0 mol 7 unq 0 iso 0 dist 8.88982 13.9585 7.10621 18.3683 10.789 7.31201 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.88982 13.9585 7.10621 19.3325 10.515 9.36807 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.8576 10.4545 8.41585 13.1708 6.06176 6.36911 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 7.25179 13.7 8.57077 10.8001 5.60154 8.47421 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 8.72522 16.5569 8.57077 10.7994 5.60154 8.47421 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 7.34549 4.76147 8.34347 9.08976 11.887 9.16962 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.09068 6.30129 8.34347 14.8032 11.887 9.16962 numMergedOcc 0
7 mol 26 unq 2 iso 0 dist 9.72289 5.93227 8.34347 13.0219 11.887 9.16962 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 7.66055 5.76106 6.81627 10.5081 5.98837 8.26899 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 7.59073 4.53858 5.73196 9.70777 6.47779 7.22293 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.11612 10.3475 9.33865 11.0433 6.09023 9.66954 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 5.11612 10.3475 9.33865 9.95565 10.2377 7.64585 numMergedOcc 0
12 mol 115 unq 2 iso 0 dist 5.11612 6.86762 5.83991 11.0433 6.09023 8.66155 numMergedOcc 0
13 mol 115 unq 3 iso 0 dist 5.22628 10.0419 9.33865 10.2245 10.7942 7.76729 numMergedOcc 0
14 mol 115 unq 4 iso 0 dist 5.22628 6.8104 6.11741 12.7277 10.8292 6.99777 numMergedOcc 0
15 mol 115 unq 5 iso 0 dist 5.22628 6.8104 6.11741 11.1013 6.12943 9.14376 numMergedOcc 0
16 mol 117 unq 0 iso 0 dist 9.60425 5.17524 9.84395 9.77482 11.3679 6.62561 numMergedOcc 0
17 mol 127 unq 0 iso 0 dist 8.09965 11.3174 9.30299 10.4013 4.77464 9.81878 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 7.94593 13.2723 9.0018 13.2601 8.22779 9.8589 numMergedOcc 0
19 mol 175 unq 1 iso 0 dist 7.94593 8.63795 7.652 13.2601 8.22779 7.24908 numMergedOcc 0
20 mol 178 unq 0 iso 0 dist 5.41229 4.51874 6.69288 12.452 10.5783 8.96511 numMergedOcc 0
21 mol 178 unq 1 iso 0 dist 8.57378 4.51874 6.43573 12.452 5.96647 8.96511 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 9.50454 11.755 7.63312 8.22583 9.60512 7.98142 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 9.50454 11.755 7.63312 12.8564 13.3389 7.37327 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 7.15963 6.73556 5.98885 10.4914 5.4601 7.20046 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 7.15963 6.73556 5.98885 12.7342 10.0524 7.13543 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 7.15963 5.49666 9.15386 7.82604 8.25067 9.6668 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 6.43406 10.9813 7.81386 15.0054 9.53462 7.98142 numMergedOcc 0
28 mol 181 unq 6 iso 0 dist 6.43406 10.9813 7.81386 14.1437 11.1462 7.37327 numMergedOcc 0
29 mol 181 unq 7 iso 0 dist 8.80581 10.209 7.63312 16.0943 9.60512 7.98142 numMergedOcc 0
30 mol 181 unq 8 iso 0 dist 8.80581 10.209 7.63312 17.06 13.3389 7.37327 numMergedOcc 0
31 mol 205 unq 0 iso 0 dist 6.04106 12.9245 7.26832 9.70674 6.23291 9.19704 numMergedOcc 0
32 mol 224 unq 0 iso 0 dist 9.61379 9.57016 8.95269 11.9527 7.98696 6.87664 numMergedOcc 0
33 mol 224 unq 1 iso 0 dist 8.47457 8.1404 6.60589 10.8956 6.12232 6.65984 numMergedOcc 0
34 mol 234 unq 0 iso 0 dist 7.17032 5.44278 6.56247 11.5443 11.216 6.25105 numMergedOcc 0
35 mol 234 unq 1 iso 0 dist 7.17032 9.25445 9.45496 15.1563 15.9563 9.5707 numMergedOcc 0
36 mol 234 unq 2 iso 0 dist 7.17032 9.25445 9.45496 11.5443 11.216 7.85175 numMergedOcc 0
37 mol 235 unq 0 iso 0 dist 8.84872 4.28841 5.4638 11.4738 4.65302 8.21247 numMergedOcc 0
38 mol 238 unq 0 iso 0 dist 8.39522 4.88998 6.57393 6.59305 6.20606 5.38637 numMergedOcc 0
39 mol 238 unq 1 iso 0 dist 5.99187 5.74685 6.22714 9.63117 5.17471 7.49471 numMergedOcc 0
40 mol 238 unq 2 iso 0 dist 5.99187 5.87189 7.31233 6.59305 10.4664 6.55759 numMergedOcc 0
41 mol 238 unq 3 iso 0 dist 5.99187 5.87189 7.31233 10.6202 11.2717 7.02475 numMergedOcc 0
42 mol 238 unq 4 iso 0 dist 5.99187 5.87189 7.31233 13.1524 12.6986 7.67322 numMergedOcc 0
43 mol 238 unq 5 iso 0 dist 5.99187 5.87189 7.31233 9.63117 5.17471 7.19008 numMergedOcc 0
44 mol 248 unq 0 iso 0 dist 9.5107 11.8955 7.69895 17.8606 10.1857 8.50864 numMergedOcc 0
45 mol 265 unq 0 iso 0 dist 6.78702 4.75685 8.4218 7.74463 6.43013 6.34034 numMergedOcc 0
46 mol 265 unq 1 iso 0 dist 8.59825 11.5105 8.4218 11.0134 6.43013 6.34034 numMergedOcc 0
47 mol 282 unq 0 iso 0 dist 7.34596 4.36798 8.76532 10.7897 8.14825 8.8673 numMergedOcc 0
48 mol 282 unq 1 iso 0 dist 7.12228 4.36798 6.33524 10.7897 7.36881 8.8673 numMergedOcc 0
