0 mol 7 unq 0 iso 0 dist 6.22805 5.85668 7.15434 12.2255 9.67164 8.75346 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.04834 9.19152 6.28033 5.37568 7.65889 6.64634 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.37503 6.78528 6.83481 10.5203 6.74179 6.01658 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 8.54845 10.2322 9.77018 5.37928 9.2898 12.6833 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.30194 6.13631 8.124 10.7557 8.68662 15.7072 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 6.30194 6.13631 8.124 11.1632 7.4369 15.2252 numMergedOcc 0
6 mol 108 unq 0 iso 0 dist 6.11003 7.24343 7.24815 6.0318 9.72024 9.03406 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 8.46734 9.59741 7.51061 4.57343 6.29161 6.98893 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 8.46734 9.59741 7.51061 11.3914 7.86666 11.231 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 5.97879 9.53071 9.62866 5.33859 5.7144 6.76872 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 7.15203 8.86818 9.79004 5.94578 8.26547 5.37122 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 5.67862 6.50741 7.27598 7.77359 9.33924 4.70162 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 5.67862 6.50741 7.27598 10.8891 7.93372 12.487 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 9.42819 13.5359 8.46796 8.39434 7.37333 8.53742 numMergedOcc 0
14 mol 162 unq 1 iso 0 dist 9.42819 13.5359 8.46796 4.92282 7.45998 11.0013 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 5.10683 7.11105 6.74267 5.27109 7.60269 6.80103 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 7.47238 16.9546 9.95045 6.2559 6.71524 13.3209 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.27989 9.44182 6.83046 3.28983 6.73665 8.15025 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 6.47376 4.77763 8.68797 4.91802 6.35028 5.03816 numMergedOcc 0
19 mol 279 unq 1 iso 0 dist 9.6147 5.44699 8.68797 9.35656 6.35028 5.03816 numMergedOcc 0
