0 mol 44 unq 0 iso 0 dist 7.85573 7.78905 6.07691 9.64095 7.42925 9.6782 numMergedOcc 0
1 mol 44 unq 1 iso 0 dist 6.21423 9.44909 6.07691 4.83412 7.42925 9.6782 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 9.52763 7.20538 7.91078 3.63144 9.78973 7.16773 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.87177 8.06168 4.49951 4.53047 7.45801 6.02816 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.70925 8.67532 4.49951 7.05537 7.45801 6.02816 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.44788 6.18763 6.83988 6.49348 5.58734 8.00003 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 8.77869 8.25167 6.71523 4.13881 9.25835 6.45896 numMergedOcc 0
7 mol 227 unq 0 iso 0 dist 6.14732 9.07872 13.552 4.21811 8.61546 6.02296 numMergedOcc 0
8 mol 249 unq 0 iso 0 dist 7.279 6.37672 9.82483 4.20164 4.68783 5.48118 numMergedOcc 0
9 mol 249 unq 1 iso 0 dist 8.43448 8.94023 9.82483 5.93404 4.68783 5.48118 numMergedOcc 0
10 mol 259 unq 0 iso 0 dist 5.98006 8.06771 5.71237 5.61261 9.69025 7.98231 numMergedOcc 0
11 mol 265 unq 0 iso 0 dist 6.98812 7.04833 5.56416 10.7881 7.49913 6.71375 numMergedOcc 0
12 mol 274 unq 0 iso 0 dist 8.14634 6.55855 10.2307 5.15747 9.02661 6.39866 numMergedOcc 0
