%chk=000286533.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286533

0 1
Br 6.375549 1.517928 1.770771
Br -6.596370 -1.600897 0.655949
O -0.130867 -1.323726 2.661877
O 0.801429 1.680981 -0.619488
O -0.922507 -1.006704 -1.691166
O 1.824910 -0.245508 2.924424
N 0.933638 -0.460336 2.153497
N -1.076111 -1.444468 1.684061
C 2.799343 0.460759 -0.118974
C -2.865735 -0.156948 -0.564747
C 3.738421 1.096909 0.716523
C 3.209346 -0.484206 -1.083407
C -3.897469 -1.013396 -0.128436
C -3.140110 1.182659 -0.918687
C 1.357236 0.795858 -0.018020
C 0.570689 -0.085198 0.905451
C -1.477297 -0.657718 -0.680348
C -0.707419 -0.721995 0.629135
C 5.516158 -0.230949 -0.332301
C -5.478717 0.856787 -0.306358
C 5.088468 0.724438 0.607641
C 4.564586 -0.820526 -1.176662
C -5.191257 -0.483284 0.010487
C -4.442927 1.674207 -0.779313
C 3.304820 2.124700 1.703265
C 2.220374 -1.098154 -2.011168
C -3.630931 -2.446841 0.172643
C -2.059729 2.061652 -1.438194
C 6.950002 -0.618579 -0.443480
C -6.852685 1.411032 -0.153382
H 4.886299 -1.550661 -1.917819
H -4.655834 2.709077 -1.043565
H 2.277167 2.481010 1.559754
H 3.372197 1.726279 2.732643
H 3.941205 3.025322 1.669568
H 1.294140 -1.430808 -1.510123
H 1.898447 -0.373606 -2.779499
H 2.613946 -1.972151 -2.546955
H -3.722854 -2.643965 1.256690
H -4.349486 -3.113886 -0.332952
H -2.634252 -2.796284 -0.124140
H -1.247880 2.210043 -0.699624
H -1.573837 1.630793 -2.330094
H -2.408948 3.062856 -1.721145
H 7.586047 0.251911 -0.675549
H 7.327564 -1.039131 0.503619
H 7.134135 -1.368346 -1.223964
H -6.924931 2.468086 -0.441030
H -7.581212 0.858239 -0.769705
H -7.203151 1.335645 0.889598


%chk=000286533-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286533

0 1
Br 6.689517 2.344386 -0.312502
Br -6.602996 -1.639903 -1.928505
O -0.418318 -0.788587 3.068346
O 0.940536 1.631135 -0.590065
O -0.873871 -0.814581 -1.383426
O 2.088313 -0.233322 3.006468
N 1.040506 -0.289333 2.320820
N -1.351155 -0.728289 2.066149
C 2.937964 0.330510 -0.058573
C -2.965602 -0.003522 -0.418833
C 3.933363 1.367399 -0.095465
C 3.298852 -1.049880 -0.186908
C -3.910194 -0.885933 -1.044738
C -3.373741 1.258404 0.120702
C 1.498916 0.702520 0.062511
C 0.633031 -0.026605 1.062821
C -1.519753 -0.377194 -0.383446
C -0.779372 -0.300329 0.921761
C 5.685475 -0.390846 -0.384527
C -5.711104 0.781369 -0.569849
C 5.282346 0.961560 -0.252848
C 4.661689 -1.368871 -0.356005
C -5.261246 -0.458623 -1.087873
C -4.733431 1.619171 0.020013
C 3.591651 2.835768 0.067569
C 2.283080 -2.182905 -0.215053
C -3.516897 -2.240553 -1.601535
C -2.401941 2.253214 0.738567
C 7.128571 -0.808296 -0.558394
C -7.155122 1.227143 -0.633655
H 4.946409 -2.420004 -0.479112
H -5.052025 2.593345 0.408384
H 2.547041 3.000509 0.361136
H 4.254530 3.302633 0.816873
H 3.751895 3.377330 -0.883272
H 1.955204 -2.462035 0.804443
H 1.382281 -1.932020 -0.802330
H 2.736121 -3.084065 -0.661520
H -4.188559 -3.025483 -1.211051
H -3.619418 -2.250556 -2.702531
H -2.478542 -2.508931 -1.368622
H -2.148237 1.973692 1.778142
H -1.456255 2.330212 0.173162
H -2.856834 3.257584 0.772462
H 7.569324 -0.358034 -1.466972
H 7.747837 -0.467607 0.291745
H 7.215188 -1.904448 -0.635450
H -7.280206 2.222665 -0.177093
H -7.514417 1.273771 -1.678224
H -7.816806 0.515336 -0.106397


