%chk=000206369.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206369

0 1
O 0.473404 -2.703424 -0.020922
O 2.536628 1.423973 0.043708
N 0.231695 1.395472 0.009094
N 1.515327 -0.662038 0.012003
C -0.933079 0.638460 -0.014563
C -2.333886 1.187873 -0.031195
C -3.227060 -0.080744 -0.054737
C -2.281893 -1.313131 -0.051015
C -0.897912 -0.730514 -0.025257
C 0.323660 -1.500298 -0.013069
C 1.523240 0.749706 0.023399
C 0.188497 2.876333 0.020667
C 2.851870 -1.316871 0.028293
H -2.538785 1.812594 0.857574
H -2.512154 1.826749 -0.915620
H -3.872072 -0.086520 -0.948524
H -3.897924 -0.101062 0.819623
H -2.431313 -1.947377 -0.944268
H -2.457967 -1.962513 0.826344
H 1.222355 3.284709 0.039491
H -0.336162 3.246498 0.916735
H -0.309183 3.261322 -0.884508
H 2.726931 -2.416780 -0.001876
H 3.404664 -1.046436 0.943847
H 3.448620 -1.001683 -0.844421


%chk=000206369-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206369

0 1
O 0.456601 -2.754744 -0.020023
O 2.591932 1.440347 0.047547
N 0.239097 1.390877 0.009433
N 1.516618 -0.640385 0.011847
C -0.918868 0.624680 -0.014892
C -2.322386 1.193348 -0.032174
C -3.238419 -0.080591 -0.055390
C -2.297221 -1.338848 -0.051797
C -0.904803 -0.751806 -0.025926
C 0.341016 -1.491750 -0.012954
C 1.520582 0.766006 0.023913
C 0.194277 2.866667 0.021996
C 2.846532 -1.289561 0.027568
H -2.511197 1.826189 0.856779
H -2.483953 1.839006 -0.917309
H -3.880966 -0.075316 -0.952001
H -3.906328 -0.089234 0.822454
H -2.447913 -1.974352 -0.943742
H -2.474442 -1.989187 0.824422
H 1.233423 3.227427 0.039052
H -0.335201 3.233685 0.918652
H -0.311402 3.249580 -0.881658
H 2.676254 -2.375731 0.003690
H 3.398510 -1.003812 0.938358
H 3.435759 -0.968199 -0.847044


