%chk=000062093.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062093

0 1
 Br   4.814700       1.283300      -1.892900    
 Br  -4.806600       1.264100       1.896400    
 Br   2.605400      -1.110800       2.838100    
 Br  -2.589300      -1.115300      -2.838200    
 O    4.661400     -0.5551000      0.5927000    
 O   -4.647000     -0.5700000     -0.5920000    
 O    3.660800      -2.217500     -0.7149000    
 O   -3.640800      -2.230900      0.7131000    
 C   1.8000000E-03   2.579300      2.7000001E-03
 C    1.232800       1.751900      0.1588000    
 C   -1.286900       1.706800     -0.1623000    
 C  -0.1047000       3.550600       1.230400    
 C  -1.3800000E-02   3.549000      -1.238600    
 C    1.343700      0.8614000       1.226700    
 C   -1.334300      0.8587000      -1.223800    
 C    2.272800       1.868000     -0.7635000    
 C   -2.266800       1.859100      0.7678000    
 C    3.423900       1.093700     -0.6177000    
 C   -3.415200       1.081200      0.6209000    
 C    2.494900      8.7200001E-02   1.372500    
 C   -2.482700      8.0899999E-02  -1.370800    
 C    3.535000      0.2035000      0.4504000    
 C   -3.523200      0.1921000     -0.4484000    
 C    4.599400      -1.789600     -6.0899999E-02
 C   -4.580800      -1.805300      5.9799999E-02
 C    5.873900      -2.501600      0.1744000    
 C   -5.853100      -2.521200     -0.1766000    
 C    6.067100      -3.716200     -0.3473000    
 C   -6.042100      -3.737300      0.3433000    
 H   0.8017000       4.167000       1.301400    
 H  -0.9471000       4.247500       1.140100    
 H  -0.1886000       3.024100       2.188400    
 H   0.7941000       4.288400      -1.176200    
 H   9.2900001E-02   3.020700      -2.193000    
 H  -0.9573000       4.108000      -1.288800    
 H   0.5344000      0.7633000       1.946500    
 H  -0.5195000      0.7708000      -1.935100    
 H    2.220300       2.550800      -1.604900    
 H   -2.222300       2.532200       1.612700    
 H    6.641100      -2.023600      0.7727000    
 H   -6.621800      -2.045000     -0.7743000    
 H    7.002200      -4.238500     -0.1746000    
 H    5.317600      -4.218000     -0.9493000    
 H   -6.975400      -4.262500      0.1698000    
 H   -5.290800      -4.237400      0.9446000    


%chk=000062093-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000062093

0 1
Br 5.100770 1.546787 -1.711963
Br -5.125386 1.504737 1.710343
Br 2.525870 -1.538833 2.489895
Br -2.525917 -1.561055 -2.491071
O 4.813138 -0.588011 0.570149
O -4.820137 -0.629308 -0.571140
O 4.204028 -2.204315 -1.035426
O -4.200482 -2.234791 1.041255
C -0.016913 2.597239 -0.002092
C 1.253403 1.713822 0.071179
C -1.280490 1.703635 -0.074722
C -0.013066 3.514518 1.257536
C -0.027816 3.513283 -1.262639
C 1.311709 0.665112 1.026719
C -1.330293 0.654423 -1.029959
C 2.389507 1.959022 -0.735654
C -2.418086 1.939333 0.732898
C 3.551568 1.176808 -0.584314
C -3.573513 1.147203 0.582355
C 2.476435 -0.107233 1.167236
C -2.488410 -0.128098 -1.169463
C 3.618554 0.134347 0.365299
C -3.632032 0.103815 -0.366905
C 5.023802 -1.788663 -0.197808
C -5.022929 -1.828039 0.201885
C 6.327547 -2.370317 0.194716
C -6.320350 -2.422755 -0.192006
C 6.777849 -3.518966 -0.373795
C -6.761412 -3.573894 0.378716
H 0.935548 4.077461 1.299534
H -0.837277 4.249689 1.219652
H -0.100012 2.931820 2.191738
H 0.790398 4.255134 -1.224996
H 0.064731 2.930455 -2.196205
H -0.980946 4.068411 -1.305647
H 0.441116 0.443322 1.651268
H -0.458297 0.440014 -1.655102
H 2.382907 2.751551 -1.486604
H -2.417805 2.732150 1.483521
H 6.893029 -1.827468 0.958262
H -6.889043 -1.887222 -0.958327
H 7.739694 -3.957100 -0.088843
H 6.181711 -4.035682 -1.135126
H -7.718590 -4.021565 0.092887
H -6.162314 -4.082973 1.142862


