0 mol 1 unq 0 iso 0 dist 5.06175 4.17249 5.91417 8.54503 3.81243 7.83632 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 8.83891 4.96682 9.51568 8.3794 5.20798 6.50647 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.3307 4.76457 8.38156 12.1138 10.4006 8.90835 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 9.83555 15.3438 8.96498 9.71705 5.26394 9.0008 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.55112 6.14439 9.4866 11.1286 10.1364 7.03226 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 8.40389 10.7702 5.51885 11.8114 4.08391 5.79343 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 5.64587 5.40594 6.47811 11.7813 10.5938 7.75012 numMergedOcc 0
7 mol 128 unq 1 iso 0 dist 5.64587 5.40594 6.47811 9.39728 5.91388 6.98158 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.88752 14.4059 8.55349 14.1386 11.4316 7.41399 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 8.88752 14.4059 8.55349 12.982 12.3375 8.21165 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 8.88752 14.4059 8.55349 9.14147 4.10674 8.97945 numMergedOcc 0
11 mol 133 unq 3 iso 0 dist 8.88752 14.4059 8.55349 14.9074 6.24625 9.50664 numMergedOcc 0
12 mol 133 unq 4 iso 0 dist 8.88752 14.4059 8.55349 14.2167 6.11861 6.71555 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 4.73115 9.50813 6.57379 8.86811 6.32315 6.21403 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 8.73668 13.6923 6.44575 17.8884 11.5269 8.55616 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 9.76579 12.3819 7.30954 14.3972 5.95858 7.80054 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 5.51167 7.08042 7.06851 5.24076 4.02702 7.60254 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 5.97971 5.20775 6.76746 12.2628 11.9796 7.05653 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 8.72747 8.17808 6.76746 14.6112 11.9796 7.05653 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 8.23845 5.64849 6.76746 11.2332 11.9796 7.05653 numMergedOcc 0
20 mol 195 unq 0 iso 0 dist 8.84149 7.56699 9.32333 13.0323 5.66395 9.82588 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 8.09016 5.14615 5.93063 13.6587 10.1358 9.47117 numMergedOcc 0
22 mol 227 unq 0 iso 0 dist 8.76745 6.20562 7.79951 13.5381 12.8337 7.57454 numMergedOcc 0
23 mol 227 unq 1 iso 0 dist 5.77762 6.92493 7.79951 14.0842 12.8337 7.57454 numMergedOcc 0
24 mol 267 unq 0 iso 0 dist 5.463 4.62072 6.32877 10.7074 14.8427 9.01354 numMergedOcc 0
25 mol 267 unq 1 iso 0 dist 8.68244 4.62072 8.38545 10.7074 5.32312 9.01354 numMergedOcc 0
26 mol 267 unq 2 iso 0 dist 9.46729 4.62072 6.10838 10.7074 5.41564 9.01354 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 8.34313 10.8816 6.0283 13.4795 9.85432 9.24367 numMergedOcc 0
