0 mol 26 unq 0 iso 0 dist 9.125 5.98456 4.27944 3.9696 12.5557 9.51178 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 8.69158 8.3189 9.63015 8.69235 13.7703 6.32509 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.18109 6.44363 14.739 5.89139 12.4066 8.18971 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 8.48766 9.94635 5.97999 6.47746 11.051 8.75826 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 9.75212 8.66256 10.2509 10.778 12.9732 8.02616 numMergedOcc 0
5 mol 151 unq 0 iso 0 dist 5.89907 5.11555 4.53999 12.2132 12.9526 9.62391 numMergedOcc 0
6 mol 232 unq 0 iso 0 dist 7.99525 6.69874 10.7725 7.93509 12.9043 4.79504 numMergedOcc 0
7 mol 232 unq 1 iso 0 dist 9.20965 5.40264 10.7725 4.44276 12.9043 4.79504 numMergedOcc 0
8 mol 249 unq 0 iso 0 dist 7.279 5.68936 9.43294 7.08836 13.5759 5.89339 numMergedOcc 0
9 mol 266 unq 0 iso 0 dist 9.33447 7.01175 9.68248 4.39397 11.0568 9.96942 numMergedOcc 0
10 mol 266 unq 1 iso 0 dist 3.90274 7.50074 9.68248 9.47559 11.0568 9.96942 numMergedOcc 0
11 mol 266 unq 2 iso 0 dist 7.49024 7.50074 5.36855 9.47559 14.1312 9.96942 numMergedOcc 0
12 mol 283 unq 0 iso 0 dist 8.80418 7.81415 12.1217 4.01355 10.8712 4.1631 numMergedOcc 0
