%chk=000136527.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000136527

0 1
 Br  0.6212000      -2.569800      4.6000001E-03
 N    1.634800      0.4219000     -6.0000003E-04
 C   0.2278000      0.2904000     -5.0000002E-04
 C  -0.3871000     -0.9615000      1.7000000E-03
 C  -0.5490000       1.449000     -2.4000001E-03
 C    2.362900      0.4921000       1.249000    
 C    2.364200      0.4737000      -1.250600    
 C   -1.778700      -1.055000      1.5000000E-03
 C   -1.940700       1.355600     -2.3000001E-03
 C   -2.555600      0.1036000     -3.9999999E-04
 H  -8.2099997E-02   2.430900     -4.0000002E-03
 H    3.414500      0.2156000       1.117800    
 H    1.939400     -0.1862000       1.997800    
 H    2.326200       1.510500       1.649400    
 H    1.893200       1.175100      -1.948200    
 H    2.397400     -0.5126000      -1.723600    
 H    3.396000      0.8096000      -1.101200    
 H   -2.276300      -2.021500      3.1000001E-03
 H   -2.545700       2.257600     -3.8000001E-03
 H   -3.639200      3.0999999E-02 -3.9999999E-04


%chk=000136527-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000136527

0 1
Br 0.392025 -2.709902 0.724653
N 1.674479 0.171937 -0.152403
C 0.262718 0.162679 -0.061634
C -0.488895 -0.978724 0.364970
C -0.504762 1.305430 -0.453464
C 2.499964 -0.121901 1.037601
C 2.313962 1.114381 -1.081295
C -1.893846 -0.962672 0.454119
C -1.912100 1.318764 -0.398096
C -2.618311 0.190970 0.074413
H 0.026572 2.203538 -0.783714
H 3.406960 -0.685365 0.749595
H 1.940386 -0.726808 1.763896
H 2.816491 0.819221 1.542025
H 1.763954 1.144825 -2.036536
H 3.340712 0.761808 -1.288453
H 2.390609 2.152596 -0.680250
H -2.421902 -1.861660 0.786142
H -2.454664 2.219056 -0.707608
H -3.711152 0.191827 0.132941


