0 mol 0 unq 0 iso 0 dist 6.99269 5.5652 7.65806 5.15154 9.19007 9.64573 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.99269 5.5652 7.65806 7.30631 9.56794 6.05328 numMergedOcc 0
2 mol 1 unq 0 iso 0 dist 8.78392 5.54135 9.00903 6.52576 6.09918 7.94662 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 7.86009 14.9943 8.86116 9.39466 6.72502 6.58998 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 7.86009 13.1266 8.38394 9.39466 6.72502 6.59374 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 7.84098 10.9752 7.2846 10.844 9.44459 5.73693 numMergedOcc 0
6 mol 45 unq 1 iso 0 dist 7.84098 5.97638 7.58835 10.844 9.44459 11.6164 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 8.17351 4.21919 7.17396 14.0676 8.64015 11.0904 numMergedOcc 0
8 mol 59 unq 1 iso 0 dist 8.17351 8.92028 9.21998 14.0676 8.64015 12.9211 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 7.10826 13.0428 9.38498 6.41955 7.04044 15.7304 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 7.10826 12.5046 9.96396 6.41955 7.04044 8.26458 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 7.10826 4.51799 9.75218 6.41955 7.04044 8.35241 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 4.86758 9.60547 6.45675 7.94862 9.00544 11.8512 numMergedOcc 0
13 mol 100 unq 1 iso 0 dist 4.86758 9.60547 6.45675 11.2186 7.12017 9.52882 numMergedOcc 0
14 mol 100 unq 2 iso 0 dist 4.86758 9.59578 7.47343 7.94862 9.00544 14.9392 numMergedOcc 0
15 mol 100 unq 3 iso 0 dist 4.86758 9.59578 7.47343 11.2186 7.12017 12.6602 numMergedOcc 0
16 mol 100 unq 4 iso 0 dist 4.86758 5.92453 8.86688 7.94862 9.00544 9.01214 numMergedOcc 0
17 mol 100 unq 5 iso 0 dist 4.86758 5.92453 8.86688 11.2186 7.12017 14.8674 numMergedOcc 0
18 mol 114 unq 0 iso 0 dist 9.46144 8.56349 7.5732 13.291 6.34525 11.128 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 7.30166 7.3338 7.12972 5.32791 8.71039 5.89022 numMergedOcc 0
20 mol 131 unq 1 iso 0 dist 7.30166 7.3338 7.12972 3.46778 6.92648 9.32969 numMergedOcc 0
21 mol 131 unq 2 iso 0 dist 9.82508 7.3338 6.85062 3.46778 9.29384 9.32969 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 9.91541 9.97933 9.29945 7.79723 5.4969 12.3408 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 9.91541 9.97933 9.29945 7.51483 6.4318 8.68081 numMergedOcc 0
24 mol 175 unq 2 iso 0 dist 9.91541 9.97933 9.29945 13.9444 7.35824 12.5754 numMergedOcc 0
25 mol 175 unq 3 iso 0 dist 9.91541 9.97933 9.29945 16.3385 9.17364 10.0424 numMergedOcc 0
