%chk=000186777.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186777

0 1
Br -0.908072 3.423031 1.040832
C 0.468390 0.348241 -0.176575
C 0.577622 -1.049084 0.052145
C -0.844826 0.917531 -0.337530
C -1.846814 -1.285339 -0.000749
C -0.601024 -1.853392 0.135081
C -1.963132 0.119168 -0.241354
C 1.664911 1.130953 -0.228719
C 1.875380 -1.636722 0.202300
C -1.010744 2.372751 -0.624595
C -3.096043 -2.099081 0.095183
C 2.896770 0.544298 -0.077584
C 3.004205 -0.859957 0.136976
H -0.489235 -2.921028 0.313165
H -2.960869 0.544902 -0.341003
H 1.586466 2.208169 -0.377321
H 1.944183 -2.710011 0.371592
H -1.990363 2.609573 -1.079372
H -0.225553 2.767141 -1.296252
H -3.730872 -1.754102 0.924769
H -3.693271 -2.026172 -0.824903
H -2.896871 -3.165151 0.265977
H 3.806876 1.140324 -0.114298
H 3.994088 -1.299243 0.250933


%chk=000186777-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186777

0 1
Br -0.891164 3.595779 1.032990
C 0.482918 0.363467 -0.176261
C 0.589233 -1.063366 0.056788
C -0.836881 0.935918 -0.338427
C -1.873881 -1.298542 -0.001613
C -0.600297 -1.860274 0.137685
C -1.966791 0.110559 -0.243699
C 1.685919 1.140506 -0.227743
C 1.887054 -1.654148 0.204761
C -1.031929 2.384663 -0.648407
C -3.135835 -2.136381 0.090614
C 2.938443 0.536887 -0.076986
C 3.042509 -0.872359 0.136315
H -0.497114 -2.938226 0.317649
H -2.962549 0.560292 -0.356721
H 1.627914 2.225606 -0.360649
H 1.958355 -2.735016 0.376456
H -2.042154 2.603126 -1.019633
H -0.271372 2.812129 -1.316300
H -3.783795 -1.792008 0.918764
H -3.732340 -2.065860 -0.838584
H -2.901853 -3.200460 0.263815
H 3.847254 1.147599 -0.114545
H 4.029560 -1.333090 0.252430


