0 mol 85 unq 0 iso 0 dist 9.9795 5.20528 9.29301 4.78636 13.3997 5.05893 numMergedOcc 0
1 mol 85 unq 1 iso 0 dist 9.9795 5.20528 9.29301 7.24335 14.6517 5.71866 numMergedOcc 0
2 mol 96 unq 0 iso 0 dist 6.21351 5.19438 5.04559 5.30464 11.4929 9.13187 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 8.86938 8.65004 11.8396 10.5025 13.5845 7.67238 numMergedOcc 0
4 mol 112 unq 1 iso 0 dist 8.86938 9.86487 18.0868 4.9759 13.1243 8.72725 numMergedOcc 0
5 mol 112 unq 2 iso 0 dist 8.86938 9.86487 18.0868 6.59976 15.3113 6.11407 numMergedOcc 0
6 mol 112 unq 3 iso 0 dist 7.42474 8.65004 12.2656 10.5025 16.3693 7.67238 numMergedOcc 0
7 mol 112 unq 4 iso 0 dist 7.42474 9.86487 5.76986 4.9759 9.05166 8.72725 numMergedOcc 0
8 mol 112 unq 5 iso 0 dist 7.42474 9.86487 5.76986 6.59976 5.56994 6.11407 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 4.68975 7.85849 4.60632 15.9796 13.0242 9.0176 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 8.84656 7.85849 5.29786 15.9796 7.93372 9.0176 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 4.9155 7.85849 5.71679 15.9796 11.988 9.0176 numMergedOcc 0
12 mol 134 unq 3 iso 0 dist 9.42271 6.08299 5.71679 11.6261 11.988 9.0176 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 6.28961 8.59976 10.3792 6.43144 11.1627 6.0859 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 6.28961 8.59976 10.3792 6.37039 11.4792 6.05009 numMergedOcc 0
15 mol 169 unq 2 iso 0 dist 6.28961 9.71763 8.6888 6.43144 11.1627 9.15283 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 6.09874 9.01017 6.06566 6.22666 10.0333 9.06571 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 6.09874 9.01017 6.06566 5.43915 8.59874 7.35884 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.52413 8.34668 15.1778 4.68208 11.3216 9.99396 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 8.95071 5.27184 9.52712 4.51728 10.0129 6.15635 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 9.79022 6.59092 7.81483 4.3735 6.31969 5.61969 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 9.13226 6.74022 5.29529 11.3961 12.8334 8.60027 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 7.151 6.71956 6.28695 10.3171 9.57499 9.26157 numMergedOcc 0
23 mol 277 unq 1 iso 0 dist 8.53324 6.71956 4.37645 10.3171 5.46926 9.26157 numMergedOcc 0
24 mol 277 unq 2 iso 0 dist 7.23956 6.71956 7.70529 10.3171 8.9682 9.26157 numMergedOcc 0
25 mol 278 unq 0 iso 0 dist 9.91518 6.9592 14.3412 5.90283 15.2028 9.03998 numMergedOcc 0
