0 mol 7 unq 0 iso 0 dist 9.49232 8.98901 11.3411 15.7777 9.4095 18.4534 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.57343 6.46901 10.0786 16.7996 8.99557 16.3923 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 9.57343 9.30547 5.79552 16.7996 8.99557 9.47718 numMergedOcc 0
3 mol 81 unq 0 iso 0 dist 6.99027 9.12919 4.79903 11.1775 9.1024 5.96486 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 5.99463 9.35364 5.17317 4.84407 7.923 8.36326 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 8.19835 5.93206 5.28557 8.97001 8.94422 10.8154 numMergedOcc 0
6 mol 109 unq 1 iso 0 dist 8.19835 7.73529 9.66892 8.97001 8.94422 15.5578 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 9.06373 6.9952 4.81545 4.18707 8.64091 6.4879 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 9.06373 9.30054 11.2125 4.18707 8.64091 12.7704 numMergedOcc 0
9 mol 146 unq 0 iso 0 dist 8.21621 6.98479 9.67898 6.31044 9.44765 10.144 numMergedOcc 0
10 mol 167 unq 0 iso 0 dist 5.7126 9.08229 13.3242 4.88159 7.5179 9.763 numMergedOcc 0
11 mol 167 unq 1 iso 0 dist 5.7126 7.99057 10.1682 4.88159 7.5179 12.538 numMergedOcc 0
12 mol 188 unq 0 iso 0 dist 9.63715 8.72253 7.76882 5.88388 9.99509 9.5523 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 9.05137 9.19343 11.5865 10.7235 8.26132 16.3034 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 5.68392 8.36772 4.69692 3.73772 8.69185 10.0828 numMergedOcc 0
15 mol 233 unq 1 iso 0 dist 5.68392 8.83541 5.49245 3.73772 8.69185 12.2189 numMergedOcc 0
16 mol 233 unq 2 iso 0 dist 5.68392 7.55878 7.41379 3.73772 8.69185 7.74693 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 8.03252 8.79625 13.4866 4.46246 8.31953 7.79408 numMergedOcc 0
18 mol 278 unq 1 iso 0 dist 8.03252 9.9609 12.3196 4.46246 8.31953 14.1798 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 8.76413 7.60019 10.9754 4.56764 9.22345 8.35169 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 6.88719 8.99187 6.32057 5.50542 9.81603 8.35169 numMergedOcc 0
