%chk=000220712.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220712

0 1
Br 2.972424 -2.200827 -0.001099
S -0.163168 -1.846346 -0.001861
O -2.991090 -1.333682 -0.001207
O 2.222568 2.315911 0.004339
O 3.625715 0.673331 0.002334
N 2.497443 1.123656 0.002591
C -0.919190 -0.291722 -0.000446
C -3.055674 1.081484 -0.000601
C -2.398472 -0.276942 -0.000890
C 0.007635 0.711587 0.001096
C 1.355589 0.204287 0.001043
C -4.574734 0.977921 -0.005962
C 1.424835 -1.176047 -0.000556
H -2.715393 1.658795 0.886579
H -2.709446 1.662745 -0.882789
H -0.194394 1.781183 0.002273
H -4.943720 0.427931 0.871057
H -5.043796 1.968046 -0.004639
H -4.937932 0.433089 -0.888560


%chk=000220712-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220712

0 1
Br 3.029049 -2.297389 0.000200
S -0.124681 -1.974810 -0.001737
O -3.064884 -1.370744 -0.003484
O 2.161459 2.428778 0.003882
O 3.692895 0.732047 0.003052
N 2.482414 1.173703 0.002847
C -0.923716 -0.336187 -0.000948
C -3.065426 1.088097 -0.000948
C -2.402454 -0.291030 -0.001967
C 0.016040 0.682723 0.000626
C 1.373726 0.211794 0.001218
C -4.601918 1.012463 -0.005231
C 1.486449 -1.185097 0.000060
H -2.704086 1.647913 0.885775
H -2.699226 1.652036 -0.883005
H -0.218671 1.747850 0.001370
H -4.973427 0.469755 0.880074
H -5.035572 2.027725 -0.003538
H -4.968773 0.474774 -0.895542


