0 mol 9 unq 0 iso 0 dist 7.70405 7.90063 8.01055 14.3347 11.8626 6.89519 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.70405 7.90063 8.01055 12.1556 13.1565 5.24341 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 7.70405 4.86477 8.61976 12.1556 13.1565 7.67661 numMergedOcc 0
3 mol 12 unq 0 iso 0 dist 7.68446 13.7296 8.15864 14.2056 6.9065 9.75368 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 9.34433 5.9674 7.32913 6.78532 6.9067 9.47348 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 5.63207 6.15285 7.32913 11.6685 6.9067 9.47348 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 9.5663 12.0987 5.66803 15.3021 6.33529 9.15386 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 9.93275 5.64101 9.86325 10.9096 6.02362 9.95767 numMergedOcc 0
8 mol 78 unq 1 iso 0 dist 9.93275 5.64101 9.86325 9.29446 9.54341 5.68286 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 7.40582 15.2733 8.15664 12.2195 6.09495 7.11695 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 5.33659 5.34994 6.08846 11.0714 6.58443 8.88233 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 6.85063 5.38327 5.32865 13.5287 12.348 9.88662 numMergedOcc 0
12 mol 187 unq 0 iso 0 dist 9.55621 9.61673 5.58167 9.38169 4.98423 6.82787 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 9.32133 9.09362 6.62514 17.0164 9.44151 9.24822 numMergedOcc 0
14 mol 204 unq 1 iso 0 dist 6.58174 10.9794 6.20044 10.8579 6.12296 9.24822 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 9.0815 7.03455 6.52136 9.90891 5.91558 8.45825 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 8.67577 8.04189 9.79293 11.035 5.35827 9.66809 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 5.60195 12.9073 8.57174 13.6631 9.18635 9.9693 numMergedOcc 0
18 mol 220 unq 1 iso 0 dist 7.87359 15.2936 8.57174 16.6539 9.18635 9.9693 numMergedOcc 0
19 mol 226 unq 0 iso 0 dist 8.64849 9.4366 8.52996 14.0426 9.00536 5.90092 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 5.46484 5.81446 7.74348 8.95071 6.49831 5.90804 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 8.80671 14.8289 7.74348 12.8768 6.49831 5.90804 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 8.36611 8.31476 8.88741 11.83 6.5875 7.30472 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 9.44017 10.4689 8.04712 12.4086 5.28949 6.03235 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 4.98604 5.51191 6.45597 7.95849 5.10722 9.32175 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 4.98604 5.51191 6.45597 7.95849 5.10722 9.32175 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 4.98604 5.51191 6.45597 7.95849 5.10722 9.32175 numMergedOcc 0
