0 mol 5 unq 0 iso 0 dist 9.75695 7.4332 3.9731 8.33646 7.24457 6.14476 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 9.41639 5.68079 11.0949 5.63041 13.9692 8.4014 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 5.96181 7.72372 5.24477 5.78908 6.23095 7.03372 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 7.02986 7.72372 6.05669 5.78908 10.199 7.03372 numMergedOcc 0
4 mol 28 unq 0 iso 0 dist 8.77833 8.66738 16.276 9.10555 13.9245 8.95154 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.73832 4.8983 11.3918 4.30874 8.16299 7.37171 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.73832 4.8983 11.3918 6.97502 10.8051 8.62079 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 7.85973 4.8983 6.29235 4.30874 8.27015 7.37171 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 7.85973 4.8983 6.29235 6.97502 13.7608 8.62079 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 8.30943 5.6516 9.8511 6.63027 13.957 7.74064 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 9.46036 6.34669 7.81379 5.60777 5.90776 4.17838 numMergedOcc 0
11 mol 126 unq 0 iso 0 dist 7.83445 5.78493 4.46904 4.57807 11.6011 8.2777 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 9.71493 9.57243 8.36223 12.8338 15.6171 7.46621 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 7.53667 8.09561 4.52353 10.0459 10.743 6.79114 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 7.53667 9.07315 6.79695 10.0459 10.743 7.59457 numMergedOcc 0
15 mol 152 unq 2 iso 0 dist 7.53667 9.07315 6.79695 14.7437 14.0626 9.00072 numMergedOcc 0
16 mol 152 unq 3 iso 0 dist 7.53667 9.07315 6.79695 10.719 12.9164 7.55419 numMergedOcc 0
17 mol 157 unq 0 iso 0 dist 8.695 7.75542 10.0833 11.5877 17.185 8.10592 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 9.0323 8.83628 9.59325 14.3203 18.689 9.31158 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 8.32947 6.06793 8.88341 5.68772 13.953 9.57465 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 5.04068 5.94328 4.2886 4.6881 8.40766 8.03012 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 9.52075 7.91978 4.2886 6.80596 8.40766 8.03012 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 8.04439 8.67957 12.2565 7.23876 6.36173 8.12739 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 8.50964 8.73403 11.0976 5.10722 12.4366 9.76232 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 8.50964 8.73403 11.0976 5.10722 12.4366 9.76232 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 8.50964 8.73403 11.0976 5.10722 12.4366 9.76232 numMergedOcc 0
