%chk=000259165.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259165

0 1
O -1.811268 -2.754002 -1.136317
O 4.790368 -0.290002 1.153764
N -2.005231 -0.720367 0.095789
N 3.261802 1.493501 0.726589
C 1.648732 -1.902807 -0.044762
C 0.237303 -1.744856 -0.272431
C 2.530891 -0.868556 0.426665
C -0.520759 -0.500832 0.109453
C 2.093761 0.559838 0.612149
C 2.221284 -3.186598 -0.311699
C -0.475468 -2.804928 -0.814238
C 3.860930 -1.181213 0.663846
C -2.432353 -1.440878 -1.129441
C 4.279514 0.965229 1.670986
C -2.737682 0.577818 0.259356
C 2.835459 2.875872 1.121946
C 1.422478 -4.258319 -0.824546
C 3.610572 -3.438520 -0.077754
C 0.094310 -4.083696 -1.091148
C 4.432305 -2.463929 0.414078
C -4.220542 0.343944 0.427862
C 1.900571 3.464437 0.091243
C -5.135665 1.127178 -0.289902
C 2.235713 3.428469 -1.271146
C -4.687919 -0.630244 1.323057
C 0.706469 4.075526 0.499188
C -6.509104 0.937777 -0.108508
C 1.381089 4.000381 -2.215669
C -6.060830 -0.817759 1.496820
C -0.143021 4.650895 -0.451068
C -6.973787 -0.033303 0.783346
C 0.191352 4.614152 -1.807735
H -0.267775 -0.233344 1.166539
H -0.204747 0.344048 -0.549915
H 1.534631 0.892370 -0.301482
H 1.403184 0.630896 1.485329
H -3.512519 -1.697587 -1.078665
H -2.162554 -0.956327 -2.088570
H 5.189451 1.600886 1.666988
H 3.918412 0.760777 2.699107
H -2.538748 1.291435 -0.571998
H -2.352479 1.064551 1.188684
H 3.753716 3.511791 1.164668
H 2.377462 2.911736 2.136068
H 1.899373 -5.223081 -1.005875
H 4.004420 -4.432273 -0.297976
H -0.543417 -4.868051 -1.491359
H 5.490251 -2.617470 0.611131
H -4.784645 1.884220 -0.987614
H 3.161472 2.940096 -1.583949
H -3.970467 -1.246325 1.869710
H 0.437678 4.111167 1.552616
H -7.217675 1.548467 -0.665342
H 1.643371 3.969954 -3.272396
H -6.420489 -1.577110 2.189643
H -1.065896 5.131507 -0.130884
H -8.042975 -0.179814 0.921978
H -0.469710 5.064377 -2.545410


%chk=000259165-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259165

0 1
O -1.955168 -2.489266 -1.516551
O 4.526937 -0.211415 1.567926
N -2.237838 -0.718085 0.060456
N 3.050129 1.584837 1.028572
C 1.469198 -1.737886 -0.077109
C 0.054961 -1.568245 -0.380358
C 2.311582 -0.736301 0.562652
C -0.794261 -0.420308 0.179880
C 1.882701 0.723476 0.754989
C 2.089778 -3.005269 -0.443787
C -0.607840 -2.575347 -1.114914
C 3.638984 -1.080450 0.900110
C -2.562636 -1.171304 -1.285419
C 3.889407 1.018071 2.067559
C -3.110419 0.350513 0.591952
C 2.748534 3.023566 1.136037
C 1.344130 -4.005923 -1.145997
C 3.456052 -3.272155 -0.109035
C 0.022487 -3.793666 -1.503202
C 4.220706 -2.340173 0.573976
C -4.552255 -0.099665 0.810593
C 2.332959 3.643337 -0.198280
C -5.620700 0.806541 0.601723
C 2.944301 3.227061 -1.407478
C -4.840176 -1.409379 1.271002
C 1.364546 4.675935 -0.236852
C -6.955572 0.418292 0.859440
C 2.597391 3.839303 -2.631782
C -6.173429 -1.801030 1.522933
C 1.019401 5.294314 -1.461083
C -7.235828 -0.888006 1.321851
C 1.635829 4.877412 -2.663144
H -0.571920 -0.297704 1.255091
H -0.551375 0.549814 -0.322523
H 1.414265 1.091390 -0.173479
H 1.125897 0.829913 1.572949
H -3.647017 -1.311912 -1.398885
H -2.175238 -0.483256 -2.079612
H 4.712264 1.702562 2.325604
H 3.322556 0.733786 2.990267
H -3.103263 1.266408 -0.052154
H -2.673971 0.656672 1.564481
H 3.669954 3.524933 1.495939
H 1.952769 3.235894 1.894111
H 1.843754 -4.946225 -1.405207
H 3.887291 -4.237139 -0.398641
H -0.566777 -4.530141 -2.056081
H 5.260574 -2.521975 0.858410
H -5.409350 1.819317 0.234854
H 3.680044 2.415685 -1.370124
H -4.009519 -2.109899 1.411070
H 0.879173 4.999714 0.693072
H -7.772957 1.129232 0.693500
H 3.075575 3.508167 -3.560676
H -6.384572 -2.817207 1.874981
H 0.270383 6.094289 -1.477156
H -8.270000 -1.192905 1.517824
H 1.368167 5.352906 -3.613478


