%chk=000038706.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038706

0 1
 Br   2.835900       2.527600      2.6000000E-03
 O   -1.100000      -2.059300     -1.6200000E-02
 O   -2.744500      0.6927000      -1.098900    
 N   -2.731600      0.7202000       1.180300    
 C    1.157100      -1.280300      7.1000000E-03
 C  -0.2136000      -1.022300     -1.2200000E-02
 C  -0.6755000      0.2937000     -2.6500000E-02
 C    2.065900     -0.2221000      1.2000000E-02
 C   0.2334000       1.351900     -2.1700000E-02
 C    1.604100       1.093900     -2.4000001E-03
 C    1.671000      -2.682300      2.3200000E-02
 C   -2.102400      0.5863000     -4.7300000E-02
 H    3.134800     -0.4226000      2.7000001E-02
 H  -0.1310000       2.376900     -3.3599999E-02
 H    2.766300      -2.711400      3.7000000E-02
 H    1.325400      -3.210300      0.9182000    
 H    1.347600      -3.222800     -0.8726000    
 H  -0.6446000      -2.915000     -4.6999999E-03
 H   -2.229900      0.6283000       2.058100    
 H   -3.725300      0.9162000       1.238700    


%chk=000038706-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038706

0 1
Br 3.023379 2.520499 -0.706766
O -1.124437 -1.870816 0.565343
O -2.301267 2.215068 0.219106
N -2.998269 0.040831 0.626709
C 1.195268 -1.232791 0.087505
C -0.169178 -0.870241 0.270638
C -0.607359 0.477343 0.167170
C 2.129786 -0.214355 -0.203433
C 0.356424 1.475607 -0.125802
C 1.701022 1.125550 -0.305737
C 1.630070 -2.683876 0.206247
C -2.029993 0.978614 0.338863
H 3.183376 -0.471620 -0.347655
H -0.003591 2.506136 -0.200673
H 2.712898 -2.780534 0.027782
H 1.436556 -3.097746 1.216896
H 1.127177 -3.335919 -0.537015
H -0.706878 -2.765459 0.606293
H -2.756807 -0.948877 0.720245
H -3.955078 0.371887 0.742384


