%chk=000228826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228826

0 1
O -2.836472 -1.692573 0.003886
O -1.299319 2.644291 0.002925
O 4.072529 -0.535905 -0.002808
N -0.550122 -1.410013 0.001578
N -2.070138 0.492073 0.003067
N 1.793857 -1.090761 -0.001118
N 1.381363 1.727653 0.000496
N 2.591185 1.219858 -0.000746
C 0.552044 -0.567216 0.000376
C 0.341169 0.880351 0.001068
C -1.909005 -0.914187 0.002850
C -1.016069 1.472827 0.002044
C -0.347450 -2.886156 0.000257
C -3.482028 0.975144 0.003381
C 2.906412 -0.255952 -0.001772
H 0.216704 -3.193351 -0.899894
H -1.322869 -3.407958 0.011567
H 0.236841 -3.192279 0.887968
H -4.008968 0.622638 -0.900376
H -3.504557 2.081831 0.019360
H -4.017631 0.596348 0.891372
H 3.370128 1.904435 -0.001082


%chk=000228826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228826

0 1
O -2.872986 -1.701074 0.002036
O -1.303953 2.705635 0.004089
O 4.093216 -0.606481 -0.002929
N -0.550518 -1.390495 0.000285
N -2.078806 0.490498 0.002951
N 1.773856 -1.093666 -0.001442
N 1.362198 1.745714 0.000979
N 2.584416 1.174659 -0.000248
C 0.550455 -0.543560 -0.000164
C 0.320411 0.896037 0.001106
C -1.893878 -0.912801 0.001613
C -1.046329 1.476261 0.002260
C -0.325199 -2.857483 -0.000870
C -3.489993 0.952251 0.004735
C 2.893773 -0.252691 -0.001288
H 0.251291 -3.143821 -0.894677
H -1.308958 -3.346116 0.002047
H 0.257130 -3.144119 0.888999
H -4.009817 0.576115 -0.890776
H -3.475629 2.051171 0.008634
H -4.009546 0.569285 0.897441
H 3.376471 1.825780 -0.000382


