -1.291    -0.008    0.069    0
  56. 1.883    -2.398    -1.19    -0.131    0.063    0.007
  57. 1.907    -2.524    -1.025    -0.248    0.054    0.013
  58. 1.931    -2.649    -0.806    -0.351    0.043    0.019
  59. 1.956    -2.775    -0.589    -0.459    0.031    0.024
  60. 1.98    -2.901    -0.449    -0.632    0.024    0.034
  61. 2.004    -3.027    -0.357    -0.863    0.019    0.046
  62. 2.029    -3.152    -0.258    -1.072    0.014    0.057
  63. 2.053    -3.278    -0.145    -1.222    0.008    0.065
  64. 2.078    -3.404    -0.025    -1.309    0.001    0.069
  65. 2.103    -3.531    0.097    -1.337    -0.005    0.071
  66. 2.127    -3.657    0.214    -1.306    -0.011    0.069
  67. 2.152    -3.783    0.322    -1.217    -0.017    0.065
  68. 2.177    -3.91    0.413    -1.068    -0.022    0.057
  69. 2.202    -4.037    0.482    -0.86    -0.026    0.046
  70. 2.227    -4.163    0.531    -0.616    -0.028    0.033
  71. 2.252    -4.29    0.614    -0.402    -0.033    0.021
  72. 2.278    -4.416    0.792    -0.252    -0.042    0.013
  73. 2.303    -4.543    0.998    -0.115    -0.053    0.006
  74. 2.328    -4.67    1.16    0.026    -0.062    -0.001
  75. 2.353    -4.797    1.258    0.165    -0.067    -0.009
  76. 2.378    -4.923    1.294    0.297    -0.069    -0.016
  77. 2.403    -5.05    1.274    0.415    -0.068    -0.022
  78. 2.428    -5.177    1.198    0.516    -0.064    -0.027
  79. 2.453    -5.303    1.067    0.593    -0.057    -0.031
  80. 2.478    -5.43    0.881    0.638    -0.047    -0.034
  81. 2.503    -5.557    0.647    0.649    -0.034    -0.034
  82. 2.528    -5.684    0.399    0.651    -0.021    -0.035
  83. 2.554    -5.81    0.193    0.728    -0.01    -0.039
  84. 2.579    -5.937    0.014    0.896    -0.001    -0.048
  85. 2.604    -6.064    -0.161    1.058    0.009    -0.056
  86. 2.629    -6.19    -0.328    1.163    0.017    -0.062
  87. 2.654    -6.317    -0.477    1.207    0.025    -0.064
  88. 2.679    -6.444    -0.604    1.194    0.032    -0.063
  89. 2.704    -6.57    -0.705    1.13    0.037    -0.06
  90. 2.729    -6.697    -0.775    1.016    0.041    -0.054
  91. 2.754    -6.824    -0.808    0.853    0.043    -0.045
  92. 2.779    -6.951    -0.797    0.644    0.042    -0.034
  93. 2.804    -7.077    -0.747    0.403    0.04    -0.021
  94. 2.83    -7.204    -0.717    0.168    0.038    -0.009
  95. 2.855    -7.331    -0.796    -0.043    0.042    0.002
  96. 2.88    -7.457    -0.932    -0.252    0.049    0.013
  97. 2.905    -7.584    -1.035    -0.451    0.055    0.024
  98. 2.93    -7.711    -1.081    -0.625    0.057    0.033
  99. 2.955    -7.838    -1.073    -0.767    0.057    0.041
  100. 2.98    -7.964    -1.016    -0.876    0.054    0.046
  101. 3.005    -8.091    -0.916    -0.946    0.049    0.05
  102. 3.03    -8.218    -0.774    -0.974    0.041    0.052
  103. 3.055    -8.344    -0.593    -0.952    0.031    0.051
  104. 3.08    -8.471    -0.38    -0.878    0.02    0.047
  105. 3.106    -8.598    -0.152    -0.775    0.008    0.041
  106. 3.131    -8.725    0.068    -0.736    -0.004    0.039
  107. 3.156    -8.851    0.297    -0.805    -0.016    0.043
  108. 3.181    -8.978    0.526    -0.889    -0.028    0.047
  109. 3.206    -9.105    0.729    -0.929    -0.039    0.049
  110. 3.231    -9.231    0.893    -0.919    -0.047    0.049
  111. 3.256    -9.358    1.014    -0.865    -0.054    0.046
  112. 3.281    -9.485    1.091    -0.774    -0.058    0.041
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