0 mol 38 unq 0 iso 0 dist 9.70612 4.46801 7.68478 6.46781 5.64331 6.87122 numMergedOcc 0
1 mol 38 unq 1 iso 0 dist 6.46781 4.46801 6.87122 9.70612 5.64331 7.68478 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 7.66055 7.84103 7.4785 11.2215 5.47421 6.39747 numMergedOcc 0
3 mol 127 unq 0 iso 0 dist 8.09965 5.12492 5.39356 10.0545 5.55757 5.01504 numMergedOcc 0
4 mol 127 unq 1 iso 0 dist 8.09965 5.12492 5.39356 10.9303 6.16471 6.80627 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 7.94863 5.17954 5.92733 12.2255 8.38345 8.81797 numMergedOcc 0
6 mol 130 unq 1 iso 0 dist 7.94863 5.17954 5.92733 14.4292 10.0969 9.81269 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 7.4653 3.75216 8.39897 7.95564 7.63992 9.03078 numMergedOcc 0
8 mol 147 unq 1 iso 0 dist 7.95564 3.75216 9.03078 7.4653 7.63992 8.39897 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 9.37459 5.0146 7.59457 9.0847 5.42328 9.00072 numMergedOcc 0
10 mol 152 unq 1 iso 0 dist 9.37459 5.0146 7.59457 6.00061 5.54906 7.55419 numMergedOcc 0
11 mol 152 unq 2 iso 0 dist 9.0847 5.0146 9.00072 9.37459 5.42328 7.59457 numMergedOcc 0
12 mol 152 unq 3 iso 0 dist 9.0847 5.0146 9.00072 6.00061 6.4896 7.55419 numMergedOcc 0
13 mol 152 unq 4 iso 0 dist 6.00061 5.0146 7.55419 9.37459 5.54906 7.59457 numMergedOcc 0
14 mol 152 unq 5 iso 0 dist 6.00061 5.0146 7.55419 9.0847 6.4896 9.00072 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 7.94694 5.69659 4.51255 7.51923 5.63422 6.23183 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 7.51923 5.69659 6.23183 7.94694 5.63422 4.51255 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 7.22234 12.1593 8.82761 8.48081 5.45334 4.66576 numMergedOcc 0
18 mol 213 unq 1 iso 0 dist 5.86501 12.8419 8.82761 10.1705 5.45334 4.66576 numMergedOcc 0
19 mol 213 unq 2 iso 0 dist 8.48081 12.1593 4.66576 7.22234 5.45334 8.82761 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 6.51823 5.61713 6.46771 10.9573 8.87326 8.94231 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 6.51823 5.61713 6.46771 10.5699 5.31152 8.88652 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.64889 13.4595 4.9764 12.6823 7.08227 7.42932 numMergedOcc 0
