%chk=000190658.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190658

0 1
O 1.697845 0.426685 1.093165
O -0.668908 -1.787738 0.007197
O -0.160305 -2.943962 1.928566
N 0.988193 0.540815 -1.098760
N -0.377042 -4.007611 -0.152717
C -0.517802 -0.522574 0.723272
C -1.804130 0.235172 0.496033
C 0.676962 0.152777 0.119261
C -2.235832 0.528930 -0.800657
C 2.707963 1.037462 0.355651
C 2.284454 1.113971 -1.009537
C -2.568433 0.624491 1.606301
C -3.440720 1.223610 -0.998869
C -3.764177 1.317088 1.405884
C -4.201861 1.616779 0.112005
C 3.936926 1.513920 0.803955
C 3.127394 1.689960 -1.966532
C -3.895645 1.532509 -2.387738
C 4.755239 2.082336 -0.171571
C 4.359365 2.168218 -1.524982
C -0.386772 -2.948780 0.736823
C -0.399628 -5.390188 0.368016
H -0.324489 -0.734635 1.813820
H -1.629370 0.219210 -1.655795
H -2.238058 0.389953 2.616711
H -4.361082 1.625037 2.263528
H -5.135837 2.156861 -0.030137
H 4.231244 1.441398 1.846887
H 2.819765 1.754597 -3.008629
H -3.111836 2.051887 -2.959103
H -4.138784 0.611660 -2.937931
H -4.788138 2.170215 -2.412704
H 5.732317 2.473579 0.115183
H 5.043265 2.623625 -2.241185
H -0.665310 -3.860443 -1.117589
H 0.262775 -6.021535 -0.249821
H -1.416450 -5.817659 0.360547
H -0.022699 -5.422519 1.409951


%chk=000190658-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190658

0 1
O 1.982128 0.291926 0.924047
O -0.269353 -1.825409 0.009878
O -0.791240 -2.752939 2.130300
N 0.993244 0.924773 -1.072990
N -0.524906 -4.072512 0.199093
C -0.356474 -0.447473 0.634368
C -1.734454 0.146922 0.396039
C 0.815708 0.298665 0.078215
C -2.094539 0.774235 -0.820954
C 2.945221 0.996696 0.172403
C 2.336386 1.386468 -1.054871
C -2.697923 0.014647 1.429518
C -3.405325 1.274086 -1.024053
C -4.003664 0.511859 1.239164
C -4.354172 1.138597 0.021137
C 4.269642 1.296585 0.513852
C 3.075867 2.114699 -2.009867
C -3.778619 1.938730 -2.338735
C 5.000666 2.026770 -0.453102
C 4.415356 2.427125 -1.689366
C -0.556384 -2.892847 0.901747
C -0.769256 -5.367646 0.838637
H -0.194469 -0.589885 1.718248
H -1.338697 0.885598 -1.605703
H -2.424017 -0.490030 2.362905
H -4.747414 0.413304 2.037702
H -5.370630 1.526419 -0.119762
H 4.711272 0.986311 1.464194
H 2.622484 2.420555 -2.956805
H -3.059877 2.735787 -2.603869
H -3.773121 1.208802 -3.170637
H -4.785459 2.388787 -2.294239
H 6.042977 2.290617 -0.244944
H 5.022085 2.991113 -2.405617
H -0.328768 -4.014887 -0.800499
H 0.105137 -6.036683 0.736722
H -1.656149 -5.867243 0.406788
H -0.952861 -5.187422 1.909554


