%chk=000023619.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023619

0 1
 Br  -4.339100      6.3600004E-02 -0.3632000    
 N    3.713700      4.6900000E-02 -0.3951000    
 C    1.834200     -8.6900003E-02  0.5395000    
 C    2.669600       1.048800     -6.8099998E-02
 C    2.659600     -0.9968000     -0.3812000    
 C   0.2903000     -4.5200001E-02  0.3120000    
 C  -0.4339000      -1.235700      0.2514000    
 C  -0.3655000       1.178000      0.1719000    
 C   -1.813800      -1.203200      5.0900001E-02
 C   -1.745400       1.210600     -2.8700000E-02
 C   -2.469700      2.0000000E-02 -8.9400001E-02
 H    2.080500     -0.2482000       1.600800    
 H    2.251800       1.529000     -0.9613000    
 H    2.992200       1.825800      0.6310000    
 H    2.973100      -1.950800      5.2400000E-02
 H    2.223800      -1.184300      -1.370300    
 H    4.169200      0.1824000      -1.296000    
 H   6.5800004E-02  -2.194100      0.3635000    
 H   0.1775000       2.116800      0.2288000    
 H   -2.363400      -2.139900      6.8999999E-03
 H   -2.241600       2.172000     -0.1335000    


%chk=000023619-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023619

0 1
Br -4.442268 0.042996 -0.326162
N 3.734564 0.015412 -0.455609
C 1.814659 -0.032246 0.507762
C 2.715872 1.082349 -0.136720
C 2.705060 -1.071593 -0.265402
C 0.319147 -0.011940 0.276841
C -0.409992 -1.219321 0.124960
C -0.396974 1.211998 0.245418
C -1.812236 -1.214842 -0.051362
C -1.799198 1.239577 0.070118
C -2.490793 0.020314 -0.076183
H 2.022043 -0.098125 1.592329
H 2.228543 1.541038 -1.024652
H 3.091753 1.878630 0.529237
H 3.072581 -1.945348 0.300561
H 2.212257 -1.415761 -1.200724
H 4.205164 0.067732 -1.369794
H 0.117764 -2.180038 0.143831
H 0.140511 2.160638 0.358960
H -2.361249 -2.153799 -0.167984
H -2.338307 2.191128 0.046875


