%chk=000069378.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069378

0 1
 O  -0.2929000      -1.260900      0.8149000    
 C    2.263300     -9.1600001E-02  0.1058000    
 C   0.9959000      0.7340000      0.3731000    
 C  -0.2808000     -9.5299996E-02  0.4226000    
 C   -1.534200      0.6023000     -8.3400004E-02
 C    2.127200     -0.8473000      -1.217500    
 C    3.510000      0.7962000      6.7299999E-02
 C   -2.779100     -0.2729000      2.9800000E-02
 C   -4.009400      0.4356000     -0.5125000    
 H    2.389300     -0.8275000      0.9098000    
 H    1.078500       1.261500       1.330200    
 H   0.8852000       1.491900     -0.4120000    
 H   -1.366100      0.8754000      -1.131100    
 H   -1.668300       1.519500      0.5007000    
 H    3.046000      -1.401500      -1.439200    
 H    1.312500      -1.576800      -1.194600    
 H    1.943500     -0.1600000      -2.050700    
 H    3.444800       1.539100     -0.7349000    
 H    3.631700       1.330600       1.015200    
 H    4.411000      0.1960000     -9.7400002E-02
 H   -2.949200     -0.5466000       1.077900    
 H   -2.630700      -1.208900     -0.5220000    
 H   -4.205500       1.359600      4.0800001E-02
 H   -4.889300     -0.2087000     -0.4204000    
 H   -3.882600      0.6882000      -1.570100    


%chk=000069378-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000069378

0 1
O -0.278767 -1.370497 0.558753
C 2.291591 -0.121862 0.031455
C 0.975644 0.685969 0.132448
C -0.298808 -0.165414 0.189018
C -1.599730 0.534743 -0.213619
C 2.413012 -0.811604 -1.348101
C 3.510519 0.786580 0.309772
C -2.882593 -0.217840 0.189672
C -4.158560 0.476592 -0.330171
H 2.248393 -0.914746 0.803867
H 0.981798 1.297563 1.062213
H 0.894151 1.414398 -0.700839
H -1.566951 0.664936 -1.318420
H -1.593284 1.565913 0.197329
H 3.341763 -1.408406 -1.407727
H 1.563704 -1.493865 -1.529403
H 2.441633 -0.061011 -2.162641
H 3.571789 1.608788 -0.430051
H 3.456267 1.240685 1.317431
H 4.452709 0.211197 0.248285
H -2.919623 -0.305311 1.292493
H -2.824032 -1.253602 -0.191915
H -4.244673 1.508665 0.060157
H -5.065381 -0.075087 -0.022342
H -4.159770 0.535115 -1.435365


