0 mol 11 unq 0 iso 0 dist 7.86299 6.79676 7.77766 6.3554 9.88198 4.46511 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 8.62634 5.65481 9.04834 5.1333 5.36911 6.51133 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 8.62634 10.0664 8.17898 5.1333 5.36911 5.30082 numMergedOcc 0
3 mol 21 unq 0 iso 0 dist 5.27589 9.07166 8.85347 8.36356 7.30397 8.28093 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.3613 7.16404 6.85305 10.5928 8.58962 8.04976 numMergedOcc 0
5 mol 36 unq 0 iso 0 dist 4.32337 5.19721 6.29647 6.99697 9.53334 5.52411 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 9.5663 7.70414 5.54343 5.40109 9.23947 6.21578 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 9.48319 5.88392 7.77558 10.3314 7.65069 4.64757 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 6.7095 5.26061 7.48277 11.7136 9.2062 10.6281 numMergedOcc 0
9 mol 102 unq 1 iso 0 dist 6.7095 8.90571 9.0361 11.7136 9.2062 4.48396 numMergedOcc 0
10 mol 124 unq 0 iso 0 dist 8.55572 9.70366 7.23052 8.13727 9.18949 14.8831 numMergedOcc 0
11 mol 155 unq 0 iso 0 dist 6.1274 9.26984 8.66709 9.32273 9.83653 6.3363 numMergedOcc 0
12 mol 188 unq 0 iso 0 dist 9.66794 7.74092 7.63268 5.60968 9.26919 6.38128 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 7.55389 10.1816 7.7292 11.9752 8.82861 5.86489 numMergedOcc 0
14 mol 204 unq 1 iso 0 dist 7.55389 7.7596 6.27396 11.9752 8.82861 11.2903 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 5.60195 12.0174 8.9077 7.03806 7.46122 7.11498 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 7.87359 9.89208 8.9077 4.69654 7.46122 7.11498 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 8.76741 7.39364 6.095 13.2515 9.62583 6.00069 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 5.46484 9.62351 9.96011 5.69026 8.88405 5.82256 numMergedOcc 0
19 mol 236 unq 1 iso 0 dist 5.46484 9.62351 9.96011 8.22446 7.13854 4.94799 numMergedOcc 0
20 mol 236 unq 2 iso 0 dist 8.80671 7.47558 9.96011 11.4601 8.88405 5.82256 numMergedOcc 0
21 mol 236 unq 3 iso 0 dist 8.80671 7.47558 9.96011 6.4298 7.13854 4.94799 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 8.49961 17.1024 9.27989 9.7952 6.91534 11.169 numMergedOcc 0
23 mol 239 unq 1 iso 0 dist 8.49961 17.1024 9.27989 10.1967 8.67704 14.8007 numMergedOcc 0
24 mol 250 unq 0 iso 0 dist 5.97672 6.15778 8.21206 5.61043 8.85979 4.34713 numMergedOcc 0
25 mol 261 unq 0 iso 0 dist 9.66298 6.39263 7.6414 11.7392 6.45102 6.18925 numMergedOcc 0
26 mol 273 unq 0 iso 0 dist 7.29081 12.0564 6.54753 6.85615 9.57659 10.199 numMergedOcc 0
27 mol 273 unq 1 iso 0 dist 7.29081 12.0564 6.54753 9.64596 7.8424 5.81246 numMergedOcc 0
