%chk=000268534.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268534

0 1
S 3.435702 -0.453266 0.049627
N -3.891819 0.977954 -0.057051
N -1.865877 -2.748649 0.671678
C 0.646303 2.571937 0.450727
C 2.061446 2.003612 0.237713
C -0.393286 1.878143 -0.443708
C 2.013982 0.537048 0.060889
C 0.886543 -0.231472 -0.152334
C -0.433695 0.392189 -0.171875
C 1.202871 -1.630404 -0.360671
C -1.615681 -0.250985 0.050356
C 2.530928 -1.905163 -0.279397
C -2.874033 0.430701 -0.008150
C -1.739270 -1.634598 0.386614
H 0.353711 2.455291 1.514619
H 0.643359 3.660753 0.250324
H 2.713297 2.290337 1.091516
H 2.526702 2.472554 -0.660236
H -0.143521 2.035738 -1.517374
H -1.380091 2.365503 -0.301376
H 0.442362 -2.371285 -0.580894
H 3.024569 -2.856139 -0.391097


%chk=000268534-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268534

0 1
S 3.541587 -0.419713 -0.038709
N -3.932682 1.044304 -0.177664
N -2.014822 -2.887149 0.010697
C 0.738488 2.592174 0.530257
C 2.085330 2.065329 -0.016630
C -0.444884 1.917918 -0.197563
C 2.046793 0.561941 -0.043426
C 0.889440 -0.243524 -0.063550
C -0.427385 0.393606 -0.097721
C 1.210756 -1.668265 -0.069898
C -1.653091 -0.280276 -0.085432
C 2.559246 -1.932900 -0.063311
C -2.894338 0.449074 -0.134430
C -1.821756 -1.706235 -0.033440
H 0.673964 2.388022 1.615356
H 0.678180 3.686861 0.394307
H 2.928955 2.430173 0.597382
H 2.250236 2.456011 -1.042988
H -0.406135 2.189370 -1.274717
H -1.402346 2.312725 0.183016
H 0.469494 -2.465912 -0.083532
H 3.069475 -2.893733 -0.068102


