0 mol 24 unq 0 iso 0 dist 9.33902 6.80849 4.42703 4.98987 9.7743 6.11056 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 5.76314 6.13476 9.65953 10.5752 11.1658 5.97635 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.24768 9.58156 10.1976 11.1016 14.8872 8.1599 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 8.51622 7.59416 10.1976 7.04908 14.8872 8.1599 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 9.93577 9.89618 11.498 9.88666 17.7643 9.44078 numMergedOcc 0
5 mol 90 unq 1 iso 0 dist 9.93577 9.89618 11.498 10.1669 15.7056 5.9179 numMergedOcc 0
6 mol 90 unq 2 iso 0 dist 7.38568 4.75701 4.52556 5.13128 12.4723 9.44078 numMergedOcc 0
7 mol 90 unq 3 iso 0 dist 7.38568 4.75701 4.52556 4.14427 9.29411 5.9179 numMergedOcc 0
8 mol 90 unq 4 iso 0 dist 8.6767 9.89618 4.52556 9.88666 12.4723 9.44078 numMergedOcc 0
9 mol 90 unq 5 iso 0 dist 8.6767 9.89618 4.52556 10.1669 9.29411 5.9179 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 9.52936 6.91417 14.5145 4.23182 7.62621 8.86252 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 9.32154 8.1306 4.60073 6.9318 11.289 9.73174 numMergedOcc 0
12 mol 110 unq 1 iso 0 dist 9.32154 8.1306 4.60073 4.29339 9.95088 9.65418 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 8.27008 6.29975 4.32516 7.49664 9.86691 9.3894 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 6.23859 9.71735 11.1768 4.20223 9.71888 7.80299 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 7.50691 9.71735 7.03438 4.20223 8.6011 7.80299 numMergedOcc 0
16 mol 196 unq 0 iso 0 dist 9.67795 7.23126 12.8012 15.4605 16.8265 8.79558 numMergedOcc 0
17 mol 196 unq 1 iso 0 dist 9.67795 6.40064 12.7415 8.51719 11.7963 6.25429 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 8.39627 8.39522 15.529 5.58605 12.3045 6.24928 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.39009 6.70123 5.07427 4.31756 10.5015 9.77689 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 9.39009 6.70123 5.07427 11.7666 9.84936 8.51931 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 9.5174 7.63115 4.51764 9.73504 8.53542 7.74162 numMergedOcc 0
