%chk=000230058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230058

0 1
Br -2.920822 2.280700 0.203599
O -0.827660 0.904953 2.011140
O -2.085705 -0.799160 0.250685
O -1.683654 -0.455483 -1.953369
C -0.252730 1.345661 0.791686
C 0.968486 0.523667 0.417989
C -1.295916 1.346697 -0.352678
C 1.462185 -0.434330 1.312375
C 1.633352 0.751181 -0.795538
C -1.689199 -0.036650 -0.824715
C 2.602354 -1.175015 0.987511
C 2.772365 0.008557 -1.117237
C 3.256895 -0.957210 -0.228343
C -2.462835 -2.177746 -0.021603
H 0.048289 2.397795 1.040594
H -0.896017 1.915259 -1.232408
H 0.959103 -0.589139 2.269490
H 1.271312 1.503448 -1.494180
H 2.982036 -1.919444 1.685846
H 3.283360 0.182730 -2.063263
H -1.331130 0.055632 1.890184
H 4.143941 -1.535227 -0.482410
H -3.033791 -2.452100 0.872052
H -1.548586 -2.769485 -0.128170
H -3.075034 -2.233590 -0.929140


%chk=000230058-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230058

0 1
Br -2.885191 2.410160 -0.221670
O -0.849478 0.985851 2.000207
O -2.108699 -0.855758 0.407426
O -1.824774 -0.704738 -1.900225
C -0.260836 1.358214 0.728229
C 1.020095 0.568478 0.391492
C -1.239231 1.222781 -0.474015
C 1.352771 -0.610548 1.098701
C 1.884012 1.026180 -0.636470
C -1.740977 -0.187886 -0.769790
C 2.524148 -1.331193 0.772449
C 3.054479 0.307282 -0.962555
C 3.375404 -0.878722 -0.261475
C -2.635302 -2.235320 0.234549
H -0.013220 2.430933 0.825334
H -0.783444 1.611948 -1.395305
H 0.711644 -0.936306 1.923889
H 1.654483 1.954670 -1.176106
H 2.777158 -2.239534 1.330874
H 3.715613 0.672274 -1.756262
H -1.454340 0.208068 1.846016
H 4.283964 -1.437256 -0.512342
H -2.871404 -2.576624 1.251591
H -1.868970 -2.871975 -0.236569
H -3.537305 -2.209277 -0.397878


