%chk=000266429.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266429

0 1
O 7.034221 -0.525687 0.810394
O -3.613680 1.464091 0.677598
N -7.569083 -2.237245 -0.682743
C 3.956344 -0.364049 -1.034264
C 4.626651 -0.658138 0.340083
C 2.436902 -0.112989 -1.007241
C 2.000493 0.793395 0.167874
C 4.079271 0.223793 1.482117
C 4.750861 0.828283 -1.625369
C 2.551674 0.264467 1.507596
C 1.661202 -1.443165 -0.960530
C 6.097139 -0.219069 0.117811
C 6.185347 0.676239 -1.104979
C 4.575061 -2.140787 0.699073
C 0.494944 0.914217 0.248567
C 0.157855 -1.202037 -1.127443
C -0.362525 -0.039046 -0.327986
C -0.053302 2.009525 0.942152
C -1.756059 0.099100 -0.201413
C -1.427782 2.165118 1.080229
C -2.262277 1.192401 0.500665
C -4.545448 0.477602 0.312440
C -4.633878 -0.722893 1.027512
C -5.445416 0.816524 -0.704837
C -5.660468 -1.610458 0.717814
C -6.475596 -0.070022 -1.007793
C -6.584726 -1.290072 -0.302952
H 4.138926 -1.247916 -1.696301
H 2.161156 0.410607 -1.958283
H 2.430795 1.811406 -0.013520
H 4.470555 1.256240 1.380484
H 4.465768 -0.147270 2.452112
H 4.318113 1.790825 -1.298955
H 4.711675 0.827929 -2.726176
H 2.139309 -0.742382 1.713510
H 2.205128 0.904857 2.340594
H 1.860941 -1.956659 0.002545
H 2.018060 -2.129238 -1.750584
H 6.649252 1.645396 -0.849927
H 6.855706 0.221369 -1.857931
H 4.967947 -2.774546 -0.103293
H 5.176998 -2.350570 1.594574
H 3.545775 -2.460897 0.904041
H -0.395744 -2.125837 -0.859013
H -0.076266 -1.018662 -2.199386
H 0.611769 2.752878 1.383860
H -2.425082 -0.629058 -0.652516
H -1.862625 3.005509 1.613817
H -3.912317 -0.946342 1.812405
H -5.336418 1.762562 -1.233842
H -5.743122 -2.551515 1.256424
H -7.184182 0.173773 -1.795854
H -8.378922 -1.866668 -1.159758
H -7.827622 -2.913488 0.021900


%chk=000266429-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266429

0 1
O 7.100413 -0.685716 0.943058
O -3.692108 1.543481 0.514434
N -7.741163 -2.307180 -0.398951
C 4.036365 -0.357718 -1.006777
C 4.675327 -0.709337 0.378723
C 2.504581 -0.097316 -1.029591
C 2.033248 0.816224 0.139275
C 4.128799 0.251264 1.494699
C 4.878883 0.853737 -1.520585
C 2.587318 0.307460 1.503320
C 1.658153 -1.395387 -1.064655
C 6.165849 -0.331627 0.183648
C 6.323629 0.545907 -1.067172
C 4.552081 -2.183653 0.822230
C 0.510316 0.963001 0.181598
C 0.179174 -1.068806 -1.356548
C -0.364144 0.056521 -0.479691
C -0.059440 2.028318 0.928029
C -1.768193 0.219213 -0.364719
C -1.450262 2.199369 1.042610
C -2.306047 1.279626 0.393700
C -4.644110 0.517091 0.243584
C -4.605120 -0.732916 0.901936
C -5.716019 0.832300 -0.616387
C -5.631039 -1.672829 0.684407
C -6.748926 -0.102968 -0.828325
C -6.721223 -1.374673 -0.185615
H 4.240006 -1.211647 -1.689972
H 2.289240 0.441244 -1.979891
H 2.464312 1.829139 -0.015008
H 4.517680 1.279089 1.338700
H 4.521715 -0.088692 2.471171
H 4.523348 1.793890 -1.059045
H 4.789724 0.972143 -2.614561
H 2.160634 -0.687466 1.733968
H 2.245906 0.983014 2.310736
H 1.737108 -1.934337 -0.101988
H 2.049662 -2.076691 -1.845153
H 6.952696 1.428415 -0.857288
H 6.864276 -0.056283 -1.825552
H 4.768633 -2.872132 -0.015507
H 5.281864 -2.386689 1.626790
H 3.542152 -2.417805 1.200907
H -0.447707 -1.973298 -1.235981
H 0.081116 -0.766721 -2.420815
H 0.606373 2.742446 1.429542
H -2.437866 -0.477956 -0.880718
H -1.887218 3.022554 1.615306
H -3.781425 -0.965477 1.585066
H -5.735278 1.811454 -1.104769
H -5.595529 -2.640531 1.199532
H -7.581524 0.151249 -1.495324
H -8.523077 -2.092793 -1.009940
H -7.729866 -3.208101 0.068864


