%chk=000238745.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238745

0 1
Br -2.645617 2.862502 0.047733
N -0.239391 1.071822 0.102056
N -1.342766 -1.058814 -0.079456
N -3.810181 -1.115051 -0.187763
N -2.518505 -3.091659 -0.299705
N 6.325990 -0.741300 0.155418
C -1.400541 0.307544 -0.009465
C 1.111096 0.607925 0.109663
C -2.651021 0.989586 -0.032739
C -3.842872 0.242761 -0.121606
C 2.077900 1.529956 0.580053
C 1.512905 -0.657936 -0.352803
C 3.423057 1.179180 0.589765
C 2.862390 -1.001820 -0.337822
C -2.559066 -1.721848 -0.177404
C -5.179352 0.893474 -0.143069
C 3.823205 -0.089581 0.132010
C 5.206620 -0.449617 0.144874
H -0.352394 2.084834 0.258877
H 1.778441 2.512514 0.941904
H 0.777297 -1.379196 -0.723271
H -5.276426 1.576694 -1.002932
H -6.000674 0.160072 -0.210997
H -5.346892 1.493364 0.766390
H 4.170098 1.886947 0.954445
H 3.175421 -1.984916 -0.695744
H -1.646173 -3.584463 -0.190557
H -3.376849 -3.621975 -0.278555


%chk=000238745-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238745

0 1
Br -2.716767 2.927291 0.356330
N -0.225771 0.998755 0.150411
N -1.385823 -1.057906 -0.202614
N -3.835339 -1.101922 -0.300691
N -2.566659 -3.046826 -0.551425
N 6.452955 -0.703908 0.196817
C -1.411171 0.290226 0.001351
C 1.120852 0.573426 0.146139
C -2.668590 0.979418 0.060189
C -3.870455 0.253629 -0.094526
C 2.109546 1.586451 0.323379
C 1.535935 -0.777970 -0.019100
C 3.473670 1.264634 0.337097
C 2.905039 -1.094326 -0.003894
C -2.594856 -1.689037 -0.344436
C -5.234660 0.895484 -0.045868
C 3.892639 -0.086212 0.173199
C 5.289463 -0.422969 0.186499
H -0.363410 2.004966 0.291152
H 1.801460 2.631880 0.450719
H 0.775960 -1.546807 -0.155513
H -5.343418 1.663843 -0.833075
H -5.999387 0.118034 -0.188937
H -5.404314 1.401227 0.922232
H 4.222106 2.051065 0.473725
H 3.219979 -2.135159 -0.130348
H -1.676346 -3.533676 -0.597555
H -3.446939 -3.542612 -0.661959


