%chk=000002294.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002294

0 1
 O   0.1847000      -2.462400     -0.5216000    
 O   0.8166000       1.862700       1.194400    
 O   -3.368400      0.3899000      2.2399999E-02
 N   -1.574500      -1.001200     -0.3411000    
 N   -1.258800       1.159500      0.5155000    
 C   0.7098000     -0.1166000     -0.2024000    
 C    2.026300     -0.5668000      0.4475000    
 C   0.9957000      0.4046000      -1.622100    
 C  -0.2235000      -1.314700     -0.3460000    
 C   0.1214000       1.046200      0.5904000    
 C    1.775900      -1.185700       1.804300    
 C    1.945900       1.582100      -1.588700    
 C   -2.150800      0.2023000      4.7300000E-02
 H    2.719300      0.2666000      0.6035000    
 H    2.546100      -1.296900     -0.1856000    
 H   6.6600002E-02  0.7133000      -2.118600    
 H    1.425000     -0.3916000      -2.243800    
 H    1.264900     -0.5004000       2.487400    
 H    1.195100      -2.110400       1.753300    
 H    2.734100      -1.444100       2.269100    
 H    1.539100       2.455000      -1.072800    
 H    2.927400       1.339900      -1.175200    
 H    2.130400       1.907700      -2.620000    
 H   -2.216400      -1.755000     -0.5704000    
 H   -1.668000       1.998400      0.9175000    


%chk=000002294-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000002294

0 1
O 0.197745 -2.388294 -0.860736
O 0.726009 2.001712 1.116565
O -3.477290 0.210852 0.292799
N -1.600941 -1.048347 -0.310205
N -1.341810 1.114330 0.601321
C 0.717388 -0.072813 -0.212316
C 2.003329 -0.557695 0.519244
C 1.062860 0.471600 -1.669710
C -0.218306 -1.269267 -0.465837
C 0.068622 1.079142 0.569067
C 1.735306 -1.191618 1.900605
C 2.114058 1.597022 -1.724950
C -2.230272 0.103254 0.195340
H 2.669118 0.313442 0.638342
H 2.504503 -1.289978 -0.139244
H 0.124074 0.814053 -2.149651
H 1.417850 -0.405472 -2.243359
H 1.260166 -0.470872 2.591364
H 1.090901 -2.085612 1.819808
H 2.686159 -1.511559 2.362506
H 1.830588 2.462443 -1.102590
H 3.105363 1.247840 -1.389159
H 2.219630 1.943591 -2.769363
H -2.226541 -1.820304 -0.563858
H -1.774610 1.934949 1.038317


