# generated using pymatgen data_K8Rh3(Br9O5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.66914200 _cell_length_b 15.33683700 _cell_length_c 16.06464300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural K8Rh3(Br9O5)2 _chemical_formula_sum 'K16 Rh6 Br36 O20' _cell_volume 2382.29104913 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy K K0 1 0.25414600 0.91383600 0.18728000 1.0 K K1 1 0.25414600 0.08616400 0.81272000 1.0 K K2 1 0.74585400 0.41383600 0.31272000 1.0 K K3 1 0.74585400 0.58616400 0.68728000 1.0 K K4 1 0.74585400 0.08616400 0.81272000 1.0 K K5 1 0.74585400 0.91383600 0.18728000 1.0 K K6 1 0.25414600 0.58616400 0.68728000 1.0 K K7 1 0.25414600 0.41383600 0.31272000 1.0 K K8 1 0.26434700 0.71221200 0.42386300 1.0 K K9 1 0.26434700 0.28778800 0.57613700 1.0 K K10 1 0.73565300 0.21221200 0.07613700 1.0 K K11 1 0.73565300 0.78778800 0.92386300 1.0 K K12 1 0.73565300 0.28778800 0.57613700 1.0 K K13 1 0.73565300 0.71221200 0.42386300 1.0 K K14 1 0.26434700 0.78778800 0.92386300 1.0 K K15 1 0.26434700 0.21221200 0.07613700 1.0 Rh Rh16 1 0.00000000 0.50000000 0.50000000 1.0 Rh Rh17 1 0.00000000 0.00000000 0.00000000 1.0 Rh Rh18 1 0.50000000 0.69468100 0.18559300 1.0 Rh Rh19 1 0.50000000 0.30531900 0.81440700 1.0 Rh Rh20 1 0.50000000 0.19468100 0.31440700 1.0 Rh Rh21 1 0.50000000 0.80531900 0.68559300 1.0 Br Br22 1 0.00000000 0.65394900 0.55505500 1.0 Br Br23 1 0.00000000 0.34605100 0.44494500 1.0 Br Br24 1 0.00000000 0.15394900 0.94494500 1.0 Br Br25 1 0.00000000 0.84605100 0.05505500 1.0 Br Br26 1 0.26198800 0.50000000 0.50000000 1.0 Br Br27 1 0.73801200 0.00000000 0.00000000 1.0 Br Br28 1 0.73801200 0.50000000 0.50000000 1.0 Br Br29 1 0.26198800 0.00000000 0.00000000 1.0 Br Br30 1 0.00000000 0.56070600 0.35374300 1.0 Br Br31 1 0.00000000 0.43929400 0.64625700 1.0 Br Br32 1 0.00000000 0.06070600 0.14625700 1.0 Br Br33 1 0.00000000 0.93929400 0.85374300 1.0 Br Br34 1 0.50000000 0.80859300 0.30258800 1.0 Br Br35 1 0.50000000 0.19140700 0.69741200 1.0 Br Br36 1 0.50000000 0.30859300 0.19741200 1.0 Br Br37 1 0.50000000 0.69140700 0.80258800 1.0 Br Br38 1 0.23865900 0.69291500 0.19215400 1.0 Br Br39 1 0.23865900 0.30708500 0.80784600 1.0 Br Br40 1 0.76134100 0.19291500 0.30784600 1.0 Br Br41 1 0.76134100 0.80708500 0.69215400 1.0 Br Br42 1 0.76134100 0.30708500 0.80784600 1.0 Br Br43 1 0.76134100 0.69291500 0.19215400 1.0 Br Br44 1 0.23865900 0.80708500 0.69215400 1.0 Br Br45 1 0.23865900 0.19291500 0.30784600 1.0 Br Br46 1 0.50000000 0.57398900 0.29304800 1.0 Br Br47 1 0.50000000 0.42601100 0.70695200 1.0 Br Br48 1 0.50000000 0.07398900 0.20695200 1.0 Br Br49 1 0.50000000 0.92601100 0.79304800 1.0 Br Br50 1 0.50000000 0.81560200 0.07952800 1.0 Br Br51 1 0.50000000 0.18439800 0.92047200 1.0 Br Br52 1 0.50000000 0.31560200 0.42047200 1.0 Br Br53 1 0.50000000 0.68439800 0.57952800 1.0 Br Br54 1 0.50000000 0.59394200 0.06399700 1.0 Br Br55 1 0.50000000 0.40605800 0.93600300 1.0 Br Br56 1 0.50000000 0.09394200 0.43600300 1.0 Br Br57 1 0.50000000 0.90605800 0.56399700 1.0 O O58 1 0.00000000 0.84783500 0.32807300 1.0 O O59 1 0.00000000 0.15216500 0.67192700 1.0 O O60 1 0.00000000 0.34783500 0.17192700 1.0 O O61 1 0.00000000 0.65216500 0.82807300 1.0 O O62 1 0.35816300 0.88160400 0.50705700 1.0 O O63 1 0.35816300 0.11839600 0.49294300 1.0 O O64 1 0.64183700 0.38160400 0.99294300 1.0 O O65 1 0.64183700 0.61839600 0.00705700 1.0 O O66 1 0.64183700 0.11839600 0.49294300 1.0 O O67 1 0.64183700 0.88160400 0.50705700 1.0 O O68 1 0.35816300 0.61839600 0.00705700 1.0 O O69 1 0.35816300 0.38160400 0.99294300 1.0 O O70 1 0.07513500 0.92628400 0.35490100 1.0 O O71 1 0.07513500 0.07371600 0.64509900 1.0 O O72 1 0.92486500 0.42628400 0.14509900 1.0 O O73 1 0.92486500 0.57371600 0.85490100 1.0 O O74 1 0.92486500 0.07371600 0.64509900 1.0 O O75 1 0.92486500 0.92628400 0.35490100 1.0 O O76 1 0.07513500 0.57371600 0.85490100 1.0 O O77 1 0.07513500 0.42628400 0.14509900 1.0