%chk=000075802.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075802

0 1
 O    2.551600      0.2437000     -3.7700001E-02
 O    1.123200      -1.492600      0.2929000    
 N   0.2767000      0.6590000     -0.1572000    
 C   -1.113100      0.2632000     -7.0400000E-02
 C   -1.441000      -1.020500     -0.4170000    
 C   -2.023800       1.193800      0.3541000    
 C   0.6204000       2.057800     -0.4520000    
 C    1.293600     -0.3019000      4.2199999E-02
 C   -2.779900      -1.402200     -0.3332000    
 C   -3.362800      0.8119000      0.4380000    
 C    3.650000     -0.6488000      0.1865000    
 C   -3.740800     -0.4861000      9.4400004E-02
 C    4.946100      0.1227000      5.9200000E-02
 H  -0.7555000      -1.745600     -0.8370000    
 H   -1.753900       2.203600      0.6436000    
 H   0.6562000       2.613500      0.4896000    
 H  -0.1215000       2.496200      -1.126700    
 H    1.594900       2.133900     -0.9418000    
 H   -3.078200      -2.406600     -0.6194000    
 H   -4.111000       1.524200      0.7738000    
 H    3.571900      -1.077600       1.191700    
 H    3.623500      -1.453100     -0.5570000    
 H   -4.783900     -0.7822000      0.1562000    
 H    5.807800     -0.5299000      0.2248000    
 H    5.029800      0.5739000     -0.9350000    
 H    4.979000      0.9429000      0.7840000    


%chk=000075802-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075802

0 1
O 2.605950 0.273965 -0.035093
O 1.237916 -1.612530 -0.042396
N 0.307916 0.580277 -0.036098
C -1.086326 0.204534 -0.025992
C -1.526234 -1.150972 -0.077477
C -2.072531 1.232192 0.033796
C 0.629490 2.027746 -0.033941
C 1.345103 -0.357392 -0.038275
C -2.904502 -1.449051 -0.069446
C -3.447423 0.914673 0.040790
C 3.767833 -0.661597 -0.043005
C -3.879037 -0.427776 -0.011077
C 5.022860 0.205708 -0.038260
H -0.791669 -1.954435 -0.119496
H -1.787486 2.285386 0.078382
H 0.253952 2.506685 0.888623
H 0.171430 2.521605 -0.909572
H 1.716219 2.151706 -0.081095
H -3.213812 -2.499741 -0.110130
H -4.179934 1.728506 0.088026
H 3.699783 -1.312680 0.846844
H 3.697921 -1.300410 -0.941630
H -4.946598 -0.671750 -0.005677
H 5.919875 -0.440052 -0.043708
H 5.058445 0.855643 -0.929435
H 5.060159 0.842959 0.861942


