# generated using pymatgen data_Li2MnCu3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.30735400 _cell_length_b 8.30735400 _cell_length_c 8.30735400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2MnCu3O8 _chemical_formula_sum 'Li8 Mn4 Cu12 O32' _cell_volume 573.30819820 _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 0.49759900 0.49759900 0.49759900 1.0 Li Li1 1 0.75240100 0.75240100 0.75240100 1.0 Li Li2 1 0.74759900 0.24759900 0.25240100 1.0 Li Li3 1 0.00240100 0.50240100 0.99759900 1.0 Li Li4 1 0.99759900 0.00240100 0.50240100 1.0 Li Li5 1 0.25240100 0.74759900 0.24759900 1.0 Li Li6 1 0.24759900 0.25240100 0.74759900 1.0 Li Li7 1 0.50240100 0.99759900 0.00240100 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 Cu Cu12 1 0.62838000 0.62162000 0.12500000 1.0 Cu Cu13 1 0.62500000 0.87162000 0.37838000 1.0 Cu Cu14 1 0.62162000 0.12500000 0.62838000 1.0 Cu Cu15 1 0.87838000 0.87500000 0.12838000 1.0 Cu Cu16 1 0.87500000 0.12838000 0.87838000 1.0 Cu Cu17 1 0.87162000 0.37838000 0.62500000 1.0 Cu Cu18 1 0.12838000 0.87838000 0.87500000 1.0 Cu Cu19 1 0.12500000 0.62838000 0.62162000 1.0 Cu Cu20 1 0.12162000 0.37500000 0.37162000 1.0 Cu Cu21 1 0.37838000 0.62500000 0.87162000 1.0 Cu Cu22 1 0.37500000 0.37162000 0.12162000 1.0 Cu Cu23 1 0.37162000 0.12162000 0.37500000 1.0 O O24 1 0.61679500 0.60712400 0.88572600 1.0 O O25 1 0.61427400 0.38320500 0.10712400 1.0 O O26 1 0.60735900 0.10735900 0.39264100 1.0 O O27 1 0.64287600 0.63320500 0.36427400 1.0 O O28 1 0.60712400 0.88572600 0.61679500 1.0 O O29 1 0.64264100 0.85735900 0.14264100 1.0 O O30 1 0.63572600 0.14287600 0.86679500 1.0 O O31 1 0.63320500 0.36427400 0.64287600 1.0 O O32 1 0.86679500 0.63572600 0.14287600 1.0 O O33 1 0.86427400 0.85712400 0.36679500 1.0 O O34 1 0.85735900 0.14264100 0.64264100 1.0 O O35 1 0.89287600 0.11427400 0.11679500 1.0 O O36 1 0.85712400 0.36679500 0.86427400 1.0 O O37 1 0.89264100 0.89264100 0.89264100 1.0 O O38 1 0.88572600 0.61679500 0.60712400 1.0 O O39 1 0.88320500 0.39287600 0.38572600 1.0 O O40 1 0.11679500 0.89287600 0.11427400 1.0 O O41 1 0.11427400 0.11679500 0.89287600 1.0 O O42 1 0.10735900 0.39264100 0.60735900 1.0 O O43 1 0.14287600 0.86679500 0.63572600 1.0 O O44 1 0.10712400 0.61427400 0.38320500 1.0 O O45 1 0.14264100 0.64264100 0.85735900 1.0 O O46 1 0.13572600 0.35712400 0.13320500 1.0 O O47 1 0.13320500 0.13572600 0.35712400 1.0 O O48 1 0.36679500 0.86427400 0.85712400 1.0 O O49 1 0.36427400 0.64287600 0.63320500 1.0 O O50 1 0.35735900 0.35735900 0.35735900 1.0 O O51 1 0.39287600 0.38572600 0.88320500 1.0 O O52 1 0.35712400 0.13320500 0.13572600 1.0 O O53 1 0.39264100 0.60735900 0.10735900 1.0 O O54 1 0.38572600 0.88320500 0.39287600 1.0 O O55 1 0.38320500 0.10712400 0.61427400 1.0