%chk=000077595.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077595

0 1
 Br   4.182800      8.8999998E-03  3.9999999E-04
 C   -1.988100      2.0999999E-03  9.9999997E-05
 C  -0.4504000      2.4999999E-03 -1.9999999E-04
 C   -2.507100     -0.7252000       1.259400    
 C   -2.507700     -0.7273000      -1.257700    
 C   -2.613700       1.415300     -1.1000000E-03
 C   0.2019000      -1.204500     -1.9999999E-04
 C   0.1989000       1.211500     -9.9999997E-05
 C    1.596900      -1.202700     -9.9999997E-05
 C    1.593800       1.213300     -1.9999999E-04
 C    2.292800      6.2000002E-03 -3.0000001E-04
 H   -3.602300     -0.7018000       1.305100    
 H   -2.210700      -1.779500       1.285500    
 H   -2.126000     -0.2533000       2.172900    
 H   -2.211800      -1.781800      -1.282000    
 H   -3.602900     -0.7038000      -1.303100    
 H   -2.126800     -0.2572000      -2.172200    
 H   -3.709300       1.355100     -1.2000001E-03
 H   -2.333200       1.989500      0.8899000    
 H   -2.332800       1.988100     -0.8928000    
 H  -0.3181000      -2.156300     -9.9999997E-05
 H  -0.2916000       2.176300      9.9999997E-05
 H    2.126600      -2.151900       0.000000    
 H    2.121700       2.163600     -9.9999997E-05


%chk=000077595-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077595

0 1
Br 4.313028 -0.025703 -0.000156
C -2.047001 0.008086 0.000128
C -0.499528 0.031278 0.000000
C -2.551179 -0.738323 1.272251
C -2.551439 -0.739829 -1.270997
C -2.657622 1.432941 -0.000652
C 0.227826 -1.191099 0.000545
C 0.251342 1.234065 -0.000599
C 1.638362 -1.221445 0.000501
C 1.666661 1.230055 -0.000649
C 2.345474 -0.001726 -0.000096
H -3.656814 -0.773708 1.280778
H -2.179753 -1.777919 1.311147
H -2.213804 -0.223844 2.190481
H -2.180053 -1.779484 -1.308736
H -3.657076 -0.775214 -1.279248
H -2.214255 -0.226457 -2.189917
H -3.760454 1.360474 -0.000583
H -2.360718 2.007772 0.896129
H -2.360744 2.006767 -0.898086
H -0.306701 -2.147897 0.001006
H -0.259016 2.201383 -0.001057
H 2.173751 -2.175416 0.000923
H 2.222611 2.172343 -0.001114


