0 mol 7 unq 0 iso 0 dist 8.80895 6.64176 4.60206 6.70503 5.51421 5.99972 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.80895 6.64176 4.60206 7.6899 7.81271 9.68006 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 4.85282 6.02731 7.46975 4.05764 8.1599 4.74544 numMergedOcc 0
3 mol 65 unq 0 iso 0 dist 7.62028 8.70783 6.59475 10.8737 8.76461 6.72639 numMergedOcc 0
4 mol 65 unq 1 iso 0 dist 7.62028 9.20162 13.4516 10.8737 8.76461 15.6317 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 5.77675 5.86118 4.31746 6.45647 9.46247 11.6703 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 8.25884 8.59945 10.0241 5.82571 8.04256 12.1896 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 4.76012 7.98622 4.92611 8.48942 6.38163 7.58957 numMergedOcc 0
8 mol 171 unq 0 iso 0 dist 7.7195 8.53734 4.98945 11.071 6.07091 9.61462 numMergedOcc 0
9 mol 171 unq 1 iso 0 dist 8.30819 6.08141 4.98945 10.3893 6.07091 9.61462 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 8.91036 7.3879 7.6477 9.63894 8.1088 13.1713 numMergedOcc 0
11 mol 173 unq 1 iso 0 dist 8.91036 9.70728 5.04427 9.63894 8.1088 12.1236 numMergedOcc 0
12 mol 180 unq 0 iso 0 dist 5.78414 8.66298 4.11186 5.31 5.80441 5.85827 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 5.39622 8.28099 5.18732 5.01462 8.96988 10.6519 numMergedOcc 0
14 mol 212 unq 0 iso 0 dist 7.67675 7.89739 6.48939 5.19318 5.87223 8.69988 numMergedOcc 0
15 mol 212 unq 1 iso 0 dist 7.67675 6.12161 5.81626 5.19318 5.87223 8.55903 numMergedOcc 0
16 mol 212 unq 2 iso 0 dist 7.35349 8.06858 4.69067 10.1617 8.062 9.74144 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 9.60654 8.65088 7.43844 5.78711 9.13552 10.9206 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 8.15743 8.70651 6.36084 9.88635 7.70279 8.50102 numMergedOcc 0
19 mol 232 unq 1 iso 0 dist 8.15743 8.70651 6.36084 5.08111 9.29752 9.40808 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 5.67249 8.88567 6.06471 5.19951 7.46434 6.30154 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 5.67249 9.45787 11.1213 5.19951 7.46434 7.32499 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 5.1766 7.24253 3.87679 6.54531 6.86162 7.49645 numMergedOcc 0
23 mol 243 unq 1 iso 0 dist 5.1766 7.83742 10.9686 6.54531 6.86162 11.1208 numMergedOcc 0
24 mol 251 unq 0 iso 0 dist 8.3966 7.59626 4.01393 4.80531 8.39644 8.68707 numMergedOcc 0
25 mol 251 unq 1 iso 0 dist 5.34851 7.52286 4.01393 5.60154 8.39644 8.68707 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 6.84909 5.54272 6.08322 11.5692 9.64124 14.7209 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 6.84909 5.54272 6.08322 11.634 9.30668 14.0973 numMergedOcc 0
