0 mol 10 unq 0 iso 0 dist 9.1686 7.28753 6.68744 11.6447 5.04413 6.77807 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.99402 4.84364 6.68744 9.77054 5.04413 6.77807 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 7.3489 11.1641 6.68744 7.74463 5.04413 6.77807 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 8.60149 5.816 6.19657 11.3043 9.98735 9.46349 numMergedOcc 0
4 mol 21 unq 0 iso 0 dist 6.72231 5.25936 9.23319 7.63222 3.5175 9.53277 numMergedOcc 0
5 mol 36 unq 0 iso 0 dist 8.47497 8.02028 9.96441 7.7124 4.61635 5.70939 numMergedOcc 0
6 mol 38 unq 0 iso 0 dist 5.86243 6.19943 5.17241 11.1021 5.73081 8.50003 numMergedOcc 0
7 mol 38 unq 1 iso 0 dist 5.86243 6.19943 5.17241 11.4364 6.66655 7.00717 numMergedOcc 0
8 mol 38 unq 2 iso 0 dist 7.55357 5.09927 5.17241 7.17698 5.73081 8.50003 numMergedOcc 0
9 mol 38 unq 3 iso 0 dist 7.55357 5.09927 5.17241 4.74069 6.66655 7.00717 numMergedOcc 0
10 mol 68 unq 0 iso 0 dist 9.32972 5.74636 9.7662 15.2083 17.168 9.63906 numMergedOcc 0
11 mol 68 unq 1 iso 0 dist 7.19203 6.31365 6.7739 11.5398 13.4251 9.63906 numMergedOcc 0
12 mol 68 unq 2 iso 0 dist 7.19203 5.08329 8.3318 11.5398 13.4251 7.71872 numMergedOcc 0
13 mol 68 unq 3 iso 0 dist 8.8095 5.74636 6.7739 15.2083 13.4251 9.63906 numMergedOcc 0
14 mol 68 unq 4 iso 0 dist 8.8095 8.30034 8.3318 15.2083 13.4251 7.71872 numMergedOcc 0
15 mol 83 unq 0 iso 0 dist 7.37989 13.8604 9.55089 14.1503 7.78693 5.35861 numMergedOcc 0
16 mol 83 unq 1 iso 0 dist 7.37989 8.71052 7.22942 14.1503 7.78693 8.61641 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 8.56593 9.65579 7.53168 9.09014 7.13673 5.95801 numMergedOcc 0
18 mol 141 unq 1 iso 0 dist 8.56593 5.93647 5.18805 9.09014 7.13673 9.92715 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 7.53834 11.2878 8.78397 17.1908 16.0705 8.60651 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.39345 5.86994 5.06194 6.49577 6.79905 8.17928 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 9.89311 12.3846 9.88692 18.4705 11.3947 7.88986 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 8.13696 6.61744 8.43724 12.8159 7.50311 8.51564 numMergedOcc 0
