%chk=000017719.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017719

0 1
 O   -3.556300      -2.119400      9.2900001E-02
 O    3.560000       2.117200      9.8600000E-02
 N   -2.901600     -0.1960000       1.251700    
 N    2.902400      0.1917000       1.252200    
 C   -2.342500      0.8738000      0.3755000    
 C    2.341600     -0.8749000      0.3730000    
 C   -1.131900      0.4240000     -0.3706000    
 C    1.131500     -0.4211000     -0.3716000    
 C  -3.0000001E-04  5.0000002E-04  0.3264000    
 C   -3.547400       1.323900     -0.4983000    
 C   -1.994100       2.050500       1.322000    
 C    3.545700      -1.324400     -0.5020000    
 C    1.991500      -2.053600       1.316300    
 C   -1.131800      0.4259000      -1.765500    
 C    1.131400     -0.4192000      -1.766600    
 C  -1.9999999E-04  4.4000000E-03  -2.463500    
 C   -3.222900      -1.146100      0.6632000    
 C    3.225000       1.142800      0.6663000    
 H  -3.9999999E-04 -1.2000001E-03   1.412800    
 H   -3.893300      0.5517000      -1.195700    
 H   -3.293000       2.213100      -1.088000    
 H   -4.408300       1.592500      0.1275000    
 H   -1.276700       1.761800       2.098200    
 H   -1.566700       2.892000      0.7646000    
 H   -2.887300       2.412600       1.845500    
 H    3.892800     -0.5509000      -1.197200    
 H    3.289700      -2.211500      -1.094400    
 H    4.406200      -1.596200      0.1229000    
 H    1.274800      -1.765900       2.093600    
 H    1.562300      -2.892800      0.7567000    
 H    2.884100      -2.418800       1.838500    
 H   -1.982500      0.7481000      -2.355700    
 H    1.982100     -0.7400000      -2.357700    
 H  -9.9999997E-05  5.7999999E-03  -3.549700    


%chk=000017719-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000017719

0 1
O -3.164802 -1.954963 2.396478
O 3.162772 1.948325 2.401763
N -2.563796 0.211329 1.453294
N 2.563540 -0.215502 1.452102
C -2.328992 1.055535 0.265049
C 2.328135 -1.056697 0.261816
C -1.139267 0.482939 -0.545820
C 1.138515 -0.481485 -0.547363
C -0.000474 -0.000582 0.141069
C -3.648643 1.121104 -0.547263
C -1.959524 2.474476 0.780452
C 3.647569 -1.120824 -0.550932
C 1.958219 -2.476779 0.773730
C -1.129404 0.482826 -1.962186
C 1.129021 -0.476078 -1.963705
C -0.000123 0.004660 -2.661391
C -2.873551 -0.902630 1.848847
C 2.873037 0.897569 1.850316
H -0.000571 -0.002597 1.237417
H -3.908552 0.135650 -0.971902
H -3.567856 1.854318 -1.368052
H -4.467638 1.445952 0.116508
H -1.059506 2.435531 1.416352
H -1.755516 3.141950 -0.074340
H -2.791135 2.892295 1.374164
H 3.908083 -0.134357 -0.972838
H 3.566019 -1.851658 -1.373768
H 4.466484 -1.448117 0.111733
H 1.058221 -2.439156 1.409736
H 1.754029 -3.142081 -0.082715
H 2.789714 -2.896299 1.366401
H -1.992696 0.847349 -2.526662
H 1.992483 -0.838404 -2.529335
H 0.000006 0.006703 -3.757057


