0 mol 20 unq 0 iso 0 dist 8.52857 4.68566 5.11883 11.9031 4.9399 8.72023 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.74298 6.06832 5.44124 6.23095 5.52519 5.81959 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 6.74298 6.06832 5.44124 11.9439 7.19007 6.90155 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 9.54121 8.13252 6.83373 10.0639 7.72347 9.53458 numMergedOcc 0
4 mol 42 unq 1 iso 0 dist 9.54121 8.13252 6.83373 6.86731 5.65461 9.16649 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 7.49284 6.5705 7.3576 8.96238 11.2895 6.77886 numMergedOcc 0
6 mol 111 unq 0 iso 0 dist 9.92617 6.39541 6.98727 13.5129 6.3561 7.71107 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.04565 10.4914 8.3642 13.2957 8.87718 6.98934 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 9.46689 8.79034 4.31261 7.85527 4.72999 6.98934 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 9.46689 5.53632 7.7186 7.85527 4.72999 7.99623 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 7.7209 6.49088 6.59925 13.5463 13.4456 8.0154 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.3959 5.26443 7.9637 10.6149 6.67453 7.28841 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 8.09352 6.37333 6.61806 12.9169 12.2848 8.44861 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 8.09352 6.37333 6.61806 6.15806 9.41884 5.60393 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 6.25473 6.23657 7.48626 11.3827 10.2428 6.38157 numMergedOcc 0
15 mol 251 unq 0 iso 0 dist 9.0301 14.2271 6.12282 11.2696 7.703 8.01198 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 7.59719 12.6696 7.75255 13.196 7.83541 5.26434 numMergedOcc 0
17 mol 261 unq 1 iso 0 dist 7.59719 12.6696 7.75255 18.9793 14.5304 8.60026 numMergedOcc 0
18 mol 261 unq 2 iso 0 dist 7.73751 6.0813 7.75255 10.1373 7.83541 5.26434 numMergedOcc 0
19 mol 261 unq 3 iso 0 dist 7.73751 6.0813 7.75255 13.9801 14.5304 8.60026 numMergedOcc 0
20 mol 261 unq 4 iso 0 dist 8.93454 6.0813 8.96013 10.1373 10.6727 5.26434 numMergedOcc 0
21 mol 261 unq 5 iso 0 dist 8.93454 6.0813 8.96013 13.9801 16.5975 8.60026 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 6.93143 7.12217 7.64992 11.7409 5.99934 9.19033 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 6.97686 10.2946 5.04032 13.3404 6.40962 5.31728 numMergedOcc 0
