0 mol 14 unq 0 iso 0 dist 4.76499 9.22226 7.13488 8.54362 6.28466 8.9616 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.25761 9.53735 10.4631 5.03531 6.00253 6.36636 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.02604 9.53735 4.77336 5.03531 5.60099 6.36636 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 6.81211 6.19084 5.21113 9.942 10.5093 6.67753 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 6.81211 6.19084 5.21113 5.92771 6.95897 8.49258 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 7.34695 5.0478 5.01159 7.18148 13.1197 10.1455 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 8.65949 7.52378 3.85135 8.86914 8.61134 9.68887 numMergedOcc 0
7 mol 56 unq 1 iso 0 dist 4.76164 7.52378 4.936 8.86914 6.21444 9.68887 numMergedOcc 0
8 mol 62 unq 0 iso 0 dist 5.86234 5.44722 6.12351 6.42645 9.92911 5.85606 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 4.65525 6.97467 5.66705 6.10125 7.92829 5.64188 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 6.32577 6.97467 5.80433 6.10125 3.37658 5.64188 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 7.29604 8.67001 4.91809 6.74196 11.0913 10.7696 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 6.66619 5.11863 4.84884 9.15923 10.5517 6.04545 numMergedOcc 0
13 mol 184 unq 1 iso 0 dist 6.66619 5.11863 4.84884 7.79098 6.53883 4.12242 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 5.42362 8.03226 6.77421 9.59909 6.93198 3.63257 numMergedOcc 0
15 mol 247 unq 0 iso 0 dist 7.80979 6.76933 6.96883 5.27761 4.90304 8.67313 numMergedOcc 0
16 mol 253 unq 0 iso 0 dist 8.0425 7.06589 5.01342 8.86676 10.3873 5.68255 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 6.2083 9.1926 6.02611 8.54895 6.51841 10.5558 numMergedOcc 0
18 mol 272 unq 1 iso 0 dist 6.2083 9.17894 13.4883 8.54895 6.51841 15.1513 numMergedOcc 0
