0 mol 92 unq 0 iso 0 dist 9.20639 7.6296 8.30176 12.5969 5.54732 8.29345 numMergedOcc 0
1 mol 93 unq 0 iso 0 dist 5.77804 3.74136 7.85041 7.29701 6.957 7.62611 numMergedOcc 0
2 mol 130 unq 0 iso 0 dist 9.02079 4.91324 5.38314 13.7244 10.0581 9.13191 numMergedOcc 0
3 mol 130 unq 1 iso 0 dist 9.02079 4.91324 5.38314 8.65287 7.20197 6.95405 numMergedOcc 0
4 mol 147 unq 0 iso 0 dist 7.9061 5.78019 5.1101 6.6094 10.7872 7.25644 numMergedOcc 0
5 mol 147 unq 1 iso 0 dist 4.48898 5.78019 7.01133 6.6094 7.66774 7.25644 numMergedOcc 0
6 mol 147 unq 2 iso 0 dist 6.36426 4.52246 5.1101 9.52263 10.7872 7.25644 numMergedOcc 0
7 mol 147 unq 3 iso 0 dist 7.06711 4.52246 7.01133 9.52263 7.66774 7.25644 numMergedOcc 0
8 mol 147 unq 4 iso 0 dist 7.6489 5.88056 5.1101 12.6767 10.7872 7.25644 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 7.63085 4.19444 6.39981 10.1408 5.42969 6.76055 numMergedOcc 0
10 mol 158 unq 1 iso 0 dist 7.63085 4.19444 6.39981 10.0208 4.77562 9.36343 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 7.06919 11.1891 7.01126 10.7125 4.30489 5.89564 numMergedOcc 0
12 mol 175 unq 1 iso 0 dist 7.06919 11.1891 7.01126 8.70622 4.57622 5.60528 numMergedOcc 0
13 mol 175 unq 2 iso 0 dist 7.06919 5.28649 6.58434 8.70622 4.57622 5.5995 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 8.22583 5.80934 5.49808 11.3654 4.46559 9.26796 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 6.62037 5.27973 5.49808 11.0182 4.46559 9.26796 numMergedOcc 0
16 mol 181 unq 2 iso 0 dist 6.21461 5.27973 7.96291 11.0182 9.08227 9.26796 numMergedOcc 0
17 mol 182 unq 0 iso 0 dist 6.76894 6.38456 8.89822 13.368 11.9845 8.2169 numMergedOcc 0
18 mol 182 unq 1 iso 0 dist 6.76894 6.38456 8.89822 12.3472 12.8718 8.52103 numMergedOcc 0
19 mol 193 unq 0 iso 0 dist 9.06161 10.5008 8.76185 17.0518 10.8409 7.8141 numMergedOcc 0
20 mol 193 unq 1 iso 0 dist 9.06161 10.5008 8.76185 7.06538 5.97706 8.43187 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 9.70674 14.4882 9.83885 19.2182 11.8917 5.95375 numMergedOcc 0
22 mol 205 unq 1 iso 0 dist 9.70674 10.0849 5.42696 19.2182 11.8917 9.17946 numMergedOcc 0
23 mol 225 unq 0 iso 0 dist 7.21089 9.53753 5.13453 8.00354 6.16433 8.20162 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 9.2456 5.79235 7.94894 9.61914 5.91881 5.0804 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 7.78881 8.4162 5.80415 14.0341 7.87216 8.16947 numMergedOcc 0
26 mol 285 unq 1 iso 0 dist 7.78881 8.4162 5.80415 10.7038 4.39689 6.74142 numMergedOcc 0
