%chk=000113526.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113526

0 1
 O  -0.6976000     -0.8547000     -7.3100001E-02
 O   0.2866000      -2.788400      0.6964000    
 O    6.323800      0.3945000     -0.4288000    
 O    5.405800       2.434900     -2.8600000E-02
 C   -3.017200     -0.4336000     -0.4591000    
 C   -2.993900      0.8105000      0.4448000    
 C   -4.420300      -1.063000     -0.4862000    
 C   -4.060100       1.829700      3.8500000E-02
 C   -5.491700     -5.0000001E-02 -0.8950000    
 C   -5.417600       1.182400     -3.3300001E-02
 C   -1.977700      -1.453900      8.9999998E-04
 C   -6.477400       1.656700      0.6370000    
 C   0.3569000      -1.633600      0.3052000    
 C    1.637200     -0.8916000      0.1834000    
 C    1.632800      0.4778000      0.3524000    
 C    2.791800      -1.594700     -9.3099996E-02
 C    2.835800       1.174600      0.2397000    
 C    3.994800     -0.8978000     -0.2056000    
 C    4.016900      0.4868000     -3.9099999E-02
 C    5.271000       1.213400     -0.1564000    
 H   -2.755400     -0.1091000      -1.475900    
 H   -2.012300       1.296700      0.4021000    
 H   -3.154800      0.5135000       1.489700    
 H   -4.663700      -1.469800      0.5044000    
 H   -4.436600      -1.906000      -1.187400    
 H   -3.813700       2.248100     -0.9453000    
 H   -4.051000       2.664000      0.7495000    
 H   -6.478400     -0.5239000     -0.8334000    
 H   -5.343400      0.2399000      -1.942600    
 H   -2.005000      -2.334000     -0.6527000    
 H   -2.179500      -1.771800       1.031200    
 H   -7.445400       1.170600      0.5781000    
 H   -6.400700       2.542000       1.259200    
 H   0.7297000       1.034500      0.5836000    
 H    2.786100      -2.672300     -0.2278000    
 H    2.832600       2.253000      0.3757000    
 H    4.890400      -1.472500     -0.4245000    
 H    7.164500      0.8942000     -0.5052000    


%chk=000113526-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113526

0 1
O -0.693900 -0.763223 -0.179829
O 0.277747 -2.812079 0.356663
O 6.600055 0.335611 0.080192
O 5.644682 2.382528 -0.458268
C -3.088351 -0.352950 -0.442114
C -3.123358 0.762189 0.632752
C -4.482250 -1.021385 -0.577421
C -4.218587 1.817308 0.319708
C -5.584838 0.026652 -0.890838
C -5.578789 1.163522 0.121934
C -2.035840 -1.420641 -0.134770
C -6.689635 1.548705 0.801677
C 0.395894 -1.590723 0.086590
C 1.695729 -0.855465 0.009244
C 1.764049 0.527506 -0.304879
C 2.885954 -1.585787 0.261724
C 3.013615 1.170515 -0.364904
C 4.136117 -0.943950 0.201825
C 4.203555 0.438714 -0.112189
C 5.500799 1.165660 -0.189170
H -2.830289 0.110461 -1.418173
H -2.133713 1.250621 0.700963
H -3.331360 0.302588 1.621148
H -4.733097 -1.539680 0.370760
H -4.463000 -1.790080 -1.375209
H -3.932418 2.351134 -0.612324
H -4.263421 2.573239 1.124831
H -6.576572 -0.460436 -0.922588
H -5.392281 0.440973 -1.903943
H -2.041412 -2.239137 -0.878633
H -2.171749 -1.864021 0.869847
H -7.658310 1.057752 0.647493
H -6.663301 2.367999 1.530375
H 0.840054 1.078028 -0.498680
H 2.805046 -2.650660 0.501609
H 3.093013 2.235445 -0.605342
H 5.060367 -1.494902 0.393817
H 7.433097 0.875067 0.014820


