0 mol 1 unq 0 iso 0 dist 8.27735 5.27206 9.00903 6.03793 8.56884 9.01967 12.4968 6.44928 12.6791 9.44115 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.27735 5.27206 9.00903 6.03793 8.56884 9.01967 8.40848 6.35409 12.2079 7.90928 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 7.25179 13.7 8.57077 4.75933 6.33889 11.4878 13.4599 11.3797 12.8762 8.77049 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 7.25179 13.7 8.57077 4.75933 6.33889 11.4878 11.3949 11.7623 13.0231 6.95341 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 8.72522 16.5569 8.57077 6.35665 6.33889 11.4878 12.6785 11.3797 12.8762 8.77049 numMergedOcc 0
5 mol 9 unq 3 iso 0 dist 8.72522 16.5569 8.57077 6.35665 6.33889 11.4878 12.0424 11.7623 13.0231 6.95341 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 7.34549 4.76147 8.34347 7.23551 6.73162 7.23546 6.42206 5.3315 6.88695 9.97117 numMergedOcc 0
7 mol 26 unq 1 iso 0 dist 8.09068 6.30129 8.34347 4.03252 6.73162 7.23546 10.1907 5.3315 6.88695 9.97117 numMergedOcc 0
8 mol 26 unq 2 iso 0 dist 9.72289 5.93227 8.34347 8.34836 6.73162 7.23546 9.66602 5.3315 6.88695 9.97117 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 5.22628 10.0419 9.33865 5.26498 7.64585 10.2377 6.12404 5.24961 12.5192 5.58063 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 5.22628 6.8104 6.11741 5.26498 7.64585 10.8939 6.12404 5.24961 10.8398 5.58063 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 7.15963 14.1493 9.1374 9.09192 6.94688 6.25083 13.6065 9.47799 9.86845 8.45395 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 7.15963 14.1493 9.1374 9.09192 6.94688 6.25083 11.4115 9.09989 12.5284 9.15368 numMergedOcc 0
13 mol 181 unq 2 iso 0 dist 7.15963 14.1493 9.1374 9.09192 6.94688 6.25083 8.63713 4.98009 12.0593 9.20477 numMergedOcc 0
14 mol 181 unq 3 iso 0 dist 7.15963 14.1493 9.1374 12.1848 6.71012 4.77278 13.6065 9.47799 9.86845 5.41368 numMergedOcc 0
15 mol 181 unq 4 iso 0 dist 7.15963 14.1493 9.1374 12.1848 6.71012 4.77278 11.4115 9.09989 12.5284 7.96182 numMergedOcc 0
16 mol 181 unq 5 iso 0 dist 7.15963 14.1493 9.1374 12.1848 6.71012 4.77278 8.63713 4.98009 12.0593 7.90237 numMergedOcc 0
17 mol 181 unq 6 iso 0 dist 7.15963 6.73556 5.98885 9.09192 6.94688 5.86342 13.6065 9.47799 13.0329 8.45395 numMergedOcc 0
18 mol 181 unq 7 iso 0 dist 7.15963 6.73556 5.98885 9.09192 6.94688 5.86342 11.4115 9.09989 12.9014 9.15368 numMergedOcc 0
19 mol 181 unq 8 iso 0 dist 7.15963 6.73556 5.98885 9.09192 6.94688 5.86342 8.63713 4.98009 10.3248 9.20477 numMergedOcc 0
20 mol 181 unq 9 iso 0 dist 7.15963 6.73556 5.98885 12.1848 6.71012 9.14057 13.6065 9.47799 13.0329 5.41368 numMergedOcc 0
21 mol 181 unq 10 iso 0 dist 7.15963 6.73556 5.98885 12.1848 6.71012 9.14057 11.4115 9.09989 12.9014 7.96182 numMergedOcc 0
