0 mol 7 unq 0 iso 0 dist 6.64176 6.70503 5.99972 8.80895 4.60206 5.51421 9.76051 7.25346 7.88043 10.3237 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.64176 6.70503 5.99972 8.80895 4.60206 5.51421 9.04663 10.0658 8.80762 13 numMergedOcc 0
2 mol 65 unq 0 iso 0 dist 8.70783 10.8737 6.72639 7.62028 6.59475 8.76461 15.8178 9.35965 9.14931 9.11969 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 9.04937 7.79117 8.99399 11.0698 5.73999 6.40546 12.1563 8.28905 6.98934 6.00304 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 9.04937 7.79117 8.99399 11.0698 5.73999 6.40546 9.69341 4.99495 7.99623 6.64646 numMergedOcc 0
5 mol 162 unq 0 iso 0 dist 9.06613 6.66205 6.45896 12.1214 4.13881 8.25167 8.47144 4.56165 8.00506 5.49559 numMergedOcc 0
6 mol 180 unq 0 iso 0 dist 8.66298 5.31 5.85827 13.1502 10.6052 9.88732 10.2124 4.02573 9.18528 12.4792 numMergedOcc 0
7 mol 180 unq 1 iso 0 dist 8.66298 5.31 5.85827 10.0322 5.62869 5.77949 10.2124 4.02573 9.18528 8.4927 numMergedOcc 0
8 mol 180 unq 2 iso 0 dist 8.66298 5.31 5.85827 13.5864 8.39191 8.68403 10.2124 4.02573 9.18528 11.4009 numMergedOcc 0
9 mol 180 unq 3 iso 0 dist 8.66298 5.31 5.85827 5.78414 4.11186 5.80441 10.2124 4.02573 9.18528 5.05257 numMergedOcc 0
10 mol 192 unq 0 iso 0 dist 9.71614 9.58683 8.77999 17.6782 11.0516 9.90531 11.4597 3.86183 7.24199 7.32981 numMergedOcc 0
11 mol 192 unq 1 iso 0 dist 8.81185 10.9985 8.77999 18.3634 11.0516 9.90531 11.736 3.86183 7.24199 7.32981 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 8.06858 10.1617 9.74144 13.7865 9.39384 5.87223 11.2133 9.75095 6.29767 6.8255 numMergedOcc 0
13 mol 212 unq 1 iso 0 dist 8.06858 10.1617 9.74144 13.7865 9.39384 5.87223 17.3075 15.1535 8.74585 8.90296 numMergedOcc 0
14 mol 212 unq 2 iso 0 dist 8.06858 10.1617 9.74144 7.35349 4.69067 8.062 11.2133 9.75095 6.29767 11.009 numMergedOcc 0
15 mol 212 unq 3 iso 0 dist 8.06858 10.1617 9.74144 7.35349 4.69067 8.062 17.3075 15.1535 8.74585 12.2246 numMergedOcc 0
16 mol 212 unq 4 iso 0 dist 8.06858 10.1617 9.74144 12.302 5.37854 8.70011 11.2133 9.75095 6.29767 8.66123 numMergedOcc 0
17 mol 212 unq 5 iso 0 dist 8.06858 10.1617 9.74144 12.302 5.37854 8.70011 17.3075 15.1535 8.74585 12.2545 numMergedOcc 0
18 mol 212 unq 6 iso 0 dist 7.89739 5.19318 8.69988 7.67675 6.48939 5.87223 9.94185 12.8059 6.29767 6.8255 numMergedOcc 0
19 mol 212 unq 7 iso 0 dist 7.89739 5.19318 8.69988 7.67675 6.48939 5.87223 5.90507 4.21442 8.74585 8.90296 numMergedOcc 0
20 mol 212 unq 8 iso 0 dist 7.89739 5.19318 8.69988 12.2251 10.4595 8.062 9.94185 12.8059 6.29767 11.009 numMergedOcc 0
21 mol 212 unq 9 iso 0 dist 7.89739 5.19318 8.69988 12.2251 10.4595 8.062 5.90507 4.21442 8.74585 12.2246 numMergedOcc 0
22 mol 212 unq 10 iso 0 dist 7.89739 5.19318 8.69988 12.1291 8.87823 8.70011 9.94185 12.8059 6.29767 8.66123 numMergedOcc 0
23 mol 212 unq 11 iso 0 dist 7.89739 5.19318 8.69988 12.1291 8.87823 8.70011 5.90507 4.21442 8.74585 12.2545 numMergedOcc 0
24 mol 212 unq 12 iso 0 dist 6.12161 5.19318 8.55903 7.67675 5.81626 5.87223 9.94185 10.7914 6.29767 6.8255 numMergedOcc 0
25 mol 212 unq 13 iso 0 dist 6.12161 5.19318 8.55903 7.67675 5.81626 5.87223 5.90507 6.69225 8.74585 8.90296 numMergedOcc 0
26 mol 212 unq 14 iso 0 dist 6.12161 5.19318 8.55903 12.2251 14.0193 8.062 9.94185 10.7914 6.29767 11.009 numMergedOcc 0
27 mol 212 unq 15 iso 0 dist 6.12161 5.19318 8.55903 12.2251 14.0193 8.062 5.90507 6.69225 8.74585 12.2246 numMergedOcc 0
28 mol 212 unq 16 iso 0 dist 6.12161 5.19318 8.55903 12.1291 10.7245 8.70011 9.94185 10.7914 6.29767 8.66123 numMergedOcc 0
29 mol 212 unq 17 iso 0 dist 6.12161 5.19318 8.55903 12.1291 10.7245 8.70011 5.90507 6.69225 8.74585 12.2545 numMergedOcc 0
30 mol 234 unq 0 iso 0 dist 8.88567 5.19951 6.30154 5.67249 6.06471 7.46434 12.1995 7.82953 9.007 11.2204 numMergedOcc 0
31 mol 234 unq 1 iso 0 dist 8.88567 5.19951 6.30154 12.2496 11.2248 7.50424 12.1995 7.82953 9.007 11.6788 numMergedOcc 0
32 mol 234 unq 2 iso 0 dist 9.45787 5.19951 7.32499 5.67249 11.1213 7.46434 12.1995 5.76537 9.007 11.2204 numMergedOcc 0
33 mol 234 unq 3 iso 0 dist 9.45787 5.19951 7.32499 12.2496 10.6488 7.50424 12.1995 5.76537 9.007 11.6788 numMergedOcc 0
34 mol 258 unq 0 iso 0 dist 7.41653 6.88723 9.63959 10.577 5.32742 9.59174 6.51617 4.22544 9.1925 5.79227 numMergedOcc 0
35 mol 259 unq 0 iso 0 dist 9.98231 5.69584 7.08526 11.678 8.74892 9.54857 13.3883 6.31909 8.55558 12.7168 numMergedOcc 0
