%chk=000012076.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012076

0 1
 O   -3.175800       1.464400      0.5004000    
 O   -3.491200     -0.5601000     -0.4837000    
 O    3.585300       1.115200     -8.2300000E-02
 O    3.499300      -1.072000      8.4600002E-02
 N   -1.358500      -2.223800      0.1555000    
 N    2.934800      4.5200001E-02 -3.0000000E-03
 C   -1.271700      0.2096000     -3.0800000E-02
 C  -0.6226000      -1.021300      6.5399997E-02
 C    1.515800      0.1004000     -1.2300000E-02
 C   0.7712000      -1.075800      7.4699998E-02
 C  -0.5271000       1.385900     -0.1177000    
 C   0.8667000       1.331200     -0.1086000    
 C   -2.726300      0.3010000     -4.1999999E-02
 H    1.256400      -2.046700      0.1508000    
 H   -1.002300       2.359300     -0.2073000    
 H    1.414500       2.267400     -0.1811000    
 H   -2.368900      -2.213700      0.1602000    
 H  -0.8700000      -3.106900      0.2248000    
 H   -4.155200       1.518100      0.4895000    


%chk=000012076-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000012076

0 1
O -3.262729 1.598515 0.058956
O -3.552571 -0.697387 0.125988
O 3.649848 1.138986 -0.094085
O 3.547153 -1.136389 -0.024286
N -1.354283 -2.240915 0.116649
N 2.994280 0.029773 -0.045911
C -1.292458 0.222735 0.048364
C -0.638833 -1.067502 0.067821
C 1.505029 0.102786 -0.013343
C 0.790029 -1.098479 0.035779
C -0.513547 1.412649 -0.001963
C 0.885533 1.378252 -0.033837
C -2.760865 0.293652 0.081309
H 1.335506 -2.046673 0.049199
H -1.042389 2.369034 -0.015650
H 1.495028 2.282566 -0.072492
H -2.379433 -2.183837 0.139965
H -0.874960 -3.137816 0.130432
H -4.255939 1.557449 0.084207


