0 mol 1 unq 0 iso 0 dist 9.60615 9.06627 5.96833 12.2244 4.50502 8.56884 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.60361 6.58295 8.81608 11.5381 6.88805 6.36911 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.60361 6.58295 8.81608 9.62914 13.156 9.36807 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 7.54282 7.95969 9.96121 9.61029 7.11305 6.73162 numMergedOcc 0
4 mol 27 unq 0 iso 0 dist 9.21811 3.71754 6.78936 8.28463 9.11842 9.77484 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.58849 11.8719 8.67634 11.9963 4.53828 6.23899 numMergedOcc 0
6 mol 86 unq 0 iso 0 dist 7.19148 4.51657 5.88159 5.49793 5.9022 7.79359 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 7.79263 6.21945 6.55202 11.6835 6.30721 7.39889 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 7.79263 6.21945 6.55202 10.5727 6.9194 9.63176 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 7.79263 6.21945 6.55202 12.8917 12.4621 7.44174 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 9.9292 4.91188 6.13374 8.32004 6.20019 6.19042 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 9.9292 4.91188 6.13374 13.1001 4.39676 8.43904 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 9.9292 7.01214 9.08536 13.6623 14.443 7.39889 numMergedOcc 0
13 mol 119 unq 6 iso 0 dist 9.9292 7.01214 9.08536 15.0885 9.68677 9.63176 numMergedOcc 0
14 mol 119 unq 7 iso 0 dist 9.9292 7.01214 9.08536 8.32004 6.20019 7.44174 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 8.64976 6.27514 9.10003 13.4206 14.8533 7.92688 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 8.61511 7.49514 5.52149 13.4172 11.5407 8.94837 numMergedOcc 0
17 mol 134 unq 1 iso 0 dist 8.61511 7.49514 5.52149 10.3211 5.91192 7.77454 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 8.45614 5.37421 5.73635 6.31492 4.88992 6.73313 numMergedOcc 0
19 mol 197 unq 0 iso 0 dist 6.89441 12.7975 9.27218 17.7712 17.0276 8.99696 numMergedOcc 0
20 mol 213 unq 0 iso 0 dist 7.31478 12.3402 8.65196 15.1021 10.1881 6.0965 numMergedOcc 0
21 mol 213 unq 1 iso 0 dist 7.31478 6.32328 5.461 9.06306 4.72944 8.45368 numMergedOcc 0
22 mol 213 unq 2 iso 0 dist 7.31478 6.32328 5.461 15.1021 10.1881 9.59129 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.97859 12.4402 7.39547 14.66 5.71717 7.67322 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 9.97859 10.4365 7.24334 14.7634 6.82305 7.49471 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 9.97859 10.4365 7.24334 14.66 5.71717 7.19008 numMergedOcc 0
26 mol 282 unq 0 iso 0 dist 9.07173 6.63358 7.52924 10.9708 4.57104 6.85028 numMergedOcc 0
27 mol 282 unq 1 iso 0 dist 9.07173 6.63358 7.52924 7.90792 5.29852 7.32347 numMergedOcc 0
28 mol 282 unq 2 iso 0 dist 9.07173 6.63358 7.52924 11.2496 5.80572 8.3411 numMergedOcc 0
