0 mol 7 unq 0 iso 0 dist 9.20552 5.26458 5.99972 10.4548 5.99459 6.12483 11.1443 12.2041 11.2662 9.67164 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.94828 6.84017 6.16347 16.0229 9.48085 9.62058 13.2682 10.9391 7.45383 9.49421 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 8.94828 15.5398 7.92503 16.0229 9.48085 10.2758 13.2682 10.9391 16.8925 9.49421 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 9.81637 6.18332 5.93884 6.69301 9.22598 5.66912 12.4928 4.81926 7.68678 8.96727 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 8.27156 5.40878 4.74544 7.751 6.9103 4.09232 12.0244 8.62608 7.56205 9.69044 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 6.92837 6.56303 9.97775 5.29207 6.9362 5.1678 8.27307 8.99811 10.8967 5.99857 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 9.43143 11.9655 9.27838 12.6194 7.12321 14.005 14.5784 5.36766 11.1896 9.74228 numMergedOcc 0
7 mol 72 unq 1 iso 0 dist 9.43143 11.9655 9.27838 12.6194 7.12321 14.005 16.5383 8.24309 16.0048 6.21799 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 6.86713 5.04455 9.49454 12.4753 8.27883 15.7954 13.3871 6.59884 15.8861 7.7152 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 9.61812 7.76066 7.80975 17.5707 9.21662 12.48 19.6188 10.8375 14.8081 8.91882 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 5.79157 12.2847 9.94764 4.72407 9.1998 11.5269 8.31276 11.6064 12.1214 6.42772 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 5.79157 12.2847 9.94764 4.72407 9.1998 11.5269 5.50687 7.09823 15.049 8.70621 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 5.79157 12.2847 9.94764 7.97297 8.69531 6.93712 9.87619 6.81259 6.23142 9.33094 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 6.09874 5.06341 6.22122 5.43915 8.59874 6.39406 9.75336 6.01247 6.2479 9.76212 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.77347 10.0244 8.73217 8.69152 6.61112 4.03697 15.2469 7.09479 10.6519 8.90571 numMergedOcc 0
