0 mol 4 unq 0 iso 0 dist 8.67981 11.5212 6.12485 19.7457 11.4817 9.65942 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 9.1125 11.8229 8.2106 19.1898 11.8048 8.64111 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.41842 10.8869 8.04019 14.817 7.07421 8.07619 numMergedOcc 0
3 mol 33 unq 1 iso 0 dist 8.41842 10.1727 7.44828 5.73206 4.77227 5.52908 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 7.5203 6.20447 8.68012 6.44158 5.80848 8.95619 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 7.38663 5.18893 7.36738 6.72594 8.39751 5.96987 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 9.1662 3.86843 6.49343 7.09184 13.0828 7.7106 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 6.36357 10.4989 6.79959 12.8066 7.12864 7.06817 numMergedOcc 0
8 mol 103 unq 1 iso 0 dist 5.52999 6.64985 6.79959 10.8993 7.12864 7.06817 numMergedOcc 0
9 mol 103 unq 2 iso 0 dist 7.52954 6.78021 6.56481 12.7906 8.17578 7.06817 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 9.8446 4.08841 6.85551 9.63241 5.54803 6.89325 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 8.40718 12.4189 6.20044 15.2536 10.7478 9.85636 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 7.47852 5.9027 7.65121 10.6641 4.37243 9.24959 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 6.22332 4.95393 7.65121 6.97662 4.37243 9.24959 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 7.54614 12.983 8.74399 19.2272 12.0828 9.8349 numMergedOcc 0
15 mol 226 unq 1 iso 0 dist 9.5942 4.31761 8.52996 9.03261 4.1635 9.8349 numMergedOcc 0
16 mol 226 unq 2 iso 0 dist 9.5942 4.31761 8.52996 7.67573 9.6805 6.72708 numMergedOcc 0
17 mol 226 unq 3 iso 0 dist 9.5942 4.31761 8.52996 11.4049 6.06315 8.01046 numMergedOcc 0
18 mol 244 unq 0 iso 0 dist 9.53211 11.4783 7.43391 17.634 9.74679 9.88553 numMergedOcc 0
19 mol 244 unq 1 iso 0 dist 9.53211 11.4783 7.43391 12.267 5.65728 8.99869 numMergedOcc 0
20 mol 250 unq 0 iso 0 dist 9.54274 8.6355 8.69437 14.3382 6.93378 8.4116 numMergedOcc 0
21 mol 250 unq 1 iso 0 dist 8.65735 7.30402 8.69437 11.9911 6.93378 8.4116 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 9.36806 4.39397 9.39714 13.0774 13.2572 8.73645 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 7.51446 9.47559 9.39714 16.6998 13.2572 8.73645 numMergedOcc 0
24 mol 286 unq 0 iso 0 dist 8.97304 5.95493 6.83763 11.6047 5.74706 8.23648 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 6.72 3.74041 7.65009 10.4759 5.0794 9.99184 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 6.72 3.74041 7.65009 10.4759 5.0794 9.99184 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 6.72 3.74041 7.65009 10.4759 5.0794 9.99184 numMergedOcc 0
