%chk=000211107.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211107

0 1
Br 0.394418 -4.486697 1.426585
O -0.657222 2.801528 0.987021
O 2.956753 2.961320 -0.906419
N -0.256289 0.643064 0.331041
N 2.425729 0.770673 -0.975534
C 0.636241 -0.484214 0.235994
C 1.894439 -0.428094 -0.415084
C 0.154186 1.930023 0.768994
C 1.642161 2.135375 0.945731
C -1.649053 0.394971 -0.017958
C 0.206499 -1.705341 0.797877
C 2.386276 2.040601 -0.362152
C 2.671114 -1.601399 -0.528706
C 0.996050 -2.842719 0.671893
C -1.934924 -0.346149 -1.178597
C -2.681875 0.892701 0.791505
C 2.224772 -2.807321 0.002092
C -3.266439 -0.593560 -1.515808
C -4.008239 0.639578 0.431949
C -4.303831 -0.104933 -0.713742
H 2.062424 1.441478 1.705729
H 1.803613 3.160288 1.372219
H 2.970185 0.682078 -1.840182
H -0.757243 -1.748491 1.317938
H 3.636378 -1.563502 -1.037551
H -1.131129 -0.718141 -1.811635
H -2.455874 1.494568 1.673978
H 2.832502 -3.709313 -0.099094
H -3.496985 -1.167328 -2.413257
H -4.815502 1.029588 1.052257
H -5.339733 -0.299933 -0.985083


%chk=000211107-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211107

0 1
Br 0.289755 -4.536746 1.414532
O -0.661899 2.933295 0.675602
O 3.070030 3.013914 -0.898869
N -0.244889 0.661599 0.262822
N 2.481979 0.769688 -0.933150
C 0.650367 -0.465059 0.233733
C 1.943149 -0.419097 -0.372716
C 0.151288 1.974932 0.627414
C 1.641112 2.158375 0.923346
C -1.648609 0.405169 -0.041143
C 0.188069 -1.696064 0.775403
C 2.462228 2.051145 -0.362394
C 2.711108 -1.611229 -0.456253
C 0.969047 -2.855774 0.670791
C -1.976693 -0.261676 -1.245594
C -2.667356 0.807826 0.852885
C 2.233923 -2.836199 0.042441
C -3.327181 -0.535841 -1.549542
C -4.016830 0.537945 0.536553
C -4.351819 -0.137053 -0.659857
H 1.989092 1.407216 1.657384
H 1.778467 3.168578 1.331240
H 3.105818 0.676864 -1.741070
H -0.795410 -1.727705 1.250638
H 3.703363 -1.569481 -0.919637
H -1.180626 -0.557455 -1.936913
H -2.409642 1.341264 1.771261
H 2.835163 -3.744918 -0.042250
H -3.577866 -1.051700 -2.482622
H -4.805718 0.855216 1.226826
H -5.400016 -0.346331 -0.898863


