%chk=000209288.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209288

0 1
O -3.282783 -0.282116 0.301916
O 3.028435 -1.128703 -1.023674
N 5.684706 -0.132783 -0.953074
N 2.121597 0.958468 -0.641007
N -2.501776 2.261707 0.463602
C 6.121843 -0.260234 0.475457
C -0.183499 1.642077 -0.086072
C 0.753405 0.590672 -0.409551
C -1.547683 1.306708 0.149015
C -5.272936 -1.463248 0.553143
C -1.954577 -0.084371 0.056227
C -3.793505 -1.654763 0.229067
C 4.528159 0.764803 -1.163728
C -6.020494 -2.800886 0.532793
C 0.322388 -0.719874 -0.487643
C -1.032130 -1.061366 -0.254760
C 3.175536 0.075726 -0.935640
C 5.040967 -0.821169 1.410213
C 7.368838 -1.155189 0.485179
C 0.171356 3.024540 0.016482
C -7.500736 -2.615404 0.856353
C -0.778289 3.964015 0.328228
C -2.126582 3.533628 0.547916
H 6.409002 0.766822 0.824241
H -5.375854 -0.968723 1.541130
H -5.721800 -0.749394 -0.168136
H -3.264639 -2.268615 0.976536
H -3.622063 -2.042112 -0.788697
H 4.643030 1.681497 -0.547269
H 4.567561 1.099207 -2.231492
H 5.474393 -1.060542 -1.350904
H -5.565063 -3.501166 1.260990
H -5.913698 -3.280121 -0.460701
H 1.023345 -1.529448 -0.732890
H 2.318832 1.959884 -0.586961
H -1.310674 -2.109130 -0.330486
H 4.245031 -0.095396 1.601308
H 5.459185 -1.106346 2.380895
H 4.562300 -1.716583 0.989288
H 7.848692 -1.148560 1.469013
H 7.131085 -2.196708 0.241553
H 8.108793 -0.808903 -0.248681
H 1.205550 3.325402 -0.155618
H -7.645772 -2.176989 1.850851
H -7.993012 -1.953333 0.134111
H -8.033261 -3.573136 0.839225
H -0.534752 5.020414 0.412160
H -2.903752 4.266646 0.798394


%chk=000209288-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209288

0 1
O -3.396400 -0.156478 0.317337
O 3.026945 -1.238961 -1.126526
N 5.698306 -0.146761 -0.946957
N 2.130775 0.870930 -0.582361
N -2.475364 2.385962 0.470427
C 6.196567 -0.259050 0.452379
C -0.151335 1.669170 -0.069855
C 0.749376 0.578991 -0.375759
C -1.560346 1.393699 0.165863
C -5.417669 -1.461671 0.546232
C -2.038900 0.028519 0.079542
C -3.919908 -1.536386 0.245278
C 4.532131 0.705909 -1.183701
C -6.084040 -2.856652 0.516186
C 0.244880 -0.725917 -0.452343
C -1.132555 -0.996293 -0.229770
C 3.162474 0.008584 -0.945429
C 5.175909 -0.829719 1.476960
C 7.485778 -1.106296 0.430606
C 0.250386 3.043789 0.017976
C -7.597027 -2.790919 0.816040
C -0.681741 4.036866 0.324258
C -2.040496 3.657062 0.546578
H 6.466399 0.769998 0.771393
H -5.560183 -0.994183 1.539120
H -5.899890 -0.794693 -0.193391
H -3.393441 -2.171191 0.989212
H -3.734836 -1.950186 -0.768582
H 4.624865 1.622416 -0.567618
H 4.533880 1.031626 -2.245567
H 5.562348 -1.073826 -1.376743
H -5.589988 -3.519897 1.255514
H -5.925605 -3.322916 -0.477977
H 0.930479 -1.541840 -0.687386
H 2.407945 1.845026 -0.452362
H -1.468280 -2.033883 -0.303399
H 4.264853 -0.206129 1.540644
H 5.625335 -0.869245 2.487327
H 4.864697 -1.850676 1.189899
H 7.942463 -1.155711 1.435223
H 7.264239 -2.143171 0.110209
H 8.216815 -0.675347 -0.274799
H 1.289285 3.346791 -0.159704
H -7.784251 -2.360619 1.817602
H -8.119759 -2.156776 0.075834
H -8.057572 -3.795215 0.787307
H -0.387212 5.088607 0.392054
H -2.795635 4.413570 0.791531


