%chk=000219733.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219733

0 1
Br 5.518132 0.451337 -0.109505
N -0.533668 -0.410688 0.108948
N -1.061972 -1.647664 0.426704
N -1.344998 1.884855 -0.399977
N -5.153721 0.754457 -0.184749
C 0.892428 -0.210585 0.076943
C -1.560986 0.530185 -0.129079
C -2.775908 -0.169052 0.058429
C 1.443307 0.966082 0.612299
C 1.710944 -1.207589 -0.483831
C -2.402864 -1.518130 0.409460
C 2.825130 1.159752 0.552599
C 3.091502 -1.008644 -0.531913
C 3.633751 0.175740 -0.023095
C -4.079683 0.335393 -0.071779
H 0.809737 1.713136 1.096843
H 1.269973 -2.133801 -0.863498
H -3.079325 -2.332706 0.630121
H 3.262625 2.072450 0.964513
H 3.735918 -1.778114 -0.964635
H -2.172237 2.388336 -0.713440
H -0.528088 2.106850 -0.960556


%chk=000219733-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219733

0 1
Br 5.595663 0.417579 -0.126624
N -0.545367 -0.389491 0.107228
N -1.041322 -1.704563 0.355366
N -1.407153 1.848409 -0.421364
N -5.180474 0.820960 -0.197015
C 0.867588 -0.185135 0.062769
C -1.574115 0.520672 -0.099138
C -2.787255 -0.205412 0.055263
C 1.446363 1.019797 0.534214
C 1.693484 -1.226943 -0.425129
C -2.382976 -1.557996 0.330574
C 2.845554 1.200909 0.473494
C 3.090900 -1.052576 -0.475257
C 3.654215 0.165869 -0.037916
C -4.087755 0.340081 -0.077765
H 0.828019 1.793036 1.001418
H 1.233089 -2.163949 -0.747691
H -3.027899 -2.416366 0.508635
H 3.294543 2.127325 0.842231
H 3.729669 -1.855541 -0.853352
H -2.239301 2.408557 -0.594689
H -0.505474 2.216378 -0.714449


