%chk=000297764.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297764

0 1
Br 1.250816 -0.607787 -0.992734
O -3.881642 -1.201110 -0.101070
O 0.333512 1.065438 1.966871
N -1.675789 0.624582 -0.041351
N -0.293683 0.941684 -0.336969
N 1.892004 1.704657 0.368516
C -2.298263 0.180768 -1.348664
C -1.774201 -0.506021 0.950036
C -3.774653 -0.150245 -1.078130
C -3.258065 -0.842759 1.150123
C 0.586617 1.259019 0.804513
C 3.009197 0.767077 0.663969
C 3.016389 -0.425950 -0.272281
C 4.043119 -1.216413 -0.537728
H -1.786998 -0.702678 -1.791261
H -2.228470 1.007980 -2.084907
H -1.338667 -0.164074 1.921929
H -1.207531 -1.409455 0.639006
H -4.335305 0.733845 -0.724860
H -4.267759 -0.590887 -1.962790
H -3.394578 -1.757719 1.753887
H -3.813871 -0.000282 1.599306
H -0.313427 1.731772 -1.025053
H 1.950680 2.071286 -0.589221
H 3.963253 1.339114 0.593218
H 2.923461 0.413866 1.722790
H 3.990557 -2.071172 -1.200969
H 5.029499 -1.078835 -0.109775


%chk=000297764-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297764

0 1
Br 3.426545 -2.144415 0.852776
O -4.656954 -0.350486 -0.002014
O 0.429562 0.970250 1.470787
N -1.828347 0.181038 -0.072273
N -0.496777 0.121387 -0.534738
N 1.806411 0.470657 -0.356228
C -2.736485 0.818909 -1.058115
C -2.335701 -1.133301 0.407951
C -4.135256 0.958009 -0.428798
C -3.745126 -0.939259 0.994332
C 0.561653 0.553877 0.287543
C 3.041683 0.737049 0.376277
C 4.072132 -0.369598 0.257492
C 5.343528 -0.234246 -0.181147
H -2.816026 0.215320 -1.997202
H -2.332927 1.814600 -1.312017
H -1.649810 -1.503175 1.189766
H -2.376967 -1.882627 -0.421289
H -4.080048 1.643679 0.442898
H -4.860734 1.345166 -1.162766
H -4.192864 -1.906188 1.275187
H -3.684685 -0.279496 1.885044
H -0.287111 -0.461460 -1.360990
H 1.866579 0.243707 -1.349543
H 3.522863 1.675581 0.031183
H 2.741858 0.887530 1.430812
H 6.053396 -1.064329 -0.206437
H 5.695810 0.747522 -0.522089


