0 mol 33 unq 0 iso 0 dist 9.90906 8.87925 6.08005 11.3653 5.31968 10.0784 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 9.90906 8.87925 6.08005 16.0592 9.86405 14.7934 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 8.90372 9.29446 13.9318 8.63685 9.43893 15.8844 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 8.90372 5.8992 7.73661 8.63685 9.43893 12.3007 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 8.54678 9.9795 12.1235 10.6449 6.27877 15.5717 numMergedOcc 0
5 mol 158 unq 0 iso 0 dist 8.88105 9.66837 8.53662 6.31999 8.6903 14.0717 numMergedOcc 0
6 mol 217 unq 0 iso 0 dist 8.75987 7.58097 12.6895 11.5492 6.86611 16.895 numMergedOcc 0
7 mol 218 unq 0 iso 0 dist 7.78107 8.95233 9.70376 5.68847 5.51354 11.5094 numMergedOcc 0
8 mol 229 unq 0 iso 0 dist 9.98938 6.32302 4.98446 8.6372 9.79447 10.3466 numMergedOcc 0
9 mol 229 unq 1 iso 0 dist 9.98938 6.88694 9.9295 8.6372 9.79447 14.1376 numMergedOcc 0
10 mol 229 unq 2 iso 0 dist 6.75338 8.53615 4.98446 8.78758 9.79447 10.3466 numMergedOcc 0
11 mol 241 unq 0 iso 0 dist 9.92576 6.90245 10.1832 10.9722 8.10031 14.5069 numMergedOcc 0
12 mol 252 unq 0 iso 0 dist 6.74917 7.91348 5.91451 8.06449 7.56716 11.2692 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 5.67503 8.49415 4.75685 13.5795 8.43749 7.54805 numMergedOcc 0
14 mol 281 unq 0 iso 0 dist 6.76971 9.27716 11.6589 11.731 9.09172 17.9448 numMergedOcc 0
