0 mol 1 unq 0 iso 0 dist 9.62879 10.0096 9.60596 15.0965 9.01148 8.26708 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.62879 10.0096 9.60596 15.7654 12.4943 6.09918 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 5.16345 5.77009 5.19692 8.21595 5.59189 8.7817 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 5.16345 5.77009 5.19692 9.60744 7.78507 7.55415 numMergedOcc 0
4 mol 42 unq 0 iso 0 dist 7.81641 7.15313 8.04465 15.2959 13.006 9.53458 numMergedOcc 0
5 mol 42 unq 1 iso 0 dist 7.81641 7.15313 8.04465 16.061 13.1762 9.16649 numMergedOcc 0
6 mol 44 unq 0 iso 0 dist 9.53901 15.0516 8.6578 14.2564 6.07691 7.52117 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.4658 8.42036 8.95491 14.3769 11.9657 6.49956 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 7.8034 11.8905 7.5344 9.33945 8.25445 8.86329 numMergedOcc 0
9 mol 131 unq 1 iso 0 dist 7.8034 11.8905 7.5344 14.2573 11.8349 8.71039 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 9.74966 12.127 5.29515 14.8137 7.12546 9.02318 numMergedOcc 0
11 mol 148 unq 1 iso 0 dist 9.74966 12.127 5.29515 19.8565 10.7866 9.74542 numMergedOcc 0
12 mol 148 unq 2 iso 0 dist 9.74966 12.127 5.29515 14.6724 5.2593 7.97543 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 9.87914 12.1375 5.16917 19.8733 10.734 9.6606 numMergedOcc 0
14 mol 150 unq 1 iso 0 dist 9.87914 12.1375 5.16917 14.7418 5.1918 7.85526 numMergedOcc 0
15 mol 150 unq 2 iso 0 dist 9.87914 12.1375 5.16917 14.7263 7.02896 8.94552 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 9.15574 15.5484 8.86912 14.2325 7.46358 5.38091 numMergedOcc 0
17 mol 156 unq 1 iso 0 dist 8.98636 17.4843 8.60938 24.7269 16.8259 9.43259 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 8.39634 6.49088 5.32236 13.5463 5.96451 8.0154 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.09373 7.56736 9.51006 13.4599 10.568 7.20574 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 8.09373 7.56736 9.51006 12.8237 11.1286 6.85302 numMergedOcc 0
21 mol 186 unq 2 iso 0 dist 8.40343 8.71876 9.05979 13.9001 7.10544 9.56197 numMergedOcc 0
22 mol 186 unq 3 iso 0 dist 8.40343 8.71876 9.05979 13.7557 10.591 7.24795 numMergedOcc 0
23 mol 186 unq 4 iso 0 dist 8.40343 8.71876 9.05979 10.812 8.86145 8.64409 numMergedOcc 0
24 mol 186 unq 5 iso 0 dist 8.40343 8.71876 9.05979 14.5593 10.8899 7.60202 numMergedOcc 0
25 mol 194 unq 0 iso 0 dist 5.69866 10.735 9.13708 9.68918 5.03763 6.26839 numMergedOcc 0
26 mol 194 unq 1 iso 0 dist 5.69866 10.735 9.13708 16.4654 12.8318 8.12346 numMergedOcc 0
27 mol 194 unq 2 iso 0 dist 5.69866 10.735 9.13708 15.4498 16.5287 8.83356 numMergedOcc 0
28 mol 194 unq 3 iso 0 dist 5.69866 10.735 9.13708 13.4844 11.4735 8.2654 numMergedOcc 0
29 mol 210 unq 0 iso 0 dist 9.26518 5.20757 8.53457 12.598 13.2569 7.63018 numMergedOcc 0
30 mol 220 unq 0 iso 0 dist 8.58709 6.71715 6.50846 6.21273 4.90657 5.45036 numMergedOcc 0
31 mol 248 unq 0 iso 0 dist 7.83878 10.4208 7.21518 12.7933 6.42363 6.77954 numMergedOcc 0
32 mol 252 unq 0 iso 0 dist 8.04265 11.199 6.88874 13.0796 5.26867 6.86945 numMergedOcc 0
33 mol 252 unq 1 iso 0 dist 9.42193 9.71846 6.88874 13.4304 5.26867 6.86945 numMergedOcc 0
