%chk=000070548.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070548

0 1
 Br   4.029900       1.593900      -1.658200    
 O  -0.4409000      -2.198200     -0.9084000    
 C   0.9751000     -0.6027000      5.0799999E-02
 C   -1.583900     -0.3046000     -0.1479000    
 C  -0.3767000      -1.086200     -0.3634000    
 C    1.715300      0.1310000     -0.8463000    
 C    1.424200     -0.9120000       1.313500    
 C   -1.505400      0.9454000      0.4659000    
 C   -2.820600     -0.8053000     -0.5547000    
 C    2.977100      0.5816000     -0.4587000    
 C    2.686000     -0.4615000       1.701100    
 C   -2.663600       1.695000      0.6730000    
 C   -3.978700     -5.5900000E-02 -0.3478000    
 C    3.462500      0.2853000      0.8151000    
 C   -3.900100       1.194200      0.2661000    
 H    1.326200      0.3550000      -1.835800    
 H   0.8230000      -1.493300       2.005900    
 H  -0.5643000       1.373200      0.7979000    
 H   -2.909300      -1.776100      -1.035000    
 H    3.063800     -0.6922000       2.692900    
 H   -2.602900       2.668400       1.150900    
 H   -4.941900     -0.4453000     -0.6644000    
 H    4.443600      0.6288000       1.132900    
 H   -4.801900       1.777700      0.4272000    


%chk=000070548-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000070548

0 1
Br 3.293338 2.378864 -1.299414
O -0.710058 -2.433091 0.579375
C 0.916492 -0.671727 0.467904
C -1.643541 -0.263859 0.121449
C -0.496897 -1.192922 0.399203
C 1.346601 0.450257 -0.291118
C 1.856076 -1.384053 1.259426
C -1.630421 1.108032 0.495032
C -2.815364 -0.810318 -0.470082
C 2.698165 0.839637 -0.230938
C 3.199866 -0.966596 1.315395
C -2.764822 1.917641 0.268205
C -3.939557 0.002954 -0.710721
C 3.636466 0.154436 0.567697
C -3.916751 1.370796 -0.343012
H 0.645999 0.983421 -0.939181
H 1.510481 -2.263258 1.812012
H -0.752561 1.533326 0.992537
H -2.820268 -1.874930 -0.726314
H 3.920768 -1.509794 1.935110
H -2.751775 2.970072 0.571519
H -4.833274 -0.423553 -1.178824
H 4.680676 0.478102 0.602453
H -4.793137 2.002764 -0.525110


