%chk=000237542.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237542

0 1
Br 5.405970 0.451856 -0.345364
Br -5.373737 -0.439398 0.534209
O 2.738466 1.712671 -0.296360
O -2.706375 -1.700588 0.484826
N 1.324451 0.252498 0.695348
N -1.292129 -0.240458 -0.506644
C 0.722120 -1.104407 0.714130
C 0.280846 1.319998 0.658172
C -0.248561 -1.307978 -0.469351
C -0.689819 1.116454 -0.525324
C 2.563344 0.570355 0.086261
C -2.531141 -0.558292 0.102237
C 3.677967 -0.504093 0.039037
C -3.645758 0.516212 0.148882
C 3.436141 -1.454804 -1.120684
C 3.869051 -1.202742 1.372780
C -3.836859 1.213800 -1.185417
C -3.403852 1.467815 1.307848
H 0.170359 -1.218818 1.678799
H 1.509183 -1.891161 0.714512
H 0.774118 2.320180 0.578080
H -0.258568 1.296716 1.630012
H 0.290868 -1.284773 -1.441194
H -0.741868 -2.308138 -0.389148
H -1.476898 1.903197 -0.525586
H -0.138078 1.230948 -1.489999
H 3.320295 -0.919376 -2.075678
H 4.278732 -2.150721 -1.257687
H 2.541003 -2.072599 -0.973092
H 3.008453 -1.836703 1.635009
H 4.005890 -0.485202 2.196532
H 4.754490 -1.856011 1.371894
H -3.973831 0.495568 -2.008557
H -4.722255 1.867126 -1.184991
H -2.976232 1.847393 -1.448262
H -2.509078 2.085975 1.159368
H -3.287333 0.933125 2.263154
H -4.246675 2.163472 1.444749


%chk=000237542-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237542

0 1
Br 5.619125 0.398402 -0.294192
Br -5.586370 -0.388096 0.480340
O 3.013994 1.822220 -0.064645
O -2.981011 -1.810191 0.250206
N 1.403456 0.243135 0.434769
N -1.370781 -0.230605 -0.248514
C 0.793064 -1.088547 0.648217
C 0.400689 1.330761 0.532555
C -0.367995 -1.318241 -0.346209
C -0.760367 1.101106 -0.461881
C 2.727015 0.606570 0.136055
C -2.694664 -0.594562 0.048405
C 3.808745 -0.527565 0.071702
C -3.776453 0.539354 0.116159
C 3.612047 -1.472804 -1.135936
C 4.011455 -1.247329 1.423664
C -3.980084 1.262455 -1.233893
C -3.579841 1.481443 1.326290
H 0.396584 -1.143211 1.682550
H 1.527752 -1.893364 0.527001
H 0.916465 2.279570 0.315036
H 0.001107 1.361941 1.566797
H 0.031622 -1.349600 -1.380448
H -0.883784 -2.267046 -0.128709
H -1.494990 1.905912 -0.340506
H -0.363903 1.155911 -1.496216
H 3.569915 -0.897129 -2.075325
H 4.457406 -2.178068 -1.201723
H 2.682084 -2.063689 -1.051184
H 3.111718 -1.808721 1.732026
H 4.250275 -0.520424 2.217363
H 4.849222 -1.960586 1.346734
H -4.218588 0.537448 -2.029421
H -4.818396 1.974838 -1.154839
H -3.080926 1.825425 -1.541028
H -2.649956 2.072657 1.243189
H -3.537640 0.903306 2.264160
H -4.425293 2.186423 1.393955


