%chk=000231784.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231784

0 1
Br -7.227279 0.119481 -1.630450
Br 5.107353 5.405060 -0.707259
O 0.390129 1.550508 2.467379
C -1.507465 0.340690 0.798226
C -0.741869 -0.946469 0.554567
C -0.677361 1.551436 0.320666
C -2.886917 0.300741 0.172832
C 0.728593 -3.317655 0.175987
C 1.514508 -4.583828 -0.026950
C -0.841519 -1.656700 -0.648628
C 0.106597 -1.426746 1.565700
C 2.890896 -4.278901 -0.639200
C -0.112512 -2.833592 -0.836391
C 0.835179 -2.600929 1.378754
C 0.403769 1.923005 1.313914
C -3.130749 0.744944 -1.135340
C -3.952827 -0.209855 0.933800
C 3.707756 -5.560055 -0.853059
C 1.518061 2.783340 0.796051
C -4.419528 0.693613 -1.675842
C -5.243360 -0.268184 0.403282
C 5.075742 -5.259471 -1.461174
C -5.462523 0.188884 -0.898380
C 1.312275 3.750634 -0.196759
C 2.795447 2.610817 1.351405
C 2.378338 4.536613 -0.643937
C 3.869829 3.385712 0.905283
C 3.645663 4.339417 -0.089555
H -1.641893 0.460404 1.914759
H -0.229089 1.337486 -0.671603
H -1.342472 2.430145 0.178210
H 1.638775 -5.120618 0.935484
H 0.956844 -5.285748 -0.679672
H -1.494751 -1.301898 -1.444693
H 0.203557 -0.869844 2.501528
H 2.762251 -3.745845 -1.601246
H 3.445477 -3.580438 0.017249
H -0.200660 -3.376879 -1.775447
H 1.489830 -2.961709 2.170148
H -2.316666 1.128531 -1.748388
H -3.774789 -0.571059 1.947594
H 3.151873 -6.257024 -1.510480
H 3.836055 -6.091299 0.110441
H -4.598971 1.043354 -2.693249
H -6.063637 -0.666685 1.002249
H 5.669016 -4.601183 -0.816190
H 4.985390 -4.766974 -2.436143
H 5.653180 -6.178741 -1.610723
H 0.320963 3.906672 -0.622984
H 2.943173 1.868575 2.141906
H 2.216090 5.291889 -1.414459
H 4.862736 3.244977 1.335888


%chk=000231784-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231784

0 1
Br -7.392769 0.084728 -1.463347
Br 5.127220 5.724845 -0.696999
O 0.564435 1.485606 2.435958
C -1.495730 0.375970 0.829334
C -0.757172 -0.952321 0.567664
C -0.654534 1.578940 0.322469
C -2.915369 0.353237 0.252614
C 0.670002 -3.397280 0.084760
C 1.458683 -4.670239 -0.183179
C -0.796228 -1.579158 -0.704238
C 0.001637 -1.566267 1.595484
C 2.916544 -4.389559 -0.645383
C -0.091976 -2.778973 -0.940173
C 0.700944 -2.769589 1.355900
C 0.519535 1.923374 1.248165
C -3.266989 0.975547 -0.971366
C -3.927146 -0.355462 0.951690
C 3.713492 -5.682875 -0.926796
C 1.602470 2.832928 0.738765
C -4.583071 0.902946 -1.485398
C -5.246704 -0.441148 0.459447
C 5.163335 -5.407161 -1.380532
C -5.559087 0.193333 -0.761118
C 1.563769 3.435583 -0.547012
C 2.705262 3.109375 1.592012
C 2.598634 4.293360 -0.975431
C 3.749081 3.958025 1.178429
C 3.682197 4.541882 -0.106591
H -1.573188 0.491736 1.927370
H -0.279946 1.385877 -0.700082
H -1.289793 2.488991 0.263452
H 1.493984 -5.294660 0.731646
H 0.951944 -5.273527 -0.962310
H -1.402974 -1.143626 -1.507383
H 0.051085 -1.087377 2.579761
H 2.894008 -3.759650 -1.557822
H 3.436265 -3.792945 0.131416
H -0.144766 -3.252503 -1.928830
H 1.276172 -3.230833 2.168709
H -2.517803 1.529753 -1.546765
H -3.678406 -0.854062 1.895942
H 3.186694 -6.274172 -1.703730
H 3.723751 -6.311245 -0.012446
H -4.837327 1.389982 -2.431254
H -6.013487 -0.988735 1.014853
H 5.718754 -4.840394 -0.609654
H 5.181407 -4.810515 -2.312079
H 5.713530 -6.347066 -1.570856
H 0.726311 3.248687 -1.226097
H 2.721591 2.643872 2.582757
H 2.563616 4.757856 -1.964641
H 4.596624 4.163507 1.838013


