%chk=000021413.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021413

0 1
 Br  -3.906800      0.7438000     -9.9999997E-05
 N  -0.5315000      -1.655600       0.000000    
 C   0.2590000      0.6210000       0.000000    
 C   0.4842000     -0.7716000     -9.9999997E-05
 C    1.342900       1.515200       0.000000    
 C   -1.066900       1.074800       0.000000    
 C    1.801500      -1.221900       0.000000    
 C    2.650200       1.037300       0.000000    
 C    2.879400     -0.3330000     -9.9999997E-05
 C   -2.115600      0.1663000      9.9999997E-05
 C   -1.796500      -1.176400      9.9999997E-05
 H   -1.273700       2.143500       0.000000    
 H    1.174700       2.589900      9.9999997E-05
 H    2.007800      -2.290700       0.000000    
 H    3.485100       1.731200       0.000000    
 H    3.896200     -0.7147000     -9.9999997E-05
 H   -2.564700      -1.944000      9.9999997E-05


%chk=000021413-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021413

0 1
Br -4.000396 0.718639 0.000040
N -0.544784 -1.688457 0.000006
C 0.259637 0.666000 0.000003
C 0.496055 -0.765800 -0.000011
C 1.378660 1.560490 -0.000003
C -1.101119 1.119021 0.000020
C 1.840891 -1.254133 -0.000017
C 2.681005 1.055123 -0.000018
C 2.913329 -0.358514 -0.000031
C -2.117889 0.168342 0.000029
C -1.808643 -1.231270 0.000027
H -1.324079 2.190789 0.000026
H 1.199545 2.642268 0.000000
H 1.989508 -2.338169 -0.000020
H 3.534881 1.741301 -0.000025
H 3.941790 -0.735600 -0.000046
H -2.613091 -1.974929 0.000023


