0 mol 32 unq 0 iso 0 dist 8.5448 8.88829 12.4304 3.24351 5.78231 8.91596 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 5.99174 5.67627 7.12257 7.8635 9.35905 10.7457 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.63855 8.30291 4.44795 5.4275 6.51901 9.81276 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 5.48766 8.30291 4.83921 5.4275 9.1926 9.81276 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 9.54529 9.60879 6.77896 4.5904 7.31881 9.58351 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 6.73908 9.61096 6.77896 4.63088 7.31881 9.58351 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.25793 8.14057 11.8136 4.3421 6.77993 11.3564 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 8.98691 6.5136 9.7565 13.5194 9.98215 16.2942 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 8.02307 8.92287 11.7416 12.4117 6.02608 17.6355 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 6.95777 8.26309 5.60443 4.39733 9.75833 12.1379 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 6.98104 6.97244 6.3368 10.2106 5.94465 7.42146 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 5.51129 6.1421 5.57978 8.90391 8.42277 13.0143 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 5.51129 6.1421 5.57978 5.85476 6.26653 10.4172 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 5.58048 9.81482 7.11231 7.34804 8.54982 15.0844 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 7.38265 8.14812 5.29393 6.55101 4.98907 8.03012 numMergedOcc 0
15 mol 264 unq 0 iso 0 dist 6.14231 8.43682 6.67602 11.3526 6.67548 12.967 numMergedOcc 0
16 mol 264 unq 1 iso 0 dist 6.14231 8.43682 6.67602 8.93485 5.57579 12.2505 numMergedOcc 0
17 mol 264 unq 2 iso 0 dist 6.14231 6.20796 5.7052 11.3526 6.67548 11.4804 numMergedOcc 0
18 mol 264 unq 3 iso 0 dist 6.14231 6.20796 5.7052 8.93485 5.57579 10.384 numMergedOcc 0
19 mol 264 unq 4 iso 0 dist 4.68488 7.73693 5.7052 6.26054 6.67548 11.4804 numMergedOcc 0
20 mol 264 unq 5 iso 0 dist 4.68488 7.73693 5.7052 3.81537 5.57579 10.384 numMergedOcc 0
21 mol 294 unq 0 iso 0 dist 9.03579 5.71661 9.41638 4.63586 7.58948 8.88595 numMergedOcc 0
22 mol 294 unq 1 iso 0 dist 9.03579 8.98536 13.9089 4.63586 7.58948 12.2136 numMergedOcc 0
