0 mol 5 unq 0 iso 0 dist 9.68326 9.08586 7.44029 16.938 12.2037 9.13041 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 9.68326 9.08586 7.44029 17.3805 10.5084 9.43038 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 8.18111 8.83912 7.44029 17.4908 12.2037 9.13041 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 8.18111 8.83912 7.44029 13.9308 10.5084 9.43038 numMergedOcc 0
4 mol 11 unq 0 iso 0 dist 5.59847 7.4835 6.50001 10.4679 6.56765 7.95811 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 7.54379 5.06613 7.51725 11.018 7.28949 8.51496 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 7.10218 6.61758 9.42184 8.64736 12.669 7.57443 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 6.99586 6.13489 9.68629 9.96547 11.7168 5.59552 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 5.96246 4.84407 9.70292 8.4204 5.88327 9.49995 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 5.91797 9.55396 5.08983 5.21813 3.92737 5.94696 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 6.37954 10.4899 8.3505 19.3848 17.4008 9.25249 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 5.32773 6.61244 6.12348 5.55446 3.84573 5.37302 numMergedOcc 0
12 mol 113 unq 1 iso 0 dist 5.32773 4.80164 7.2672 5.55446 3.84573 8.47541 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 5.30818 6.54652 6.27683 5.77897 3.95773 5.51388 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 5.30818 4.85063 7.1757 5.77897 3.95773 8.68909 numMergedOcc 0
15 mol 169 unq 2 iso 0 dist 8.89822 14.3008 6.27683 9.71763 3.95773 5.51388 numMergedOcc 0
16 mol 169 unq 3 iso 0 dist 8.89822 12.1929 7.1757 9.71763 3.95773 8.68909 numMergedOcc 0
17 mol 184 unq 0 iso 0 dist 8.09403 3.76321 8.27396 6.71675 4.67256 8.95598 numMergedOcc 0
18 mol 193 unq 0 iso 0 dist 5.06367 4.30951 7.85801 10.793 8.86693 9.37035 numMergedOcc 0
19 mol 206 unq 0 iso 0 dist 9.36144 8.60571 8.79378 13.2258 5.70985 8.15381 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 5.9625 5.05085 9.94117 5.27184 3.86189 8.37813 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 5.9625 5.05085 9.94117 11.9134 13.1595 9.25988 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 9.61255 10.0125 7.15079 13.9176 9.78219 9.02071 numMergedOcc 0
23 mol 274 unq 1 iso 0 dist 7.64703 6.59723 4.97796 13.9176 13.3632 9.11072 numMergedOcc 0
24 mol 274 unq 2 iso 0 dist 7.64703 6.59723 4.97796 10.3335 5.39432 6.83113 numMergedOcc 0
25 mol 274 unq 3 iso 0 dist 7.64703 6.59723 4.97796 10.7045 10.7442 9.44134 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 7.48212 4.56764 5.72473 10.4203 6.32259 6.68863 numMergedOcc 0
