0 mol 26 unq 0 iso 0 dist 5.51158 7.90324 4.04528 6.69874 5.73363 5.56687 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 7.19406 6.35731 6.70122 9.72598 8.18251 10.6515 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 7.19406 6.35731 6.70122 4.50032 5.02642 6.02472 numMergedOcc 0
3 mol 65 unq 0 iso 0 dist 7.62028 8.70783 6.59475 5.42391 5.98248 9.38599 numMergedOcc 0
4 mol 65 unq 1 iso 0 dist 7.62028 9.20162 13.4516 5.42391 5.98248 14.1738 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 5.77675 5.86118 4.31746 9.45059 8.39857 12.0172 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 8.4689 8.73268 6.71593 11.4549 5.47459 9.04661 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 6.8456 7.27601 3.88006 4.65951 5.82456 8.55826 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 9.20442 9.38149 8.92172 5.54195 8.83811 11.7813 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 4.76012 7.98622 4.92611 7.37866 5.16531 9.47532 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 8.94007 5.53183 7.38323 12.2068 5.47265 12.4176 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 9.43988 8.53734 13.7258 6.94063 9.1056 10.2527 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 8.91036 7.3879 7.6477 14.4364 6.60418 13.9632 numMergedOcc 0
13 mol 173 unq 1 iso 0 dist 8.91036 9.70728 5.04427 14.4364 6.60418 8.14167 numMergedOcc 0
14 mol 212 unq 0 iso 0 dist 7.67675 7.89739 6.48939 10.4593 8.09185 12.6328 numMergedOcc 0
15 mol 212 unq 1 iso 0 dist 7.67675 6.12161 5.81626 10.4593 8.09185 12.7684 numMergedOcc 0
16 mol 212 unq 2 iso 0 dist 7.35349 8.06858 4.69067 6.60813 7.27225 6.80332 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 8.73545 5.83278 11.4985 4.67806 8.01777 9.72671 numMergedOcc 0
