%chk=000254894.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254894

0 1
O 4.197683 -0.395995 -1.050993
N 2.277203 -0.061659 0.283053
C 3.519569 0.596866 -0.228820
C 1.067888 0.256724 -0.543279
C 2.598410 -1.526014 0.318276
C -0.196730 -0.119151 0.246843
C 3.822450 -1.719227 -0.603253
C -1.463090 0.278920 -0.520647
C 4.414767 1.008098 0.950729
C -2.729407 -0.096079 0.261264
C -3.999170 0.301227 -0.503615
C -5.264895 -0.073783 0.278636
C 5.606527 1.827631 0.470716
C -6.536273 0.322784 -0.485115
C -7.799244 -0.048085 0.289116
H 3.336159 1.437767 -0.931712
H 1.064320 1.351046 -0.744366
H 1.076235 -0.248708 -1.532457
H 1.740921 -2.155207 0.018093
H 2.838455 -1.784835 1.370991
H -0.206695 -1.204238 0.463219
H -0.172708 0.378227 1.237726
H 3.607087 -2.277422 -1.526812
H 4.693766 -2.149419 -0.087108
H -1.475496 -0.211787 -1.513042
H -1.456615 1.367834 -0.722128
H 4.764749 0.105581 1.488433
H 3.812821 1.580976 1.684170
H -2.738248 -1.184065 0.465602
H -2.718246 0.396051 1.253209
H -4.010643 -0.190027 -1.495623
H -3.991255 1.389583 -0.706507
H -5.255444 0.417366 1.270656
H -5.274727 -1.161594 0.483064
H 6.164284 1.286693 -0.307100
H 5.299465 2.789552 0.046301
H 6.301394 2.035525 1.291559
H -6.529000 1.411618 -0.688141
H -6.548332 -0.169486 -1.477219
H -7.837666 0.453453 1.262807
H -7.857220 -1.126672 0.474265
H -8.700946 0.238831 -0.263292


%chk=000254894-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254894

0 1
O 4.198331 -0.260786 -1.114281
N 2.328444 0.018901 0.360083
C 3.550214 0.685738 -0.110349
C 1.104697 0.295627 -0.452720
C 2.705370 -1.426845 0.393593
C -0.186628 -0.029415 0.323442
C 3.646315 -1.608400 -0.842397
C -1.464471 0.270823 -0.492157
C 4.550566 1.002296 1.015474
C -2.762779 -0.055263 0.280172
C -4.047666 0.244726 -0.524233
C -5.343946 -0.081487 0.251420
C 5.844054 1.650549 0.480841
C -6.630952 0.218042 -0.550733
C -7.920160 -0.106419 0.234866
H 3.304898 1.605217 -0.672897
H 1.107474 1.373427 -0.701944
H 1.108470 -0.260800 -1.421131
H 1.807395 -2.063122 0.348795
H 3.239954 -1.651071 1.332573
H -0.188827 -1.098315 0.620425
H -0.185859 0.555587 1.263532
H 3.092960 -1.948389 -1.739324
H 4.476242 -2.309490 -0.639208
H -1.446978 -0.309393 -1.438837
H -1.472786 1.341893 -0.784871
H 4.792981 0.073107 1.566061
H 4.045354 1.679840 1.730952
H -2.755470 -1.126553 0.571943
H -2.779510 0.523530 1.227140
H -4.031764 -0.334866 -1.471124
H -4.055603 1.315938 -0.816267
H -5.360921 0.498227 1.198170
H -5.337453 -1.152630 0.544053
H 6.323799 0.989751 -0.261660
H 5.630545 2.617241 -0.014441
H 6.560936 1.842617 1.299611
H -6.635445 1.287472 -0.845490
H -6.615395 -0.363948 -1.494969
H -7.974762 0.486051 1.167740
H -7.954243 -1.176211 0.515668
H -8.825276 0.115702 -0.360024


