0 mol 25 unq 0 iso 0 dist 7.72372 5.78908 7.03372 9.99134 6.32857 5.81959 15.6351 13.2158 10.6808 6.90155 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 4.8983 4.30874 7.37171 9.94595 12.6176 8.85586 6.97502 8.62079 8.07446 5.16364 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 4.8983 6.97502 8.62079 9.94595 12.6176 5.16364 4.30874 7.37171 8.07446 8.85586 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 9.64908 10.746 6.87434 10.7806 4.25001 6.43433 14.9116 11.5809 5.0812 9.92283 numMergedOcc 0
4 mol 124 unq 0 iso 0 dist 8.50362 10.3233 8.57739 4.83761 5.46636 8.80896 8.39675 11.4882 5.59807 8.97264 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 9.57243 12.8338 7.46621 18.4482 10.7652 6.69515 17.9202 13.6589 6.21253 7.86572 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 6.68265 6.62991 7.55934 12.5941 6.69469 9.77552 13.4463 11.2397 7.65448 8.28642 numMergedOcc 0
7 mol 152 unq 1 iso 0 dist 7.78842 7.17016 7.55934 9.19078 6.69469 9.77552 11.3742 11.2397 7.65448 8.28642 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 4.79423 8.24478 5.90765 12.4674 9.28201 7.24795 16.1315 14.8324 9.41955 9.56197 numMergedOcc 0
9 mol 186 unq 1 iso 0 dist 4.79423 8.24478 5.90765 12.4674 9.28201 7.24795 19.5023 17.3863 13.684 8.64409 numMergedOcc 0
10 mol 186 unq 2 iso 0 dist 4.79423 8.24478 5.90765 12.4674 9.28201 7.24795 13.6898 13.011 9.45987 7.60202 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 7.56217 13.445 9.52922 8.63008 7.82899 6.26839 15.3582 11.2599 8.0179 8.12346 numMergedOcc 0
12 mol 194 unq 1 iso 0 dist 7.56217 13.445 9.52922 8.63008 7.82899 6.26839 10.977 14.7152 14.6506 8.83356 numMergedOcc 0
13 mol 194 unq 2 iso 0 dist 7.56217 13.445 9.52922 8.63008 7.82899 6.26839 16.6746 14.7929 8.48054 8.2654 numMergedOcc 0
14 mol 198 unq 0 iso 0 dist 7.94413 4.81051 6.77156 10.1253 13.3432 8.10985 10.8778 17.8926 11.6493 9.18635 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.46274 14.5108 9.06459 15.5549 13.3401 8.46327 19.8064 19.3882 12.7897 7.05523 numMergedOcc 0
