%chk=000235539.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235539

0 1
Br -4.551122 -0.038258 0.070128
S 0.537816 -2.570601 -0.011254
O 3.602642 1.479586 0.072733
O 0.298957 -2.807669 -1.668029
O 1.777690 -3.233398 0.307416
O -0.697966 -3.047725 0.564732
N 1.614386 3.245885 -0.060021
C -0.343244 0.042229 0.035392
C -0.079530 1.446867 0.003683
C 0.738354 -0.878223 0.040700
C 1.281639 1.913315 0.001981
C 2.057424 -0.420683 0.053163
C 2.321967 0.943225 0.042375
C -1.717109 -0.384749 0.068544
C -1.176081 2.368849 -0.029529
C -2.727241 0.534677 0.035782
C -2.474762 1.935677 -0.020029
H 2.894086 -1.134310 0.076431
H -1.949261 -1.461560 0.144586
H -0.967542 3.439027 -0.065792
H -3.308648 2.637588 -0.050245
H 0.918349 3.966975 -0.003850
H 2.585046 3.524027 -0.004907
H 4.285741 0.765479 0.051010
H -0.184993 -3.606830 -1.917800


%chk=000235539-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235539

0 1
Br -4.620584 -0.047266 -0.042667
S 0.560643 -2.673977 0.018315
O 3.640021 1.540775 0.059709
O 0.047554 -2.831461 -1.771630
O 2.022102 -3.344706 0.213936
O -0.686114 -3.215393 0.904811
N 1.643778 3.277104 0.019411
C -0.367439 0.056143 0.017923
C -0.077081 1.481171 0.011290
C 0.753211 -0.832827 0.038935
C 1.293020 1.943329 0.023432
C 2.081100 -0.391546 0.040186
C 2.342056 0.988378 0.043621
C -1.733877 -0.381963 0.006666
C -1.176332 2.398730 -0.012610
C -2.758009 0.558478 -0.020939
C -2.500267 1.960131 -0.030931
H 2.892655 -1.129829 0.049852
H -1.959276 -1.450685 0.037652
H -0.998207 3.479430 -0.018209
H -3.327855 2.673915 -0.051040
H 0.955991 4.022187 0.006679
H 2.634596 3.512639 0.028745
H 4.337097 0.841880 0.067202
H -0.262188 -3.775237 -1.903140


