0 mol 6 unq 0 iso 0 dist 8.74649 9.81304 9.82511 8.48886 6.76978 14.5161 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 8.96529 8.53244 6.1852 11.5235 8.18518 13.8602 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 6.97295 8.33265 10.4247 9.14995 8.85347 16.8654 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.49678 6.17165 6.47086 5.50758 8.89758 10.9423 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.04007 9.68339 6.32526 5.82571 6.87176 13.0736 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 5.04007 9.68339 6.32526 8.48982 7.45675 10.7402 numMergedOcc 0
6 mol 68 unq 2 iso 0 dist 6.60395 9.68339 11.4996 5.82571 5.57389 13.0736 numMergedOcc 0
7 mol 68 unq 3 iso 0 dist 5.68303 8.56621 9.86454 10.2854 9.7754 17.3037 numMergedOcc 0
8 mol 75 unq 0 iso 0 dist 6.76977 6.63403 4.391 6.54018 7.16583 9.5668 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 8.08674 9.39338 17.2592 9.08836 4.83274 16.806 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 8.08674 8.9053 15.1961 9.08836 4.83274 13.2454 numMergedOcc 0
11 mol 76 unq 2 iso 0 dist 8.33694 9.39338 11.7045 9.08836 7.89214 16.806 numMergedOcc 0
12 mol 76 unq 3 iso 0 dist 8.33694 8.9053 8.38148 9.08836 7.89214 13.2454 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 5.1232 6.9902 5.46236 12.0258 8.20865 8.25817 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 4.76168 8.33541 5.46236 5.58126 8.20865 8.25817 numMergedOcc 0
15 mol 132 unq 0 iso 0 dist 8.97036 9.4827 15.7512 13.8837 6.495 18.2309 numMergedOcc 0
16 mol 132 unq 1 iso 0 dist 8.97036 9.4827 15.7512 14.8844 9.43748 18.461 numMergedOcc 0
17 mol 132 unq 2 iso 0 dist 8.97036 9.0788 5.6296 13.8837 6.495 11.5642 numMergedOcc 0
18 mol 132 unq 3 iso 0 dist 8.97036 9.0788 5.6296 14.8844 9.43748 13.9285 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 6.73513 9.00763 6.89035 10.4602 6.57849 11.0135 numMergedOcc 0
20 mol 230 unq 0 iso 0 dist 7.50128 6.05795 4.32804 4.66984 9.10813 9.54235 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 7.73969 5.50501 10.1358 5.81354 6.73134 8.77254 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 5.50553 8.94629 11.8626 7.08073 7.46199 15.1009 numMergedOcc 0
23 mol 281 unq 0 iso 0 dist 5.53313 9.29634 6.32828 9.02336 9.65665 15.6837 numMergedOcc 0
24 mol 284 unq 0 iso 0 dist 6.05336 8.18785 6.69796 8.82631 7.2795 8.27793 numMergedOcc 0
25 mol 284 unq 1 iso 0 dist 6.05336 8.18785 6.69796 13.559 9.41428 10.8451 numMergedOcc 0
