0 mol 4 unq 0 iso 0 dist 7.00324 10.5475 8.24634 5.44672 5.58487 7.66731 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.17764 5.93318 6.02702 12.0561 8.60435 6.58469 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.17764 9.69326 8.72114 12.0561 8.60435 16.4405 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 5.20528 9.53239 9.82915 11.5334 8.70863 6.37974 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 5.19438 7.66327 8.39111 7.06723 7.3964 6.16858 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.21813 5.90686 6.7117 10.7165 8.43352 7.32662 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.21813 9.41666 4.47349 10.7165 8.43352 6.934 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 5.21813 9.57791 5.65185 10.7165 8.43352 7.17433 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 7.89276 12.4645 6.7117 8.40294 8.43352 7.32662 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 7.89276 4.89219 4.47349 8.40294 8.43352 6.934 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 7.89276 3.91112 5.65185 8.40294 8.43352 7.17433 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 7.35647 6.73179 9.72053 5.23329 8.91311 6.24241 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 7.35647 12.7556 7.7949 5.23329 8.91311 11.6508 numMergedOcc 0
13 mol 130 unq 2 iso 0 dist 4.88366 8.77629 9.72053 5.54251 8.91311 6.24241 numMergedOcc 0
14 mol 130 unq 3 iso 0 dist 4.88366 6.51295 7.7949 5.54251 8.91311 11.6508 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 7.85849 9.30817 7.69991 17.112 9.30061 13.1292 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 7.85849 10.879 6.23142 17.112 9.30061 9.4027 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 7.85849 16.7911 9.94764 17.112 9.30061 5.12325 numMergedOcc 0
18 mol 134 unq 3 iso 0 dist 6.08299 6.16353 7.69991 9.75179 9.30061 13.1292 numMergedOcc 0
19 mol 134 unq 4 iso 0 dist 6.08299 7.07625 6.23142 9.75179 9.30061 9.4027 numMergedOcc 0
20 mol 134 unq 5 iso 0 dist 6.08299 10.4858 9.94764 9.75179 9.30061 5.12325 numMergedOcc 0
21 mol 135 unq 0 iso 0 dist 5.95344 5.52034 5.62052 10.4311 9.40325 5.66293 numMergedOcc 0
22 mol 135 unq 1 iso 0 dist 5.95344 5.52034 5.62052 6.46708 8.25527 7.79226 numMergedOcc 0
23 mol 135 unq 2 iso 0 dist 5.95344 5.52034 5.62052 10.2113 8.83856 13.2293 numMergedOcc 0
24 mol 135 unq 3 iso 0 dist 5.95344 9.8859 7.85645 10.4311 9.40325 10.1275 numMergedOcc 0
25 mol 135 unq 4 iso 0 dist 5.95344 9.8859 7.85645 6.46708 8.25527 6.99298 numMergedOcc 0
26 mol 135 unq 5 iso 0 dist 5.95344 9.8859 7.85645 10.2113 8.83856 12.8689 numMergedOcc 0
27 mol 135 unq 6 iso 0 dist 7.8687 9.8231 5.62052 15.2788 9.40325 5.66293 numMergedOcc 0
28 mol 135 unq 7 iso 0 dist 7.8687 9.8231 5.62052 5.25373 8.25527 7.79226 numMergedOcc 0
29 mol 135 unq 8 iso 0 dist 7.8687 9.8231 5.62052 5.94856 8.83856 13.2293 numMergedOcc 0
30 mol 135 unq 9 iso 0 dist 7.8687 10.955 7.85645 15.2788 9.40325 10.1275 numMergedOcc 0
31 mol 135 unq 10 iso 0 dist 7.8687 10.955 7.85645 5.25373 8.25527 6.99298 numMergedOcc 0
32 mol 135 unq 11 iso 0 dist 7.8687 10.955 7.85645 5.94856 8.83856 12.8689 numMergedOcc 0
33 mol 156 unq 0 iso 0 dist 5.42285 11.1222 9.00416 7.66951 7.46845 12.962 numMergedOcc 0
34 mol 204 unq 0 iso 0 dist 6.67938 5.96888 7.32294 8.9748 5.91727 5.74707 numMergedOcc 0
35 mol 265 unq 0 iso 0 dist 7.87337 10.3482 6.71375 9.04612 8.85062 7.4402 numMergedOcc 0
36 mol 274 unq 0 iso 0 dist 6.74022 10.7073 8.52587 12.9095 8.2997 5.90436 numMergedOcc 0
37 mol 274 unq 1 iso 0 dist 6.74022 6.45522 6.39866 12.9095 8.2997 10.4342 numMergedOcc 0
