%chk=000089470.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089470

0 1
 Br   3.263200     -0.8740000     -0.1478000    
 O   -1.863900     -0.6977000      0.4174000    
 O   -1.065000       1.010400     -0.9111000    
 C    1.624900      0.2069000     -0.2228000    
 C   0.4252000     -0.7300000     -9.5700003E-02
 C    1.694800       1.245100      0.8885000    
 C  -0.8954000     -8.8000000E-03 -0.2557000    
 C   -3.184000     -0.1520000      0.3273000    
 H    1.642200      0.6974000      -1.201600    
 H   0.4433000      -1.219400      0.8865000    
 H   0.4603000      -1.515200     -0.8601000    
 H    2.593900       1.864300      0.7928000    
 H    1.721800      0.7749000       1.878000    
 H   0.8316000       1.917300      0.8600000    
 H   -3.856500     -0.7917000      0.9048000    
 H   -3.518600     -0.1403000     -0.7144000    
 H   -3.206700      0.8560000      0.7524000    


%chk=000089470-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089470

0 1
Br 3.301530 -0.966725 -0.298256
O -1.947106 -0.776563 0.355739
O -1.082267 1.154818 -0.616856
C 1.621169 0.219648 -0.212598
C 0.423720 -0.713056 0.033181
C 1.825792 1.293241 0.856007
C -0.906546 0.018299 -0.120600
C -3.311254 -0.201227 0.223047
H 1.577881 0.657935 -1.221695
H 0.475140 -1.169946 1.037393
H 0.429805 -1.550686 -0.689304
H 2.721025 1.900473 0.644416
H 1.936401 0.845321 1.858967
H 0.946160 1.964555 0.856230
H -3.977798 -0.968024 0.640757
H -3.540384 -0.006728 -0.837869
H -3.382166 0.741864 0.789941


