0 mol 1 unq 0 iso 0 dist 5.55208 8.47429 4.49401 8.93702 6.28655 9.45781 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.5933 8.47429 5.72763 8.93702 10.1521 9.45781 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 7.46191 8.47429 9.79586 8.93702 10.2276 9.45781 numMergedOcc 0
3 mol 7 unq 0 iso 0 dist 9.25234 8.98901 7.48475 6.16125 5.26896 4.48817 numMergedOcc 0
4 mol 7 unq 1 iso 0 dist 9.25234 8.98901 7.48475 9.34656 11.5809 5.9201 numMergedOcc 0
5 mol 18 unq 0 iso 0 dist 6.60128 9.4649 4.76553 8.95573 9.45185 10.3579 numMergedOcc 0
6 mol 18 unq 1 iso 0 dist 6.60128 6.45965 10.8382 8.95573 9.45185 5.867 numMergedOcc 0
7 mol 94 unq 0 iso 0 dist 5.4622 7.81363 12.8989 5.80964 10.7906 4.4432 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 8.6786 7.11556 5.13555 9.9443 11.3473 7.62048 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 8.6786 6.15185 8.44185 9.9443 11.3473 8.44086 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.47392 8.47476 10.5086 9.55297 11.805 5.65619 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 6.47392 8.47476 10.5086 7.447 5.34489 14.1869 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 6.47392 8.47476 10.5086 6.59782 4.93548 8.66026 numMergedOcc 0
13 mol 141 unq 3 iso 0 dist 6.47392 6.74947 8.78038 9.55297 11.805 15.8344 numMergedOcc 0
14 mol 141 unq 4 iso 0 dist 6.47392 6.74947 8.78038 7.447 5.34489 5.25586 numMergedOcc 0
15 mol 141 unq 5 iso 0 dist 6.47392 6.74947 8.78038 6.59782 4.93548 10.1908 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 9.15244 9.08229 4.74884 9.4422 11.0411 10.9873 numMergedOcc 0
17 mol 167 unq 1 iso 0 dist 9.15244 7.99057 6.44271 9.4422 11.0411 12.2296 numMergedOcc 0
18 mol 167 unq 2 iso 0 dist 8.08948 9.08229 14.6278 9.4422 10.8865 10.9873 numMergedOcc 0
19 mol 167 unq 3 iso 0 dist 8.08948 7.99057 7.06542 9.4422 10.8865 12.2296 numMergedOcc 0
20 mol 209 unq 0 iso 0 dist 9.53736 6.3344 6.26842 5.20111 4.84657 4.45815 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 7.30288 9.39546 9.92692 5.13604 6.32132 4.8744 numMergedOcc 0
22 mol 220 unq 1 iso 0 dist 7.30288 4.17978 6.85536 5.13604 6.32132 3.90017 numMergedOcc 0
23 mol 233 unq 0 iso 0 dist 6.59321 4.91191 5.5881 7.99897 4.43794 5.3674 numMergedOcc 0
24 mol 233 unq 1 iso 0 dist 9.80759 4.91191 11.4518 7.99897 11.2489 5.3674 numMergedOcc 0
25 mol 233 unq 2 iso 0 dist 6.09111 7.89581 4.73495 8.98366 6.99665 5.19341 numMergedOcc 0
26 mol 236 unq 0 iso 0 dist 6.35418 6.54859 7.34037 7.05868 4.99523 4.52208 numMergedOcc 0
27 mol 260 unq 0 iso 0 dist 7.5129 7.90537 11.113 9.50619 8.29529 5.51525 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 7.19754 6.38338 4.88674 8.70062 8.6202 4.26276 numMergedOcc 0
29 mol 287 unq 1 iso 0 dist 7.19754 6.38338 4.88674 9.919 5.64526 9.92609 numMergedOcc 0
30 mol 288 unq 0 iso 0 dist 7.19754 6.38338 4.88674 8.70062 8.6202 4.26276 numMergedOcc 0
31 mol 288 unq 1 iso 0 dist 7.19754 6.38338 4.88674 9.919 5.64526 9.92609 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 7.19754 6.38338 4.88674 8.70062 8.6202 4.26276 numMergedOcc 0
33 mol 289 unq 1 iso 0 dist 7.19754 6.38338 4.88674 9.919 5.64526 9.92609 numMergedOcc 0
