0 mol 8 unq 0 iso 0 dist 7.61253 12.4742 8.4444 13.2172 5.95251 7.8922 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.89531 11.1464 8.4444 13.1475 5.95251 7.8922 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 9.11545 18.1967 9.95165 23.0309 15.9496 6.82379 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 9.11545 18.1967 9.95165 23.1163 14.678 6.24978 numMergedOcc 0
4 mol 8 unq 4 iso 0 dist 9.11545 18.1967 9.95165 26.3646 17.3707 9.66439 numMergedOcc 0
5 mol 8 unq 5 iso 0 dist 9.11545 18.1967 9.95165 21.7728 12.915 7.3915 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 9.82581 8.80435 9.23617 15.7716 11.8354 7.48847 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 9.82581 8.80435 9.23617 12.9168 14.4019 6.92532 numMergedOcc 0
8 mol 19 unq 2 iso 0 dist 9.82581 8.80435 9.23617 10.9975 10.38 6.36455 numMergedOcc 0
9 mol 19 unq 3 iso 0 dist 8.96529 8.80435 8.63204 15.7716 15.2051 7.48847 numMergedOcc 0
10 mol 19 unq 4 iso 0 dist 8.96529 8.80435 8.63204 12.9168 6.57145 6.92532 numMergedOcc 0
11 mol 19 unq 5 iso 0 dist 8.96529 8.80435 8.63204 10.9975 6.01189 6.36455 numMergedOcc 0
12 mol 19 unq 6 iso 0 dist 9.39332 15.8565 8.63204 22.2344 15.2051 7.48847 numMergedOcc 0
13 mol 19 unq 7 iso 0 dist 9.39332 15.8565 8.63204 12.4855 6.57145 6.92532 numMergedOcc 0
14 mol 19 unq 8 iso 0 dist 9.39332 15.8565 8.63204 14.8314 6.01189 6.36455 numMergedOcc 0
15 mol 53 unq 0 iso 0 dist 6.26613 4.37564 6.95013 7.20005 5.02495 7.09169 numMergedOcc 0
16 mol 75 unq 0 iso 0 dist 6.76977 5.00148 6.59253 11.0276 8.82267 7.9233 numMergedOcc 0
17 mol 114 unq 0 iso 0 dist 9.26301 6.5265 7.73842 11.1736 5.24877 6.34525 numMergedOcc 0
18 mol 183 unq 0 iso 0 dist 7.23572 4.5307 6.40448 9.60878 5.72 8.54827 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.86673 5.99908 4.97005 14.4342 11.3961 9.56197 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 8.86673 5.99908 4.97005 7.69466 10.0248 7.24795 numMergedOcc 0
21 mol 186 unq 2 iso 0 dist 8.86673 5.99908 4.97005 14.5515 9.14781 8.64409 numMergedOcc 0
22 mol 186 unq 3 iso 0 dist 8.86673 5.99908 4.97005 12.8327 6.69897 7.60202 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 6.86845 10.4827 9.33735 18.7534 15.9389 8.38865 numMergedOcc 0
24 mol 227 unq 1 iso 0 dist 6.86845 10.4827 9.33735 14.6311 10.8811 5.4694 numMergedOcc 0
25 mol 227 unq 2 iso 0 dist 8.97396 8.24431 9.33735 16.5076 15.9389 8.38865 numMergedOcc 0
26 mol 227 unq 3 iso 0 dist 8.97396 8.24431 9.33735 13.2454 10.8811 5.4694 numMergedOcc 0
27 mol 278 unq 0 iso 0 dist 4.86518 4.49854 8.04138 6.23184 6.42903 7.67245 numMergedOcc 0
28 mol 278 unq 1 iso 0 dist 4.86518 4.49854 8.04138 10.2998 10.3943 9.12395 numMergedOcc 0
29 mol 285 unq 0 iso 0 dist 7.47103 6.98442 7.06878 10.6145 5.93692 5.31728 numMergedOcc 0
30 mol 294 unq 0 iso 0 dist 8.92737 10.4837 6.16375 6.45955 6.99988 7.91611 numMergedOcc 0
31 mol 294 unq 1 iso 0 dist 7.15278 6.89875 6.16375 5.71661 6.99988 7.91611 numMergedOcc 0
