%chk=000072658.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072658

1 1
 O    2.312300      -1.227600      0.5080000    
 O    3.635000       1.001500     -0.2102000    
 N   -1.913200      0.7312000      6.1400000E-02
 N    2.237100      0.9310000     -0.2968000    
 C   0.1944000     -0.3367000      2.3100000E-02
 C  -0.5774000      0.8115000      0.1298000    
 C   -2.554100     -0.4332000     -0.1095000    
 C  -0.4446000      -1.560000     -0.1553000    
 C   -1.833500      -1.613500     -0.2228000    
 C   -2.699200       1.956600      0.1758000    
 C    1.643200     -0.2609000      9.6400000E-02
 H  -0.1703000       1.801800      0.2917000    
 H   -3.636500     -0.4116000     -0.1490000    
 H   0.1233000      -2.482000     -0.2471000    
 H   -2.343700      -2.560700     -0.3611000    
 H   -2.171800       2.770700     -0.3295000    
 H   -3.675100       1.821600     -0.2983000    
 H   -2.818700       2.175400       1.240200    
 H    1.776000       1.715000     -0.7443000    
 H    3.731500       1.411900      0.6659000    


%chk=000072658-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072658

1 1
O 2.389570 -1.095256 0.546217
O 3.742903 1.132798 -0.073533
N -2.015829 0.765115 0.018398
N 2.325381 1.073761 -0.193992
C 0.208235 -0.186347 0.001860
C -0.649550 0.924754 0.084044
C -2.577816 -0.482427 -0.124896
C -0.362382 -1.483789 -0.117826
C -1.762165 -1.623319 -0.193152
C -2.900235 1.966979 0.164379
C 1.699853 -0.103863 0.130315
H -0.293915 1.946679 0.237163
H -3.667600 -0.532053 -0.167399
H 0.308130 -2.348731 -0.135364
H -2.230989 -2.604221 -0.297124
H -2.442896 2.826712 -0.347475
H -3.877742 1.759838 -0.294146
H -3.035468 2.196587 1.233909
H 1.975957 1.883339 -0.707182
H 3.981256 0.225442 0.304206


