0 mol 5 unq 0 iso 0 dist 6.96588 8.49537 14.8615 6.5186 9.94911 12.1496 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 6.96588 9.85529 9.74637 6.5186 9.94911 13.9652 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 9.20625 8.92334 4.23443 6.67638 7.37857 6.31089 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 9.20625 8.92334 4.23443 6.29954 4.7978 7.07502 numMergedOcc 0
4 mol 28 unq 2 iso 0 dist 8.33169 8.97167 11.0902 10.922 8.08195 17.6333 numMergedOcc 0
5 mol 28 unq 3 iso 0 dist 8.33169 8.97167 11.0902 5.18775 5.78587 11.5939 numMergedOcc 0
6 mol 28 unq 4 iso 0 dist 8.33169 8.8182 8.59089 10.922 8.08195 15.6673 numMergedOcc 0
7 mol 28 unq 5 iso 0 dist 8.33169 8.8182 8.59089 5.18775 5.78587 10.095 numMergedOcc 0
8 mol 30 unq 0 iso 0 dist 8.2071 5.82731 3.68767 4.35049 7.57624 5.85146 numMergedOcc 0
9 mol 30 unq 1 iso 0 dist 8.2071 5.82731 3.68767 17.4466 9.29609 12.5473 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 6.14769 9.13689 3.3085 11.0524 9.32166 11.3634 numMergedOcc 0
11 mol 120 unq 1 iso 0 dist 8.02616 9.13689 8.27043 11.0524 5.92729 11.3634 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 8.76341 9.58166 5.11518 15.4077 8.82299 12.296 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 5.1524 7.34765 3.38209 6.32847 5.70499 4.48699 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.14817 5.28634 11.8161 16.27 8.88404 18.6201 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 9.2828 8.76245 17.5486 11.9449 6.61386 20.4873 numMergedOcc 0
16 mol 159 unq 0 iso 0 dist 7.67418 8.61788 4.31404 4.92046 9.37298 8.12238 numMergedOcc 0
17 mol 159 unq 1 iso 0 dist 7.67418 8.61788 4.31404 9.94088 8.02691 11.5147 numMergedOcc 0
18 mol 165 unq 0 iso 0 dist 8.01191 9.54118 13.1897 5.79543 6.08508 14.6732 numMergedOcc 0
19 mol 230 unq 0 iso 0 dist 7.668 5.48736 3.83847 4.32828 7.74885 5.63025 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 4.79504 5.86945 4.62296 5.08257 8.48604 6.19029 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 4.79504 5.86945 4.62296 4.67807 9.35873 9.99655 numMergedOcc 0
