0 mol 1 unq 0 iso 0 dist 8.47429 9.35554 14.6429 5.99543 12.7552 9.00903 12.7135 17.6078 5.42625 9.72202 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 6.48746 9.56181 4.96726 7.70414 8.99491 9.67592 9.41957 4.69203 7.26966 8.75668 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.91797 9.49626 5.6722 15.643 14.1497 9.65964 13.8039 10.2615 5.43139 9.74802 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 6.82522 8.07365 5.33325 14.1188 9.65047 7.27724 19.6395 16.8321 12.0894 9.64673 numMergedOcc 0
4 mol 95 unq 1 iso 0 dist 9.89353 6.86713 5.69671 9.70895 9.65047 8.03644 19.349 16.8321 16.4832 9.64673 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 6.26722 8.66715 12.7925 14.0905 18.2779 7.11802 8.58727 14.3686 5.34829 9.47554 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 6.26722 9.00172 12.7637 13.2145 14.4659 6.29155 8.61597 6.37933 9.74121 8.97762 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 6.26722 9.00172 12.7637 14.0905 18.2779 8.00618 8.58727 14.3686 9.67676 9.47554 numMergedOcc 0
8 mol 133 unq 3 iso 0 dist 5.63173 8.95433 5.36939 11.0811 10.8427 7.11802 14.171 9.79179 5.34829 9.47554 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.49649 5.79157 6.36794 13.0109 9.55556 9.86662 15.3362 10.971 9.66197 9.16358 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 8.49649 5.79157 6.36794 14.1608 12.1043 9.71307 15.3362 10.971 9.66197 6.48328 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 8.95136 9.25882 10.6076 9.40714 8.87534 7.80463 11.5853 4.06506 9.67882 8.52924 numMergedOcc 0
12 mol 209 unq 0 iso 0 dist 6.3344 5.92907 4.1329 5.35615 10.2865 7.56373 8.9906 9.9501 8.42394 9.62543 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 6.79115 5.77925 4.38595 8.93012 9.89665 6.84306 8.74211 4.93347 5.03564 6.61371 numMergedOcc 0
14 mol 236 unq 1 iso 0 dist 6.79115 5.77925 4.38595 12.1686 14.0991 9.99038 16.2516 17.9571 13.6195 5.90804 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 4.92572 7.38315 9.71999 10.6994 14.983 7.32223 10.7957 13.0856 5.32928 8.82388 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.45685 9.2067 11.716 9.88911 15.0351 6.42289 15.0241 15.9256 5.90131 9.04358 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 8.07113 9.80409 4.49913 6.39263 9.73983 8.45658 7.43425 5.96176 6.75336 7.00833 numMergedOcc 0
