0 mol 25 unq 0 iso 0 dist 8.83402 8.46842 5.59268 5.70349 4.11406 7.19007 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.07638 8.85981 8.60018 9.46867 16.408 11.9262 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 8.07638 8.85981 8.60018 7.09141 5.3163 4.05793 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 8.07638 9.37314 5.96946 9.46867 16.408 14.6422 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 8.07638 9.37314 5.96946 7.09141 5.3163 6.84413 numMergedOcc 0
5 mol 73 unq 4 iso 0 dist 6.79787 8.85981 7.06343 9.46867 13.9042 11.9262 numMergedOcc 0
6 mol 73 unq 5 iso 0 dist 6.79787 8.85981 7.06343 7.09141 5.18759 4.05793 numMergedOcc 0
7 mol 73 unq 6 iso 0 dist 6.79787 9.37314 3.27963 9.46867 13.9042 14.6422 numMergedOcc 0
8 mol 73 unq 7 iso 0 dist 6.79787 9.37314 3.27963 7.09141 5.18759 6.84413 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.04398 9.80191 4.38811 5.6738 11.3166 10.3188 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.22824 7.31419 5.73965 7.77458 14.5158 13.8191 numMergedOcc 0
11 mol 146 unq 0 iso 0 dist 9.5348 8.74283 8.76758 9.58114 12.333 11.4049 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 8.94007 9.11046 6.91778 6.16995 12.2295 9.58148 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 8.30819 8.68992 10.5731 6.07578 12.3288 5.92577 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 8.05227 7.18765 7.56497 8.49016 13.4823 13.1412 numMergedOcc 0
15 mol 197 unq 1 iso 0 dist 8.05227 7.41091 5.66137 8.49016 13.4823 10.444 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 6.17749 8.81925 4.82768 6.70789 6.37759 8.6493 numMergedOcc 0
17 mol 229 unq 0 iso 0 dist 8.17234 9.48923 9.29848 5.82844 10.8457 6.02603 numMergedOcc 0
18 mol 229 unq 1 iso 0 dist 8.17234 9.67544 6.21233 5.82844 10.8457 8.88968 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 8.15743 6.94983 9.60401 7.68603 4.30202 8.36582 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 9.01177 9.55574 11.6171 8.16181 4.28835 13.4436 numMergedOcc 0
21 mol 252 unq 1 iso 0 dist 9.15686 9.55574 11.2271 8.16181 11.8501 13.4436 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.38051 6.07571 9.00118 5.43095 3.41551 9.6563 numMergedOcc 0
