%chk=000104445.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104445

0 1
 Br  -8.723200      -1.503000     -3.5000000E-02
 Br   8.736100      -1.485100     -2.0999999E-03
 O   -3.663600     -0.2633000      4.4000000E-02
 O    3.667300     -0.2783000     -1.8500000E-02
 O   -5.063700       1.568500     -2.7400000E-02
 O    5.056800       1.562700     -1.2800000E-02
 C  -6.8000001E-03  0.6007000      1.7999999E-02
 C   -1.269100     -0.2587000      5.6800000E-02
 C    1.255800     -0.2661000      1.1600000E-02
 C   -2.530000      0.5930000      2.0300001E-02
 C    2.529100      0.5709000      6.3000000E-03
 C   -4.884700      0.3591000      1.5600000E-02
 C    4.885000      0.3516000     -2.5900001E-02
 C   -5.979600     -0.6870000      1.4800000E-02
 C    5.986700     -0.6873000     -2.1299999E-02
 C   -7.375900     -9.3500003E-02 -4.8000000E-02
 C    7.379800     -8.4100001E-02  3.5000001E-03
 H  -1.7999999E-02   1.234400     -0.8770000    
 H   9.8000001E-03   1.268300      0.8879000    
 H   -1.279300     -0.9561000     -0.7903000    
 H   -1.276500     -0.8829000      0.9591000    
 H    1.254400     -0.9281000     -0.8634000    
 H    1.264500     -0.9279000      0.8868000    
 H   -2.548700       1.196600     -0.8948000    
 H   -2.557300       1.259600      0.8904000    
 H    2.541900       1.218700     -0.8783000    
 H    2.563500       1.197800      0.9053000    
 H   -5.817100      -1.342600     -0.8489000    
 H   -5.870700      -1.285800      0.9268000    
 H    5.843800      -1.324500      0.8595000    
 H    5.865600      -1.307000     -0.9177000    
 H   -7.584800      0.5478000      0.8132000    
 H   -7.532500      0.4823000     -0.9647000    
 H    7.569300      0.5391000     -0.8752000    
 H    7.548800      0.5130000      0.9043000    


%chk=000104445-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104445

0 1
Br -8.869575 -1.564123 0.077296
Br 8.868394 -1.563328 -0.051770
O -3.711356 -0.278859 0.047386
O 3.709969 -0.278789 -0.033416
O -5.155096 1.548698 -0.076049
O 5.153410 1.550616 0.063264
C -0.000774 0.656480 0.000217
C -1.282742 -0.208874 0.016266
C 1.281325 -0.208786 -0.007739
C -2.543261 0.655613 0.005730
C 2.541721 0.655943 -0.004036
C -4.971909 0.311551 0.003933
C 4.970420 0.312390 0.001637
C -6.060153 -0.753457 0.074562
C 6.058793 -0.753493 -0.051375
C -7.449420 -0.124552 -0.063124
C 7.448626 -0.120935 0.061452
H -0.008315 1.316656 -0.891515
H 0.006662 1.324694 0.885947
H -1.295055 -0.881583 -0.862359
H -1.290740 -0.853212 0.915943
H 1.289888 -0.861082 -0.901647
H 1.293280 -0.873685 0.876828
H -2.622807 1.275415 -0.906424
H -2.601650 1.325026 0.884098
H 2.601761 1.316262 -0.889128
H 2.619380 1.285143 0.901848
H -5.880613 -1.504235 -0.715739
H -5.964600 -1.291493 1.035723
H 5.885429 -1.484395 0.758823
H 5.956517 -1.315510 -0.997908
H -7.672384 0.590146 0.740822
H -7.606737 0.348507 -1.042364
H 7.666358 0.573298 -0.761664
H 7.611952 0.376753 1.027383


