0 mol 61 unq 0 iso 0 dist 9.2228 7.09641 4.51374 3.60431 10.9049 9.40835 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 8.92491 6.57826 10.7901 4.81015 13.5396 6.92381 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 8.12903 9.4909 9.82939 12.3912 14.8625 7.03887 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 8.12903 9.4909 9.82939 11.2645 14.2595 5.36451 numMergedOcc 0
4 mol 78 unq 2 iso 0 dist 8.12903 9.4909 9.82939 15.9147 16.4443 9.28354 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 8.87089 5.82918 11.5264 6.15983 14.7334 9.08952 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 5.82456 9.78437 11.5584 5.40104 9.35759 5.96977 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 7.82249 8.78982 5.13173 10.5972 11.0815 9.86985 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 4.77515 6.01132 4.94874 11.7596 12.3803 7.92317 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 8.57666 9.00025 16.553 3.47137 10.4251 7.6077 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 8.90161 7.96182 10.7557 6.33098 14.0626 7.61421 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 5.13534 5.83596 5.20775 9.61614 11.6986 6.91878 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 9.63004 7.19662 9.76461 9.98235 12.9092 7.35086 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 7.15878 5.18952 4.47004 9.98527 4.37138 5.50017 numMergedOcc 0
14 mol 239 unq 1 iso 0 dist 7.15878 5.648 7.14566 9.98527 4.37138 9.99181 numMergedOcc 0
15 mol 239 unq 2 iso 0 dist 4.53228 5.66792 4.74711 6.29809 5.4687 6.16848 numMergedOcc 0
