%chk=000010712.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010712

0 1
 O  -0.1014000      0.8340000      0.8158000    
 O    1.353500     -0.7755000     -4.2800002E-02
 O   -3.389300      0.7192000     -0.7935000    
 O  -0.9150000      -1.919600       1.151100    
 O    2.027100       2.698000      0.8690000    
 O    4.643000       1.372500       1.153900    
 O    4.933800     -0.7262000     -0.8125000    
 O   -3.836400      -2.098200       1.489500    
 O   -5.222700     -0.7021000     -0.5444000    
 O   -2.675200       3.282600      -1.483300    
 O    1.465000      -2.997900      -1.656700    
 C   -1.209900      0.2345000      0.1502000    
 C   -1.830800     -0.8272000       1.058100    
 C    1.112500      0.6229000      9.5299996E-02
 C   -2.234600       1.315900     -0.2004000    
 C    2.245500       1.287400      0.8771000    
 C    3.606700      0.9810000      0.2522000    
 C    3.763200     -0.5137000     -2.7799999E-02
 C   -3.162300      -1.325900      0.4962000    
 C    2.545100      -1.056000     -0.7793000    
 C   -4.069000     -0.1612000      9.8300003E-02
 C   -1.673300       2.323300      -1.198900    
 C    2.624500      -2.567800     -0.9672000    
 H  -0.9039000     -0.2567000     -0.7858000    
 H   -1.955800     -0.4438000       2.077500    
 H    1.010500       1.083400     -0.8967000    
 H   -2.547100       1.865500      0.6980000    
 H    2.229200      0.9702000       1.926600    
 H    3.752700       1.569800     -0.6618000    
 H    3.901700      -1.049300      0.9194000    
 H    2.456800     -0.5950000      -1.772600    
 H   -2.979000      -1.991000     -0.3570000    
 H   -4.424800      0.3960000      0.9727000    
 H   -1.393000       1.842000      -2.141800    
 H  -0.8031000       2.850400     -0.7981000    
 H    2.652800      -3.089600     -4.9999999E-03
 H    3.501500      -2.858500      -1.552500    
 H  -0.8293000      -2.316500      0.2682000    
 H    2.033400       2.998800     -5.5700000E-02
 H    5.492400       1.152800      0.7341000    
 H    4.817000     -0.2605000      -1.658200    
 H   -4.680000      -2.393800       1.106500    
 H   -4.944200      -1.446700      -1.103200    
 H   -3.445700       2.806800      -1.837900    
 H   0.6919000      -2.709900      -1.143100    


%chk=000010712-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000010712

0 1
O -0.096956 0.814238 0.560211
O 1.486522 -0.862530 0.175764
O -3.651473 0.920734 -0.587561
O -0.854347 -2.098332 0.262868
O 1.960246 2.810916 0.008803
O 4.611157 1.786654 0.548753
O 5.173404 -0.872523 -0.573630
O -3.661231 -2.488656 0.966392
O -5.443840 -0.597974 -0.438411
O -3.100733 3.695526 -0.572025
O 1.728277 -3.530295 -1.159033
C -1.328796 0.305489 -0.108150
C -1.781468 -1.016818 0.570781
C 1.122700 0.555309 -0.115169
C -2.385788 1.415717 0.016766
C 2.242683 1.443891 0.436042
C 3.600711 0.977442 -0.133365
C 3.874117 -0.533247 0.040064
C -3.180889 -1.424453 0.089333
C 2.693239 -1.339173 -0.540784
C -4.179294 -0.238537 0.147924
C -2.044306 2.700216 -0.744306
C 2.737632 -2.858838 -0.343599
H -1.112479 0.104863 -1.179754
H -1.825018 -0.837567 1.667578
H 1.022017 0.673203 -1.219210
H -2.562538 1.654694 1.087296
H 2.264948 1.354656 1.541179
H 3.607067 1.205221 -1.227393
H 4.013768 -0.775056 1.107673
H 2.573981 -1.130944 -1.630116
H -3.107132 -1.767314 -0.968162
H -4.409353 0.025496 1.198701
H -1.891327 2.457954 -1.819164
H -1.123894 3.146179 -0.336893
H 2.628476 -3.092546 0.736165
H 3.708600 -3.246081 -0.693358
H 0.072937 -1.744321 0.441176
H 2.708927 3.383175 0.317932
H 5.505140 1.426119 0.312378
H 5.099136 -0.796289 -1.561292
H -4.588829 -2.712065 0.691054
H -5.326983 -0.687068 -1.420685
H -3.959824 3.253665 -0.801740
H 0.814812 -3.336330 -0.817532


