# generated using pymatgen data_Li5MgTi12O24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.99481828 _cell_length_b 5.99481828 _cell_length_c 14.75757100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000307 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5MgTi12O24 _chemical_formula_sum 'Li5 Mg1 Ti12 O24' _cell_volume 459.30116307 _cell_formula_units_Z 1 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 0.66666700 0.33333300 0.04218800 1.0 Li Li1 1 0.66666700 0.33333300 0.29011900 1.0 Li Li2 1 0.33333300 0.66666700 0.37590800 1.0 Li Li3 1 0.33333300 0.66666700 0.62026300 1.0 Li Li4 1 0.00000000 0.00000000 0.96180400 1.0 Mg Mg5 1 0.66666700 0.33333300 0.66372300 1.0 Ti Ti6 1 0.16684800 0.33369600 0.16694700 1.0 Ti Ti7 1 0.82923100 0.17076900 0.49879000 1.0 Ti Ti8 1 0.16684800 0.83315200 0.16694700 1.0 Ti Ti9 1 0.00000000 0.00000000 0.33288600 1.0 Ti Ti10 1 0.33333300 0.66666700 0.00183600 1.0 Ti Ti11 1 0.66630400 0.83315200 0.16694700 1.0 Ti Ti12 1 0.34153800 0.17076900 0.49879000 1.0 Ti Ti13 1 0.82923100 0.65846200 0.49879000 1.0 Ti Ti14 1 0.00896800 0.50448400 0.83806200 1.0 Ti Ti15 1 0.00000000 0.00000000 0.70976800 1.0 Ti Ti16 1 0.49551600 0.50448400 0.83806200 1.0 Ti Ti17 1 0.49551600 0.99103200 0.83806200 1.0 O O18 1 0.03326800 0.51663400 0.08826700 1.0 O O19 1 0.48336600 0.51663400 0.08826700 1.0 O O20 1 0.00000000 0.00000000 0.09673200 1.0 O O21 1 0.85064500 0.14935500 0.24586100 1.0 O O22 1 0.85064500 0.70128900 0.24586100 1.0 O O23 1 0.29871100 0.14935500 0.24586100 1.0 O O24 1 0.97124600 0.48562300 0.57413800 1.0 O O25 1 0.48336600 0.96673200 0.08826700 1.0 O O26 1 0.14798800 0.29597600 0.42084300 1.0 O O27 1 0.14798800 0.85201200 0.42084300 1.0 O O28 1 0.33333300 0.66666700 0.23700900 1.0 O O29 1 0.00000000 0.00000000 0.57925100 1.0 O O30 1 0.66666700 0.33333300 0.42668700 1.0 O O31 1 0.51437700 0.48562300 0.57413800 1.0 O O32 1 0.51437700 0.02875400 0.57413800 1.0 O O33 1 0.18188100 0.36376200 0.91316200 1.0 O O34 1 0.70402400 0.85201200 0.42084300 1.0 O O35 1 0.34456000 0.17228000 0.75295900 1.0 O O36 1 0.82772000 0.65544000 0.75295900 1.0 O O37 1 0.82772000 0.17228000 0.75295900 1.0 O O38 1 0.66666700 0.33333300 0.90168300 1.0 O O39 1 0.33333300 0.66666700 0.76305600 1.0 O O40 1 0.18188100 0.81811900 0.91316200 1.0 O O41 1 0.63623800 0.81811900 0.91316200 1.0