0 mol 24 unq 0 iso 0 dist 8.15652 8.92687 4.90592 15.461 9.65174 9.63925 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.15652 5.12527 8.16324 15.461 9.65174 12.5427 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.44893 6.2838 4.90592 4.30555 9.65174 9.63925 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.44893 11.8259 8.16324 4.30555 9.65174 12.5427 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.2612 11.5196 9.5053 5.01774 9.41425 8.58071 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 8.72742 13.3807 6.15801 16.7414 9.31883 9.92713 numMergedOcc 0
6 mol 34 unq 1 iso 0 dist 8.72742 13.3807 6.15801 15.4411 9.475 10.6518 numMergedOcc 0
7 mol 34 unq 2 iso 0 dist 8.72742 13.3807 6.15801 15.4933 8.34011 5.94977 numMergedOcc 0
8 mol 34 unq 3 iso 0 dist 8.72742 13.3807 6.15801 9.39237 6.29842 6.35031 numMergedOcc 0
9 mol 34 unq 4 iso 0 dist 8.72742 14.8083 9.63403 16.7414 9.31883 15.7295 numMergedOcc 0
10 mol 34 unq 5 iso 0 dist 8.72742 14.8083 9.63403 15.4411 9.475 16.8534 numMergedOcc 0
11 mol 34 unq 6 iso 0 dist 8.72742 14.8083 9.63403 15.4933 8.34011 12.3865 numMergedOcc 0
12 mol 34 unq 7 iso 0 dist 8.72742 14.8083 9.63403 9.39237 6.29842 5.50427 numMergedOcc 0
13 mol 34 unq 8 iso 0 dist 8.72742 5.89131 8.07314 16.7414 9.31883 16.4972 numMergedOcc 0
14 mol 34 unq 9 iso 0 dist 8.72742 5.89131 8.07314 15.4411 9.475 15.5365 numMergedOcc 0
15 mol 34 unq 10 iso 0 dist 8.72742 5.89131 8.07314 15.4933 8.34011 13.3825 numMergedOcc 0
16 mol 34 unq 11 iso 0 dist 8.72742 5.89131 8.07314 9.39237 6.29842 5.12822 numMergedOcc 0
17 mol 109 unq 0 iso 0 dist 9.9387 9.58922 6.76575 14.2274 9.67274 4.8632 numMergedOcc 0
18 mol 114 unq 0 iso 0 dist 5.36473 8.30856 7.42482 8.14095 6.4569 3.67473 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 8.51895 5.7124 5.39061 8.67179 4.48699 4.94367 numMergedOcc 0
20 mol 163 unq 0 iso 0 dist 8.74174 5.81031 9.79069 10.1781 7.69757 6.5925 numMergedOcc 0
21 mol 163 unq 1 iso 0 dist 8.74174 11.0152 9.27496 10.1781 7.69757 15.5126 numMergedOcc 0
22 mol 182 unq 0 iso 0 dist 9.94949 10.0197 8.43933 7.33017 9.19506 11.8933 numMergedOcc 0
23 mol 182 unq 1 iso 0 dist 9.94949 10.0197 8.43933 11.9628 9.94904 7.36876 numMergedOcc 0
24 mol 182 unq 2 iso 0 dist 9.94949 10.0197 8.43933 13.6283 9.30893 4.17332 numMergedOcc 0
25 mol 205 unq 0 iso 0 dist 9.88251 8.78075 9.17946 11.0081 5.19567 13.6793 numMergedOcc 0
26 mol 209 unq 0 iso 0 dist 6.43914 9.57857 7.97418 4.41097 9.90699 11.5669 numMergedOcc 0
27 mol 252 unq 0 iso 0 dist 9.45457 5.46761 7.39391 5.45887 8.38453 3.99887 numMergedOcc 0
