0 mol 10 unq 0 iso 0 dist 7.69328 9.24342 6.02543 10.8707 9.61828 6.18431 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.26327 5.04413 6.02543 10.5152 9.61828 6.18431 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 7.52634 13.4881 8.04168 17.7877 10.6438 6.5551 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 8.95491 12.6233 7.0561 19.4253 13.0818 6.87506 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 4.7699 6.95933 9.05336 9.92669 10.0747 9.94998 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 5.96907 7.04886 6.99125 7.35385 12.612 9.27009 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 8.49918 11.085 9.82982 18.3682 13.1849 8.71789 numMergedOcc 0
7 mol 154 unq 1 iso 0 dist 8.49918 11.085 9.82982 14.9657 11.4511 5.2693 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 8.83254 11.0223 8.17226 14.3656 5.80425 8.92115 numMergedOcc 0
9 mol 194 unq 0 iso 0 dist 9.13708 13.2622 5.53324 10.6315 5.92931 4.19371 numMergedOcc 0
10 mol 194 unq 1 iso 0 dist 9.13708 14.7732 6.72182 12.6412 7.50057 9.00322 numMergedOcc 0
11 mol 234 unq 0 iso 0 dist 8.89152 11.8226 9.08151 16.6065 9.35405 7.77911 numMergedOcc 0
12 mol 273 unq 0 iso 0 dist 7.87371 8.83577 5.4307 13.1165 9.76492 5.61969 numMergedOcc 0
13 mol 273 unq 1 iso 0 dist 7.87371 8.83577 5.4307 16.3174 11.5256 9.0277 numMergedOcc 0
14 mol 279 unq 0 iso 0 dist 7.92537 11.9254 7.37478 6.12347 5.89415 8.98854 numMergedOcc 0
15 mol 279 unq 1 iso 0 dist 7.92537 11.9254 7.37478 14.9954 15.1378 9.42255 numMergedOcc 0
