%chk=000287463.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287463

0 1
Br 3.639311 -0.471960 -1.792596
S -0.983677 -3.594305 1.421319
C -2.036819 2.786825 -0.379341
C -3.472345 2.380670 -0.740549
C -1.030703 2.425188 -1.480243
C -3.721193 0.866796 -0.688301
C 0.368452 3.001824 -1.224601
C -3.869772 0.341737 0.746469
C 1.058145 2.368650 -0.008718
C -4.274458 -1.138468 0.787250
C 2.529147 2.794622 0.087566
C -3.110504 -2.104130 0.512394
C 3.201107 2.232456 1.347701
C -2.258439 -2.332193 1.752551
C 4.682920 2.593436 1.408942
C 0.256158 -2.699357 0.542291
C 1.025767 -1.738101 1.202140
C 0.485605 -3.020574 -0.797197
C 2.039292 -1.074401 0.504369
C 1.503952 -2.363012 -1.497965
C 2.261923 -1.393977 -0.836879
H -1.738148 2.308885 0.573193
H -2.004280 3.877643 -0.190606
H -3.716959 2.752387 -1.755355
H -4.177957 2.898136 -0.061340
H -1.398942 2.795928 -2.457027
H -0.970763 1.323928 -1.583057
H -2.897987 0.330900 -1.199960
H -4.636118 0.631079 -1.266328
H 0.990789 2.842235 -2.127954
H 0.307750 4.098939 -1.092891
H -2.924257 0.495831 1.300623
H -4.631259 0.940885 1.283273
H 0.989443 1.265166 -0.076498
H 0.519661 2.650020 0.915821
H -5.078825 -1.323743 0.047586
H -4.728674 -1.367323 1.771048
H 3.077079 2.451338 -0.812366
H 2.605994 3.898466 0.083935
H -3.518389 -3.069344 0.147222
H -2.487764 -1.712571 -0.318096
H 3.088438 1.123086 1.369530
H 2.684231 2.608608 2.251341
H -2.860939 -2.729808 2.593908
H -1.795724 -1.393251 2.105818
H 4.834560 3.678793 1.405089
H 5.231831 2.183537 0.552770
H 5.151382 2.199712 2.317582
H 0.848659 -1.505391 2.253065
H -0.119128 -3.777081 -1.301019
H 2.644994 -0.303345 1.006416
H 1.693634 -2.606671 -2.543926


%chk=000287463-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287463

0 1
Br 2.556533 -1.214171 -3.761301
S -0.702747 -3.522538 1.520226
C -1.877631 2.725334 -0.655524
C -3.270104 2.202273 -1.091747
C -0.696104 2.014702 -1.358061
C -3.573227 0.728026 -0.718077
C 0.689637 2.631408 -1.047032
C -3.659195 0.473445 0.806560
C 1.123879 2.508261 0.433281
C -4.135693 -0.955927 1.172926
C 2.576918 2.971562 0.682296
C -3.119239 -2.092167 0.870954
C 3.016573 2.850732 2.159654
C -1.938061 -2.104667 1.854281
C 4.472894 3.306223 2.395828
C 0.178008 -2.849685 0.048085
C 0.988235 -1.693823 0.154931
C 0.087749 -3.528242 -1.190341
C 1.688679 -1.202096 -0.969456
C 0.798647 -3.057300 -2.319784
C 1.584243 -1.893537 -2.194617
H -1.774450 2.637838 0.443832
H -1.820106 3.810437 -0.882774
H -3.360511 2.318115 -2.191886
H -4.054852 2.847119 -0.643764
H -0.868133 2.047275 -2.454053
H -0.676701 0.941320 -1.079750
H -2.811765 0.064786 -1.173010
H -4.543556 0.440369 -1.173909
H 1.452194 2.136867 -1.684670
H 0.690608 3.702771 -1.338560
H -2.678409 0.677585 1.280698
H -4.368462 1.206742 1.243144
H 1.017062 1.449833 0.755755
H 0.440596 3.097235 1.077848
H -5.073012 -1.167004 0.618595
H -4.399242 -0.993182 2.250520
H 3.266925 2.377130 0.045691
H 2.687680 4.025791 0.352632
H -3.634344 -3.070075 0.930265
H -2.737341 -1.999412 -0.163739
H 2.899303 1.797676 2.489361
H 2.331991 3.451508 2.792885
H -2.275471 -2.286775 2.890572
H -1.363717 -1.163218 1.836703
H 4.609281 4.363756 2.100326
H 5.179794 2.698884 1.799404
H 4.760772 3.212387 3.459140
H 1.090076 -1.182977 1.118561
H -0.539298 -4.421160 -1.275566
H 2.310850 -0.306611 -0.883303
H 0.728446 -3.584125 -3.275631


