0 mol 18 unq 0 iso 0 dist 6.41856 8.35401 3.96312 14.3063 12.4475 8.95648 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 8.51213 8.35401 13.06 14.3063 18.0886 8.95648 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 7.88429 6.29808 7.08873 11.2872 12.7952 9.39923 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.80849 6.74914 4.79736 6.27332 8.20058 8.45916 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 7.74108 9.873 6.06485 11.1211 13.4039 9.57919 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.51543 8.18572 5.31985 7.17313 6.62246 8.8326 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 9.32453 8.25047 6.77898 14.7997 16.4532 9.78762 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 4.31067 7.63284 7.03983 5.88769 8.05602 4.79891 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 7.55822 5.93365 3.87365 6.15779 11.4333 9.17843 numMergedOcc 0
9 mol 116 unq 1 iso 0 dist 7.55822 5.93365 3.87365 9.13854 11.0982 7.31364 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 9.60425 5.20001 6.57678 6.63536 8.81172 8.54233 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 7.00798 8.62413 12.1739 11.3239 17.6185 8.46972 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 6.76166 9.13631 11.5407 5.35536 10.9185 6.41759 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 7.2977 9.13631 5.91192 5.35536 6.54987 6.41759 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 7.14849 5.4647 6.42973 5.39133 12.3456 9.03126 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.84116 9.22792 12.9384 13.4487 16.3554 8.56602 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 8.16369 9.22792 13.6489 13.4487 13.7557 8.56602 numMergedOcc 0
17 mol 212 unq 0 iso 0 dist 8.13678 5.10392 3.9436 7.26672 10.0663 8.43638 numMergedOcc 0
18 mol 212 unq 1 iso 0 dist 8.13678 5.10392 3.9436 6.88669 10.8077 7.06117 numMergedOcc 0
