# generated using pymatgen data_Sr4Ca4TiMn7O24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.70135735 _cell_length_b 7.70135735 _cell_length_c 7.70349581 _cell_angle_alpha 89.98143440 _cell_angle_beta 89.98143440 _cell_angle_gamma 89.99614920 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr4Ca4TiMn7O24 _chemical_formula_sum 'Sr4 Ca4 Ti1 Mn7 O24' _cell_volume 456.90125875 _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 Sr Sr0 1 0.24834900 0.75185300 0.75184200 1.0 Sr Sr1 1 0.75170400 0.75170400 0.75191500 1.0 Sr Sr2 1 0.75185300 0.24834900 0.75184200 1.0 Sr Sr3 1 0.24820100 0.24820100 0.24809700 1.0 Ca Ca4 1 0.24749300 0.75219900 0.24764900 1.0 Ca Ca5 1 0.75247500 0.75247500 0.24765800 1.0 Ca Ca6 1 0.24770600 0.24770600 0.75224100 1.0 Ca Ca7 1 0.75219900 0.24749300 0.24764900 1.0 Ti Ti8 1 0.50000300 0.50000300 0.49739300 1.0 Mn Mn9 1 0.00010900 0.49994600 0.00081700 1.0 Mn Mn10 1 0.49994600 0.49994600 0.00036200 1.0 Mn Mn11 1 0.00007100 0.49991900 0.49879100 1.0 Mn Mn12 1 0.00006800 0.00006800 0.00088500 1.0 Mn Mn13 1 0.49994600 0.00010900 0.00081700 1.0 Mn Mn14 1 0.00009800 0.00009800 0.49905500 1.0 Mn Mn15 1 0.49991900 0.00007100 0.49879100 1.0 O O16 1 0.99999800 0.75017600 0.00663600 1.0 O O17 1 0.49994200 0.74990300 0.00685800 1.0 O O18 1 0.00001200 0.74987900 0.49333000 1.0 O O19 1 0.49997100 0.75267200 0.49547500 1.0 O O20 1 0.99998100 0.24984000 0.00092900 1.0 O O21 1 0.50006800 0.25005400 0.00077600 1.0 O O22 1 0.99997600 0.25011900 0.49930000 1.0 O O23 1 0.50005700 0.24733300 0.49868300 1.0 O O24 1 0.00303500 0.49703700 0.74997100 1.0 O O25 1 0.49830200 0.49830200 0.75272700 1.0 O O26 1 0.99701600 0.50290300 0.25013100 1.0 O O27 1 0.50152100 0.50152100 0.24733500 1.0 O O28 1 0.00286700 0.00286700 0.75016400 1.0 O O29 1 0.49703700 0.00303500 0.74997100 1.0 O O30 1 0.99720200 0.99720200 0.24979100 1.0 O O31 1 0.50290300 0.99701600 0.25013100 1.0 O O32 1 0.25005400 0.50006800 0.00077600 1.0 O O33 1 0.74990300 0.49994200 0.00685800 1.0 O O34 1 0.24733300 0.50005700 0.49868300 1.0 O O35 1 0.75267200 0.49997100 0.49547500 1.0 O O36 1 0.24984000 0.99998100 0.00092900 1.0 O O37 1 0.75017600 0.99999800 0.00663600 1.0 O O38 1 0.25011900 0.99997600 0.49930000 1.0 O O39 1 0.74987900 0.00001200 0.49333000 1.0