%chk=000096714.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096714

0 1
 Br   2.702300      -1.503900      0.2765000    
 O   -2.918500      0.3910000      0.8214000    
 N  -0.8812000      0.2342000     -0.2617000    
 N  -0.1603000       1.367100     -0.2056000    
 C  -0.1368000     -0.9002000     -0.1221000    
 C    1.086700      0.9243000     -2.3700001E-02
 C    1.161400     -0.4803000      3.5799999E-02
 C   -2.310200      0.3181000     -0.4550000    
 C  -0.7288000      -2.251600     -0.1531000    
 C    2.185400       1.901200      8.7499999E-02
 H   -2.537800       1.220900      -1.030100    
 H   -2.664400     -0.5628000     -0.9963000    
 H   -1.564500      -2.331800      0.5500000    
 H   -1.095500      -2.489300      -1.156900    
 H  -9.9999997E-05  -3.020000      0.1224000    
 H    1.824700       2.932100      3.8000001E-03
 H    2.690900       1.804300       1.053800    
 H    2.923700       1.742900     -0.7053000    
 H   -3.878100      0.4508000      0.6770000    


%chk=000096714-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096714

0 1
Br 2.669783 -1.524186 0.436395
O -3.155768 0.169064 0.660715
N -0.963491 0.175518 -0.405145
N -0.225509 1.368878 -0.305508
C -0.192240 -0.958418 -0.170981
C 1.050229 0.968742 -0.023762
C 1.099658 -0.461285 0.065195
C -2.407070 0.273794 -0.586596
C -0.742563 -2.351680 -0.192111
C 2.160033 1.963728 0.141547
H -2.585562 1.235205 -1.101208
H -2.768174 -0.568482 -1.194336
H -1.648062 -2.434139 0.435415
H -1.006966 -2.674610 -1.217212
H 0.012490 -3.055718 0.193353
H 1.768327 2.986040 0.016780
H 2.625022 1.881065 1.140929
H 2.959484 1.798350 -0.603822
H -2.950721 0.955135 1.228753


