%chk=000231624.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231624

0 1
Br -0.407473 -0.024441 2.753054
C -0.284122 -0.029839 0.750116
C 0.510255 1.192623 0.317694
C 0.642420 -1.180672 0.391694
C 1.757255 0.788336 -0.251532
C 1.840376 -0.679653 -0.202133
C -1.665930 -0.078176 0.154100
C 0.175608 2.532319 0.406121
C 0.462960 -2.539164 0.589800
C 2.653523 1.731367 -0.729864
C 2.841681 -1.548586 -0.608569
C -1.924952 -0.904333 -0.950950
C -2.695756 0.731396 0.661511
C 1.090418 3.485535 -0.081547
C 1.482975 -3.415684 0.174628
C 2.305870 3.092269 -0.639353
C 2.649176 -2.929074 -0.415515
C -3.197415 -0.930804 -1.528880
C -3.965462 0.701400 0.080259
C -4.221086 -0.130884 -1.014289
H -0.768769 2.849384 0.845149
H -0.440556 -2.921603 1.063720
H 3.604443 1.432675 -1.163977
H 3.757229 -1.177059 -1.062113
H -1.134417 -1.526720 -1.372365
H -2.518619 1.385978 1.515981
H 0.839392 4.543515 -0.017305
H 1.356315 -4.487241 0.323741
H 3.000905 3.844631 -1.010560
H 3.427937 -3.623575 -0.729032
H -3.388278 -1.577370 -2.384159
H -4.759330 1.328351 0.483801
H -5.212271 -0.154200 -1.463328


%chk=000231624-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231624

0 1
Br -0.329931 0.002917 2.830420
C -0.274744 -0.039089 0.695859
C 0.525079 1.193157 0.271982
C 0.662561 -1.189365 0.356770
C 1.803212 0.791196 -0.220243
C 1.890470 -0.682254 -0.160468
C -1.704931 -0.103176 0.173452
C 0.154513 2.547363 0.289863
C 0.460646 -2.570900 0.513528
C 2.725307 1.752855 -0.679437
C 2.927745 -1.564096 -0.526267
C -1.991146 -0.890788 -0.974184
C -2.744531 0.689864 0.727030
C 1.082817 3.513993 -0.170558
C 1.502225 -3.457214 0.143994
C 2.357577 3.119672 -0.646788
C 2.724903 -2.956718 -0.369717
C -3.281927 -0.884940 -1.548876
C -4.033552 0.691026 0.155306
C -4.309465 -0.095304 -0.987859
H -0.829206 2.856464 0.656747
H -0.476403 -2.953118 0.932094
H 3.707772 1.454119 -1.061143
H 3.875123 -1.185460 -0.925469
H -1.201824 -1.500133 -1.425044
H -2.550982 1.274424 1.632235
H 0.812767 4.575498 -0.158722
H 1.365127 -4.537491 0.262224
H 3.062773 3.881081 -0.998212
H 3.521355 -3.656640 -0.646080
H -3.482139 -1.500064 -2.433256
H -4.824821 1.300085 0.606355
H -5.312066 -0.096265 -1.429639


