%chk=000077014.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077014

0 1
 Br   4.251800     -3.8000001E-03  7.0699997E-02
 S   -2.171000      1.8000000E-03 -0.1175000    
 O   -2.601600       1.263800     -0.7023000    
 O   -2.626700      -1.255200     -0.6952000    
 C  -0.4258000      7.9999998E-04 -6.5800004E-02
 C   0.2705000      -1.207700     -5.0000001E-02
 C   0.2722000       1.208200     -4.0300000E-02
 C   -2.663400     -4.8000002E-03   1.591500    
 C    1.664800      -1.208800     -8.7000001E-03
 C    1.666500       1.207100      7.9999998E-04
 C    2.362700     -1.4000000E-03  1.6700000E-02
 H  -0.2531000      -2.159500     -6.2899999E-02
 H  -0.2496000       2.161100     -4.4900000E-02
 H   -2.270200      0.8900000       2.077700    
 H   -3.754800      9.9999997E-05   1.629700    
 H   -2.278100     -0.9077000       2.069000    
 H    2.192200      -2.159100      4.4999998E-03
 H    2.195300       2.156600      2.1600001E-02


%chk=000077014-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077014

0 1
Br 4.379439 -0.004611 0.036944
S -2.239404 0.002016 -0.127343
O -2.691392 1.437016 -0.760799
O -2.692800 -1.428835 -0.769508
C -0.334086 0.000202 -0.037184
C 0.325349 -1.238057 -0.046719
C 0.327755 1.237237 -0.036339
C -2.801318 -0.002847 1.709899
C 1.739307 -1.238540 -0.022575
C 1.741714 1.234914 -0.012231
C 2.421941 -0.002568 0.002891
H -0.244088 -2.171677 -0.104321
H -0.239725 2.172533 -0.085824
H -2.400804 0.911999 2.166733
H -3.899160 -0.001763 1.665761
H -2.402513 -0.920887 2.161874
H 2.293645 -2.180489 -0.032402
H 2.297838 2.175859 -0.014257


