%chk=000221483.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221483

0 1
Br -7.326287 0.458981 -0.020067
Br 7.326619 -0.457831 0.025825
C -0.619738 -0.451635 0.009665
C 0.620068 0.452796 -0.003088
C -1.913597 0.373395 -0.006905
C 1.913927 -0.372230 0.013686
C -3.153159 -0.530962 0.005580
C 3.153489 0.532120 0.000766
C -4.445239 0.300343 -0.010919
C 4.445571 -0.299184 0.017304
C -5.665646 -0.606239 0.001138
C 5.665980 0.607379 0.004094
H -0.596523 -1.134111 -0.862000
H -0.600127 -1.104273 0.903974
H 0.600523 1.105338 -0.897470
H 0.596789 1.135365 0.868501
H -1.935861 1.056156 0.864835
H -1.932096 1.026613 -0.901082
H 1.932496 -1.025098 0.908118
H 1.936121 -1.055331 -0.857787
H -3.129687 -1.212279 -0.867146
H -3.133357 -1.182853 0.900591
H 3.133550 1.183784 -0.894405
H 3.130156 1.213659 0.873326
H -4.460655 0.957940 -0.904691
H -4.464629 0.986769 0.860829
H 4.464607 -0.986227 -0.853966
H 4.461338 -0.956147 0.911536
H -5.706525 -1.263407 -0.884012
H -5.710590 -1.234103 0.907121
H 5.707097 1.265362 0.888627
H 5.710686 1.234408 -0.902479


%chk=000221483-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221483

0 1
Br -7.474842 0.463436 -0.019318
Br 7.475174 -0.462277 0.025590
C -0.630292 -0.446108 0.008865
C 0.630623 0.447263 -0.002636
C -1.946651 0.362907 -0.007275
C 1.946982 -0.361752 0.013497
C -3.207098 -0.532770 0.004803
C 3.207429 0.533926 0.001430
C -4.517639 0.296440 -0.011807
C 4.517970 -0.295283 0.018026
C -5.746279 -0.614503 0.002153
C 5.746610 0.615659 0.004032
H -0.606065 -1.125629 -0.868610
H -0.610181 -1.096971 0.907919
H 0.610513 1.098129 -0.901688
H 0.606395 1.126782 0.874841
H -1.971486 1.041970 0.870056
H -1.967687 1.012835 -0.906512
H 1.968019 -1.011688 0.912728
H 1.971818 -1.040805 -0.863840
H -3.182696 -1.210764 -0.873400
H -3.186514 -1.181269 0.905125
H 3.186842 1.182441 -0.898881
H 3.183030 1.211905 0.879644
H -4.541231 0.938705 -0.912547
H -4.544089 0.969730 0.865898
H 4.544406 -0.968585 -0.859670
H 4.541578 -0.937536 0.918774
H -5.810427 -1.256329 -0.890606
H -5.813241 -1.224775 0.916585
H 5.810743 1.257537 0.896756
H 5.813589 1.225879 -0.910433


