%chk=000296011.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296011

0 1
Br -3.418052 2.069422 0.017772
O -1.104598 -2.096476 1.414977
O 2.430089 -1.112166 -1.405678
N 0.196272 0.079885 -0.043380
N -2.102243 -0.609026 -0.050247
N 2.483393 0.742904 -0.020065
C -1.124223 0.413481 -0.027359
C 1.110714 1.097863 -0.016833
C -1.559750 1.764873 -0.005625
C 0.740154 2.466104 0.038355
C -0.616066 2.788668 0.034402
C -1.931454 -1.895233 0.562014
C 3.018709 -0.470349 -0.575373
C -2.936504 -2.902809 0.079443
C 4.396477 -0.778562 -0.060402
H 1.491680 3.248208 0.061000
H -0.933922 3.833856 0.064149
H -2.936200 -0.435665 -0.620483
H 3.109381 1.385744 0.467088
H -3.972821 -2.601211 0.277974
H -2.777332 -3.864635 0.596169
H -2.837857 -3.101702 -0.997264
H 5.129675 0.001143 -0.299655
H 4.763164 -1.714445 -0.516479
H 4.404413 -0.935169 1.028101


%chk=000296011-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296011

0 1
Br -3.479285 2.210044 -0.094610
O -0.935718 -2.363424 1.179411
O 2.464966 -1.177530 -1.354276
N 0.186467 0.078115 0.036704
N -2.074113 -0.660636 -0.000013
N 2.478207 0.692960 0.075398
C -1.133469 0.385845 0.007350
C 1.110758 1.069463 0.025007
C -1.562634 1.747223 -0.038204
C 0.763694 2.446770 -0.010269
C -0.607146 2.778403 -0.042577
C -1.915991 -1.980100 0.499549
C 3.064478 -0.443157 -0.532623
C -3.074423 -2.899762 0.112743
C 4.504090 -0.695295 -0.084991
H 1.528677 3.228154 -0.045124
H -0.925073 3.823811 -0.080033
H -3.006772 -0.408504 -0.338118
H 3.105437 1.329648 0.570246
H -4.040999 -2.371013 0.025602
H -3.162935 -3.698743 0.864155
H -2.852946 -3.369899 -0.863361
H 5.032531 0.220316 0.236942
H 5.059748 -1.165172 -0.910823
H 4.495550 -1.402815 0.764516


