%chk=000051583.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051583

0 1
 O   9.8200001E-02 -0.6576000      -1.045900    
 O    3.030500      0.3661000      0.5742000    
 O    2.576800      0.3520000      -1.686700    
 C   -1.067300     -0.1741000     -0.5094000    
 C   -1.264200       1.200000     -0.4096000    
 C   -2.045400      -1.060900     -6.9600001E-02
 C    1.170400     -0.8920000     -0.1446000    
 C   -2.450100       1.691800      0.1353000    
 C   -3.231500     -0.5689000      0.4753000    
 C    1.577000      -2.363100     -0.2242000    
 C   -3.433800      0.8075000      0.5778000    
 C  -0.2069000       2.145000     -0.8848000    
 C   -1.825300      -2.535900     -0.1817000    
 C   -2.689900       3.160900      0.2589000    
 C   -4.300100      -1.495100      0.9564000    
 C    2.320800      1.4300000E-02 -0.5382000    
 C    2.733300      -2.693700      0.7098000    
 C    4.167500       1.203500      0.3417000    
 C    4.840200       1.500300       1.665000    
 H   0.8686000     -0.6427000      0.8827000    
 H    1.851900      -2.624400      -1.253700    
 H   0.7402000      -3.011600      3.7400000E-02
 H   -4.359400       1.190800       1.000800    
 H  -0.6133000       3.106900      -1.210900    
 H   0.5208000       2.329700     -8.8600002E-02
 H   0.3110000       1.750500      -1.764400    
 H   -2.758500      -3.075900     -0.3719000    
 H   -1.187200      -2.787500      -1.034300    
 H   -1.386700      -2.924200      0.7422000    
 H   -3.593800       3.373800      0.8409000    
 H   -1.860600       3.651400      0.7795000    
 H   -2.825500       3.612800     -0.7290000    
 H   -4.778700      -2.000700      0.1115000    
 H   -3.892400      -2.239400       1.648400    
 H   -5.083700     -0.9571000       1.501900    
 H    3.662900      -2.213600      0.3904000    
 H    2.911400      -3.774300      0.7125000    
 H    2.513200      -2.387200       1.737400    
 H    4.869700      0.6888000     -0.3234000    
 H    3.841700       2.139200     -0.1264000    
 H    5.716100       2.139600       1.524000    
 H    4.144200       1.999200       2.347500    
 H    5.154300      0.5722000       2.153900    


%chk=000051583-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051583

0 1
O 0.113875 -1.032059 -1.261639
O 2.178070 0.176021 0.960988
O 3.070361 0.074247 -1.191142
C -0.847159 -0.261292 -0.528022
C -0.918060 1.132323 -0.790432
C -1.739367 -0.932868 0.352270
C 1.295092 -1.526205 -0.494708
C -1.907791 1.891687 -0.101283
C -2.712450 -0.155047 1.041962
C 1.899056 -2.670379 -1.315596
C -2.771652 1.239475 0.808693
C 0.018429 1.795365 -1.783238
C -1.678675 -2.439905 0.528373
C -2.035732 3.386122 -0.339082
C -3.689484 -0.807605 2.005224
C 2.286865 -0.364549 -0.318686
C 3.087304 -3.354067 -0.605171
C 3.023774 1.378549 1.246117
C 2.699916 1.816343 2.670276
H 0.971766 -1.862663 0.508234
H 2.221333 -2.261657 -2.290332
H 1.093527 -3.402148 -1.511793
H -3.524507 1.833372 1.341890
H -0.551174 2.351394 -2.551928
H 0.680571 2.532841 -1.287449
H 0.651462 1.053123 -2.291155
H -2.692846 -2.878438 0.529771
H -1.108551 -2.907556 -0.290553
H -1.206355 -2.727863 1.489080
H -2.814847 3.827046 0.305817
H -1.085592 3.916880 -0.136501
H -2.301807 3.608833 -1.390828
H -4.368158 -1.512033 1.485199
H -3.167165 -1.389315 2.788287
H -4.316206 -0.050788 2.507052
H 3.926221 -2.650127 -0.457932
H 3.463276 -4.196322 -1.212282
H 2.794776 -3.755491 0.383463
H 4.083815 1.094294 1.115680
H 2.781139 2.152489 0.495155
H 3.293137 2.711768 2.931349
H 1.629655 2.064697 2.770133
H 2.940556 1.017907 3.392841


