0 mol 7 unq 0 iso 0 dist 9.85726 11.5784 9.60499 10.4728 8.43473 6.02702 14.1116 13.2603 15.9584 9.97624 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.21217 6.09254 7.10621 12.8055 13.8829 8.72114 12.4418 9.36807 10.515 9.97624 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.59893 10.3564 6.83299 8.77224 4.29856 6.14538 10.8658 5.02241 5.06052 6.30987 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 5.59773 10.4238 6.83299 5.7405 4.29856 6.14538 10.352 5.02241 5.06052 6.30987 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 7.84983 11.5882 6.62496 11.799 9.95364 8.80614 15.2479 16.3613 13.9007 7.6481 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 7.84983 11.5882 6.62496 11.799 9.95364 8.80614 17.0485 11.5023 6.47744 9.11258 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 9.56737 11.5882 6.35756 11.799 5.49591 8.80614 15.2479 12.7237 13.9007 7.6481 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 9.56737 11.5882 6.35756 11.799 5.49591 8.80614 17.0485 8.89374 6.47744 9.11258 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 9.62468 10.7369 6.65721 19.3555 13.5488 9.25641 16.1201 11.7721 5.94559 7.46994 numMergedOcc 0
9 mol 61 unq 1 iso 0 dist 5.92705 5.4671 6.65721 11.9267 13.5488 9.25641 11.1625 11.7721 5.94559 7.46994 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 9.514 11.8037 7.4729 7.44343 9.50382 6.95572 6.12826 10.6071 9.32974 6.72712 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 9.514 11.8037 7.4729 7.44343 9.50382 6.95572 5.02124 5.81965 6.99832 5.39745 numMergedOcc 0
12 mol 126 unq 0 iso 0 dist 9.54928 7.01529 6.06638 12.4696 6.0268 6.30546 13.0595 7.75534 7.01257 7.36017 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 7.78849 11.454 9.89303 9.46933 4.60632 7.69991 13.9992 12.7291 6.69989 8.55616 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 7.78849 11.454 9.89303 9.46933 4.60632 7.69991 17.8858 12.0514 10.1448 8.73604 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 7.30021 5.0966 7.44554 9.6281 5.4555 9.44367 10.3893 6.27641 7.29758 5.81122 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 7.30021 5.75141 8.94056 9.6281 5.4555 7.90267 10.3893 6.27641 8.67156 5.81122 numMergedOcc 0
17 mol 156 unq 2 iso 0 dist 6.71202 5.70205 7.66148 6.22667 6.03934 7.90267 7.02779 10.9818 8.67156 5.81122 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 8.69888 7.39186 6.57069 15.8107 8.29015 9.77896 14.6255 9.8589 7.5414 5.4997 numMergedOcc 0
19 mol 175 unq 1 iso 0 dist 5.08206 5.77256 6.57069 11.0322 8.29015 9.77896 11.5085 9.8589 7.5414 5.4997 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 7.44191 9.60754 8.03334 13.0487 7.81713 6.2479 14.6692 12.1309 6.25083 9.06217 numMergedOcc 0
21 mol 181 unq 1 iso 0 dist 7.44191 9.60754 8.03334 13.0487 7.81713 6.2479 14.2587 12.2058 4.77278 7.13252 numMergedOcc 0
22 mol 181 unq 2 iso 0 dist 6.00053 11.1879 8.03334 12.5826 7.81713 6.2479 13.2672 12.1309 6.25083 9.06217 numMergedOcc 0
23 mol 181 unq 3 iso 0 dist 6.00053 11.1879 8.03334 12.5826 7.81713 6.2479 15.4116 12.2058 4.77278 7.13252 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 9.75313 6.46679 6.61986 13.8414 12.4692 9.51597 7.89905 12.6391 7.67202 8.08737 numMergedOcc 0
25 mol 224 unq 1 iso 0 dist 6.08709 7.85135 6.61986 15.5459 12.4692 9.51597 15.4854 12.6391 7.67202 8.08737 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 6.77279 5.71237 8.13497 9.69025 8.41846 7.98231 15.1483 10.9591 11.6195 8.71497 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 9.58006 5.71237 7.88519 9.69025 8.81835 7.98231 15.1483 7.48005 11.6195 8.71497 numMergedOcc 0
28 mol 259 unq 2 iso 0 dist 9.58006 11.8501 7.46176 9.69025 8.81835 7.08526 15.1483 7.48005 5.79468 8.71497 numMergedOcc 0
