%chk=000276271.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276271

0 1
O 2.305868 2.799340 0.044273
N 0.170359 2.072094 0.025545
N -3.780241 -1.982396 -0.078191
N -4.503176 0.744322 0.041493
C -0.387024 -0.305633 0.002068
C 1.033703 -0.631829 -0.000785
C -0.798487 1.050245 0.010357
C 1.985954 0.410873 0.013559
C -1.392237 -1.300071 0.001469
C -2.165145 1.402366 -0.005123
C 1.575614 1.824117 0.029333
C -2.740117 -0.980434 -0.002139
C -3.143990 0.403582 -0.016220
C 1.501687 -1.967369 -0.017337
C 3.366899 0.121705 0.012556
C 2.862389 -2.239959 -0.018549
C 3.804612 -1.194495 -0.003212
H -1.082791 -2.348803 -0.000440
H -0.134438 3.049262 0.036583
H -2.454053 2.449647 -0.003993
H 0.783791 -2.786332 -0.030234
H 4.078311 0.953631 0.024314
H 3.210974 -3.273429 -0.031672
H 4.868252 -1.422762 -0.004094
H -3.409951 -2.893303 -0.335300
H -4.257232 -2.079912 0.817703
H -4.753388 1.685842 -0.222871
H -5.163842 0.049702 -0.290493


%chk=000276271-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276271

0 1
O 2.369308 2.838898 0.071527
N 0.191320 2.037002 0.049902
N -3.809663 -1.966338 0.011531
N -4.526222 0.694953 -0.065042
C -0.383059 -0.339765 0.001826
C 1.051733 -0.649829 -0.008957
C -0.789202 1.029601 0.028314
C 2.008307 0.419853 0.016613
C -1.409877 -1.327297 0.016700
C -2.160083 1.386549 0.014540
C 1.580112 1.839936 0.048269
C -2.773186 -0.994489 0.019345
C -3.159857 0.393163 -0.017200
C 1.556869 -1.984535 -0.046111
C 3.401469 0.150879 0.009490
C 2.937742 -2.240738 -0.052847
C 3.872921 -1.170870 -0.023972
H -1.137737 -2.388107 0.048891
H -0.102394 3.018013 0.069695
H -2.445626 2.445977 -0.005365
H 0.863764 -2.831277 -0.073780
H 4.082097 1.008521 0.030213
H 3.295561 -3.276343 -0.082315
H 4.948254 -1.377579 -0.029663
H -3.531069 -2.938789 -0.118416
H -4.578926 -1.829511 0.671768
H -4.822312 1.667124 -0.115600
H -5.147945 -0.004998 -0.470753


