%chk=000267783.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267783

0 1
Br -4.523287 -2.111376 -2.724521
O -1.045139 3.384919 -0.232827
O 4.476391 -0.123563 -1.294379
O -5.011223 -1.015677 0.971249
O 4.276284 -1.766134 0.246711
N -1.503199 1.238990 0.438416
C -2.525667 0.249624 0.874586
C -3.054139 -0.554505 -0.324466
C -0.163745 0.751203 0.236496
C -1.877139 2.587377 0.150152
C 0.285567 -0.365903 0.977078
C 0.701699 1.359746 -0.694680
C -4.306841 -1.311507 0.034078
C 2.428673 -0.256348 -0.151546
C 1.570710 -0.860108 0.783187
C 1.987007 0.858915 -0.881182
C -3.314158 2.964257 0.356610
C -4.655289 -2.507199 -0.829509
C 3.782091 -0.819939 -0.327834
C 5.855083 -0.530378 -1.567882
C 6.772369 0.013165 -0.492527
H -2.084729 -0.441345 1.634160
H -3.367302 0.757769 1.402184
H -3.271949 0.124326 -1.181641
H -2.264031 -1.230257 -0.717126
H -0.362411 -0.835908 1.717461
H 0.381754 2.241413 -1.260584
H 1.925244 -1.721295 1.358755
H 2.661906 1.332228 -1.602039
H -3.649277 2.819614 1.394045
H -3.998944 2.408731 -0.298676
H -3.449627 4.036324 0.127025
H -5.691710 -2.848241 -0.621809
H -3.987582 -3.362428 -0.606643
H 6.014812 -0.063448 -2.556711
H 5.889710 -1.632217 -1.639724
H 7.827040 -0.138397 -0.748832
H 6.590904 -0.485800 0.471778
H 6.615245 1.087872 -0.333835


%chk=000267783-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267783

0 1
Br -4.498665 -2.258459 -2.831737
O -1.005571 3.628840 0.054341
O 4.436426 -0.153995 -1.312859
O -4.689956 -1.502148 1.116803
O 4.072898 -1.885084 0.214245
N -1.607779 1.388830 0.435971
C -2.667685 0.415543 0.807419
C -2.960778 -0.578051 -0.336731
C -0.275363 0.869781 0.232083
C -1.899488 2.771743 0.310920
C 0.147413 -0.293570 0.937305
C 0.626585 1.470122 -0.692054
C -4.038549 -1.582718 0.039963
C 2.321368 -0.237711 -0.193553
C 1.427008 -0.835759 0.728158
C 1.904379 0.920460 -0.897717
C -3.350720 3.215016 0.508183
C -4.305439 -2.774541 -0.881161
C 3.663383 -0.853877 -0.379577
C 5.817282 -0.672262 -1.551171
C 6.798310 -0.085513 -0.532086
H -2.388209 -0.132210 1.723790
H -3.587546 0.954913 1.063117
H -3.283612 -0.034732 -1.246872
H -2.046545 -1.126017 -0.640048
H -0.506766 -0.772224 1.671368
H 0.330997 2.370000 -1.230157
H 1.755230 -1.723934 1.277934
H 2.589697 1.384720 -1.611879
H -3.693241 3.067501 1.548781
H -4.054362 2.691641 -0.164120
H -3.384059 4.291188 0.284212
H -5.243698 -3.270628 -0.596461
H -3.460996 -3.484957 -0.858972
H 6.042915 -0.345946 -2.579185
H 5.793470 -1.774770 -1.495529
H 7.827212 -0.410323 -0.775102
H 6.558630 -0.434037 0.486336
H 6.770926 1.017666 -0.548959


