0 mol 62 unq 0 iso 0 dist 7.63855 6.49446 10.1564 8.30291 4.44795 11.1759 numMergedOcc 0
1 mol 62 unq 1 iso 0 dist 5.48766 6.49446 10.5761 8.30291 4.83921 11.1759 numMergedOcc 0
2 mol 62 unq 2 iso 0 dist 9.63139 6.49446 14.8985 8.30291 6.16158 11.1759 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 9.25793 8.91055 9.9082 8.14057 11.8136 5.36296 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.96016 4.3761 12.341 9.58693 12.7375 8.91618 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 8.96016 4.3761 12.341 9.48388 8.49566 12.3835 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 8.96016 5.84583 4.74936 9.58693 12.7375 12.9994 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 8.96016 5.84583 4.74936 9.48388 8.49566 4.96747 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 6.95777 8.8763 11.5439 8.26309 5.60443 9.45824 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 9.16474 9.04398 4.81683 9.80191 5.89983 4.38811 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 5.51129 4.76012 4.04119 6.1421 5.57978 6.43966 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 9.47429 8.94007 10.7363 9.11046 7.29693 6.91778 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 8.12807 8.17234 10.1227 9.48923 4.20878 9.29848 numMergedOcc 0
13 mol 229 unq 1 iso 0 dist 8.12807 8.17234 10.1227 9.67544 5.91886 6.21233 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 8.27116 8.73545 14.0636 4.94074 9.08355 6.52848 numMergedOcc 0
15 mol 233 unq 1 iso 0 dist 8.27116 8.14581 12.4219 4.94074 9.08355 5.51 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 6.8314 6.28725 5.55026 9.5181 4.98993 6.94762 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 7.51983 9.01177 15.0579 9.55574 9.73696 11.6171 numMergedOcc 0
18 mol 252 unq 1 iso 0 dist 7.51983 9.15686 5.86631 9.55574 9.73696 11.2271 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 7.38265 9.44043 3.89286 8.14812 5.29393 9.07364 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.14231 5.03174 3.98318 8.43682 6.67602 5.21164 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 6.14231 5.03174 3.98318 6.20796 5.7052 6.12009 numMergedOcc 0
22 mol 264 unq 2 iso 0 dist 4.68488 7.22743 3.98318 7.73693 5.7052 6.12009 numMergedOcc 0
23 mol 270 unq 0 iso 0 dist 8.36659 4.60602 4.55587 9.02113 4.26143 5.00269 numMergedOcc 0
