%chk=000269376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269376

0 1
Br -3.720174 2.792057 0.483644
Br -4.289375 -1.756367 2.050856
O 0.055958 1.792374 0.957159
O -2.634156 -2.480505 -1.293009
O 1.999960 0.198750 -1.904166
O 6.048378 0.493400 1.098017
O 4.701753 -1.106145 1.895082
C -1.974922 0.536045 0.611740
C 0.120459 -0.135465 -0.493065
C -2.627276 -0.573509 0.054282
C -0.602773 0.739104 0.321897
C -1.879729 -1.446852 -0.788406
C -0.525898 -1.238394 -1.062997
C 1.581983 0.075698 -0.775858
C 2.463064 0.091225 0.450037
C -2.658441 1.493812 1.521213
C -4.061855 -0.869936 0.301711
C 3.917435 0.398751 0.110559
C 4.849344 -0.185726 1.126941
C 0.154500 2.994723 0.143021
C -1.979088 -3.441880 -2.158785
H 0.031946 -1.907371 -1.716858
H 2.058511 0.830096 1.186007
H 2.378624 -0.889877 0.977822
H -3.351217 1.000859 2.231072
H -1.929578 2.086342 2.116683
H -4.482638 -1.567414 -0.454175
H -4.697924 0.035721 0.316140
H 4.177906 -0.006646 -0.900865
H 4.084690 1.494665 0.011067
H -0.844346 3.354303 -0.124386
H 0.757158 2.795475 -0.747629
H 0.658256 3.691387 0.822875
H -1.609671 -2.950937 -3.063872
H -2.807903 -4.125232 -2.390646
H -1.184876 -3.963011 -1.616241
H 6.712515 0.130079 1.742835


%chk=000269376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269376

0 1
Br -3.654685 2.970027 0.615681
Br -4.594113 -1.851573 1.917547
O 0.061820 1.724361 1.080366
O -2.764441 -2.457599 -1.432773
O 2.055546 -0.676745 -1.723633
O 6.187000 0.840431 0.889059
O 4.874191 -0.626397 2.117870
C -1.999947 0.493869 0.662005
C 0.110323 -0.275237 -0.376680
C -2.709659 -0.568141 0.030593
C -0.599244 0.645009 0.442633
C -1.997415 -1.458072 -0.831528
C -0.611090 -1.307266 -1.029108
C 1.603022 -0.264986 -0.614032
C 2.539224 0.094913 0.535498
C -2.685068 1.428384 1.607380
C -4.180360 -0.752951 0.212857
C 3.967085 0.414117 0.062305
C 4.998328 0.138326 1.134936
C 0.268354 2.914473 0.216807
C -2.084286 -3.411565 -2.318520
H -0.044783 -1.975745 -1.683337
H 2.101814 0.898207 1.149517
H 2.571032 -0.794585 1.202306
H -3.491765 0.959146 2.185856
H -1.971255 1.955627 2.251646
H -4.624969 -1.359759 -0.584487
H -4.731679 0.183096 0.371079
H 4.208563 -0.218520 -0.816065
H 4.071159 1.458434 -0.278896
H -0.703066 3.313552 -0.126850
H 0.901062 2.659405 -0.655362
H 0.778733 3.653188 0.852747
H -1.622869 -2.894938 -3.181162
H -2.876648 -4.088970 -2.666777
H -1.315836 -3.985017 -1.767034
H 6.856520 0.603096 1.587258


