%chk=000066632.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066632

0 1
 O   0.4654000      -2.827200      9.0000004E-02
 O    4.472900      0.3710000     -0.5931000    
 O    3.504400       2.139700      0.4859000    
 N   0.2358000     -0.4681000      2.3100000E-02
 N    1.063000      0.6302000      3.0000001E-04
 N   -3.587400       2.508200     -9.2299998E-02
 C    2.370600      -1.316400      6.5399997E-02
 C   -1.146400     -0.2782000      4.4000000E-03
 C   0.9140000      -1.693500      6.2899999E-02
 C    2.266300      0.1639000      2.3900000E-02
 C   -1.672700       1.013000     -3.4899998E-02
 C   -2.001900      -1.379800      2.5900001E-02
 C   -3.054600       1.202600     -5.2600000E-02
 C   -3.383700      -1.190200      8.2000000E-03
 C   -3.910000      0.1009000     -3.1199999E-02
 C    3.464300       1.024000      1.3900000E-02
 H    2.862900      -1.708500     -0.8265000    
 H    2.854900      -1.649600      0.9850000    
 H   -1.028800       1.889100     -5.2099999E-02
 H   -1.672500      -2.408700      5.6400001E-02
 H   -4.051000      -2.047100      2.4900001E-02
 H   -4.988600      0.2354000     -4.4700000E-02
 H   -2.968400       3.307800     -0.1071000    
 H   -4.589300       2.645500     -0.1045000    
 H    5.294500      0.9061000     -0.6235000    


%chk=000066632-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066632

0 1
O 0.476425 -2.939776 0.062461
O 4.656731 0.401837 -0.109215
O 3.375764 2.357469 -0.149387
N 0.217421 -0.547349 -0.017272
N 1.058134 0.574835 -0.065671
N -3.565926 2.546449 -0.053761
C 2.425251 -1.353885 -0.015120
C -1.205431 -0.337965 -0.006353
C 0.953652 -1.782995 0.017571
C 2.318125 0.146234 -0.065612
C -1.685431 0.991217 -0.035231
C -2.091151 -1.445237 0.032100
C -3.084116 1.238006 -0.025596
C -3.478821 -1.180211 0.041123
C -3.984996 0.131861 0.013076
C 3.433399 1.108581 -0.112431
H 2.943315 -1.780661 -0.891800
H 2.964356 -1.719818 0.876238
H -0.971110 1.818235 -0.065358
H -1.710691 -2.466590 0.054799
H -4.177364 -2.023822 0.070685
H -5.067125 0.308637 0.020804
H -2.927896 3.336198 -0.081156
H -4.564062 2.732546 -0.046692
H 5.405245 1.056305 -0.140506


