0 mol 16 unq 0 iso 0 dist 6.31157 6.03921 8.7585 5.02127 6.86324 7.48255 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 8.58489 7.5289 8.33265 9.3844 9.29842 12.1679 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 5.11663 6.81855 6.70575 5.45587 4.82342 5.39129 numMergedOcc 0
3 mol 38 unq 1 iso 0 dist 9.55714 7.85579 6.70575 4.95113 4.82342 5.39129 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 7.32126 5.99558 9.2044 6.124 8.37969 5.37608 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 7.7946 15.7034 8.01128 15.403 9.58693 9.30656 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 7.7946 15.7034 8.01128 9.57791 9.48388 14.8937 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 9.47443 7.43027 6.11155 11.152 6.37427 6.31152 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 9.47443 6.28463 5.77755 11.152 6.37427 5.81666 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 7.82774 7.43569 9.63478 5.61003 9.45717 11.1611 numMergedOcc 0
10 mol 228 unq 0 iso 0 dist 7.4244 13.7298 9.89425 4.91976 8.89311 10.9632 numMergedOcc 0
11 mol 228 unq 1 iso 0 dist 7.21082 6.6167 9.89425 4.70843 8.89311 10.9632 numMergedOcc 0
12 mol 264 unq 0 iso 0 dist 5.21387 5.7123 5.11475 7.50444 6.66602 5.11257 numMergedOcc 0
13 mol 294 unq 0 iso 0 dist 8.79534 6.06378 5.85292 9.13951 5.71661 5.25596 numMergedOcc 0
14 mol 294 unq 1 iso 0 dist 8.79534 6.06378 5.85292 10.409 8.98536 5.28447 numMergedOcc 0
15 mol 294 unq 2 iso 0 dist 6.18078 12.2573 7.64578 9.48026 6.45955 5.25596 numMergedOcc 0
16 mol 294 unq 3 iso 0 dist 6.18078 12.2573 7.64578 13.5893 8.86937 5.28447 numMergedOcc 0
17 mol 294 unq 4 iso 0 dist 6.18078 9.52905 6.28096 9.48026 6.45955 9.87129 numMergedOcc 0
18 mol 294 unq 5 iso 0 dist 6.18078 9.52905 6.28096 13.5893 8.86937 10.5605 numMergedOcc 0
19 mol 294 unq 6 iso 0 dist 6.78706 12.2573 5.85292 9.48026 5.71661 5.25596 numMergedOcc 0
20 mol 294 unq 7 iso 0 dist 6.78706 12.2573 5.85292 13.5893 8.98536 5.28447 numMergedOcc 0
