%chk=000128846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128846

0 1
 O   -4.779700       1.802800      0.4341000    
 O   -4.871300      2.6200000E-02 -0.9751000    
 C   -1.369900      -2.633200      0.2242000    
 C   3.1599998E-02  -2.388600     -0.3420000    
 C   -2.177900      -1.352400      0.4385000    
 C   0.9153000      -3.631500     -0.5003000    
 C   -3.554600      -1.596000       1.071600    
 C    2.337100      -3.376600      -1.017000    
 C   -4.367200     -0.3373000       1.378500    
 C    3.161400      -2.535300     -8.5600004E-02
 C   0.6842000       2.653500     -0.3408000    
 C    1.883400       3.588300     -0.1363000    
 C  -0.2169000       3.064700      -1.505300    
 C   -4.707700      0.4761000      0.1505000    
 C    2.803100       3.228400       1.032000    
 C    3.717600      -1.341000     -0.3428000    
 C   -1.390900       2.109500      -1.660000    
 C    4.541000     -0.4973000      0.5829000    
 C    3.429100       1.911100      0.8622000    
 C    3.932400      0.8287000      0.7307000    
 H   -1.918800      -3.300500     -0.4513000    
 H   -1.276400      -3.161000       1.181400    
 H   0.5402000      -1.671900      0.3146000    
 H  -6.2199999E-02  -1.897100      -1.318700    
 H   -1.607900     -0.6719000       1.083200    
 H   -2.298700     -0.8457000     -0.5256000    
 H   0.9738000      -4.149000      0.4660000    
 H   0.4185000      -4.325100      -1.190300    
 H   -4.136200      -2.246800      0.4065000    
 H   -3.419000      -2.150300       2.008800    
 H    2.282500      -2.908600      -2.007300    
 H    2.844500      -4.339400      -1.150400    
 H   -3.793600      0.2910000       2.069900    
 H   -5.308400     -0.6086000       1.868600    
 H    3.314200      -2.958700      0.9059000    
 H   9.3000002E-02   2.627900      0.5831000    
 H    1.039600       1.630900     -0.5160000    
 H    1.510300       4.607900      2.2800000E-02
 H    2.471700       3.613700      -1.063000    
 H  -0.5962000       4.079600      -1.340300    
 H   0.3622000       3.080600      -2.435800    
 H    3.583400       3.993100       1.120600    
 H    2.231300       3.247400       1.967000    
 H    3.572500     -0.9312000      -1.342300    
 H   -2.000100       2.087300     -0.7511000    
 H   -2.030100       2.424900      -2.490400    
 H   -1.043600       1.092100      -1.865900    
 H    4.636900     -0.9763000       1.563800    
 H    5.551200     -0.4006000      0.1702000    
 H   -4.981400       2.336400     -0.3640000    


%chk=000128846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128846

0 1
O -4.918139 1.726074 -0.081329
O -5.026339 -0.371240 -1.067255
C -1.263556 -2.609847 0.384336
C 0.097900 -2.432598 -0.324298
C -2.082076 -1.301331 0.442397
C 0.930587 -3.731988 -0.382966
C -3.433219 -1.466850 1.173759
C 2.334332 -3.532154 -1.026348
C -4.235229 -0.151202 1.274884
C 3.240306 -2.658184 -0.183491
C 0.597110 2.702458 -0.228262
C 1.811019 3.611277 0.064639
C -0.259032 3.211772 -1.410177
C -4.749291 0.329564 -0.069530
C 2.715616 3.093292 1.220537
C 3.706057 -1.434041 -0.539346
C -1.495613 2.328715 -1.684483
C 4.584924 -0.556022 0.345152
C 3.380529 1.808933 0.921390
C 3.944763 0.740014 0.664126
H -1.855896 -3.390894 -0.136583
H -1.092376 -2.983111 1.416259
H 0.683405 -1.646829 0.193792
H -0.072052 -2.062909 -1.357644
H -1.480364 -0.517615 0.949546
H -2.265812 -0.941705 -0.590206
H 1.055004 -4.136980 0.643133
H 0.376549 -4.501349 -0.958501
H -4.046255 -2.223973 0.648363
H -3.253398 -1.847181 2.198726
H 2.216032 -3.088917 -2.034958
H 2.805348 -4.527286 -1.164523
H -3.638805 0.656669 1.734796
H -5.123942 -0.293016 1.923366
H 3.503157 -3.056592 0.810751
H -0.036769 2.629929 0.680860
H 0.953503 1.675267 -0.445413
H 1.455055 4.627361 0.331461
H 2.424463 3.716114 -0.851923
H -0.585138 4.252520 -1.205369
H 0.373856 3.257866 -2.320091
H 3.486543 3.856298 1.449306
H 2.101373 2.984183 2.137879
H 3.434646 -1.009734 -1.517087
H -2.177900 2.315870 -0.813305
H -2.067269 2.695163 -2.557566
H -1.196075 1.283685 -1.892080
H 4.823328 -1.096872 1.282179
H 5.553781 -0.364007 -0.161673
H -5.281340 2.001602 -0.967228


