0 mol 7 unq 0 iso 0 dist 8.80895 9.04663 13 6.64176 4.60206 10.0658 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.00876 9.04663 10.587 6.64176 4.05107 10.0658 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 4.85282 8.9629 5.0413 6.02731 7.46975 7.97193 numMergedOcc 0
3 mol 65 unq 0 iso 0 dist 9.19964 9.62658 10.6022 9.4508 4.01708 7.25966 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.18358 7.10351 6.32618 7.54919 4.22631 9.33125 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 4.3761 6.91361 3.92844 9.66226 11.2155 14.6934 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.84583 6.91361 10.8121 9.66226 9.51607 14.6934 numMergedOcc 0
7 mol 171 unq 0 iso 0 dist 8.30819 9.08829 13.9427 6.08141 4.98945 9.85607 numMergedOcc 0
8 mol 171 unq 1 iso 0 dist 8.30819 5.94881 14.0377 6.08141 4.98945 11.6944 numMergedOcc 0
9 mol 173 unq 0 iso 0 dist 8.91036 7.38163 15.0429 7.3879 7.6477 9.52796 numMergedOcc 0
10 mol 173 unq 1 iso 0 dist 8.91036 7.38163 15.0429 9.70728 5.04427 15.1357 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 5.39622 9.12102 11.5511 8.28099 5.18732 11.8992 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 7.67675 6.99065 9.6542 7.89739 6.48939 7.75271 numMergedOcc 0
13 mol 212 unq 1 iso 0 dist 7.67675 6.99065 9.6542 6.12161 5.81626 4.01146 numMergedOcc 0
14 mol 212 unq 2 iso 0 dist 7.67675 5.90507 8.90296 7.89739 6.48939 4.21442 numMergedOcc 0
15 mol 212 unq 3 iso 0 dist 7.67675 5.90507 8.90296 6.12161 5.81626 6.69225 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 8.73545 9.63438 5.72267 5.83278 11.4985 12.2675 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 8.14581 9.63438 13.5353 5.83278 5.74726 12.2675 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 8.79012 7.31866 14.3006 7.23618 7.55193 8.3719 numMergedOcc 0
19 mol 260 unq 1 iso 0 dist 8.79012 5.6002 7.23536 7.23618 7.55193 5.52447 numMergedOcc 0
20 mol 292 unq 0 iso 0 dist 6.84909 9.97806 9.67324 5.54272 6.08322 7.0085 numMergedOcc 0
