%chk=000030709.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030709

0 1
 Br   5.092900       1.452300     -3.5000001E-03
 Cl   2.144500      -2.910600       1.581900    
 Cl   2.324300       2.459500      -1.597000    
 S   -1.446100      -1.563900      -2.654200    
 P   -1.493800      -1.245100     -0.7180000    
 O  -0.1001000      -1.656100      2.5800001E-02
 O   -2.489400      -2.291200      5.2000001E-02
 C   -1.936800      0.3253000      3.0000000E-03
 C    1.071200     -0.9586000      2.1400001E-02
 C   -1.564100      0.6036000       1.308800    
 C   -2.646900       1.244400     -0.7538000    
 C   -1.910300       1.831800       1.872200    
 C   -2.993000       2.472600     -0.1904000    
 C    2.194400      -1.426500      0.7035000    
 C    1.133500      0.2438000     -0.6825000    
 C   -2.624700       2.766200       1.122500    
 C    2.319000      0.9785000     -0.7046000    
 C    3.380000     -0.6919000      0.6818000    
 C    3.442200      0.5108000     -2.2299999E-02
 C   -3.896900      -2.144800     -4.6799999E-02
 H   -1.027600     -0.1203000       1.913200    
 H   -2.946700       1.028500      -1.773500    
 H   -1.627900       2.058500       2.896100    
 H   -3.550800       3.199700     -0.7733000    
 H   0.2962000      0.6269000      -1.251800    
 H   -2.895600       3.721800       1.561700    
 H    4.253400      -1.061000       1.215500    
 H   -4.192900      -1.865200      -1.060800    
 H   -4.238200      -1.386300      0.6620000    
 H   -4.364100      -3.099500      0.2072000    


%chk=000030709-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000030709

0 1
Br 5.526005 0.145930 -1.343103
Cl 1.205705 0.418978 2.284975
Cl 3.386876 -1.405062 -3.478034
S -1.643073 0.160871 -2.586150
P -1.832323 -0.331314 -0.591434
O -0.345820 -1.081936 0.135315
O -2.883589 -1.626066 -0.149802
C -2.367329 0.963603 0.598731
C 0.954082 -0.752450 -0.248460
C -2.685213 0.600155 1.929395
C -2.441701 2.305857 0.162946
C -3.087162 1.606180 2.833279
C -2.841825 3.303658 1.078706
C 1.819883 -0.094665 0.662799
C 1.462622 -1.140107 -1.511061
C -3.163131 2.955059 2.411051
C 2.804519 -0.878352 -1.847830
C 3.163089 0.158657 0.333248
C 3.661912 -0.230638 -0.930357
C -2.773310 -2.899601 -0.896302
H -2.624317 -0.445256 2.244860
H -2.198026 2.558182 -0.875407
H -3.338355 1.338517 3.864891
H -2.903335 4.346757 0.751740
H 0.801512 -1.640237 -2.222592
H -3.473314 3.731751 3.118686
H 3.817731 0.657238 1.051962
H -1.823674 -3.404723 -0.648249
H -2.843534 -2.719217 -1.984861
H -3.629204 -3.498570 -0.552840


