0 mol 21 unq 0 iso 0 dist 5.27589 6.51606 6.9745 8.36356 7.30397 3.89106 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 9.27422 13.5788 9.37221 5.22384 9.19374 12.7266 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.23755 17.4754 8.83749 15.0981 6.82707 4.20036 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 7.40582 6.74546 8.20203 16.1172 8.96747 16.4758 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 6.7095 11.1681 9.43068 11.7136 9.2062 13.5663 numMergedOcc 0
5 mol 128 unq 0 iso 0 dist 7.94925 8.39849 8.2617 5.8344 6.51968 5.9373 numMergedOcc 0
6 mol 128 unq 1 iso 0 dist 7.94925 8.39849 8.2617 10.172 7.61237 14.6652 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 6.85063 9.0716 9.95567 4.11976 8.40219 6.01719 numMergedOcc 0
8 mol 226 unq 0 iso 0 dist 6.3687 10.2359 7.59794 6.62409 5.3747 5.50401 numMergedOcc 0
9 mol 236 unq 0 iso 0 dist 5.46484 13.2282 9.48237 5.69026 8.88405 13.9605 numMergedOcc 0
10 mol 236 unq 1 iso 0 dist 5.46484 13.2282 9.48237 8.22446 7.13854 10.5345 numMergedOcc 0
11 mol 236 unq 2 iso 0 dist 8.80671 5.43533 9.48237 11.4601 8.88405 13.9605 numMergedOcc 0
12 mol 236 unq 3 iso 0 dist 8.80671 5.43533 9.48237 6.4298 7.13854 10.5345 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 6.20998 5.03854 9.03645 7.30886 6.77259 5.47931 numMergedOcc 0
14 mol 285 unq 0 iso 0 dist 4.49395 10.5523 8.84177 9.67478 6.46935 8.7298 numMergedOcc 0
