0 mol 1 unq 0 iso 0 dist 7.68779 6.41817 11.8728 7.94217 14.9536 6.26921 numMergedOcc 0
1 mol 36 unq 0 iso 0 dist 7.34019 7.11464 6.11846 6.73215 10.6124 9.16388 numMergedOcc 0
2 mol 36 unq 1 iso 0 dist 8.43828 7.11464 7.3917 6.73215 14.0273 9.16388 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 7.16036 9.52676 4.55437 12.8173 9.34889 5.81645 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 7.51978 5.0478 4.29856 10.8539 10.042 9.20373 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 8.60577 5.39827 9.23414 9.60458 14.4962 5.67362 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 9.84668 7.35929 7.78153 3.62253 13.3625 9.40924 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 6.6606 8.14607 9.12845 6.56112 10.1583 8.38855 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.28737 6.25276 4.3931 13.6156 5.56964 9.61367 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 5.09688 8.22984 9.75737 5.65432 9.56324 6.36749 numMergedOcc 0
10 mol 100 unq 1 iso 0 dist 9.91446 6.6157 7.16919 6.03516 12.9385 6.36749 numMergedOcc 0
11 mol 100 unq 2 iso 0 dist 9.26343 6.6157 9.75737 6.03516 9.56324 6.36749 numMergedOcc 0
12 mol 125 unq 0 iso 0 dist 8.38646 8.6317 9.20086 11.1148 13.7275 8.2793 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 4.93035 9.14007 7.42649 11.026 12.7314 8.61279 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 9.75558 9.14007 9.43674 11.026 16.928 8.61279 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.03567 9.01369 5.4141 3.88154 5.16813 5.77158 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 7.92766 6.21588 5.86489 10.0976 11.513 6.62013 numMergedOcc 0
17 mol 204 unq 1 iso 0 dist 6.32652 6.21588 11.2903 10.0976 15.4761 6.62013 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 9.93154 5.87056 6.00424 5.92389 15.2006 9.90065 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 9.93154 9.84311 10.7656 7.61598 14.1483 6.65275 numMergedOcc 0
20 mol 227 unq 2 iso 0 dist 9.93154 8.85568 10.3825 9.94292 17.4008 8.91452 numMergedOcc 0
21 mol 227 unq 3 iso 0 dist 9.18218 5.87056 9.76735 5.92389 14.5325 9.90065 numMergedOcc 0
22 mol 227 unq 4 iso 0 dist 9.18218 9.84311 5.10635 7.61598 9.8971 6.65275 numMergedOcc 0
23 mol 227 unq 5 iso 0 dist 9.18218 8.85568 8.86483 9.94292 15.1507 8.91452 numMergedOcc 0
24 mol 227 unq 6 iso 0 dist 6.18486 5.87056 9.32448 5.92389 11.3124 9.90065 numMergedOcc 0
25 mol 227 unq 7 iso 0 dist 6.18486 9.84311 6.48027 7.61598 7.71761 6.65275 numMergedOcc 0
26 mol 227 unq 8 iso 0 dist 6.18486 8.85568 6.67321 9.94292 10.8929 8.91452 numMergedOcc 0
