%chk=000067246.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067246

0 1
 O   -3.417300       1.926700      2.4000001E-03
 O    3.416100       1.927100     -2.3000001E-03
 O   -3.495600      -2.689300     -3.1999999E-03
 O    3.497100      -2.688700      3.4000000E-03
 N   -3.528000     -0.4047000     -3.0000001E-04
 N    3.528400     -0.4042000      3.9999999E-04
 N   -2.770800      -1.688500     -3.8999999E-03
 N    2.771700      -1.688300      3.8999999E-03
 C   -1.395100      0.8257000     -5.0000002E-04
 C    1.394600      0.8249000      1.9999999E-04
 C  -0.6975000      0.8253000      -1.208300    
 C   0.6974000      0.8249000      -1.208000    
 C  -0.6979000      0.8257000       1.207800    
 C   0.6970000      0.8254000       1.207900    
 C   -2.849000      0.8258000     -6.0000003E-04
 C    2.848700      0.8258000      6.0000003E-04
 C   -4.983000     -0.4474000      3.7000000E-03
 C    4.983300     -0.4463000     -3.3000000E-03
 H   -1.230500      0.8257000      -2.155700    
 H    1.230700      0.8251000      -2.155200    
 H   -1.231200      0.8263000       2.155000    
 H    1.230000      0.8260000       2.155400    
 H   -5.411600      0.5583000      6.2000002E-03
 H   -5.322900     -0.9748000      0.9001000    
 H   -5.327800     -0.9725000     -0.8921000    
 H    5.411400      0.5595000     -5.5999998E-03
 H    5.323600     -0.9735000     -0.8996000    
 H    5.328200     -0.9713000      0.8925000    


%chk=000067246-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000067246

0 1
O -3.236613 0.885637 1.670220
O 3.237265 0.888434 -1.671844
O -4.435523 -1.525578 -1.997525
O 4.434964 -1.519462 1.998744
N -3.861095 -0.180400 -0.292656
N 3.860905 -0.174773 0.293011
N -3.453859 -1.049500 -1.341028
N 3.453672 -1.046825 1.339371
C -1.405119 0.268874 0.224910
C 1.405154 0.270823 -0.227314
C -0.894249 0.274086 -1.100906
C 0.494442 0.296142 -1.317743
C -0.494293 0.295555 1.315482
C 0.894388 0.275367 1.098625
C -2.857337 0.353361 0.589760
C 2.857607 0.357002 -0.591126
C -5.298268 0.038539 -0.026374
C 5.298022 0.047488 0.029689
H -1.569855 0.272047 -1.957681
H 0.895565 0.335186 -2.334842
H -0.895504 0.334266 2.332541
H 1.570141 0.274220 1.955300
H -5.378740 0.672569 0.866585
H -5.800072 -0.929376 0.143099
H -5.769122 0.521145 -0.899419
H 5.379067 0.677810 -0.865859
H 5.803235 -0.919682 -0.133707
H 5.765223 0.535746 0.901587


