%chk=000229782.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229782

0 1
Br -4.692340 -1.043522 0.995340
O -2.265505 1.005972 0.768647
O -1.669781 0.700268 -1.389786
C 0.550381 -1.180123 -0.083457
C 1.180229 0.193818 -0.315394
C -0.155716 0.098565 0.434787
C -0.035546 -1.906102 -1.268839
C 1.120951 -2.104372 0.964660
C 2.388191 0.640528 0.411377
C -1.380459 0.601094 -0.216458
C 3.639552 0.315759 0.046669
C 4.829267 0.820590 0.803390
C 3.946744 -0.550870 -1.134035
C -3.555828 1.526519 0.357985
C -4.418733 0.440740 -0.256024
H 1.135395 0.595237 -1.343329
H -0.158054 0.262013 1.524778
H -0.508490 -1.221276 -1.992080
H 0.734378 -2.467522 -1.810648
H -0.810575 -2.618828 -0.957799
H 1.849811 -2.797642 0.526474
H 1.640708 -1.559576 1.764103
H 0.330628 -2.704041 1.434533
H 2.196500 1.283179 1.269925
H 5.361706 -0.004840 1.296046
H 5.545060 1.316826 0.133479
H 4.563373 1.545016 1.583818
H 3.961724 0.046108 -2.057551
H 4.920624 -1.047705 -1.051118
H 3.190569 -1.337089 -1.272278
H -3.390138 2.356279 -0.357241
H -3.947621 1.909636 1.321053
H -5.415575 0.821477 -0.537540
H -3.940130 0.014782 -1.163187


%chk=000229782-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229782

0 1
Br -5.170233 -0.039465 1.152405
O -2.038569 1.091001 0.582557
O -1.343176 0.306401 -1.506761
C 0.434233 -1.695066 0.265077
C 1.296027 -0.507182 -0.189058
C -0.077343 -0.239837 0.526830
C -0.233677 -2.544366 -0.814003
C 0.826765 -2.486980 1.512190
C 2.565318 -0.101433 0.466442
C -1.167200 0.368649 -0.260865
C 3.634321 0.507805 -0.129724
C 4.874599 0.856584 0.676555
C 3.707144 0.889235 -1.597543
C -3.173903 1.763260 -0.089837
C -4.296347 0.804384 -0.471368
H 1.230016 -0.317707 -1.266730
H -0.041840 0.092598 1.567848
H -0.539360 -1.938645 -1.682898
H 0.468324 -3.326058 -1.160733
H -1.133047 -3.050171 -0.413723
H 1.598610 -3.238552 1.260100
H 1.228168 -1.848122 2.317534
H -0.052539 -3.021652 1.916158
H 2.643226 -0.318860 1.541833
H 5.773166 0.357469 0.261434
H 5.075985 1.946150 0.643025
H 4.776700 0.559084 1.735063
H 3.885956 1.977541 -1.705965
H 4.560002 0.380286 -2.089384
H 2.794398 0.641739 -2.162234
H -2.808653 2.248183 -1.017139
H -3.509341 2.521518 0.633886
H -5.108933 1.344180 -0.982998
H -3.937496 -0.031073 -1.087676


