%chk=000188468.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188468

0 1
Br -1.569800 -3.678600 0.312576
C 0.015053 -1.256008 0.504211
C -1.179476 -0.352000 0.267336
C 1.322346 -0.532119 0.237172
C -0.105963 -2.531183 -0.337230
C -2.267306 -0.408970 1.153644
C 1.898241 0.215275 1.279036
C -1.232494 0.523069 -0.825186
C 1.966644 -0.573341 -1.005926
C -3.437659 1.277922 -0.143552
C 3.747317 0.848197 -0.162426
C -3.386293 0.398190 0.950860
C 3.097338 0.898099 1.082915
C -2.351858 1.333583 -1.029389
C 3.170888 0.108185 -1.204043
C -4.642725 2.136575 -0.353309
C 5.033458 1.581678 -0.361911
H 0.021965 -1.559613 1.589844
H 0.812851 -3.140396 -0.286049
H -0.333869 -2.310630 -1.394328
H -2.245796 -1.094623 2.000590
H 1.401934 0.269070 2.247727
H -0.395283 0.582233 -1.519909
H 1.535914 -1.132684 -1.834658
H -4.224606 0.342989 1.642053
H 3.531488 1.473909 1.898132
H -2.377002 2.009745 -1.881114
H 3.659308 0.062543 -2.175434
H -4.533213 2.822103 -1.203180
H -5.535466 1.524056 -0.545814
H -4.854687 2.752360 0.532052
H 5.796867 1.253023 0.357761
H 5.454670 1.437331 -1.365050
H 4.899015 2.664131 -0.221999


%chk=000188468-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188468

0 1
Br -1.580210 -3.797898 0.209011
C 0.004243 -1.291256 0.468021
C -1.204955 -0.366633 0.253748
C 1.342074 -0.567063 0.232545
C -0.075862 -2.569702 -0.395435
C -2.227743 -0.287956 1.230811
C 1.943609 0.136168 1.308476
C -1.343750 0.408980 -0.923484
C 1.997595 -0.541425 -1.023864
C -3.506389 1.303919 -0.148029
C 3.809377 0.869747 -0.124417
C -3.358142 0.533421 1.033935
C 3.150915 0.841600 1.133863
C -2.477534 1.227080 -1.120856
C 3.211542 0.163175 -1.196025
C -4.730433 2.178839 -0.359518
C 5.110184 1.633170 -0.304885
H -0.008700 -1.616926 1.525957
H 0.831029 -3.186660 -0.303963
H -0.308415 -2.364211 -1.451096
H -2.144151 -0.885772 2.146488
H 1.454314 0.134096 2.290399
H -0.553963 0.395210 -1.683831
H 1.574011 -1.077834 -1.881407
H -4.137841 0.574113 1.804894
H 3.592126 1.376935 1.984013
H -2.562491 1.820203 -2.039741
H 3.699608 0.163418 -2.178305
H -4.653810 2.762236 -1.293121
H -5.652556 1.569963 -0.419101
H -4.866194 2.892171 0.474811
H 5.892167 1.265244 0.385697
H 5.497159 1.536463 -1.333797
H 4.974985 2.711286 -0.096395


