0 mol 11 unq 0 iso 0 dist 5.95165 6.50001 4.10106 4.46394 5.96346 6.859 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.54519 6.36381 5.50396 6.53276 8.23446 4.44526 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.54519 6.36381 5.50396 6.81998 8.75662 9.586 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.11056 8.94703 4.79736 4.04757 8.44664 9.98592 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 8.40051 5.77745 5.63212 4.32173 6.16347 5.20109 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 8.6396 5.77745 6.47509 4.32173 7.45383 5.20109 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 9.7522 9.90986 7.11305 14.288 11.9684 6.81793 numMergedOcc 0
7 mol 26 unq 1 iso 0 dist 6.88695 9.63803 8.25132 10.5687 10.177 6.07276 numMergedOcc 0
8 mol 30 unq 0 iso 0 dist 6.88974 5.14358 6.54878 6.06435 10.5933 5.22979 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 6.36193 8.85156 4.23671 4.37642 5.93884 9.53438 numMergedOcc 0
10 mol 58 unq 1 iso 0 dist 4.88613 8.85156 5.6823 4.37642 7.68678 9.53438 numMergedOcc 0
11 mol 71 unq 0 iso 0 dist 9.50139 9.47964 11.9362 11.8589 17.963 9.0504 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 8.67532 9.762 5.9144 7.25285 9.06229 5.7684 numMergedOcc 0
13 mol 76 unq 0 iso 0 dist 6.4551 6.63973 6.77898 13.5835 14.1196 8.77077 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 5.9747 8.3505 3.9764 11.9783 11.3043 9.84703 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 5.9747 8.3505 3.9764 7.43001 6.65501 4.62494 numMergedOcc 0
16 mol 109 unq 0 iso 0 dist 8.3164 9.94704 5.00433 4.81814 7.80523 7.56755 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 8.82535 9.10803 9.20252 6.49348 10.4034 6.18678 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 6.18763 9.10803 9.85023 6.49348 8.00003 6.18678 numMergedOcc 0
19 mol 119 unq 2 iso 0 dist 8.44385 9.10803 12.4829 6.49348 13.7362 6.18678 numMergedOcc 0
20 mol 119 unq 3 iso 0 dist 5.63005 9.10803 8.84069 6.49348 9.77873 6.18678 numMergedOcc 0
21 mol 128 unq 0 iso 0 dist 8.01677 9.45412 10.0888 10.9024 16.0239 7.8929 numMergedOcc 0
22 mol 129 unq 0 iso 0 dist 6.38163 6.53559 6.28232 4.92611 7.58957 6.34626 numMergedOcc 0
23 mol 154 unq 0 iso 0 dist 7.26897 5.06116 5.68978 9.10645 14.249 8.71789 numMergedOcc 0
24 mol 154 unq 1 iso 0 dist 7.26897 5.06116 5.68978 4.02111 9.23461 5.2693 numMergedOcc 0
25 mol 155 unq 0 iso 0 dist 4.44292 7.25009 7.10286 8.61147 11.1616 9.16358 numMergedOcc 0
26 mol 155 unq 1 iso 0 dist 4.44292 7.25009 7.10286 5.45915 6.53347 9.24038 numMergedOcc 0
27 mol 171 unq 0 iso 0 dist 6.07091 6.51523 7.5383 4.98945 9.61462 7.47964 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 8.96988 9.18289 13.0315 6.33168 14.1868 6.56416 numMergedOcc 0
29 mol 186 unq 1 iso 0 dist 8.96988 6.52441 10.6555 6.33168 14.1868 6.88127 numMergedOcc 0
30 mol 186 unq 2 iso 0 dist 8.96988 6.26168 5.75483 5.18732 10.6519 9.99396 numMergedOcc 0
31 mol 212 unq 0 iso 0 dist 5.87223 5.03184 3.9436 6.48939 8.69988 9.10288 numMergedOcc 0
32 mol 212 unq 1 iso 0 dist 5.87223 5.03184 3.9436 5.81626 8.55903 6.19798 numMergedOcc 0
33 mol 212 unq 2 iso 0 dist 5.87223 5.03184 3.9436 6.89781 10.6618 7.24895 numMergedOcc 0
34 mol 224 unq 0 iso 0 dist 8.39002 6.32334 7.05804 4.12728 11.9653 9.25617 numMergedOcc 0
35 mol 224 unq 1 iso 0 dist 8.39002 6.32334 7.05804 7.13796 14.5387 9.05276 numMergedOcc 0
36 mol 224 unq 2 iso 0 dist 8.46129 6.32334 5.76843 4.12728 10.8507 9.25617 numMergedOcc 0
37 mol 224 unq 3 iso 0 dist 8.46129 6.32334 5.76843 7.13796 13.4196 9.05276 numMergedOcc 0
38 mol 224 unq 4 iso 0 dist 9.2053 6.32334 4.54188 4.12728 12.9355 9.25617 numMergedOcc 0
39 mol 224 unq 5 iso 0 dist 9.2053 6.32334 4.54188 7.13796 12.8311 9.05276 numMergedOcc 0
40 mol 266 unq 0 iso 0 dist 8.59986 6.22195 4.74189 6.00136 10.1085 9.63518 numMergedOcc 0
41 mol 274 unq 0 iso 0 dist 6.55855 4.97796 8.87855 6.70266 9.45514 9.65868 numMergedOcc 0
42 mol 274 unq 1 iso 0 dist 6.55855 4.97796 8.87855 5.15747 6.39866 8.60027 numMergedOcc 0
43 mol 274 unq 2 iso 0 dist 9.52894 4.97796 13.0867 6.70266 7.1729 9.65868 numMergedOcc 0
44 mol 274 unq 3 iso 0 dist 9.52894 4.97796 13.0867 5.15747 10.6913 8.60027 numMergedOcc 0
45 mol 274 unq 4 iso 0 dist 9.71801 7.15079 11.4471 9.95931 15.461 7.77765 numMergedOcc 0
46 mol 292 unq 0 iso 0 dist 9.64124 5.72473 6.80049 6.08322 14.7209 8.62162 numMergedOcc 0
47 mol 292 unq 1 iso 0 dist 9.30668 5.72473 7.8414 6.08322 14.0973 8.62162 numMergedOcc 0
