0 mol 15 unq 0 iso 0 dist 5.89412 14.8121 9.41935 9.75966 6.03257 6.25997 6.91314 6.23015 10.5167 5.20798 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 7.07399 5.88545 9.41935 4.39605 6.03257 6.25997 5.49251 6.23015 10.5167 5.20798 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 7.51452 10.0614 6.70097 10.0815 5.86181 10.3521 16.3456 9.07213 12.8405 10.2902 numMergedOcc 0
3 mol 20 unq 1 iso 0 dist 7.51452 10.0614 6.70097 13.457 6.3253 8.19819 16.3456 9.07213 12.8405 5.22924 numMergedOcc 0
4 mol 20 unq 2 iso 0 dist 7.51452 10.0614 6.70097 11.3821 5.80568 6.11738 16.3456 9.07213 12.8405 9.92781 numMergedOcc 0
5 mol 20 unq 3 iso 0 dist 9.20198 11.637 6.70097 8.96335 5.86181 10.3521 4.18921 9.07213 12.8405 10.2902 numMergedOcc 0
6 mol 20 unq 4 iso 0 dist 9.20198 11.637 6.70097 6.05944 6.3253 8.19819 4.18921 9.07213 12.8405 5.22924 numMergedOcc 0
7 mol 20 unq 5 iso 0 dist 9.20198 11.637 6.70097 7.46656 5.80568 6.11738 4.18921 9.07213 12.8405 9.92781 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 8.4051 13.2525 6.23824 12.176 6.72323 6.39466 10.1698 6.61696 5.97274 4.08755 numMergedOcc 0
9 mol 24 unq 1 iso 0 dist 8.4051 13.2525 6.23824 12.176 6.72323 6.39466 13.6174 5.80953 6.46192 10.0453 numMergedOcc 0
10 mol 24 unq 2 iso 0 dist 7.29868 4.99125 6.23824 6.66749 6.72323 6.39466 8.91183 6.61696 5.97274 4.08755 numMergedOcc 0
11 mol 24 unq 3 iso 0 dist 7.29868 4.99125 6.23824 6.66749 6.72323 6.39466 5.69214 5.80953 6.46192 10.0453 numMergedOcc 0
12 mol 24 unq 4 iso 0 dist 8.60554 11.4659 6.23824 14.012 6.72323 6.39466 14.8647 6.61696 5.97274 4.08755 numMergedOcc 0
13 mol 24 unq 5 iso 0 dist 8.60554 11.4659 6.23824 14.012 6.72323 6.39466 5.11636 5.80953 6.46192 10.0453 numMergedOcc 0
14 mol 85 unq 0 iso 0 dist 9.82915 12.8706 9.35279 10.4987 9.66222 18.1901 11.9064 5.05893 9.75167 11.0952 numMergedOcc 0
15 mol 85 unq 1 iso 0 dist 9.82915 12.8706 9.35279 10.4987 9.66222 18.1901 14.7521 5.71866 10.8439 12.5181 numMergedOcc 0
16 mol 100 unq 0 iso 0 dist 7.01812 8.07089 6.84692 10.6848 9.5057 4.71426 4.03277 6.59691 8.59989 12.48 numMergedOcc 0
17 mol 100 unq 1 iso 0 dist 8.30845 12.8256 6.84692 15.3454 9.5057 4.71426 6.23008 6.59691 8.59989 12.48 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 6.16242 5.47259 6.49688 12.131 8.95662 14.6184 13.0405 8.83732 13.2024 6.24625 numMergedOcc 0
19 mol 133 unq 1 iso 0 dist 5.87634 4.70102 6.49688 14.8102 8.95662 14.6184 13.7612 8.83732 13.2024 6.24625 numMergedOcc 0
20 mol 171 unq 0 iso 0 dist 9.61462 11.5192 7.03303 11.5561 5.25109 7.23254 7.5383 7.47964 8.11114 11.4851 numMergedOcc 0
21 mol 171 unq 1 iso 0 dist 9.61462 11.5192 7.03303 10.844 8.21618 8.97143 7.5383 7.47964 8.11114 12.9811 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 6.46704 5.87996 8.91675 7.81713 7.32087 10.0785 6.28125 9.06571 6.12433 5.3698 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 6.46704 5.87996 8.91675 7.81713 7.32087 10.0785 6.50233 7.35884 4.46602 6.39406 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 5.9176 5.83639 6.2176 6.29863 7.22883 8.51662 10.6474 8.12266 7.11838 14.2282 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 5.9176 5.83639 6.2176 6.29863 7.22883 8.51662 5.12833 9.43306 5.42919 10.273 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 5.9176 5.83639 6.2176 6.29863 7.22883 8.51662 4.61184 8.59681 6.20414 5.14966 numMergedOcc 0
