%chk=000279640.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279640

0 1
Br 5.215325 -0.376395 -2.629279
O 0.248932 1.596410 1.967433
O -5.637974 -0.361574 -0.528400
C 0.724774 -0.729928 0.355041
C -0.053546 0.513098 -0.162100
C 0.333370 -2.002859 -0.420823
C 2.211749 -0.441786 0.275609
C -1.543990 0.281943 -0.209935
C 0.208980 1.713450 0.763045
C 1.031904 -3.243397 0.127303
C 2.907690 -0.535200 -0.939742
C 2.900932 -0.053105 1.436225
C -2.207001 0.253998 -1.451594
C -2.276824 0.087720 0.969238
C 0.396066 3.031430 0.075873
C -3.577589 0.036231 -1.518028
C -3.655711 -0.133121 0.929605
C 4.272384 -0.249235 -0.964885
C 4.268407 0.225932 1.388537
C -4.292692 -0.156961 -0.317131
C 4.970887 0.128824 0.181830
C -6.481043 -0.569524 0.630449
H 0.441709 -0.884158 1.431386
H 0.320997 0.750529 -1.189445
H 0.559783 -1.884866 -1.497923
H -0.766621 -2.141272 -0.361759
H 2.123767 -3.160304 0.053152
H 0.733737 -4.141093 -0.426162
H 0.789818 -3.413324 1.182688
H 2.384595 -0.837724 -1.847598
H 2.358525 0.045845 2.379917
H -1.643872 0.401100 -2.373386
H -1.763523 0.118583 1.935484
H 0.456191 3.855880 0.802797
H -0.431193 3.257760 -0.610320
H 1.325416 3.051985 -0.510565
H -4.108438 0.010620 -2.466944
H -4.205629 -0.279071 1.853242
H 4.793918 0.523853 2.295943
H 6.037925 0.345690 0.146549
H -6.176974 -1.474137 1.164594
H -7.468481 -0.699121 0.168002
H -6.463978 0.312775 1.276576


%chk=000279640-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279640

0 1
Br 5.205386 -0.002657 -2.739322
O 0.335824 1.661450 1.960844
O -5.738083 -0.358395 -0.562878
C 0.761725 -0.728291 0.375369
C -0.035897 0.510142 -0.170014
C 0.375380 -2.038087 -0.365329
C 2.266977 -0.447208 0.313542
C -1.553075 0.289133 -0.236144
C 0.221206 1.758648 0.709175
C 1.050883 -3.291652 0.230576
C 2.930752 -0.369473 -0.941009
C 3.024166 -0.247461 1.494585
C -2.224485 0.252176 -1.487286
C -2.320478 0.111136 0.941351
C 0.293465 3.094567 -0.008795
C -3.611942 0.035397 -1.564842
C -3.714323 -0.110009 0.882815
C 4.311393 -0.103780 -0.984449
C 4.410559 0.015656 1.430153
C -4.363500 -0.148686 -0.377072
C 5.075190 0.090603 0.183989
C -6.562228 -0.552799 0.632746
H 0.484976 -0.838227 1.442188
H 0.318288 0.733820 -1.195380
H 0.633343 -1.952794 -1.440922
H -0.723107 -2.155531 -0.320590
H 2.152018 -3.230106 0.164657
H 0.728741 -4.203541 -0.304488
H 0.783645 -3.414400 1.297426
H 2.377049 -0.527349 -1.872411
H 2.516799 -0.282634 2.464497
H -1.652247 0.386894 -2.413351
H -1.826102 0.158994 1.918608
H 0.274441 3.926422 0.712255
H -0.540336 3.196327 -0.727782
H 1.234170 3.144277 -0.592376
H -4.133839 0.002510 -2.526021
H -4.275992 -0.241769 1.812483
H 4.983511 0.168756 2.351080
H 6.148109 0.294191 0.127694
H -6.244116 -1.449050 1.200282
H -7.585051 -0.697236 0.255297
H -6.530494 0.335540 1.293347


