%chk=000293101.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293101

0 1
Br 5.514952 0.729171 0.338999
S -1.431867 -1.476980 0.029913
O -2.363305 -2.245739 -0.766101
O -0.966399 -1.951702 1.309698
N -0.073743 -1.321270 -1.035101
C -1.996146 0.144260 0.185819
C 1.226716 -0.888482 -0.685982
C -3.028093 0.598886 -0.643570
C -1.436786 0.998902 1.141643
C 1.637500 -0.780147 0.658640
C 2.122053 -0.540994 -1.725673
C -3.493699 1.910853 -0.524361
C -1.900842 2.312115 1.261264
C -2.927664 2.767371 0.426999
C 2.912347 -0.301383 0.956800
C 3.394698 -0.066275 -1.417739
C 3.777517 0.060784 -0.079062
H -0.185992 -1.635238 -2.009555
H -3.479187 -0.075250 -1.381304
H -0.639903 0.643632 1.803926
H 0.990557 -1.115778 1.476898
H 1.822353 -0.638853 -2.766320
H -4.297318 2.264843 -1.169157
H -1.463664 2.978481 2.004326
H -3.289906 3.792634 0.519826
H 3.228354 -0.221380 1.999380
H 4.082667 0.204337 -2.221306


%chk=000293101-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293101

0 1
Br 5.157203 1.303696 0.604092
S -1.515864 -1.679499 0.135157
O -2.647919 -2.483293 -0.705725
O -1.074937 -2.065063 1.647115
N 0.089548 -1.909905 -0.945741
C -1.967796 0.163434 0.124846
C 1.218631 -1.126971 -0.593039
C -2.864598 0.610206 -0.860675
C -1.391779 0.992942 1.101650
C 1.866172 -1.377912 0.650828
C 1.747640 -0.136455 -1.468807
C -3.194727 1.985242 -0.866283
C -1.732233 2.365624 1.073418
C -2.625055 2.857685 0.092119
C 3.017278 -0.649890 1.009855
C 2.922650 0.566099 -1.130222
C 3.538449 0.309935 0.113193
H -0.247029 -1.790118 -1.917801
H -3.310147 -0.095068 -1.570159
H -0.726358 0.578566 1.865373
H 1.463544 -2.147840 1.314721
H 1.249274 0.075499 -2.422679
H -3.898763 2.369517 -1.611591
H -1.304023 3.043085 1.819165
H -2.886135 3.921296 0.080308
H 3.512838 -0.843572 1.965308
H 3.339334 1.309559 -1.815525


