0 mol 17 unq 0 iso 0 dist 9.52568 9.55169 11.7814 10.9885 17.0164 8.70792 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 9.15735 9.55169 14.955 10.9885 18.6263 8.70792 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 6.70575 4.82342 5.39129 7.34619 5.17241 7.68478 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 9.2044 8.37969 5.37608 8.23958 10.1466 9.45756 numMergedOcc 0
4 mol 52 unq 0 iso 0 dist 8.52059 8.52979 6.55558 10.7036 12.3355 6.22221 numMergedOcc 0
5 mol 52 unq 1 iso 0 dist 9.99694 8.52979 6.86126 10.7036 12.6812 6.22221 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 8.11268 7.09258 7.06403 10.7286 13.6423 6.62699 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 5.60664 7.28058 4.49951 10.273 6.8173 8.62079 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 6.8754 7.53748 5.14202 4.18108 7.93917 5.6125 numMergedOcc 0
9 mol 232 unq 0 iso 0 dist 7.38809 6.94983 13.6402 8.26136 13.3682 8.25985 numMergedOcc 0
10 mol 232 unq 1 iso 0 dist 7.38809 6.94983 13.6402 4.7723 9.7837 9.27788 numMergedOcc 0
11 mol 257 unq 0 iso 0 dist 6.82161 6.50405 5.86413 8.74714 11.1583 9.6834 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 9.41308 8.14812 5.09738 6.55101 8.64933 8.03012 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 9.62474 8.82941 18.4374 7.79913 14.9038 9.29666 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 8.01441 8.82941 5.928 7.79913 11.1772 9.29666 numMergedOcc 0
15 mol 294 unq 0 iso 0 dist 7.64578 6.45955 5.25596 8.3297 7.75936 8.88595 numMergedOcc 0
16 mol 294 unq 1 iso 0 dist 5.85292 5.71661 5.25596 4.63586 7.75936 8.88595 numMergedOcc 0
17 mol 294 unq 2 iso 0 dist 6.28096 6.45955 9.87129 8.3297 14.5805 8.88595 numMergedOcc 0
