0 mol 6 unq 0 iso 0 dist 9.38351 9.47965 4.59751 14.255 9.56016 14.0989 16.6659 8.15992 11.5544 9.20957 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.73908 6.88786 9.86454 10.6719 8.52421 14.3217 7.27578 5.26566 10.895 3.73169 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 5.73908 6.88786 9.86454 10.6719 8.52421 14.3217 5.66182 6.27118 11.957 7.15831 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.09675 6.70925 7.78899 10.2047 7.69222 10.0791 11.1342 9.85386 15.65 13.815 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.09675 6.70925 7.78899 10.2047 7.69222 10.0791 8.22845 4.8983 6.8173 11.9118 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.09675 6.70925 7.78899 10.8441 5.82056 9.37392 11.1342 9.85386 15.65 13.7005 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 8.09675 6.70925 7.78899 10.8441 5.82056 9.37392 8.22845 4.8983 6.8173 10.0644 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 8.09675 6.70925 7.78899 15.2203 9.09115 11.6626 11.1342 9.85386 15.65 17.9011 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 8.09675 6.70925 7.78899 15.2203 9.09115 11.6626 8.22845 4.8983 6.8173 12.1501 numMergedOcc 0
9 mol 73 unq 6 iso 0 dist 9.02753 8.95756 7.78899 14.0199 7.69222 10.0791 10.0544 9.85386 15.65 13.815 numMergedOcc 0
10 mol 73 unq 7 iso 0 dist 9.02753 8.95756 7.78899 14.0199 7.69222 10.0791 6.96897 4.8983 6.8173 11.9118 numMergedOcc 0
11 mol 73 unq 8 iso 0 dist 9.02753 8.95756 7.78899 13.7625 5.82056 9.37392 10.0544 9.85386 15.65 13.7005 numMergedOcc 0
12 mol 73 unq 9 iso 0 dist 9.02753 8.95756 7.78899 13.7625 5.82056 9.37392 6.96897 4.8983 6.8173 10.0644 numMergedOcc 0
13 mol 73 unq 10 iso 0 dist 9.02753 8.95756 7.78899 17.5374 9.09115 11.6626 10.0544 9.85386 15.65 17.9011 numMergedOcc 0
14 mol 73 unq 11 iso 0 dist 9.02753 8.95756 7.78899 17.5374 9.09115 11.6626 6.96897 4.8983 6.8173 12.1501 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 5.31333 9.89709 9.79728 9.03587 5.27578 13.507 12.2056 8.99777 12.9744 12.7357 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 8.40718 5.67196 11.2342 12.5259 5.81438 16.4188 16.6893 8.77524 19.9526 5.80328 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 8.72578 5.89788 10.8948 3.59923 6.58871 5.27487 8.03625 7.94351 13.4849 8.82823 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 6.73794 8.78928 4.62586 3.80794 8.66133 10.2471 10.5232 8.13393 9.72798 9.06868 numMergedOcc 0
19 mol 273 unq 1 iso 0 dist 6.73794 8.78928 4.62586 13.255 6.95569 5.63226 10.5232 8.13393 9.72798 11.8515 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 7.47179 8.34389 10.9407 9.23896 6.06665 15.8219 5.42266 8.73403 11.8073 8.63376 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 7.47179 8.34389 10.9407 9.23896 6.06665 15.8219 5.42266 8.73403 11.8073 8.63376 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 7.47179 8.34389 10.9407 9.23896 6.06665 15.8219 5.42266 8.73403 11.8073 8.63376 numMergedOcc 0
