# generated using pymatgen data_MgMn2O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.04304639 _cell_length_b 6.04304639 _cell_length_c 14.82043093 _cell_angle_alpha 89.98241890 _cell_angle_beta 89.98241890 _cell_angle_gamma 60.22087484 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgMn2O4 _chemical_formula_sum 'Mg6 Mn12 O24' _cell_volume 469.74871193 _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 Mg Mg0 1 0.84267900 0.84267900 0.95809400 1.0 Mg Mg1 1 0.16552600 0.16552600 0.66654700 1.0 Mg Mg2 1 0.33314300 0.33314300 0.83316400 1.0 Mg Mg3 1 0.83398400 0.83398400 0.33389400 1.0 Mg Mg4 1 0.99978500 0.99978500 0.50016600 1.0 Mg Mg5 1 0.66693100 0.66693100 0.16656000 1.0 Mn Mn6 1 0.83442600 0.33504000 0.83302800 1.0 Mn Mn7 1 0.50687000 0.50687000 0.62091300 1.0 Mn Mn8 1 0.49992800 0.49992800 0.99899000 1.0 Mn Mn9 1 0.33504000 0.83442600 0.83302800 1.0 Mn Mn10 1 0.50016100 0.99960900 0.50029200 1.0 Mn Mn11 1 0.17423600 0.17423600 0.29113100 1.0 Mn Mn12 1 0.99960900 0.50016100 0.50029200 1.0 Mn Mn13 1 0.16302600 0.66607100 0.16693900 1.0 Mn Mn14 1 0.82583100 0.82583100 0.70978900 1.0 Mn Mn15 1 0.66607100 0.16302600 0.16693900 1.0 Mn Mn16 1 0.49258500 0.49258500 0.37832400 1.0 Mn Mn17 1 0.16011000 0.16011000 0.04217100 1.0 O O18 1 0.65880400 0.20775200 0.91493700 1.0 O O19 1 0.50725700 0.50725700 0.76250300 1.0 O O20 1 0.20775200 0.65880400 0.91493700 1.0 O O21 1 0.65713000 0.65713000 0.91394800 1.0 O O22 1 0.32962400 0.86855900 0.57601200 1.0 O O23 1 0.00882200 0.00882200 0.75948900 1.0 O O24 1 0.17471700 0.17471700 0.42916700 1.0 O O25 1 0.46697100 0.00273000 0.75889800 1.0 O O26 1 0.86855900 0.32962400 0.57601200 1.0 O O27 1 0.15901400 0.15901400 0.90431600 1.0 O O28 1 0.32026100 0.32026100 0.57455000 1.0 O O29 1 0.00273000 0.46697100 0.75889800 1.0 O O30 1 0.99590900 0.53258100 0.24106900 1.0 O O31 1 0.67919100 0.67919100 0.42596000 1.0 O O32 1 0.13153900 0.66962700 0.42439200 1.0 O O33 1 0.53258100 0.99590900 0.24106900 1.0 O O34 1 0.84035100 0.84035100 0.09420600 1.0 O O35 1 0.82507200 0.82507200 0.57153600 1.0 O O36 1 0.99117000 0.99117000 0.24145900 1.0 O O37 1 0.66962700 0.13153900 0.42439200 1.0 O O38 1 0.34589100 0.34589100 0.08568200 1.0 O O39 1 0.78836700 0.34259700 0.08478700 1.0 O O40 1 0.49126100 0.49126100 0.23663300 1.0 O O41 1 0.34259700 0.78836700 0.08478700 1.0