0 mol 30 unq 0 iso 0 dist 9.72314 8.50298 9.07692 9.28932 10.6695 5.61656 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 9.72314 8.50298 9.07692 13.0925 10.6381 8.67487 numMergedOcc 0
2 mol 30 unq 2 iso 0 dist 9.72314 8.50298 9.07692 6.83481 6.40527 6.95343 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 7.81641 7.34182 7.44829 15.2959 13.006 8.08117 numMergedOcc 0
4 mol 52 unq 0 iso 0 dist 6.86785 5.29002 6.56768 7.1203 6.55558 5.75761 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 8.96223 16.4978 8.64454 17.6654 9.41535 7.13536 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.40844 16.278 8.91833 10.1112 8.31041 9.33919 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 8.40844 16.278 8.91833 8.124 5.44275 9.79143 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 8.40844 16.278 8.91833 19.5696 11.2674 6.43377 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 7.02351 5.9581 8.91833 11.0108 8.31041 9.33919 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 7.02351 5.9581 8.91833 10.9082 5.44275 9.79143 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 7.02351 5.9581 8.91833 8.16299 11.2674 6.43377 numMergedOcc 0
12 mol 73 unq 6 iso 0 dist 8.66342 14.3083 8.91833 16.3948 8.31041 9.33919 numMergedOcc 0
13 mol 73 unq 7 iso 0 dist 8.66342 14.3083 8.91833 11.801 5.44275 9.79143 numMergedOcc 0
14 mol 73 unq 8 iso 0 dist 8.66342 14.3083 8.91833 12.2721 11.2674 6.43377 numMergedOcc 0
15 mol 108 unq 0 iso 0 dist 7.58484 5.56331 9.4344 10.4011 12.692 9.56285 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 8.39634 11.4313 7.59434 13.5463 5.96451 6.95549 numMergedOcc 0
17 mol 175 unq 1 iso 0 dist 7.2067 12.1682 8.09125 18.2519 13.2027 6.95549 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 7.4732 11.8994 8.13196 15.2064 11.2111 6.20349 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 7.8316 10.7091 6.16322 12.8593 5.60233 9.92067 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 7.8316 10.7091 6.16322 13.6667 6.32647 7.7904 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 4.21935 5.86234 7.84904 6.83046 5.29737 5.45139 numMergedOcc 0
22 mol 239 unq 1 iso 0 dist 4.21935 5.86234 7.84904 13.3769 15.9383 8.10769 numMergedOcc 0
23 mol 256 unq 0 iso 0 dist 8.11884 8.0817 6.5266 5.98967 9.07441 9.72168 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 9.42812 7.56591 9.25134 14.0486 12.4605 9.78482 numMergedOcc 0
