%chk=000264043.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264043

0 1
Br 6.125549 -0.532894 -0.556441
S -0.808330 -0.222268 -0.886137
O -0.361177 1.200253 1.319971
N -2.753638 -0.881781 0.794861
C 1.573877 0.265488 0.215360
C 2.482149 1.336891 0.225739
C 2.020585 -1.043757 -0.010990
C 0.140685 0.545643 0.461014
C 3.838837 1.102067 -0.006956
C 3.380040 -1.283848 -0.238168
C 4.269521 -0.207856 -0.237520
C -2.490507 -0.186790 -0.335383
C -3.454315 0.484976 -1.096192
C -4.779701 0.427503 -0.647573
C -5.083189 -0.276808 0.521187
C -4.043279 -0.917784 1.219555
H 2.127554 2.352181 0.418157
H 1.317803 -1.882533 -0.002323
H 4.546722 1.932887 -0.003952
H 3.731250 -2.302538 -0.413540
H -3.187086 1.036346 -1.996284
H -5.567512 0.934219 -1.205696
H -6.105265 -0.328942 0.889961
H -4.232071 -1.479255 2.142149


%chk=000264043-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264043

0 1
Br 6.373140 -0.336939 -0.315077
S -0.847286 -1.053191 0.333411
O -0.335997 1.600563 -0.307486
N -3.424774 -1.629251 0.565271
C 1.633155 0.210671 -0.126550
C 2.476849 1.324237 -0.391945
C 2.217947 -1.066928 0.080896
C 0.160364 0.468496 -0.085593
C 3.875589 1.172125 -0.448717
C 3.616535 -1.232057 0.026471
C 4.430462 -0.109123 -0.237697
C -2.635884 -0.558935 0.301938
C -3.128009 0.743255 0.045595
C -4.530478 0.917261 0.067579
C -5.374180 -0.184721 0.339082
C -4.774630 -1.440700 0.582974
H 2.017930 2.304859 -0.551832
H 1.591538 -1.941600 0.282699
H 4.520618 2.031178 -0.652470
H 4.064073 -2.216647 0.185515
H -2.444783 1.568413 -0.159877
H -4.953485 1.908577 -0.126104
H -6.462883 -0.078898 0.362880
H -5.377306 -2.329246 0.799834


