%chk=000097095.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097095

0 1
 Br   4.673000      -2.283200     -0.9877000    
 Br  -5.051800       1.436800      -1.614100    
 O  -0.1158000       1.211300       1.362300    
 N   0.3667000      0.4161000      0.4840000    
 N  -0.3118000     -0.4043000     -0.2284000    
 C    1.802500      0.4313000      0.2415000    
 C   -1.696400     -0.4560000     -3.9299998E-02
 C    2.418300     -0.7284000     -0.1787000    
 C    2.497000       1.605300      0.4420000    
 C   -2.534400      0.3702000     -0.7882000    
 C   -2.239700      -1.335000      0.8978000    
 C    3.793800     -0.7133000     -0.4097000    
 C    3.872500       1.620400      0.2111000    
 C    4.520900      0.4611000     -0.2148000    
 C   -3.915500      0.3173000     -0.6003000    
 C   -3.620700      -1.387800       1.085800    
 C   -4.458600     -0.5617000      0.3367000    
 H    1.861700      -1.650700     -0.3205000    
 H    2.007300       2.518700      0.7656000    
 H   -2.104000       1.053000      -1.517500    
 H   -1.594700      -1.982900       1.485700    
 H    4.438400       2.535200      0.3611000    
 H    5.593200      0.4900000     -0.3908000    
 H   -4.043500      -2.072300       1.815400    
 H   -5.532600     -0.6153000      0.4956000    


%chk=000097095-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097095

0 1
Br 4.161024 -0.325426 -3.123033
Br -4.834664 -1.497736 -2.545737
O 0.197103 0.603545 2.042448
N 0.472151 0.273872 0.793408
N -0.372728 -0.126058 -0.142343
C 1.885731 0.355877 0.373665
C -1.757422 -0.245553 0.122440
C 2.255732 0.025677 -0.950466
C 2.832529 0.772171 1.333109
C -2.477793 -0.699124 -1.028833
C -2.468377 0.022347 1.335311
C 3.615187 0.124515 -1.294087
C 4.188004 0.858895 0.951826
C 4.594566 0.536742 -0.363618
C -3.864677 -0.875726 -0.955205
C -3.865430 -0.168487 1.367546
C -4.582627 -0.616617 0.234064
H 1.493044 -0.291814 -1.662617
H 2.495376 1.016205 2.342741
H -1.917519 -0.898097 -1.945865
H -1.929103 0.368987 2.215517
H 4.938223 1.179634 1.681366
H 5.645838 0.604721 -0.656779
H -4.412278 0.036076 2.294127
H -5.666091 -0.758826 0.275615


