%chk=000081093.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081093

0 1
 Br   4.635700      0.7096000      1.7100001E-02
 N   -4.194800      0.6931000     -4.0000002E-03
 C   0.5713000     -0.6592000     -1.5400000E-02
 C  -0.7281000      0.1551000     -1.5699999E-02
 C    1.798500      0.2597000     -1.0100000E-02
 C   -1.979600     -0.7235000      2.2800000E-02
 C    3.113800     -0.5040000     -2.9000000E-03
 C   -3.216700      6.9100000E-02  8.1000002E-03
 H   0.5999000      -1.307600     -0.8991000    
 H   0.5977000      -1.309400      0.8670000    
 H  -0.7337000      0.8315000      0.8491000    
 H  -0.7558000      0.7929000     -0.9088000    
 H    1.752900      0.9164000      0.8682000    
 H    1.761300      0.9161000     -0.8889000    
 H   -1.975900      -1.403500     -0.8371000    
 H   -1.960700      -1.348900      0.9229000    
 H    3.224100      -1.124400     -0.8966000    
 H    3.209200      -1.133300      0.8863000    


%chk=000081093-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081093

0 1
Br 4.752058 0.661881 -0.020848
N -4.277813 0.639107 -0.005862
C 0.569703 -0.626301 0.002644
C -0.740557 0.193045 -0.003544
C 1.820747 0.290074 -0.008796
C -1.990001 -0.732370 0.007244
C 3.108408 -0.536956 -0.005470
C -3.258267 0.017644 -0.000337
H 0.590313 -1.297494 -0.880748
H 0.593373 -1.279437 0.899360
H -0.772969 0.859772 0.878626
H -0.775328 0.842264 -0.898596
H 1.805406 0.955551 0.874711
H 1.800227 0.940270 -0.903539
H -1.971492 -1.402078 -0.874704
H -1.970889 -1.382600 0.903642
H 3.215385 -1.164145 -0.904462
H 3.220796 -1.148528 0.903578


