0 mol 10 unq 0 iso 0 dist 6.47424 5.64721 7.30932 11.2695 9.17574 14.5484 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 6.47424 5.64721 7.30932 8.2944 8.79953 10.4755 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 9.59744 12.6064 7.30932 6.42677 9.17574 14.5484 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 9.59744 12.6064 7.30932 4.28255 8.79953 10.4755 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 7.0851 5.88248 7.47596 6.26554 6.53981 4.47203 numMergedOcc 0
5 mol 44 unq 1 iso 0 dist 7.0851 5.88248 7.47596 4.39351 9.14809 7.11688 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 9.07283 11.6226 7.32699 7.16993 9.42099 7.12927 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 9.07283 6.87877 6.45933 7.16993 9.42099 5.77634 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 9.50763 5.30015 7.75075 8.77331 8.99536 4.90088 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 9.50763 5.30015 7.75075 8.84883 5.94317 7.5659 numMergedOcc 0
10 mol 111 unq 0 iso 0 dist 6.33923 9.73916 8.69371 12.6461 9.72371 12.0392 numMergedOcc 0
11 mol 124 unq 0 iso 0 dist 8.06631 5.20968 9.66083 4.31676 8.65859 4.26006 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.14978 7.47861 4.93944 12.0582 9.59109 14.0112 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 7.53591 4.27597 7.43045 7.84926 9.62774 10.537 numMergedOcc 0
14 mol 141 unq 2 iso 0 dist 8.34503 6.0848 7.43045 6.13227 9.62774 10.537 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 7.00382 5.43796 8.45086 5.48326 8.2241 9.57677 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 8.78251 14.813 7.62945 12.5102 5.25762 5.96605 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 6.2669 5.60686 4.29411 4.45301 7.13824 5.07333 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 8.7917 4.66494 8.33245 10.1937 9.30639 10.4275 numMergedOcc 0
19 mol 222 unq 1 iso 0 dist 8.7917 4.66494 8.33245 7.56406 6.24462 9.86636 numMergedOcc 0
20 mol 222 unq 2 iso 0 dist 8.7917 4.66494 8.33245 4.03396 6.02034 5.78833 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 8.4625 5.7177 9.57637 13.0927 9.25759 13.8928 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 9.03468 13.1162 9.2144 5.87907 9.23152 9.52438 numMergedOcc 0
23 mol 287 unq 2 iso 0 dist 6.05363 13.3584 9.2144 14.8133 9.23152 9.52438 numMergedOcc 0
24 mol 287 unq 3 iso 0 dist 9.14217 5.11604 7.29668 6.88096 8.58427 7.65493 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 8.4625 5.7177 9.57637 13.0927 9.25759 13.8928 numMergedOcc 0
26 mol 288 unq 1 iso 0 dist 9.03468 13.1162 9.2144 5.87907 9.23152 9.52438 numMergedOcc 0
27 mol 288 unq 2 iso 0 dist 6.05363 13.3584 9.2144 14.8133 9.23152 9.52438 numMergedOcc 0
28 mol 288 unq 3 iso 0 dist 9.14217 5.11604 7.29668 6.88096 8.58427 7.65493 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 8.4625 5.7177 9.57637 13.0927 9.25759 13.8928 numMergedOcc 0
30 mol 289 unq 1 iso 0 dist 9.03468 13.1162 9.2144 5.87907 9.23152 9.52438 numMergedOcc 0
31 mol 289 unq 2 iso 0 dist 6.05363 13.3584 9.2144 14.8133 9.23152 9.52438 numMergedOcc 0
32 mol 289 unq 3 iso 0 dist 9.14217 5.11604 7.29668 6.88096 8.58427 7.65493 numMergedOcc 0
