%chk=000082925.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082925

0 1
 Br  -2.918100       2.232300     -0.5358000    
 O   0.1307000      -2.021900      -1.606700    
 O   0.2770000       1.077000       1.918400    
 O    4.081400     -2.4499999E-02 -0.3987000    
 N    2.084800     -0.9486000      -1.066000    
 N    2.158000      0.5989000      0.6953000    
 C  -2.9700000E-02 -4.7400001E-02 -0.2081000    
 C   -1.325700     -0.6387000      0.3655000    
 C   -1.037800      -1.814600       1.322500    
 C   -2.272800      -1.120700     -0.7532000    
 C  -0.3785000       1.085800      -1.189500    
 C   0.7096000      -1.117200      -1.005500    
 C   0.7894000      0.5740000      0.9188000    
 C  -0.1722000      -1.438600       2.517100    
 C   -3.545700      -1.780600     -0.2411000    
 C   -1.045800       2.239800     -0.5050000    
 C    2.858000     -0.1058000     -0.2766000    
 C  -0.3628000       3.250800      4.8500001E-02
 H   -1.859600      9.7900003E-02  0.9761000    
 H   -1.979200      -2.183600       1.745000    
 H  -0.5866000      -2.665900      0.8010000    
 H   -2.587000     -0.3162000      -1.415400    
 H   -1.866700      -1.879500      -1.414200    
 H  -0.9405000      0.7467000      -2.067100    
 H   0.5552000       1.461800      -1.637200    
 H  -0.5862000     -0.6097000       3.095400    
 H  -0.1950000      -2.289900       3.212200    
 H   0.8878000      -1.330400       2.286500    
 H   -4.255200      -1.910600      -1.065900    
 H   -4.033600      -1.164700      0.5209000    
 H   -3.356400      -2.775900      0.1718000    
 H    2.590100      -1.562400      -1.698900    
 H    2.716900       1.126000       1.360500    
 H  -0.8685000       4.086400      0.5215000    
 H   0.7216000       3.281000      3.0900000E-02


%chk=000082925-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082925

0 1
Br -2.900506 2.452648 -0.292577
O 0.384877 -1.825899 -1.798461
O 0.017247 1.279415 1.923519
O 4.137831 0.046966 0.186407
N 2.209425 -0.868513 -0.768985
N 2.035726 0.728876 0.955572
C -0.092936 -0.046294 -0.153615
C -1.358394 -0.812776 0.415748
C -0.955122 -2.106324 1.193920
C -2.432987 -1.170016 -0.651881
C -0.410504 1.104783 -1.229705
C 0.817867 -1.002672 -0.951888
C 0.624647 0.676051 1.006728
C 0.037329 -1.959493 2.369567
C -3.780970 -1.605200 -0.031617
C -0.971972 2.415649 -0.727024
C 2.885363 -0.019927 0.127049
C -0.272406 3.567408 -0.608773
H -1.812884 -0.103158 1.134970
H -1.890045 -2.534541 1.599198
H -0.568826 -2.851043 0.469790
H -2.643666 -0.291896 -1.287398
H -2.042628 -1.960768 -1.317971
H -1.062682 0.658050 -1.998596
H 0.544841 1.355863 -1.731493
H -0.300931 -1.197904 3.094266
H 0.130212 -2.923004 2.903584
H 1.056852 -1.683256 2.040312
H -4.538069 -1.747568 -0.824402
H -4.163087 -0.834216 0.664487
H -3.705165 -2.557483 0.522782
H 2.808243 -1.455943 -1.359331
H 2.498833 1.299342 1.670993
H -0.724084 4.499309 -0.261271
H 0.795471 3.584532 -0.860904


