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 26 unq 0 iso 0 dist 9.97991 11.1182 8.44506 6.81961 9.5053 10.9837 10.6968 14.3325 13.2086 5.497 numMergedOcc 0
2 mol 76 unq 0 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
3 mol 85 unq 0 iso 0 dist 8.09408 6.38992 8.00777 10.2703 8.70863 11.165 12.0301 13.7907 14.6253 6.05495 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 8.09408 9.13494 7.1589 10.2703 8.70863 9.29301 12.0301 13.7907 13.9302 6.05495 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 9.60416 11.8887 7.26086 17.0061 8.43352 7.06961 21.245 13.6622 10.417 6.0129 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 6.07991 9.52181 6.34525 14.3305 9.35942 12.7083 13.9013 8.36453 10.6048 9.83981 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 6.07991 9.52181 6.34525 14.3305 9.35942 12.7083 11.2872 6.22315 11.237 6.13559 numMergedOcc 0
8 mol 114 unq 2 iso 0 dist 6.07991 9.52181 6.34525 14.3305 9.35942 12.7083 8.90311 6.18257 10.3172 6.51395 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 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
11 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
12 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
13 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
14 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
15 mol 232 unq 0 iso 0 dist 8.73422 6.64614 7.83711 5.53537 6.57921 4.9377 8.66693 7.0877 11.4727 7.17337 numMergedOcc 0
16 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
