0 mol 26 unq 0 iso 0 dist 9.90242 13.1932 9.37435 15.9311 8.97566 4.79817 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.90242 13.1932 9.37435 8.4126 8.81085 5.2495 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.07029 4.18634 9.63803 7.18898 7.89667 8.86888 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 9.30547 13.9221 8.55202 13.8332 8.79378 9.44812 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.00045 11.1577 4.62314 16.7918 8.03895 6.99884 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 9.00045 11.1577 4.62314 14.0325 5.68873 3.75261 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 9.00045 11.2541 4.41745 16.7918 8.03895 7.80916 numMergedOcc 0
7 mol 78 unq 3 iso 0 dist 9.00045 11.2541 4.41745 14.0325 5.68873 5.07608 numMergedOcc 0
8 mol 78 unq 4 iso 0 dist 9.00045 14.937 6.35234 16.7918 8.03895 4.75637 numMergedOcc 0
9 mol 78 unq 5 iso 0 dist 9.00045 14.937 6.35234 14.0325 5.68873 5.62063 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 7.92498 9.33696 6.12348 7.50896 7.08403 3.52445 numMergedOcc 0
11 mol 128 unq 0 iso 0 dist 7.4738 6.24319 9.45412 9.10228 5.38983 11.7784 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 6.98479 4.84029 8.85403 6.52877 7.70383 6.15206 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 8.11268 9.33941 6.27683 7.64279 7.33643 3.59996 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 9.53702 11.4368 6.51523 9.6035 7.06555 7.20382 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 6.22466 13.2447 9.18289 9.09753 6.99587 4.97041 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 6.22466 13.2447 9.18289 6.7472 4.37577 6.50779 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 6.22466 6.21482 6.52441 9.09753 6.99587 4.75583 numMergedOcc 0
18 mol 186 unq 3 iso 0 dist 6.22466 6.21482 6.52441 6.7472 4.37577 3.11607 numMergedOcc 0
19 mol 186 unq 4 iso 0 dist 6.22466 4.68208 6.26168 9.09753 6.99587 5.53349 numMergedOcc 0
20 mol 186 unq 5 iso 0 dist 6.22466 4.68208 6.26168 6.7472 4.37577 4.65666 numMergedOcc 0
21 mol 192 unq 0 iso 0 dist 6.88947 8.2928 7.93715 5.81179 5.05414 3.41605 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 6.88947 8.2928 7.93715 3.26277 7.16964 7.59825 numMergedOcc 0
23 mol 235 unq 0 iso 0 dist 7.47945 3.35321 5.39924 16.5237 9.82099 14.4239 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 6.54859 7.27242 8.58772 3.2549 8.69334 9.51878 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 9.33149 12.3683 8.69325 13.8352 5.28731 10.7499 numMergedOcc 0
26 mol 285 unq 1 iso 0 dist 9.33149 13.1909 5.09181 13.8352 5.28731 4.98469 numMergedOcc 0
27 mol 285 unq 2 iso 0 dist 5.77107 13.2325 8.69325 5.32175 5.28731 10.7499 numMergedOcc 0
28 mol 285 unq 3 iso 0 dist 5.77107 7.67857 5.09181 5.32175 5.28731 4.98469 numMergedOcc 0
