0 mol 0 unq 0 iso 0 dist 8.82652 12.7194 8.66548 16.547 8.73015 8.34244 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.96415 5.13744 8.81608 10.9229 5.5683 9.97624 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 8.26334 9.34187 7.08841 15.2965 9.25868 7.9067 numMergedOcc 0
3 mol 29 unq 1 iso 0 dist 7.68854 4.78536 7.08841 10.5673 9.25868 7.9067 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 7.80026 14.6616 8.35444 20.2146 14.2005 9.52272 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 9.56474 10.2536 6.52887 14.2233 4.72639 9.52272 numMergedOcc 0
6 mol 67 unq 0 iso 0 dist 6.44825 13.1761 8.96498 5.63802 5.26394 9.0008 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.12959 12.0704 9.4866 15.2405 10.1364 7.03226 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.79486 5.19762 6.84165 11.4043 5.46083 6.87262 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 5.20195 5.43722 5.52149 7.50264 6.06606 6.93279 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 9.70788 4.85796 7.05845 9.98349 12.207 6.46089 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 9.70788 13.1446 8.18023 19.0876 13.1214 9.30424 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 8.09064 5.85057 8.42899 9.77704 3.92992 8.28564 numMergedOcc 0
13 mol 148 unq 1 iso 0 dist 9.87654 13.9851 8.42899 13.7713 3.92992 8.28564 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 8.00956 6.01237 8.33721 10.0084 3.94762 8.39475 numMergedOcc 0
15 mol 150 unq 1 iso 0 dist 9.90415 13.9093 8.33721 13.8352 3.94762 8.39475 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 6.95244 8.94838 8.62366 15.8158 16.0084 8.41245 numMergedOcc 0
17 mol 173 unq 1 iso 0 dist 6.95244 8.94838 8.62366 9.31172 11.3761 6.64779 numMergedOcc 0
18 mol 173 unq 2 iso 0 dist 6.11224 8.94838 6.52508 15.8158 11.2063 8.41245 numMergedOcc 0
19 mol 173 unq 3 iso 0 dist 6.11224 8.94838 6.52508 9.31172 4.60149 6.64779 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 8.39573 11.4382 6.76746 17.0911 11.9796 7.05653 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 5.81438 5.64245 5.3819 9.23676 6.65648 7.10526 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 8.68934 8.2025 8.27411 14.1034 11.1693 7.43663 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 8.40328 10.0667 6.23661 10.9688 4.47425 8.71497 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 7.32002 10.5538 6.1905 11.0414 3.92782 5.7131 numMergedOcc 0
