%chk=000245684.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245684

0 1
O 0.018960 1.656268 1.797389
O -0.012870 1.637127 -1.818180
O -1.702015 -0.260552 1.357289
O 1.704800 -0.277779 -1.357910
N -2.188332 0.293817 -0.816611
N 2.192060 0.298603 0.810045
N -3.064009 -0.791363 -1.067032
N 3.066888 -0.784582 1.071631
C -0.576775 1.667773 0.499560
C 0.582904 1.661423 -0.520569
C -1.524220 0.461179 0.381709
C 1.528275 0.454477 -0.389989
H -1.148913 2.625986 0.419623
H 1.156595 2.619494 -0.450812
H -0.415479 0.945641 2.370460
H 0.420117 0.919420 -2.383498
H -1.922690 0.813422 -1.672559
H 1.927814 0.828117 1.660336
H -2.616461 -1.683885 -0.808303
H -3.892185 -0.707173 -0.458625
H 2.616815 -1.679708 0.826687
H 3.892922 -0.710105 0.459062


%chk=000245684-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245684

0 1
O 0.010073 1.716282 1.853917
O -0.004781 1.696371 -1.874579
O -1.834873 -0.122201 1.543653
O 1.835541 -0.143271 -1.545205
N -2.076347 0.180368 -0.767533
N 2.080835 0.184975 0.762005
N -3.000090 -0.881267 -0.973994
N 3.003841 -0.875219 0.978928
C -0.570818 1.686716 0.512849
C 0.576403 1.679714 -0.533415
C -1.547601 0.483085 0.456373
C 1.550205 0.474281 -0.464345
H -1.158510 2.610449 0.337601
H 1.166409 2.603815 -0.368110
H -0.571550 1.096363 2.396643
H 0.575217 1.069414 -2.410902
H -1.697662 0.663502 -1.595964
H 1.705251 0.678911 1.585443
H -2.638849 -1.759957 -0.577244
H -3.918233 -0.647384 -0.571600
H 2.639347 -1.758826 0.596306
H 3.920391 -0.648521 0.568877


