%chk=000222045.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222045

0 1
O 0.258874 1.800845 -0.162138
O 1.420042 1.115750 -1.976369
N -3.966215 0.897619 -0.280169
C 1.906985 0.189676 0.269114
C 3.425249 0.158163 -0.007028
C 1.260437 -1.223591 0.284667
C 4.059490 1.581918 -0.006786
C -0.119353 -1.165749 0.973746
C -0.909759 -2.457725 0.743745
C 4.188036 -0.588348 1.069769
C 5.225845 1.536355 1.009549
C 1.188418 -1.819484 -1.097569
C 1.221611 1.035548 -0.788284
C -1.111874 -2.726413 -0.754671
C 5.163230 0.153640 1.607614
C 0.139074 -2.510555 -1.550450
C -4.906571 1.014185 0.885332
C -3.960228 -0.562351 -0.624268
C -4.931943 -0.341845 1.626159
C -4.326355 -1.362465 0.646756
C -2.600945 1.420642 0.042410
C -1.906200 1.835101 -1.265738
C -0.627526 2.616368 -0.989802
H 1.740309 0.661742 1.274033
H 3.603670 -0.328953 -0.996988
H 1.923006 -1.893516 0.896411
H 3.329059 2.357053 0.274552
H 4.415052 1.844992 -1.015919
H -0.707636 -0.295031 0.590343
H 0.008759 -0.985068 2.056350
H -0.383334 -3.311974 1.209694
H -1.901550 -2.385613 1.245304
H 3.927717 -1.605072 1.310954
H 5.121549 2.315202 1.784666
H 6.198436 1.712158 0.516509
H 2.070822 -1.653823 -1.717071
H -1.493928 -3.754350 -0.906364
H -1.902815 -2.040678 -1.153009
H 5.860512 -0.136292 2.375863
H -4.640644 1.851428 1.554022
H -5.906290 1.246607 0.459258
H -4.726548 -0.705275 -1.414996
H -2.986767 -0.891733 -1.051825
H 0.130687 -2.941627 -2.551207
H -5.958958 -0.617349 1.913699
H -4.348324 -0.294476 2.559802
H -3.425914 -1.844566 1.081639
H -5.034723 -2.172962 0.416323
H -2.694929 2.304202 0.709289
H -1.953257 0.684899 0.584036
H -2.596677 2.448459 -1.881854
H -1.681080 0.940057 -1.879740
H -0.101746 2.900075 -1.920252
H -0.784279 3.501602 -0.348912


%chk=000222045-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222045

0 1
O 0.175310 1.762440 0.200950
O 1.316078 1.216598 -1.761100
N -4.204149 1.173855 -0.372064
C 1.921007 0.095919 0.365175
C 3.435422 0.181884 -0.000486
C 1.343909 -1.366759 0.276128
C 4.007892 1.639184 0.089170
C 0.017772 -1.523691 1.063789
C -0.571530 -2.938885 0.864970
C 4.357707 -0.592766 0.938491
C 5.463291 1.502679 0.636842
C 1.186502 -1.870037 -1.153447
C 1.136478 1.050434 -0.531536
C -0.912272 -3.198041 -0.623001
C 5.458981 0.124173 1.282646
C 0.173023 -2.683366 -1.551975
C -5.286986 1.142997 0.653942
C -4.120514 -0.252893 -0.807598
C -5.099298 -0.183383 1.468879
C -4.355466 -1.134214 0.473967
C -2.911246 1.718326 0.132590
C -1.978542 2.115915 -1.029306
C -0.658952 2.744470 -0.566437
H 1.790689 0.435620 1.410493
H 3.551268 -0.196404 -1.038038
H 2.100569 -2.004527 0.782973
H 3.399648 2.221701 0.808847
H 3.961961 2.159540 -0.881732
H -0.711612 -0.764831 0.718137
H 0.197499 -1.327234 2.138904
H 0.169753 -3.689707 1.205411
H -1.474079 -3.073471 1.491792
H 4.170383 -1.627542 1.245706
H 5.725859 2.309187 1.347417
H 6.214349 1.543985 -0.179110
H 1.931662 -1.543009 -1.890090
H -1.070741 -4.281682 -0.795422
H -1.877467 -2.711472 -0.882844
H 6.277737 -0.243551 1.911097
H -5.259655 2.051760 1.279093
H -6.261803 1.121879 0.128777
H -4.923555 -0.441476 -1.545296
H -3.156611 -0.457649 -1.303498
H 0.116159 -2.989826 -2.606124
H -6.067130 -0.597793 1.802028
H -4.486970 -0.002605 2.370485
H -3.396061 -1.477234 0.900810
H -4.950545 -2.033429 0.235113
H -3.142287 2.625115 0.724816
H -2.374668 1.015351 0.814729
H -2.511691 2.850873 -1.663666
H -1.754833 1.245905 -1.674610
H -0.067876 3.099394 -1.428709
H -0.823867 3.565692 0.152121


