0 mol 17 unq 0 iso 0 dist 6.62838 13.5595 7.02884 18.1657 12.5119 9.877 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 7.08192 10.3706 8.84341 17.0358 14.8804 9.877 numMergedOcc 0
2 mol 17 unq 2 iso 0 dist 4.8921 10.3706 7.02884 17.0358 12.5119 9.877 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 9.9773 10.3774 5.80623 6.32286 10.1283 7.60283 numMergedOcc 0
4 mol 27 unq 1 iso 0 dist 8.15117 7.71155 6.75307 6.32286 3.71754 8.71752 numMergedOcc 0
5 mol 27 unq 2 iso 0 dist 8.15117 10.3774 7.24775 6.32286 3.71754 7.60283 numMergedOcc 0
6 mol 46 unq 0 iso 0 dist 9.35028 4.01305 8.5377 6.67418 6.20913 6.61977 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 8.05585 10.6881 5.39827 14.3016 6.35361 7.46994 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.31486 8.62539 7.43804 8.02478 11.1769 6.0129 numMergedOcc 0
9 mol 189 unq 0 iso 0 dist 8.21424 5.77635 7.45329 11.4731 5.79318 9.33695 numMergedOcc 0
10 mol 189 unq 1 iso 0 dist 8.21424 5.77635 7.45329 6.90908 4.88868 6.31466 numMergedOcc 0
11 mol 253 unq 0 iso 0 dist 6.54733 4.91528 8.70383 9.02428 3.494 9.58354 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 8.01242 10.1742 9.52718 13.8796 9.81184 5.59555 numMergedOcc 0
13 mol 288 unq 0 iso 0 dist 8.01242 10.1742 9.52718 13.8796 9.81184 5.59555 numMergedOcc 0
14 mol 289 unq 0 iso 0 dist 8.01242 10.1742 9.52718 13.8796 9.81184 5.59555 numMergedOcc 0
