0 mol 1 unq 0 iso 0 dist 9.83016 7.08802 4.02997 8.55986 11.0512 9.76947 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 7.18305 7.27086 4.44905 9.49815 11.2457 13.8309 numMergedOcc 0
2 mol 63 unq 1 iso 0 dist 7.18305 7.45058 6.25029 9.49815 11.2457 8.56126 numMergedOcc 0
3 mol 128 unq 0 iso 0 dist 7.44522 8.2617 10.3732 9.52878 11.5809 8.36211 numMergedOcc 0
4 mol 128 unq 1 iso 0 dist 7.37469 8.2617 9.77148 9.52878 8.56151 8.36211 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 4.4004 8.18035 3.97743 9.24258 6.68239 7.56409 numMergedOcc 0
6 mol 131 unq 1 iso 0 dist 4.4004 8.18035 3.97743 9.55246 7.74794 9.47173 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 5.60304 9.95567 7.75436 8.64606 12.2185 15.912 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 9.81785 8.66775 9.42376 7.89425 8.67242 7.76905 numMergedOcc 0
9 mol 176 unq 1 iso 0 dist 9.81785 8.66775 9.42376 8.36552 7.48392 5.22451 numMergedOcc 0
10 mol 176 unq 2 iso 0 dist 9.81785 8.66775 9.42376 7.8954 16.2744 15.212 numMergedOcc 0
11 mol 180 unq 0 iso 0 dist 9.96844 9.72941 7.68826 8.78619 16.5901 16.6015 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 4.19953 9.2295 5.77981 5.64008 3.88329 5.06301 numMergedOcc 0
13 mol 183 unq 1 iso 0 dist 4.19953 9.2295 5.77981 6.44683 4.79561 9.23722 numMergedOcc 0
14 mol 183 unq 2 iso 0 dist 8.51822 9.2295 11.6069 5.64008 7.4851 5.06301 numMergedOcc 0
15 mol 183 unq 3 iso 0 dist 8.51822 9.2295 11.6069 6.44683 5.24909 9.23722 numMergedOcc 0
16 mol 211 unq 0 iso 0 dist 9.53956 9.03554 11.6045 7.79873 7.9703 11.4935 numMergedOcc 0
17 mol 211 unq 1 iso 0 dist 9.53956 8.19203 12.4494 7.79873 7.9703 13.8833 numMergedOcc 0
18 mol 256 unq 0 iso 0 dist 5.04445 6.06606 6.78978 8.13647 9.74403 9.74361 numMergedOcc 0
19 mol 268 unq 0 iso 0 dist 6.39171 7.96508 12.1944 6.65505 3.5334 13.1353 numMergedOcc 0
20 mol 282 unq 0 iso 0 dist 5.54546 6.05687 4.22263 7.66682 8.64534 8.36397 numMergedOcc 0
