%chk=000289798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289798

0 1
Br 5.115155 -0.538209 -0.211160
F -5.115137 -0.046922 0.156288
F -4.273065 -1.677117 -0.887629
F -4.194781 -1.617420 1.225364
O 2.609407 3.549025 -0.228847
O 0.441226 4.049819 -0.163845
C -0.263586 -0.321903 -0.016281
C -0.172265 1.092906 -0.058744
C 0.942916 -1.139742 -0.038743
C 2.211031 -0.508403 -0.103473
C 1.145921 1.702197 -0.124639
C -1.546332 -0.925805 0.048245
C 2.275178 0.930755 -0.145474
C -2.697094 -0.154770 0.069814
C -1.366102 1.860747 -0.035484
C 0.877549 -2.559329 0.002823
C -2.605255 1.256882 0.027373
C 3.374538 -1.326880 -0.124388
C 2.026208 -3.322838 -0.019031
C 3.296537 -2.703525 -0.083547
C -4.033344 -0.840765 0.138649
C 1.279929 3.176510 -0.170216
H -1.611786 -2.019214 0.080939
H 3.262768 1.416453 -0.195606
H -1.302872 2.958690 -0.068208
H -0.099945 -3.046775 0.052758
H -3.507184 1.873308 0.043928
H 1.970243 -4.412637 0.013095
H 4.193123 -3.327180 -0.099859
H 2.718518 4.539441 -0.260201


%chk=000289798-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289798

0 1
Br 5.180905 -0.512742 -0.224676
F -5.159219 0.049929 0.146477
F -4.277850 -1.727281 -0.955754
F -4.200781 -1.651471 1.302319
O 2.685723 3.562653 -0.227776
O 0.443062 4.095438 -0.159813
C -0.281401 -0.332487 -0.014637
C -0.189617 1.110739 -0.058659
C 0.928431 -1.163796 -0.036666
C 2.216405 -0.510987 -0.105368
C 1.137521 1.722654 -0.125192
C -1.573020 -0.929043 0.049620
C 2.274994 0.921816 -0.147102
C -2.736027 -0.147352 0.070208
C -1.395540 1.881249 -0.036000
C 0.883893 -2.588612 0.006801
C -2.650164 1.268625 0.027158
C 3.395668 -1.328721 -0.128700
C 2.058105 -3.350127 -0.017174
C 3.332812 -2.723045 -0.085916
C -4.066267 -0.841060 0.138888
C 1.328052 3.202740 -0.171382
H -1.676861 -2.016085 0.083051
H 3.252117 1.406186 -0.197904
H -1.319886 2.969072 -0.069240
H -0.072875 -3.112941 0.060363
H -3.560724 1.873663 0.043315
H 2.003649 -4.442905 0.016828
H 4.245629 -3.323763 -0.104869
H 2.744766 4.554953 -0.254299


