%chk=000202974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202974

0 1
Br 4.393418 -1.750846 0.209431
N -3.668075 0.106761 -0.088500
N -0.364943 1.978778 -0.129744
C -1.717581 -1.457764 0.279953
C -0.864715 -0.241546 0.137430
C -1.403293 1.029750 -0.003337
C -3.136699 -1.020226 0.741977
C -2.855632 1.365147 0.008650
C 0.568021 -0.115804 0.092667
C 0.858402 1.285975 -0.078965
C -1.775081 -2.233884 -1.039644
C 1.629793 -1.032347 0.179100
C 2.178984 1.767656 -0.162580
C 2.918062 -0.533225 0.094716
C 3.205923 0.842652 -0.073913
H -1.287451 -2.121231 1.072548
H -3.842256 -1.870563 0.617141
H -3.101183 -0.776994 1.825264
H -3.094855 1.974180 0.910620
H -3.126778 1.977340 -0.885967
H -4.626806 0.316687 0.213550
H -0.475967 2.962901 -0.267069
H -0.770285 -2.451065 -1.418153
H -2.310629 -3.180712 -0.930293
H -2.294567 -1.645179 -1.809962
H 1.423546 -2.094424 0.306814
H 2.381712 2.826002 -0.292823
H 4.243933 1.172881 -0.134610


%chk=000202974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202974

0 1
Br 4.468704 -1.782197 0.162041
N -3.625227 0.116588 -0.121960
N -0.363415 1.979212 -0.101818
C -1.740554 -1.469360 0.284976
C -0.869360 -0.240227 0.135458
C -1.402393 1.041149 0.016385
C -3.151136 -0.994706 0.739539
C -2.868629 1.378831 0.035027
C 0.572845 -0.102201 0.080565
C 0.864170 1.303924 -0.066690
C -1.811993 -2.297613 -1.025014
C 1.647573 -1.028380 0.150013
C 2.183298 1.793934 -0.148565
C 2.953404 -0.520414 0.067841
C 3.242245 0.863050 -0.080405
H -1.329698 -2.114947 1.089413
H -3.872102 -1.827501 0.649267
H -3.098965 -0.701988 1.817809
H -3.108140 1.924443 0.986168
H -3.129730 2.057861 -0.801865
H -4.639937 0.258105 -0.076748
H -0.482287 2.983167 -0.217114
H -0.802169 -2.533336 -1.406260
H -2.348954 -3.250979 -0.860258
H -2.347969 -1.719173 -1.797575
H 1.465884 -2.100569 0.265327
H 2.399664 2.861718 -0.261287
H 4.279871 1.202509 -0.139970


