home *** CD-ROM | disk | FTP | other *** search
/ Great Canadian Scientists / GCS_CD.iso / mac / PC / GCSData / atomdata.cxt / 00046_4-25.txt < prev    next >
Encoding:
Text File  |  1996-09-01  |  2.8 KB  |  150 lines
  1. "6  4    25.00   48.04500   51.95500  [itraj,v,angle,Evib,Etrans]"                    
  2.  
  3.  
  4.  
  5.  
  6. 0                    
  7. 24                    
  8. 6.979    0    1.059    0.494    -0.056    -0.026
  9. 6.766    0    1.12    0.522    -0.059    -0.028
  10. 6.553    0    1.124    0.524    -0.06    -0.028
  11. 6.34    0    1.07    0.499    -0.057    -0.026
  12. 6.127    0    0.958    0.447    -0.051    -0.024
  13. 5.914    0    0.796    0.371    -0.042    -0.02
  14. 5.702    0    0.641    0.299    -0.034    -0.016
  15. 5.489    0    0.634    0.296    -0.034    -0.016
  16. 5.276    0    0.784    0.366    -0.042    -0.019
  17. 5.063    0    0.949    0.443    -0.05    -0.023
  18. 4.85    0    1.065    0.497    -0.056    -0.026
  19. 4.637    0    1.122    0.523    -0.06    -0.028
  20. 4.425    0    1.122    0.523    -0.06    -0.028
  21. 4.212    0    1.064    0.496    -0.056    -0.026
  22. 3.999    0    0.948    0.442    -0.05    -0.023
  23. 3.787    0    0.783    0.366    -0.042    -0.019
  24. 3.575    0    0.633    0.296    -0.034    -0.016
  25. 3.363    0    0.641    0.3    -0.034    -0.016
  26. 3.151    0    0.796    0.374    -0.042    -0.02
  27. 2.94    -0.001    0.957    0.45    -0.051    -0.024
  28. 2.73    -0.001    1.068    0.504    -0.057    -0.027
  29. 2.521    -0.002    1.122    0.531    -0.06    -0.028
  30. 2.31    -0.001    1.128    0.532    -0.06    -0.028
  31. 2.095    0.004    1.097    0.509    -0.058    -0.027
  32. 1.875    0.015    1.041    0.463    -0.055    -0.025
  33. 1.661    0.029    0.965    0.404    -0.051    -0.021
  34. 1.484    0.035    0.866    0.348    -0.046    -0.018
  35. 1.39    0.016    0.739    0.323    -0.039    -0.017
  36. 1.398    -0.032    0.626    0.357    -0.033    -0.019
  37. 1.482    -0.103    0.6    0.485    -0.032    -0.026
  38. 1.609    -0.19    0.621    0.678    -0.033    -0.036
  39. 1.756    -0.286    0.624    0.864    -0.033    -0.046
  40. 1.912    -0.387    0.59    1.006    -0.031    -0.053
  41. 2.071    -0.49    0.521    1.096    -0.028    -0.058
  42. 2.232    -0.595    0.424    1.128    -0.022    -0.06
  43. 2.393    -0.7    0.304    1.1    -0.016    -0.058
  44. 2.555    -0.805    0.166    1.011    -0.009    -0.054
  45. 2.718    -0.91    0.02    0.871    -0.001    -0.046
  46. 2.88    -1.016    -0.129    0.738    0.007    -0.039
  47. 3.043    -1.122    -0.298    0.704    0.016    -0.037
  48. 3.206    -1.227    -0.497    0.751    0.026    -0.04
  49. 3.369    -1.333    -0.69    0.791    0.037    -0.042
  50. 3.532    -1.439    -0.846    0.789    0.045    -0.042
  51. 3.695    -1.544    -0.955    0.744    0.051    -0.039
  52. 3.858    -1.65    -1.013    0.659    0.054    -0.035
  53. 4.021    -1.756    -1.017    0.539    0.054    -0.029
  54. 4.184    -1.861    -0.965    0.389    0.051    -0.021
  55. 4.347    -1.967    -0.862    0.218    0.046    -0.012
  56. 4.51    -2.073    -0.757    0.045    0.04    -0.002
  57. 4.673    -2.179    -0.743    -0.127    0.039    0.007
  58. 4.836    -2.284    -0.825    -0.312    0.044    0.017
  59. 4.999    -2.39    -0.908    -0.494    0.048    0.026
  60. 5.162    -2.496    -0.945    -0.651    0.05    0.035
  61. 5.325    -2.601    -0.928    -0.771    0.049    0.041
  62. 5.488    -2.707    -0.862    -0.85    0.046    0.045
  63. 5.651    -2.813    -0.751    -0.885    0.04    0.047
  64. 5.814    -2.919    -0.598    -0.87    0.032    0.046
  65. 5.977    -3.024    -0.412    -0.808    0.022    0.043
  66. 6.14    -3.13    -0.219    -0.736    0.012    0.039
  67. 6.303    -3.236    -0.046    -0.745    0.002    0.04
  68. 6.466    -3.341    0.117    -0.857    -0.006    0.045
  69. 6.629    -3.447    0.28    -0.979    -0.015    0.052
  70. 6.792    -3.553    0.428    -1.053    -0.023    0.056
  71. 6.955    -3.658    0.553    -1.068    -0.029    0.057
  72. 7.118    -3.764    0.647    -1.026    -0.034    0.054
  73. 7.281    -3.87    0.708    -0.93    -0.038    0.049
  74. 7.444    -3.976    0.729    -0.783    -0.039    0.042
  75. 7.607    -4.081    0.711    -0.592    -0.038    0.031
  76. 7.77    -4.187    0.678    -0.387    -0.036    0.021
  77. 7.933    -4.293    0.709    -0.215    -0.038    0.011
  78. 8.095    -4.398    0.844    -0.076    -0.045    0.004
  79. 8.258    -4.504    1    0.059    -0.053    -0.003
  80. 8.421    -4.61    1.11    0.189    -0.059    -0.01
  81. 8.584    -4.715    1.157    0.31    -0.061    -0.016
  82.  
  83.  
  84.  
  85.  
  86.  
  87.  
  88.  
  89.  
  90.  
  91.  
  92.  
  93.  
  94.  
  95.  
  96.  
  97.  
  98.  
  99.  
  100.  
  101.  
  102.  
  103.  
  104.  
  105.  
  106.  
  107.  
  108.  
  109.  
  110.  
  111.  
  112.  
  113.  
  114.  
  115.  
  116.  
  117.  
  118.  
  119.  
  120.  
  121.  
  122.  
  123.  
  124.  
  125.  
  126.  
  127.  
  128.  
  129.  
  130.  
  131.  
  132.  
  133.  
  134.  
  135.  
  136.  
  137.  
  138.  
  139.  
  140.  
  141.  
  142.  
  143.  
  144.  
  145.  
  146.  
  147.  
  148.  
  149.  
  150.