%chk=000137099.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137099

0 1
 Br   6.312000     -1.9999999E-04 -0.3257000    
 Br  -6.310900     -1.9999999E-04  0.3268000    
 N   0.2972000      5.0000002E-04  0.5514000    
 N  -0.2965000      3.9999999E-04 -0.5525000    
 C    1.681300      3.0000001E-04  0.3500000    
 C   -1.687200      3.0000001E-04 -0.3497000    
 C    2.371600       1.208000      0.2496000    
 C   -2.370800       1.208100     -0.2499000    
 C    2.371200      -1.207900      0.2491000    
 C   -2.370400      -1.207900     -0.2494000    
 C    3.751800       1.207800      4.7899999E-02
 C   -3.750900       1.207900     -4.7899999E-02
 C    3.751500      -1.208200      4.7600001E-02
 C   -3.750600      -1.208300     -4.7600001E-02
 C    4.441900     -1.9999999E-04 -5.2800000E-02
 C   -4.441000     -3.0000001E-04  5.3199999E-02
 H    1.842900       2.154500      0.3276000    
 H   -1.841100       2.153800     -0.3283000    
 H    1.842000      -2.154200      0.3267000    
 H   -1.840300      -2.153300     -0.3274000    
 H    4.274600       2.157700     -2.8100001E-02
 H   -4.273800       2.157800      2.8200001E-02
 H    4.274000      -2.158300     -2.8800000E-02
 H   -4.273100      -2.158300      2.8999999E-02


%chk=000137099-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137099

0 1
Br 6.543628 -0.000135 -0.232839
Br -6.542628 0.000114 0.237749
N 0.373759 0.000118 0.524025
N -0.373104 -0.000398 -0.527886
C 1.800921 0.000188 0.259764
C -1.800970 -0.000141 -0.261874
C 2.500723 1.227957 0.197982
C -2.500226 1.227768 -0.199159
C 2.500208 -1.227699 0.194489
C -2.500000 -1.227999 -0.195741
C 3.904780 1.229283 0.048806
C -3.904134 1.229276 -0.047907
C 3.904264 -1.229199 0.045381
C -3.903908 -1.229348 -0.044514
C 4.592626 -0.000001 -0.026537
C -4.591875 0.000003 0.028483
H 1.956595 2.175374 0.265910
H -1.956088 2.175092 -0.268041
H 1.955663 -2.175068 0.259686
H -1.955681 -2.175410 -0.261971
H 4.448952 2.176425 -0.010380
H -4.448276 2.176384 0.012004
H 4.448049 -2.176395 -0.016431
H -4.447875 -2.176390 0.018001


