%chk=000111170.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111170

0 1
 Br   5.823700       1.992000     -0.3554000    
 O    2.145700      0.2873000      0.5041000    
 O    4.190700     -0.6756000     -0.1345000    
 O  -0.4624000     -0.7596000     -1.1700000E-02
 C    1.908300     -0.8866000     -0.2780000    
 C    3.178700      -1.681300     -9.5899999E-02
 C    3.567400      0.4720000      0.4578000    
 C   0.6617000      -1.601100      0.1979000    
 C    3.902400       1.705100     -0.3592000    
 C   -1.667500      -1.379500      0.4179000    
 C   -2.814500     -0.4441000      0.1711000    
 C   -3.191300      0.4590000       1.159000    
 C   -3.490000     -0.4882000      -1.043500    
 C   -4.257400       1.328700      0.9296000    
 C   -4.555900      0.3817000      -1.272800    
 C   -4.939600       1.290200     -0.2863000    
 H    1.793700     -0.5545000      -1.317500    
 H    3.228200      -2.175300      0.8811000    
 H    3.342900      -2.420800     -0.8839000    
 H    3.927900      0.5693000       1.488300    
 H   0.7393000      -1.822400       1.269200    
 H   0.5302000      -2.538200     -0.3550000    
 H    3.426800       2.604100      4.1800000E-02
 H    3.611100       1.588900      -1.407400    
 H   -1.604300      -1.625400       1.485400    
 H   -1.822300      -2.318800     -0.1278000    
 H   -2.665300      0.4992000       2.108900    
 H   -3.198000      -1.190200      -1.819700    
 H   -4.555700       2.036600       1.697400    
 H   -5.087000      0.3522000      -2.219800    
 H   -5.769400       1.967700     -0.4651000    


%chk=000111170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000111170

0 1
Br 6.092792 1.515926 1.746886
O 2.250260 0.518875 0.264504
O 4.265357 -0.461701 -0.427384
O -0.498841 -0.679091 -0.344068
C 1.884920 -0.574438 -0.686268
C 3.201574 -1.387432 -0.856346
C 3.659504 0.292867 0.665532
C 0.738942 -1.421555 -0.139651
C 4.313193 1.657834 0.805042
C -1.665252 -1.370719 0.212611
C -2.896133 -0.499603 0.036642
C -2.779116 0.898093 -0.156010
C -4.184948 -1.086048 0.098096
C -3.938469 1.697060 -0.282011
C -5.343140 -0.286035 -0.021194
C -5.223105 1.110375 -0.212077
H 1.563569 -0.086641 -1.622575
H 3.200506 -2.295036 -0.215581
H 3.416599 -1.665371 -1.898282
H 3.686009 -0.297495 1.607274
H 0.907974 -1.633323 0.939764
H 0.697729 -2.393209 -0.687835
H 3.695256 2.318048 1.429398
H 4.509576 2.099659 -0.181405
H -1.487933 -1.575864 1.294010
H -1.808307 -2.351481 -0.294731
H -1.780603 1.340479 -0.216716
H -4.286892 -2.170488 0.235882
H -3.838195 2.777665 -0.435383
H -6.334399 -0.750868 0.027420
H -6.120328 1.731917 -0.309541


