%chk=000073807.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073807

0 1
 Br  -3.886400      -2.507900     -0.5714000    
 O   0.5605000       1.125700      -2.049900    
 N  -0.6786000       2.474600      0.8431000    
 N    1.466000     -0.6058000      0.8428000    
 C  -0.8829000      0.3666000     -0.3733000    
 C   -1.410400       1.315300      0.5028000    
 C   0.4369000      0.5356000     -0.9682000    
 C   -1.621200     -0.7724000     -0.6948000    
 C    1.676700      1.7400000E-02 -0.3189000    
 C   -2.676000       1.125000       1.057300    
 C   -2.886700     -0.9628000     -0.1401000    
 C   -3.414100     -1.4100000E-02  0.7360000    
 C    2.877300      0.2158000     -0.9399000    
 C    4.000500     -0.2860000     -0.2918000    
 C    3.857800     -0.9474000      0.9229000    
 C    2.580500      -1.079700       1.443300    
 H   -1.206400      -1.510600      -1.378000    
 H   -3.098700       1.856000       1.741900    
 H   -4.398400     -0.1477000       1.177400    
 H    2.987900      0.7315000      -1.886200    
 H   -1.079300       3.152600       1.478000    
 H   0.2372000       2.642000      0.4497000    
 H    4.985200     -0.1619000     -0.7322000    
 H    4.719300      -1.346600       1.445900    
 H    2.415400      -1.587300       2.388100    


%chk=000073807-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000073807

0 1
Br -3.080757 -2.769106 1.352142
O 0.977891 2.177696 -0.390057
N -1.462546 2.980382 -0.233217
N 1.593257 -1.347832 0.282595
C -0.773069 0.645741 0.213165
C -1.785526 1.690452 0.115878
C 0.637661 0.970792 -0.064917
C -1.196900 -0.673362 0.583981
C 1.793383 -0.020721 -0.002634
C -3.152111 1.359403 0.392568
C -2.537495 -0.945883 0.844676
C -3.531757 0.063425 0.752687
C 3.093247 0.495720 -0.262071
C 4.202596 -0.372270 -0.226434
C 3.994039 -1.739728 0.065955
C 2.672183 -2.176340 0.312332
H -0.425853 -1.445210 0.646552
H -3.911971 2.146152 0.318715
H -4.581007 -0.167801 0.960375
H 3.191644 1.560647 -0.485463
H -2.186769 3.692947 -0.295497
H -0.464582 3.170831 -0.420203
H 5.209941 0.009226 -0.423110
H 4.825208 -2.450606 0.103490
H 2.461393 -3.226658 0.542994


