0 mol 27 unq 0 iso 0 dist 9.62305 8.16102 10.9668 11.3937 9.77484 9.64797 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 9.62318 9.2795 4.84198 13.2245 8.68559 8.91596 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 8.71991 7.45026 9.67572 13.8549 8.39016 16.2909 numMergedOcc 0
3 mol 90 unq 1 iso 0 dist 8.71991 7.45026 9.67572 10.226 6.99355 15.0154 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 6.41992 8.29395 3.98398 5.78487 9.38288 12.5872 numMergedOcc 0
5 mol 119 unq 1 iso 0 dist 8.15125 8.29395 10.1947 5.78487 6.19042 12.5872 numMergedOcc 0
6 mol 119 unq 2 iso 0 dist 8.15125 8.29395 10.1947 13.4592 8.43904 17.1696 numMergedOcc 0
7 mol 187 unq 0 iso 0 dist 9.1091 8.17194 4.87462 10.643 9.27478 11.9848 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 8.15486 8.42665 7.69353 5.64431 8.36822 11.4498 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 7.48163 6.13687 6.76174 5.80113 7.21533 9.76973 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 9.76751 8.50234 8.20163 7.37147 9.59333 12.6443 numMergedOcc 0
11 mol 256 unq 0 iso 0 dist 7.54244 3.62582 8.80744 9.41321 5.24676 11.7308 numMergedOcc 0
12 mol 256 unq 1 iso 0 dist 7.54244 3.62582 8.80744 7.29128 8.09363 9.98542 numMergedOcc 0
13 mol 276 unq 0 iso 0 dist 7.3327 9.97709 3.71137 11.6308 9.38971 10.8848 numMergedOcc 0
14 mol 276 unq 1 iso 0 dist 7.3327 9.97709 3.71137 4.73253 8.71541 10.906 numMergedOcc 0
15 mol 276 unq 2 iso 0 dist 7.3327 9.97709 3.71137 5.75852 8.76347 12.1756 numMergedOcc 0
