%chk=000217662.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217662

0 1
Br 0.514584 1.542081 1.575328
O -0.181232 -1.154734 -0.293413
O -1.523002 0.652352 -0.678615
C 0.868635 1.083252 -0.316292
C 2.237793 0.422496 -0.448508
C -0.227055 0.152433 -0.886946
C 2.231655 -0.987240 0.153287
C 1.091571 -1.824101 -0.428264
C -2.261608 0.237620 0.511375
C -3.457370 -0.556559 0.015126
H 0.831136 2.063854 -0.841304
H 3.019526 1.039197 0.040902
H 2.523151 0.381198 -1.520468
H -0.144021 0.073261 -1.995564
H 3.201831 -1.487599 -0.022350
H 2.117707 -0.920346 1.256715
H 1.246599 -2.062608 -1.494931
H 0.913657 -2.754107 0.143551
H -1.622381 -0.352877 1.190127
H -2.543809 1.200110 0.973568
H -4.156802 -0.777772 0.827311
H -4.000293 -0.007082 -0.764683
H -3.138473 -1.507927 -0.430953


%chk=000217662-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217662

0 1
Br 0.534611 1.494266 1.682323
O -0.026542 -1.331563 -0.170280
O -1.571671 0.352218 -0.799590
C 0.825099 1.013150 -0.286898
C 2.260124 0.477906 -0.470910
C -0.197529 -0.027181 -0.816867
C 2.419364 -0.932885 0.141381
C 1.329253 -1.878145 -0.396978
C -2.370056 0.135687 0.445849
C -3.756844 -0.333656 0.005715
H 0.662098 1.977879 -0.794306
H 2.988711 1.186013 -0.040895
H 2.457059 0.432797 -1.564190
H 0.039167 -0.126230 -1.905095
H 3.417544 -1.343208 -0.103206
H 2.340344 -0.868380 1.241216
H 1.471433 -2.054766 -1.487208
H 1.330779 -2.848515 0.124886
H -1.865380 -0.614554 1.077196
H -2.421469 1.096048 0.990189
H -4.416650 -0.443672 0.887038
H -4.215719 0.397688 -0.682699
H -3.691927 -1.305995 -0.511673


