%chk=000293183.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293183

0 1
Br 3.536872 1.540898 2.183576
O -2.326567 -2.324753 0.486634
O -5.010514 1.875701 0.027659
O -3.380116 1.929047 -1.502940
N -0.140845 -1.784668 0.200280
C 0.899572 -0.817357 -0.058376
C 1.573758 -0.207822 1.027467
C 1.243074 -0.502277 -1.393184
C 2.959126 1.034905 -0.577230
C 2.598030 0.708302 0.741264
C 2.268074 0.422574 -1.630474
C -1.496927 -1.451732 0.273151
C -1.847026 0.009301 0.064157
C 1.213604 -0.512976 2.441404
C 0.536040 -1.103913 -2.561258
C 0.295574 -3.191295 0.380499
C -3.339153 0.242634 0.289608
C 4.047625 2.010457 -0.867202
C -3.835105 1.402959 -0.514217
H 2.532441 0.671823 -2.658119
H -1.557236 0.316932 -0.969799
H -1.243943 0.657780 0.734675
H 0.375870 -1.216123 2.544536
H 2.066406 -0.954513 2.983086
H 0.929099 0.399415 2.990653
H -0.069132 -1.984837 -2.303699
H -0.146393 -0.373332 -3.024925
H 1.240307 -1.423435 -3.343241
H 0.990346 -3.277108 1.231642
H 0.800544 -3.560978 -0.526514
H -0.583997 -3.835704 0.579095
H -3.568644 0.381673 1.369560
H -3.923301 -0.675813 0.013223
H 3.827800 2.999744 -0.432994
H 5.007881 1.682758 -0.436314
H 4.212634 2.161857 -1.941902
H -5.393379 2.635476 -0.486681


%chk=000293183-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293183

0 1
Br 3.581434 1.557623 2.262967
O -2.379586 -2.374053 0.373355
O -5.082055 1.913164 0.181446
O -3.553307 1.838962 -1.561142
N -0.135273 -1.777767 0.192336
C 0.902520 -0.798368 -0.060483
C 1.575457 -0.196655 1.048732
C 1.267662 -0.498286 -1.402083
C 3.022652 1.047756 -0.562794
C 2.622136 0.711688 0.754930
C 2.320330 0.419858 -1.619757
C -1.499036 -1.475087 0.190884
C -1.875457 -0.009327 -0.062881
C 1.170677 -0.516286 2.473291
C 0.548363 -1.118923 -2.585733
C 0.300359 -3.174410 0.407740
C -3.333131 0.267938 0.341916
C 4.143284 2.021062 -0.861846
C -3.944884 1.396939 -0.456495
H 2.610026 0.659395 -2.649835
H -1.760170 0.205954 -1.143666
H -1.176956 0.670072 0.456251
H 0.285789 -1.170082 2.499401
H 1.994002 -1.014604 3.018317
H 0.940722 0.407823 3.033985
H 0.090457 -2.088854 -2.331749
H -0.266175 -0.459846 -2.944440
H 1.239679 -1.269147 -3.432850
H 0.959443 -3.243475 1.292465
H 0.855364 -3.548623 -0.472437
H -0.599327 -3.789622 0.566668
H -3.437546 0.484887 1.418548
H -3.928092 -0.651423 0.163803
H 3.932110 3.019629 -0.436746
H 5.098174 1.685340 -0.417032
H 4.286846 2.131521 -1.949417
H -5.484088 2.620826 -0.392548


