%chk=000101663.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101663

0 1
 Br   2.256300       2.933100     -0.4014000    
 F    2.924400      -2.177000      0.5838000    
 O   -2.133900       1.243300       1.399500    
 O    3.833300      0.3899000      0.4784000    
 O   -3.839800       1.225700     -0.1042000    
 N   -3.651700      -1.539100     -0.1185000    
 C   -1.475400     -0.8332000     -0.9965000    
 C   -2.449100     -0.7620000      0.1878000    
 C  -5.4800000E-02 -0.4964000     -0.6035000    
 C   0.3727000      0.8190000     -0.6695000    
 C   0.7896000      -1.511200     -0.1858000    
 C   -2.902200      0.6619000      0.4422000    
 C    1.683400       1.128800     -0.3066000    
 C    2.100200      -1.201400      0.1772000    
 C    2.547100      0.1186000      0.1170000    
 H   -1.797400     -0.1704000      -1.811500    
 H   -1.475100      -1.844600      -1.426900    
 H   -2.010800      -1.178300       1.101900    
 H  -0.3053000       1.600300      -1.003400    
 H   0.4502000      -2.541500     -0.1329000    
 H   -4.106300      -1.168500     -0.9521000    
 H   -4.323500      -1.456200      0.6434000    
 H   -2.416900       2.163700       1.586400    
 H    3.982100       1.346300      0.3801000    


%chk=000101663-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101663

0 1
Br 2.344535 2.988653 -0.748282
F 3.001815 -2.070132 0.764990
O -2.874138 0.825078 1.931946
O 3.926773 0.488308 0.428211
O -2.716080 1.668242 -0.229264
N -3.793479 -1.362942 -0.208459
C -1.489780 -0.926442 -1.021987
C -2.484375 -0.786569 0.158729
C -0.065735 -0.530825 -0.662663
C 0.388081 0.799710 -0.847484
C 0.828987 -1.486608 -0.116380
C -2.662485 0.690560 0.553475
C 1.703217 1.145141 -0.488484
C 2.131121 -1.110445 0.231757
C 2.617419 0.210288 0.059791
H -1.857157 -0.305877 -1.860959
H -1.533747 -1.983548 -1.338062
H -2.102825 -1.333932 1.036774
H -0.288882 1.552776 -1.260506
H 0.524199 -2.527301 0.034203
H -4.242193 -0.910176 -1.011769
H -4.434197 -1.508487 0.577135
H -3.056776 1.779798 2.151539
H 4.132804 1.445528 0.250648


