%chk=000033070.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033070

0 1
 O  -8.4700003E-02   3.014500      0.2340000    
 O    4.717100      -2.415300     -5.2499998E-02
 O    5.837300     -0.5487000     -0.3661000    
 N   -3.162600      9.3199998E-02 -0.1028000    
 N   -2.020600      0.7204000     -0.4577000    
 N    4.765800      -1.166500     -0.1582000    
 C   -5.584500      -1.552800     -7.4500002E-02
 C   -5.638700     -4.0800001E-02 -0.2517000    
 C   -4.332900      -1.946800      0.6991000    
 C   -4.347000      0.4941000     -0.8685000    
 C   -3.073900      -1.362600      5.9400000E-02
 C   -1.329600       1.092400      0.5618000    
 C  -3.7999999E-02   1.796100      0.3155000    
 C    1.216300       1.022700      0.1918000    
 C    1.171800     -0.3545000      0.3077000    
 C    2.402200       1.695900     -3.6600001E-02
 C    3.561700     -0.4237000     -3.9099999E-02
 C    2.355000      -1.084100      0.1913000    
 C    3.585400      0.9663000     -0.1531000    
 H   -5.578000      -2.038800      -1.057800    
 H   -6.478700      -1.902200      0.4530000    
 H   -5.804200      0.4355000      0.7230000    
 H   -6.490700      0.2269000     -0.8869000    
 H   -4.253300      -3.039000      0.7418000    
 H   -4.416300      -1.591500       1.734100    
 H   -4.257700      0.1490000      -1.906600    
 H   -4.410500       1.588900     -0.9005000    
 H   -2.219900      -1.617800      0.6984000    
 H   -2.895000      -1.836800     -0.9142000    
 H   -1.595400      0.9393000       1.622500    
 H   0.2521000     -0.9001000      0.4903000    
 H    2.439300       2.777500     -0.1281000    
 H    2.298400      -2.165600      0.2863000    
 H    4.506700       1.514600     -0.3326000    


%chk=000033070-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000033070

0 1
O 0.493306 1.419262 2.822801
O 4.374022 -0.544008 -3.104496
O 5.748570 0.518487 -1.627158
N -2.989577 -0.564295 0.373115
N -1.682701 -0.237199 0.504304
N 4.594236 0.062456 -1.984820
C -5.763681 -1.223905 -0.258262
C -4.669286 -1.254158 -1.348493
C -5.419615 -0.151129 0.797961
C -3.286311 -1.518459 -0.722312
C -4.024781 -0.381144 1.423725
C -1.211040 0.400080 1.575084
C 0.192180 0.818859 1.730959
C 1.284963 0.585898 0.706991
C 1.100992 -0.075244 -0.539210
C 2.579339 1.071992 1.047119
C 3.452537 0.245463 -1.053746
C 2.183175 -0.248289 -1.423394
C 3.668547 0.907798 0.175671
H -5.835868 -2.219373 0.226435
H -6.751341 -1.012824 -0.707218
H -4.651800 -0.286168 -1.885528
H -4.876974 -2.043682 -2.094362
H -6.168583 -0.143223 1.611739
H -5.438448 0.849077 0.324029
H -3.255291 -2.555173 -0.319241
H -2.474484 -1.418899 -1.460272
H -3.756557 0.489368 2.045379
H -4.037492 -1.275855 2.084652
H -1.819017 0.672633 2.452213
H 0.108355 -0.446401 -0.798744
H 2.696584 1.576814 2.010989
H 2.064816 -0.754016 -2.385282
H 4.668121 1.274957 0.421872


