%chk=000296935.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296935

0 1
Br 6.268413 2.084239 -0.879867
S 1.200323 -1.592784 0.486196
O -0.010279 -0.580995 -0.092390
O 1.178070 -2.775156 -0.337288
O 0.999913 -1.699175 1.909923
C -3.604152 -0.348226 -0.940285
C -3.980689 1.437395 0.899106
C -2.233855 0.147204 -0.401540
C -2.467506 1.192519 0.713700
C -4.357340 0.865255 -1.532226
C -4.446172 -0.946430 0.208193
C -4.583513 1.926732 -0.437183
C -4.660161 0.111425 1.308718
C -1.376794 -1.033803 0.077309
C 2.567375 -0.606995 0.120658
C 3.030453 0.316038 1.064127
C 3.204935 -0.735107 -1.117765
C 4.135651 1.121660 0.771605
C 4.311033 0.064961 -1.421962
C 4.759648 0.985048 -0.471026
H -3.446477 -1.112585 -1.731474
H -4.143251 2.202980 1.688128
H -1.676803 0.638173 -1.239129
H -1.956767 2.136383 0.455316
H -2.017578 0.862848 1.667169
H -5.323259 0.536126 -1.953628
H -3.786041 1.294120 -2.373644
H -3.952006 -1.841246 0.623045
H -5.418873 -1.292214 -0.184593
H -4.123231 2.886118 -0.729893
H -5.661717 2.127172 -0.313099
H -5.738060 0.276387 1.479064
H -4.247484 -0.242800 2.269343
H -1.512123 -1.934554 -0.550005
H -1.543586 -1.279889 1.142067
H 2.535042 0.407730 2.038791
H 2.846136 -1.466928 -1.852412
H 4.498507 1.842087 1.506986
H 4.809820 -0.034115 -2.387835


%chk=000296935-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296935

0 1
Br 6.506978 2.063705 -0.842043
S 1.225126 -1.602244 0.589278
O -0.050223 -0.429493 -0.098580
O 1.240319 -2.949332 -0.314829
O 1.042002 -1.695188 2.196857
C -3.755192 -0.371192 -0.958525
C -3.988434 1.454757 0.893954
C -2.338143 0.144408 -0.549452
C -2.486289 1.198263 0.601419
C -4.564460 0.835264 -1.509126
C -4.508427 -0.960671 0.264810
C -4.690715 1.938249 -0.402599
C -4.648649 0.135277 1.375857
C -1.411971 -1.024230 -0.173360
C 2.717295 -0.545930 0.179576
C 3.174613 0.360419 1.148519
C 3.324346 -0.725089 -1.073169
C 4.312291 1.140227 0.840782
C 4.461472 0.056556 -1.375909
C 4.934245 0.980306 -0.417248
H -3.656179 -1.142520 -1.748321
H -4.083956 2.227411 1.681716
H -1.893724 0.627448 -1.442714
H -1.986061 2.144553 0.324782
H -1.983988 0.834805 1.518883
H -5.564501 0.483192 -1.826970
H -4.066575 1.238718 -2.411669
H -3.983157 -1.853449 0.653432
H -5.504587 -1.309204 -0.067857
H -4.231355 2.886960 -0.740497
H -5.754240 2.157837 -0.189060
H -5.714386 0.318286 1.611606
H -4.166960 -0.195105 2.316065
H -1.420375 -1.817044 -0.945875
H -1.684704 -1.453845 0.810329
H 2.672583 0.445584 2.117161
H 2.936071 -1.461339 -1.783611
H 4.702297 1.856745 1.568310
H 4.965217 -0.053498 -2.339723


