0 mol 26 unq 0 iso 0 dist 8.42581 5.497 5.45023 5.11733 7.90721 6.7142 6.79475 4.39827 5.39199 8.96682 numMergedOcc 0
1 mol 39 unq 0 iso 0 dist 8.19733 6.24515 5.14532 6.96883 6.41793 6.13351 8.98219 6.3982 3.91611 5.27182 numMergedOcc 0
2 mol 105 unq 0 iso 0 dist 7.20953 5.03173 4.22355 4.67929 7.44838 7.77089 13.1083 9.94027 13.4342 9.17843 numMergedOcc 0
3 mol 143 unq 0 iso 0 dist 8.1582 6.46089 11.5146 4.38322 10.6706 5.06564 10.55 8.4697 10.0079 9.29944 numMergedOcc 0
4 mol 143 unq 1 iso 0 dist 7.88655 6.46089 6.60479 4.38322 8.612 5.06564 10.55 6.78032 10.0079 9.29944 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 9.59034 9.84492 6.71237 6.00734 10.5765 9.99396 10.5584 9.435 4.03697 8.5672 numMergedOcc 0
6 mol 195 unq 0 iso 0 dist 9.79691 9.82588 11.4252 4.18074 7.87972 9.24936 9.32333 8.68163 5.66395 6.396 numMergedOcc 0
7 mol 214 unq 0 iso 0 dist 7.39624 7.69296 4.23527 6.2381 8.21997 5.31416 10.1796 6.28124 3.94038 8.25329 numMergedOcc 0
8 mol 214 unq 1 iso 0 dist 7.39624 7.69296 4.23527 9.8806 9.29924 5.44533 10.1796 6.28124 3.94038 4.85332 numMergedOcc 0
9 mol 225 unq 0 iso 0 dist 7.29542 7.73748 6.59663 6.24324 7.8744 7.7086 11.7254 6.05548 6.67492 9.3502 numMergedOcc 0
10 mol 227 unq 0 iso 0 dist 7.1372 7.57454 4.59123 4.09934 9.43618 8.91971 12.0306 14.9695 15.624 8.85955 numMergedOcc 0
11 mol 227 unq 1 iso 0 dist 7.1372 7.57454 4.59123 4.09934 9.43618 8.91971 7.79951 11.2819 12.8337 6.09335 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 9.31673 7.31773 5.92143 4.47008 9.11454 8.97952 9.85304 10.0222 10.6687 6.03081 numMergedOcc 0
13 mol 235 unq 1 iso 0 dist 9.31673 7.31773 5.92143 4.47008 9.11454 8.97952 10.6744 6.89973 10.6919 7.41433 numMergedOcc 0
14 mol 273 unq 0 iso 0 dist 6.94131 8.85779 9.76492 4.42663 5.4307 5.61969 9.35749 6.87067 10.5462 9.02537 numMergedOcc 0
15 mol 273 unq 1 iso 0 dist 9.84628 8.85779 13.6188 4.42663 9.85914 5.61969 9.35749 5.81024 10.5462 9.02537 numMergedOcc 0
