%chk=000285906.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285906

0 1
Br -2.879070 4.320449 0.157770
O -2.192235 1.357288 -0.862530
O -0.991786 0.246896 -2.371777
C -0.457729 -0.049640 0.059079
C -1.410011 0.416805 1.189420
C -2.264285 1.546513 0.585181
C -1.177657 0.477313 -1.208824
C -0.307152 -1.562302 0.091774
C 0.930404 0.577274 0.091777
C -1.717740 2.933059 0.896750
C 0.230981 -2.147987 1.251687
C 1.745738 0.472812 -1.048007
C -0.676686 -2.379308 -0.982972
C 1.424560 1.223320 1.232147
C 0.379637 -3.532887 1.336457
C 3.029878 1.019768 -1.046098
C -0.526017 -3.767641 -0.892700
C 2.711887 1.769411 1.230974
C -0.002542 -4.347881 0.264698
C 3.516359 1.671059 0.092887
H -0.862050 0.735069 2.094847
H -2.057338 -0.421139 1.517104
H -3.348859 1.448849 0.810443
H -0.713092 3.078885 0.451133
H -1.644495 3.113468 1.982851
H 0.546238 -1.519260 2.082866
H 1.371562 -0.035178 -1.942344
H -1.072994 -1.949574 -1.906948
H 0.811442 1.299400 2.130898
H 0.797830 -3.979808 2.237130
H 3.653872 0.937802 -1.935905
H -0.817800 -4.395227 -1.734411
H 3.087471 2.271053 2.121567
H 0.112687 -5.428061 0.332086
H 4.517891 2.097699 0.091791


%chk=000285906-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285906

0 1
Br -2.728634 4.470376 -0.000751
O -2.075156 1.345834 -1.092797
O -0.787412 0.036111 -2.491428
C -0.435271 -0.085864 0.012998
C -1.525940 0.365985 1.033427
C -2.234978 1.584126 0.373969
C -1.069021 0.386330 -1.336726
C -0.263679 -1.621292 0.053752
C 0.933326 0.635770 0.157336
C -1.645681 2.939827 0.761536
C 0.768146 -2.212779 0.824205
C 1.834292 0.624202 -0.941688
C -1.193285 -2.468750 -0.603393
C 1.357562 1.238826 1.368045
C 0.865291 -3.617551 0.941204
C 3.110667 1.214925 -0.835232
C -1.094718 -3.872090 -0.489551
C 2.638566 1.829235 1.476634
C -0.065893 -4.453953 0.286207
C 3.520441 1.822940 0.374300
H -1.133998 0.591712 2.036358
H -2.260308 -0.449228 1.146586
H -3.321726 1.578507 0.558790
H -0.622602 3.083643 0.386345
H -1.686616 3.084842 1.852728
H 1.506240 -1.578381 1.326152
H 1.530200 0.152976 -1.882350
H -1.986681 -2.038359 -1.225168
H 0.706392 1.250414 2.248480
H 1.671256 -4.056719 1.539801
H 3.785733 1.199529 -1.697844
H -1.815408 -4.510312 -1.012757
H 2.943527 2.289052 2.423302
H 0.012464 -5.543362 0.372133
H 4.511802 2.281778 0.456196


