0 mol 26 unq 0 iso 0 dist 6.84751 4.25444 6.79475 5.43726 8.96682 5.11733 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 5.51172 7.02939 5.91068 4.71262 7.01952 10.3961 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 5.51172 7.02939 5.91068 4.28439 4.58552 7.52709 numMergedOcc 0
3 mol 34 unq 2 iso 0 dist 7.93454 14.28 7.79336 12.5404 7.01952 4.22398 numMergedOcc 0
4 mol 34 unq 3 iso 0 dist 9.06898 14.28 7.08559 12.5404 4.58552 4.22398 numMergedOcc 0
5 mol 34 unq 4 iso 0 dist 9.06898 10.7254 8.63635 12.5404 4.58552 8.82586 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 8.8014 9.66967 7.95451 6.73987 5.7369 5.6999 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.18572 8.36307 9.4866 5.4968 9.59729 4.00608 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 8.18572 10.4617 9.40363 5.4968 9.59729 11.915 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 9.21978 5.39389 8.0168 3.85674 7.65564 5.78043 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 9.26505 5.26498 7.65255 3.82475 7.65564 5.65471 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 9.8564 8.67365 7.43401 16.6683 8.62504 9.48887 numMergedOcc 0
12 mol 157 unq 0 iso 0 dist 8.51753 6.83479 6.4431 6.17631 8.40821 9.61577 numMergedOcc 0
13 mol 157 unq 1 iso 0 dist 8.51753 6.83479 6.4431 3.80096 9.86925 7.32006 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 5.00402 4.32025 7.25339 5.7782 8.36129 4.4803 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 5.00402 4.32025 7.25339 5.44287 5.86483 5.92278 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 9.67667 10.4381 9.27218 8.58041 6.69042 12.627 numMergedOcc 0
17 mol 273 unq 0 iso 0 dist 7.05843 9.47751 9.06937 5.74227 9.02537 14.7645 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 9.65996 6.33111 6.1905 6.49965 6.22943 6.87619 numMergedOcc 0
19 mol 292 unq 1 iso 0 dist 9.65996 6.33111 6.1905 12.2613 9.31056 11.493 numMergedOcc 0
20 mol 292 unq 2 iso 0 dist 9.13412 6.33111 5.84792 6.49965 9.23612 6.87619 numMergedOcc 0
