0 mol 8 unq 0 iso 0 dist 9.95422 8.89145 12.7683 9.31461 9.30213 11.4855 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.95422 6.92865 12.3778 9.31461 9.30213 5.96331 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 7.65219 8.89145 13.0138 9.31461 4.84108 11.4855 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 7.65219 6.92865 5.95251 9.31461 4.84108 5.96331 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 6.8824 7.78708 5.3957 9.97466 12.7353 8.32752 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 6.8824 7.84393 10.38 9.97466 12.7353 6.3033 numMergedOcc 0
6 mol 19 unq 2 iso 0 dist 8.33492 8.18518 9.01721 5.96899 10.2789 9.32418 numMergedOcc 0
7 mol 19 unq 3 iso 0 dist 8.33492 7.78708 10.6828 9.97466 4.87227 8.32752 numMergedOcc 0
8 mol 19 unq 4 iso 0 dist 8.33492 7.84393 6.01189 9.97466 4.87227 6.3033 numMergedOcc 0
9 mol 41 unq 0 iso 0 dist 6.42931 4.68793 8.85978 7.7727 7.30423 9.50094 numMergedOcc 0
10 mol 48 unq 0 iso 0 dist 9.65989 5.36645 10.2391 5.43913 6.60964 3.63758 numMergedOcc 0
11 mol 48 unq 1 iso 0 dist 9.65989 5.36645 10.2391 8.26877 8.54787 6.88863 numMergedOcc 0
12 mol 48 unq 2 iso 0 dist 8.66272 5.36645 10.8186 5.43913 8.75048 3.63758 numMergedOcc 0
13 mol 48 unq 3 iso 0 dist 8.66272 5.36645 10.8186 8.26877 13.5473 6.88863 numMergedOcc 0
14 mol 140 unq 0 iso 0 dist 9.35707 9.41832 12.5321 7.82005 11.929 9.54649 numMergedOcc 0
15 mol 140 unq 1 iso 0 dist 9.35707 5.44596 11.9489 7.82005 11.929 4.56057 numMergedOcc 0
16 mol 140 unq 2 iso 0 dist 9.35707 9.69069 4.95731 7.82005 11.929 9.9108 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 7.78154 5.30872 7.64386 8.10681 6.91785 7.20921 numMergedOcc 0
18 mol 143 unq 1 iso 0 dist 5.9183 5.30872 5.11989 8.10681 5.80693 7.20921 numMergedOcc 0
19 mol 143 unq 2 iso 0 dist 5.9183 7.5984 6.3915 5.33772 7.33175 6.75249 numMergedOcc 0
20 mol 175 unq 0 iso 0 dist 9.30469 6.73365 12.0877 8.06007 9.89765 12.5746 numMergedOcc 0
21 mol 175 unq 1 iso 0 dist 9.30469 9.45659 9.79219 8.06007 9.89765 13.5565 numMergedOcc 0
22 mol 175 unq 2 iso 0 dist 9.30469 9.44856 5.94412 8.06007 9.89765 9.03819 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 5.65146 6.99623 5.47219 9.12589 8.12735 4.42375 numMergedOcc 0
24 mol 186 unq 1 iso 0 dist 5.65146 8.32829 6.37037 7.32974 8.09407 5.62024 numMergedOcc 0
25 mol 186 unq 2 iso 0 dist 4.47148 9.08672 7.6995 5.97886 8.25671 11.0596 numMergedOcc 0
26 mol 206 unq 0 iso 0 dist 8.21649 9.19263 8.21044 5.73198 6.18377 4.94346 numMergedOcc 0
27 mol 219 unq 0 iso 0 dist 9.48678 8.09769 13.0834 8.58891 3.97661 10.0702 numMergedOcc 0
28 mol 219 unq 1 iso 0 dist 9.48678 7.24832 6.90908 8.58891 3.97661 5.0824 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 8.59579 7.45019 10.7098 8.17436 11.3889 12.3128 numMergedOcc 0
30 mol 288 unq 0 iso 0 dist 8.59579 7.45019 10.7098 8.17436 11.3889 12.3128 numMergedOcc 0
31 mol 289 unq 0 iso 0 dist 8.59579 7.45019 10.7098 8.17436 11.3889 12.3128 numMergedOcc 0
