%chk=000203115.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203115

0 1
Br 1.155204 2.690707 0.039738
N -1.776060 2.016024 0.422687
N 2.526048 0.051887 -0.513859
N -1.412666 -2.680160 -0.562221
N -1.634843 -0.357566 -0.056846
N 0.582230 -1.387487 -0.303456
C -3.165754 2.259304 -0.061157
C -2.023087 3.143483 -0.524169
C 3.570558 -0.916275 -0.073659
C 3.488897 0.465402 0.548625
C -2.429887 -3.301459 0.332380
C -1.061943 -3.936868 0.157703
C -1.035539 0.869548 0.045719
C 1.149032 -0.142074 -0.253006
C -0.797327 -1.436926 -0.255377
C 0.361075 1.011526 -0.068137
H -3.867825 2.607777 0.703531
H -3.642157 1.555259 -0.750991
H -1.663662 3.094148 -1.555531
H -1.877359 4.141533 -0.095280
H 4.333280 -1.146411 -0.825609
H 3.294960 -1.805777 0.500326
H 3.158152 0.592832 1.582404
H 4.187592 1.255832 0.250479
H -3.306717 -3.710677 -0.182251
H -2.708921 -2.822009 1.274794
H -0.332379 -3.927228 0.971683
H -0.930402 -4.813947 -0.486418


%chk=000203115-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203115

0 1
Br 1.233050 2.860625 0.088696
N -1.846310 2.018227 0.387310
N 2.567534 0.004777 -0.479581
N -1.366617 -2.585622 -0.510156
N -1.598280 -0.287350 -0.064859
N 0.603742 -1.304409 -0.366377
C -3.238929 2.141234 -0.107115
C -2.174668 3.171334 -0.505307
C 3.513652 -1.055999 -0.064022
C 3.594050 0.348329 0.549516
C -2.389648 -3.216200 0.352869
C -1.003834 -3.858048 0.150484
C -1.009888 0.945805 0.058309
C 1.186098 -0.065459 -0.276525
C -0.761023 -1.345987 -0.286119
C 0.399238 1.100514 -0.061759
H -3.982874 2.402026 0.651568
H -3.563701 1.413494 -0.859036
H -1.799309 3.136033 -1.534895
H -2.155738 4.156051 -0.029641
H 4.243047 -1.355599 -0.822491
H 3.111205 -1.868662 0.551034
H 3.252561 0.467053 1.584802
H 4.371225 1.046913 0.226565
H -3.261680 -3.628096 -0.163864
H -2.596250 -2.738414 1.317996
H -0.292165 -3.807651 0.983273
H -0.893987 -4.724521 -0.508572


