0 mol 7 unq 0 iso 0 dist 9.60499 6.02702 8.43473 10.5551 7.5706 6.04832 6.55304 6.7985 6.14469 5.82034 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 8.72114 13.8829 4.87279 8.70159 6.04832 6.34041 12.9581 6.14469 5.82034 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 9.62394 9.5997 9.32349 13.8869 9.68136 16.147 14.519 7.35972 12.2786 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.57077 9.62394 9.5997 9.32349 13.8869 9.68136 19.4709 18.1148 9.93542 16.2955 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 8.38064 7.07399 4.29582 5.88545 7.876 9.41935 4.39605 7.48342 6.03257 6.25997 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.86014 7.29868 8.52463 4.99125 10.8237 6.23824 6.66749 9.41441 6.72323 6.39466 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 8.86116 8.60554 8.52463 11.4659 10.8237 6.23824 14.012 9.41441 6.72323 6.39466 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 8.38394 8.60554 12.3994 11.4659 16.0099 6.23824 14.012 15.392 6.72323 6.39466 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 5.54419 8.4051 5.11617 13.2525 9.40259 6.23824 12.176 6.73939 6.72323 6.39466 numMergedOcc 0
9 mol 24 unq 4 iso 0 dist 7.36323 8.4051 13.2229 13.2525 18.5567 6.23824 12.176 18.673 6.72323 6.39466 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 7.97049 9.82915 9.29301 12.8706 10.3643 9.35279 10.4987 14.4725 9.66222 18.1901 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 7.47541 9.82915 13.5116 12.8706 11.3324 9.35279 10.4987 17.5738 9.66222 18.1901 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 9.60661 7.01812 5.80144 8.07089 12.5743 6.84692 10.6848 14.8081 9.5057 4.71426 numMergedOcc 0
13 mol 100 unq 1 iso 0 dist 7.17106 7.01812 8.4128 8.07089 8.20656 6.84692 10.6848 7.10378 9.5057 4.71426 numMergedOcc 0
14 mol 100 unq 2 iso 0 dist 9.35224 7.01812 10.0456 8.07089 14.6339 6.84692 10.6848 15.2289 9.5057 4.71426 numMergedOcc 0
15 mol 100 unq 3 iso 0 dist 7.47343 8.30845 12.2861 12.8256 17.5797 6.84692 15.3454 21.075 9.5057 4.71426 numMergedOcc 0
16 mol 100 unq 4 iso 0 dist 6.65086 8.30845 5.80144 12.8256 12.5743 6.84692 15.3454 14.8081 9.5057 4.71426 numMergedOcc 0
17 mol 100 unq 5 iso 0 dist 6.56369 8.30845 10.0456 12.8256 14.6339 6.84692 15.3454 15.2289 9.5057 4.71426 numMergedOcc 0
18 mol 100 unq 6 iso 0 dist 9.30209 8.30845 6.70236 12.8256 12.1782 6.84692 15.3454 12.6004 9.5057 4.71426 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 6.29155 6.16242 4.54648 5.47259 4.51266 6.49688 12.131 10.9581 8.95662 14.6184 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 6.80239 5.87634 4.54648 4.70102 4.51266 6.49688 14.8102 10.9581 8.95662 14.6184 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 8.03334 6.46704 4.43096 5.87996 12.0793 8.91675 7.81713 6.2479 7.32087 10.0785 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 7.63312 5.9176 5.63555 5.83639 8.47008 6.2176 6.29863 11.9764 7.22883 8.51662 numMergedOcc 0
23 mol 249 unq 0 iso 0 dist 7.57994 5.48118 10.7772 6.66935 13.131 5.72442 9.0676 16.0282 5.9627 4.9236 numMergedOcc 0
24 mol 249 unq 1 iso 0 dist 6.18582 5.48118 7.04666 6.66935 9.60911 5.72442 9.0676 12.4721 5.9627 4.9236 numMergedOcc 0
25 mol 273 unq 0 iso 0 dist 9.01049 8.49177 9.25493 5.29565 6.70271 8.25037 4.60101 11.6152 7.16346 6.54339 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 7.56915 8.52587 5.29529 5.87456 6.92434 5.0002 6.20558 9.85289 6.88827 4.67674 numMergedOcc 0
27 mol 274 unq 1 iso 0 dist 7.56915 8.52587 5.29529 5.87456 6.92434 5.0002 16.3619 14.1515 9.16942 11.1431 numMergedOcc 0
