0 mol 12 unq 0 iso 0 dist 6.91627 7.86307 11.0859 6.62201 9.79847 11.9185 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.2056 5.03976 4.49033 5.34733 6.39307 5.04478 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 6.42206 9.08976 6.66387 7.56492 9.63803 5.84066 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 4.87397 9.26475 6.0563 5.51402 7.31989 13.0928 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 4.87397 6.5784 5.77806 5.51402 7.31989 5.64432 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 8.68381 7.13638 10.3974 12.0249 8.85156 17.4106 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.04935 7.93317 9.59811 9.01045 8.59739 12.7886 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 9.04935 7.11013 11.9573 9.01045 8.59739 12.9112 numMergedOcc 0
8 mol 79 unq 2 iso 0 dist 9.04935 9.62096 13.9374 9.01045 8.59739 14.3577 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 8.21127 9.36283 12.8154 10.4345 6.31773 16.787 numMergedOcc 0
10 mol 128 unq 0 iso 0 dist 8.54297 8.04178 10.7037 12.3248 8.83385 18.0927 numMergedOcc 0
11 mol 128 unq 1 iso 0 dist 8.54297 8.04178 10.7037 10.6485 7.11781 15.5467 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 8.87505 9.02079 4.72188 11.1633 5.82945 10.5067 numMergedOcc 0
13 mol 146 unq 0 iso 0 dist 5.3184 6.66451 10.2064 3.75935 6.93154 5.41078 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 6.17825 6.86439 6.25647 11.725 9.71835 14.6876 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 7.24533 7.40764 5.3674 5.47357 8.7831 8.24424 numMergedOcc 0
16 mol 233 unq 1 iso 0 dist 7.24533 7.40764 5.3674 5.47592 9.61071 7.0942 numMergedOcc 0
17 mol 233 unq 2 iso 0 dist 7.24533 7.40764 5.3674 3.67394 7.1229 6.01775 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 6.86805 6.41474 10.0609 6.11441 6.22195 11.6498 numMergedOcc 0
