0 mol 32 unq 0 iso 0 dist 7.33936 7.29783 6.49199 8.70331 4.84198 5.33785 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.80334 6.68961 11.7517 5.43913 5.67204 9.40261 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.80334 6.68961 11.7517 8.26877 4.28224 13.3796 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.18002 8.52421 10.5767 5.26566 8.14072 3.73169 numMergedOcc 0
4 mol 68 unq 1 iso 0 dist 8.18002 8.52421 10.5767 6.27118 4.262 7.15831 numMergedOcc 0
5 mol 68 unq 2 iso 0 dist 7.07032 8.52421 5.64912 5.26566 5.54348 3.73169 numMergedOcc 0
6 mol 68 unq 3 iso 0 dist 7.07032 8.52421 5.64912 6.27118 3.9061 7.15831 numMergedOcc 0
7 mol 107 unq 0 iso 0 dist 9.31826 9.68222 8.87968 7.2168 6.48911 5.88785 numMergedOcc 0
8 mol 107 unq 1 iso 0 dist 9.31826 8.28321 3.60392 7.2168 6.48911 8.55732 numMergedOcc 0
9 mol 140 unq 0 iso 0 dist 5.17739 8.4449 4.04445 7.82005 6.69665 5.24385 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 5.80433 5.27578 8.96928 8.99777 4.30589 12.7357 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 6.8285 5.27578 6.66771 8.99777 8.75635 12.7357 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 6.49786 8.25953 8.96928 7.32974 4.30589 12.7357 numMergedOcc 0
13 mol 186 unq 3 iso 0 dist 8.43154 8.25953 6.66771 7.32974 8.75635 12.7357 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 9.01377 5.81438 9.00714 8.77524 14.6896 5.80328 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 5.60554 6.58871 6.59014 7.94351 4.23392 8.82823 numMergedOcc 0
16 mol 219 unq 0 iso 0 dist 9.38761 8.3704 8.80389 8.58891 9.62023 6.69913 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 6.45422 9.52528 10.3708 8.99666 7.41325 15.3449 numMergedOcc 0
18 mol 272 unq 0 iso 0 dist 6.52635 5.38409 6.15056 9.87477 10.2516 6.69425 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 6.59786 8.66133 8.0478 8.13393 3.40141 9.06868 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 6.59786 6.95569 10.0013 8.13393 3.40141 11.8515 numMergedOcc 0
21 mol 273 unq 2 iso 0 dist 7.96519 8.66133 14.4172 8.13393 9.36978 9.06868 numMergedOcc 0
22 mol 273 unq 3 iso 0 dist 7.96519 6.95569 4.42663 8.13393 9.36978 11.8515 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 7.61398 5.49829 8.8752 7.08681 13.7458 8.34667 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 7.61398 5.49829 8.8752 4.95596 5.88535 8.31211 numMergedOcc 0
25 mol 285 unq 2 iso 0 dist 7.61398 5.49829 8.8752 6.3508 10.021 8.08247 numMergedOcc 0
26 mol 285 unq 3 iso 0 dist 7.61398 5.49829 8.8752 8.3005 3.73773 7.23311 numMergedOcc 0
27 mol 285 unq 4 iso 0 dist 7.61398 6.24134 10.6055 7.08681 13.7458 4.98469 numMergedOcc 0
28 mol 285 unq 5 iso 0 dist 7.61398 6.24134 10.6055 4.95596 5.88535 10.5542 numMergedOcc 0
29 mol 285 unq 6 iso 0 dist 7.61398 6.24134 10.6055 6.3508 10.021 12.5361 numMergedOcc 0
30 mol 285 unq 7 iso 0 dist 7.61398 6.24134 10.6055 8.3005 3.73773 11.9464 numMergedOcc 0
