0 mol 7 unq 0 iso 0 dist 8.88982 9.49401 6.34041 10.5313 6.22805 12.0954 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 7.88429 6.77108 6.71887 10.7179 8.85347 12.6087 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.13365 8.12171 6.66749 11.7903 6.85331 13.4332 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 9.8294 8.41903 12.9702 13.2858 5.66319 18.2365 numMergedOcc 0
4 mol 181 unq 0 iso 0 dist 9.50454 5.87853 6.29863 18.3782 9.63295 14.0071 numMergedOcc 0
5 mol 204 unq 0 iso 0 dist 6.73266 9.639 5.86489 14.4545 7.7292 8.82861 numMergedOcc 0
6 mol 234 unq 0 iso 0 dist 7.14333 9.33455 5.08515 8.3924 9.67966 12.4654 numMergedOcc 0
7 mol 236 unq 0 iso 0 dist 5.99137 7.87572 13.1168 11.7831 6.36941 17.4661 numMergedOcc 0
8 mol 238 unq 0 iso 0 dist 6.51823 6.62283 10.4017 5.98533 8.89538 12.3944 numMergedOcc 0
9 mol 238 unq 1 iso 0 dist 6.51823 8.60978 7.95232 5.98533 8.89538 14.1787 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 6.92721 9.26512 11.169 4.95913 9.27989 6.91534 numMergedOcc 0
11 mol 239 unq 1 iso 0 dist 6.92721 9.2495 9.59042 4.95913 9.27989 13.7183 numMergedOcc 0
12 mol 239 unq 2 iso 0 dist 6.92721 5.82804 5.88931 4.95913 9.27989 9.05892 numMergedOcc 0
13 mol 261 unq 0 iso 0 dist 6.68878 9.9247 6.65675 8.9397 9.43169 11.5569 numMergedOcc 0
14 mol 280 unq 0 iso 0 dist 8.88567 7.18775 6.19336 11.5286 8.40961 9.38952 numMergedOcc 0
15 mol 280 unq 1 iso 0 dist 8.88567 7.18775 6.19336 11.855 9.42213 12.9106 numMergedOcc 0
16 mol 280 unq 2 iso 0 dist 8.88567 9.9394 13.0704 11.5286 8.40961 17.7021 numMergedOcc 0
17 mol 280 unq 3 iso 0 dist 8.88567 9.9394 13.0704 11.855 9.42213 20.2974 numMergedOcc 0
18 mol 282 unq 0 iso 0 dist 7.34596 9.88071 8.2662 5.5267 6.84554 10.5547 numMergedOcc 0
19 mol 282 unq 1 iso 0 dist 7.12228 9.88071 6.6348 5.5267 9.51581 10.5547 numMergedOcc 0
