# generated using pymatgen data_Mn5FeO12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.86088675 _cell_length_b 5.86088675 _cell_length_c 13.07208388 _cell_angle_alpha 77.55145553 _cell_angle_beta 77.55145553 _cell_angle_gamma 90.04104729 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn5FeO12 _chemical_formula_sum 'Mn10 Fe2 O24' _cell_volume 427.63645909 _cell_formula_units_Z 2 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 0.50000000 0.00000000 0.00000000 1.0 Mn Mn1 1 0.16618000 0.16581300 0.16703800 1.0 Mn Mn2 1 0.66626800 0.16591700 0.16714200 1.0 Mn Mn3 1 0.83408300 0.33373200 0.33285800 1.0 Mn Mn4 1 0.83418700 0.83382000 0.33296200 1.0 Mn Mn5 1 0.00000000 0.50000000 0.50000000 1.0 Mn Mn6 1 0.16591700 0.66626800 0.66714200 1.0 Mn Mn7 1 0.16581300 0.16618000 0.66703800 1.0 Mn Mn8 1 0.83382000 0.83418700 0.83296200 1.0 Mn Mn9 1 0.33373200 0.83408300 0.83285800 1.0 Fe Fe10 1 0.50000000 0.50000000 0.00000000 1.0 Fe Fe11 1 0.50000000 0.50000000 0.50000000 1.0 O O12 1 0.27086300 0.23603200 0.01159900 1.0 O O13 1 0.71590900 0.23821300 0.01141200 1.0 O O14 1 0.42016600 0.38635900 0.15985500 1.0 O O15 1 0.42225400 0.95371700 0.15612800 1.0 O O16 1 0.91082800 0.37975000 0.17746000 1.0 O O17 1 0.91078800 0.94326900 0.17720800 1.0 O O18 1 0.05673100 0.08921200 0.32279200 1.0 O O19 1 0.62025000 0.08917200 0.32254000 1.0 O O20 1 0.61364100 0.57983400 0.34014500 1.0 O O21 1 0.04628300 0.57774600 0.34387200 1.0 O O22 1 0.76396800 0.72913700 0.48840100 1.0 O O23 1 0.76178700 0.28409100 0.48858800 1.0 O O24 1 0.23821300 0.71590900 0.51141200 1.0 O O25 1 0.23603200 0.27086300 0.51159900 1.0 O O26 1 0.95371700 0.42225400 0.65612800 1.0 O O27 1 0.38635900 0.42016600 0.65985500 1.0 O O28 1 0.94326900 0.91078800 0.67720800 1.0 O O29 1 0.37975000 0.91082800 0.67746000 1.0 O O30 1 0.08921200 0.05673100 0.82279200 1.0 O O31 1 0.08917200 0.62025000 0.82254000 1.0 O O32 1 0.57983400 0.61364100 0.84014500 1.0 O O33 1 0.57774600 0.04628300 0.84387200 1.0 O O34 1 0.72913700 0.76396800 0.98840100 1.0 O O35 1 0.28409100 0.76178700 0.98858800 1.0