0 mol 30 unq 0 iso 0 dist 5.16345 5.77009 5.19692 13.1546 9.86665 7.78893 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 5.16345 5.77009 5.19692 10.191 10.4845 5.85146 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 7.78306 9.2642 6.24063 14.0609 11.5102 5.9281 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 7.4658 8.42036 8.95491 13.9756 10.2236 7.7346 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 8.51265 11.6312 5.96907 12.2003 4.20944 5.4206 numMergedOcc 0
5 mol 141 unq 1 iso 0 dist 8.51265 11.6312 5.96907 11.2971 6.685 9.56763 numMergedOcc 0
6 mol 156 unq 0 iso 0 dist 9.15574 15.5484 8.86912 13.4243 4.9682 5.22104 numMergedOcc 0
7 mol 165 unq 0 iso 0 dist 6.31455 8.88879 9.00812 11.188 8.92393 7.61231 numMergedOcc 0
8 mol 175 unq 0 iso 0 dist 8.39634 6.49088 5.32236 7.19751 10.8953 7.6741 numMergedOcc 0
9 mol 210 unq 0 iso 0 dist 9.26518 5.20757 8.53457 8.44451 13.4995 8.83523 numMergedOcc 0
10 mol 223 unq 0 iso 0 dist 7.70946 5.88785 9.35643 10.3825 5.19705 8.95054 numMergedOcc 0
11 mol 252 unq 0 iso 0 dist 8.04265 11.199 6.88874 12.5807 8.56684 8.38453 numMergedOcc 0
12 mol 252 unq 1 iso 0 dist 9.42193 9.71846 6.88874 7.38867 8.56684 8.38453 numMergedOcc 0
13 mol 255 unq 0 iso 0 dist 9.51384 5.94053 6.86437 10.6173 12.3106 8.56885 numMergedOcc 0
14 mol 255 unq 1 iso 0 dist 9.51384 5.94053 6.86437 10.2841 4.56113 5.54361 numMergedOcc 0
15 mol 255 unq 2 iso 0 dist 9.51384 5.94053 6.86437 10.6052 7.01955 7.73503 numMergedOcc 0
16 mol 270 unq 0 iso 0 dist 7.65449 8.29488 9.22297 5.2559 3.53146 9.64524 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 5.25218 5.15042 4.96272 12.483 8.61444 8.17846 numMergedOcc 0
18 mol 279 unq 1 iso 0 dist 8.31465 5.21882 4.96272 11.941 8.61444 8.17846 numMergedOcc 0
19 mol 279 unq 2 iso 0 dist 7.88102 8.4307 4.96272 5.16266 8.61444 8.17846 numMergedOcc 0
20 mol 279 unq 3 iso 0 dist 7.93694 8.4307 7.31569 5.16266 6.1215 8.17846 numMergedOcc 0
