0 mol 34 unq 0 iso 0 dist 6.85305 6.71226 6.87871 10.1079 5.3372 6.17472 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 8.54845 12.3451 6.80741 17.1061 10.1759 8.23618 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.89021 14.4661 9.02288 20.0111 16.0086 6.99156 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.89021 14.4661 9.02288 12.649 4.91508 7.21285 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 9.89021 18.6603 9.58544 12.649 4.91508 6.95094 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 6.30103 7.30364 7.84888 9.46036 10.9352 4.85152 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 7.48277 5.51997 9.43411 11.479 10.3418 7.59973 numMergedOcc 0
7 mol 102 unq 1 iso 0 dist 9.0361 11.7098 9.01767 11.479 13.9809 9.61113 numMergedOcc 0
8 mol 102 unq 2 iso 0 dist 9.0361 11.7098 9.01767 11.8703 5.09542 7.73836 numMergedOcc 0
9 mol 102 unq 3 iso 0 dist 9.0361 5.51997 9.80678 11.479 13.9809 7.59973 numMergedOcc 0
10 mol 174 unq 0 iso 0 dist 4.93781 5.07406 8.76218 10.4881 11.932 8.67807 numMergedOcc 0
11 mol 174 unq 1 iso 0 dist 9.32818 10.8025 8.76218 17.2345 11.932 8.67807 numMergedOcc 0
12 mol 174 unq 2 iso 0 dist 7.03029 13.1688 8.76218 18.501 11.932 8.67807 numMergedOcc 0
13 mol 185 unq 0 iso 0 dist 9.03315 4.81985 8.04591 10.876 10.9948 6.11382 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 9.40003 10.6403 8.49704 9.40687 5.68711 5.69733 numMergedOcc 0
15 mol 214 unq 1 iso 0 dist 8.68385 15.7236 8.49704 12.8315 5.68711 5.69733 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 7.30244 11.8854 8.48112 19.3456 16.2851 7.96759 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 7.30244 11.8854 8.48112 11.0522 10.3576 8.94384 numMergedOcc 0
18 mol 220 unq 2 iso 0 dist 9.58343 12.1621 8.48112 18.2216 16.2851 7.96759 numMergedOcc 0
19 mol 220 unq 3 iso 0 dist 9.58343 12.1621 8.48112 15.7269 10.3576 8.94384 numMergedOcc 0
20 mol 220 unq 4 iso 0 dist 8.9077 15.8912 7.31105 16.3654 9.20027 4.3362 numMergedOcc 0
21 mol 222 unq 0 iso 0 dist 7.27481 4.56782 8.7347 6.19798 5.01062 7.10689 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 4.79841 6.4556 6.56437 8.27538 5.25583 4.99301 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 4.79841 5.66462 6.23882 8.27538 5.25583 6.36813 numMergedOcc 0
24 mol 224 unq 2 iso 0 dist 4.79841 9.46589 9.34636 14.1813 11.8217 7.7163 numMergedOcc 0
25 mol 224 unq 3 iso 0 dist 4.79841 9.46589 9.34636 13.1738 11.9904 9.06201 numMergedOcc 0
26 mol 276 unq 0 iso 0 dist 8.28881 4.48428 7.70061 7.07283 7.16212 7.35537 numMergedOcc 0
27 mol 276 unq 1 iso 0 dist 5.30976 4.48428 9.05218 7.07283 9.58401 7.35537 numMergedOcc 0
28 mol 279 unq 0 iso 0 dist 5.17586 5.72978 8.13489 8.06324 5.31331 8.66917 numMergedOcc 0
