0 mol 7 unq 0 iso 0 dist 7.7393 9.49373 8.4061 8.23909 4.92824 5.37308 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 7.59354 9.80586 6.62867 9.59261 6.83826 4.04716 numMergedOcc 0
2 mol 98 unq 1 iso 0 dist 7.59354 9.80586 6.62867 6.67936 9.94628 13.0429 numMergedOcc 0
3 mol 98 unq 2 iso 0 dist 7.59354 9.80586 6.62867 8.25817 7.53156 13.699 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 9.95698 9.53895 8.49582 9.42766 7.09701 8.82375 numMergedOcc 0
5 mol 126 unq 0 iso 0 dist 9.93897 9.55276 14.3099 7.11388 5.44525 8.91034 numMergedOcc 0
6 mol 126 unq 1 iso 0 dist 9.93897 9.55276 14.3099 8.83131 14.2677 6.14226 numMergedOcc 0
7 mol 165 unq 0 iso 0 dist 5.5411 9.73305 9.13937 9.78437 7.59954 7.60008 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 9.58724 8.40945 16.7204 9.8711 14.6296 6.29733 numMergedOcc 0
9 mol 220 unq 1 iso 0 dist 9.58724 7.81237 10.1832 9.8711 14.6296 13.3213 numMergedOcc 0
10 mol 224 unq 0 iso 0 dist 9.79842 9.9137 5.76597 6.08709 6.06244 6.57808 numMergedOcc 0
11 mol 224 unq 1 iso 0 dist 8.23071 8.65729 5.2011 9.75313 10.9485 6.57808 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 9.92855 7.32814 4.71113 9.84492 7.49004 5.88282 numMergedOcc 0
13 mol 261 unq 0 iso 0 dist 9.50269 8.69675 10.1876 9.62828 4.50761 6.43209 numMergedOcc 0
14 mol 294 unq 0 iso 0 dist 9.68579 9.08548 14.172 9.37818 5.28447 12.9452 numMergedOcc 0
15 mol 294 unq 1 iso 0 dist 8.60714 9.08548 16.741 9.37818 10.5605 12.9452 numMergedOcc 0
