%chk=000076929.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076929

0 1
 Br   4.996800       1.938200     -0.1317000    
 Br  -4.996300       1.938100      0.1317000    
 S   1.9999999E-04  -2.158100       0.000000    
 C    1.377700      -1.027600     -3.5799999E-02
 C   -1.380700      -1.024700      3.5799999E-02
 C    1.506200     -0.1183000      -1.085700    
 C   -1.505800     -0.1184000       1.085700    
 C    2.327500      -1.052700      0.9855000    
 C   -2.327000      -1.052700     -0.9855000    
 C    2.584800      0.7657000      -1.114300    
 C   -2.584300      0.7657000       1.114400    
 C    3.405900     -0.1684000      0.9567000    
 C   -3.405500     -0.1684000     -0.9568000    
 C    3.534700      0.7407000     -9.3199998E-02
 C   -3.534200      0.7407000      9.3099996E-02
 H   0.7822000     -8.4600002E-02  -1.896000    
 H  -0.7814000     -8.5400000E-02   1.895600    
 H    2.243500      -1.754000       1.812100    
 H   -2.242300      -1.754100      -1.811600    
 H    2.671300       1.467000      -1.940300    
 H   -2.670900       1.467000       1.940400    
 H    4.137200     -0.2008000       1.760300    
 H   -4.136700     -0.2008000      -1.760300    


%chk=000076929-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076929

0 1
Br 5.341480 1.803133 0.034363
Br -5.341165 1.803580 -0.031258
S 0.000047 -2.097035 -0.001922
C 1.438016 -0.943295 0.027426
C -1.437745 -0.943024 -0.028912
C 1.497435 0.201662 -0.801487
C -1.495581 0.202732 0.798961
C 2.536439 -1.279635 0.852333
C -2.537783 -1.280119 -0.851416
C 2.647146 1.021798 -0.794133
C -2.645323 1.022865 0.792982
C 3.699487 -0.474843 0.850602
C -3.700787 -0.475316 -0.848275
C 3.738030 0.670463 0.029904
C -3.737771 0.670811 -0.028626
H 0.654400 0.459514 -1.450108
H -0.651380 0.461287 1.445785
H 2.488254 -2.159412 1.501991
H -2.490905 -2.160503 -1.500359
H 2.692652 1.910070 -1.430547
H -2.689557 1.911751 1.428632
H 4.549192 -0.735654 1.487637
H -4.551681 -0.736730 -1.483474


