%chk=000226146.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226146

0 1
O 0.149957 -0.979239 -0.857655
O -0.629800 2.300758 1.771076
O -1.864602 2.443995 -0.093379
N 1.289429 0.321150 0.673894
C -1.158295 0.234907 0.800169
C -2.374219 -0.471378 0.246137
C 0.134478 -0.223547 0.084587
C -2.800238 -0.236846 -1.069075
C -3.072890 -1.373374 1.062024
C -1.310059 1.736443 0.702051
C 2.640537 0.066767 0.262045
C -3.925018 -0.902604 -1.563365
C -4.196588 -2.035239 0.559870
C -4.624049 -1.801052 -0.751208
C 3.661712 0.729216 0.976015
C 2.957718 -0.799821 -0.796450
C 4.992851 0.513933 0.619393
C 4.297672 -0.999205 -1.135072
C 5.316936 -0.348064 -0.433925
H -1.051494 -0.034947 1.893027
H -2.254274 0.464170 -1.703274
H -2.745887 -1.566982 2.081619
H 1.181077 0.980560 1.457034
H -4.253923 -0.720895 -2.585958
H -4.738580 -2.737048 1.191838
H -5.498985 -2.319654 -1.139734
H 3.424394 1.401474 1.796245
H 2.168512 -1.314846 -1.353565
H 5.785316 1.023079 1.167639
H 4.546212 -1.671499 -1.956947
H 6.357183 -0.510235 -0.705807
H -0.686985 3.293922 1.785953


%chk=000226146-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226146

0 1
O 0.123753 -0.985166 -1.012302
O -0.441159 2.263484 1.776327
O -1.930144 2.460683 -0.000776
N 1.297056 0.264520 0.597185
C -1.167366 0.200569 0.764538
C -2.413441 -0.484375 0.232615
C 0.150069 -0.237428 -0.000070
C -2.844195 -0.303880 -1.104683
C -3.157886 -1.328481 1.091831
C -1.271446 1.725803 0.753870
C 2.656990 0.049608 0.225623
C -4.005599 -0.956413 -1.569319
C -4.320958 -1.983163 0.627212
C -4.748010 -1.796762 -0.706743
C 3.649624 0.706217 1.002979
C 3.044822 -0.778035 -0.861503
C 5.015118 0.540130 0.697795
C 4.417554 -0.933586 -1.153063
C 5.408696 -0.281952 -0.384207
H -1.012114 -0.088412 1.821145
H -2.272899 0.340385 -1.778749
H -2.828562 -1.478137 2.128072
H 1.142044 0.910356 1.381245
H -4.330733 -0.811596 -2.605390
H -4.887637 -2.634031 1.302225
H -5.649080 -2.302513 -1.071741
H 3.351075 1.343061 1.845864
H 2.280315 -1.280701 -1.456282
H 5.770361 1.051463 1.304715
H 4.711309 -1.573136 -1.992889
H 6.469708 -0.411865 -0.622033
H -0.489168 3.257255 1.751711


