0 mol 30 unq 0 iso 0 dist 8.02713 6.40398 5.24517 10.1033 11.7185 8.58568 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.32818 8.8717 15.424 10.8155 19.6646 9.36424 numMergedOcc 0
2 mol 74 unq 0 iso 0 dist 9.46313 5.50438 7.42971 6.21762 12.8213 8.2657 numMergedOcc 0
3 mol 74 unq 1 iso 0 dist 9.02317 5.50438 5.2386 6.21762 13.122 8.2657 numMergedOcc 0
4 mol 74 unq 2 iso 0 dist 7.81632 5.50438 7.00308 6.21762 13.4207 8.2657 numMergedOcc 0
5 mol 74 unq 3 iso 0 dist 6.50183 8.97568 7.00308 11.4527 13.4207 8.2657 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 8.54678 8.82052 13.0179 5.84688 13.0291 8.87194 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 8.47929 8.83011 7.33078 5.21787 5.89919 9.89462 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 9.71728 8.83011 5.34549 5.21787 8.04178 9.89462 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 8.36066 6.03116 6.33168 10.4329 13.8491 7.53158 numMergedOcc 0
10 mol 154 unq 1 iso 0 dist 8.36066 6.03116 6.33168 7.55279 13.1177 7.43407 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 8.88105 5.32135 8.77064 5.65278 14.1236 7.35329 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 8.08225 8.74174 6.25864 14.2403 13.7532 8.21476 numMergedOcc 0
13 mol 163 unq 1 iso 0 dist 8.08225 8.74174 6.25864 9.45801 12.717 7.66897 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.30192 6.59729 6.11242 4.34714 11.7753 9.59034 numMergedOcc 0
15 mol 189 unq 0 iso 0 dist 8.91697 9.5853 6.90931 14.9891 14.6724 9.6013 numMergedOcc 0
16 mol 189 unq 1 iso 0 dist 8.91697 9.5853 6.90931 15.4181 14.8275 8.32712 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 8.27047 6.47064 5.33482 10.353 12.2801 8.85215 numMergedOcc 0
18 mol 240 unq 0 iso 0 dist 5.05078 5.46783 5.02268 12.0688 12.302 8.33853 numMergedOcc 0
19 mol 240 unq 1 iso 0 dist 5.05078 5.46783 5.02268 5.53988 8.3417 5.66537 numMergedOcc 0
20 mol 240 unq 2 iso 0 dist 7.99097 5.46783 3.38705 12.0688 10.0131 8.33853 numMergedOcc 0
21 mol 240 unq 3 iso 0 dist 7.99097 5.46783 3.38705 5.53988 9.01347 5.66537 numMergedOcc 0
