%chk=000228077.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228077

0 1
Br 2.640416 -2.645307 -0.162271
O -2.990476 -1.101015 1.197641
O 3.200057 1.678325 -0.673550
O -3.092047 -1.678053 -0.979551
O -1.369615 2.828434 0.276755
O -2.886513 1.375953 -0.253595
O 4.025189 -0.001072 0.562662
N -1.744653 1.703283 0.008207
C -0.704196 0.636647 -0.011795
C -1.046445 -0.725820 -0.049264
C 1.650552 0.055819 -0.023104
C 0.640650 1.028823 0.001207
C -0.040182 -1.694015 -0.088359
C 1.305883 -1.302686 -0.078932
C -2.472922 -1.200817 -0.065614
C 3.072401 0.497005 0.022036
H 0.904718 2.099919 0.026522
H -0.306072 -2.758149 -0.129474
H -3.956739 -1.361818 1.237512
H 4.137693 2.022846 -0.671634


%chk=000228077-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228077

0 1
Br 2.604834 -2.793557 -0.307648
O -3.118753 -0.703209 1.190444
O 3.152321 1.925532 -0.184417
O -2.959659 -2.191988 -0.596018
O -1.425996 2.824222 0.400763
O -2.842256 1.379857 -0.662178
O 4.144531 -0.165360 -0.046810
N -1.727024 1.668849 -0.083303
C -0.697033 0.601569 -0.016648
C -1.063698 -0.766786 -0.025640
C 1.689321 0.036252 -0.102370
C 0.646854 0.997152 -0.039172
C -0.034644 -1.724974 -0.117736
C 1.325911 -1.341253 -0.160301
C -2.471020 -1.282353 0.104636
C 3.105665 0.524721 -0.108082
H 0.898961 2.059417 -0.020769
H -0.303614 -2.784220 -0.149026
H -4.059181 -1.024883 1.241746
H 4.102179 2.219315 -0.172073


