%chk=000121765.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121765

0 1
 Br   2.965600     -0.4523000      -1.984300    
 O   -2.218100      0.2854000     -0.3878000    
 O   0.8949000      -2.083200      0.2778000    
 O   -1.434400      -1.093400       1.292000    
 C   9.6299998E-02  0.1624000     -7.6700002E-02
 C   0.4660000       1.433200      0.6842000    
 C    1.847700       1.942100      0.2865000    
 C    2.917900      0.8868000      0.5596000    
 C    2.615900     -0.4642000     -6.9100000E-02
 C    1.175400     -0.8969000      9.6500002E-02
 C   -1.253800     -0.3035000      0.3752000    
 C   -3.564500     -7.4100003E-02 -6.1999999E-02
 C   -4.508900      0.6577000     -0.9918000    
 H   4.3400001E-02  0.3651000      -1.154300    
 H   0.4457000       1.246200       1.766100    
 H  -0.2769000       2.216900      0.4912000    
 H    1.850800       2.223900     -0.7728000    
 H    2.080100       2.849800      0.8555000    
 H    3.894300       1.262900      0.2318000    
 H    2.987000      0.7519000       1.647200    
 H    3.277000      -1.230400      0.3483000    
 H   -3.692500      -1.155800     -0.1805000    
 H   -3.776100      0.2058000      0.9760000    
 H   -5.549700      0.4057000     -0.7700000    
 H   -4.379500       1.741100     -0.8978000    
 H   -4.297500      0.4018000      -2.035300    


%chk=000121765-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121765

0 1
Br 2.284513 0.302025 -2.454731
O -2.270690 0.357230 -0.414457
O 0.171296 -1.651795 -0.013545
O -1.757267 0.522565 1.854129
C 0.011359 0.807756 0.147462
C 0.850935 1.639565 1.164532
C 2.305590 1.828832 0.682934
C 2.998183 0.473490 0.425637
C 2.198888 -0.427703 -0.530549
C 0.718319 -0.529214 -0.144342
C -1.406636 0.556152 0.653315
C -3.677652 -0.023156 -0.066232
C -4.391062 -0.316932 -1.381035
H -0.049375 1.353332 -0.814308
H 0.827286 1.126624 2.144329
H 0.361390 2.619476 1.309762
H 2.324272 2.432280 -0.244711
H 2.876855 2.391372 1.444330
H 4.022704 0.610365 0.036129
H 3.086893 -0.084018 1.383211
H 2.621713 -1.438724 -0.633092
H -3.637054 -0.900789 0.603014
H -4.132978 0.817369 0.488429
H -5.438309 -0.608059 -1.180426
H -4.396713 0.570787 -2.036493
H -3.896360 -1.143930 -1.917791


