%chk=000095051.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095051

0 1
 Br  -4.797300      -1.718300      8.5299999E-02
 S   0.6407000       1.700900     -5.4400001E-02
 O   0.7011000       2.385000      -1.327800    
 O   0.7412000       2.430300       1.191000    
 N    1.792100      0.4310000     -4.8200000E-02
 C    1.703100     -0.5151000      -1.199400    
 C    1.947300     -0.2817000       1.254200    
 C    2.967600      -1.365600      -1.261900    
 C    3.215800      -1.128000       1.226200    
 C    3.206200      -2.103600      5.2499998E-02
 C  -0.8527000      0.7608000     -1.6000001E-02
 C   -1.408900      0.4215000       1.206200    
 C   -1.444100      0.3790000      -1.209100    
 C   -2.589500     -0.3205000       1.236500    
 C   -2.624900     -0.3629000      -1.179000    
 C   -3.197700     -0.7127000      4.3900002E-02
 H    1.608900      3.8600001E-02  -2.138900    
 H   0.8386000      -1.177200      -1.087800    
 H    1.082100     -0.9259000       1.441800    
 H    2.032600      0.4376000       2.074600    
 H    3.830700     -0.7231000      -1.476500    
 H    2.890200      -2.087100      -2.082900    
 H    3.314200      -1.681400       2.166700    
 H    4.091800     -0.4725000       1.143200    
 H    2.418000      -2.851500      0.2026000    
 H    4.158700      -2.643200      8.9999996E-03
 H  -0.9500000      0.7141000       2.145600    
 H   -1.014700      0.6394000      -2.171600    
 H   -3.022400     -0.5858000       2.197700    
 H   -3.085700     -0.6611000      -2.117300    


%chk=000095051-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095051

0 1
Br -5.242395 -1.501091 0.170010
S 0.598781 1.609344 -0.089580
O 0.683354 2.295776 -1.561655
O 0.749429 2.438586 1.301807
N 1.971924 0.323881 -0.058985
C 1.924348 -0.573822 -1.243433
C 2.044012 -0.395396 1.240316
C 3.259814 -1.356409 -1.278161
C 3.385751 -1.167482 1.257169
C 3.484637 -2.124311 0.045577
C -1.074227 0.712891 -0.012092
C -1.636873 0.453264 1.249069
C -1.698860 0.366411 -1.222072
C -2.884346 -0.209619 1.302591
C -2.946472 -0.295766 -1.166953
C -3.515423 -0.580412 0.094355
H 1.813875 0.050056 -2.146737
H 1.072310 -1.293453 -1.186867
H 1.199826 -1.115444 1.367420
H 2.010027 0.351202 2.051666
H 4.083991 -0.637655 -1.442278
H 3.240489 -2.051230 -2.139333
H 3.461688 -1.726594 2.209177
H 4.213406 -0.434805 1.227821
H 2.719679 -2.922280 0.144049
H 4.470898 -2.624122 0.033384
H -1.133785 0.789987 2.161351
H -1.240931 0.637064 -2.179077
H -3.356307 -0.422844 2.265532
H -3.465622 -0.574728 -2.087874


