%chk=000290548.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290548

0 1
Br 0.558660 -1.724061 -0.219131
O 5.828243 1.125089 0.324761
O 5.834505 -1.049709 -0.628591
O -7.561816 -1.026433 0.498489
N -0.121891 1.297823 -0.063999
C -1.487058 0.818997 0.312206
C 0.882844 1.123274 1.026303
C -2.318699 0.520235 -0.948464
C 2.174419 0.503112 0.552640
C -3.705345 0.083287 -0.569346
C 3.380790 1.238951 0.706810
C 4.536379 0.626827 0.282436
C 4.539791 -0.683175 -0.291978
C 2.201322 -0.771647 -0.013413
C 3.383402 -1.409493 -0.455277
C 6.686212 0.083301 -0.252215
C -4.000666 -1.278177 -0.414609
C -4.713467 1.042969 -0.357705
C -5.285981 -1.695064 -0.056789
C -6.001044 0.655602 -0.000429
C -6.267950 -0.716933 0.144575
H -1.484762 -0.067588 0.982946
H -1.963917 1.644757 0.889907
H 0.490599 0.528742 1.886306
H 1.065718 2.149902 1.430110
H -1.820248 -0.254216 -1.566506
H -2.356393 1.423430 -1.594228
H 0.196610 0.879243 -0.941250
H 3.381173 2.239736 1.133513
H 3.377405 -2.406392 -0.893196
H 7.135442 0.487391 -1.169202
H 7.374509 -0.257993 0.532334
H -3.223736 -2.025249 -0.574145
H -4.483183 2.102648 -0.474379
H -5.510924 -2.749454 0.059941
H -6.794965 1.379882 0.166481
H -7.699377 -2.000113 0.585094


%chk=000290548-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290548

0 1
Br 2.103027 -3.145297 0.771960
O 5.247433 2.051076 -0.098438
O 6.375386 -0.043025 -0.424451
O -7.944081 0.335755 0.329880
N -0.025711 -0.054886 -0.023273
C -1.466640 -0.052608 0.312953
C 0.863803 -0.132260 1.165350
C -2.326982 0.026319 -0.972846
C 2.323944 -0.196476 0.750053
C -3.814932 0.083697 -0.663944
C 3.027532 1.028760 0.532888
C 4.359621 0.970394 0.131622
C 5.025022 -0.259268 -0.060932
C 3.020247 -1.412573 0.538013
C 4.381042 -1.481084 0.133482
C 6.484185 1.427596 -0.639439
C -4.572791 -1.100098 -0.482941
C -4.478677 1.328995 -0.502893
C -5.945383 -1.051763 -0.152583
C -5.846939 1.399013 -0.172531
C -6.580254 0.203508 0.003914
H -1.777726 -0.948957 0.907077
H -1.673951 0.833047 0.945579
H 0.622962 -1.002270 1.821482
H 0.695052 0.780675 1.767923
H -2.101434 -0.857561 -1.603513
H -2.007181 0.918941 -1.541378
H 0.201685 -0.800989 -0.697952
H 2.512616 1.982674 0.671379
H 4.893564 -2.432757 -0.015765
H 6.544449 1.627199 -1.725563
H 7.352586 1.806543 -0.079503
H -4.087497 -2.075921 -0.608299
H -3.915725 2.259892 -0.643622
H -6.514141 -1.982153 -0.022402
H -6.360054 2.357882 -0.053102
H -8.367455 -0.552517 0.431814


