0 mol 12 unq 0 iso 0 dist 8.46546 6.05244 5.0983 6.65672 6.33746 6.55567 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 7.59016 9.01993 4.77336 7.39066 5.60099 6.36636 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.69758 5.71014 6.10997 7.92586 14.6477 8.85178 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 9.25184 8.44761 16.2151 7.51631 16.2547 3.56619 numMergedOcc 0
4 mol 68 unq 1 iso 0 dist 9.25184 6.81124 13.8355 7.51631 16.2547 6.23171 numMergedOcc 0
5 mol 68 unq 2 iso 0 dist 9.43167 8.44761 15.8706 7.51631 15.8674 3.56619 numMergedOcc 0
6 mol 68 unq 3 iso 0 dist 9.43167 6.81124 12.1622 7.51631 15.8674 6.23171 numMergedOcc 0
7 mol 68 unq 4 iso 0 dist 9.69923 6.27321 11.5132 4.9983 9.70187 3.99506 numMergedOcc 0
8 mol 70 unq 0 iso 0 dist 9.60641 5.76805 12.0376 9.87737 16.0618 10.0384 numMergedOcc 0
9 mol 70 unq 1 iso 0 dist 9.60641 5.76805 12.0376 6.7303 13.6348 6.36433 numMergedOcc 0
10 mol 70 unq 2 iso 0 dist 7.19617 5.76805 11.4909 9.87737 11.1525 10.0384 numMergedOcc 0
11 mol 70 unq 3 iso 0 dist 7.19617 5.76805 11.4909 6.7303 9.79464 6.36433 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 5.74157 8.64736 13.2031 5.98764 6.29235 14.0777 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 8.58504 6.15011 5.60494 4.96173 7.64986 3.79182 numMergedOcc 0
14 mol 92 unq 1 iso 0 dist 5.94598 6.14674 5.60494 4.55309 7.64986 3.79182 numMergedOcc 0
15 mol 128 unq 0 iso 0 dist 9.74069 4.89256 8.67414 7.66528 5.13616 6.30769 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 5.56994 6.01599 6.89624 8.08259 7.92829 12.8363 numMergedOcc 0
17 mol 156 unq 1 iso 0 dist 5.56994 5.42285 5.66705 8.08259 7.92829 5.64188 numMergedOcc 0
18 mol 156 unq 2 iso 0 dist 8.99176 6.01599 12.4917 8.08259 3.37658 12.8363 numMergedOcc 0
19 mol 156 unq 3 iso 0 dist 8.99176 5.42285 5.80433 8.08259 3.37658 5.64188 numMergedOcc 0
20 mol 180 unq 0 iso 0 dist 9.85529 8.92145 10.1364 5.70326 8.6624 3.77126 numMergedOcc 0
21 mol 180 unq 1 iso 0 dist 9.85529 8.67796 14.113 5.70326 8.6624 5.46832 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 9.38925 5.75445 8.95878 8.32382 11.8908 8.76971 numMergedOcc 0
23 mol 230 unq 1 iso 0 dist 8.71717 5.75445 10.3317 8.32382 7.68924 8.76971 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 8.69185 4.76698 6.93843 4.54064 5.76999 3.60349 numMergedOcc 0
