0 mol 70 unq 0 iso 0 dist 6.13606 8.63204 8.92835 5.06146 8.42287 9.19079 numMergedOcc 0
1 mol 70 unq 1 iso 0 dist 6.13606 5.4014 5.07553 5.06146 8.42287 8.37742 numMergedOcc 0
2 mol 70 unq 2 iso 0 dist 8.42287 9.19079 8.92835 5.06146 6.13606 8.63204 numMergedOcc 0
3 mol 70 unq 3 iso 0 dist 8.42287 8.37742 5.07553 5.06146 6.13606 5.4014 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 6.14674 6.99586 6.48115 5.56318 6.15011 10.987 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.21813 5.91797 3.92737 12.706 7.89276 9.93764 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.21813 6.37954 3.94967 12.706 7.89276 10.0215 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 7.35647 9.47287 10.5637 7.12648 4.88366 13.9934 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 5.08086 8.8639 5.75739 10.5002 9.29665 14.2909 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 5.08086 7.32009 5.46083 10.5002 9.29665 14.7484 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 6.08299 7.76446 11.5269 11.0847 7.85849 18.4308 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 6.08299 6.14652 6.93712 11.0847 7.85849 14.395 numMergedOcc 0
12 mol 169 unq 0 iso 0 dist 9.03552 5.30818 7.33583 13.0819 8.59976 8.89822 numMergedOcc 0
13 mol 169 unq 1 iso 0 dist 5.77897 5.30818 3.95773 13.0819 9.71763 8.89822 numMergedOcc 0
14 mol 169 unq 2 iso 0 dist 8.59976 8.89822 7.33583 13.0819 9.03552 5.30818 numMergedOcc 0
15 mol 169 unq 3 iso 0 dist 9.71763 8.89822 3.95773 13.0819 5.77897 5.30818 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 6.19189 6.04336 3.78314 10.9361 8.34668 11.5802 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 6.19189 9.00537 4.03697 10.9361 8.34668 8.9388 numMergedOcc 0
18 mol 186 unq 2 iso 0 dist 8.34668 8.9388 4.03697 10.9361 6.19189 9.00537 numMergedOcc 0
19 mol 217 unq 0 iso 0 dist 5.88992 9.41353 11.304 5.46432 5.19677 13.3642 numMergedOcc 0
20 mol 217 unq 1 iso 0 dist 5.88992 9.41353 11.304 7.23953 8.94906 16.4902 numMergedOcc 0
21 mol 217 unq 2 iso 0 dist 5.88992 8.28155 9.98266 5.46432 5.19677 10.084 numMergedOcc 0
22 mol 217 unq 3 iso 0 dist 5.88992 8.28155 9.98266 7.23953 8.94906 15.167 numMergedOcc 0
23 mol 217 unq 4 iso 0 dist 5.19677 7.83824 4.17047 5.46432 5.88992 9.69921 numMergedOcc 0
24 mol 217 unq 5 iso 0 dist 5.19677 7.83824 4.17047 6.97933 8.94906 10.2988 numMergedOcc 0
25 mol 226 unq 0 iso 0 dist 8.31751 8.34875 5.99712 7.66467 9.37981 11.7943 numMergedOcc 0
