%chk=000092977.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092977

0 1
 Br -0.1445000      -3.954900      0.3498000    
 O    1.534600      0.3118000       1.220400    
 O    2.339100      -2.020800      -1.393500    
 O    4.164400     -0.9227000      0.2940000    
 O    3.430300       2.897500     -0.5127000    
 O   -4.610500     -0.3576000     -0.3201000    
 N  -0.1793000      -1.034400      0.2820000    
 N  -0.9220000       1.277300      0.1325000    
 N   -2.190800      -2.004500      3.7200000E-02
 N   -3.287600       1.540500     -0.1866000    
 N   -1.837000       3.392900     -3.5599999E-02
 C    1.262300     -0.8864000      0.4685000    
 C    2.045400     -0.7591000     -0.8293000    
 C    3.281200     -1.4400000E-02 -0.3640000    
 C    2.709200      0.9511000      0.6693000    
 C    2.291700       2.285500      6.7400001E-02
 C   -1.095300     -4.6900000E-02  0.1392000    
 C  -0.8961000      -2.209600      0.2125000    
 C   -2.312900     -0.6442000     -8.8000000E-03
 C   -3.507300      0.1575000     -0.1848000    
 C   -2.074800       2.041500     -3.7300002E-02
 H    1.601500      -1.730100       1.079100    
 H    1.497400     -0.1637000      -1.568700    
 H    3.836400      0.4474000      -1.184800    
 H    3.417300       1.119100       1.488900    
 H    1.859100       2.951400      0.8209000    
 H    1.558900       2.161700     -0.7336000    
 H    2.868100      -2.522200     -0.7499000    
 H    4.925200     -0.4076000      0.6129000    
 H  -4.6000000E-02   1.727100      0.3507000    
 H    4.079600       3.043200      0.1964000    
 H  -0.9003000       3.764800      7.7399999E-02
 H   -2.593000       4.059000     -0.1504000    


%chk=000092977-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092977

0 1
Br -0.040568 -3.811219 1.309563
O 1.431668 0.571230 1.099921
O 2.081988 -1.920805 -1.536699
O 4.198319 -0.855632 -0.446447
O 4.392650 2.740156 0.336605
O -4.892071 -0.536990 -0.065483
N -0.258881 -0.997726 0.519205
N -1.123681 1.263786 -0.109568
N -2.265256 -2.109881 0.570978
N -3.526128 1.342916 -0.441896
N -2.226550 3.276601 -0.695985
C 1.171036 -0.766787 0.503439
C 1.831939 -0.652509 -0.906481
C 3.138025 0.152590 -0.600026
C 2.846791 0.884024 0.742973
C 3.001030 2.407778 0.674863
C -1.256960 -0.087185 0.173098
C -0.960507 -2.216580 0.757665
C -2.482752 -0.763018 0.201621
C -3.737383 -0.039506 -0.093731
C -2.339238 1.923853 -0.418419
H 1.662661 -1.567298 1.089276
H 1.162787 -0.080133 -1.572001
H 3.391732 0.860994 -1.407641
H 3.508318 0.455110 1.523587
H 2.679414 2.873840 1.626466
H 2.395385 2.824656 -0.148556
H 3.007816 -2.191412 -1.275941
H 5.076445 -0.470510 -0.680855
H -0.270784 1.749280 0.183917
H 4.950611 2.709959 1.153716
H -1.343493 3.719654 -0.936447
H -3.100065 3.760962 -0.891715


