%chk=000264185.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264185

0 1
Br 5.266229 1.373275 -1.665690
S -0.003447 0.387158 -0.425163
C -2.418173 -0.266147 0.338746
C -1.016638 -0.678928 0.652718
C 1.668651 -0.045604 -0.106801
C -3.129997 -0.909061 -0.686955
C -3.029577 0.766676 1.067818
C 2.609970 0.679822 -0.852813
C 2.069487 -1.023525 0.804004
C -4.442033 -0.524162 -0.974011
C -4.341943 1.146160 0.775104
C -5.050723 0.501686 -0.243853
C 3.961302 0.398156 -0.660670
C 3.434890 -1.284517 0.975631
C 4.392538 -0.576064 0.244914
H -0.761048 -0.518566 1.717800
H -0.835217 -1.748376 0.431787
H -2.659444 -1.703003 -1.264930
H -2.480786 1.278349 1.857017
H 2.293644 1.445422 -1.565728
H 1.345808 -1.590027 1.385852
H -4.990705 -1.024074 -1.770965
H -4.812586 1.948373 1.341708
H -6.072788 0.799483 -0.469751
H 3.753959 -2.047520 1.685923
H 5.453826 -0.782786 0.382009


%chk=000264185-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000264185

0 1
Br 5.583912 1.259579 -1.585872
S 0.060076 0.583823 -0.598882
C -2.466368 -0.210365 0.298748
C -1.007861 -0.529564 0.529392
C 1.763323 0.037968 -0.186917
C -3.204785 -0.899104 -0.697751
C -3.118116 0.784842 1.071463
C 2.809981 0.700940 -0.882806
C 2.074080 -0.973226 0.754978
C -4.569039 -0.604342 -0.913224
C -4.482460 1.081059 0.857633
C -5.211839 0.386467 -0.135262
C 4.141269 0.335110 -0.618220
C 3.423111 -1.316400 0.996271
C 4.477487 -0.668659 0.314528
H -0.706018 -0.324831 1.569946
H -0.775580 -1.575542 0.269326
H -2.707752 -1.664539 -1.305712
H -2.553829 1.327995 1.839032
H 2.584204 1.483848 -1.613028
H 1.287418 -1.497798 1.303769
H -5.128877 -1.145210 -1.684112
H -4.975040 1.849837 1.463084
H -6.270422 0.615148 -0.301053
H 3.657952 -2.099268 1.725533
H 5.520373 -0.935567 0.502838


