0 mol 7 unq 0 iso 0 dist 7.32392 7.20175 7.5706 15.1166 13.6105 8.48947 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 9.28932 8.50298 5.61656 14.4976 7.87571 7.02425 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 9.28932 12.5461 7.22242 14.4976 7.87571 7.69972 numMergedOcc 0
3 mol 30 unq 2 iso 0 dist 7.53042 7.22668 5.61656 11.9474 7.87571 7.02425 numMergedOcc 0
4 mol 30 unq 3 iso 0 dist 7.53042 5.11873 7.22242 11.9474 7.87571 7.69972 numMergedOcc 0
5 mol 30 unq 4 iso 0 dist 6.83481 8.50298 6.95343 14.4976 9.62374 7.02425 numMergedOcc 0
6 mol 30 unq 5 iso 0 dist 7.47342 6.94189 7.27268 9.81709 6.54878 5.77851 numMergedOcc 0
7 mol 30 unq 6 iso 0 dist 7.47342 6.94189 7.27268 11.1249 5.53425 8.41189 numMergedOcc 0
8 mol 30 unq 7 iso 0 dist 7.47342 6.94189 7.27268 12.45 5.62773 9.21122 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 6.56728 6.48722 5.62635 11.6278 5.59906 8.67263 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 6.56728 6.48722 5.62635 9.64389 5.48575 6.79353 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 6.56728 6.48722 5.62635 12.9609 8.75957 8.60897 numMergedOcc 0
12 mol 86 unq 0 iso 0 dist 7.35763 7.83371 7.73058 12.563 9.06034 6.15557 numMergedOcc 0
13 mol 86 unq 1 iso 0 dist 8.40609 11.4177 6.81209 10.6594 5.9022 6.15557 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 8.62648 10.2909 6.69217 14.5947 8.84069 6.16682 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 8.34737 5.64218 7.74216 6.91511 4.55687 5.98313 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 9.75141 13.512 8.96646 21.1371 13.4142 8.52247 numMergedOcc 0
17 mol 219 unq 0 iso 0 dist 6.8424 10.7226 8.69579 16.0058 11.1178 6.83121 numMergedOcc 0
18 mol 229 unq 0 iso 0 dist 5.00457 7.23814 7.38552 10.3383 7.22525 7.8168 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 6.83046 5.86234 5.45139 15.0086 10.3 9.50048 numMergedOcc 0
