%chk=000121894.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121894

0 1
 Br  -2.989900       2.582700      -1.173000    
 O  -0.4102000      -1.867600     -0.1069000    
 O    3.802600      0.3717000     -8.7099999E-02
 O   -2.421600      -2.955600     -0.1188000    
 C  -0.3627000      0.5520000      0.2258000    
 C   -1.828400      0.5418000      0.3259000    
 C   0.3012000     -0.6568000      1.1700000E-02
 C   0.4169000       1.711500      0.3333000    
 C    1.690900     -0.7357000     -9.5200002E-02
 C    2.446900      0.4266000      1.4200000E-02
 C   -2.478900     -0.6245000      0.2089000    
 C    1.811100       1.648300      0.2282000    
 C   -2.571600       1.825100      0.5556000    
 C   -1.792800      -1.907900     -1.6700000E-02
 C    4.386500     -0.9118000     -0.3061000    
 H  -2.4599999E-02   2.690600      0.4918000    
 H    2.117500      -1.718900     -0.2613000    
 H   -3.561800     -0.6677000      0.2773000    
 H    2.395300       2.561000      0.3130000    
 H   -3.536800       1.646700       1.041800    
 H   -2.042300       2.566000       1.157200    
 H    5.470600     -0.7686000     -0.3612000    
 H    4.195500      -1.589000      0.5333000    
 H    4.071000      -1.339000      -1.264000    


%chk=000121894-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121894

0 1
Br -2.788450 2.950806 -1.114201
O -0.458812 -1.901160 -0.070174
O 3.821077 0.396417 -0.102435
O -2.460894 -3.049804 -0.075344
C -0.402748 0.549644 0.219063
C -1.854439 0.548771 0.330166
C 0.254751 -0.701358 0.021674
C 0.419697 1.715208 0.292690
C 1.655238 -0.812728 -0.090353
C 2.432633 0.362619 -0.006896
C -2.553881 -0.643607 0.232286
C 1.809042 1.631943 0.184535
C -2.617085 1.815599 0.586923
C -1.912449 -1.935571 0.024120
C 4.527095 -0.876173 -0.312571
H -0.044874 2.698358 0.414577
H 2.086356 -1.805014 -0.239486
H -3.644742 -0.670969 0.303889
H 2.443458 2.520664 0.234958
H -3.657223 1.624348 0.882020
H -2.127068 2.489197 1.304288
H 5.591538 -0.606646 -0.358118
H 4.349639 -1.571219 0.529488
H 4.216541 -1.348424 -1.263400


