%chk=000104543.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000104543

0 1
Br 0.181019 -2.674416 -0.000917
F 4.456556 0.280302 -0.000077
C 0.350242 0.195983 0.000032
C -1.130303 0.184947 0.000080
C 1.090229 -0.995613 -0.000390
C 1.034567 1.424524 0.000418
C -1.829634 0.184632 -1.215843
C -1.829553 0.183614 1.216047
C 2.486403 -0.991813 -0.000433
C 2.429300 1.466875 0.000385
C -3.227043 0.184909 -1.211219
C -3.226963 0.183894 1.211515
C 3.123642 0.252445 -0.000041
C -3.926371 0.185795 0.000172
H 0.461791 2.354282 0.000749
H -1.283809 0.176020 -2.157887
H -1.283667 0.174212 2.158048
H 3.058803 -1.921515 -0.000760
H 2.958501 2.419529 0.000687
H -3.771773 0.181884 -2.154070
H -3.771630 0.180080 2.154399
H -5.014806 0.185029 0.000207


%chk=000104543-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104543

0 1
Br 0.275759 -2.781135 -0.000857
F 4.579352 0.312887 -0.000067
C 0.350369 0.161283 0.000022
C -1.150078 0.157449 0.000070
C 1.137883 -1.019840 -0.000349
C 1.045975 1.402132 0.000357
C -1.868513 0.175040 -1.222745
C -1.868438 0.173900 1.222945
C 2.548566 -0.989024 -0.000383
C 2.454724 1.475908 0.000334
C -3.281315 0.205168 -1.222338
C -3.281239 0.204033 1.222653
C 3.173058 0.269281 -0.000037
C -3.991653 0.219993 0.000187
H 0.457073 2.325020 0.000645
H -1.319391 0.160397 -2.171107
H -1.319256 0.158378 2.171258
H 3.147213 -1.902858 -0.000672
H 2.982447 2.433321 0.000595
H -3.825002 0.216697 -2.173590
H -3.824867 0.214678 2.173949
H -5.087165 0.242891 0.000231


