0 mol 0 unq 0 iso 0 dist 8.31596 5.75315 11.6716 6.0597 13.1109 9.00092 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.3267 5.75315 6.78129 6.0597 8.34244 9.00092 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 8.11206 6.78936 10.1896 4.39306 11.682 5.9635 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.55901 5.91068 4.22398 4.46241 8.90835 6.88052 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 8.80108 7.03126 11.0945 11.6859 18.9163 9.02642 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 6.90952 6.52887 8.83983 5.80538 12.5097 8.65144 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 9.19459 5.4605 6.74416 4.67641 13.1462 7.58875 numMergedOcc 0
7 mol 72 unq 1 iso 0 dist 9.19459 6.53824 10.7904 4.67641 13.1462 6.91169 numMergedOcc 0
8 mol 72 unq 2 iso 0 dist 8.59747 6.7272 6.74416 7.04549 13.1462 7.58875 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 6.4218 5.73203 5.58312 12.2578 6.93279 7.83568 numMergedOcc 0
10 mol 135 unq 0 iso 0 dist 9.1005 7.6337 6.06659 11.52 12.8178 7.28318 numMergedOcc 0
11 mol 135 unq 1 iso 0 dist 9.1005 7.6337 6.06659 7.69819 10.5009 7.17599 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.55681 4.26972 6.37052 6.76437 5.52683 7.58337 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 7.37901 5.36254 4.48516 5.50045 9.80845 9.16358 numMergedOcc 0
14 mol 155 unq 1 iso 0 dist 7.37901 5.36254 4.48516 6.40403 7.55196 9.24038 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 6.74517 9.65629 4.01736 8.00091 9.19117 8.81244 numMergedOcc 0
16 mol 193 unq 0 iso 0 dist 6.33838 5.79911 5.4245 4.58486 10.2835 8.15661 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 8.57853 8.61306 16.2592 9.52657 17.7942 8.57119 numMergedOcc 0
18 mol 218 unq 1 iso 0 dist 6.75035 8.61306 10.1772 9.52657 15.2093 8.57119 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 4.55996 5.73591 5.93269 6.957 8.64644 5.05368 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 8.49841 9.11572 11.8229 7.17691 7.43663 7.77911 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 9.6101 7.20293 11.8229 4.51304 7.43663 7.77911 numMergedOcc 0
22 mol 234 unq 2 iso 0 dist 5.32183 7.20293 6.45373 4.51304 7.94068 7.77911 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 8.49866 6.66172 5.70568 12.625 12.6896 9.65868 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 8.49866 6.66172 5.70568 4.60275 11.838 8.60027 numMergedOcc 0
