0 mol 0 unq 0 iso 0 dist 9.83355 7.16396 6.64713 10.961 4.04089 8.34244 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.33703 6.71084 8.60435 10.6321 17.4118 9.97624 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.97991 6.81961 9.5053 10.6968 14.3325 5.497 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.09727 7.87342 8.86698 14.4964 10.9405 7.281 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.98078 4.80291 9.75201 6.22513 5.77727 7.03226 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 8.09408 10.2703 8.70863 12.0301 13.7907 6.05495 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 9.60416 17.0061 8.43352 21.245 13.6622 6.0129 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 6.07991 14.3305 9.35942 13.9013 8.36453 9.83981 numMergedOcc 0
8 mol 114 unq 1 iso 0 dist 6.07991 14.3305 9.35942 11.2872 6.22315 6.13559 numMergedOcc 0
9 mol 114 unq 2 iso 0 dist 6.07991 14.3305 9.35942 8.90311 6.18257 6.51395 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 9.03491 5.67542 8.85881 6.87582 6.03931 5.60389 numMergedOcc 0
11 mol 126 unq 0 iso 0 dist 9.31118 5.23583 5.94233 10.8729 5.83002 7.36017 numMergedOcc 0
12 mol 126 unq 1 iso 0 dist 9.31118 11.0459 8.56219 10.8729 5.83002 5.14819 numMergedOcc 0
13 mol 126 unq 2 iso 0 dist 8.44104 7.25449 5.94233 12.3377 5.83002 7.36017 numMergedOcc 0
14 mol 126 unq 3 iso 0 dist 8.44104 11.2199 8.56219 12.3377 5.83002 5.14819 numMergedOcc 0
15 mol 193 unq 0 iso 0 dist 7.46207 9.7127 7.8141 8.52642 5.91268 7.60625 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 5.7371 5.3236 7.74683 8.60851 4.05564 9.86703 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 8.73422 5.53537 6.57921 8.66693 7.0877 7.17337 numMergedOcc 0
18 mol 234 unq 0 iso 0 dist 9.2457 6.2709 6.00582 10.8275 6.56378 9.25517 numMergedOcc 0
19 mol 234 unq 1 iso 0 dist 9.2457 6.2709 6.00582 12.8613 5.3976 7.22019 numMergedOcc 0
20 mol 253 unq 0 iso 0 dist 8.72947 8.89634 8.15091 17.8247 14.5407 9.58354 numMergedOcc 0
