%chk=000219217.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219217

0 1
Br 7.727358 -0.737495 -0.373273
Br -7.727429 0.738276 -0.369905
O 1.462578 1.915349 0.535095
O -1.462502 -1.916739 0.531072
C 0.705700 -0.292642 0.025152
C -0.705700 0.292385 0.025923
C 1.755503 0.771170 0.255547
C -1.755473 -0.771923 0.254177
C 3.188101 0.358607 0.107981
C -3.188102 -0.359024 0.107870
C 3.601294 -0.978223 0.193008
C -3.601252 0.977631 0.195999
C 4.139466 1.369568 -0.107640
C -4.139528 -1.369469 -0.109803
C 4.952594 -1.307912 0.052910
C -4.952562 1.307661 0.056943
C 5.491784 1.050601 -0.254419
C -5.491882 -1.050139 -0.255562
C 5.880426 -0.288169 -0.173170
C -5.880473 0.288439 -0.171221
H 0.782670 -1.079325 0.814153
H 0.898414 -0.830461 -0.926861
H -0.782509 1.077347 0.816654
H -0.898592 0.832282 -0.924880
H 2.878312 -1.775149 0.375984
H -2.878196 1.774113 0.380609
H 3.810647 2.413390 -0.153594
H -3.810758 -2.413195 -0.158178
H 5.271047 -2.349509 0.121456
H -5.270995 2.349102 0.127892
H 6.225812 1.839957 -0.425231
H -6.225953 -1.839104 -0.427986


%chk=000219217-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219217

0 1
Br 7.865656 -0.760953 0.006901
Br -7.865659 0.760819 0.010154
O 1.466210 2.026933 0.012058
O -1.466237 -2.027128 0.008020
C 0.709845 -0.289392 -0.001902
C -0.709858 0.289218 -0.000981
C 1.782246 0.798712 0.005299
C -1.782264 -0.798893 0.004034
C 3.226332 0.384336 0.004855
C -3.226346 -0.384505 0.004825
C 3.632287 -0.977239 -0.001049
C -3.632290 0.977084 0.001983
C 4.221925 1.398532 0.011216
C -4.221948 -1.398703 0.009149
C 5.000197 -1.322495 -0.000458
C -5.000197 1.322350 0.003551
C 5.590971 1.071163 0.011809
C -5.590992 -1.071324 0.010688
C 5.963901 -0.291657 0.006000
C -5.963909 0.291509 0.007908
H 0.848939 -0.955430 0.872022
H 0.852014 -0.946779 -0.881856
H -0.848657 0.953180 0.874568
H -0.852320 0.948692 -0.879325
H 2.889780 -1.781329 -0.006044
H -2.889776 1.781176 -0.001350
H 3.896093 2.443853 0.015858
H -3.896126 -2.444035 0.011435
H 5.310086 -2.371142 -0.004904
H -5.310077 2.371007 0.001457
H 6.353078 1.855225 0.016742
H -6.353105 -1.855388 0.014039


