%chk=000250014.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250014

0 1
O -0.693310 -1.470066 0.906996
O -0.954097 2.199725 -1.840418
O -2.902160 2.161829 -0.861184
N -1.152005 1.276004 0.190982
N 1.606132 -1.300386 0.373848
N 2.624963 -0.624143 -0.067484
N -1.716548 1.901606 -0.940439
C 0.124638 0.625305 0.065536
C 1.234535 1.328560 -0.402040
C 0.358608 -0.737192 0.449363
C 2.493137 0.677117 -0.463532
C -2.108431 0.735607 1.198527
C 3.706265 1.381269 -0.960556
C -0.413074 -2.856083 1.285149
H 1.138102 2.367137 -0.735340
H -2.929220 1.458579 1.365911
H -1.569664 0.589936 2.151667
H -2.546341 -0.232394 0.891243
H 3.576575 1.716069 -2.001293
H 3.938423 2.266125 -0.349806
H 4.598077 0.730872 -0.940396
H -0.036147 -3.409809 0.418609
H -1.406737 -3.197281 1.594056
H 0.309980 -2.879586 2.106800


%chk=000250014-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250014

0 1
O -0.672304 -1.568751 0.892148
O -1.013337 2.036193 -2.031723
O -2.972195 2.249324 -0.850348
N -1.221714 1.091390 0.101235
N 1.622231 -1.324663 0.431620
N 2.698998 -0.596907 -0.018588
N -1.759241 1.838248 -1.000674
C 0.097003 0.561905 0.037932
C 1.203274 1.300110 -0.414225
C 0.377510 -0.784179 0.452614
C 2.491142 0.694850 -0.435444
C -2.143766 0.893095 1.237606
C 3.711419 1.438724 -0.924567
C -0.345131 -2.970090 1.260949
H 1.079547 2.327111 -0.762246
H -2.492467 1.873292 1.604651
H -1.593393 0.363432 2.026457
H -3.017340 0.291418 0.939221
H 3.597923 1.737602 -1.982818
H 3.886317 2.358583 -0.336802
H 4.595098 0.788128 -0.834489
H 0.083329 -3.501004 0.395446
H -1.312848 -3.398311 1.559020
H 0.381643 -2.990700 2.089224


