0 mol 0 unq 0 iso 0 dist 8.99617 11.2001 9.19007 6.48924 7.92928 7.02374 18.0627 14.0232 6.91778 13.4647 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 7.21619 8.75206 8.80762 6.84045 7.57354 12.2708 13.4942 10.0658 5.99972 15.5696 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 7.21619 8.75206 8.80762 4.95992 6.96586 6.06176 13.4942 10.0658 5.99972 10.6471 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 5.87266 5.41626 7.05346 14.9544 9.82483 13.5628 11.2374 8.88528 7.32257 11.6997 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 9.60462 7.06965 7.05346 10.7245 9.82483 13.5628 10.5597 8.88528 7.32257 11.6997 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 5.78238 9.59761 6.60423 8.08994 8.62284 5.39241 16.7308 11.9395 9.41441 13.2857 numMergedOcc 0
6 mol 44 unq 0 iso 0 dist 8.6578 6.07691 7.52117 11.6488 9.17518 5.87283 7.42925 5.1728 9.6782 13.4333 numMergedOcc 0
7 mol 44 unq 1 iso 0 dist 8.6578 6.07691 7.52117 15.1165 8.21833 10.6223 7.42925 5.1728 9.6782 13.2979 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 9.07229 10.6381 8.41611 5.45952 6.40901 5.44503 18.178 15.0801 7.78652 13.204 numMergedOcc 0
9 mol 143 unq 1 iso 0 dist 9.07229 10.6381 8.41611 5.45952 6.40901 5.44503 18.2773 15.0315 8.91301 13.8861 numMergedOcc 0
10 mol 143 unq 2 iso 0 dist 8.98581 4.98373 7.63338 6.11011 8.1582 6.01455 10.8751 11.5146 7.78652 6.46089 numMergedOcc 0
11 mol 143 unq 3 iso 0 dist 8.98581 4.98373 7.63338 6.11011 8.1582 6.01455 13.1013 13.434 8.91301 10.1154 numMergedOcc 0
12 mol 143 unq 4 iso 0 dist 8.98581 4.98373 7.63338 5.41014 9.40626 5.44503 10.8751 11.5146 7.78652 13.204 numMergedOcc 0
13 mol 143 unq 5 iso 0 dist 8.98581 4.98373 7.63338 5.41014 9.40626 5.44503 13.1013 13.434 8.91301 13.8861 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 5.29515 10.7866 9.74542 8.95758 8.12589 10.2478 12.0052 7.23332 9.91993 8.73468 numMergedOcc 0
15 mol 148 unq 1 iso 0 dist 5.29515 10.7866 9.74542 8.95758 8.12589 10.2478 11.7851 7.89336 6.22055 9.73927 numMergedOcc 0
16 mol 150 unq 0 iso 0 dist 5.16917 10.734 9.6606 8.91883 8.11592 10.2318 12.0168 7.35366 9.96691 8.73558 numMergedOcc 0
17 mol 150 unq 1 iso 0 dist 5.16917 10.734 9.6606 8.91883 8.11592 10.2318 11.6886 7.86976 6.14675 9.66129 numMergedOcc 0
18 mol 150 unq 2 iso 0 dist 5.16917 10.734 9.6606 8.91883 8.11592 10.2318 15.9383 11.8012 9.24244 12.6576 numMergedOcc 0
19 mol 171 unq 0 iso 0 dist 7.11599 12.3586 7.71426 5.00808 5.73148 8.08908 12.9816 6.29877 5.93786 10.4506 numMergedOcc 0
20 mol 171 unq 1 iso 0 dist 7.11599 12.3586 7.71426 5.00808 5.73148 8.08908 12.9808 5.90358 8.1344 10.7861 numMergedOcc 0
21 mol 171 unq 2 iso 0 dist 7.11599 9.45239 5.10618 5.00808 5.73148 6.05805 12.9816 6.29877 8.24693 10.4506 numMergedOcc 0
22 mol 171 unq 3 iso 0 dist 7.11599 9.45239 5.10618 5.00808 5.73148 6.05805 12.9808 5.90358 6.71356 10.7861 numMergedOcc 0
23 mol 194 unq 0 iso 0 dist 9.13708 5.03763 6.26839 18.6899 9.77862 15.9311 10.6315 5.92931 8.65535 11.6497 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 9.13708 16.5287 8.83356 18.6899 9.77862 5.38925 15.691 12.361 8.29382 13.132 numMergedOcc 0
25 mol 194 unq 2 iso 0 dist 9.13708 16.5287 8.83356 18.6899 9.77862 5.38925 12.6412 7.50057 6.72379 9.3402 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 7.92537 9.73122 6.43341 10.8222 8.23056 7.18967 6.12347 5.89415 9.09855 12.8413 numMergedOcc 0