27 mol 194 unq 0 iso 0 dist 8.65535 12.9377 9.42308 11.6598 6.1886 9.82808 10.0756 4.19371 11.795 4.002 numMergedOcc 0
28 mol 194 unq 1 iso 0 dist 8.65535 12.9377 9.42308 11.6598 6.1886 9.82808 16.4082 9.71015 15.9063 7.09553 numMergedOcc 0
29 mol 194 unq 2 iso 0 dist 6.72379 12.3879 5.67863 7.11753 6.38324 9.82808 4.66791 9.00322 14.0502 7.41775 numMergedOcc 0
30 mol 235 unq 0 iso 0 dist 6.36341 9.82715 5.3481 5.5163 6.94789 11.5344 13.089 7.39085 4.81611 14.2323 numMergedOcc 0
31 mol 235 unq 1 iso 0 dist 6.21292 6.55862 5.3481 7.77516 6.94789 11.5344 10.5354 7.39085 4.81611 14.2323 numMergedOcc 0
32 mol 235 unq 2 iso 0 dist 9.21736 6.8239 5.3481 11.7254 6.94789 11.5344 11.3865 7.39085 4.81611 14.2323 numMergedOcc 0
33 mol 273 unq 0 iso 0 dist 8.83865 9.75887 6.83684 12.0136 7.16346 5.91142 4.24707 7.85836 6.91408 8.43367 numMergedOcc 0
34 mol 273 unq 1 iso 0 dist 8.83865 9.75887 6.83684 12.0136 7.16346 5.91142 8.56043 6.35532 4.04219 3.78984 numMergedOcc 0
35 mol 273 unq 2 iso 0 dist 9.18157 7.29345 6.83684 12.1851 7.16346 5.91142 6.65672 7.85836 6.91408 8.43367 numMergedOcc 0
36 mol 273 unq 3 iso 0 dist 9.18157 7.29345 6.83684 12.1851 7.16346 5.91142 8.81454 6.35532 4.04219 3.78984 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 7.46394 10.0578 7.1364 11.1602 7.75216 4.45928 5.22914 7.77765 13.3529 13.9324 numMergedOcc 0
38 mol 274 unq 1 iso 0 dist 7.46394 10.0578 7.1364 11.1602 7.75216 4.45928 14.7507 9.65868 13.7073 10.7442 numMergedOcc 0
39 mol 274 unq 2 iso 0 dist 9.45514 10.0247 7.1364 6.52035 7.75216 4.45928 12.393 7.77765 13.3529 13.9324 numMergedOcc 0
40 mol 274 unq 3 iso 0 dist 9.45514 10.0247 7.1364 6.52035 7.75216 4.45928 8.87855 9.65868 13.7073 10.7442 numMergedOcc 0
41 mol 274 unq 4 iso 0 dist 8.91672 5.25703 7.1364 5.58338 7.75216 4.45928 16.5034 7.77765 13.3529 13.9324 numMergedOcc 0
42 mol 274 unq 5 iso 0 dist 8.91672 5.25703 7.1364 5.58338 7.75216 4.45928 12.5615 9.65868 13.7073 10.7442 numMergedOcc 0
43 mol 274 unq 6 iso 0 dist 7.1729 5.56942 7.1364 5.71192 7.75216 4.45928 10.2884 7.77765 13.3529 13.9324 numMergedOcc 0
44 mol 274 unq 7 iso 0 dist 7.1729 5.56942 7.1364 5.71192 7.75216 4.45928 13.0867 9.65868 13.7073 10.7442 numMergedOcc 0
45 mol 274 unq 8 iso 0 dist 8.52587 5.87456 5.0002 6.20558 6.88827 4.67674 16.9539 8.60027 12.616 13.3632 numMergedOcc 0
46 mol 274 unq 9 iso 0 dist 8.52587 5.87456 5.0002 16.3619 9.16942 11.1431 16.9539 8.60027 12.616 5.39432 numMergedOcc 0
47 mol 274 unq 10 iso 0 dist 6.39866 6.38211 5.0002 6.16703 6.88827 4.67674 8.87855 8.60027 12.616 13.3632 numMergedOcc 0
48 mol 274 unq 11 iso 0 dist 6.39866 6.38211 5.0002 5.64601 9.16942 11.1431 8.87855 8.60027 12.616 5.39432 numMergedOcc 0
