0 mol 9 unq 0 iso 0 dist 8.48677 13.4414 6.59312 13.208 5.67536 6.11048 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.48677 13.4414 6.59312 10.069 6.96891 8.14998 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 6.35398 10.7048 9.81983 14.7815 10.7734 6.84216 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 9.01567 8.92779 7.03544 11.0194 4.50066 4.7841 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.4051 6.7846 7.85986 5.54419 5.11617 8.23075 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 8.4051 8.03955 4.30252 5.54419 5.11617 4.7841 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 7.29868 13.7992 7.85986 11.0194 5.11617 8.23075 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 7.29868 8.92779 4.30252 11.0194 5.11617 4.7841 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 8.60554 13.2846 7.85986 13.2433 5.11617 8.23075 numMergedOcc 0
9 mol 24 unq 6 iso 0 dist 8.60554 12.3897 4.30252 13.2433 5.11617 4.7841 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 8.80614 4.59417 6.41008 6.86465 10.2049 9.23438 numMergedOcc 0
11 mol 58 unq 1 iso 0 dist 8.80614 4.59417 6.41008 6.35756 5.49591 7.17488 numMergedOcc 0
12 mol 58 unq 2 iso 0 dist 8.80614 4.59417 6.41008 10.3224 5.85698 6.79356 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 9.66219 13.0914 5.35711 5.86073 8.42718 9.59585 numMergedOcc 0
14 mol 168 unq 0 iso 0 dist 7.44629 12.7437 6.12453 18.8183 11.7533 7.48734 numMergedOcc 0
15 mol 168 unq 1 iso 0 dist 7.44629 12.7437 6.12453 14.6546 7.32989 5.6125 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 8.90963 11.618 9.20617 9.94371 11.85 9.70481 numMergedOcc 0
17 mol 188 unq 0 iso 0 dist 7.14503 8.02684 8.34477 13.353 8.77113 7.86092 numMergedOcc 0
18 mol 188 unq 1 iso 0 dist 8.10214 8.02684 8.4784 13.353 10.5721 7.86092 numMergedOcc 0
19 mol 198 unq 0 iso 0 dist 6.34616 4.27652 8.78623 13.7844 15.6566 9.76973 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 4.8668 7.35363 7.75318 10.9575 9.55992 7.13783 numMergedOcc 0
21 mol 232 unq 0 iso 0 dist 8.50102 6.95968 9.78273 10.5803 4.9377 8.25985 numMergedOcc 0
22 mol 232 unq 1 iso 0 dist 9.40808 4.04428 9.78273 8.27212 4.9377 8.25985 numMergedOcc 0
