# generated using pymatgen data_Ca9Y3(CoO6)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.30745500 _cell_length_b 8.85095130 _cell_length_c 9.04140826 _cell_angle_alpha 89.74304905 _cell_angle_beta 88.75097792 _cell_angle_gamma 89.87428640 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca9Y3(CoO6)4 _chemical_formula_sum 'Ca9 Y3 Co4 O24' _cell_volume 504.62837740 _cell_formula_units_Z 1 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 0.10972000 0.32010600 0.07083900 1.0 Ca Ca1 1 0.74762000 0.85869200 0.25013200 1.0 Ca Ca2 1 0.74997200 0.35908800 0.74975500 1.0 Ca Ca3 1 0.89164000 0.17717400 0.42919900 1.0 Ca Ca4 1 0.89028700 0.67869400 0.92857100 1.0 Ca Ca5 1 0.25211200 0.14514100 0.75157100 1.0 Ca Ca6 1 0.25018500 0.64057500 0.24928600 1.0 Ca Ca7 1 0.60892500 0.67813700 0.57072200 1.0 Ca Ca8 1 0.60676000 0.17862700 0.07247700 1.0 Y Y9 1 0.39212600 0.32072700 0.42933300 1.0 Y Y10 1 0.39206300 0.82143700 0.92905100 1.0 Y Y11 1 0.10708700 0.82213400 0.56963900 1.0 Co Co12 1 0.50249600 0.99894200 0.50283100 1.0 Co Co13 1 0.50202100 0.49909400 0.00248100 1.0 Co Co14 1 0.99550700 0.00075500 0.99805700 1.0 Co Co15 1 0.99667400 0.49897800 0.49836200 1.0 O O16 1 0.43172500 0.89027600 0.67883700 1.0 O O17 1 0.43400700 0.39389400 0.18081400 1.0 O O18 1 0.78622300 0.92899900 0.50576200 1.0 O O19 1 0.77550000 0.43262400 0.00537100 1.0 O O20 1 0.56697000 0.17595700 0.60680100 1.0 O O21 1 0.56647800 0.67696000 0.10742900 1.0 O O22 1 0.93480100 0.10037500 0.17485500 1.0 O O23 1 0.93864600 0.60850700 0.67260400 1.0 O O24 1 0.07997100 0.32984100 0.60510100 1.0 O O25 1 0.07875800 0.82989800 0.10064000 1.0 O O26 1 0.28205300 0.56734600 0.50259400 1.0 O O27 1 0.28298100 0.06353700 0.00014500 1.0 O O28 1 0.56104200 0.10835800 0.32801500 1.0 O O29 1 0.56322400 0.60957700 0.82686200 1.0 O O30 1 0.21911300 0.06875600 0.49860000 1.0 O O31 1 0.22607800 0.57277100 0.99365800 1.0 O O32 1 0.41911300 0.82922400 0.39729400 1.0 O O33 1 0.42578000 0.33031000 0.89396400 1.0 O O34 1 0.07009400 0.88867700 0.81839600 1.0 O O35 1 0.07031200 0.39156300 0.32601600 1.0 O O36 1 0.93476900 0.67484800 0.39220200 1.0 O O37 1 0.92898700 0.16741000 0.89176800 1.0 O O38 1 0.71455100 0.43152400 0.49484500 1.0 O O39 1 0.71362600 0.93046600 0.99511800 1.0