0 mol 0 unq 0 iso 0 dist 9.83355 5.47921 6.26831 7.16396 6.64713 5.24778 10.961 4.04089 9.23213 8.34244 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.83355 5.47921 6.26831 7.16396 6.64713 5.24778 11.2375 7.56754 8.81979 12.5479 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.97991 11.1182 8.44506 6.81961 9.5053 10.9837 15.0861 8.13684 6.73162 12.2621 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.42735 6.71804 4.79949 7.88113 6.66954 4.3931 8.35595 6.81799 8.97793 10.8997 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 9.42735 6.71804 4.79949 7.88113 6.66954 4.3931 6.22513 8.83525 8.19682 11.4594 numMergedOcc 0
5 mol 76 unq 2 iso 0 dist 9.98078 6.71804 7.27693 4.80291 9.75201 6.45686 8.35595 6.42322 8.97793 11.1148 numMergedOcc 0
6 mol 76 unq 3 iso 0 dist 9.98078 6.71804 7.27693 4.80291 9.75201 6.45686 6.22513 5.77727 8.19682 7.03226 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 8.09408 9.13494 7.1589 10.2703 8.70863 9.29301 17.0219 12.5072 9.47876 10.0297 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 6.07991 9.52181 6.34525 14.3305 9.35942 12.7083 16.22 14.3491 8.71128 20.6955 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 9.03491 7.12329 5.74857 5.67542 8.85881 5.22052 6.87582 6.03931 6.99777 5.60389 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 9.03491 7.12329 5.74857 5.67542 8.85881 5.22052 12.696 5.99374 9.14376 13.7028 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 7.20629 4.6251 7.77116 9.25614 8.8562 7.20179 12.5653 8.96522 9.63176 11.8717 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 7.20629 4.6251 7.77116 5.53673 7.91683 9.89358 12.5653 8.96522 9.63176 15.8603 numMergedOcc 0
13 mol 126 unq 0 iso 0 dist 9.31118 5.50061 9.46588 5.23583 5.94233 6.0268 10.8729 5.83002 7.75534 7.36017 numMergedOcc 0
14 mol 126 unq 1 iso 0 dist 9.31118 5.50061 9.46588 11.0459 8.56219 8.01268 10.8729 5.83002 7.75534 5.14819 numMergedOcc 0
15 mol 126 unq 2 iso 0 dist 8.44104 13.2671 9.46588 7.25449 5.94233 6.0268 12.3377 5.83002 7.75534 7.36017 numMergedOcc 0
16 mol 126 unq 3 iso 0 dist 8.44104 13.2671 9.46588 11.2199 8.56219 8.01268 12.3377 5.83002 7.75534 5.14819 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 6.86144 5.65167 6.51749 5.71112 7.11785 5.6044 12.5367 10.4684 6.94688 10.3766 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 6.86144 5.65167 6.51749 5.71112 7.11785 5.6044 11.772 12.69 6.71012 10.7723 numMergedOcc 0
19 mol 194 unq 0 iso 0 dist 5.7371 5.87898 6.96521 5.3236 7.74683 5.43725 8.60851 4.05564 6.95408 9.86703 numMergedOcc 0
20 mol 209 unq 0 iso 0 dist 9.93982 9.80484 8.41195 5.78532 7.97418 6.552 11.2201 9.02883 9.52027 12.3767 numMergedOcc 0
21 mol 209 unq 1 iso 0 dist 9.9518 11.2558 8.41195 5.54278 7.97418 6.552 16.9282 9.02883 9.52027 12.3767 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 8.72947 13.1177 7.77998 8.89634 8.15091 5.78064 17.8247 14.5407 7.19465 9.58354 numMergedOcc 0
