0 mol 7 unq 0 iso 0 dist 8.85869 14.1047 9.85726 12.2583 10.4879 7.32392 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 7.72142 5.40044 8.47315 9.15653 10.2869 8.59049 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.17472 5.3372 6.87871 8.16211 5.41061 5.2422 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 8.52824 11.051 9.29873 15.1706 7.70339 9.76806 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 8.23618 10.1759 6.80741 15.7483 7.62116 9.77018 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 6.85094 7.15161 5.92705 9.65026 6.47853 9.70415 numMergedOcc 0
6 mol 61 unq 1 iso 0 dist 9.94756 18.7183 9.62468 23.9088 14.0458 9.70415 numMergedOcc 0
7 mol 111 unq 0 iso 0 dist 8.41868 10.9559 8.42147 19.1802 13.7393 9.04546 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 5.24519 5.34484 7.70533 9.14994 10.7285 7.0318 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 5.50364 5.29825 8.97145 9.12773 7.31861 8.99949 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 8.7301 5.29825 6.5874 9.12773 4.55152 8.99949 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 8.79185 5.59399 6.71202 10.9621 4.87536 9.68507 numMergedOcc 0
12 mol 174 unq 0 iso 0 dist 8.67807 11.932 8.76218 17.2385 12.3305 6.04817 numMergedOcc 0
13 mol 213 unq 0 iso 0 dist 8.84278 8.28789 4.58599 16.5217 8.82924 9.75141 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 4.3362 9.20027 7.31105 13.1043 9.98645 6.21273 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 4.21935 4.77446 6.37342 9.01934 5.39741 8.61729 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 5.66519 6.47697 5.78121 12.4798 7.82195 7.72708 numMergedOcc 0
17 mol 251 unq 0 iso 0 dist 9.22712 10.1343 9.94161 12.1808 9.21736 7.54763 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 6.59521 5.13233 8.58088 10.7357 7.42035 8.9706 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 5.96276 5.55516 5.90381 10.0651 4.96619 6.94113 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 5.68643 7.48637 9.91395 11.5007 9.91966 8.30175 numMergedOcc 0
21 mol 274 unq 1 iso 0 dist 7.59956 11.3084 9.02749 10.1819 4.84163 6.36173 numMergedOcc 0
22 mol 274 unq 2 iso 0 dist 8.05503 16.897 9.02749 11.481 4.84163 6.36173 numMergedOcc 0
23 mol 274 unq 3 iso 0 dist 5.59151 13.8866 9.02749 10.1489 4.84163 6.36173 numMergedOcc 0
24 mol 274 unq 4 iso 0 dist 8.17922 10.374 7.80446 13.3181 5.44831 8.30175 numMergedOcc 0
25 mol 276 unq 0 iso 0 dist 7.35537 7.16212 7.70061 13.7158 8.00091 9.64575 numMergedOcc 0
