0 mol 62 unq 0 iso 0 dist 8.32519 6.7153 8.1717 8.33049 6.35779 5.56678 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 7.51631 7.59475 6.82511 9.04231 5.57551 3.95228 numMergedOcc 0
2 mol 113 unq 0 iso 0 dist 6.36631 12.6498 6.38269 8.77924 7.96893 12.0115 numMergedOcc 0
3 mol 136 unq 0 iso 0 dist 8.65282 6.88498 6.99374 5.12719 8.59512 4.90618 numMergedOcc 0
4 mol 169 unq 0 iso 0 dist 6.85177 4.40805 9.3206 9.83306 7.50458 13.9828 numMergedOcc 0
5 mol 180 unq 0 iso 0 dist 5.70326 6.9926 9.84484 4.10999 6.91244 10.4843 numMergedOcc 0
6 mol 257 unq 0 iso 0 dist 6.73777 12.73 9.12546 14.832 9.82105 9.11516 numMergedOcc 0
7 mol 257 unq 1 iso 0 dist 6.73777 12.1363 8.71617 14.832 9.82105 12.611 numMergedOcc 0
8 mol 258 unq 0 iso 0 dist 8.82533 13.622 8.95095 5.1755 9.60767 12.7366 numMergedOcc 0
9 mol 277 unq 0 iso 0 dist 7.73997 4.8947 7.88615 13.5843 8.75619 10.5169 numMergedOcc 0
10 mol 277 unq 1 iso 0 dist 7.73997 4.8947 7.88615 12.0948 5.79925 12.8601 numMergedOcc 0
11 mol 277 unq 2 iso 0 dist 7.73997 4.8947 7.88615 4.16246 8.55906 8.85294 numMergedOcc 0
12 mol 277 unq 3 iso 0 dist 7.73997 4.8947 7.88615 6.69623 5.55523 4.2416 numMergedOcc 0
13 mol 281 unq 0 iso 0 dist 7.5689 13.6398 9.22428 4.63172 9.13909 16.6962 numMergedOcc 0
14 mol 281 unq 1 iso 0 dist 7.5689 13.6398 9.22428 7.02463 4.29351 6.85714 numMergedOcc 0
15 mol 281 unq 2 iso 0 dist 7.5689 4.42659 7.95687 4.63172 9.13909 9.0331 numMergedOcc 0
16 mol 281 unq 3 iso 0 dist 7.5689 4.42659 7.95687 7.02463 4.29351 5.28494 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 8.95073 8.11806 5.64165 7.72208 8.19757 4.30784 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 5.80835 6.92022 4.97488 4.7967 8.85506 10.841 numMergedOcc 0
19 mol 292 unq 1 iso 0 dist 5.80835 6.45352 8.80146 4.7967 8.85506 10.3918 numMergedOcc 0
