%chk=000084037.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084037

0 1
 O   -2.983700     -0.2582000      0.9039000    
 O    2.983700      0.2581000      0.9038000    
 O   -1.489300       2.188400     -0.1284000    
 O    1.489300      -2.188300     -0.1287000    
 N  -0.5790000      -1.188900     -0.2747000    
 N   0.5790000       1.189100     -0.2746000    
 N   -4.398100     -0.4088000       1.213100    
 N    4.398000      0.4084000       1.213300    
 C   -1.378400     -0.1228000     -0.8603000    
 C    1.378500      0.1231000     -0.8603000    
 C  -0.8057000       1.191000     -0.3463000    
 C   0.8057000      -1.190900     -0.3464000    
 C   -2.848800     -0.2786000     -0.5073000    
 C    2.848900      0.2785000     -0.5072000    
 H   -1.244700     -0.1555000      -1.947800    
 H    1.244800      0.1558000      -1.947900    
 H   -1.038700      -2.053100     -3.4000000E-03
 H    1.038700       2.053200     -3.1999999E-03
 H   -3.225400      -1.233000     -0.8967000    
 H   -3.434500      0.5377000     -0.9484000    
 H    3.225600       1.232800     -0.8967000    
 H    3.434500     -0.5378000     -0.9483000    
 H   -4.548300      0.4114000       1.798600    
 H   -4.366500      -1.211600       1.839700    
 H    4.548000     -0.4118000       1.798700    
 H    4.366600       1.211200       1.839800    


%chk=000084037-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084037

0 1
O -2.930078 -0.647901 0.842762
O 2.929998 0.647357 0.842893
O -1.387852 2.274864 0.024660
O 1.387993 -2.274087 0.026078
N -0.646739 -1.214956 -0.418428
N 0.646783 1.215011 -0.418341
N -4.369380 -0.659490 1.257620
N 4.369277 0.658885 1.257831
C -1.387511 -0.031355 -0.907245
C 1.387547 0.031486 -0.907422
C -0.728637 1.273067 -0.376122
C 0.728716 -1.273285 -0.377088
C -2.873429 -0.126228 -0.536950
C 2.873449 0.126323 -0.537067
H -1.332905 0.014971 -2.018263
H 1.333011 -0.014611 -2.018438
H -1.183485 -1.934109 0.075146
H 1.183644 1.934428 0.074728
H -3.422020 -0.811679 -1.210677
H -3.316648 0.884346 -0.582365
H 3.422002 0.812120 -1.210471
H 3.316732 -0.884201 -0.582944
H -4.435735 0.099630 1.961575
H -4.475244 -1.574379 1.730388
H 4.435641 -0.100443 1.961561
H 4.475073 1.573637 1.730878


