0 mol 7 unq 0 iso 0 dist 9.20552 9.81211 5.51421 6.49868 7.88043 10.3237 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.20552 9.81211 5.51421 8.07954 8.80762 13 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.94828 4.93826 8.40051 10.812 6.90155 13.0772 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 8.87925 12.3928 7.14232 10.416 9.63263 8.76485 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 9.83528 13.0144 5.9747 5.90298 7.26086 8.89866 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 9.83528 10.11 4.50572 5.90298 7.26086 7.87523 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 7.54969 12.9828 5.9747 8.8736 7.26086 8.89866 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 7.54969 9.82501 4.50572 8.8736 7.26086 7.87523 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 9.26438 9.97562 8.3164 12.3653 5.34214 10.9842 numMergedOcc 0
9 mol 109 unq 1 iso 0 dist 6.43255 13.5611 8.3164 5.55157 5.34214 10.9842 numMergedOcc 0
10 mol 109 unq 2 iso 0 dist 7.4389 13.6781 8.3164 3.56506 5.34214 10.9842 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 5.06555 8.75149 7.04864 10.214 8.93905 4.63594 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 7.34207 9.95968 6.23399 6.03671 7.72144 9.97577 numMergedOcc 0
13 mol 163 unq 0 iso 0 dist 7.75045 4.49316 9.63873 7.79531 8.38738 4.9482 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.52413 16.5529 8.03995 12.1191 9.83476 9.52773 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 9.52413 16.5529 8.03995 10.0766 6.258 11.8884 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 7.39185 5.39526 7.63036 9.67099 6.60567 6.90444 numMergedOcc 0
17 mol 195 unq 1 iso 0 dist 4.78641 8.94388 7.63036 9.33058 6.60567 6.90444 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 7.94344 5.58634 4.84709 6.27546 8.46327 6.83037 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 9.79816 16.0359 7.73315 10.5293 8.06216 9.58139 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 9.79816 16.0359 7.73315 10.888 5.76954 5.77167 numMergedOcc 0
21 mol 218 unq 2 iso 0 dist 9.79816 16.0359 7.73315 8.17702 6.29511 13.9605 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 8.85887 10.1159 6.83408 5.95173 6.42588 5.7394 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 7.151 12.4082 9.77689 6.63088 6.57903 9.41779 numMergedOcc 0
24 mol 277 unq 1 iso 0 dist 7.151 7.47195 8.51931 6.63088 6.57903 12.4389 numMergedOcc 0
25 mol 277 unq 2 iso 0 dist 8.33977 14.7999 9.77689 14.3997 6.57903 9.41779 numMergedOcc 0
26 mol 277 unq 3 iso 0 dist 8.33977 5.65499 8.51931 14.3997 6.57903 12.4389 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 7.77765 6.22911 7.98617 5.94806 9.13907 8.97436 numMergedOcc 0
