%chk=000238013.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238013

0 1
Br -5.815268 -0.749445 -0.024887
N -0.014868 1.137989 0.464469
N 1.203279 -0.749280 -0.383830
N 3.665433 -0.663648 -0.496692
N 4.838934 1.207408 0.292064
N 2.458425 -2.531782 -1.292501
C -1.339422 0.626476 0.325719
C 1.200021 0.522703 0.129246
C -1.677251 -0.462130 -0.498451
C -2.349621 1.308991 1.044219
C 2.394179 1.250754 0.350995
C 3.612854 0.610320 0.035340
C -3.008026 -0.868391 -0.597629
C -3.677302 0.898492 0.937412
C -3.995824 -0.187517 0.118217
C 2.447456 -1.283646 -0.691938
H 0.063522 2.047552 0.928480
H -0.906500 -0.998075 -1.062315
H -2.103468 2.150848 1.687663
H 2.382922 2.249285 0.759147
H -3.266951 -1.714925 -1.236860
H -4.454836 1.425006 1.493769
H 5.679328 0.767477 -0.056580
H 4.886504 2.197583 0.454905
H 1.614226 -3.084232 -1.285839
H 3.335153 -3.025818 -1.370923


%chk=000238013-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238013

0 1
Br -5.943153 -0.701387 -0.011776
N -0.007279 1.042246 0.520971
N 1.238450 -0.736605 -0.478422
N 3.688165 -0.611150 -0.579426
N 4.854452 1.211677 0.281868
N 2.519180 -2.438386 -1.440336
C -1.336517 0.582130 0.369063
C 1.217672 0.478245 0.149253
C -1.690169 -0.651084 -0.245086
C -2.372023 1.423778 0.868660
C 2.405985 1.202555 0.444246
C 3.634111 0.606716 0.053228
C -3.046998 -1.023051 -0.353294
C -3.726362 1.052301 0.760954
C -4.053666 -0.174054 0.147111
C 2.483791 -1.215148 -0.808781
H 0.077206 1.949649 0.982630
H -0.893677 -1.291237 -0.625556
H -2.120526 2.379600 1.346346
H 2.376743 2.172982 0.948637
H -3.310642 -1.972932 -0.827906
H -4.509320 1.709742 1.149241
H 5.692471 0.723938 -0.026274
H 4.927564 2.114669 0.740134
H 1.649121 -2.924031 -1.636204
H 3.418319 -2.829169 -1.706081


