# generated using pymatgen data_Li2Mn3FeO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.90335800 _cell_length_b 5.90335800 _cell_length_c 9.45122700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000004 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Mn3FeO8 _chemical_formula_sum 'Li4 Mn6 Fe2 O16' _cell_volume 285.24436161 _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 Li Li0 1 0.33333300 0.66666700 0.89099600 1.0 Li Li1 1 0.00000000 0.00000000 0.99764900 1.0 Li Li2 1 0.00000000 0.00000000 0.49764900 1.0 Li Li3 1 0.66666700 0.33333300 0.39099600 1.0 Mn Mn4 1 0.17078600 0.82921400 0.21491600 1.0 Mn Mn5 1 0.17078600 0.34157200 0.21491600 1.0 Mn Mn6 1 0.65842800 0.82921400 0.21491600 1.0 Mn Mn7 1 0.34157200 0.17078600 0.71491600 1.0 Mn Mn8 1 0.82921400 0.65842800 0.71491600 1.0 Mn Mn9 1 0.82921400 0.17078600 0.71491600 1.0 Fe Fe10 1 0.33333300 0.66666700 0.49376900 1.0 Fe Fe11 1 0.66666700 0.33333300 0.99376900 1.0 O O12 1 0.16212100 0.83787900 0.60269900 1.0 O O13 1 0.03960000 0.51980000 0.33673100 1.0 O O14 1 0.33333300 0.66666700 0.10053200 1.0 O O15 1 0.00000000 0.00000000 0.30820000 1.0 O O16 1 0.00000000 0.00000000 0.80820000 1.0 O O17 1 0.16212100 0.32424200 0.60269900 1.0 O O18 1 0.48020000 0.96040000 0.33673100 1.0 O O19 1 0.48020000 0.51980000 0.33673100 1.0 O O20 1 0.32424200 0.16212100 0.10269900 1.0 O O21 1 0.67575800 0.83787900 0.60269900 1.0 O O22 1 0.51980000 0.48020000 0.83673100 1.0 O O23 1 0.51980000 0.03960000 0.83673100 1.0 O O24 1 0.66666700 0.33333300 0.60053200 1.0 O O25 1 0.83787900 0.67575800 0.10269900 1.0 O O26 1 0.96040000 0.48020000 0.83673100 1.0 O O27 1 0.83787900 0.16212100 0.10269900 1.0