0 mol 18 unq 0 iso 0 dist 9.4649 8.95573 10.3579 7.81434 16.0569 9.74802 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.45965 8.95573 5.867 7.81434 4.70023 9.74802 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.2794 8.06918 11.9871 12.7403 15.484 8.82184 numMergedOcc 0
3 mol 94 unq 0 iso 0 dist 7.81363 5.80964 4.4432 7.27358 8.30482 9.09071 numMergedOcc 0
4 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 5.84146 8.22824 8.72056 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 8.47476 9.55297 5.65619 5.41269 6.4822 5.83972 numMergedOcc 0
6 mol 141 unq 1 iso 0 dist 6.74947 9.55297 15.8344 5.41269 11.496 5.83972 numMergedOcc 0
7 mol 194 unq 0 iso 0 dist 8.40769 9.20864 10.2713 15.0598 16.0471 6.29314 numMergedOcc 0
8 mol 197 unq 0 iso 0 dist 8.22331 6.58245 4.40086 7.6839 8.05227 9.47487 numMergedOcc 0
9 mol 212 unq 0 iso 0 dist 7.11204 6.11919 6.91212 7.19605 11.8479 6.80916 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 8.36772 5.34745 8.95188 8.39255 13.9301 9.13657 numMergedOcc 0
11 mol 233 unq 1 iso 0 dist 8.83541 5.34745 5.19341 8.39255 14.3143 9.13657 numMergedOcc 0
12 mol 233 unq 2 iso 0 dist 7.55878 5.34745 5.3674 8.39255 7.09902 9.13657 numMergedOcc 0
13 mol 233 unq 3 iso 0 dist 4.91191 7.99897 5.3674 6.69492 7.09902 9.13657 numMergedOcc 0
14 mol 233 unq 4 iso 0 dist 7.89581 8.98366 5.19341 15.1659 14.3143 9.13657 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 5.65943 7.54327 4.21173 6.00606 5.67249 5.99388 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 5.41373 6.89216 5.98329 6.24744 9.55737 6.21984 numMergedOcc 0
17 mol 248 unq 0 iso 0 dist 8.4908 7.96942 8.23532 4.54692 7.6899 8.33529 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 6.38338 8.70062 4.26276 12.463 12.9995 9.99897 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 6.38338 8.70062 4.26276 12.463 12.9995 9.99897 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 6.38338 8.70062 4.26276 12.463 12.9995 9.99897 numMergedOcc 0
