0 mol 34 unq 0 iso 0 dist 6.20159 7.66913 11.3492 5.39587 11.0471 9.12176 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 6.20159 7.66913 11.3492 6.47252 3.40337 9.21138 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.94809 6.27321 13.6446 6.72469 8.98281 7.71726 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 9.54062 6.13606 11.4024 8.63204 14.179 8.92835 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 9.54062 6.13606 11.4024 5.4014 9.95452 5.07553 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.35752 8.64736 3.69039 7.10218 12.0556 12.669 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.88238 8.64736 15.0328 7.10218 4.3232 12.669 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.40368 7.35647 3.76328 9.47287 11.9733 10.5637 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 6.94623 6.08299 5.51309 7.76446 10.8443 11.5269 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 6.94623 6.08299 5.51309 6.14652 5.62629 6.93712 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 5.7306 8.85675 11.9741 8.59532 6.11889 14.2356 numMergedOcc 0
11 mol 169 unq 0 iso 0 dist 6.58855 8.59976 13.1373 8.89822 9.907 7.33583 numMergedOcc 0
12 mol 169 unq 1 iso 0 dist 6.58855 9.71763 12.3204 8.89822 9.907 3.95773 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 8.12102 8.76228 9.00139 8.46046 3.40693 11.3761 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 8.12102 8.76228 9.00139 7.48065 5.49842 4.60149 numMergedOcc 0
15 mol 173 unq 2 iso 0 dist 7.95138 8.76228 7.55884 8.46046 6.40851 11.3761 numMergedOcc 0
16 mol 173 unq 3 iso 0 dist 7.95138 8.76228 7.55884 7.48065 3.39015 4.60149 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 8.13982 6.19189 7.65999 6.04336 4.4877 3.78314 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 8.13982 6.19189 7.65999 9.00537 11.4066 4.03697 numMergedOcc 0
19 mol 186 unq 2 iso 0 dist 9.02321 6.0685 10.9995 9.16579 11.7754 6.42554 numMergedOcc 0
20 mol 186 unq 3 iso 0 dist 9.02321 6.0685 10.9995 8.95209 13.9412 3.87082 numMergedOcc 0
21 mol 195 unq 0 iso 0 dist 8.77346 5.0778 6.12638 8.08491 8.49747 5.60628 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 6.254 6.32542 8.16279 9.71147 8.55206 8.8607 numMergedOcc 0
23 mol 205 unq 1 iso 0 dist 6.254 6.32542 8.16279 6.32553 3.45124 5.28417 numMergedOcc 0
24 mol 217 unq 0 iso 0 dist 8.57319 5.88992 9.12199 9.41353 3.27808 11.304 numMergedOcc 0
25 mol 217 unq 1 iso 0 dist 8.57319 5.88992 9.12199 8.28155 4.38808 9.98266 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.85095 8.31182 12.6333 7.30349 11.5702 10.0756 numMergedOcc 0
27 mol 266 unq 1 iso 0 dist 8.25191 8.31182 15.5391 7.30349 7.82159 10.0756 numMergedOcc 0
28 mol 266 unq 2 iso 0 dist 7.35056 8.31182 13.1627 7.30349 5.24624 10.0756 numMergedOcc 0
29 mol 270 unq 0 iso 0 dist 8.19788 6.97639 11.4433 9.97694 5.98023 9.62847 numMergedOcc 0
