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- " 6 1 25.00 17.12700 82.87300 [itraj,v,angle,Evib,Etrans]"
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- 24
- 6.973 0 0.918 0.428 -0.049 -0.023
- 6.704 0 0.954 0.445 -0.051 -0.024
- 6.435 0 0.938 0.437 -0.05 -0.023
- 6.167 0 0.871 0.406 -0.046 -0.022
- 5.898 0 0.771 0.36 -0.041 -0.019
- 5.629 0 0.686 0.32 -0.036 -0.017
- 5.36 0 0.688 0.321 -0.036 -0.017
- 5.091 0 0.774 0.361 -0.041 -0.019
- 4.822 0 0.873 0.407 -0.046 -0.022
- 4.554 0 0.939 0.438 -0.05 -0.023
- 4.285 0 0.954 0.445 -0.051 -0.024
- 4.016 0 0.916 0.428 -0.049 -0.023
- 3.748 0 0.833 0.389 -0.044 -0.021
- 3.479 0 0.73 0.341 -0.039 -0.018
- 3.211 0 0.673 0.315 -0.036 -0.017
- 2.944 0 0.715 0.335 -0.038 -0.018
- 2.677 -0.001 0.814 0.383 -0.043 -0.02
- 2.413 -0.001 0.902 0.426 -0.048 -0.023
- 2.152 -0.002 0.947 0.451 -0.05 -0.024
- 1.897 -0.004 0.946 0.454 -0.05 -0.024
- 1.654 -0.007 0.908 0.441 -0.048 -0.023
- 1.444 -0.017 0.842 0.427 -0.045 -0.023
- 1.304 -0.052 0.753 0.438 -0.04 -0.023
- 1.258 -0.128 0.648 0.498 -0.034 -0.026
- 1.291 -0.243 0.546 0.617 -0.029 -0.033
- 1.369 -0.385 0.448 0.778 -0.024 -0.041
- 1.464 -0.54 0.337 0.938 -0.018 -0.05
- 1.564 -0.701 0.209 1.061 -0.011 -0.056
- 1.664 -0.863 0.068 1.127 -0.004 -0.06
- 1.765 -1.025 -0.078 1.133 0.004 -0.06
- 1.865 -1.188 -0.219 1.075 0.012 -0.057
- 1.966 -1.351 -0.349 0.957 0.019 -0.051
- 2.067 -1.514 -0.461 0.79 0.024 -0.042
- 2.168 -1.677 -0.564 0.605 0.03 -0.032
- 2.27 -1.841 -0.687 0.439 0.036 -0.023
- 2.371 -2.004 -0.839 0.293 0.045 -0.016
- 2.473 -2.168 -0.982 0.145 0.052 -0.008
- 2.574 -2.331 -1.08 -0.008 0.057 0
- 2.676 -2.495 -1.117 -0.162 0.059 0.009
- 2.778 -2.659 -1.091 -0.305 0.058 0.016
- 2.879 -2.822 -1.003 -0.432 0.053 0.023
- 2.981 -2.986 -0.858 -0.534 0.045 0.028
- 3.083 -3.15 -0.67 -0.61 0.036 0.032
- 3.184 -3.313 -0.469 -0.676 0.025 0.036
- 3.286 -3.477 -0.284 -0.768 0.015 0.041
- 3.388 -3.641 -0.111 -0.89 0.006 0.047
- 3.49 -3.804 0.061 -0.999 -0.003 0.053
- 3.591 -3.968 0.23 -1.061 -0.012 0.056
- 3.693 -4.132 0.386 -1.063 -0.02 0.056
- 3.795 -4.296 0.52 -1.004 -0.028 0.053
- 3.897 -4.459 0.624 -0.889 -0.033 0.047
- 3.999 -4.623 0.694 -0.723 -0.037 0.038
- 4.1 -4.787 0.73 -0.522 -0.039 0.028
- 4.202 -4.951 0.757 -0.313 -0.04 0.017
- 4.304 -5.114 0.814 -0.114 -0.043 0.006
- 4.406 -5.278 0.902 0.078 -0.048 -0.004
- 4.507 -5.442 0.973 0.268 -0.052 -0.014
- 4.609 -5.606 0.997 0.444 -0.053 -0.024
- 4.711 -5.769 0.964 0.595 -0.051 -0.032
- 4.813 -5.933 0.876 0.712 -0.046 -0.038
- 4.915 -6.097 0.739 0.788 -0.039 -0.042
- 5.016 -6.261 0.56 0.821 -0.03 -0.044
- 5.118 -6.424 0.355 0.815 -0.019 -0.043
- 5.22 -6.588 0.144 0.802 -0.008 -0.043
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