0 mol 7 unq 0 iso 0 dist 6.10226 8.88982 5.70161 10.5313 8.0166 6.22805 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.80034 8.88982 4.57188 10.5313 9.32945 6.22805 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.83056 8.88982 6.09254 10.5313 9.90117 6.22805 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 8.36361 5.38103 5.31774 6.52889 13.3149 8.84153 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 9.67926 8.13365 10.0637 11.7903 13.0162 6.85331 numMergedOcc 0
5 mol 33 unq 0 iso 0 dist 9.69775 9.8294 17.9599 13.2858 22.3059 5.66319 numMergedOcc 0
6 mol 33 unq 1 iso 0 dist 9.01202 9.8294 15.1668 13.2858 20.079 5.66319 numMergedOcc 0
7 mol 38 unq 0 iso 0 dist 7.98333 9.70612 5.39129 10.6088 5.86243 7.57586 numMergedOcc 0
8 mol 38 unq 1 iso 0 dist 7.98333 6.46781 5.29179 5.39032 7.55357 8.86547 numMergedOcc 0
9 mol 43 unq 0 iso 0 dist 9.62895 6.6657 7.20074 7.64564 14.7822 9.05728 numMergedOcc 0
10 mol 140 unq 0 iso 0 dist 9.83976 6.40792 12.1389 6.79553 15.6696 8.36882 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.02183 8.80581 5.16386 7.11843 6.47689 9.63295 numMergedOcc 0
12 mol 185 unq 0 iso 0 dist 9.20346 6.62848 10.9909 8.1871 16.2987 8.94984 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 8.14413 7.86668 5.82028 12.3207 6.24111 8.07523 numMergedOcc 0
14 mol 210 unq 1 iso 0 dist 8.14413 7.86668 5.82028 12.2935 9.00343 7.56882 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 9.62606 7.52229 5.42652 10.9243 6.01666 9.90668 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 9.4525 9.23844 12.7764 9.07015 12.9236 9.85951 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 8.98518 9.23844 6.80494 9.07015 8.98362 9.85951 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 9.5831 7.14333 16.1011 8.3924 14.5394 9.67966 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 6.02845 5.99137 9.92965 11.7831 14.3719 6.36941 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 9.35599 5.99137 13.9306 11.7831 19.1177 6.36941 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 6.86905 6.51823 7.22173 5.98533 5.33462 8.89538 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 5.62744 6.92721 5.29737 4.95913 10.2234 9.27989 numMergedOcc 0
23 mol 239 unq 1 iso 0 dist 7.76984 6.92721 11.4465 4.95913 8.34832 9.27989 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 8.8726 5.31858 9.22664 4.18036 12.9422 7.9357 numMergedOcc 0
25 mol 258 unq 1 iso 0 dist 8.8726 5.31858 9.22664 4.69752 7.70189 8.81059 numMergedOcc 0
26 mol 258 unq 2 iso 0 dist 8.8726 5.71851 13.0489 12.1477 20.0893 9.47519 numMergedOcc 0
27 mol 258 unq 3 iso 0 dist 8.8726 5.71851 13.0489 4.18036 12.9422 5.79537 numMergedOcc 0
28 mol 258 unq 4 iso 0 dist 8.8726 5.71851 13.0489 4.69752 7.70189 9.12006 numMergedOcc 0
29 mol 282 unq 0 iso 0 dist 5.72197 7.34596 4.58403 5.5267 7.93511 6.84554 numMergedOcc 0
30 mol 282 unq 1 iso 0 dist 5.72197 7.12228 5.04235 5.5267 7.93511 9.51581 numMergedOcc 0
