0 mol 44 unq 0 iso 0 dist 5.81645 5.51351 7.48846 10.0155 6.30672 7.42925 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.93628 10.8019 9.49774 13.1264 4.49937 9.47699 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 6.48163 4.76916 5.50508 11.3414 5.97684 8.66742 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 6.04768 4.81103 7.14031 8.87856 11.3708 4.94406 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 6.04768 4.81103 7.14031 6.2491 7.43547 7.2337 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 9.40173 7.22196 7.14031 11.3126 11.3708 4.94406 numMergedOcc 0
6 mol 98 unq 3 iso 0 dist 9.40173 7.22196 7.14031 3.59451 7.43547 7.2337 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 9.66995 6.21679 5.75014 14.4372 7.74959 9.1593 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 7.03339 5.54999 7.80873 12.1635 9.59885 9.69961 numMergedOcc 0
9 mol 125 unq 0 iso 0 dist 8.2793 5.61158 6.33431 14.775 12.5885 9.2657 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 8.32841 6.07262 5.9976 6.47989 5.46268 8.32227 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 6.00295 6.07262 6.86566 6.47989 4.78734 8.32227 numMergedOcc 0
12 mol 156 unq 2 iso 0 dist 6.56065 6.25291 5.9976 9.91857 5.46268 8.32227 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 9.87543 8.33986 9.7361 11.6948 8.75377 9.25835 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 6.65725 4.84884 7.54099 5.13722 8.44389 5.0207 numMergedOcc 0
15 mol 256 unq 0 iso 0 dist 9.31961 12.3321 6.00636 8.11884 6.82173 7.40057 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 7.88238 13.008 8.20644 9.42812 5.10104 5.92532 numMergedOcc 0
