%chk=000148523.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148523

0 1
 O   -4.332400      0.2703000      -1.590400    
 O    5.506400      0.3871000      -1.051400    
 C   -2.788900     -0.7605000      0.1331000    
 C   -2.072300      0.5850000     -0.1790000    
 C   -4.185600     -0.5178000     -0.4032000    
 C  -0.6844000      0.6592000      0.4520000    
 C   -4.416000      0.9618000     -0.3374000    
 C   0.1841000     -0.4891000     -0.1592000    
 C   -3.145100       1.644500      0.1203000    
 C   -1.993900      -1.864400     -0.5612000    
 C  -0.5243000      -1.875100     -9.0400003E-02
 C    1.660900     -0.4929000      0.3941000    
 C  -1.8500000E-02   2.015300      0.1959000    
 C   -2.932300      -1.067500       1.644900    
 C    2.248700      0.9212000      0.2907000    
 C    1.384300       2.056000      0.7895000    
 C    2.501600      -1.483000     -0.4632000    
 C    1.722900     -0.9339000       1.873900    
 C    4.003100      -1.314300     -0.2922000    
 C    3.474400       1.190700     -0.1894000    
 C    4.407000      0.1078000     -0.5772000    
 H   -1.912700      0.6435000      -1.269900    
 H   -4.958900      -1.216100     -0.1285000    
 H  -0.7686000      0.5310000       1.536100    
 H   -5.352300       1.374700     -4.4000000E-03
 H   0.2607000     -0.2618000      -1.235500    
 H   -3.198400       1.878000       1.188300    
 H   -2.970600       2.569600     -0.4370000    
 H   -2.019400      -1.721000      -1.649400    
 H   -2.448500      -2.845100     -0.3752000    
 H  -0.4863000      -2.266600      0.9308000    
 H   1.5500000E-02  -2.597700     -0.7130000    
 H  -0.6155000       2.818800      0.6429000    
 H   3.0099999E-02   2.216900     -0.8821000    
 H   -3.492200      -1.999400       1.790500    
 H   -1.974300      -1.184200       2.157100    
 H   -3.487600     -0.2819000       2.169100    
 H    1.320900       1.998900       1.883300    
 H    1.833500       3.029800      0.5591000    
 H    2.264100      -1.338600      -1.526600    
 H    2.239300      -2.520900     -0.2253000    
 H    1.465500      -1.991600       1.991200    
 H    2.728500     -0.8034000       2.290600    
 H    1.041500     -0.3583000       2.507900    
 H    4.520900      -1.971200      -1.000000    
 H    4.330500      -1.577600      0.7184000    
 H    3.851900       2.205400     -0.2593000    


%chk=000148523-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148523

0 1
O -4.306545 0.283595 -1.664021
O 5.617196 0.371990 -1.084081
C -2.803331 -0.790849 0.141344
C -2.097059 0.579196 -0.140032
C -4.221699 -0.514807 -0.379053
C -0.694141 0.666530 0.487443
C -4.459640 0.967330 -0.308154
C 0.179338 -0.471261 -0.142597
C -3.174817 1.659790 0.156672
C -1.978142 -1.886034 -0.570174
C -0.503476 -1.870785 -0.073956
C 1.670451 -0.491195 0.398005
C -0.034406 2.037975 0.226479
C -2.978302 -1.107846 1.653687
C 2.261003 0.925910 0.270747
C 1.412240 2.078696 0.775083
C 2.498835 -1.491276 -0.468871
C 1.741234 -0.910035 1.902012
C 4.026222 -1.331749 -0.326553
C 3.515749 1.162854 -0.232533
C 4.471591 0.102230 -0.606990
H -1.952021 0.610472 -1.240096
H -5.020006 -1.256507 -0.255190
H -0.764845 0.521349 1.586431
H -5.446641 1.412444 -0.145861
H 0.259679 -0.208864 -1.223436
H -3.256110 1.899238 1.235951
H -2.990488 2.603945 -0.385861
H -2.011822 -1.703545 -1.662614
H -2.409266 -2.891977 -0.394367
H -0.472255 -2.253738 0.963879
H 0.073464 -2.589742 -0.684498
H -0.627411 2.845602 0.696868
H -0.023524 2.235663 -0.865009
H -3.583868 -2.025202 1.782190
H -2.013255 -1.276797 2.159190
H -3.496162 -0.289215 2.185964
H 1.361129 2.023960 1.883993
H 1.898582 3.040402 0.529933
H 2.226715 -1.339484 -1.533385
H 2.216300 -2.528154 -0.209265
H 1.391205 -1.948423 2.040839
H 2.780261 -0.854943 2.272742
H 1.126794 -0.255181 2.544229
H 4.569634 -2.011061 -1.006885
H 4.351501 -1.590105 0.702320
H 3.887410 2.191208 -0.333219


