%chk=000222105.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222105

0 1
Br -1.397860 -4.054223 -0.316652
O -0.767524 1.921760 0.309590
O -4.507064 0.384078 -0.205786
N -3.405966 2.058488 0.837209
C 1.655797 0.370113 0.093383
C 2.416984 0.113321 -1.222801
C 2.463302 -0.136675 1.305313
C 3.805750 0.764092 -1.182194
C 3.852105 0.514315 1.342563
C 4.614060 0.281292 0.030352
C 0.279333 -0.254260 0.056964
C -0.875308 0.560001 0.166056
C 0.103738 -1.630692 -0.083731
C -2.174537 0.027672 0.130148
C -1.188666 -2.171267 -0.122187
C -2.318344 -1.363536 -0.025180
C -3.441466 0.818522 0.209480
H 1.540091 1.489187 0.205711
H 1.835551 0.501438 -2.079770
H 2.519456 -0.975233 -1.396532
H 2.568078 -1.237792 1.258078
H 1.914998 0.073827 2.242223
H 3.708310 1.866071 -1.154664
H 4.353536 0.532073 -2.115542
H 4.432645 0.105902 2.191761
H 3.757763 1.600018 1.534763
H 4.845638 -0.795861 -0.080502
H 5.589935 0.800887 0.063831
H 0.976983 -2.284156 -0.165561
H -3.332706 -1.785399 -0.074670
H 0.199730 2.215921 0.297759
H -2.546944 2.520840 1.093755
H -4.242095 2.623777 0.846333


%chk=000222105-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222105

0 1
Br -1.370805 -4.107605 -0.341824
O -0.816310 1.997209 0.409803
O -4.642893 0.149220 0.240620
N -3.479249 2.141202 0.467086
C 1.672222 0.382918 0.159851
C 2.402903 0.210192 -1.205107
C 2.530149 -0.204673 1.318936
C 3.822111 0.823869 -1.172561
C 3.948121 0.413261 1.344544
C 4.665907 0.239156 -0.014881
C 0.259304 -0.204663 0.124570
C -0.914083 0.595950 0.241793
C 0.097004 -1.600235 -0.049026
C -2.218577 0.027077 0.191135
C -1.189872 -2.166177 -0.099249
C -2.338952 -1.373809 0.018427
C -3.536626 0.774460 0.301357
H 1.637089 1.484362 0.346747
H 1.798756 0.664727 -2.013518
H 2.475629 -0.871930 -1.434609
H 2.612862 -1.302036 1.185882
H 2.014773 -0.041409 2.284730
H 3.745274 1.924644 -1.049253
H 4.326294 0.648745 -2.142174
H 4.541931 -0.050091 2.155399
H 3.874202 1.495132 1.583049
H 4.840514 -0.840904 -0.199606
H 5.660732 0.723313 0.014102
H 0.979055 -2.240312 -0.146199
H -3.352753 -1.783820 -0.017532
H 0.131510 2.280662 0.433932
H -2.577881 2.622978 0.512464
H -4.363039 2.643087 0.540611


