0 mol 1 unq 0 iso 0 dist 8.40848 8.27735 6.35409 6.03793 7.90928 8.56884 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.42206 7.34549 5.3315 7.23551 9.97117 6.73162 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.66602 9.72289 5.3315 8.34836 9.97117 6.73162 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 4.90079 6.31203 4.8042 6.87327 9.16721 12.0114 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 6.12404 5.22628 5.24961 5.26498 5.58063 7.64585 numMergedOcc 0
5 mol 147 unq 0 iso 0 dist 5.70772 9.23551 10.5583 6.73253 9.8769 15.8772 numMergedOcc 0
6 mol 147 unq 1 iso 0 dist 8.93916 7.4653 8.95179 13.0045 9.8769 16.7359 numMergedOcc 0
7 mol 147 unq 2 iso 0 dist 8.93916 7.95564 11.4531 13.0045 9.8769 19.1329 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 7.76856 9.09857 10.6484 10.6378 9.32452 18.0301 numMergedOcc 0
9 mol 173 unq 1 iso 0 dist 7.76856 9.09857 10.6484 9.00192 9.56248 8.31897 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 8.63713 9.50454 8.88398 9.09192 9.20477 15.7174 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 8.63713 9.50454 8.88398 12.1848 7.90237 16.3976 numMergedOcc 0
12 mol 181 unq 2 iso 0 dist 8.63713 7.15963 4.98009 9.09192 9.20477 6.94688 numMergedOcc 0
13 mol 181 unq 3 iso 0 dist 8.63713 7.15963 4.98009 12.1848 7.90237 6.71012 numMergedOcc 0
14 mol 181 unq 4 iso 0 dist 5.08796 6.43406 4.3158 4.56814 6.17129 4.93785 numMergedOcc 0
15 mol 181 unq 5 iso 0 dist 5.93515 6.43406 4.3226 4.56814 5.83596 4.93785 numMergedOcc 0
16 mol 183 unq 0 iso 0 dist 8.53483 9.09322 7.79648 6.93732 7.42108 7.01383 numMergedOcc 0
17 mol 183 unq 1 iso 0 dist 8.50695 9.60723 6.50505 4.50779 9.19941 7.01383 numMergedOcc 0
18 mol 185 unq 0 iso 0 dist 6.06763 6.62848 4.53126 6.57842 8.60027 11.1239 numMergedOcc 0
19 mol 197 unq 0 iso 0 dist 8.61953 9.14737 10.5326 7.69844 8.32685 8.99696 numMergedOcc 0
20 mol 197 unq 1 iso 0 dist 7.91999 9.14737 5.29309 7.69844 6.74777 8.99696 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 4.43243 5.99137 4.15973 4.47231 6.98151 5.34718 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 8.92585 6.51823 10.7712 4.40826 7.96197 9.93432 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 8.92585 6.51823 10.7712 6.04481 6.24435 7.2766 numMergedOcc 0
24 mol 270 unq 0 iso 0 dist 6.55866 7.05331 5.00269 7.15001 7.63678 11.4624 numMergedOcc 0
