%chk=000184442.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184442

0 1
Br 1.652880 -3.004583 0.417404
S -0.121345 0.996257 -0.058718
S 3.367515 0.397468 -1.503481
S -3.911902 -0.890520 -0.724126
C 1.172846 -0.177503 0.072806
C -1.366795 -0.229186 0.084910
C 2.533616 0.260933 0.031819
C 0.637105 -1.426849 0.218176
C -0.801848 -1.467209 0.223402
C -2.737880 0.163788 0.036306
C 3.371149 0.616596 1.050766
C -3.358002 1.293368 0.497088
C 4.686021 1.005072 0.597621
C -4.777794 1.307674 0.240522
C 4.837640 0.940673 -0.753796
C -5.227303 0.198223 -0.408996
H -1.349877 -2.396260 0.337625
H 3.103128 0.612191 2.099336
H -2.864787 2.106458 1.013985
H 5.455053 1.311568 1.294566
H -5.398904 2.138279 0.550712
H 5.709432 1.173474 -1.340987
H -6.232649 -0.036812 -0.714539


%chk=000184442-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184442

0 1
Br 1.625374 -2.975928 0.781336
S -0.150025 1.124410 -0.049581
S 3.001954 1.817648 -0.858974
S -4.089359 -1.092364 0.378949
C 1.194160 -0.089253 0.214999
C -1.415489 -0.161535 0.180225
C 2.567527 0.354498 0.144815
C 0.619273 -1.337304 0.475179
C -0.810848 -1.386189 0.459772
C -2.815072 0.170446 0.067397
C 3.716833 -0.169711 0.743835
C -3.415457 1.387738 -0.264187
C 4.920814 0.554120 0.439957
C -4.852117 1.350193 -0.281596
C 4.721130 1.646069 -0.390856
C -5.377647 0.107217 0.036687
H -1.372219 -2.306412 0.634685
H 3.691215 -1.039187 1.402155
H -2.836814 2.287034 -0.493724
H 5.901712 0.278496 0.834174
H -5.474569 2.214914 -0.522399
H 5.444722 2.365312 -0.770059
H -6.417799 -0.207111 0.099612


