0 mol 24 unq 0 iso 0 dist 6.60423 5.86882 5.47982 4.32034 9.69752 9.921 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.60423 5.86882 5.47982 8.52463 9.36461 11.3314 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 7.83786 4.56797 5.47982 9.6469 9.69752 9.921 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 7.83786 4.56797 5.47982 14.6654 9.36461 11.3314 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 4.93188 7.6222 4.87192 5.11617 4.90592 3.4435 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 4.93188 7.6222 4.87192 10.8238 8.16324 7.63657 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 9.24958 11.7026 4.87192 13.2229 4.90592 3.4435 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 9.24958 11.7026 4.87192 6.7828 8.16324 7.63657 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 6.77886 9.56076 9.53772 10.0962 6.99108 8.64891 numMergedOcc 0
9 mol 56 unq 1 iso 0 dist 6.77886 11.2895 7.3576 10.0962 6.99108 10.4286 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 7.04044 8.00278 9.22853 5.11416 6.48232 4.10173 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 8.73253 10.4159 9.22853 6.56633 6.48232 4.10173 numMergedOcc 0
12 mol 75 unq 0 iso 0 dist 7.9233 9.23701 9.4871 5.38908 7.6433 11.0435 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 8.00777 6.62562 6.00564 11.165 8.70863 4.58085 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 7.1589 5.46695 6.00564 9.29301 8.70863 4.58085 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 8.86674 11.3507 8.40501 9.66102 7.39179 4.04076 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 8.86674 7.84987 9.82156 9.66102 7.39179 13.3756 numMergedOcc 0
17 mol 92 unq 2 iso 0 dist 8.65802 5.44942 9.93806 13.534 8.57827 11.3027 numMergedOcc 0
18 mol 92 unq 3 iso 0 dist 8.65802 5.44942 9.93806 5.83515 7.94453 4.64144 numMergedOcc 0
19 mol 109 unq 0 iso 0 dist 8.67766 9.44195 7.04752 7.20706 6.76575 4.31811 numMergedOcc 0
20 mol 109 unq 1 iso 0 dist 8.0831 4.26194 7.04752 5.35728 6.76575 4.31811 numMergedOcc 0
21 mol 119 unq 0 iso 0 dist 7.99623 4.72999 7.7186 7.45148 9.9151 11.7528 numMergedOcc 0
22 mol 120 unq 0 iso 0 dist 8.93905 12.4334 9.23243 8.2619 6.03352 6.93115 numMergedOcc 0
23 mol 158 unq 0 iso 0 dist 7.88319 12.9396 9.38045 6.4079 6.76055 9.44283 numMergedOcc 0
24 mol 158 unq 1 iso 0 dist 7.88319 12.9396 9.38045 4.25067 9.36343 10.8632 numMergedOcc 0
25 mol 162 unq 0 iso 0 dist 6.20182 5.05715 6.00293 4.20425 7.14263 8.06906 numMergedOcc 0
26 mol 162 unq 1 iso 0 dist 6.20182 5.05715 6.00293 6.07158 8.57005 6.76865 numMergedOcc 0
27 mol 175 unq 0 iso 0 dist 8.0154 13.4456 6.59925 6.29885 8.05247 11.3868 numMergedOcc 0
28 mol 175 unq 1 iso 0 dist 8.0154 13.4456 6.59925 7.27408 9.71028 11.3992 numMergedOcc 0
29 mol 194 unq 0 iso 0 dist 6.26839 11.1912 7.39369 11.6598 5.68348 8.10654 numMergedOcc 0
30 mol 194 unq 1 iso 0 dist 8.12346 6.11279 7.39369 12.0887 5.68348 8.10654 numMergedOcc 0
31 mol 194 unq 2 iso 0 dist 8.83356 9.99597 7.39369 7.11753 5.68348 8.10654 numMergedOcc 0
32 mol 194 unq 3 iso 0 dist 8.2654 9.50345 7.39369 12.8755 5.68348 8.10654 numMergedOcc 0
33 mol 205 unq 0 iso 0 dist 8.44861 12.2848 6.61806 13.0658 9.17946 11.0113 numMergedOcc 0
34 mol 205 unq 1 iso 0 dist 8.44861 9.73907 7.85966 13.0658 9.17946 3.5693 numMergedOcc 0
35 mol 205 unq 2 iso 0 dist 5.60393 9.41884 6.61806 14.4523 9.17946 11.0113 numMergedOcc 0
36 mol 205 unq 3 iso 0 dist 5.60393 12.3578 7.85966 14.4523 9.17946 3.5693 numMergedOcc 0
37 mol 225 unq 0 iso 0 dist 6.6561 10.225 9.33639 7.17211 8.20162 3.7016 numMergedOcc 0
38 mol 225 unq 1 iso 0 dist 8.87609 11.7207 9.18343 5.76292 9.23935 6.88681 numMergedOcc 0
39 mol 225 unq 2 iso 0 dist 8.87609 11.7207 9.18343 8.21235 7.77552 4.55231 numMergedOcc 0
40 mol 230 unq 0 iso 0 dist 6.41286 10.3804 7.81987 6.33877 8.34416 11.3876 numMergedOcc 0
41 mol 230 unq 1 iso 0 dist 6.41286 10.3804 7.81987 5.0515 6.34832 6.78617 numMergedOcc 0
42 mol 252 unq 0 iso 0 dist 6.86945 3.6688 8.62955 6.35641 7.39391 9.96528 numMergedOcc 0
43 mol 258 unq 0 iso 0 dist 6.70815 9.34197 8.65191 10.8558 9.91199 6.08477 numMergedOcc 0
44 mol 258 unq 1 iso 0 dist 7.99477 8.40328 8.65191 13.2927 9.91199 6.08477 numMergedOcc 0
45 mol 261 unq 0 iso 0 dist 5.26434 7.83541 7.75255 7.39176 8.61563 7.44855 numMergedOcc 0
46 mol 261 unq 1 iso 0 dist 5.26434 10.6727 8.96013 7.39176 8.61563 6.79825 numMergedOcc 0
47 mol 261 unq 2 iso 0 dist 8.60026 14.5304 7.75255 12.8544 8.61563 7.44855 numMergedOcc 0
48 mol 261 unq 3 iso 0 dist 8.60026 16.5975 8.96013 12.8544 8.61563 6.79825 numMergedOcc 0
49 mol 282 unq 0 iso 0 dist 5.23193 7.35437 7.44686 7.55098 8.53065 7.59282 numMergedOcc 0
50 mol 282 unq 1 iso 0 dist 5.23193 7.35437 7.44686 6.46616 8.67489 13.6597 numMergedOcc 0
51 mol 282 unq 2 iso 0 dist 5.23193 11.0422 9.82855 7.55098 8.53065 10.6451 numMergedOcc 0
52 mol 282 unq 3 iso 0 dist 5.23193 11.0422 9.82855 6.46616 8.67489 17.0693 numMergedOcc 0
53 mol 282 unq 4 iso 0 dist 5.23193 10.3109 8.62579 7.55098 8.53065 6.22006 numMergedOcc 0
54 mol 282 unq 5 iso 0 dist 5.23193 10.3109 8.62579 6.46616 8.67489 16.027 numMergedOcc 0
