%chk=000244032.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244032

0 1
Br 3.722848 1.573631 -0.532622
O 0.866851 -1.540989 -0.589908
O 1.610610 0.777262 1.560426
O -0.835721 -2.763331 0.257300
C -0.391900 0.842580 0.271374
C -1.072362 -0.357866 0.026114
C -1.105513 2.043886 0.360784
C -2.469369 -0.351605 -0.124857
C 1.105807 0.893960 0.476342
C -2.494530 2.046601 0.201692
C -3.176200 0.849676 -0.042263
C -0.398078 -1.682631 -0.053932
C 1.853723 1.131530 -0.815442
C 1.687090 -2.739168 -0.680066
H -0.579791 2.977624 0.567032
H -2.997501 -1.294211 -0.297185
H -3.047299 2.984463 0.273800
H -4.260209 0.851826 -0.160930
H 1.812305 0.204750 -1.435660
H 1.398787 1.942842 -1.412797
H 1.465738 -3.224046 -1.634938
H 1.482782 -3.414642 0.159444
H 2.707933 -2.342242 -0.639907


%chk=000244032-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244032

0 1
Br 3.795030 0.836697 -0.968943
O 0.983531 -1.540321 -0.091994
O 1.687652 1.376427 1.366316
O -0.890569 -2.614559 -0.964030
C -0.392894 0.892705 0.227284
C -1.056505 -0.298101 -0.195051
C -1.170999 2.016994 0.602420
C -2.472999 -0.322289 -0.273755
C 1.115156 1.073919 0.294493
C -2.579762 1.983179 0.519891
C -3.233359 0.813118 0.067989
C -0.355548 -1.589472 -0.477437
C 1.807577 1.081602 -1.073201
C 1.774999 -2.781958 -0.272649
H -0.661140 2.917884 0.959869
H -2.953131 -1.253711 -0.590947
H -3.162550 2.864254 0.808765
H -4.325567 0.782197 -0.000585
H 1.424199 0.293171 -1.734143
H 1.652305 2.068733 -1.545483
H 1.699310 -3.135093 -1.314488
H 1.397449 -3.562261 0.408725
H 2.803815 -2.493213 -0.019246


