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Text File  |  1996-09-01  |  3.2 KB  |  150 lines
  1. "2  4     5.00   48.04500   51.95500  [itraj,v,angle,Evib,Etrans]"                    
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  6. 0                    
  7. 24                    
  8. 6.979    0    1.164    0.102    -0.062    -0.005
  9. 6.766    0    1.231    0.108    -0.065    -0.006
  10. 6.553    0    1.235    0.108    -0.066    -0.006
  11. 6.34    0    1.176    0.103    -0.062    -0.005
  12. 6.127    0    1.053    0.092    -0.056    -0.005
  13. 5.914    0    0.875    0.077    -0.046    -0.004
  14. 5.702    0    0.704    0.062    -0.037    -0.003
  15. 5.489    0    0.697    0.061    -0.037    -0.003
  16. 5.276    0    0.862    0.075    -0.046    -0.004
  17. 5.063    0    1.043    0.091    -0.055    -0.005
  18. 4.85    0    1.17    0.102    -0.062    -0.005
  19. 4.637    0    1.233    0.108    -0.065    -0.006
  20. 4.425    0    1.233    0.108    -0.065    -0.006
  21. 4.212    0    1.17    0.102    -0.062    -0.005
  22. 4    0    1.042    0.091    -0.055    -0.005
  23. 3.787    0    0.86    0.075    -0.046    -0.004
  24. 3.575    0    0.696    0.061    -0.037    -0.003
  25. 3.364    0    0.705    0.062    -0.037    -0.003
  26. 3.152    0    0.876    0.077    -0.046    -0.004
  27. 2.941    0    1.054    0.093    -0.056    -0.005
  28. 2.732    0    1.176    0.104    -0.062    -0.006
  29. 2.522    0    1.241    0.11    -0.066    -0.006
  30. 2.303    0.001    1.269    0.111    -0.067    -0.006
  31. 2.068    0.004    1.288    0.107    -0.068    -0.006
  32. 1.844    0.006    1.295    0.104    -0.069    -0.006
  33. 1.735    -0.012    1.21    0.119    -0.064    -0.006
  34. 1.756    -0.059    1.023    0.162    -0.054    -0.009
  35. 1.826    -0.117    0.803    0.212    -0.043    -0.011
  36. 1.919    -0.179    0.619    0.283    -0.033    -0.015
  37. 2.025    -0.245    0.603    0.441    -0.032    -0.023
  38. 2.139    -0.314    0.682    0.665    -0.036    -0.035
  39. 2.256    -0.384    0.741    0.871    -0.039    -0.046
  40. 2.375    -0.455    0.758    1.03    -0.04    -0.055
  41. 2.496    -0.527    0.739    1.14    -0.039    -0.06
  42. 2.618    -0.599    0.688    1.203    -0.036    -0.064
  43. 2.74    -0.672    0.61    1.219    -0.032    -0.065
  44. 2.862    -0.744    0.506    1.185    -0.027    -0.063
  45. 2.984    -0.817    0.379    1.095    -0.02    -0.058
  46. 3.107    -0.89    0.231    0.945    -0.012    -0.05
  47. 3.23    -0.963    0.074    0.763    -0.004    -0.04
  48. 3.353    -1.036    -0.081    0.677    0.004    -0.036
  49. 3.476    -1.11    -0.255    0.78    0.014    -0.041
  50. 3.599    -1.183    -0.441    0.93    0.023    -0.049
  51. 3.722    -1.256    -0.605    1.037    0.032    -0.055
  52. 3.844    -1.329    -0.737    1.089    0.039    -0.058
  53. 3.967    -1.402    -0.836    1.092    0.044    -0.058
  54. 4.09    -1.475    -0.901    1.05    0.048    -0.056
  55. 4.213    -1.548    -0.93    0.967    0.049    -0.051
  56. 4.336    -1.621    -0.919    0.842    0.049    -0.045
  57. 4.459    -1.695    -0.862    0.675    0.046    -0.036
  58. 4.582    -1.768    -0.759    0.472    0.04    -0.025
  59. 4.705    -1.841    -0.657    0.266    0.035    -0.014
  60. 4.828    -1.914    -0.703    0.114    0.037    -0.006
  61. 4.951    -1.987    -0.899    -0.008    0.048    0
  62. 5.074    -2.06    -1.093    -0.127    0.058    0.007
  63. 5.197    -2.134    -1.227    -0.239    0.065    0.013
  64. 5.32    -2.207    -1.3    -0.339    0.069    0.018
  65. 5.443    -2.28    -1.317    -0.425    0.07    0.023
  66. 5.566    -2.353    -1.282    -0.494    0.068    0.026
  67. 5.689    -2.426    -1.195    -0.543    0.063    0.029
  68. 5.812    -2.499    -1.054    -0.567    0.056    0.03
  69. 5.935    -2.572    -0.857    -0.561    0.045    0.03
  70. 6.058    -2.646    -0.62    -0.529    0.033    0.028
  71. 6.181    -2.719    -0.419    -0.536    0.022    0.028
  72. 6.304    -2.792    -0.336    -0.694    0.018    0.037
  73. 6.427    -2.865    -0.297    -0.932    0.016    0.049
  74. 6.55    -2.938    -0.249    -1.136    0.013    0.06
  75. 6.673    -3.011    -0.187    -1.278    0.01    0.068
  76. 6.796    -3.084    -0.116    -1.36    0.006    0.072
  77. 6.919    -3.158    -0.041    -1.385    0.002    0.073
  78. 7.042    -3.231    0.036    -1.357    -0.002    0.072
  79. 7.165    -3.304    0.112    -1.271    -0.006    0.067
  80. 7.288    -3.377    0.182    -1.124    -0.01    0.06
  81. 7.411    -3.45    0.242    -0.916    -0.013    0.049
  82. 7.534    -3.523    0.298    -0.683    -0.016    0.036
  83. 7.657    -3.597    0.406    -0.556    -0.022    0.029
  84. 7.78    -3.67    0.618    -0.577    -0.033    0.031
  85. 7.903    -3.743    0.85    -0.623    -0.045    0.033
  86. 8.026    -3.816    1.038    -0.636    -0.055    0.034
  87. 8.149    -3.889    1.173    -0.617    -0.062    0.033
  88. 8.272    -3.962    1.255    -0.57    -0.067    0.03
  89. 8.395    -4.035    1.287    -0.501    -0.068    0.027
  90. 8.518    -4.109    1.268    -0.411    -0.067    0.022
  91. 8.641    -4.182    1.193    -0.303    -0.063    0.016
  92. 8.764    -4.255    1.057    -0.18    -0.056    0.01
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