%chk=000086465.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086465

0 1
 Br   5.562000     -3.6100000E-02   1.342300    
 S  -0.1879000     -0.2933000      -1.514400    
 O  -0.2938000      0.9276000      -2.322100    
 O  -0.2876000      -1.600600      -2.171800    
 O   -1.906600       2.043500     -6.6500001E-02
 O  -0.4464000       1.177400       1.500300    
 C   -1.402100     -0.2433000     -0.2025000    
 C   -2.809900     -0.2727000     -0.8154000    
 C   -1.173000      -1.431200      0.7435000    
 C   -3.909500     -0.4346000      0.2344000    
 C   -2.284500      -1.583800       1.782000    
 C   -3.660900      -1.643600       1.129100    
 C   -1.177300       1.055700      0.5265000    
 C    1.401800     -0.2221000     -0.7246000    
 C    2.019800      -1.401500     -0.3624000    
 C    1.977400       1.010600     -0.4940000    
 C    3.268000      -1.345700      0.2579000    
 C    3.225600       1.066400      0.1261000    
 C   -1.786000       3.339000      0.5293000    
 C    3.870800     -0.1117000      0.5021000    
 H   -2.880500      -1.133800      -1.495200    
 H   -3.026500      0.5947000      -1.450200    
 H  -0.2243000      -1.347600       1.284800    
 H   -1.118500      -2.365700      0.1704000    
 H   -4.877600     -0.5469000     -0.2672000    
 H   -3.978100      0.4697000      0.8505000    
 H   -2.252100     -0.7477000       2.490800    
 H   -2.116500      -2.496500       2.365100    
 H   -4.434500      -1.694400       1.903600    
 H   -3.743800      -2.561800      0.5346000    
 H    1.565100      -2.370600     -0.5408000    
 H    1.490100       1.938700     -0.7752000    
 H    3.756900      -2.272900      0.5456000    
 H    3.681100       2.036000      0.3103000    
 H  -0.7483000       3.682400      0.4803000    
 H   -2.136900       3.312800       1.565300    
 H   -2.412900       4.033000     -3.6699999E-02


%chk=000086465-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086465

0 1
Br 5.819567 -1.037146 1.320185
S -0.052846 0.080408 -1.508519
O -0.008201 1.597807 -2.119053
O -0.309867 -1.218986 -2.475322
O -2.460038 2.230369 -0.090849
O -0.673077 1.823259 1.342711
C -1.566647 -0.007477 -0.031704
C -2.807653 -0.425904 -0.816319
C -1.102569 -1.050338 0.986071
C -3.966188 -0.758887 0.167537
C -2.266693 -1.369485 1.968900
C -3.538376 -1.815758 1.211584
C -1.510303 1.413801 0.497568
C 1.602085 -0.238239 -0.644272
C 2.146578 -1.529027 -0.740571
C 2.250732 0.832469 -0.006438
C 3.410087 -1.767564 -0.153650
C 3.512505 0.589700 0.582456
C -2.355938 3.675413 0.231550
C 4.069487 -0.705763 0.503601
H -2.554017 -1.324264 -1.412514
H -3.115509 0.369157 -1.514848
H -0.223842 -0.685054 1.544742
H -0.822874 -1.980219 0.452242
H -4.831195 -1.120207 -0.419441
H -4.289197 0.168313 0.680647
H -2.488063 -0.470106 2.577305
H -1.931813 -2.156376 2.670529
H -4.361226 -1.994437 1.929666
H -3.341758 -2.779976 0.699673
H 1.611447 -2.313345 -1.286013
H 1.797411 1.826813 0.027044
H 3.869954 -2.757557 -0.214168
H 4.047067 1.396570 1.090554
H -1.400840 4.064952 -0.157317
H -2.405005 3.828500 1.322382
H -3.210586 4.137985 -0.280150


