%chk=000100834.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100834

0 1
 Br   5.336000       1.379400      0.3844000    
 C    2.763400      0.2632000     -0.1071000    
 C    1.827600     -0.8927000     -0.4731000    
 C    4.220400     -0.1658000     -2.0400001E-02
 C   0.3803000     -0.4910000     -0.4874000    
 C  -0.5390000      -1.001300      0.3434000    
 C   -4.452300      0.1775000      0.2083000    
 C   -4.592400       1.562900     -0.3993000    
 C   -1.897200     -0.5891000      0.2950000    
 C   -3.046700     -0.2431000      0.2562000    
 H    2.654500       1.063500     -0.8510000    
 H    2.451800      0.6932000      0.8542000    
 H    2.090100      -1.273400      -1.467600    
 H    1.986400      -1.720800      0.2291000    
 H    4.582900     -0.5729000     -0.9681000    
 H    4.386000     -0.8930000      0.7790000    
 H   9.1499999E-02  0.2549000      -1.225100    
 H  -0.2615000      -1.746400       1.081800    
 H   -5.034000     -0.5391000     -0.3821000    
 H   -4.873600      0.1796000       1.219800    
 H   -4.203900       1.587000      -1.423400    
 H   -4.042800       2.308900      0.1852000    
 H   -5.645200       1.861100     -0.4277000    


%chk=000100834-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100834

0 1
Br 5.576550 1.300261 0.436341
C 2.850029 0.263313 -0.054790
C 1.887858 -0.901719 -0.445684
C 4.303541 -0.213146 -0.051392
C 0.448682 -0.444610 -0.507754
C -0.551590 -0.951976 0.275491
C -4.534274 0.194141 0.254928
C -4.770410 1.560549 -0.443527
C -1.920418 -0.534395 0.243800
C -3.118273 -0.215740 0.259711
H 2.731701 1.097541 -0.771311
H 2.574301 0.650010 0.942752
H 2.198005 -1.295324 -1.436999
H 1.989705 -1.733093 0.279055
H 4.643797 -0.551649 -1.042928
H 4.496424 -0.990399 0.704586
H 0.211481 0.353475 -1.226031
H -0.300316 -1.749020 0.992915
H -5.139235 -0.586368 -0.249241
H -4.904318 0.243760 1.298523
H -4.441857 1.523258 -1.496511
H -4.205355 2.361604 0.063462
H -5.843728 1.822128 -0.421294


