%chk=000223717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223717

0 1
Br -6.362347 0.304506 -0.000031
O -0.442603 -0.994022 0.000259
N 4.098579 -0.083496 0.000015
N 3.941565 -1.448748 0.000360
N 2.573816 1.910780 -0.000458
N 0.214402 1.272386 -0.000231
C 1.872503 -0.493020 0.000104
C 2.868411 0.560189 -0.000185
C 0.531133 -0.042799 0.000071
C 2.615918 -1.718767 0.000308
C 5.431929 0.532269 -0.000338
C -1.800909 -0.568003 0.000154
C 1.256793 2.190891 -0.000496
C -2.446646 -0.436846 -1.231603
C -2.446448 -0.435279 1.231849
C -3.819845 -0.175293 -1.223783
C -3.819646 -0.173732 1.223918
C -4.486480 -0.049650 0.000041
H 2.215606 -2.722391 0.000579
H 6.005172 0.220925 0.893683
H 6.003151 0.224307 -0.896822
H 5.338565 1.636142 0.001812
H 0.953179 3.252084 -0.000669
H -1.891452 -0.533477 -2.163322
H -1.891100 -0.530707 2.163600
H -4.358247 -0.068106 -2.167781
H -4.357896 -0.065340 2.167865


%chk=000223717-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223717

0 1
Br -6.447559 0.415386 -0.000002
O -0.438656 -1.025439 0.000019
N 4.124366 -0.065467 -0.000014
N 4.006942 -1.462843 -0.000067
N 2.617655 1.888624 0.000077
N 0.251537 1.249684 -0.000001
C 1.911835 -0.509112 0.000034
C 2.886305 0.546930 0.000064
C 0.562619 -0.063766 -0.000031
C 2.670398 -1.724142 0.000214
C 5.439451 0.572987 -0.000396
C -1.812639 -0.606312 -0.000006
C 1.288033 2.160101 0.000107
C -2.481094 -0.462548 -1.229441
C -2.480609 -0.460347 1.229439
C -3.860342 -0.157260 -1.232317
C -3.859850 -0.155047 1.232310
C -4.530409 -0.006423 -0.000006
H 2.323274 -2.754507 0.000330
H 6.007384 0.275995 0.896578
H 6.005582 0.279073 -0.899548
H 5.282519 1.662675 0.001546
H 0.995719 3.213495 0.000003
H -1.935856 -0.586972 -2.169570
H -1.935007 -0.583064 2.169580
H -4.397681 -0.040409 -2.177364
H -4.396813 -0.036489 2.177358


