# generated using pymatgen data_Li2MnFe3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.41994500 _cell_length_b 8.41994500 _cell_length_c 8.41994500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2MnFe3O8 _chemical_formula_sum 'Li8 Mn4 Fe12 O32' _cell_volume 596.93599017 _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 Li Li0 1 0.50144400 0.50144400 0.50144400 1.0 Li Li1 1 0.74855600 0.74855600 0.74855600 1.0 Li Li2 1 0.75144400 0.25144400 0.24855600 1.0 Li Li3 1 0.99855600 0.49855600 0.00144400 1.0 Li Li4 1 0.00144400 0.99855600 0.49855600 1.0 Li Li5 1 0.24855600 0.75144400 0.25144400 1.0 Li Li6 1 0.25144400 0.24855600 0.75144400 1.0 Li Li7 1 0.49855600 0.00144400 0.99855600 1.0 Mn Mn8 1 0.62500000 0.37500000 0.87500000 1.0 Mn Mn9 1 0.87500000 0.62500000 0.37500000 1.0 Mn Mn10 1 0.12500000 0.12500000 0.12500000 1.0 Mn Mn11 1 0.37500000 0.87500000 0.62500000 1.0 Fe Fe12 1 0.62611300 0.62388700 0.12500000 1.0 Fe Fe13 1 0.62500000 0.87388700 0.37611300 1.0 Fe Fe14 1 0.62388700 0.12500000 0.62611300 1.0 Fe Fe15 1 0.87611300 0.87500000 0.12611300 1.0 Fe Fe16 1 0.87500000 0.12611300 0.87611300 1.0 Fe Fe17 1 0.87388700 0.37611300 0.62500000 1.0 Fe Fe18 1 0.12611300 0.87611300 0.87500000 1.0 Fe Fe19 1 0.12500000 0.62611300 0.62388700 1.0 Fe Fe20 1 0.12388700 0.37500000 0.37388700 1.0 Fe Fe21 1 0.37611300 0.62500000 0.87388700 1.0 Fe Fe22 1 0.37500000 0.37388700 0.12388700 1.0 Fe Fe23 1 0.37388700 0.12388700 0.37500000 1.0 O O24 1 0.61634700 0.60506800 0.88554200 1.0 O O25 1 0.61445800 0.38365300 0.10506800 1.0 O O26 1 0.61348200 0.11348200 0.38651800 1.0 O O27 1 0.64493200 0.63365300 0.36445800 1.0 O O28 1 0.60506800 0.88554200 0.61634700 1.0 O O29 1 0.63651800 0.86348200 0.13651800 1.0 O O30 1 0.63554200 0.14493200 0.86634700 1.0 O O31 1 0.63365300 0.36445800 0.64493200 1.0 O O32 1 0.86634700 0.63554200 0.14493200 1.0 O O33 1 0.86445800 0.85506800 0.36634700 1.0 O O34 1 0.86348200 0.13651800 0.63651800 1.0 O O35 1 0.89493200 0.11445800 0.11634700 1.0 O O36 1 0.85506800 0.36634700 0.86445800 1.0 O O37 1 0.88651800 0.88651800 0.88651800 1.0 O O38 1 0.88554200 0.61634700 0.60506800 1.0 O O39 1 0.88365300 0.39493200 0.38554200 1.0 O O40 1 0.11634700 0.89493200 0.11445800 1.0 O O41 1 0.11445800 0.11634700 0.89493200 1.0 O O42 1 0.11348200 0.38651800 0.61348200 1.0 O O43 1 0.14493200 0.86634700 0.63554200 1.0 O O44 1 0.10506800 0.61445800 0.38365300 1.0 O O45 1 0.13651800 0.63651800 0.86348200 1.0 O O46 1 0.13554200 0.35506800 0.13365300 1.0 O O47 1 0.13365300 0.13554200 0.35506800 1.0 O O48 1 0.36634700 0.86445800 0.85506800 1.0 O O49 1 0.36445800 0.64493200 0.63365300 1.0 O O50 1 0.36348200 0.36348200 0.36348200 1.0 O O51 1 0.39493200 0.38554200 0.88365300 1.0 O O52 1 0.35506800 0.13365300 0.13554200 1.0 O O53 1 0.38651800 0.61348200 0.11348200 1.0 O O54 1 0.38554200 0.88365300 0.39493200 1.0 O O55 1 0.38365300 0.10506800 0.61445800 1.0