%chk=000198340.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198340

0 1
Br -0.526719 0.020605 -3.052761
Br -6.344374 0.723295 1.820782
O -1.412599 2.324842 -0.822701
O -0.567605 -2.369977 -0.735846
C -0.465097 0.065510 -1.085640
C 0.931839 0.343383 -0.623925
C -1.504192 1.142899 -0.652634
C -1.069511 -1.288550 -0.614025
C -2.639372 0.412399 -0.005117
C -2.392020 -0.979021 0.011652
C 1.766185 -0.662721 -0.186555
C 1.419159 1.690363 -0.683928
C 3.096168 -0.370889 0.248405
C 3.564650 0.967544 0.211810
C -3.803973 0.942992 0.524526
C -3.309308 -1.862281 0.558150
C 2.690832 1.991589 -0.274496
C -4.728856 0.036748 1.079353
C -4.498948 -1.338149 1.101358
C 3.969074 -1.403570 0.719833
C 4.895080 1.255610 0.652318
C 5.241058 -1.099903 1.135592
C 5.709537 0.246715 1.102446
H 1.443833 -1.708625 -0.174901
H 0.761222 2.475290 -1.072286
H -3.992158 2.020484 0.508536
H -3.117135 -2.937654 0.567613
H 3.059709 3.016381 -0.318752
H -5.234952 -2.019719 1.537066
H 3.602735 -2.429534 0.738927
H 5.244472 2.286573 0.621514
H 5.912311 -1.878305 1.495486
H 6.723954 0.455574 1.439602


%chk=000198340-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198340

0 1
Br -0.725606 0.072688 -2.942182
Br -6.679644 0.657898 1.510923
O -1.415851 2.402633 -0.428196
O -0.556365 -2.403530 -0.473032
C -0.460738 0.095612 -0.824155
C 0.972242 0.376970 -0.490944
C -1.530037 1.154190 -0.404546
C -1.095265 -1.269598 -0.422015
C -2.729531 0.400918 0.067717
C -2.478943 -0.991510 0.052523
C 1.829906 -0.637656 -0.027898
C 1.489654 1.714792 -0.653647
C 3.193302 -0.358746 0.302202
C 3.702974 0.987621 0.146029
C -3.963144 0.928199 0.495367
C -3.466233 -1.909262 0.465703
C 2.813713 2.003357 -0.343103
C -4.943038 -0.000126 0.905388
C -4.712668 -1.403475 0.894841
C 4.073811 -1.386655 0.780221
C 5.069765 1.257656 0.475304
C 5.403369 -1.095358 1.094078
C 5.904523 0.237159 0.941421
H 1.462793 -1.663156 0.070596
H 0.824500 2.498552 -1.023067
H -4.139723 2.007115 0.503058
H -3.267649 -2.985032 0.451731
H 3.194773 3.023039 -0.473371
H -5.504922 -2.083630 1.220463
H 3.686214 -2.405940 0.893868
H 5.453945 2.277625 0.356466
H 6.069639 -1.884759 1.458046
H 6.949232 0.452304 1.191611


