0 mol 53 unq 0 iso 0 dist 5.38734 5.57443 7.28228 5.3578 5.40489 5.46827 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 9.113 11.8999 9.03564 14.5 8.77529 9.96534 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.28542 5.37685 8.13108 9.23259 9.59729 13.5024 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 8.06915 8.94548 8.23026 9.49124 9.08825 6.46372 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 6.05967 8.36426 9.36001 5.87008 9.99441 6.77937 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 9.46118 8.19473 9.33861 5.64102 8.89015 6.95017 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 9.92003 5.2048 9.3948 9.6275 8.75345 13.086 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 8.90712 7.37914 9.11586 13.6841 8.75345 16.9857 numMergedOcc 0
8 mol 95 unq 2 iso 0 dist 8.90712 7.37914 9.11586 9.32071 9.79643 7.63763 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 7.47769 14.0652 9.89083 10.2645 9.09348 10.9531 numMergedOcc 0
10 mol 109 unq 1 iso 0 dist 7.47769 9.80725 8.52024 10.2645 9.09348 4.69373 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 7.46657 5.38186 5.35237 5.20011 5.78982 5.4761 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 7.46657 9.44162 7.99477 5.20011 5.78982 5.03507 numMergedOcc 0
13 mol 146 unq 0 iso 0 dist 4.40679 12.6231 9.04757 9.6665 7.78784 8.33152 numMergedOcc 0
14 mol 146 unq 1 iso 0 dist 9.65986 12.8655 9.04757 15.6597 7.78784 8.33152 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 7.92886 9.69197 9.10817 11.044 6.69042 9.61454 numMergedOcc 0
16 mol 197 unq 1 iso 0 dist 7.92886 5.10611 6.86828 11.044 6.69042 7.59871 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 9.98943 17.8612 8.19317 12.5996 6.03081 9.72447 numMergedOcc 0
18 mol 235 unq 1 iso 0 dist 9.98943 17.8612 8.19317 8.97305 7.41433 12.983 numMergedOcc 0
19 mol 235 unq 2 iso 0 dist 9.98943 12.7194 5.1823 12.5996 6.03081 4.21867 numMergedOcc 0
20 mol 235 unq 3 iso 0 dist 9.98943 12.7194 5.1823 8.97305 7.41433 5.88852 numMergedOcc 0
