%chk=000296861.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296861

0 1
Br -4.894492 -0.442885 0.000074
O 0.290851 -1.657516 -0.000051
C -0.322509 0.613262 0.000051
C 1.128926 0.541158 0.000051
C -0.778023 -0.743165 -0.000069
C 1.450156 -0.850548 0.000003
C -1.262907 1.637980 0.000057
C 2.167210 1.468499 0.000012
C -2.117944 -1.107441 -0.000025
C 2.747002 -1.344688 -0.000034
C -2.623647 1.301000 -0.000140
C 3.483640 0.990529 0.000103
C -3.023776 -0.041601 -0.000078
C 3.766876 -0.385011 -0.000015
H -0.950067 2.680953 0.000167
H 1.958535 2.536311 -0.000035
H -2.430012 -2.150519 -0.000146
H 2.953396 -2.411083 0.000021
H -3.371769 2.095586 -0.000114
H 4.308914 1.701601 0.000189
H 4.806240 -0.715922 -0.000023


%chk=000296861-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296861

0 1
Br -4.976906 -0.450881 -0.000072
O 0.290570 -1.665748 -0.000035
C -0.323120 0.601001 0.000012
C 1.136277 0.527794 0.000022
C -0.787065 -0.749168 -0.000035
C 1.462826 -0.861725 -0.000001
C -1.276849 1.643632 0.000023
C 2.186630 1.474541 0.000045
C -2.139442 -1.112121 -0.000061
C 2.772634 -1.354495 -0.000002
C -2.652020 1.318527 -0.000013
C 3.519122 1.004155 0.000052
C -3.058562 -0.040167 -0.000050
C 3.807830 -0.388503 0.000024
H -0.968852 2.694062 0.000056
H 1.977430 2.549635 0.000060
H -2.455759 -2.157427 -0.000109
H 2.979624 -2.427970 -0.000012
H -3.404242 2.111955 -0.000010
H 4.345733 1.722494 0.000078
H 4.850740 -0.723094 0.000025


