0 mol 34 unq 0 iso 0 dist 9.10681 5.27829 5.68877 9.67615 5.55479 8.73415 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 7.40218 4.33582 8.35366 5.02755 5.87258 8.76163 numMergedOcc 0
2 mol 44 unq 1 iso 0 dist 7.40218 4.88924 8.69829 5.02755 5.87258 8.72795 numMergedOcc 0
3 mol 44 unq 2 iso 0 dist 6.9327 8.53366 7.41011 5.60618 9.99671 6.99174 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 8.06502 10.8072 6.04611 9.96015 6.90069 3.44873 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 9.17333 4.05045 6.59749 11.2845 6.91511 7.4198 numMergedOcc 0
6 mol 192 unq 0 iso 0 dist 6.55345 9.11877 9.9224 6.3479 9.62225 3.81315 numMergedOcc 0
7 mol 220 unq 0 iso 0 dist 7.10646 8.12353 6.64341 4.48277 9.94612 7.79226 numMergedOcc 0
8 mol 220 unq 1 iso 0 dist 7.10646 10.6332 7.31315 4.48277 9.94612 11.122 numMergedOcc 0
9 mol 259 unq 0 iso 0 dist 5.80603 6.00285 5.16838 5.13757 6.95658 9.54522 numMergedOcc 0
10 mol 274 unq 0 iso 0 dist 7.86884 4.23871 6.8693 11.8328 9.00595 11.0896 numMergedOcc 0
11 mol 274 unq 1 iso 0 dist 7.86884 4.23871 6.8693 15.3165 9.40401 15.4174 numMergedOcc 0
12 mol 279 unq 0 iso 0 dist 5.15432 9.33832 7.35799 9.50243 5.41277 6.32559 numMergedOcc 0
13 mol 279 unq 1 iso 0 dist 8.2375 13.7765 7.35799 10.2744 5.41277 6.32559 numMergedOcc 0
14 mol 279 unq 2 iso 0 dist 9.23951 11.1553 7.35799 9.14765 5.41277 6.32559 numMergedOcc 0
15 mol 280 unq 0 iso 0 dist 7.11605 4.35391 4.26671 9.85019 6.16546 5.55901 numMergedOcc 0
16 mol 283 unq 0 iso 0 dist 7.11407 3.85698 9.69083 9.46362 8.39635 12.9436 numMergedOcc 0
17 mol 283 unq 1 iso 0 dist 7.11407 7.85589 5.96202 9.46362 8.39635 3.77125 numMergedOcc 0
18 mol 283 unq 2 iso 0 dist 7.11407 10.1709 9.55068 9.46362 8.39635 11.2772 numMergedOcc 0
