%chk=000189465.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189465

0 1
Br -6.206130 -2.081537 -1.896160
F -4.301713 1.619375 1.251772
O 3.649650 0.559312 0.209805
O -1.809242 1.264245 0.591406
O 3.600427 -2.674304 0.830738
O 4.804623 -2.058331 -0.956506
C 4.400977 -0.455030 0.921285
C 2.271982 0.601271 0.354052
C -0.440227 0.960083 0.449832
C 1.487534 -0.374558 0.978715
C 1.717318 1.759909 -0.231931
C 0.102962 -0.187573 1.030943
C 0.340456 1.938013 -0.188175
C 5.817767 0.084183 0.933007
C -2.717825 0.424480 -0.021186
C 4.334176 -1.756888 0.106352
C -4.061307 0.666784 0.356000
C -2.426932 -0.566842 -0.960994
C -5.109340 -0.063816 -0.191664
C -3.476153 -1.310982 -1.516524
C -4.791981 -1.056442 -1.130549
H 3.980944 -0.602170 1.943781
H 1.927861 -1.272815 1.414370
H 2.373870 2.487573 -0.708552
H -0.541309 -0.917977 1.520064
H -0.136465 2.817004 -0.623058
H 6.213060 0.203914 -0.089897
H 6.502585 -0.572924 1.483258
H 5.852178 1.080725 1.398664
H -1.398930 -0.757230 -1.268344
H -6.144003 0.129476 0.102527
H -3.251027 -2.085833 -2.252998
H 3.511816 -3.554295 0.375768


%chk=000189465-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189465

0 1
Br -6.229290 -2.422797 -1.701878
F -4.439695 1.669947 1.196154
O 3.737180 0.710272 0.376406
O -1.853376 1.427016 0.365647
O 4.036342 -2.850047 0.913256
O 4.078741 -1.773790 -1.152903
C 4.385040 -0.469723 0.954742
C 2.328534 0.776689 0.394234
C -0.456038 1.139616 0.332657
C 1.478846 -0.216745 0.941589
C 1.781585 1.953393 -0.172009
C 0.078802 -0.027926 0.912999
C 0.387137 2.135378 -0.205827
C 5.887241 -0.152523 0.996736
C -2.773927 0.483523 -0.112797
C 4.138372 -1.717379 0.088072
C -4.119880 0.641475 0.301117
C -2.472096 -0.557032 -1.021792
C -5.147476 -0.198238 -0.153517
C -3.487882 -1.418703 -1.493827
C -4.813835 -1.231292 -1.054193
H 3.999238 -0.665357 1.973377
H 1.877150 -1.129436 1.395229
H 2.461387 2.705351 -0.582309
H -0.584202 -0.780975 1.350889
H -0.056237 3.037992 -0.635424
H 6.258923 0.053587 -0.020617
H 6.448614 -1.000916 1.424506
H 6.054656 0.738329 1.624049
H -1.443772 -0.690273 -1.369544
H -6.169618 -0.037229 0.197545
H -3.242289 -2.216715 -2.199203
H 3.949428 -3.668672 0.352435


