%chk=000277952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277952

0 1
Br -2.484422 1.664312 -1.182714
O 4.619892 -0.822050 -0.481668
O 4.440910 1.243132 0.140960
O -4.621911 -0.677677 -0.719024
O -4.610122 0.676107 0.976194
N 3.976196 0.144028 -0.108873
N -4.074349 0.051888 0.082530
C -0.229928 -0.362223 0.357442
C 0.560133 -1.443792 -0.069375
C 0.357183 0.882956 0.635423
C 2.512560 -0.032197 0.054265
C 1.935592 -1.279997 -0.227409
C 1.733872 1.051423 0.486203
C -1.680998 -0.561274 0.526935
C -2.602831 0.205758 -0.048974
H 0.100806 -2.409380 -0.288666
H -0.260039 1.720379 0.970016
H 2.567724 -2.109850 -0.566047
H 2.210156 2.016213 0.699331
H -1.965925 -1.409354 1.170351


%chk=000277952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277952

0 1
Br -2.765912 2.343141 0.460140
O 4.712718 -1.096000 -0.107226
O 4.600082 1.169845 0.150231
O -4.219984 -1.462036 0.068424
O -5.158585 0.599506 0.324456
N 4.055455 0.005785 0.032802
N -4.147120 -0.179578 0.211385
C -0.246767 -0.208925 0.114944
C 0.547601 -1.389692 -0.037076
C 0.422665 1.047118 0.239864
C 2.571254 -0.071867 0.060704
C 1.949487 -1.333081 -0.065345
C 1.825839 1.117548 0.212884
C -1.695648 -0.412649 0.126780
C -2.764167 0.430948 0.246327
H 0.048390 -2.360337 -0.133836
H -0.151151 1.967741 0.358107
H 2.563263 -2.229667 -0.181072
H 2.353092 2.070415 0.306971
H -2.016013 -1.459816 0.017436


