%chk=000278290.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278290

0 1
Br -1.535820 3.390202 -0.125091
O -3.986683 -2.095968 0.270897
O -5.428726 -0.214636 0.410720
O -0.167646 1.084321 -2.580607
O 1.317374 2.385158 -1.528059
O 3.199077 -3.322687 0.450001
O 1.266409 -2.362490 0.529147
N 2.488716 -2.331907 0.481426
C -1.390338 0.531426 -0.089817
C -3.249681 -0.928286 0.160458
C -4.119841 0.205333 0.245035
C -1.891734 -0.798081 -0.003629
C 0.067354 0.706053 -0.267058
C -2.252688 1.626658 -0.005942
C -3.649652 1.496210 0.166266
C 0.938539 0.159591 0.596229
C 2.406921 0.188209 0.493441
C -5.385245 -1.682291 0.425939
C 3.152378 -1.011182 0.465573
C 3.096946 1.408851 0.458601
C 0.498617 1.496618 -1.455851
C 4.556584 -0.983459 0.408642
C 4.492609 1.434352 0.405236
C 5.223316 0.240154 0.383854
H -1.221997 -1.658775 -0.073968
H -4.308997 2.360910 0.230507
H 0.560899 -0.402618 1.469463
H -5.943519 -2.044603 -0.447718
H -5.729180 -2.018621 1.413108
H 2.528976 2.347812 0.443309
H 5.114161 -1.927467 0.382539
H 5.014233 2.393824 0.373598
H 6.312882 0.265466 0.341898
H 0.082558 1.618121 -3.386049


%chk=000278290-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278290

0 1
Br -1.677182 3.537884 -0.102398
O -3.951645 -2.135846 0.325593
O -5.463506 -0.274657 0.517949
O -0.512276 1.436036 -2.647446
O 1.564869 2.113010 -1.876491
O 3.264375 -3.412901 0.603808
O 1.264811 -2.409426 0.201211
N 2.540738 -2.358947 0.429537
C -1.401754 0.608296 -0.166036
C -3.254402 -0.912371 0.184776
C -4.144002 0.176581 0.296770
C -1.892670 -0.731590 -0.043716
C 0.059630 0.808228 -0.414789
C -2.319534 1.682842 -0.037028
C -3.706247 1.498219 0.194953
C 0.960162 0.187412 0.416130
C 2.442484 0.172986 0.382638
C -5.376541 -1.764285 0.533629
C 3.203094 -1.032748 0.482441
C 3.177710 1.389657 0.397100
C 0.477869 1.523515 -1.659974
C 4.613040 -1.036256 0.589017
C 4.583006 1.400050 0.506540
C 5.305963 0.187155 0.604509
H -1.209513 -1.577551 -0.155212
H -4.391758 2.341115 0.297154
H 0.516608 -0.387566 1.239143
H -5.979464 -2.165147 -0.298847
H -5.704379 -2.129743 1.521453
H 2.628440 2.329557 0.324247
H 5.132937 -1.995539 0.648987
H 5.113636 2.357626 0.513115
H 6.397318 0.195587 0.685606
H -0.205013 1.935013 -3.452272


