%chk=000087684.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087684

0 1
 Br  -4.750600       1.100400     -0.2299000    
 O    2.992200       1.750600      5.6800000E-02
 O    3.596900     -0.3164000     -0.3683000    
 N  -0.7774000     -2.7200000E-02  0.3498000    
 N    1.042500      -1.210100     -0.1205000    
 N    2.698600      0.5301000     -9.4599999E-02
 C   -2.160800      0.2910000      0.6133000    
 C  -0.2569000      -1.260500      7.1699999E-02
 C   0.2562000      0.8665000      0.3342000    
 C    1.368800      0.1130000      4.2300001E-02
 C   -2.911300      0.6355000     -0.6599000    
 C   -1.098200      -2.472900      4.9000001E-03
 H   -2.173100       1.135200       1.314200    
 H   -2.620500     -0.5541000       1.137400    
 H   0.1128000       1.921600      0.5244000    
 H   -2.480400       1.501700      -1.170600    
 H   -2.953600     -0.2038000      -1.359400    
 H   -1.535900      -2.700200      0.9818000    
 H   -1.903600      -2.359800     -0.7266000    
 H  -0.4970000      -3.336700     -0.2973000    


%chk=000087684-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000087684

0 1
Br -4.820383 1.172161 -0.295232
O 2.902309 1.853038 0.044293
O 3.688203 -0.244456 -0.437576
N -0.782651 -0.043910 0.383604
N 1.055081 -1.272285 -0.139427
N 2.744388 0.574530 -0.137417
C -2.195708 0.307105 0.630801
C -0.271594 -1.330051 0.083395
C 0.280684 0.854292 0.336754
C 1.391628 0.070051 0.016531
C -2.888863 0.728500 -0.678542
C -1.104500 -2.573569 0.049328
H -2.242380 1.125967 1.367987
H -2.707758 -0.565983 1.067644
H 0.187041 1.917458 0.533309
H -2.450249 1.639758 -1.111517
H -2.908878 -0.080218 -1.424168
H -1.538992 -2.811234 1.038509
H -1.935061 -2.507702 -0.677723
H -0.453616 -3.409554 -0.246852


