0 mol 15 unq 0 iso 0 dist 6.16274 5.46344 8.85174 9.95429 10.1154 6.23015 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 9.55181 7.16107 8.111 14.2628 10.7396 8.60614 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 6.32791 11.1182 7.65889 11.4198 6.51133 5.94982 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 6.34277 4.68147 7.05196 8.98227 7.33728 5.20109 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 9.40763 9.41688 7.05196 13.0625 7.33728 5.20109 numMergedOcc 0
5 mol 25 unq 2 iso 0 dist 8.46842 16.8735 9.48085 14.0507 6.08585 6.53269 numMergedOcc 0
6 mol 25 unq 3 iso 0 dist 8.46842 16.8735 9.48085 16.9275 9.15781 9.81524 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 7.24378 8.52286 9.85905 9.87514 6.45686 7.46095 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 9.48388 4.54306 7.78931 9.66226 7.28361 9.25444 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 9.48388 4.54306 7.78931 11.8553 12.0974 8.46823 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 9.48388 10.9661 8.7497 9.66226 7.28361 9.84703 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 9.48388 10.9661 8.7497 11.8553 12.0974 4.62494 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 6.1421 5.75588 5.51197 7.98622 4.92472 6.34626 numMergedOcc 0
13 mol 129 unq 1 iso 0 dist 9.54663 11.0564 5.51197 14.119 4.92472 6.34626 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 7.85025 13.4842 8.77023 9.196 4.54648 8.83732 numMergedOcc 0
15 mol 170 unq 0 iso 0 dist 7.665 5.03025 9.08274 10.3765 9.275 6.47164 numMergedOcc 0
16 mol 170 unq 1 iso 0 dist 7.665 5.03025 9.08274 13.3758 12.5696 9.65126 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 6.20985 5.74845 8.73533 11.1917 7.30024 9.45907 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 7.69466 5.60861 8.73533 10.3757 7.30024 9.45907 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 9.65951 4.51957 7.9133 12.9264 5.86489 9.48625 numMergedOcc 0
20 mol 204 unq 1 iso 0 dist 9.14829 9.9552 7.9133 14.6586 5.86489 9.48625 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 9.68636 9.76444 7.27993 15.5316 6.65022 9.37336 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 6.94983 7.30782 6.71524 8.70651 4.9377 9.9183 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 7.17987 12.4759 7.81215 9.45787 10.0059 7.77911 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 6.86014 14.6762 8.9682 12.8844 7.70529 9.26157 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 5.97073 11.3103 8.9682 11.2242 7.70529 9.26157 numMergedOcc 0
26 mol 277 unq 2 iso 0 dist 8.23147 6.40883 5.46926 9.76241 4.37645 9.26157 numMergedOcc 0
27 mol 277 unq 3 iso 0 dist 6.49176 6.40883 8.9682 9.76241 7.70529 9.26157 numMergedOcc 0
28 mol 277 unq 4 iso 0 dist 5.22392 6.68571 9.57499 9.17672 6.28695 9.26157 numMergedOcc 0
29 mol 277 unq 5 iso 0 dist 8.20217 6.68571 5.46926 9.17672 4.37645 9.26157 numMergedOcc 0
30 mol 292 unq 0 iso 0 dist 6.87804 4.77692 7.20674 5.54272 8.83082 8.62162 numMergedOcc 0
31 mol 292 unq 1 iso 0 dist 6.07571 11.6413 7.20674 12.2521 8.83082 8.62162 numMergedOcc 0
