%chk=000295044.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295044

0 1
O 3.670098 -2.176717 0.653147
N 2.236223 -1.938641 -1.150247
N 3.788409 -0.218304 -0.613823
C -4.447218 -0.828032 0.352614
C -3.248174 -1.156630 -0.547239
C -5.592649 -0.194263 -0.448334
C -2.104294 -1.791610 0.254743
C -6.790998 0.134953 0.452163
C -0.903341 -2.119279 -0.643325
C -7.937130 0.768305 -0.348177
C 0.234892 -2.758838 0.160023
C -9.134930 1.097535 0.552654
C -10.282552 1.731044 -0.246465
C 1.447630 -3.121378 -0.708638
C -11.477430 2.060810 0.645507
C 3.263732 -1.491453 -0.268938
C 4.916201 0.406941 0.013560
C 5.478585 1.556956 -0.600928
C 6.548967 2.209692 0.043533
C 5.429402 -0.078621 1.227383
C 4.967549 2.096016 -1.901436
C 7.050859 1.719235 1.258675
C 6.493371 0.580582 1.840082
C 7.168784 3.433031 -0.556475
H -4.132703 -0.144149 1.164590
H -4.804030 -1.747620 0.855536
H -3.564217 -1.839968 -1.359017
H -2.892224 -0.236242 -1.048807
H -5.236798 0.725419 -0.951411
H -5.908730 -0.878400 -1.259314
H -1.791190 -1.109483 1.069072
H -2.462358 -2.711802 0.756068
H -7.147367 -0.784302 0.955846
H -6.475788 0.819380 1.263292
H -1.218939 -2.800800 -1.457458
H -0.549112 -1.196845 -1.140875
H -8.253119 0.083794 -1.158843
H -7.581290 1.687738 -0.851729
H -0.130906 -3.677220 0.662508
H 0.549765 -2.087210 0.984385
H -8.820883 1.782060 1.363889
H -9.492100 0.179268 1.057156
H -9.927242 2.651326 -0.750032
H -10.599502 1.046100 -1.057119
H 1.134404 -3.663375 -1.628853
H 2.124265 -3.808442 -0.142149
H -12.291024 2.512190 0.066875
H -11.206743 2.767989 1.437770
H -11.878519 1.163826 1.130904
H 1.680056 -1.239261 -1.640828
H 3.492376 0.213043 -1.497793
H 5.003400 -0.975248 1.690568
H 4.233617 1.446070 -2.395731
H 4.487846 3.075190 -1.755715
H 5.789334 2.234895 -2.620225
H 7.878174 2.226316 1.748638
H 6.889543 0.200158 2.781466
H 7.617261 3.212826 -1.535681
H 6.424243 4.227615 -0.704911
H 7.964415 3.852928 0.072867


%chk=000295044-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295044

0 1
O 3.658418 -2.242005 0.896696
N 2.312782 -2.051126 -0.999938
N 3.927214 -0.405776 -0.583490
C -4.427951 -0.914343 0.320917
C -3.168181 -1.178271 -0.534059
C -5.532300 -0.140821 -0.434506
C -2.077669 -1.976547 0.215638
C -6.780511 0.144687 0.430469
C -0.801691 -2.212937 -0.623481
C -7.893988 0.901123 -0.329056
C 0.270294 -3.035190 0.125492
C -9.136696 1.198057 0.540103
C -10.253925 1.946088 -0.223028
C 1.562028 -3.280119 -0.690573
C -11.491380 2.240683 0.652180
C 3.327466 -1.603712 -0.147930
C 4.948989 0.353294 0.055862
C 5.380334 1.553605 -0.598864
C 6.395898 2.346911 0.007130
C 5.521800 -0.048017 1.290815
C 4.745936 1.954627 -1.923824
C 6.958400 1.936416 1.242739
C 6.522947 0.752103 1.873241
C 6.895399 3.631994 -0.639485
H -4.139582 -0.346442 1.230255
H -4.838690 -1.882220 0.677485
H -3.457887 -1.728316 -1.454122
H -2.746011 -0.208266 -0.871723
H -5.117750 0.819538 -0.807055
H -5.833831 -0.718166 -1.333746
H -1.804774 -1.440050 1.148084
H -2.493993 -2.955754 0.532213
H -7.187155 -0.814114 0.815290
H -6.480357 0.733936 1.322327
H -1.074660 -2.733067 -1.566747
H -0.378231 -1.228473 -0.914697
H -8.200872 0.306932 -1.215466
H -7.485561 1.855902 -0.722209
H -0.153000 -4.022439 0.403191
H 0.544588 -2.529724 1.071624
H -8.832595 1.798680 1.423061
H -9.542920 0.244778 0.938991
H -9.847008 2.897521 -0.622942
H -10.557935 1.344356 -1.104102
H 1.320508 -3.790095 -1.643722
H 2.243131 -3.929909 -0.114798
H -12.273907 2.774869 0.082151
H -11.221106 2.866911 1.523474
H -11.935296 1.303772 1.038851
H 1.996052 -1.475491 -1.780650
H 3.606023 -0.033713 -1.477892
H 5.177629 -0.969826 1.761938
H 4.910931 1.189574 -2.711213
H 3.651162 2.112541 -1.828827
H 5.166532 2.895448 -2.308089
H 7.739998 2.549882 1.705570
H 6.966803 0.444334 2.826715
H 7.325759 3.453288 -1.643492
H 6.087362 4.379243 -0.758079
H 7.682930 4.092934 -0.019695


