%chk=000247155.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247155

0 1
Br -0.108485 1.169879 -0.874458
Br -5.670688 0.120657 0.819325
O 3.296728 1.721500 0.831627
O -1.395087 -1.931265 1.066433
N 2.607826 0.468252 -0.953998
N -0.736494 -0.910318 -0.922535
C 1.471076 -1.442340 0.237385
C 2.800379 -0.830567 -0.274185
C 0.498139 -1.789225 -0.917037
C 1.773642 -2.695031 1.064247
C 2.750297 1.674010 -0.256135
C -1.668448 -1.160326 0.179468
C 2.197533 2.894207 -0.983156
C -2.920583 -0.313322 0.118508
C 0.684958 2.971790 -0.823658
C -4.060949 -1.002829 0.846903
H 0.989716 -0.695730 0.923753
H 3.486584 -0.676791 0.597084
H 3.316344 -1.526102 -0.968938
H 0.994410 -1.658667 -1.901897
H 0.193912 -2.857890 -0.847493
H 0.845437 -3.106610 1.489675
H 2.429233 -2.462888 1.913058
H 2.257966 -3.482811 0.480612
H 2.156210 0.434147 -1.862219
H -1.204169 -0.979344 -1.848556
H 2.483874 2.885818 -2.052186
H 2.672684 3.802559 -0.551720
H -3.208234 -0.047155 -0.920770
H -2.691082 0.675880 0.595102
H 0.411438 3.415020 0.147208
H 0.227916 3.583885 -1.612288
H -4.332813 -1.967890 0.384061
H -3.808871 -1.195100 1.909383


%chk=000247155-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247155

0 1
Br 0.045185 3.084165 -1.749522
Br -6.256657 -1.699053 1.359462
O 3.096843 1.849963 0.539682
O -1.878111 -3.040339 -0.166156
N 2.820191 0.331452 -1.201015
N -1.126320 -0.848113 0.096497
C 1.365833 -0.928038 0.450028
C 2.718743 -0.841916 -0.309105
C 0.182744 -1.058542 -0.544046
C 1.399682 -2.096546 1.457149
C 2.975382 1.607554 -0.701352
C -2.061998 -1.854491 0.251457
C 2.984159 2.743475 -1.735824
C -3.351496 -1.442170 0.987016
C 1.926831 3.797636 -1.399237
C -4.564212 -2.085405 0.305391
H 1.255622 0.023523 1.007354
H 3.532693 -0.778508 0.435458
H 2.877942 -1.751445 -0.918777
H 0.296164 -0.316792 -1.358077
H 0.156126 -2.071770 -0.985124
H 0.432797 -2.191232 1.981736
H 2.185765 -1.943482 2.219184
H 1.592559 -3.058976 0.945871
H 2.684127 0.206791 -2.204799
H -1.342887 0.090093 0.440095
H 2.863588 2.383780 -2.773323
H 3.973423 3.240488 -1.665309
H -3.466516 -0.343943 1.029802
H -3.283275 -1.808514 2.028691
H 1.939788 4.050948 -0.328853
H 1.996598 4.693965 -2.031932
H -4.755841 -1.679684 -0.698851
H -4.475072 -3.179471 0.269033


