0 mol 28 unq 0 iso 0 dist 5.87633 6.02451 5.32719 8.42277 6.77926 8.75468 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 5.87633 6.02451 5.32719 8.46493 3.85555 7.62989 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 5.87633 6.02451 5.32719 11.2567 7.50035 5.70238 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 9.96522 12.2276 7.40997 7.62814 4.04498 5.85153 numMergedOcc 0
4 mol 175 unq 0 iso 0 dist 8.09309 6.49088 9.02096 7.19751 3.92978 7.6741 numMergedOcc 0
5 mol 184 unq 0 iso 0 dist 8.49577 6.30834 9.66132 7.72354 4.57656 9.12454 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 7.6409 5.37893 7.95201 7.62945 5.28021 8.46395 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 7.6409 8.43547 9.39908 7.62945 5.28021 6.08596 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 8.50367 12.0187 8.37216 12.8375 4.68656 9.0259 numMergedOcc 0
9 mol 210 unq 1 iso 0 dist 8.50367 7.2193 5.6524 13.6273 7.85817 8.83523 numMergedOcc 0
10 mol 210 unq 2 iso 0 dist 8.94889 14.7047 8.37216 13.2134 4.68656 9.0259 numMergedOcc 0
11 mol 210 unq 3 iso 0 dist 8.94889 5.20757 5.6524 8.44451 7.85817 8.83523 numMergedOcc 0
12 mol 223 unq 0 iso 0 dist 7.96628 5.88785 8.51763 10.3825 4.62342 8.95054 numMergedOcc 0
13 mol 223 unq 1 iso 0 dist 7.76053 5.88785 5.57309 10.3825 3.38678 8.95054 numMergedOcc 0
14 mol 223 unq 2 iso 0 dist 9.65728 5.04647 5.57309 12.9153 3.38678 8.95054 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 9.32781 10.1088 9.88392 15.2056 13.6216 6.31092 numMergedOcc 0
16 mol 230 unq 1 iso 0 dist 7.66323 7.81136 9.88392 13.2647 13.6216 6.31092 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 8.81929 15.7135 9.67749 13.1308 8.96804 9.2182 numMergedOcc 0
18 mol 250 unq 0 iso 0 dist 9.04888 6.87023 7.78686 12.8774 11.4515 7.5999 numMergedOcc 0
19 mol 250 unq 1 iso 0 dist 9.04888 6.87023 7.78686 16.1479 11.6986 9.50976 numMergedOcc 0
20 mol 250 unq 2 iso 0 dist 9.04888 6.15228 9.59145 12.8774 11.4515 7.1454 numMergedOcc 0
21 mol 281 unq 0 iso 0 dist 7.76659 7.48529 8.81001 10.8558 7.72809 8.2659 numMergedOcc 0
