# generated using pymatgen data_Ba9(RhO3)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 15.40532756 _cell_length_b 15.40532756 _cell_length_c 15.40532798 _cell_angle_alpha 38.75621972 _cell_angle_beta 38.75621972 _cell_angle_gamma 38.75621848 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba9(RhO3)8 _chemical_formula_sum 'Ba18 Rh16 O48' _cell_volume 1287.91256197 _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 Ba Ba0 1 0.69759300 0.03463000 0.35117200 1.0 Ba Ba1 1 0.46537000 0.80240700 0.14882800 1.0 Ba Ba2 1 0.64882800 0.30240700 0.96537000 1.0 Ba Ba3 1 0.85117200 0.53463000 0.19759300 1.0 Ba Ba4 1 0.96537000 0.64882800 0.30240700 1.0 Ba Ba5 1 0.53463000 0.19759300 0.85117200 1.0 Ba Ba6 1 0.30240700 0.96537000 0.64882800 1.0 Ba Ba7 1 0.19759300 0.85117200 0.53463000 1.0 Ba Ba8 1 0.39806200 0.10193800 0.75000000 1.0 Ba Ba9 1 0.14882800 0.46537000 0.80240700 1.0 Ba Ba10 1 0.75000000 0.39806200 0.10193800 1.0 Ba Ba11 1 0.25000000 0.60193800 0.89806200 1.0 Ba Ba12 1 0.35117200 0.69759300 0.03463000 1.0 Ba Ba13 1 0.60193800 0.89806200 0.25000000 1.0 Ba Ba14 1 0.03463000 0.35117200 0.69759300 1.0 Ba Ba15 1 0.80240700 0.14882800 0.46537000 1.0 Ba Ba16 1 0.89806200 0.25000000 0.60193800 1.0 Ba Ba17 1 0.10193800 0.75000000 0.39806200 1.0 Rh Rh18 1 0.12073500 0.12073500 0.12073500 1.0 Rh Rh19 1 0.55973200 0.55973200 0.55973200 1.0 Rh Rh20 1 0.75000000 0.75000000 0.75000000 1.0 Rh Rh21 1 0.44026800 0.44026800 0.44026800 1.0 Rh Rh22 1 0.87926500 0.87926500 0.87926500 1.0 Rh Rh23 1 0.31569300 0.31569300 0.31569300 1.0 Rh Rh24 1 0.68430700 0.68430700 0.68430700 1.0 Rh Rh25 1 0.05973200 0.05973200 0.05973200 1.0 Rh Rh26 1 0.00000000 0.00000000 0.00000000 1.0 Rh Rh27 1 0.18430700 0.18430700 0.18430700 1.0 Rh Rh28 1 0.81569300 0.81569300 0.81569300 1.0 Rh Rh29 1 0.94026800 0.94026800 0.94026800 1.0 Rh Rh30 1 0.37926500 0.37926500 0.37926500 1.0 Rh Rh31 1 0.62073500 0.62073500 0.62073500 1.0 Rh Rh32 1 0.50000000 0.50000000 0.50000000 1.0 Rh Rh33 1 0.25000000 0.25000000 0.25000000 1.0 O O34 1 0.61861500 0.89399700 0.83759000 1.0 O O35 1 0.06304600 0.91817000 0.74993700 1.0 O O36 1 0.56304600 0.24993700 0.41817000 1.0 O O37 1 0.08183000 0.25006300 0.93695400 1.0 O O38 1 0.88138500 0.66241000 0.60600300 1.0 O O39 1 0.10600300 0.16241000 0.38138500 1.0 O O40 1 0.97278800 0.12766100 0.81032700 1.0 O O41 1 0.83759000 0.61861500 0.89399700 1.0 O O42 1 0.00790000 0.70752600 0.82915300 1.0 O O43 1 0.70752600 0.82915300 0.00790000 1.0 O O44 1 0.25006300 0.93695400 0.08183000 1.0 O O45 1 0.62766100 0.47278800 0.31032700 1.0 O O46 1 0.43695400 0.75006300 0.58183000 1.0 O O47 1 0.02721200 0.87233900 0.18967300 1.0 O O48 1 0.32915300 0.20752600 0.50790000 1.0 O O49 1 0.17084700 0.99210000 0.29247400 1.0 O O50 1 0.11861500 0.33759000 0.39399700 1.0 O O51 1 0.41817000 0.56304600 0.24993700 1.0 O O52 1 0.37233900 0.52721200 0.68967300 1.0 O O53 1 0.50790000 0.32915300 0.20752600 1.0 O O54 1 0.74993700 0.06304600 0.91817000 1.0 O O55 1 0.29247400 0.17084700 0.99210000 1.0 O O56 1 0.68967300 0.37233900 0.52721200 1.0 O O57 1 0.93695400 0.08183000 0.25006300 1.0 O O58 1 0.99210000 0.29247400 0.17084700 1.0 O O59 1 0.66241000 0.60600300 0.88138500 1.0 O O60 1 0.12766100 0.81032700 0.97278800 1.0 O O61 1 0.67084700 0.79247400 0.49210000 1.0 O O62 1 0.91817000 0.74993700 0.06304600 1.0 O O63 1 0.89399700 0.83759000 0.61861500 1.0 O O64 1 0.20752600 0.50790000 0.32915300 1.0 O O65 1 0.81032700 0.97278800 0.12766100 1.0 O O66 1 0.52721200 0.68967300 0.37233900 1.0 O O67 1 0.58183000 0.43695400 0.75006300 1.0 O O68 1 0.82915300 0.00790000 0.70752600 1.0 O O69 1 0.75006300 0.58183000 0.43695400 1.0 O O70 1 0.33759000 0.39399700 0.11861500 1.0 O O71 1 0.87233900 0.18967300 0.02721200 1.0 O O72 1 0.38138500 0.10600300 0.16241000 1.0 O O73 1 0.31032700 0.62766100 0.47278800 1.0 O O74 1 0.49210000 0.67084700 0.79247400 1.0 O O75 1 0.60600300 0.88138500 0.66241000 1.0 O O76 1 0.24993700 0.41817000 0.56304600 1.0 O O77 1 0.16241000 0.38138500 0.10600300 1.0 O O78 1 0.39399700 0.11861500 0.33759000 1.0 O O79 1 0.47278800 0.31032700 0.62766100 1.0 O O80 1 0.79247400 0.49210000 0.67084700 1.0 O O81 1 0.18967300 0.02721200 0.87233900 1.0