0 mol 7 unq 0 iso 0 dist 6.36911 10.2446 7.45262 5.03847 9.97624 10.1959 9.87885 7.92429 8.15894 11.2901 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.36911 12.3097 6.96586 5.03847 9.97624 13.9514 9.87885 7.92429 8.45544 11.2901 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.36807 5.44992 7.45262 13.8829 9.97624 10.1959 6.1206 7.92429 8.15894 11.2901 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.36807 4.74523 6.96586 13.8829 9.97624 13.9514 6.1206 7.92429 8.45544 11.2901 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 8.47421 3.98483 8.04924 9.5997 9.57198 7.28672 5.8245 3.91075 7.05919 10.9352 numMergedOcc 0
5 mol 39 unq 0 iso 0 dist 7.33969 11.962 8.19733 7.401 6.24515 5.14532 12.3745 5.94068 7.99016 8.20298 numMergedOcc 0
6 mol 39 unq 1 iso 0 dist 7.33969 11.962 8.19733 7.401 6.24515 5.14532 11.7171 6.96883 6.41793 6.13351 numMergedOcc 0
7 mol 39 unq 2 iso 0 dist 7.33969 11.962 8.19733 7.401 6.24515 5.14532 15.6429 9.56481 6.50101 9.49942 numMergedOcc 0
8 mol 45 unq 0 iso 0 dist 6.99408 6.18811 7.95778 8.26635 7.21995 6.19841 5.94756 4.51883 7.72462 10.1089 numMergedOcc 0
9 mol 45 unq 1 iso 0 dist 6.99408 6.18811 7.95778 13.4503 9.62637 10.493 5.94756 4.51883 7.72462 13.3858 numMergedOcc 0
10 mol 45 unq 2 iso 0 dist 9.3403 6.67086 7.95778 5.05051 7.21995 6.19841 10.7728 4.51883 7.72462 10.1089 numMergedOcc 0
11 mol 45 unq 3 iso 0 dist 9.3403 6.67086 7.95778 10.6148 9.62637 10.493 10.7728 4.51883 7.72462 13.3858 numMergedOcc 0
12 mol 74 unq 0 iso 0 dist 8.96501 4.79817 4.79413 8.1988 8.48471 5.74282 7.93281 5.38404 6.3567 11.9224 numMergedOcc 0
13 mol 114 unq 0 iso 0 dist 6.73814 5.6074 8.11094 13.7032 9.83981 11.4429 5.7144 4.81369 7.59156 13.8288 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 6.99777 7.3094 9.9928 5.22052 5.60389 9.18958 11.8378 13.2709 8.4965 15.3664 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 7.31468 7.11704 7.88655 10.0059 6.46089 6.60479 10.9972 4.38322 8.612 5.06564 numMergedOcc 0
16 mol 143 unq 1 iso 0 dist 7.7056 9.53139 7.88655 8.57817 6.46089 6.60479 10.7327 4.38322 8.612 5.06564 numMergedOcc 0
17 mol 188 unq 0 iso 0 dist 6.90541 5.48276 7.48284 10.5721 9.33696 5.87427 7.88013 6.39872 7.79115 11.506 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 8.17891 10.5813 7.1372 10.9607 7.57454 4.59123 5.23634 4.09934 9.43618 8.91971 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 6.95902 7.22396 7.1372 9.72615 7.57454 4.59123 6.91318 4.09934 9.43618 8.91971 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 9.58736 15.0089 9.31673 15.6327 7.31773 5.92143 11.0129 4.47008 9.11454 8.97952 numMergedOcc 0
21 mol 235 unq 1 iso 0 dist 9.43058 11.1908 9.31673 10.632 7.31773 5.92143 12.9086 4.47008 9.11454 8.97952 numMergedOcc 0
22 mol 235 unq 2 iso 0 dist 8.75735 7.87789 9.31673 6.01041 7.31773 5.92143 11.8988 4.47008 9.11454 8.97952 numMergedOcc 0
23 mol 235 unq 3 iso 0 dist 6.98084 11.5211 9.31673 6.82855 7.31773 5.92143 8.19317 4.47008 9.11454 8.97952 numMergedOcc 0
24 mol 235 unq 4 iso 0 dist 7.32211 6.65703 9.31673 6.46722 7.31773 5.92143 5.1823 4.47008 9.11454 8.97952 numMergedOcc 0
