0 mol 15 unq 0 iso 0 dist 7.87072 7.16107 9.97769 14.2628 13.903 8.60614 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.50539 4.68147 5.77745 8.98227 4.32173 5.20109 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 7.19406 6.51519 7.57749 6.35731 6.70122 5.43693 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.0101 4.05111 6.63973 10.9321 13.5835 8.77077 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 4.3761 4.54306 5.33961 9.66226 11.2155 9.25444 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 4.3761 4.54306 5.33961 11.8553 9.96465 8.46823 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 6.31509 12.8104 8.3505 18.2172 11.9783 9.84703 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 6.31509 12.8104 8.3505 12.1844 7.43001 4.62494 numMergedOcc 0
8 mol 98 unq 4 iso 0 dist 5.84583 4.54306 5.08983 9.66226 9.51607 9.25444 numMergedOcc 0
9 mol 98 unq 5 iso 0 dist 5.84583 4.54306 5.08983 11.8553 12.5752 8.46823 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 4.76012 5.75588 6.53559 7.98622 4.92611 6.34626 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 6.4822 6.98797 5.56446 11.5033 12.541 7.58337 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 9.2313 4.59736 8.43651 12.1312 6.27901 9.23136 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 7.7195 4.91613 6.51523 8.53734 4.98945 7.47964 numMergedOcc 0
14 mol 171 unq 1 iso 0 dist 8.30819 4.61696 6.51523 6.08141 4.98945 7.47964 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 5.39622 8.84505 9.18289 9.88866 6.33168 6.56416 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 5.39622 8.53889 6.52441 9.88866 6.33168 6.88127 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 5.39622 5.565 6.26168 8.28099 5.18732 9.99396 numMergedOcc 0
18 mol 212 unq 0 iso 0 dist 7.67675 4.71123 5.03184 7.89739 6.48939 9.10288 numMergedOcc 0
19 mol 212 unq 1 iso 0 dist 7.67675 4.71123 5.03184 6.12161 5.81626 6.19798 numMergedOcc 0
20 mol 212 unq 2 iso 0 dist 7.67675 4.71123 5.03184 9.27742 6.89781 7.24895 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 7.11262 8.62768 9.27308 13.4401 11.3186 9.89167 numMergedOcc 0
22 mol 225 unq 1 iso 0 dist 9.14778 7.46055 9.99149 15.7561 11.7808 9.82043 numMergedOcc 0
23 mol 225 unq 2 iso 0 dist 9.14778 7.46055 9.99149 13.1306 10.2606 8.22922 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 7.45786 8.57494 7.63381 14.3726 15.9388 8.95511 numMergedOcc 0
25 mol 239 unq 1 iso 0 dist 7.45786 8.57494 7.63381 10.1735 4.22981 5.85002 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 6.84909 4.77692 5.72473 5.54272 6.08322 8.62162 numMergedOcc 0
