0 mol 46 unq 0 iso 0 dist 9.14996 8.55031 16.7853 16.2136 24.303 9.7218 numMergedOcc 0
1 mol 46 unq 1 iso 0 dist 9.47718 8.55031 5.73909 16.2136 12.6287 9.7218 numMergedOcc 0
2 mol 46 unq 2 iso 0 dist 8.9459 8.55031 7.57955 16.2136 16.4178 9.7218 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 6.72531 7.40694 7.50273 5.05927 11.1779 8.40971 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 5.81747 8.69443 13.5189 5.43469 10.4432 7.37357 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 6.81975 8.69443 12.1252 5.43469 11.1823 7.37357 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 7.74131 8.71103 9.0655 7.96805 10.782 7.62846 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 7.84249 6.30128 9.10324 4.874 12.6205 9.45513 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.12336 8.63817 4.70999 12.4479 6.23615 8.43088 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 7.12336 6.23615 12.4479 4.70999 8.63817 8.43088 numMergedOcc 0
10 mol 183 unq 0 iso 0 dist 8.68085 7.38821 4.84477 5.24909 10.9642 9.59741 numMergedOcc 0
11 mol 183 unq 1 iso 0 dist 8.15747 9.92635 16.0056 13.9974 16.4218 8.74697 numMergedOcc 0
12 mol 183 unq 2 iso 0 dist 8.74903 9.86506 5.7389 11.1179 10.6152 9.59741 numMergedOcc 0
13 mol 183 unq 3 iso 0 dist 8.74903 7.85507 16.0056 10.3061 16.4218 8.74697 numMergedOcc 0
14 mol 183 unq 4 iso 0 dist 5.44125 9.92635 7.93856 13.9974 15.0972 8.74697 numMergedOcc 0
15 mol 183 unq 5 iso 0 dist 7.11505 9.86506 15.6656 11.1179 17.7732 9.59741 numMergedOcc 0
16 mol 183 unq 6 iso 0 dist 7.11505 7.85507 7.93856 10.3061 15.0972 8.74697 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 8.61427 6.2441 6.86057 6.63238 13.0044 8.73468 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 7.50665 4.90407 5.31797 3.75614 6.56262 6.41452 numMergedOcc 0
19 mol 234 unq 1 iso 0 dist 7.50665 6.56262 3.75614 5.31797 4.90407 6.41452 numMergedOcc 0
20 mol 256 unq 0 iso 0 dist 7.14598 9.37687 9.7941 5.57318 12.2411 9.7777 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 8.23739 8.43067 5.95774 11.5712 11.3109 6.75578 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.05363 5.98006 6.13878 5.30516 5.45793 6.13752 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 9.05363 5.45793 5.30516 5.45575 13.9549 9.29355 numMergedOcc 0
24 mol 259 unq 2 iso 0 dist 9.05363 5.45793 5.30516 7.04297 13.1503 7.87978 numMergedOcc 0
25 mol 259 unq 3 iso 0 dist 9.05363 5.45793 5.30516 6.13878 5.98006 6.13752 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 5.43053 3.90274 4.90213 8.18304 11.8868 8.14167 numMergedOcc 0
27 mol 278 unq 0 iso 0 dist 9.60643 6.97456 9.0771 4.50533 10.9843 5.12827 numMergedOcc 0
28 mol 278 unq 1 iso 0 dist 7.79408 6.97456 4.47399 4.50533 6.83278 5.12827 numMergedOcc 0
29 mol 278 unq 2 iso 0 dist 7.79408 6.83278 4.50533 4.47399 6.97456 5.12827 numMergedOcc 0
