%chk=000090279.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090279

0 1
 Br   2.254100       2.257400      -2.489800    
 O    1.883800      -1.914900      0.6569000    
 O   -2.752200     -0.8003000      0.4252000    
 C   0.6213000      -2.204100      0.2389000    
 C   -1.707000      -1.654800      0.1163000    
 C  -0.4312000      -1.343200      0.5501000    
 C   0.3799000      -3.361800     -0.5007000    
 C   -1.966300      -2.797900     -0.6182000    
 C    2.332500     -0.6144000      0.4978000    
 C   -2.548800      0.5346000      0.2572000    
 C  -0.9138000      -3.658600     -0.9294000    
 C    2.103100      3.5200000E-02 -0.7015000    
 C    2.998600      8.9999998E-04   1.542200    
 C   -1.933800       1.006100     -0.9028000    
 C   -2.954700       1.431600       1.245300    
 C    2.555400       1.345000     -0.8619000    
 C    3.450800       1.310500       1.381800    
 C   -1.724700       2.374500      -1.074400    
 C   -2.745500       2.800100       1.073500    
 C    3.229100       1.982600      0.1799000    
 C   -2.130600       3.271400     -8.6400002E-02
 H  -0.2549000     -0.4663000       1.167300    
 H    1.195800      -4.036000     -0.7467000    
 H   -2.972900      -3.029800     -0.9529000    
 H   -1.101700      -4.559800      -1.505800    
 H    1.599500     -0.4616000      -1.526600    
 H    3.171300     -0.5209000       2.478600    
 H   -1.627500      0.3332000      -1.699300    
 H   -3.433700       1.070300       2.151200    
 H    3.975100       1.807000       2.193100    
 H   -1.252000       2.742600      -1.980200    
 H   -3.061600       3.498500       1.842800    
 H    3.587500       3.003100      7.1500003E-02
 H   -1.968900       4.336900     -0.2208000    


%chk=000090279-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090279

0 1
Br 2.477612 2.453811 -2.420480
O 1.910322 -1.875281 0.743147
O -2.868289 -0.766590 0.082460
C 0.600019 -2.164119 0.271019
C -1.738752 -1.606535 -0.040625
C -0.445860 -1.220800 0.379782
C 0.378913 -3.470753 -0.210286
C -1.993182 -2.908639 -0.530191
C 2.512652 -0.623071 0.489847
C -2.743725 0.649749 0.076463
C -0.930444 -3.833418 -0.600553
C 2.204845 0.155584 -0.652798
C 3.513952 -0.218532 1.400921
C -1.878808 1.337069 -0.806530
C -3.617049 1.350482 0.935695
C 2.910547 1.358165 -0.843074
C 4.206534 0.987761 1.168969
C -1.881023 2.749707 -0.806036
C -3.614862 2.762715 0.918572
C 3.910405 1.799063 0.046679
C -2.744270 3.467834 0.054338
H -0.262835 -0.227985 0.799611
H 1.215712 -4.171456 -0.269212
H -3.008671 -3.171494 -0.838225
H -1.120290 -4.844504 -0.975383
H 1.451840 -0.177128 -1.371016
H 3.730770 -0.849903 2.266851
H -1.225581 0.785081 -1.489587
H -4.280319 0.784209 1.596300
H 4.982494 1.309937 1.871101
H -1.206474 3.284309 -1.483977
H -4.290814 3.310342 1.584379
H 4.441370 2.738734 -0.124420
H -2.740739 4.562756 0.048458


