%chk=000019676.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019676

0 1
 Br  -6.449900      0.6555000     -0.6431000    
 Cl   3.299800      -2.349800     -0.2167000    
 S    3.742300      0.8431000     -3.7900001E-02
 O   -1.694800       2.239700      0.4287000    
 O   -2.305700      -2.345800      0.1705000    
 O    3.682100       2.137200      0.6212000    
 O    4.706900     -0.1535000      0.3973000    
 N   -2.424000      3.9999999E-04  0.3458000    
 N    3.913300       1.082200      -1.719500    
 C  -0.2010000      0.4134000      0.2129000    
 C  -0.3835000     -0.9595000      0.1356000    
 C   -1.516400       1.038700      0.3451000    
 C   -1.818300      -1.231600      0.2171000    
 C    1.052500      0.9874000      0.1615000    
 C    2.143400      0.1238000      2.8100001E-02
 C   -3.856500      0.1838000      0.4685000    
 C   0.6780000      -1.830800      2.7000001E-03
 C    1.958000      -1.271700     -5.0700001E-02
 C   -4.526000      0.4377000     -0.8673000    
 H    1.165400       2.064100      0.2154000    
 H   -4.280900     -0.7113000      0.9387000    
 H   -4.034700       1.031000       1.141700    
 H   0.5183000      -2.901900     -5.7200000E-02
 H   -4.383900     -0.3978000      -1.558800    
 H   -4.159400       1.353000      -1.340700    
 H    3.878700       2.047000      -2.070600    
 H    4.577400      0.4807000      -2.222100    


%chk=000019676-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019676

0 1
Br -6.652491 0.628156 -0.473418
Cl 3.364192 -2.294601 -0.571345
S 3.817910 1.027743 -0.057795
O -1.903201 2.262212 0.635634
O -2.458538 -2.379250 0.040785
O 3.491887 2.615659 0.068189
O 4.816278 0.274763 0.971618
N -2.525132 -0.022533 0.381848
N 4.349393 0.765412 -1.783966
C -0.249279 0.445222 0.214951
C -0.418559 -0.948464 0.035948
C -1.595849 1.064918 0.437242
C -1.881905 -1.270986 0.138023
C 1.020817 1.035404 0.172218
C 2.109936 0.170748 -0.055809
C -3.976945 0.132247 0.569011
C 0.664684 -1.804743 -0.197189
C 1.952041 -1.216776 -0.242930
C -4.665907 0.422292 -0.776837
H 1.186833 2.110159 0.306894
H -4.368128 -0.801347 1.006654
H -4.146630 0.965189 1.271600
H 0.526561 -2.879923 -0.340945
H -4.559084 -0.409647 -1.488229
H -4.333034 1.372976 -1.218316
H 4.647099 1.674038 -2.174852
H 5.068153 0.026134 -1.822782


