%chk=000297210.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297210

0 1
Br -0.308986 0.094481 -2.601610
O -1.816496 0.428772 -0.198871
O -0.023862 1.833385 -0.579015
O 0.145116 -2.555330 1.264951
O 2.475600 0.225972 0.622485
O -1.093442 -2.366848 -0.627608
O 2.249835 -1.202023 -1.125680
O -2.826547 1.718884 -1.791682
O -0.124193 2.040000 1.689342
C 0.294706 -0.495722 0.194878
C -0.496622 0.500041 -0.672605
C -0.326212 -1.885014 0.160123
C 1.753687 -0.570636 -0.232495
C -2.943433 0.983577 -0.859419
C 0.101595 2.546786 0.624894
C -4.127539 0.466403 -0.133209
C 0.540769 3.916241 0.263225
C -0.277589 -3.939888 1.412312
C 3.909586 0.298019 0.381639
H 0.245789 -0.113670 1.273760
H -3.917193 0.271198 0.933255
H -4.455477 -0.496935 -0.565830
H -4.972593 1.169720 -0.197903
H 1.532756 4.136634 0.690575
H 0.609026 4.061648 -0.831538
H -0.163254 4.670178 0.652951
H -1.370465 -3.998217 1.410307
H 0.148742 -4.534753 0.597898
H 0.147564 -4.211706 2.384905
H 4.337111 -0.710219 0.373774
H 4.089506 0.805793 -0.571091
H 4.261615 0.884728 1.237083


%chk=000297210-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297210

0 1
Br -0.330372 -0.104409 -2.681249
O -1.893770 0.310210 -0.292018
O 0.038443 1.731138 -0.661503
O 0.268720 -2.687218 1.295058
O 2.384949 0.419969 0.590038
O -1.147163 -2.535040 -0.548762
O 2.346035 -1.464297 -0.780053
O -2.709595 2.112298 -1.589244
O -0.494734 2.067566 1.614421
C 0.242033 -0.588677 0.216368
C -0.525743 0.385408 -0.712972
C -0.320372 -2.019293 0.221928
C 1.751311 -0.626087 -0.076209
C -2.926126 1.173278 -0.813777
C -0.009173 2.491499 0.551252
C -4.240534 0.713070 -0.238889
C 0.601565 3.842113 0.286838
C -0.085396 -4.121806 1.428563
C 3.852797 0.511212 0.376062
H 0.111886 -0.176888 1.235510
H -4.192458 0.713269 0.863596
H -4.440838 -0.324496 -0.558137
H -5.047602 1.375431 -0.582604
H 1.641061 3.720035 -0.062819
H 0.042713 4.353052 -0.515941
H 0.581323 4.445653 1.205505
H -1.172219 -4.232352 1.579138
H 0.217500 -4.668783 0.520436
H 0.475752 -4.467264 2.307383
H 4.337974 -0.427588 0.689927
H 4.066578 0.695636 -0.689813
H 4.174553 1.354859 1.001769


