%chk=000244438.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244438

0 1
O 3.155769 0.064831 -0.000386
O -3.114686 1.812952 0.000673
N -2.420838 -0.394082 -0.000371
C -0.159967 -1.378566 -0.000396
C -0.994011 -0.222923 -0.000257
C 1.223296 -1.217504 -0.000445
C 1.776828 0.078579 -0.000292
C -0.418052 1.056515 -0.000075
C 0.969565 1.218506 -0.000099
C -0.731252 -2.761083 -0.000590
C 3.839914 1.340858 -0.000356
C -3.382774 0.626181 0.000131
H 1.894193 -2.074503 -0.000626
H -1.058801 1.949005 0.000045
H 1.389980 2.218764 0.000023
H 0.054026 -3.532238 0.000190
H -1.344705 -2.947161 0.892130
H -1.343240 -2.947430 -0.894267
H -2.746271 -1.360300 -0.000866
H 3.596649 1.902704 0.905986
H 3.596413 1.902887 -0.906520
H 4.892823 1.030766 -0.000525
H -4.417160 0.239540 -0.000108


%chk=000244438-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244438

0 1
O 3.229165 0.054383 -0.000369
O -3.246323 1.837970 0.000715
N -2.412755 -0.379202 -0.000425
C -0.176087 -1.383486 -0.000460
C -0.994296 -0.206741 -0.000349
C 1.222481 -1.231272 -0.000472
C 1.824335 0.051835 -0.000349
C -0.395138 1.075745 -0.000199
C 1.010398 1.208512 -0.000192
C -0.794162 -2.772795 -0.000604
C 3.894057 1.359331 -0.000273
C -3.410144 0.587370 -0.000130
H 1.876495 -2.109540 -0.000555
H -1.033926 1.961131 -0.000076
H 1.445106 2.212367 -0.000064
H -0.009868 -3.547064 -0.000187
H -1.423265 -2.949744 0.895409
H -1.422477 -2.949882 -0.897147
H -2.745466 -1.346403 -0.000705
H 3.635094 1.943412 0.904726
H 3.635004 1.943592 -0.905130
H 4.970374 1.132607 -0.000347
H -4.420904 0.114172 0.000182


