%chk=000213170.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213170

0 1
Br 1.813424 3.266021 -2.008401
Br -2.162285 1.437718 1.721157
O 2.143463 -0.777350 0.042787
O -0.576383 -1.983150 -0.865134
O 0.424417 -0.150075 1.429154
O -2.065050 -1.167059 -2.396900
O 0.487374 2.697352 1.674018
O -4.477945 -0.618031 -0.727247
N 1.708416 1.409327 0.187841
N -2.267691 -0.768520 -0.057576
C 1.837051 -2.215117 0.257700
C 1.631145 -2.811878 -1.150384
C 3.041899 -2.765458 1.050505
C 0.467161 -2.120234 -1.881504
C 2.878807 -2.721235 -2.028845
C 3.111570 -2.095494 2.426562
C 2.930502 -4.285638 1.199219
C 1.311727 0.127768 0.660663
C -1.720943 -1.290582 -1.251860
C 1.175140 2.631602 0.686390
C 1.592872 3.848885 -0.138783
C -3.621239 -0.329563 0.068023
C -3.848711 0.513678 1.320917
C 0.562282 4.949561 -0.039300
C -4.981811 1.494802 1.118380
H 0.889016 -2.287107 0.846260
H 1.358323 -3.890350 -1.001390
H 3.978066 -2.517022 0.489992
H 0.727422 -1.107586 -2.235454
H 0.062451 -2.722178 -2.712488
H 3.261212 -1.692004 -2.069971
H 3.688736 -3.351584 -1.642349
H 2.680250 -3.046309 -3.056713
H 3.954336 -2.477493 3.012907
H 3.241022 -1.010471 2.336357
H 2.201337 -2.265622 3.014894
H 2.989734 -4.802042 0.235370
H 3.744116 -4.676585 1.823119
H 1.991141 -4.581643 1.681572
H 2.452749 1.397674 -0.530467
H -1.617565 -0.777834 0.763103
H 2.596204 4.207642 0.198729
H -4.054090 -0.156732 2.191233
H -0.417256 4.647673 -0.443675
H 0.872060 5.853594 -0.581263
H 0.387151 5.230547 1.013918
H -4.768694 2.220998 0.319398
H -5.191032 2.067902 2.031685
H -5.907880 0.971906 0.825952


%chk=000213170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213170

0 1
Br 3.362018 3.841134 -0.169834
Br -3.430931 3.046492 0.034248
O 2.058572 -0.783468 0.084552
O -0.539155 -1.759924 -0.943503
O 0.196430 -0.318254 1.460753
O -2.186823 -1.208960 -2.534311
O -0.124908 2.500761 1.727552
O -4.462530 -0.092794 -0.906646
N 1.540954 1.375085 0.495635
N -2.219180 -0.431621 -0.269527
C 1.850830 -2.279030 0.205395
C 1.625230 -2.842044 -1.224018
C 3.062207 -2.852899 0.978081
C 0.473308 -2.119618 -1.958897
C 2.882610 -2.809065 -2.123557
C 3.177477 -2.206855 2.379455
C 2.936677 -4.392985 1.105223
C 1.165269 0.041534 0.755425
C -1.730088 -1.145138 -1.380223
C 0.892516 2.512796 0.989051
C 1.424783 3.886080 0.535119
C -3.487824 0.177734 -0.167660
C -3.561670 1.214618 0.969800
C 0.510564 4.516544 -0.527027
C -4.868803 1.144170 1.752550
H 0.928103 -2.416065 0.797504
H 1.316307 -3.895170 -1.072121
H 3.984714 -2.617631 0.410829
H 0.830949 -1.185222 -2.432225
H 0.019170 -2.759636 -2.735939
H 3.289522 -1.783938 -2.190138
H 3.677732 -3.470444 -1.738839
H 2.638944 -3.147394 -3.147563
H 4.028502 -2.643344 2.932738
H 3.344086 -1.117573 2.314607
H 2.260218 -2.379762 2.972998
H 2.973839 -4.903844 0.126593
H 3.766121 -4.788035 1.718595
H 1.989384 -4.674186 1.603960
H 2.384192 1.515509 -0.074385
H -1.544929 -0.331158 0.508240
H 1.501215 4.523339 1.429677
H -2.663446 1.215684 1.609309
H 0.496094 3.922615 -1.456322
H 0.844075 5.539463 -0.764224
H -0.518481 4.558589 -0.124125
H -5.729392 1.176975 1.065235
H -4.941415 1.972173 2.475839
H -4.909035 0.187470 2.310217


