%chk=000038779.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038779

0 1
 Br  -5.877500     -0.7625000     -0.7999000    
 Cl  -2.200700       2.451200       1.801800    
 S    2.871600       1.117100      0.3216000    
 P    1.138200      0.2030000     -0.4445000    
 O  -0.1585000      0.8798000      0.2539000    
 O    1.076000      -1.345500      4.7400001E-02
 O    1.120900      0.3312000      -1.946200    
 C    4.248600      0.2296000     -0.4335000    
 C    5.578800      0.8011000      4.4500001E-02
 C    6.750400      5.8899999E-02 -0.5817000    
 C   -1.461500      0.5236000      3.0900000E-02
 C    1.083400      -1.654000       1.430500    
 C   -2.505200       1.172300      0.6847000    
 C   -1.724700     -0.5057000     -0.8685000    
 C    1.018200      -3.156800       1.600900    
 C   -3.823100      0.7885000      0.4372000    
 C   -3.042800     -0.8894000      -1.116000    
 C   -4.092000     -0.2424000     -0.4632000    
 H    4.165000      0.3125000      -1.521900    
 H    4.169100     -0.8298000     -0.1691000    
 H    5.655000       1.863400     -0.2175000    
 H    5.657700      0.7249000       1.135900    
 H    6.727700      0.1397000      -1.673100    
 H    7.697300      0.4799000     -0.2295000    
 H    6.730300      -1.002500     -0.3146000    
 H    1.999900      -1.272800       1.889000    
 H   0.2243000      -1.184600       1.918400    
 H  -0.9517000      -1.040700      -1.406000    
 H    1.023300      -3.430800       2.659600    
 H   0.1113000      -3.557800       1.136300    
 H    1.868700      -3.638100       1.106900    
 H   -4.640900       1.293800      0.9466000    
 H   -3.235900      -1.693900      -1.821000    


%chk=000038779-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038779

0 1
Br -5.062730 1.037526 -1.955799
Cl -1.652464 0.839813 2.581940
S 3.399287 -0.315543 1.475125
P 1.671312 -1.023268 0.179370
O 0.516549 0.262113 0.591604
O 0.976098 -2.429753 0.894420
O 1.966133 -1.229950 -1.367997
C 4.664999 -0.163795 0.042094
C 4.549653 1.165796 -0.714945
C 5.657928 1.286258 -1.786882
C -0.746289 0.369106 -0.025908
C 0.755333 -2.481159 2.377489
C -1.860344 0.689248 0.786538
C -0.926166 0.242337 -1.424720
C 0.204350 -3.873570 2.664183
C -3.137370 0.895280 0.229547
C -2.200834 0.431480 -1.998355
C -3.290199 0.760742 -1.165833
H 4.511901 -1.028820 -0.624886
H 5.635858 -0.270957 0.558144
H 3.556824 1.224610 -1.198011
H 4.616689 2.008276 -0.001577
H 5.590545 0.466801 -2.525942
H 5.563437 2.241602 -2.333242
H 6.665791 1.255768 -1.331915
H 1.724910 -2.307540 2.883635
H 0.042987 -1.684330 2.660474
H -0.067449 -0.013031 -2.053575
H 0.019836 -3.981775 3.749079
H -0.747097 -4.034549 2.130400
H 0.920280 -4.651219 2.349907
H -3.983045 1.147830 0.873575
H -2.335512 0.327872 -3.078035


