%chk=000259932.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259932

0 1
Br -4.704345 1.882231 -0.021382
O 0.467604 -2.938089 0.005351
N 4.801073 0.440871 0.131293
C 0.608343 0.619787 0.010659
C -0.842366 0.369441 0.002076
C 1.287527 -0.638566 0.016783
C -1.063718 -1.045367 0.001648
C 0.260170 -1.753839 0.008947
C 1.333494 1.799777 0.014646
C 2.656113 -0.726876 0.026015
C -1.912863 1.248295 -0.004543
C -2.339902 -1.571132 -0.004724
C 3.399023 0.495264 0.031309
C 2.736504 1.736727 0.019746
C -3.205172 0.689177 -0.011472
C -3.436202 -0.680969 -0.011595
H 0.832847 2.767402 0.012262
H 3.159802 -1.692024 0.040714
H -1.763349 2.326528 -0.003645
H -2.503703 -2.650426 -0.004347
H 3.308590 2.661649 0.028530
H -4.450810 -1.081091 -0.016610
H 5.320377 1.264677 -0.130243
H 5.255662 -0.418849 -0.136319


%chk=000259932-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259932

0 1
Br -4.801639 1.888788 0.000042
O 0.482075 -2.973597 -0.000139
N 4.837303 0.429847 0.000390
C 0.601720 0.635985 0.000298
C -0.857581 0.377701 0.000142
C 1.281347 -0.619576 0.000258
C -1.071903 -1.037051 0.000158
C 0.260583 -1.730516 0.000170
C 1.356859 1.822476 0.000288
C 2.673867 -0.718642 0.000220
C -1.956137 1.257018 0.000155
C -2.361978 -1.585676 0.000076
C 3.446264 0.487146 0.000291
C 2.768782 1.745349 0.000265
C -3.251842 0.682793 0.000057
C -3.479917 -0.711509 0.000007
H 0.873239 2.805665 0.000260
H 3.156423 -1.702981 0.000072
H -1.829434 2.343149 0.000248
H -2.501930 -2.671521 0.000030
H 3.361012 2.668495 0.000050
H -4.500148 -1.103748 -0.000048
H 5.396141 1.278290 0.000928
H 5.321594 -0.463289 0.000882


