# generated using pymatgen data_Mn3O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.17260000 _cell_length_b 12.14924400 _cell_length_c 10.47941700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3O4 _chemical_formula_sum 'Mn12 O16' _cell_volume 403.92589552 _cell_formula_units_Z 4 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 Mn Mn0 1 0.24269900 0.25000000 0.52591800 1.0 Mn Mn1 1 0.75730100 0.75000000 0.47408200 1.0 Mn Mn2 1 0.24269900 0.75000000 0.97408200 1.0 Mn Mn3 1 0.75730100 0.25000000 0.02591800 1.0 Mn Mn4 1 0.74108500 0.45579200 0.62268100 1.0 Mn Mn5 1 0.25891500 0.95579200 0.37731900 1.0 Mn Mn6 1 0.74108500 0.54420800 0.87731900 1.0 Mn Mn7 1 0.25891500 0.04420800 0.12268100 1.0 Mn Mn8 1 0.25891500 0.54420800 0.37731900 1.0 Mn Mn9 1 0.74108500 0.04420800 0.62268100 1.0 Mn Mn10 1 0.25891500 0.45579200 0.12268100 1.0 Mn Mn11 1 0.74108500 0.95579200 0.87731900 1.0 O O12 1 0.23679500 0.50000000 0.75000000 1.0 O O13 1 0.76320500 0.00000000 0.25000000 1.0 O O14 1 0.76320500 0.50000000 0.25000000 1.0 O O15 1 0.23679500 0.00000000 0.75000000 1.0 O O16 1 0.74243200 0.25000000 0.62186500 1.0 O O17 1 0.25756800 0.75000000 0.37813500 1.0 O O18 1 0.74243200 0.75000000 0.87813500 1.0 O O19 1 0.25756800 0.25000000 0.12186500 1.0 O O20 1 0.24416500 0.40518700 0.50574800 1.0 O O21 1 0.75583500 0.90518700 0.49425200 1.0 O O22 1 0.24416500 0.59481300 0.99425200 1.0 O O23 1 0.75583500 0.09481300 0.00574800 1.0 O O24 1 0.75583500 0.59481300 0.49425200 1.0 O O25 1 0.24416500 0.09481300 0.50574800 1.0 O O26 1 0.75583500 0.40518700 0.00574800 1.0 O O27 1 0.24416500 0.90518700 0.99425200 1.0