%chk=000230139.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230139

0 1
Br 3.858947 1.560820 0.372304
Br -0.166614 2.764415 -2.117924
O 1.704533 -0.683916 0.250615
O -3.122773 -1.122158 1.407432
O -4.386354 0.412797 0.108262
O 2.704400 -1.229639 -1.708359
C 1.250828 0.591513 -0.294799
C -0.260567 0.596966 -0.222564
C 1.879431 1.680297 0.594238
C -0.898291 -0.342541 0.632615
C -2.271317 -0.318837 0.664908
C -1.018996 1.493332 -0.975708
C -3.033411 0.605610 -0.116344
C 1.532229 1.545964 2.059206
C -2.433815 1.524792 -0.945417
C -4.484200 -0.689988 1.072137
C 2.500855 -1.495899 -0.552681
C 2.978444 -2.639005 0.297462
C 2.918098 -3.948854 -0.475190
H 1.607677 0.662996 -1.360050
H 1.616356 2.692711 0.206245
H -0.304484 -1.046341 1.219133
H 0.454186 1.688272 2.225364
H 1.789242 0.547121 2.445527
H 2.059342 2.282484 2.680559
H -3.010699 2.229751 -1.543420
H -4.991434 -1.527620 0.574910
H -4.947902 -0.297146 1.986655
H 4.022268 -2.415787 0.617538
H 2.386643 -2.702374 1.236930
H 3.457427 -3.877106 -1.431816
H 3.370219 -4.766932 0.098601
H 1.885434 -4.238798 -0.707770


%chk=000230139-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230139

0 1
Br 3.893716 1.876654 0.315954
Br -0.090078 2.568267 -2.364459
O 1.813652 -0.658597 0.406509
O -3.191214 -0.930972 1.600725
O -4.429833 0.454557 0.076329
O 2.111283 -1.534594 -1.743258
C 1.302701 0.605698 -0.175262
C -0.227479 0.602653 -0.165301
C 1.872365 1.767131 0.668745
C -0.919397 -0.226725 0.769148
C -2.311016 -0.208061 0.760197
C -0.984987 1.411370 -1.048993
C -3.041252 0.604602 -0.132865
C 1.636760 1.674489 2.177357
C -2.405328 1.433395 -1.057022
C -4.558308 -0.623588 1.098627
C 2.216816 -1.659931 -0.507400
C 2.779328 -2.848943 0.251069
C 3.197533 -4.003603 -0.676046
H 1.666596 0.684116 -1.215397
H 1.508373 2.718398 0.247045
H -0.352330 -0.862160 1.452367
H 0.549407 1.677665 2.383912
H 2.069736 0.747157 2.585147
H 2.088645 2.537084 2.693233
H -2.967632 2.060418 -1.750926
H -4.977725 -1.524962 0.616716
H -5.172472 -0.251775 1.933653
H 3.636225 -2.485576 0.850550
H 2.018896 -3.177042 0.985759
H 3.971478 -3.675881 -1.390477
H 3.601396 -4.842478 -0.082579
H 2.339846 -4.371866 -1.264455


