%chk=000239231.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239231

0 1
Br -1.176074 0.086762 -2.023179
O -1.715102 1.313147 1.348045
O 2.451112 1.004262 -0.575022
N 1.099618 -0.861943 -0.601118
N 0.362073 1.214677 0.380459
C -0.086124 -1.556674 -0.038752
C -1.236231 -0.538049 -0.166406
C 0.121536 -2.005175 1.405371
C -0.945659 0.730599 0.625035
C 1.396291 0.474607 -0.291607
H -0.298168 -2.454072 -0.683734
H -2.233498 -0.959893 0.071597
H 1.837215 -1.421885 -1.027396
H 0.937042 -2.736523 1.484999
H 0.380616 -1.176943 2.079114
H -0.779447 -2.480856 1.813843
H 0.613301 2.158460 0.706552


%chk=000239231-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239231

0 1
Br -1.756891 -0.173712 -2.067328
O -1.767803 1.532717 1.108759
O 2.608714 1.027657 -0.441217
N 1.183196 -0.830137 -0.511254
N 0.429061 1.215655 0.393809
C -0.046686 -1.510760 -0.057623
C -1.226622 -0.524382 -0.126644
C 0.095921 -2.081580 1.380917
C -0.910287 0.829626 0.514252
C 1.493389 0.484316 -0.220615
H -0.245831 -2.343546 -0.754434
H -2.138452 -0.935004 0.328161
H 1.918608 -1.364260 -0.974208
H 0.954533 -2.773392 1.422684
H 0.268148 -1.278059 2.118545
H -0.812031 -2.638550 1.673856
H 0.681532 2.153914 0.720140


