%chk=000269338.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269338

0 1
Br -9.516396 0.004065 1.363317
Br 9.516390 -0.003926 1.363380
O -3.439546 0.983999 -1.919427
O 3.439443 -0.983754 -1.919849
N -3.527405 -0.115476 0.111454
N 3.527425 0.115411 0.111231
C -1.379097 0.181777 -0.986868
C 1.379068 -0.181698 -0.987004
C -0.533231 1.298165 -0.999080
C 0.852283 1.115549 -0.995328
C -0.852310 -1.115470 -0.995191
C 0.533203 -1.298088 -0.999076
C -2.865865 0.405364 -1.022125
C 2.865835 -0.405267 -1.022404
C -4.935348 -0.061762 0.361030
C 4.935383 0.061728 0.360825
C -5.841781 0.512495 -0.548145
C 5.841922 -0.512357 -0.548370
C -5.398584 -0.618003 1.573680
C 5.398524 0.617846 1.573568
C -7.203765 0.529855 -0.246150
C 7.203889 -0.529664 -0.246291
C -6.761526 -0.596467 1.867510
C 6.761449 0.596362 1.867478
C -7.652661 -0.023073 0.956045
C 7.652677 0.023141 0.955998
H -0.955724 2.305453 -1.025880
H 1.515443 1.981973 -1.019145
H -1.515471 -1.981897 -1.018910
H 0.955693 -2.305376 -1.025872
H -2.964595 -0.563801 0.839295
H 2.964612 0.563624 0.839138
H -5.486838 0.946448 -1.490947
H 5.487092 -0.946219 -1.491258
H -4.706581 -1.064108 2.284437
H 4.706452 1.063820 2.284341
H -7.907557 0.975900 -0.953004
H 7.907755 -0.975573 -0.953158
H -7.121807 -1.026150 2.804407
H 7.121646 1.025953 2.804450


%chk=000269338-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269338

0 1
Br -9.928209 -0.144761 0.540196
Br 9.928225 0.144953 0.539984
O -3.193475 1.882901 -0.749462
O 3.193482 -1.882864 -0.749642
N -3.739792 -0.235962 0.103820
N 3.739787 0.235941 0.103812
C -1.391524 0.308384 -0.355147
C 1.391524 -0.308400 -0.355163
C -0.423588 1.344222 -0.377883
C 0.950682 1.042367 -0.374211
C -0.950680 -1.042382 -0.374308
C 0.423590 -1.344237 -0.377996
C -2.841743 0.725731 -0.362025
C 2.841743 -0.725744 -0.362065
C -5.157918 -0.157051 0.181889
C 5.157921 0.157074 0.181827
C -5.900973 0.972936 -0.254709
C 5.901009 -0.972855 -0.254868
C -5.843630 -1.277468 0.725037
C 5.843606 1.277483 0.725025
C -7.308168 0.968688 -0.147377
C 7.308209 -0.968557 -0.147580
C -7.248000 -1.280212 0.833511
C 7.247979 1.280277 0.833455
C -7.970549 -0.151585 0.393199
C 7.970560 0.151708 0.393048
H -0.778571 2.378859 -0.415943
H 1.666260 1.871824 -0.432053
H -1.666255 -1.871835 -0.432229
H 0.778573 -2.378870 -0.416144
H -3.332435 -1.096451 0.475892
H 3.332418 1.096396 0.475949
H -5.375553 1.836697 -0.664628
H 5.375614 -1.836612 -0.664823
H -5.281997 -2.156337 1.066367
H 5.281949 2.156307 1.066428
H -7.877975 1.839294 -0.484420
H 7.878040 -1.839117 -0.484697
H -7.766296 -2.146760 1.253026
H 7.766253 2.146819 1.253010


