%chk=000035235.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035235

0 1
 O    4.662900       1.348100      0.4849000    
 O   -4.657200       1.355900     -0.4867000    
 N    2.315000     -3.9099999E-02 -0.3233000    
 N   -2.329600     -4.6000000E-02  0.3267000    
 N  -7.3000002E-03 -1.0800000E-02  3.5000001E-03
 N   -1.192900      -2.090700      0.1659000    
 N    1.183600      -2.087200     -0.1665000    
 C    2.405400       1.402400     -0.3337000    
 C   -2.401800       1.381500      0.3389000    
 C    3.843300       1.831200     -0.5719000    
 C   -3.835100       1.827400      0.5735000    
 C    1.127800     -0.7334000     -0.1564000    
 C   -1.117600     -0.7501000      0.1577000    
 C  -3.8999999E-03  -2.691900     -1.3000000E-03
 C  -2.3000001E-03  -4.182800     -5.9000002E-03
 C    6.019800       1.730700      0.3085000    
 C   -6.009900       1.754800     -0.3139000    
 H    1.768100       1.818000      -1.122400    
 H    2.064900       1.792900      0.6325000    
 H   -2.055800       1.774500     -0.6246000    
 H   -1.764600       1.793200       1.129800    
 H    3.156500     -0.5929000     -0.4359000    
 H   -3.167100     -0.6064000      0.4355000    
 H    3.896700       2.925500     -0.6052000    
 H    4.205100       1.431600      -1.527200    
 H   -4.205000       1.431400       1.527100    
 H   -3.875300       2.922300      0.6080000    
 H   0.9416000      -4.571500      0.3890000    
 H  -0.8155000      -4.574800      0.6129000    
 H  -0.1321000      -4.549000      -1.028500    
 H    6.600600       1.335000       1.146000    
 H    6.418700       1.312800     -0.6210000    
 H    6.113700       2.821000      0.3028000    
 H   -6.593000       1.367600      -1.153800    
 H   -6.416800       1.340400      0.6136000    
 H   -6.090500       2.846100     -0.3068000    


%chk=000035235-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035235

0 1
O 4.849428 1.234973 0.464628
O -4.840026 1.247522 -0.476284
N 2.291629 0.044837 0.584651
N -2.286911 0.054605 -0.552123
N 0.002644 0.143914 0.015508
N -1.181101 -1.980637 -0.273739
N 1.177111 -1.985496 0.305336
C 2.466332 1.496665 0.614623
C -2.454434 1.507330 -0.585610
C 3.710707 1.907721 -0.176565
C -3.712047 1.921655 0.182351
C 1.119951 -0.601941 0.292523
C -1.117472 -0.597071 -0.262893
C -0.002914 -2.611045 0.013943
C 0.001710 -4.118473 -0.015888
C 6.108794 1.462165 -0.240644
C -6.111072 1.477000 0.207088
H 1.560038 1.955925 0.186584
H 2.575798 1.853617 1.658607
H -2.542206 1.865297 -1.631365
H -1.554805 1.963375 -0.140355
H 3.103965 -0.543321 0.782107
H -3.101498 -0.529230 -0.753303
H 3.844812 3.011517 -0.140679
H 3.624357 1.586891 -1.237577
H -3.644563 1.603966 1.245682
H -3.844773 3.025356 0.140823
H 0.753389 -4.512151 0.686232
H -0.999583 -4.508009 0.225655
H 0.268106 -4.473248 -1.029663
H 6.881482 0.912977 0.319685
H 6.066057 1.079485 -1.282485
H 6.369975 2.541476 -0.266031
H -6.874200 0.925630 -0.364062
H -6.085518 1.098100 1.250868
H -6.372761 2.556324 0.224173


