0 mol 4 unq 0 iso 0 dist 4.88114 6.12485 9.84838 7.88748 9.81212 4.10578 4.70233 6.45344 10.361 12.2723 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 4.88114 9.04027 7.03689 7.88748 9.81212 6.87439 4.70233 6.45344 12.4173 12.2723 numMergedOcc 0
2 mol 6 unq 0 iso 0 dist 6.1462 6.36157 8.54844 9.56016 8.56432 4.75733 4.59751 9.12718 10.7638 14.0989 numMergedOcc 0
3 mol 7 unq 0 iso 0 dist 8.41173 7.38748 10.1841 9.96415 13.1033 4.65291 4.30113 9.76779 11.6762 13.9485 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 6.01454 9.53081 5.41488 6.68961 6.1565 5.93341 13.2371 8.96621 11.4224 14.9723 numMergedOcc 0
5 mol 51 unq 0 iso 0 dist 9.4097 8.84151 6.20413 7.73836 4.98392 5.2887 4.14139 9.97637 11.2388 8.04026 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.02854 5.73235 5.22567 6.14248 8.66335 6.1999 12.6371 9.45905 12.7637 11.0724 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.50126 9.2759 5.35551 5.9959 5.30466 4.85121 11.2716 8.60913 12.1981 13.018 numMergedOcc 0
8 mol 223 unq 0 iso 0 dist 5.75896 6.97426 10.6184 7.5808 4.53638 9.46802 6.5658 7.22882 11.4192 10.9498 numMergedOcc 0
9 mol 223 unq 1 iso 0 dist 5.75896 8.87456 13.8469 7.5808 4.53638 13.1129 6.5658 7.22882 13.9012 10.9498 numMergedOcc 0
10 mol 224 unq 0 iso 0 dist 7.47122 7.03925 4.49347 8.57781 3.56689 4.67513 8.09748 8.23071 11.2243 8.83742 numMergedOcc 0
11 mol 239 unq 0 iso 0 dist 9.59937 7.58554 5.94643 7.98794 3.80345 7.26668 10.6145 9.05655 11.2673 5.68578 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 6.08181 8.10903 10.8957 9.6327 6.49094 8.78474 9.0655 7.66806 14.766 11.455 numMergedOcc 0
13 mol 258 unq 1 iso 0 dist 6.08181 7.25618 11.0025 9.6327 6.49094 11.3267 9.0655 7.66806 15.9916 11.455 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 6.58277 6.57444 5.91091 8.95841 11.8531 10.6488 4.56912 9.12381 11.0001 10.9828 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 6.58277 6.57444 5.91091 8.95841 11.8531 10.6488 8.89693 8.79148 13.3746 15.3869 numMergedOcc 0
16 mol 266 unq 2 iso 0 dist 6.58277 6.57444 5.91091 8.95841 11.8531 10.6488 14.5953 8.14167 11.0568 18.3725 numMergedOcc 0
17 mol 266 unq 3 iso 0 dist 6.58277 7.9555 3.93133 8.95841 11.8531 9.70494 4.56912 9.12381 11.0616 10.9828 numMergedOcc 0
18 mol 266 unq 4 iso 0 dist 6.58277 7.9555 3.93133 8.95841 11.8531 9.70494 8.89693 8.79148 11.7745 15.3869 numMergedOcc 0
19 mol 266 unq 5 iso 0 dist 6.58277 7.9555 3.93133 8.95841 11.8531 9.70494 14.5953 8.14167 8.67354 18.3725 numMergedOcc 0
20 mol 266 unq 6 iso 0 dist 8.42706 8.8646 3.93133 8.62843 11.8531 9.70494 5.43295 9.12381 11.0616 10.9828 numMergedOcc 0
21 mol 266 unq 7 iso 0 dist 8.42706 8.8646 3.93133 8.62843 11.8531 9.70494 7.37367 8.79148 11.7745 15.3869 numMergedOcc 0
22 mol 266 unq 8 iso 0 dist 8.42706 8.8646 3.93133 8.62843 11.8531 9.70494 15.7187 8.14167 8.67354 18.3725 numMergedOcc 0
