0 mol 7 unq 0 iso 0 dist 5.51421 6.769 6.8464 10.6104 8.41585 5.0893 14.9934 14.7759 12.1991 9.68596 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.99491 4.69203 8.75668 4.96726 9.67592 7.26966 6.23138 6.21578 5.94373 9.97159 numMergedOcc 0
2 mol 75 unq 0 iso 0 dist 6.95595 4.18109 9.20448 12.7957 7.79912 14.2474 18.3917 11.4997 20.477 9.81166 numMergedOcc 0
3 mol 75 unq 1 iso 0 dist 6.95595 4.01868 6.96759 12.7957 7.79912 13.8905 18.3917 11.4997 18.043 9.81166 numMergedOcc 0
4 mol 75 unq 2 iso 0 dist 6.95595 6.54389 6.97318 12.7957 7.79912 11.2774 18.3917 11.4997 17.0121 9.81166 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 9.65047 16.8321 9.64673 5.69671 8.03644 16.4832 9.49995 11.4333 20.6196 9.49454 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.86531 4.98521 9.47554 6.26797 7.11802 5.34829 14.2733 16.0138 10.1132 9.22232 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 5.86531 4.98521 9.47554 6.26797 7.11802 5.34829 6.42904 5.92062 10.7163 9.22661 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 5.86531 4.98521 9.47554 6.26797 7.11802 5.34829 10.0298 6.61891 12.2027 7.56378 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 9.92932 5.73962 9.16358 10.5108 8.94367 10.0911 12.1527 4.57832 11.0888 6.23142 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 9.92932 5.73962 9.16358 6.20443 9.86662 9.66197 12.1527 4.57832 11.0888 9.94764 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 9.60411 5.73962 6.48328 10.5108 6.37586 10.0911 12.1527 5.29786 11.0888 6.23142 numMergedOcc 0
12 mol 134 unq 3 iso 0 dist 9.60411 5.73962 6.48328 6.20443 9.71307 9.66197 12.1527 5.29786 11.0888 9.94764 numMergedOcc 0
13 mol 134 unq 4 iso 0 dist 9.55556 10.971 9.16358 11.9294 8.94367 10.0911 11.9876 4.57832 11.0888 6.23142 numMergedOcc 0
14 mol 134 unq 5 iso 0 dist 9.55556 10.971 9.16358 6.36794 9.86662 9.66197 11.9876 4.57832 11.0888 9.94764 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 5.59806 9.13316 9.23645 8.66436 9.87651 6.45463 15.1236 13.0123 13.6518 9.67741 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 5.96555 4.12904 8.52924 10.7091 7.26832 11.993 14.6151 10.3603 15.0233 5.44002 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.94315 5.64173 4.80834 12.521 5.72887 7.04671 20.4128 14.7883 15.6369 9.24557 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 8.59074 4.11566 4.80834 9.18011 5.72887 7.04671 16.6167 14.7883 15.6369 9.24557 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 6.2365 5.64162 4.80834 4.7157 5.72887 7.04671 12.6054 14.7883 15.6369 9.24557 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 5.73834 5.66907 9.04358 6.48867 6.60405 8.81588 8.63176 5.63675 13.3737 7.21311 numMergedOcc 0
