%chk=000063190.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063190

0 1
 O   0.7899000       1.131400      -1.933200    
 N   0.1581000       1.047100      0.3370000    
 N   -2.257800      0.8217000     -4.1400000E-02
 N   -3.381100       1.538700     -0.2153000    
 N    1.741800      0.3072000       1.957500    
 C   -1.140400       1.583300      0.1344000    
 C    2.312400      0.2183000     -0.4259000    
 C    1.000400      0.8228000     -0.7637000    
 C   -2.319000     -0.5728000     -5.8300000E-02
 C    2.631300     -2.0000001E-03  0.9188000    
 C   -1.561000       2.888900      7.0699997E-02
 C   0.5872000      0.7905000       1.630200    
 C    3.222900     -0.1101000      -1.437300    
 C   -2.949300       2.800700     -0.1459000    
 C    3.876100     -0.5572000       1.237400    
 C   -1.224000      -1.300000     -0.5052000    
 C   -3.473400      -1.212700      0.3720000    
 C    4.458600     -0.6634000      -1.104300    
 C    4.785500     -0.8863000      0.2314000    
 C   -1.284600      -2.693400     -0.5221000    
 C   -3.534000      -2.606200      0.3550000    
 C   -2.439600      -3.346500     -9.2000000E-02
 H  -0.9534000       3.776900      0.1670000    
 H  -0.1507000       1.036300       2.411300    
 H    2.989000      5.6000002E-02  -2.485200    
 H   -3.664000       3.603500     -0.2560000    
 H    4.144800     -0.7386000       2.275500    
 H  -0.3626000     -0.8968000     -0.9943000    
 H   -4.338000     -0.6641000      0.7361000    
 H    5.167000     -0.9199000      -1.886600    
 H    5.748300      -1.317200      0.4902000    
 H  -0.4462000      -3.270500     -0.9018000    
 H   -4.432900      -3.115200      0.6906000    
 H   -2.489600      -4.431200     -0.1122000    


%chk=000063190-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063190

0 1
O 0.708439 0.841104 -2.016445
N 0.214454 0.969219 0.280403
N -2.244874 0.754903 -0.091902
N -3.375761 1.570793 -0.168168
N 1.810283 0.362787 1.997396
C -1.082087 1.520769 0.037040
C 2.440740 0.237872 -0.408365
C 1.101286 0.695649 -0.824828
C -2.406824 -0.673788 -0.122519
C 2.752380 0.081441 0.982707
C -1.468429 2.866847 0.035242
C 0.624895 0.783789 1.617981
C 3.420663 -0.052995 -1.393547
C -2.887359 2.844077 -0.098396
C 4.046769 -0.366294 1.360914
C -1.522033 -1.479635 -0.875990
C -3.487017 -1.247281 0.588962
C 4.696536 -0.493677 -1.005035
C 5.007428 -0.650466 0.375589
C -1.703887 -2.880066 -0.880398
C -3.664501 -2.646232 0.564108
C -2.768732 -3.468318 -0.160155
H -0.810495 3.729218 0.109300
H -0.134581 1.023913 2.368883
H 3.152445 0.076041 -2.447147
H -3.581599 3.680535 -0.149882
H 4.261601 -0.478388 2.427644
H -0.742514 -1.017999 -1.488827
H -4.173312 -0.595282 1.136357
H 5.454162 -0.717141 -1.763304
H 6.004102 -0.995224 0.671760
H -1.022932 -3.507999 -1.464889
H -4.500256 -3.094211 1.112288
H -2.907289 -4.554759 -0.172380


