%chk=000075302.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075302

0 1
 Br   4.553600     -1.1000000E-02 -0.3496000    
 S   -1.825600      1.3800000E-02  0.4205000    
 O   -2.215100       1.282700       1.023500    
 O   -2.197200      -1.237300       1.070400    
 N   -2.345100     -3.4000000E-03  -1.222600    
 N   -3.725400     -5.0900001E-02  -1.200800    
 C  -9.2299998E-02  6.5000001E-03  0.2106000    
 C   0.6032000       1.211700      0.1132000    
 C   0.5969000      -1.204200      0.1406000    
 C    1.987900       1.206100     -5.4499999E-02
 C    1.981800      -1.209600     -2.6900001E-02
 C    2.677200     -4.4999998E-03 -0.1244000    
 H   8.5800000E-02   2.165900      0.1586000    
 H   7.5300001E-02  -2.154700      0.2070000    
 H    2.514700       2.153900     -0.1301000    
 H    2.503800      -2.161500     -8.1000000E-02
 H   -2.028200      0.7779000      -1.812200    
 H   -4.020500     -0.1857000      -2.166900    
 H   -4.047400      0.8800000     -0.9370000    


%chk=000075302-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000075302

0 1
Br 4.741598 -0.540307 -0.063021
S -1.762379 0.624158 0.220002
O -1.938699 1.989917 1.129683
O -2.448567 -0.813812 0.703163
N -2.971216 0.648532 -1.816428
N -3.733166 -0.445907 -1.623311
C 0.091063 0.278075 0.140173
C 0.968019 1.367112 0.278955
C 0.529731 -1.043911 -0.041668
C 2.358952 1.121339 0.220532
C 1.920831 -1.288730 -0.098800
C 2.812927 -0.201095 0.024492
H 0.576639 2.373845 0.457255
H -0.192487 -1.864237 -0.098880
H 3.069943 1.944776 0.328675
H 2.297905 -2.306517 -0.230508
H -3.491580 1.489321 -1.469100
H -3.324222 -1.319716 -1.959664
H -4.421891 -0.537142 -0.863148


