# generated using pymatgen data_Ca7MgTiMn7O24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.61514407 _cell_length_b 7.61514407 _cell_length_c 7.61514411 _cell_angle_alpha 90.00683075 _cell_angle_beta 90.00683075 _cell_angle_gamma 90.00683116 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca7MgTiMn7O24 _chemical_formula_sum 'Ca7 Mg1 Ti1 Mn7 O24' _cell_volume 441.60538941 _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 0.75085800 0.24911300 0.75085800 1.0 Ca Ca1 1 0.75083600 0.24916800 0.24916800 1.0 Ca Ca2 1 0.75085800 0.75085800 0.24911300 1.0 Ca Ca3 1 0.24916800 0.24916800 0.75083600 1.0 Ca Ca4 1 0.24917500 0.24917500 0.24917500 1.0 Ca Ca5 1 0.24911300 0.75085800 0.75085800 1.0 Ca Ca6 1 0.24916800 0.75083600 0.24916800 1.0 Mg Mg7 1 0.75091300 0.75091300 0.75091300 1.0 Ti Ti8 1 0.50059500 0.50059500 0.50059500 1.0 Mn Mn9 1 0.50037300 0.99966300 0.99966300 1.0 Mn Mn10 1 0.50030100 0.99982500 0.50030100 1.0 Mn Mn11 1 0.50030100 0.50030100 0.99982500 1.0 Mn Mn12 1 0.99965200 0.99965200 0.99965200 1.0 Mn Mn13 1 0.99966300 0.99966300 0.50037300 1.0 Mn Mn14 1 0.99966300 0.50037300 0.99966300 1.0 Mn Mn15 1 0.99982500 0.50030100 0.50030100 1.0 O O16 1 0.75008200 0.99896800 0.99896800 1.0 O O17 1 0.75023500 0.99886100 0.50107900 1.0 O O18 1 0.75023500 0.50107900 0.99886100 1.0 O O19 1 0.75290100 0.50080700 0.50080700 1.0 O O20 1 0.24992300 0.99994300 0.99994300 1.0 O O21 1 0.24972600 0.99995800 0.50006400 1.0 O O22 1 0.24972600 0.50006400 0.99995800 1.0 O O23 1 0.24719500 0.50007800 0.50007800 1.0 O O24 1 0.50006400 0.24972600 0.99995800 1.0 O O25 1 0.50007800 0.24719500 0.50007800 1.0 O O26 1 0.50107900 0.75023500 0.99886100 1.0 O O27 1 0.50080700 0.75290100 0.50080700 1.0 O O28 1 0.99994300 0.24992300 0.99994300 1.0 O O29 1 0.99995800 0.24972600 0.50006400 1.0 O O30 1 0.99896800 0.75008200 0.99896800 1.0 O O31 1 0.99886100 0.75023500 0.50107900 1.0 O O32 1 0.50107900 0.99886100 0.75023500 1.0 O O33 1 0.50006400 0.99995800 0.24972600 1.0 O O34 1 0.50080700 0.50080700 0.75290100 1.0 O O35 1 0.50007800 0.50007800 0.24719500 1.0 O O36 1 0.99896800 0.99896800 0.75008200 1.0 O O37 1 0.99994300 0.99994300 0.24992300 1.0 O O38 1 0.99886100 0.50107900 0.75023500 1.0 O O39 1 0.99995800 0.50006400 0.24972600 1.0