0 mol 7 unq 0 iso 0 dist 9.18323 7.4516 10.1841 5.30199 9.68596 9.87885 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.18323 7.4516 10.1841 12.8047 12.9581 6.1206 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.51581 7.4516 5.81654 5.30199 10.7018 9.87885 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.51581 7.4516 5.81654 12.8047 10.2313 6.1206 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 5.78919 5.35318 5.5683 5.51296 8.72114 9.67164 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 5.78919 5.35318 5.5683 9.9698 10.3148 5.99459 numMergedOcc 0
6 mol 7 unq 6 iso 0 dist 8.04923 5.35318 6.12483 5.51296 11.2662 9.67164 numMergedOcc 0
7 mol 7 unq 7 iso 0 dist 8.04923 5.35318 6.12483 9.9698 5.99972 5.99459 numMergedOcc 0
8 mol 46 unq 0 iso 0 dist 7.99847 7.34647 4.07933 4.71097 11.5014 9.9787 numMergedOcc 0
9 mol 67 unq 0 iso 0 dist 9.52126 9.10084 8.81493 8.37508 14.483 8.3733 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 6.56349 6.91989 3.92737 9.87299 12.5931 9.64383 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 6.56349 6.91989 3.92737 6.5508 4.47349 7.54889 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 6.56349 6.91989 3.92737 10.457 5.65185 7.78931 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 6.56349 5.42942 3.94967 10.5282 6.7117 5.10496 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 6.56349 5.42942 3.94967 5.5392 9.42961 5.92242 numMergedOcc 0
15 mol 98 unq 5 iso 0 dist 6.56349 5.42942 3.94967 6.5508 4.47349 5.2571 numMergedOcc 0
16 mol 98 unq 6 iso 0 dist 6.56349 5.42942 3.94967 10.457 5.65185 8.7497 numMergedOcc 0
17 mol 113 unq 0 iso 0 dist 8.26447 4.54933 7.1951 7.84178 8.8822 8.80934 numMergedOcc 0
18 mol 113 unq 1 iso 0 dist 6.71684 4.54933 3.84573 7.84178 9.66219 8.80934 numMergedOcc 0
19 mol 168 unq 0 iso 0 dist 7.80008 7.66537 4.02702 4.7099 7.44629 6.02086 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.58636 9.41415 3.78314 6.09263 10.5615 9.3498 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 8.58636 9.41415 3.78314 4.97081 7.76163 7.05695 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 8.05239 9.02428 13.4762 12.5931 18.826 9.7982 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 9.99697 7.20837 16.6645 5.63104 11.3835 9.30212 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 6.39535 8.99208 3.92782 6.90369 9.88863 9.74118 numMergedOcc 0
25 mol 292 unq 1 iso 0 dist 6.78832 6.32663 6.32259 11.4616 11.4575 7.20674 numMergedOcc 0
26 mol 292 unq 2 iso 0 dist 6.78832 8.82672 10.1133 9.01849 14.7759 9.9886 numMergedOcc 0
