# generated using pymatgen data_Ca(AgO2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.64512110 _cell_length_b 6.64512110 _cell_length_c 16.15464500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001094 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca(AgO2)2 _chemical_formula_sum 'Ca6 Ag12 O24' _cell_volume 617.77994009 _cell_formula_units_Z 6 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 Ca Ca0 1 0.33333300 0.66666700 0.95469400 1.0 Ca Ca1 1 0.00000000 0.00000000 0.62156900 1.0 Ca Ca2 1 0.00000000 0.00000000 0.00024300 1.0 Ca Ca3 1 0.66666700 0.33333300 0.28422000 1.0 Ca Ca4 1 0.33333300 0.66666700 0.71425800 1.0 Ca Ca5 1 0.00000000 0.00000000 0.37383400 1.0 Ag Ag6 1 0.83435100 0.66870100 0.83394600 1.0 Ag Ag7 1 0.33129900 0.16564900 0.83394600 1.0 Ag Ag8 1 0.49865000 0.99730000 0.49897100 1.0 Ag Ag9 1 0.83435100 0.16564900 0.83394600 1.0 Ag Ag10 1 0.66666700 0.33333300 0.66579200 1.0 Ag Ag11 1 0.00270000 0.50135000 0.49897100 1.0 Ag Ag12 1 0.16910200 0.33820400 0.16626600 1.0 Ag Ag13 1 0.49865000 0.50135000 0.49897100 1.0 Ag Ag14 1 0.16910200 0.83089800 0.16626600 1.0 Ag Ag15 1 0.33333300 0.66666700 0.33404000 1.0 Ag Ag16 1 0.66179600 0.83089800 0.16626600 1.0 Ag Ag17 1 0.66666700 0.33333300 0.04208000 1.0 O O18 1 0.69460600 0.84730300 0.90305100 1.0 O O19 1 0.00000000 0.00000000 0.76011000 1.0 O O20 1 0.15269700 0.84730300 0.90305100 1.0 O O21 1 0.15269700 0.30539400 0.90305100 1.0 O O22 1 0.52533200 0.05066300 0.76055600 1.0 O O23 1 0.37444000 0.18722000 0.57657300 1.0 O O24 1 0.52533200 0.47466800 0.76055600 1.0 O O25 1 0.66666700 0.33333300 0.90838500 1.0 O O26 1 0.81278000 0.18722000 0.57657300 1.0 O O27 1 0.66666700 0.33333300 0.42879300 1.0 O O28 1 0.94933700 0.47466800 0.76055600 1.0 O O29 1 0.81278000 0.62556000 0.57657300 1.0 O O30 1 0.18407700 0.36815400 0.42144300 1.0 O O31 1 0.04212600 0.52106300 0.24531800 1.0 O O32 1 0.18407700 0.81592300 0.42144300 1.0 O O33 1 0.33333300 0.66666700 0.57323500 1.0 O O34 1 0.33333300 0.66666700 0.09402900 1.0 O O35 1 0.47893700 0.52106300 0.24531800 1.0 O O36 1 0.63184600 0.81592300 0.42144300 1.0 O O37 1 0.47893700 0.95787400 0.24531800 1.0 O O38 1 0.84503100 0.69006200 0.09804800 1.0 O O39 1 0.00000000 0.00000000 0.23332000 1.0 O O40 1 0.84503100 0.15496900 0.09804800 1.0 O O41 1 0.30993800 0.15496900 0.09804800 1.0