0 mol 68 unq 0 iso 0 dist 5.48997 11.1122 7.50377 10.4791 6.71645 7.95451 numMergedOcc 0
1 mol 128 unq 0 iso 0 dist 6.93718 5.50996 5.64587 10.5999 5.40594 6.47811 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 4.73804 7.15161 8.88752 11.5276 14.4059 8.55349 numMergedOcc 0
3 mol 155 unq 0 iso 0 dist 9.06599 10.541 8.99128 13.8323 6.51504 7.29911 numMergedOcc 0
4 mol 155 unq 1 iso 0 dist 9.06599 10.541 8.99128 11.1517 6.6805 5.36254 numMergedOcc 0
5 mol 197 unq 0 iso 0 dist 7.69352 8.55619 7.86042 13.6125 10.8745 9.27218 numMergedOcc 0
6 mol 210 unq 0 iso 0 dist 8.50367 6.94265 9.71107 9.99958 6.06056 6.49938 numMergedOcc 0
7 mol 210 unq 1 iso 0 dist 8.50367 9.08763 9.7449 9.99958 6.06056 5.87339 numMergedOcc 0
8 mol 210 unq 2 iso 0 dist 8.94889 4.3844 9.71107 5.57537 6.06056 6.49938 numMergedOcc 0
9 mol 210 unq 3 iso 0 dist 8.94889 6.85132 9.7449 5.57537 6.06056 5.87339 numMergedOcc 0
10 mol 217 unq 0 iso 0 dist 7.95365 14.0642 8.99484 18.0256 10.1352 9.59084 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 7.75366 4.48114 5.52788 11.1167 13.4031 9.84652 numMergedOcc 0
12 mol 242 unq 0 iso 0 dist 9.035 8.04296 8.29838 12.3299 6.47481 6.53309 numMergedOcc 0
13 mol 267 unq 0 iso 0 dist 8.21131 9.10508 5.463 11.0056 4.62072 6.32877 numMergedOcc 0
14 mol 267 unq 1 iso 0 dist 8.21131 10.0159 8.68244 11.0056 4.62072 8.38545 numMergedOcc 0
15 mol 267 unq 2 iso 0 dist 8.21131 13.2368 9.46729 11.0056 4.62072 6.10838 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.5458 4.53492 8.43856 10.9775 9.88579 8.9466 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 8.56533 9.26749 8.43856 15.8344 9.88579 8.9466 numMergedOcc 0
18 mol 287 unq 2 iso 0 dist 8.47385 4.53492 5.83857 10.9775 6.756 8.9466 numMergedOcc 0
19 mol 287 unq 3 iso 0 dist 8.44356 4.53492 5.32839 10.9775 7.93717 8.9466 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 8.5458 4.53492 8.43856 10.9775 9.88579 8.9466 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 8.56533 9.26749 8.43856 15.8344 9.88579 8.9466 numMergedOcc 0
22 mol 288 unq 2 iso 0 dist 8.47385 4.53492 5.83857 10.9775 6.756 8.9466 numMergedOcc 0
23 mol 288 unq 3 iso 0 dist 8.44356 4.53492 5.32839 10.9775 7.93717 8.9466 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 8.5458 4.53492 8.43856 10.9775 9.88579 8.9466 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 8.56533 9.26749 8.43856 15.8344 9.88579 8.9466 numMergedOcc 0
26 mol 289 unq 2 iso 0 dist 8.47385 4.53492 5.83857 10.9775 6.756 8.9466 numMergedOcc 0
27 mol 289 unq 3 iso 0 dist 8.44356 4.53492 5.32839 10.9775 7.93717 8.9466 numMergedOcc 0
