0 mol 19 unq 0 iso 0 dist 6.16954 4.87491 7.42956 9.84767 5.76052 8.43581 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.20625 6.67638 7.37857 8.92334 4.23443 6.31089 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 9.20625 6.29954 4.7978 8.92334 4.23443 7.07502 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 8.33169 10.922 8.08195 12.7472 5.4811 6.31089 numMergedOcc 0
4 mol 28 unq 3 iso 0 dist 8.33169 5.18775 5.78587 12.7472 5.4811 8.48468 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 8.2071 4.35049 7.57624 11.3572 7.63516 7.78893 numMergedOcc 0
6 mol 30 unq 1 iso 0 dist 8.2071 4.35049 7.57624 5.82731 3.68767 5.85146 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 8.75826 10.9352 7.09118 14.8205 10.3761 5.9281 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 5.1524 6.32847 5.70499 7.34765 3.38209 4.48699 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 8.14817 16.27 8.88404 12.9458 6.0189 5.4206 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 8.14817 16.27 8.88404 16.5252 11.0197 9.56763 numMergedOcc 0
11 mol 159 unq 0 iso 0 dist 7.67418 4.92046 9.37298 8.61788 4.31404 8.12238 numMergedOcc 0
12 mol 165 unq 0 iso 0 dist 8.01191 5.79543 6.08508 10.5701 4.12949 7.61231 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 9.94807 4.66436 6.45821 9.81879 3.33782 5.4621 numMergedOcc 0
14 mol 218 unq 1 iso 0 dist 9.94807 4.66436 6.45821 11.7152 9.06704 8.91819 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 7.668 4.32828 7.74885 11.493 9.09582 7.83105 numMergedOcc 0
16 mol 230 unq 1 iso 0 dist 7.668 4.32828 7.74885 5.48736 3.83847 5.63025 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 4.79504 5.08257 8.48604 5.86945 4.62296 6.19029 numMergedOcc 0
18 mol 232 unq 1 iso 0 dist 4.79504 4.67807 9.35873 5.86945 4.62296 9.99655 numMergedOcc 0
