%chk=000288461.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288461

0 1
Br -4.454420 0.447062 0.298090
O -1.842978 2.268841 0.627167
O -2.906748 -2.268048 0.017790
O -2.560118 -1.033788 -1.731545
O 4.331905 -1.062840 -0.810614
O 4.520505 -0.002314 1.066170
N -2.699050 -1.209609 -0.534378
N 3.884122 -0.385294 0.098872
C -1.679708 1.129142 -0.214872
C -0.220015 0.732203 -0.119330
C -2.585305 0.008489 0.352765
C 0.339854 -0.057090 -1.135654
C 0.558524 1.157951 0.965228
C 1.682638 -0.426776 -1.067050
C 1.904189 0.796077 1.040755
C 2.454499 0.003525 0.023210
H -1.969997 1.380609 -1.266260
H -2.273684 -0.266288 1.394593
H -0.270508 -0.385515 -1.983920
H 0.109119 1.788052 1.740521
H 2.138423 -1.044201 -1.850412
H 2.530055 1.122594 1.879545
H -2.674403 2.753318 0.408930


%chk=000288461-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288461

0 1
Br -4.569811 0.634537 0.311455
O -1.866875 2.422945 0.472038
O -2.295046 -2.287612 0.367911
O -2.571396 -1.234354 -1.645204
O 4.359392 -1.089550 -0.890223
O 4.478797 -0.180356 1.198558
N -2.498334 -1.252367 -0.361942
N 3.842144 -0.462693 0.112031
C -1.719433 1.181686 -0.276478
C -0.254237 0.764440 -0.185876
C -2.625918 0.089223 0.371250
C 0.357470 0.069153 -1.258737
C 0.490901 1.059585 0.984029
C 1.703006 -0.337795 -1.168213
C 1.836523 0.660290 1.088167
C 2.420391 -0.037541 0.008773
H -2.028863 1.291889 -1.334058
H -2.392610 -0.098008 1.429067
H -0.214272 -0.152751 -2.165855
H 0.019700 1.630773 1.788697
H 2.198782 -0.874093 -1.981179
H 2.436811 0.878405 1.975111
H -2.790224 2.770293 0.360278


