%chk=000085281.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085281

0 1
 O    2.717600      -1.747500     -9.9600002E-02
 O    2.084400       2.272400     -0.5170000    
 O    3.485900      0.8235000      0.5332000    
 C   -2.525700      0.3361000      4.3400001E-02
 C   -1.094900     -0.2258000      4.1000000E-03
 C   -3.266300     -0.2153000       1.281000    
 C   -3.285200     -8.6199999E-02  -1.232800    
 C   -2.589500       1.878300      0.1231000    
 C  -4.6200000E-02  0.6585000      4.3299999E-02
 C  -0.9322000      -1.586400     -6.8099998E-02
 C    1.251500      0.1482000      8.2999999E-03
 C   0.3654000      -2.096800     -0.1030000    
 C    1.457400      -1.229500     -6.4900003E-02
 C    2.377700       1.070600      4.9199998E-02
 H   -2.732200      3.5999998E-02   2.205000    
 H   -4.276200      0.2051000       1.355900    
 H   -3.377400      -1.304700       1.251000    
 H   -3.396900      -1.172900      -1.313000    
 H   -4.295800      0.3389000      -1.249200    
 H   -2.764700      0.2589000      -2.134200    
 H   -3.631200       2.222400      0.1454000    
 H   -2.116200       2.263400       1.034000    
 H   -2.123500       2.355000     -0.7474000    
 H  -0.1808000       1.729600      0.1170000    
 H   -1.765700      -2.279600     -9.8600000E-02
 H   0.5111000      -3.172200     -0.1599000    
 H    2.661300      -2.717200     -0.1497000    
 H    2.848200       2.887200     -0.4852000    


%chk=000085281-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085281

0 1
O 2.799699 -1.817666 -0.110967
O 2.041099 2.413704 -0.006900
O 3.697657 0.795493 -0.071501
C -2.590810 0.360221 0.027826
C -1.147553 -0.193015 -0.009852
C -3.313311 -0.169864 1.303275
C -3.362547 -0.121554 -1.237843
C -2.624765 1.909686 0.057798
C -0.006509 0.634358 -0.010776
C -0.925247 -1.598567 -0.045314
C 1.323342 0.123491 -0.044405
C 0.370887 -2.137372 -0.078868
C 1.508358 -1.289719 -0.078517
C 2.474324 1.061466 -0.044038
H -2.792207 0.165101 2.218710
H -4.352415 0.208133 1.337762
H -3.355615 -1.274024 1.322118
H -3.406037 -1.224203 -1.297774
H -4.402244 0.255843 -1.216773
H -2.877916 0.249318 -2.159438
H -3.674662 2.254486 0.083791
H -2.116483 2.314096 0.952446
H -2.149566 2.347967 -0.839086
H -0.109576 1.720215 0.014354
H -1.776371 -2.288816 -0.047373
H 0.509828 -3.226491 -0.105598
H 2.764080 -2.808196 -0.132704
H 2.854460 2.985908 -0.009054


