0 mol 63 unq 0 iso 0 dist 9.99115 8.51942 6.10379 11.6468 14.5021 8.91775 numMergedOcc 0
1 mol 88 unq 0 iso 0 dist 6.26491 6.85867 6.60008 4.75077 10.8248 9.26672 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 7.28161 6.37888 4.76916 7.42177 10.1751 5.77527 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 4.98783 5.62309 5.60494 10.3156 10.1751 9.81484 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 4.98783 7.11438 4.76916 10.3156 10.1751 5.77527 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 8.06644 5.49198 5.90151 6.0233 11.469 7.20601 numMergedOcc 0
6 mol 134 unq 1 iso 0 dist 8.06644 8.7311 5.75197 6.0233 11.469 8.72806 numMergedOcc 0
7 mol 162 unq 0 iso 0 dist 9.32658 8.88796 17.359 4.66068 12.6027 8.01723 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 7.04782 9.07527 14.9846 3.96762 10.8572 6.2176 numMergedOcc 0
9 mol 194 unq 0 iso 0 dist 9.08655 8.03512 8.39273 13.9239 15.2181 7.12765 numMergedOcc 0
10 mol 244 unq 0 iso 0 dist 8.19381 5.79898 11.4169 8.57946 9.09654 6.61951 numMergedOcc 0
11 mol 244 unq 1 iso 0 dist 8.93421 5.79898 12.7764 8.57946 16.5604 6.61951 numMergedOcc 0
12 mol 244 unq 2 iso 0 dist 7.35657 5.79898 12.7037 8.57946 14.0739 6.61951 numMergedOcc 0
13 mol 244 unq 3 iso 0 dist 6.19605 5.79898 8.63792 8.57946 13.9989 6.61951 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 6.41167 8.63176 9.76914 5.71858 11.1474 7.05518 numMergedOcc 0
15 mol 273 unq 0 iso 0 dist 5.75335 6.38341 5.63899 8.37324 10.9354 6.83684 numMergedOcc 0
16 mol 273 unq 1 iso 0 dist 8.76527 6.38341 11.3048 8.37324 16.4845 6.83684 numMergedOcc 0
