%chk=000252018.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252018

0 1
Br -1.282030 -1.605966 1.390438
O 0.215477 0.436448 -1.660350
N 1.112565 -0.611306 0.158257
C -1.298609 -0.000334 0.177123
C -1.411272 1.247369 1.058531
C -2.413095 -0.175324 -0.853705
C 0.069202 -0.022493 -0.537986
C -1.391298 2.536400 0.241245
C -3.818604 -0.150783 -0.270101
C 2.471356 -0.646055 -0.441720
C 3.412348 0.273978 0.287567
C 4.679658 -0.039116 0.544659
H -2.347480 1.199269 1.655571
H -0.587963 1.267477 1.802809
H -2.257648 -1.120290 -1.419008
H -2.301105 0.630920 -1.618319
H -1.311725 3.413895 0.893025
H -2.302683 2.653512 -0.358181
H -0.544659 2.568449 -0.460351
H -4.039195 0.795985 0.236433
H -4.568491 -0.279108 -1.060944
H -3.977708 -0.958699 0.456368
H 1.061418 -0.900376 1.132843
H 2.828000 -1.701805 -0.435346
H 2.414043 -0.336666 -1.519727
H 2.984517 1.237525 0.572477
H 5.363858 0.633027 1.044138
H 5.138223 -0.980333 0.276456


%chk=000252018-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252018

0 1
Br -1.256366 -1.557101 1.605301
O 0.121946 0.570061 -1.741412
N 1.207512 -0.470467 0.033156
C -1.264455 0.005462 0.177299
C -1.415542 1.305287 1.016368
C -2.429122 -0.293792 -0.792419
C 0.087958 0.020992 -0.592299
C -1.518781 2.588444 0.154130
C -3.845288 -0.189847 -0.197072
C 2.547118 -0.413436 -0.584914
C 3.557481 0.251558 0.327929
C 4.718560 -0.323496 0.728508
H -2.317294 1.206749 1.646231
H -0.553381 1.386247 1.704082
H -2.273114 -1.299523 -1.224153
H -2.310513 0.417905 -1.632114
H -1.587463 3.468791 0.818339
H -2.418060 2.575783 -0.486462
H -0.642102 2.712318 -0.503160
H -4.078999 0.835050 0.142864
H -4.591175 -0.461550 -0.965456
H -3.974797 -0.876020 0.658486
H 1.096500 -0.953867 0.929212
H 2.885941 -1.433660 -0.850057
H 2.423164 0.157168 -1.524793
H 3.303505 1.270042 0.656051
H 5.430229 0.205930 1.371113
H 4.993636 -1.339426 0.417443


