%chk=000257931.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257931

0 1
Br -3.416230 -4.315835 0.839681
Br -3.489343 4.236076 0.723612
O 1.008793 -0.043130 -2.279982
C 0.705825 -0.026877 -0.880041
C -0.180880 -1.223079 -0.507708
C -0.201234 1.163618 -0.539970
C -1.435376 -0.769970 -0.001455
C -1.447970 0.703039 -0.021417
C 2.028966 -0.005871 -0.147579
C 0.100137 -2.571271 -0.611375
C 0.056780 2.513121 -0.680159
C -2.405259 -1.673873 0.403727
C -2.433276 1.600907 0.359239
C 2.038941 0.013487 1.255523
C 3.235795 -0.005809 -0.857985
C -0.881421 -3.498654 -0.204534
C -0.940598 3.434304 -0.298436
C -2.099171 -3.042219 0.290209
C -2.150536 2.970715 0.208681
C 3.255508 0.032649 1.940905
C 4.450584 0.013429 -0.165938
C 4.462148 0.032635 1.231735
H 1.059910 -2.916755 -0.998014
H 1.010621 2.864320 -1.076215
H -3.365725 -1.339228 0.794372
H -3.388054 1.260628 0.758859
H 0.180824 -0.058124 -2.809433
H 1.099816 0.013537 1.808588
H 3.220046 -0.020746 -1.950914
H -0.672701 -4.567263 -0.280949
H -0.750129 4.503860 -0.403819
H 3.264205 0.047644 3.029576
H 5.388235 0.013317 -0.719329
H 5.408769 0.047516 1.769147


%chk=000257931-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257931

0 1
Br -3.463796 -4.385351 0.862265
Br -3.538830 4.304061 0.747767
O 1.023985 -0.044060 -2.350235
C 0.700771 -0.026980 -0.904895
C -0.191136 -1.221031 -0.513477
C -0.211858 1.161512 -0.545398
C -1.441596 -0.774251 -0.000597
C -1.454405 0.706883 -0.020258
C 2.044432 -0.005238 -0.158677
C 0.092800 -2.590020 -0.621825
C 0.048285 2.531916 -0.689850
C -2.425249 -1.695846 0.413855
C -2.453879 1.621889 0.370265
C 2.056256 0.017936 1.259222
C 3.270408 -0.008845 -0.863646
C -0.885762 -3.532302 -0.214513
C -0.946424 3.467506 -0.306957
C -2.120169 -3.069369 0.295039
C -2.172644 2.996909 0.215163
C 3.278939 0.036813 1.962150
C 4.495520 0.010254 -0.156501
C 4.505569 0.032993 1.255782
H 1.056574 -2.932847 -1.011263
H 1.005894 2.881231 -1.088619
H -3.390132 -1.370705 0.812913
H -3.412938 1.290713 0.778357
H 0.170857 -0.058177 -2.854859
H 1.110064 0.021370 1.813974
H 3.251730 -0.026420 -1.956083
H -0.689543 -4.605364 -0.288970
H -0.768795 4.541474 -0.409741
H 3.276870 0.054466 3.057738
H 5.440686 0.007313 -0.711274
H 5.455516 0.047663 1.801752


