0 mol 24 unq 0 iso 0 dist 6.80849 13.9888 8.86116 16.8105 10.0952 6.86014 16.2863 10.4452 9.20254 6.85331 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 9.17862 15.821 7.27724 15.8862 8.41707 8.03644 20.0521 15.3713 15.4217 8.26838 numMergedOcc 0
2 mol 95 unq 1 iso 0 dist 8.27456 9.7565 7.27724 15.5421 8.41707 8.03644 22.459 15.3713 15.4217 8.26838 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 5.11612 10.3475 9.33865 11.7895 8.02349 6.11741 14.4097 12.7842 9.97256 9.56867 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 5.11612 6.86762 5.83991 12.9567 10.8507 7.30858 14.4097 12.7842 7.64822 7.44784 numMergedOcc 0
5 mol 115 unq 2 iso 0 dist 5.11612 6.86762 5.83991 11.7895 8.02349 7.88312 14.4097 12.7842 7.64822 9.56867 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.53153 5.78974 9.91388 8.29673 6.761 7.24514 10.0451 12.6562 5.38237 7.15203 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 6.29975 5.78974 9.52634 6.53153 6.69554 9.91388 7.75063 13.5771 8.96845 9.89098 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 6.29975 5.78974 9.52634 8.29673 7.6656 7.24514 10.0451 10.7939 5.38237 7.15203 numMergedOcc 0
9 mol 133 unq 3 iso 0 dist 8.29673 5.78974 7.24514 6.53153 6.761 9.91388 7.75063 12.2343 8.96845 9.89098 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 7.94593 13.2723 9.0018 12.5882 6.2715 5.6234 16.5873 12.3723 5.73338 6.73365 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 7.94593 13.2723 9.0018 15.3964 8.16421 6.57069 16.5873 12.3723 5.73338 9.45659 numMergedOcc 0
12 mol 175 unq 2 iso 0 dist 7.94593 8.63795 7.652 12.5882 6.2715 9.92231 16.5873 12.3723 12.753 6.73365 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 7.15963 6.73556 5.98885 11.5431 10.1912 9.09537 6.65871 11.44 9.54619 9.07833 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 6.43406 10.9813 7.81386 13.9818 8.85576 7.63312 14.6346 13.3844 12.5935 9.63295 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 7.94694 5.1071 7.7366 7.51923 5.63422 9.774 8.96746 11.1422 13.609 7.10166 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 7.94694 5.1071 7.7366 7.51923 5.63422 9.774 13.4727 10.4092 12.0196 9.66896 numMergedOcc 0
17 mol 206 unq 2 iso 0 dist 7.51923 5.1071 9.774 7.94694 5.63422 7.7366 6.51093 11.7176 6.35321 8.73396 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 5.99137 13.7629 9.81562 11.0371 7.28249 8.03456 11.7831 6.36941 8.3919 9.97357 numMergedOcc 0
19 mol 236 unq 1 iso 0 dist 5.99137 13.3575 7.68742 11.0371 7.28249 6.84306 11.7831 6.36941 4.88785 9.97357 numMergedOcc 0
20 mol 236 unq 2 iso 0 dist 5.99137 5.03598 6.27581 11.0371 7.28249 9.99038 11.7831 6.36941 10.2557 9.97357 numMergedOcc 0
21 mol 261 unq 0 iso 0 dist 6.85589 4.31412 8.43057 10.2299 10.0727 8.02547 8.9397 13.1629 6.5875 7.15785 numMergedOcc 0
22 mol 261 unq 1 iso 0 dist 6.85589 4.31412 8.43057 6.68878 4.63549 6.05727 8.9397 13.1629 6.5875 9.43169 numMergedOcc 0
23 mol 261 unq 2 iso 0 dist 6.68878 4.31412 6.05727 10.2299 5.51688 8.02547 8.9397 9.43169 6.5875 7.15785 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 7.34596 4.36798 8.76532 10.5849 10.0156 8.04483 10.3431 14.7737 8.13794 8.58671 numMergedOcc 0
25 mol 282 unq 1 iso 0 dist 7.34596 4.36798 8.76532 7.12228 4.66602 6.33524 5.5267 6.84554 9.67023 9.51581 numMergedOcc 0
26 mol 282 unq 2 iso 0 dist 7.12228 4.36798 6.33524 10.5849 5.39891 8.04483 10.3431 11.0247 8.13794 8.58671 numMergedOcc 0
27 mol 282 unq 3 iso 0 dist 7.12228 4.36798 6.33524 7.34596 4.66602 8.76532 5.5267 9.51581 9.67023 6.84554 numMergedOcc 0
