%chk=000264057.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264057

0 1
Br 6.532758 0.549124 0.139455
S -1.861039 -1.846876 0.421928
O 0.143474 -1.369703 -1.513580
N -1.743987 0.821115 0.581775
N -4.379035 1.156629 -0.363481
C -0.126803 -1.595709 0.841795
C 2.074994 -0.869354 -0.239710
C -2.517913 -0.233309 0.247614
C 0.646687 -1.292596 -0.418272
C -3.850793 -0.088478 -0.233792
C -2.280944 2.068041 0.442585
C 2.835852 -1.237366 0.877806
C 2.652981 -0.085564 -1.251217
C -4.693012 -1.256213 -0.606782
C -3.607907 2.221570 -0.032471
C 4.165258 -0.819802 0.992368
C 3.978980 0.342578 -1.143668
C -1.436509 3.240563 0.802103
C 4.718024 -0.030922 -0.019512
H -0.009358 -0.774123 1.585279
H 0.233032 -2.522217 1.332989
H 2.405151 -1.856086 1.665330
H 2.055864 0.182866 -2.129193
H -4.878051 -1.915691 0.254836
H -5.678298 -0.943901 -0.992638
H -4.214878 -1.860266 -1.395705
H -4.062867 3.209953 -0.152713
H 4.756758 -1.109652 1.862067
H 4.422741 0.954274 -1.930945
H -1.896823 3.835921 1.604162
H -0.437077 2.937561 1.156018
H -1.284056 3.903233 -0.062830


%chk=000264057-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264057

0 1
Br 6.888195 0.089940 0.184098
S -1.848367 -1.904715 0.244107
O 0.231612 -0.830259 -1.703366
N -1.891256 0.827576 0.597341
N -4.579262 1.094244 -0.218126
C -0.089308 -1.418916 0.654154
C 2.210969 -0.747284 -0.334931
C -2.622546 -0.242163 0.218475
C 0.743486 -0.993383 -0.563547
C -3.991755 -0.135157 -0.196306
C -2.484976 2.064500 0.573842
C 2.822198 -0.833629 0.944751
C 3.013586 -0.406656 -1.457710
C -4.806234 -1.331647 -0.616616
C -3.833002 2.177715 0.159682
C 4.202173 -0.586140 1.104103
C 4.392291 -0.159780 -1.316088
C -1.650986 3.249597 0.993873
C 4.971433 -0.252928 -0.030607
H -0.154338 -0.562461 1.352200
H 0.355570 -2.285609 1.171152
H 2.232690 -1.086055 1.831756
H 2.530327 -0.339679 -2.437851
H -4.882922 -2.075674 0.199287
H -5.818196 -1.001595 -0.896373
H -4.340819 -1.846500 -1.478484
H -4.333480 3.150289 0.122779
H 4.668987 -0.650574 2.090759
H 5.005247 0.099630 -2.183744
H -1.301517 3.130466 2.035389
H -0.752717 3.333648 0.356309
H -2.223880 4.188798 0.921292


