%chk=000257722.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257722

0 1
Br 1.458732 -1.281475 3.836822
O -2.010178 -0.024810 -1.417548
O -0.686532 2.531915 -0.057824
O -2.818371 0.329830 0.673378
O 1.434025 1.806788 0.256138
C -0.187143 -0.401693 1.659814
C -0.393510 0.195624 0.253617
C 1.294257 -0.636199 1.960558
C 1.937210 -1.618130 1.025011
C -1.880091 0.204727 -0.071439
C 0.252358 1.566707 0.156546
C 1.614198 -2.982902 1.052826
C 2.866381 -1.140397 0.086611
C 2.220652 -3.861321 0.151361
C 3.469240 -2.023952 -0.811778
C 3.148523 -3.384840 -0.780712
C -3.361942 -0.069050 -1.983421
C -0.237784 3.922911 -0.205058
C -4.018278 -1.390714 -1.648345
C 0.357285 4.126352 -1.580282
H -0.645789 0.268506 2.421491
H -0.755932 -1.354641 1.737239
H 0.130594 -0.458343 -0.509560
H 1.852106 0.337841 1.960307
H 0.901134 -3.364224 1.783984
H 3.111421 -0.075205 0.055672
H 1.972623 -4.921344 0.178626
H 4.192240 -1.650450 -1.535548
H 3.621998 -4.072761 -1.478850
H -3.927548 0.799243 -1.601462
H -3.134822 0.048403 -3.059056
H -1.195758 4.455220 -0.054461
H 0.473029 4.146368 0.609863
H -4.968424 -1.513329 -2.182207
H -3.375817 -2.240969 -1.911242
H -4.234889 -1.466859 -0.571557
H 0.548259 5.187725 -1.781333
H 1.315313 3.594620 -1.685476
H -0.308670 3.752431 -2.369403


%chk=000257722-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257722

0 1
Br 1.838222 -0.617453 3.865333
O -2.076097 0.397996 -1.452457
O -0.515053 2.459941 0.250770
O -2.649830 -0.484676 0.629985
O 1.310863 1.640704 -0.952315
C 0.029667 -0.243264 1.597275
C -0.287057 0.072703 0.105143
C 1.536960 -0.465586 1.810166
C 2.126324 -1.671380 1.120959
C -1.793237 -0.036773 -0.162104
C 0.264739 1.444735 -0.293785
C 1.535642 -2.958238 1.236396
C 3.282151 -1.515801 0.312894
C 2.090105 -4.062831 0.557749
C 3.835704 -2.621377 -0.370631
C 3.241706 -3.898072 -0.249632
C -3.507575 0.323618 -1.889906
C -0.099729 3.867889 -0.047200
C -3.836329 -1.069144 -2.432918
C -0.687487 4.328105 -1.383187
H -0.327547 0.587086 2.228712
H -0.541962 -1.139607 1.891401
H 0.219117 -0.662624 -0.548430
H 2.116611 0.441169 1.575596
H 0.658640 -3.098437 1.878814
H 3.739880 -0.524706 0.211442
H 1.631270 -5.052415 0.660949
H 4.725571 -2.485796 -0.994890
H 3.672476 -4.757733 -0.774973
H -4.147719 0.584835 -1.029075
H -3.576678 1.100310 -2.667951
H -0.500726 4.438951 0.804977
H 1.003615 3.912695 -0.053642
H -4.866295 -1.076669 -2.835428
H -3.145968 -1.346982 -3.247818
H -3.774324 -1.827250 -1.634528
H -0.437156 5.392023 -1.551236
H -0.272117 3.739271 -2.217805
H -1.786276 4.226386 -1.385349


