# generated using pymatgen data_Li2MnCr3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.30674200 _cell_length_b 8.30674200 _cell_length_c 8.30674200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2MnCr3O8 _chemical_formula_sum 'Li8 Mn4 Cr12 O32' _cell_volume 573.18150127 _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 0.00053400 0.00053400 0.00053400 1.0 Li Li1 1 0.24946600 0.24946600 0.24946600 1.0 Li Li2 1 0.25053400 0.75053400 0.74946600 1.0 Li Li3 1 0.49946600 0.99946600 0.50053400 1.0 Li Li4 1 0.50053400 0.49946600 0.99946600 1.0 Li Li5 1 0.74946600 0.25053400 0.75053400 1.0 Li Li6 1 0.75053400 0.74946600 0.25053400 1.0 Li Li7 1 0.99946600 0.50053400 0.49946600 1.0 Mn Mn8 1 0.12500000 0.87500000 0.37500000 1.0 Mn Mn9 1 0.37500000 0.12500000 0.87500000 1.0 Mn Mn10 1 0.62500000 0.62500000 0.62500000 1.0 Mn Mn11 1 0.87500000 0.37500000 0.12500000 1.0 Cr Cr12 1 0.12553000 0.12447000 0.62500000 1.0 Cr Cr13 1 0.12500000 0.37447000 0.87553000 1.0 Cr Cr14 1 0.12447000 0.62500000 0.12553000 1.0 Cr Cr15 1 0.37553000 0.37500000 0.62553000 1.0 Cr Cr16 1 0.37500000 0.62553000 0.37553000 1.0 Cr Cr17 1 0.37447000 0.87553000 0.12500000 1.0 Cr Cr18 1 0.62553000 0.37553000 0.37500000 1.0 Cr Cr19 1 0.62500000 0.12553000 0.12447000 1.0 Cr Cr20 1 0.62447000 0.87500000 0.87447000 1.0 Cr Cr21 1 0.87553000 0.12500000 0.37447000 1.0 Cr Cr22 1 0.87500000 0.87447000 0.62447000 1.0 Cr Cr23 1 0.87447000 0.62447000 0.87500000 1.0 O O24 1 0.11377200 0.10779000 0.38981800 1.0 O O25 1 0.11018200 0.88622800 0.60779000 1.0 O O26 1 0.11226300 0.61226300 0.88773700 1.0 O O27 1 0.14221000 0.13622800 0.86018200 1.0 O O28 1 0.10779000 0.38981800 0.11377200 1.0 O O29 1 0.13773700 0.36226300 0.63773700 1.0 O O30 1 0.13981800 0.64221000 0.36377200 1.0 O O31 1 0.13622800 0.86018200 0.14221000 1.0 O O32 1 0.36377200 0.13981800 0.64221000 1.0 O O33 1 0.36018200 0.35779000 0.86377200 1.0 O O34 1 0.36226300 0.63773700 0.13773700 1.0 O O35 1 0.39221000 0.61018200 0.61377200 1.0 O O36 1 0.35779000 0.86377200 0.36018200 1.0 O O37 1 0.38773700 0.38773700 0.38773700 1.0 O O38 1 0.38981800 0.11377200 0.10779000 1.0 O O39 1 0.38622800 0.89221000 0.88981800 1.0 O O40 1 0.61377200 0.39221000 0.61018200 1.0 O O41 1 0.61018200 0.61377200 0.39221000 1.0 O O42 1 0.61226300 0.88773700 0.11226300 1.0 O O43 1 0.64221000 0.36377200 0.13981800 1.0 O O44 1 0.60779000 0.11018200 0.88622800 1.0 O O45 1 0.63773700 0.13773700 0.36226300 1.0 O O46 1 0.63981800 0.85779000 0.63622800 1.0 O O47 1 0.63622800 0.63981800 0.85779000 1.0 O O48 1 0.86377200 0.36018200 0.35779000 1.0 O O49 1 0.86018200 0.14221000 0.13622800 1.0 O O50 1 0.86226300 0.86226300 0.86226300 1.0 O O51 1 0.89221000 0.88981800 0.38622800 1.0 O O52 1 0.85779000 0.63622800 0.63981800 1.0 O O53 1 0.88773700 0.11226300 0.61226300 1.0 O O54 1 0.88981800 0.38622800 0.89221000 1.0 O O55 1 0.88622800 0.60779000 0.11018200 1.0