%chk=000170819.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170819

0 1
 O    4.507600     -0.1593000     -0.4520000    
 O   -6.314600     -0.9191000       1.079100    
 O    5.950600      -1.885500     -2.1600001E-02
 C  -0.3287000      0.9711000     -0.5733000    
 C   -1.179700       2.160100     -0.2281000    
 C    1.088500       1.099300     -1.3000000E-03
 C  -0.9508000     -0.3712000     -8.2500003E-02
 C   -2.656000       1.986400     -9.9999998E-03
 C    2.024100     -4.7699999E-02 -0.4488000    
 C   -1.763200       2.397400       1.138200    
 C   -2.453700     -0.5324000     -0.5313000    
 C    3.367100      0.4312000      0.1911000    
 C   -3.273800      0.6426000      3.6499999E-02
 C  -3.1599998E-02  -1.568800     -0.4399000    
 C    1.418600      -1.372400      4.5299999E-02
 C    1.887400       2.357200     -0.3269000    
 C    3.351300       1.961600     -6.7000002E-02
 C   -3.001100      -1.876200      2.8200001E-02
 C    2.203300     -0.1429000      -1.993500    
 C    3.590900      0.1108000       1.666500    
 C   -2.600100     -0.5281000      -2.069700    
 C   -4.501000      0.4798000      0.5660000    
 C   -4.514100      -2.006900     -5.7500001E-02
 C    4.329200      -1.208500       1.639400    
 C   -5.190100     -0.8296000      0.5896000    
 C    5.039800      -1.148800      0.3238000    
 H  -0.2653000      0.9555000      -1.666400    
 H  -0.8718000       3.040600     -0.7841000    
 H   0.9899000       1.074900       1.095200    
 H  -0.9617000     -0.3408000       1.018700    
 H   -3.292000       2.753900     -0.4421000    
 H   -1.831600       3.423200       1.482200    
 H   -1.552600       1.688800       1.929200    
 H  -4.1900001E-02  -1.751300      -1.518800    
 H  -0.4059000      -2.484800      3.0099999E-02
 H    1.400300      -1.404600       1.140400    
 H    2.029400      -2.221700     -0.2831000    
 H    1.588100       3.203000      0.3009000    
 H    1.754600       2.660400      -1.371500    
 H    3.971700       2.229600     -0.9306000    
 H    3.746700       2.527500      0.7837000    
 H   -2.708100      -1.976900       1.082800    
 H   -2.556800      -2.725800     -0.5041000    
 H    2.665200      0.7530000      -2.419900    
 H    2.848600     -0.9906000      -2.252700    
 H    1.261000     -0.2928000      -2.525900    
 H    2.685000      8.2300000E-02   2.276900    
 H    4.256300      0.8547000       2.124200    
 H   -2.224000      0.3949000      -2.522300    
 H   -2.062500      -1.365600      -2.525700    
 H   -3.648900     -0.6122000      -2.376200    
 H   -5.050700       1.323300      0.9722000    
 H   -4.823700      -2.916500      0.4693000    
 H   -4.857800      -2.082600      -1.093700    
 H    3.653900      -2.066700       1.648100    
 H    5.043200      -1.280300       2.463600    


%chk=000170819-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170819

0 1
O 4.565138 -0.195370 -0.500122
O -6.516421 -0.927777 0.869473
O 6.095942 -1.885776 -0.064417
C -0.343230 0.983999 -0.573888
C -1.204835 2.196169 -0.214975
C 1.094361 1.126802 -0.032499
C -0.959379 -0.354443 -0.047775
C -2.699870 1.996557 0.075135
C 2.026818 -0.053767 -0.451725
C -1.712006 2.393988 1.213574
C -2.462354 -0.539716 -0.493935
C 3.381412 0.447720 0.180357
C -3.303632 0.628454 0.056493
C -0.044822 -1.563177 -0.400304
C 1.420616 -1.374595 0.083610
C 1.909351 2.395556 -0.394157
C 3.395617 1.976077 -0.137780
C -3.019434 -1.884380 0.063606
C 2.215782 -0.156135 -1.992441
C 3.609605 0.099159 1.683712
C -2.595365 -0.508072 -2.050974
C -4.605158 0.463151 0.467459
C -4.549473 -2.032407 -0.078928
C 4.410078 -1.218471 1.664954
C -5.316263 -0.825837 0.463179
C 5.143637 -1.187617 0.319469
H -0.293786 0.934280 -1.680814
H -0.942573 3.112454 -0.757432
H 1.012030 1.099726 1.078594
H -0.970285 -0.297021 1.065343
H -3.382930 2.799748 -0.223082
H -1.802316 3.411822 1.603544
H -1.484133 1.639445 1.971954
H -0.054688 -1.745306 -1.491523
H -0.442399 -2.479807 0.071993
H 1.416904 -1.372109 1.192877
H 2.023039 -2.246032 -0.241504
H 1.612088 3.265514 0.216226
H 1.754578 2.671809 -1.454097
H 4.028493 2.147800 -1.025396
H 3.845286 2.545782 0.693943
H -2.750517 -1.956552 1.137557
H -2.530313 -2.732321 -0.450266
H 2.625929 0.770956 -2.427059
H 2.928805 -0.963816 -2.228704
H 1.265542 -0.376354 -2.505960
H 2.665211 0.030010 2.247056
H 4.216855 0.895746 2.149377
H -2.306407 0.473113 -2.465691
H -1.959455 -1.282345 -2.517602
H -3.638838 -0.694255 -2.358080
H -5.184255 1.322202 0.831466
H -4.915679 -2.937262 0.438315
H -4.830501 -2.152674 -1.144912
H 3.758583 -2.111004 1.682536
H 5.138117 -1.321145 2.484941


