%chk=000240872.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240872

0 1
O 6.181623 0.777090 -0.299111
O -1.995382 1.691644 -1.165555
N -0.064512 0.010886 -0.092218
N -1.413545 -0.221883 0.037283
N -6.414114 -0.526329 -0.048931
C 2.237354 -0.380051 0.282779
C 0.816738 -0.742363 0.510030
C 3.172389 -1.370716 -0.044718
C 2.647975 0.966602 0.381750
C 4.903581 0.295744 -0.133971
C 4.515541 -1.044812 -0.253293
C 3.977132 1.312703 0.182591
C 0.540171 -1.922163 1.395855
C -3.741104 0.241532 -0.375146
C -2.312527 0.690757 -0.575092
C -4.482454 0.735478 0.701704
C -4.332868 -0.632332 -1.291410
C -5.821425 0.325377 0.826924
C -5.677676 -0.990073 -1.091274
C 7.222163 -0.165116 -0.654736
H 2.855484 -2.408797 -0.147068
H 1.909021 1.739926 0.608165
H 5.227163 -1.821963 -0.507679
H 4.316863 2.343850 0.255003
H -0.219921 -1.697251 2.156302
H 0.201565 -2.791463 0.815900
H 1.437115 -2.236177 1.951009
H -1.771876 -1.041381 0.538272
H -4.043584 1.429789 1.416592
H -3.775891 -1.015292 -2.145199
H -6.450902 0.684927 1.650491
H -6.193789 -1.668586 -1.781914
H 7.001371 -0.628952 -1.620337
H 7.349624 -0.907770 0.137648
H 8.101098 0.489462 -0.725647


%chk=000240872-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240872

0 1
O 6.280480 0.900028 -0.235845
O -2.083540 2.064347 0.040487
N -0.046131 0.131796 0.022483
N -1.392941 -0.185182 0.091737
N -6.533342 -0.456063 0.073218
C 2.262757 -0.456376 0.053623
C 0.836606 -0.853027 0.152574
C 3.320103 -1.402382 0.006629
C 2.609150 0.931624 -0.006953
C 4.985394 0.378374 -0.143344
C 4.670809 -1.001065 -0.092128
C 3.942211 1.343305 -0.101165
C 0.425307 -2.300345 0.389635
C -3.783856 0.331947 0.049789
C -2.358039 0.834457 0.050364
C -4.791553 1.205031 0.529795
C -4.186748 -0.937582 -0.441153
C -6.134350 0.771814 0.528307
C -5.557522 -1.281368 -0.408514
C 7.395938 -0.050052 -0.279181
H 3.110602 -2.476829 0.032212
H 1.800073 1.666865 0.022671
H 5.454950 -1.762922 -0.129753
H 4.208821 2.403679 -0.142067
H -0.275999 -2.379358 1.244487
H -0.074307 -2.731175 -0.501448
H 1.284015 -2.941615 0.628252
H -1.710461 -1.154417 0.222596
H -4.511956 2.201542 0.884033
H -3.473500 -1.641417 -0.885431
H -6.933167 1.422056 0.901163
H -5.899068 -2.250927 -0.788426
H 7.330235 -0.705422 -1.169228
H 7.431200 -0.669331 0.638024
H 8.300229 0.572286 -0.342444


