%chk=000142869.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142869

0 1
 Br   2.022100      -2.708200     -0.1999000    
 O   -2.063400       1.708000      0.4204000    
 O   -2.792500     -0.7553000     -0.6403000    
 N    3.997200       1.217600     -0.9693000    
 C    1.128600     -6.9100000E-02  0.5387000    
 C   -1.142400      0.7142000      0.2813000    
 C   0.1761000      0.9407000      0.6761000    
 C   -1.508400     -0.5222000     -0.2508000    
 C   0.7627000      -1.305300      6.3999998E-03
 C  -0.5558000      -1.531900     -0.3882000    
 C    2.528900      0.2190000      0.9751000    
 C   -2.224600       2.601000     -0.6800000    
 C   -3.681300      -1.286200      0.3409000    
 C    3.352800      0.7775000     -0.1105000    
 H   0.4518000       1.908500       1.088700    
 H  -0.8526000      -2.491500     -0.8053000    
 H    3.012100     -0.6592000       1.415400    
 H    2.505500      0.9436000       1.800700    
 H   -2.545400       2.057100      -1.574000    
 H   -1.290600       3.135600     -0.8799000    
 H   -2.996200       3.330500     -0.4190000    
 H   -4.665400      -1.409600     -0.1194000    
 H   -3.774900     -0.5994000       1.188000    
 H   -3.331100      -2.264000      0.6863000    


%chk=000142869-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000142869

0 1
Br 2.241298 -2.693620 -0.434878
O -2.008670 1.693835 0.565970
O -2.715209 -0.833684 -0.762014
N 4.265369 1.173292 -0.845052
C 1.268756 -0.099799 0.579402
C -1.063931 0.674199 0.325659
C 0.257888 0.873427 0.770349
C -1.413484 -0.558446 -0.299604
C 0.904377 -1.295214 -0.089439
C -0.415781 -1.532362 -0.518633
C 2.688098 0.181487 1.069575
C -2.600716 2.293236 -0.657163
C -3.761538 -0.869737 0.291017
C 3.563988 0.724086 0.008874
H 0.494637 1.825342 1.257397
H -0.698602 -2.465242 -1.012905
H 3.156334 -0.740400 1.461295
H 2.660500 0.912126 1.898487
H -3.091330 1.522900 -1.278345
H -1.814856 2.804806 -1.243205
H -3.336522 3.025850 -0.293668
H -4.706756 -1.034799 -0.246915
H -3.792457 0.080757 0.852510
H -3.568193 -1.710640 0.982685


