%chk=000040989.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040989

0 1
 Br   4.600700     -1.3300000E-02 -0.3943000    
 Cl  -4.181600     -3.1599998E-02  -1.124200    
 S   -1.770600      1.2200000E-02  0.4361000    
 O   -2.160900      -1.238900       1.074200    
 O   -2.130100       1.282200       1.053300    
 C  -3.9799999E-02  5.2999998E-03  0.2095000    
 C   -2.418000     -7.7999998E-03  -1.223100    
 C   0.6546000       1.210300      0.1034000    
 C   0.6490000      -1.205500      0.1358000    
 C    2.037800       1.204600     -7.6499999E-02
 C    2.032300      -1.211300     -4.4000000E-02
 C    2.726700     -6.0999999E-03 -0.1502000    
 H   -2.071900     -0.9088000      -1.733600    
 H   -2.094100      0.8938000      -1.747100    
 H   0.1381000       2.164800      0.1507000    
 H   0.1273000      -2.155600      0.2095000    
 H    2.563700       2.152200     -0.1591000    
 H    2.553800      -2.163200     -0.1009000    


%chk=000040989-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040989

0 1
Br 4.708127 -0.015339 -0.446027
Cl -4.351880 -0.029615 -1.340737
S -1.835696 0.013685 0.524001
O -2.225259 -1.411454 1.217319
O -2.218247 1.459414 1.177651
C 0.037204 0.004948 0.203460
C -2.530186 -0.009530 -1.334896
C 0.698021 1.240509 0.110995
C 0.691773 -1.235942 0.143099
C 2.098146 1.232465 -0.085183
C 2.091858 -1.240035 -0.053148
C 2.771596 -0.006838 -0.172808
H -2.134761 -0.934720 -1.773694
H -2.154667 0.917160 -1.787788
H 0.145429 2.179549 0.222165
H 0.134527 -2.169027 0.278549
H 2.651003 2.172774 -0.159930
H 2.640011 -2.184704 -0.103528


