%chk=000073010.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073010

0 1
 Br   3.817500       1.543900     -0.9291000    
 Br   4.161300      8.0200002E-02   1.905200    
 Br   3.736700      -1.687500     -0.7386000    
 N   -1.177400      -1.187700     -0.2766000    
 N   -1.212800       1.211600     -0.2643000    
 N   -3.198700     -2.0300001E-02  0.2797000    
 N   -3.133200      -2.364600      0.2609000    
 N   -3.202300       2.324700      0.2849000    
 C   0.8243000      4.4700000E-02 -0.8230000    
 C    1.740200      5.2800000E-02  0.4140000    
 C  -0.6323000      2.1100000E-02 -0.4250000    
 C    3.252100     -1.0000000E-03  0.1433000    
 C   -2.471200      -1.130900      7.8599997E-02
 C   -2.504100       1.113100      9.0000004E-02
 H   0.9969000      0.9299000      -1.444600    
 H    1.021800     -0.8279000      -1.454600    
 H    1.505400      0.9530000       1.000900    
 H    1.457900     -0.7941000       1.056700    
 H   -2.624600      -3.226700      0.1218000    
 H   -4.107300      -2.371000      0.5299000    
 H   -2.719600       3.202900      0.1548000    
 H   -4.176200       2.299400      0.5537000    


%chk=000073010-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000073010

0 1
Br 3.816096 1.681500 -0.843367
Br 4.179619 0.034587 1.975852
Br 3.837879 -1.613161 -0.845504
N -1.200667 -1.211151 -0.285029
N -1.221184 1.217098 -0.302734
N -3.251120 -0.010005 0.305425
N -3.160712 -2.351759 0.306584
N -3.200480 2.332717 0.271965
C 0.846797 0.015848 -0.872642
C 1.723320 0.019432 0.408042
C -0.612989 0.006712 -0.474339
C 3.239345 0.029601 0.173457
C -2.526104 -1.155790 0.105950
C -2.545658 1.144840 0.089085
H 1.050189 0.919343 -1.469698
H 1.061062 -0.884130 -1.471351
H 1.479033 0.912042 1.014404
H 1.490136 -0.878170 1.011323
H -2.641692 -3.213673 0.158615
H -4.136298 -2.357981 0.593058
H -2.696067 3.200993 0.111198
H -4.176106 2.326707 0.558305


