%chk=000263599.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000263599

0 1
Br 5.576026 0.429023 -0.001045
O 1.239459 -1.367453 0.000757
N 0.259587 0.722666 0.000822
C 2.705651 0.552893 0.003145
C -1.124720 0.344905 -0.000088
C 1.359079 -0.159294 0.001054
C -2.074428 1.388616 0.000463
C -1.541383 -0.996422 -0.001499
C 3.827901 -0.471608 -0.003514
C -3.433682 1.074663 -0.000508
C -2.907041 -1.285833 -0.002454
C -3.855965 -0.258845 -0.001980
H 2.789217 1.224948 -0.879543
H 2.790643 1.214907 0.893372
H 0.436195 1.729347 0.001577
H 3.790119 -1.120417 -0.899025
H 3.792240 -1.129514 0.885476
H -1.762324 2.429149 0.001677
H -0.806895 -1.808550 -0.001746
H -4.170566 1.877624 -0.000055
H -3.232313 -2.326683 -0.003565
H -4.917199 -0.495421 -0.002723


%chk=000263599-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000263599

0 1
Br 5.635289 0.572604 -0.003862
O 1.302473 -1.465099 0.001665
N 0.257010 0.642132 0.003198
C 2.711043 0.554413 0.004657
C -1.129038 0.300495 0.001022
C 1.365825 -0.199289 0.005143
C -2.062224 1.372290 -0.000174
C -1.595329 -1.041147 0.000037
C 3.874925 -0.439609 -0.005362
C -3.446280 1.109107 -0.002304
C -2.985566 -1.286140 -0.002106
C -3.917843 -0.224208 -0.003291
H 2.772528 1.215916 -0.880983
H 2.778435 1.204613 0.898211
H 0.456135 1.646274 0.003338
H 3.892029 -1.061936 -0.909671
H 3.897104 -1.073818 0.890502
H -1.704636 2.410449 0.000594
H -0.874683 -1.860423 0.000986
H -4.154574 1.944641 -0.003191
H -3.339772 -2.322942 -0.002854
H -4.993249 -0.429621 -0.004956


