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Text File  |  1996-09-01  |  2.4 KB  |  150 lines
  1. "  5  2    20.00   27.92800   72.07200  [itraj,v,angle,Evib,Etrans]"                    
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  6. 0                    
  7. 23                    
  8. 6.975    0    1.004    0.365    -0.053    -0.019
  9. 6.724    0    1.052    0.383    -0.056    -0.02
  10. 6.473    0    1.041    0.379    -0.055    -0.02
  11. 6.223    0    0.97    0.353    -0.051    -0.019
  12. 5.972    0    0.849    0.309    -0.045    -0.016
  13. 5.721    0    0.718    0.261    -0.038    -0.014
  14. 5.471    0    0.673    0.245    -0.036    -0.013
  15. 5.22    0    0.764    0.278    -0.041    -0.015
  16. 4.969    0    0.9    0.327    -0.048    -0.017
  17. 4.719    0    1.004    0.365    -0.053    -0.019
  18. 4.468    0    1.052    0.383    -0.056    -0.02
  19. 4.217    0    1.041    0.379    -0.055    -0.02
  20. 3.967    0    0.97    0.353    -0.051    -0.019
  21. 3.717    0    0.849    0.309    -0.045    -0.016
  22. 3.467    0    0.717    0.262    -0.038    -0.014
  23. 3.217    0    0.673    0.246    -0.036    -0.013
  24. 2.968    0    0.763    0.28    -0.04    -0.015
  25. 2.719    -0.001    0.898    0.33    -0.048    -0.018
  26. 2.473    -0.001    1.001    0.369    -0.053    -0.02
  27. 2.229    -0.002    1.051    0.39    -0.056    -0.021
  28. 1.986    -0.001    1.056    0.391    -0.056    -0.021
  29. 1.747    0.002    1.034    0.378    -0.055    -0.02
  30. 1.533    -0.001    0.991    0.366    -0.053    -0.019
  31. 1.391    -0.036    0.914    0.385    -0.049    -0.02
  32. 1.341    -0.118    0.805    0.452    -0.043    -0.024
  33. 1.366    -0.234    0.673    0.55    -0.036    -0.029
  34. 1.436    -0.377    0.528    0.67    -0.028    -0.036
  35. 1.527    -0.532    0.38    0.806    -0.02    -0.043
  36. 1.626    -0.694    0.225    0.936    -0.012    -0.05
  37. 1.728    -0.857    0.06    1.03    -0.003    -0.055
  38. 1.83    -1.022    -0.108    1.071    0.006    -0.057
  39. 1.933    -1.187    -0.271    1.052    0.014    -0.056
  40. 2.036    -1.352    -0.418    0.974    0.022    -0.052
  41. 2.139    -1.517    -0.543    0.842    0.029    -0.045
  42. 2.242    -1.682    -0.641    0.668    0.034    -0.035
  43. 2.346    -1.848    -0.721    0.475    0.038    -0.025
  44. 2.449    -2.013    -0.804    0.282    0.043    -0.015
  45. 2.553    -2.179    -0.895    0.093    0.048    -0.005
  46. 2.657    -2.344    -0.971    -0.097    0.052    0.005
  47. 2.761    -2.51    -1.004    -0.282    0.053    0.015
  48. 2.864    -2.676    -0.982    -0.452    0.052    0.024
  49. 2.968    -2.841    -0.905    -0.596    0.048    0.032
  50. 3.072    -3.007    -0.776    -0.706    0.041    0.037
  51. 3.176    -3.173    -0.605    -0.777    0.032    0.041
  52. 3.279    -3.338    -0.406    -0.813    0.022    0.043
  53. 3.383    -3.504    -0.197    -0.832    0.01    0.044
  54. 3.487    -3.67    0.012    -0.858    -0.001    0.046
  55. 3.591    -3.835    0.219    -0.89    -0.012    0.047
  56. 3.695    -4.001    0.42    -0.899    -0.022    0.048
  57. 3.799    -4.167    0.601    -0.866    -0.032    0.046
  58. 3.902    -4.333    0.748    -0.785    -0.04    0.042
  59. 4.006    -4.498    0.853    -0.66    -0.045    0.035
  60. 4.11    -4.664    0.91    -0.497    -0.048    0.026
  61. 4.214    -4.83    0.918    -0.308    -0.049    0.016
  62. 4.318    -4.995    0.887    -0.105    -0.047    0.006
  63. 4.422    -5.161    0.844    0.101    -0.045    -0.005
  64. 4.526    -5.327    0.811    0.308    -0.043    -0.016
  65. 4.629    -5.493    0.779    0.515    -0.041    -0.027
  66. 4.733    -5.658    0.722    0.704    -0.038    -0.037
  67. 4.837    -5.824    0.629    0.858    -0.033    -0.046
  68. 4.941    -5.99    0.502    0.964    -0.027    -0.051
  69. 5.045    -6.156    0.345    1.015    -0.018    -0.054
  70. 5.149    -6.321    0.17    1.009    -0.009    -0.054
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