%chk=000229909.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229909

0 1
Br -0.909941 -2.918728 1.569536
Br 1.512461 -3.570247 -1.532256
O -1.462880 3.204758 -1.157580
O 1.373781 2.963535 1.134550
O -2.727009 0.141948 -0.216971
O 2.904002 -0.216209 0.189780
O -1.118675 0.256195 1.379035
O 0.980237 -0.516731 -0.975333
C -0.161050 2.723429 -0.754060
C -0.004969 3.066375 0.732001
C -2.453127 2.203345 -1.421797
C 1.848614 1.628624 1.381198
C -2.993946 1.575801 -0.136853
C 2.733333 1.235485 0.195324
C -1.709409 -0.384130 0.544152
C 1.939854 -0.983517 -0.407698
C -1.522688 -1.804655 0.104300
C 2.316689 -2.420984 -0.194027
H -0.029912 1.646424 -0.959212
H 0.535891 3.309526 -1.381821
H -0.646209 2.433502 1.375040
H -0.219217 4.135539 0.925094
H -3.225813 2.798416 -1.948834
H -2.054430 1.430236 -2.106182
H 2.426154 1.728849 2.318870
H 1.017825 0.911760 1.539597
H -4.094606 1.609483 -0.060896
H -2.534402 2.008756 0.772735
H 3.779020 1.577607 0.296813
H 2.316381 1.570133 -0.770156
H -0.757910 -1.835694 -0.715887
H -2.456000 -2.240653 -0.308679
H 1.975261 -2.760056 0.810748
H 3.418790 -2.561926 -0.220230


%chk=000229909-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229909

0 1
Br -1.179779 -2.791676 1.699596
Br 3.825051 -3.519714 -1.551682
O -1.713098 3.406872 -0.581447
O 1.696584 2.959037 0.869124
O -2.981324 0.220100 -0.421252
O 3.163442 -0.414743 0.135869
O -1.518624 0.431639 1.392906
O 1.195586 -1.181908 -0.854455
C -0.356011 2.831602 -0.561501
C 0.263821 3.284837 0.772208
C -2.759208 2.615941 -1.226821
C 1.990775 1.540826 1.123836
C -3.466775 1.629779 -0.276306
C 2.742410 1.002572 -0.107002
C -2.029960 -0.254493 0.484137
C 2.290293 -1.404387 -0.282060
C -1.704191 -1.689924 0.105673
C 2.836783 -2.776151 0.052151
H -0.383461 1.726595 -0.624496
H 0.226357 3.229448 -1.417118
H -0.303981 2.837870 1.610652
H 0.218873 4.383811 0.843594
H -3.501425 3.364867 -1.557852
H -2.387592 2.076741 -2.122798
H 2.639833 1.486085 2.016804
H 1.067102 0.960530 1.314235
H -4.536175 1.544239 -0.530316
H -3.340679 1.957984 0.770398
H 3.685220 1.547309 -0.262531
H 2.113572 1.044818 -1.012071
H -0.821789 -1.702686 -0.556858
H -2.565332 -2.183504 -0.361995
H 2.018620 -3.480620 0.251358
H 3.571183 -2.737501 0.866322


