%chk=000255491.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255491

0 1
Br -1.807509 2.278527 0.974543
Br -1.363138 1.879984 -2.537893
O -3.875437 -0.651344 1.178824
O -1.701283 -1.037282 1.517910
O 3.099330 1.556403 0.422832
O 3.840129 -0.861163 0.528110
O 0.040997 -3.603405 -1.124613
O -1.607795 -2.285807 -1.546114
N -0.456161 -2.491111 -1.168825
C -2.400877 0.725160 -0.109342
C -3.831786 0.955030 -0.609315
C -4.752339 0.249743 0.407547
C -1.433988 0.386109 -1.237848
C -2.542929 -0.414366 0.939271
C -0.046882 -0.006344 -0.804208
C -5.421277 1.174426 1.401365
C 0.378436 -1.343105 -0.770765
C 0.864853 1.001285 -0.425440
C 2.142506 0.683829 0.020261
C 1.683566 -1.683780 -0.322821
C 2.561226 -0.696944 0.076439
C 2.760343 2.990451 0.452887
C 4.326940 -2.239175 0.692843
C 4.033063 3.615421 0.982818
C 5.723423 -2.030386 1.240774
H -4.083407 2.027886 -0.724488
H -3.979058 0.530045 -1.624286
H -5.468010 -0.451387 -0.073124
H -1.900382 -0.449457 -1.856284
H -5.874847 0.599416 2.223474
H -6.213569 1.771356 0.935542
H -4.708487 1.868957 1.869238
H 0.563165 2.048790 -0.488415
H 1.963923 -2.742508 -0.298305
H 1.896610 3.127974 1.126008
H 2.516511 3.308065 -0.575221
H 4.319790 -2.730121 -0.295175
H 3.660048 -2.763220 1.399139
H 4.890831 3.391855 0.331619
H 4.288676 3.220865 1.977427
H 3.940745 4.704864 1.062422
H 5.700984 -1.470480 2.187104
H 6.342195 -1.443767 0.546689
H 6.227570 -2.986588 1.422899


%chk=000255491-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255491

0 1
Br -1.960723 2.473831 0.925050
Br -1.325542 1.914105 -2.605682
O -3.885365 -0.576972 1.286361
O -1.613139 -0.895566 1.599815
O 3.152124 1.613093 0.484508
O 3.939199 -0.918584 0.549293
O 0.143758 -3.665426 -1.190190
O -1.695753 -2.338476 -1.260295
N -0.416921 -2.506255 -1.073021
C -2.450775 0.753759 -0.123286
C -3.889688 0.882471 -0.657992
C -4.804871 0.259858 0.435403
C -1.405868 0.401323 -1.201376
C -2.540071 -0.330446 1.005476
C -0.016395 -0.000700 -0.751356
C -5.548452 1.249903 1.334543
C 0.430154 -1.355071 -0.712170
C 0.913826 0.989591 -0.360728
C 2.217613 0.680021 0.075452
C 1.743194 -1.688232 -0.293647
C 2.643613 -0.693079 0.109952
C 2.754512 3.045530 0.499039
C 4.407614 -2.325329 0.612392
C 3.955243 3.824168 1.023968
C 5.838444 -2.285079 1.137505
H -4.163275 1.921782 -0.888779
H -3.965704 0.298891 -1.593681
H -5.509192 -0.467058 -0.003242
H -1.852775 -0.414753 -1.786708
H -6.066451 0.711701 2.146193
H -6.306031 1.794456 0.741061
H -4.858199 1.984872 1.781394
H 0.599303 2.032243 -0.423355
H 2.011809 -2.745820 -0.285476
H 1.869168 3.164876 1.154844
H 2.485776 3.354597 -0.530941
H 4.356951 -2.769632 -0.402221
H 3.740489 -2.897488 1.288052
H 4.832407 3.676783 0.371728
H 4.219411 3.494292 2.042682
H 3.717345 4.902831 1.054498
H 5.872743 -1.826710 2.140115
H 6.485396 -1.698087 0.464010
H 6.241797 -3.311512 1.206316


