%chk=000087075.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087075

0 1
 Br  -2.907200      -2.901500     -0.2457000    
 O    2.209000      0.1735000     -0.6234000    
 O    2.083500      -1.181300       1.261500    
 N  -0.3044000       2.503200      0.1426000    
 C  -0.2351000      0.2999000     -0.2014000    
 C   -1.082600       1.368300      9.9799998E-02
 C    1.077100      0.8334000     -0.3372000    
 C    1.002200       2.190000     -0.1202000    
 C  -0.7848000     -0.9932000     -0.3061000    
 C   -2.457900       1.207400      0.3024000    
 C   -2.158800      -1.169300     -0.1056000    
 C   -2.980600     -8.4399998E-02  0.1938000    
 C    2.630900     -0.8252000      0.2261000    
 C    3.908600      -1.420700     -0.2865000    
 H  -0.6487000       3.432700      0.3397000    
 H    1.760500       2.960500     -0.1288000    
 H  -0.1456000      -1.839000     -0.5447000    
 H   -3.098300       2.051400      0.5354000    
 H   -4.048100     -0.2260000      0.3484000    
 H    3.756900      -1.808700      -1.296900    
 H    4.207900      -2.250100      0.3607000    
 H    4.697900     -0.6652000     -0.2782000    


%chk=000087075-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087075

0 1
Br -2.998768 -2.946205 -0.143964
O 2.295598 0.194987 -0.519640
O 2.048500 -1.465172 1.127944
N -0.349577 2.569993 0.116925
C -0.260956 0.287927 -0.107311
C -1.137788 1.413404 0.096241
C 1.074395 0.838977 -0.202480
C 0.993293 2.222166 -0.066093
C -0.809084 -1.021051 -0.176528
C -2.535171 1.260830 0.230499
C -2.198784 -1.149727 -0.049509
C -3.067428 -0.040179 0.152769
C 2.709184 -0.960159 0.203883
C 4.035850 -1.431639 -0.345478
H -0.696846 3.517592 0.243235
H 1.788864 2.962180 -0.098447
H -0.167807 -1.895601 -0.300732
H -3.196636 2.119065 0.388855
H -4.144572 -0.200648 0.250342
H 3.945642 -1.651880 -1.423065
H 4.360635 -2.332418 0.194401
H 4.793857 -0.636744 -0.236147


