%chk=000080597.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080597

0 1
 Br   2.861000      -1.173800     -9.9999997E-05
 S   -2.736900      -1.245400     -9.9999997E-05
 C   -1.212800     -0.3211000      9.9999997E-05
 C   1.0500000E-02 -0.9915000      1.9999999E-04
 C   -1.243900       1.073500       0.000000    
 C    1.202700     -0.2671000      9.9999997E-05
 C  -5.1899999E-02   1.797800       0.000000    
 C    1.171300       1.127500       0.000000    
 H   4.1999999E-02  -2.079000      9.9999997E-05
 H   -2.187500       1.613600     -9.9999997E-05
 H  -7.6099999E-02   2.883600     -9.9999997E-05
 H    2.090900       1.707000     -1.9999999E-04
 H   -2.196800      -2.473000      8.9999996E-03


%chk=000080597-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080597

0 1
Br 2.940546 -1.192393 0.000144
S -2.814921 -1.230874 0.000136
C -1.213377 -0.337176 0.000495
C 0.031261 -1.013197 0.000342
C -1.257068 1.078916 0.000170
C 1.215383 -0.248952 0.000137
C -0.052565 1.813580 -0.000283
C 1.202605 1.160102 -0.000248
H 0.084000 -2.106327 0.000270
H -2.218803 1.602049 0.000505
H -0.087936 2.908136 -0.000498
H 2.134738 1.730613 -0.000446
H -2.291361 -2.512378 0.008176