%chk=000034465.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034465

0 1
 O   0.3128000     -0.2758000     -0.1706000    
 O   -4.457100      0.9427000      0.1749000    
 O   0.6861000      -1.483700       1.787900    
 O    2.296200      -3.135800      -2.241800    
 O   0.4069000      -2.342000      -1.443100    
 N    1.653300       1.849600      0.9006000    
 N    1.646900      -2.271700      -1.608100    
 C    2.337500      0.9136000      0.2161000    
 C    3.733900      0.9968000      3.3799998E-02
 C    1.668800     -0.1756000     -0.3359000    
 C    2.346900      -1.165300      -1.051900    
 C    4.416100      1.5000000E-03 -0.6863000    
 C    3.722200      -1.076900      -1.227600    
 C   -1.547700      -1.039100       1.083400    
 C   -3.942300       1.653600     -0.9499000    
 C   -5.107200       2.171400      -1.779700    
 C   -3.691500     -6.6000000E-02  0.6735000    
 C    4.407500       2.092900      0.5893000    
 C   -2.301800     -3.8000001E-03  0.5703000    
 C  -6.8499997E-02 -0.9730000      0.9739000    
 C   -2.122700      -2.134200       1.695600    
 C   -4.296700      -1.162400       1.287800    
 C    3.705300       3.059100       1.295200    
 C   -3.512200      -2.196500       1.798900    
 C   -4.633800       2.928900      -3.007100    
 C    2.341100       2.891800       1.421000    
 H    5.492900      6.1600000E-02 -0.8292000    
 H    4.289600      -1.823400      -1.776800    
 H   -3.333400       1.004300      -1.592600    
 H   -3.331800       2.491600     -0.5941000    
 H   -5.744500       1.332200      -2.083700    
 H   -5.739000       2.820500      -1.161600    
 H    5.483900       2.199700      0.4748000    
 H   -1.813400      0.8627000      0.1360000    
 H   -1.522700      -2.947000       2.093800    
 H   -5.378700      -1.216700       1.370800    
 H    4.210200       3.913000       1.731300    
 H   -3.983700      -3.050600       2.276200    
 H   -4.035900       2.284900      -3.659900    
 H   -5.490900       3.292500      -3.582300    
 H   -4.023900       3.792600      -2.723900    
 H    1.739700       3.614900       1.962100    


%chk=000034465-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034465

0 1
O 0.355602 -0.293165 -0.084304
O -4.638866 0.582017 -0.255998
O 0.739316 -1.586319 1.835263
O 1.967073 -1.836923 -3.529952
O 0.605588 -2.411270 -1.791507
N 1.871269 1.364799 1.534268
N 1.574441 -1.733571 -2.299970
C 2.503775 0.735243 0.475171
C 3.897519 0.944103 0.151098
C 1.720712 -0.163506 -0.336079
C 2.324514 -0.790088 -1.437637
C 4.467695 0.290097 -0.989159
C 3.691514 -0.549658 -1.779054
C -1.537684 -0.872831 1.286665
C -4.098647 1.260629 -1.452592
C -5.285423 1.892049 -2.183424
C -3.740430 -0.089322 0.580573
C 4.643205 1.824072 1.001497
C -2.345154 -0.156804 0.365051
C -0.069847 -0.981677 1.112439
C -2.112429 -1.516174 2.411079
C -4.321924 -0.729804 1.706512
C 4.005637 2.439851 2.079338
C -3.507385 -1.436952 2.612312
C -4.834890 2.644451 -3.454914
C 2.612420 2.184606 2.301001
H 5.522007 0.457902 -1.234197
H 4.094902 -1.048181 -2.663972
H -3.581454 0.519699 -2.097107
H -3.365553 2.033816 -1.140598
H -6.007529 1.096394 -2.444781
H -5.803561 2.582627 -1.492258
H 5.703878 2.003380 0.793444
H -1.868097 0.322126 -0.491468
H -1.463471 -2.062911 3.101555
H -5.405368 -0.659988 1.844441
H 4.544787 3.115338 2.750212
H -3.964085 -1.929460 3.477008
H -4.330715 1.966005 -4.168335
H -5.702791 3.089755 -3.972273
H -4.132130 3.463532 -3.212205
H 2.089979 2.669012 3.133956


