0 mol 68 unq 0 iso 0 dist 7.10633 6.98378 10.647 8.14146 7.41059 6.11964 numMergedOcc 0
1 mol 68 unq 1 iso 0 dist 7.10633 6.22209 6.07491 8.14146 7.41059 4.40925 numMergedOcc 0
2 mol 128 unq 0 iso 0 dist 8.2617 9.52878 8.36211 9.47151 14.397 9.88328 numMergedOcc 0
3 mol 128 unq 1 iso 0 dist 8.2617 9.52878 8.36211 6.18485 12.7917 11.0083 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 8.18035 9.24258 7.56409 6.27279 6.04091 4.17212 numMergedOcc 0
5 mol 131 unq 1 iso 0 dist 8.18035 9.55246 9.47173 6.27279 6.04091 9.64263 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.047 9.65096 7.52391 6.48026 6.14377 13.5876 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.96012 9.65096 13.0543 6.48026 14.9571 13.5876 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 9.95567 8.64606 15.912 8.71163 5.96025 13.5514 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 8.66775 7.89425 7.76905 7.96385 15.8947 11.2154 numMergedOcc 0
10 mol 176 unq 1 iso 0 dist 8.66775 8.36552 5.22451 7.96385 15.8947 15.7327 numMergedOcc 0
11 mol 176 unq 2 iso 0 dist 8.66775 7.8954 15.212 7.96385 15.8947 5.08362 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 7.04798 8.78345 15.0013 6.45779 4.44921 13.9769 numMergedOcc 0
13 mol 194 unq 1 iso 0 dist 8.4376 8.78345 16.8324 6.45779 8.8996 13.9769 numMergedOcc 0
14 mol 211 unq 0 iso 0 dist 9.03554 7.79873 11.4935 9.69937 7.76201 13.9486 numMergedOcc 0
15 mol 211 unq 1 iso 0 dist 8.19203 7.79873 13.8833 9.69937 5.09994 13.9486 numMergedOcc 0
16 mol 268 unq 0 iso 0 dist 7.96508 6.65505 13.1353 7.36234 9.69026 6.58374 numMergedOcc 0
17 mol 282 unq 0 iso 0 dist 6.05687 7.66682 8.36397 8.35986 7.25785 8.22593 numMergedOcc 0
