%chk=000125059.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000125059

0 1
Br 4.846598 -2.294280 0.626667
Br 2.553677 2.689863 2.168834
O -0.703867 0.390264 -1.453714
O 2.494958 -2.119990 -1.483152
O -1.453009 -1.567870 -0.581824
O -5.845773 0.129778 1.388065
O -5.157419 2.023117 0.402703
C 1.574699 -0.075214 -0.795158
C 0.545695 -0.236281 -1.873483
C 2.562086 -1.074598 -0.612948
C 1.587887 1.043310 0.038901
C 3.534525 -0.946179 0.395094
C 2.560529 1.157643 1.040141
C 3.533839 0.174970 1.229711
C -1.622134 -0.391461 -0.783467
C -2.774853 0.477115 -0.423021
C -3.793157 -0.003245 0.293294
C -4.943066 0.861422 0.654673
H 0.794352 0.345730 -2.783369
H 0.364851 -1.302887 -2.126871
H 0.825864 1.819389 -0.097425
H 4.287378 0.276956 2.017714
H 3.160900 -2.840279 -1.286675
H -2.723097 1.515295 -0.781371
H -3.845578 -1.041956 0.652413
H -6.642584 0.665088 1.659470


%chk=000125059-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125059

0 1
Br 5.767373 -1.375398 -0.918254
Br 3.095502 2.520167 2.496023
O -0.727906 -0.121315 -0.230138
O 2.743739 -1.994127 -1.686713
O -2.235007 -1.403803 -1.476643
O -6.651200 0.715643 0.033025
O -5.137634 1.987323 1.268265
C 1.686770 -0.377371 -0.267540
C 0.382523 -0.896849 -0.830473
C 2.885342 -0.977513 -0.740933
C 1.757748 0.655121 0.689470
C 4.129342 -0.524644 -0.242316
C 3.014209 1.083008 1.166413
C 4.216846 0.505973 0.713046
C -2.013775 -0.485641 -0.651987
C -3.022475 0.370452 0.020059
C -4.351201 0.210403 -0.226846
C -5.359075 1.068038 0.444755
H 0.345401 -0.794895 -1.930903
H 0.239513 -1.970358 -0.605742
H 0.832557 1.109751 1.047345
H 5.186260 0.842758 1.086368
H 3.631813 -2.351549 -1.955536
H -2.666207 1.134570 0.719139
H -4.710818 -0.552189 -0.925449
H -7.316340 1.298145 0.490769