22 mol 181 unq 11 iso 0 dist 7.15963 6.73556 5.98885 12.1848 6.71012 9.14057 8.63713 4.98009 10.3248 7.90237 numMergedOcc 0
23 mol 181 unq 12 iso 0 dist 7.15963 5.49666 9.15386 9.09192 6.94688 6.80228 13.6065 9.47799 14.039 8.45395 numMergedOcc 0
24 mol 181 unq 13 iso 0 dist 7.15963 5.49666 9.15386 9.09192 6.94688 6.80228 11.4115 9.09989 12.9138 9.15368 numMergedOcc 0
25 mol 181 unq 14 iso 0 dist 7.15963 5.49666 9.15386 9.09192 6.94688 6.80228 8.63713 4.98009 11.7479 9.20477 numMergedOcc 0
26 mol 181 unq 15 iso 0 dist 7.15963 5.49666 9.15386 12.1848 6.71012 11.6919 13.6065 9.47799 14.039 5.41368 numMergedOcc 0
27 mol 181 unq 16 iso 0 dist 7.15963 5.49666 9.15386 12.1848 6.71012 11.6919 11.4115 9.09989 12.9138 7.96182 numMergedOcc 0
28 mol 181 unq 17 iso 0 dist 7.15963 5.49666 9.15386 12.1848 6.71012 11.6919 8.63713 4.98009 11.7479 7.90237 numMergedOcc 0
29 mol 181 unq 18 iso 0 dist 6.43406 10.9813 7.81386 4.56814 4.93785 6.7991 5.08796 4.3158 9.84952 6.17129 numMergedOcc 0
30 mol 181 unq 19 iso 0 dist 6.43406 10.9813 7.81386 4.56814 4.93785 6.7991 5.93515 4.3226 10.8641 5.83596 numMergedOcc 0
31 mol 197 unq 0 iso 0 dist 9.14737 9.23779 8.56633 7.69844 8.99696 9.82139 8.61953 10.5326 15.4893 8.32685 numMergedOcc 0
32 mol 197 unq 1 iso 0 dist 9.14737 9.23779 8.56633 7.69844 8.99696 9.82139 7.91999 5.29309 11.6279 6.74777 numMergedOcc 0
33 mol 197 unq 2 iso 0 dist 9.14737 9.23779 8.56633 7.69844 8.99696 9.82139 11.8525 4.57437 12.5442 9.62514 numMergedOcc 0
34 mol 236 unq 0 iso 0 dist 5.99137 13.7629 9.81562 4.47231 5.34718 11.8759 4.43243 4.15973 12.3675 6.98151 numMergedOcc 0
35 mol 236 unq 1 iso 0 dist 5.99137 13.3575 7.68742 4.47231 5.34718 11.3552 4.43243 4.15973 11.0771 6.98151 numMergedOcc 0
36 mol 236 unq 2 iso 0 dist 5.99137 5.03598 6.27581 4.47231 5.34718 6.04825 4.43243 4.15973 5.66569 6.98151 numMergedOcc 0
37 mol 238 unq 0 iso 0 dist 8.39522 4.88998 6.57393 10.4124 6.91569 10.9761 19.219 11.9794 17.949 9.88122 numMergedOcc 0
38 mol 259 unq 0 iso 0 dist 6.20344 5.56656 7.88519 12.9748 7.48005 11.6195 9.32743 4.77548 12.348 9.53092 numMergedOcc 0
39 mol 259 unq 1 iso 0 dist 6.20344 6.08432 7.84554 12.9748 7.48005 11.8736 9.32743 4.77548 12.2873 9.53092 numMergedOcc 0
40 mol 259 unq 2 iso 0 dist 6.20344 10.3156 7.46176 12.9748 7.48005 5.79468 9.32743 4.77548 11.6963 9.53092 numMergedOcc 0
41 mol 259 unq 3 iso 0 dist 6.20344 9.55719 9.18903 12.9748 7.48005 12.6649 9.32743 4.77548 12.3184 9.53092 numMergedOcc 0
42 mol 282 unq 0 iso 0 dist 7.12228 4.36798 6.33524 7.00729 7.32347 6.3384 15.2738 14.3567 15.5242 9.20119 numMergedOcc 0
43 mol 282 unq 1 iso 0 dist 7.12228 4.36798 6.33524 7.00729 7.32347 6.3384 14.3173 10.0286 11.3408 8.96997 numMergedOcc 0
