# generated using pymatgen data_Li4TiMn8O18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.92310400 _cell_length_b 9.04412700 _cell_length_c 25.15065500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4TiMn8O18 _chemical_formula_sum 'Li8 Ti2 Mn16 O36' _cell_volume 664.90595001 _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 0.00000000 0.92575700 0.99918900 1.0 Li Li1 1 0.00000000 0.94243300 0.20693100 1.0 Li Li2 1 0.00000000 0.05756700 0.70693100 1.0 Li Li3 1 0.00000000 0.07424300 0.49918900 1.0 Li Li4 1 0.00000000 0.43795700 0.52078200 1.0 Li Li5 1 0.00000000 0.43749100 0.29287400 1.0 Li Li6 1 0.00000000 0.56250900 0.79287400 1.0 Li Li7 1 0.00000000 0.56204300 0.02078200 1.0 Ti Ti8 1 0.00000000 0.24860800 0.39480900 1.0 Ti Ti9 1 0.00000000 0.75139200 0.89480900 1.0 Mn Mn10 1 0.00000000 0.74623600 0.50062800 1.0 Mn Mn11 1 0.00000000 0.75556000 0.10630800 1.0 Mn Mn12 1 0.00000000 0.76962100 0.30798000 1.0 Mn Mn13 1 0.50000000 0.89323300 0.58558300 1.0 Mn Mn14 1 0.50000000 0.89987900 0.80494300 1.0 Mn Mn15 1 0.50000000 0.10012100 0.30494300 1.0 Mn Mn16 1 0.50000000 0.10676700 0.08558300 1.0 Mn Mn17 1 0.00000000 0.23037900 0.80798000 1.0 Mn Mn18 1 0.00000000 0.24444000 0.60630800 1.0 Mn Mn19 1 0.00000000 0.25376400 0.00062800 1.0 Mn Mn20 1 0.00000000 0.27047200 0.18747100 1.0 Mn Mn21 1 0.50000000 0.40022300 0.91339400 1.0 Mn Mn22 1 0.50000000 0.40374200 0.69230900 1.0 Mn Mn23 1 0.50000000 0.59625800 0.19230900 1.0 Mn Mn24 1 0.50000000 0.59977700 0.41339400 1.0 Mn Mn25 1 0.00000000 0.72952800 0.68747100 1.0 O O26 1 0.00000000 0.74068500 0.42414200 1.0 O O27 1 0.00000000 0.74968800 0.57696500 1.0 O O28 1 0.50000000 0.80262900 0.93931500 1.0 O O29 1 0.50000000 0.79512000 0.16019700 1.0 O O30 1 0.50000000 0.85715700 0.66188800 1.0 O O31 1 0.00000000 0.85856400 0.75748700 1.0 O O32 1 0.50000000 0.90433600 0.50822200 1.0 O O33 1 0.50000000 0.89611600 0.27963200 1.0 O O34 1 0.00000000 0.94011000 0.85400700 1.0 O O35 1 0.00000000 0.96644700 0.08639700 1.0 O O36 1 0.00000000 0.03355300 0.58639700 1.0 O O37 1 0.00000000 0.05989000 0.35400700 1.0 O O38 1 0.50000000 0.10388400 0.77963200 1.0 O O39 1 0.50000000 0.09566400 0.00822200 1.0 O O40 1 0.00000000 0.14143600 0.25748700 1.0 O O41 1 0.50000000 0.14284300 0.16188800 1.0 O O42 1 0.50000000 0.20488000 0.66019700 1.0 O O43 1 0.50000000 0.19737100 0.43931500 1.0 O O44 1 0.00000000 0.25031200 0.07696500 1.0 O O45 1 0.00000000 0.25931500 0.92414200 1.0 O O46 1 0.50000000 0.29213500 0.55827700 1.0 O O47 1 0.50000000 0.29603800 0.33782900 1.0 O O48 1 0.50000000 0.35129700 0.83673500 1.0 O O49 1 0.00000000 0.36287000 0.74026300 1.0 O O50 1 0.50000000 0.40867100 0.99476800 1.0 O O51 1 0.50000000 0.39252900 0.21637800 1.0 O O52 1 0.00000000 0.44606800 0.64427400 1.0 O O53 1 0.00000000 0.45840700 0.40976400 1.0 O O54 1 0.00000000 0.54159300 0.90976400 1.0 O O55 1 0.00000000 0.55393200 0.14427400 1.0 O O56 1 0.50000000 0.60747100 0.71637800 1.0 O O57 1 0.50000000 0.59132900 0.49476800 1.0 O O58 1 0.00000000 0.63713000 0.24026300 1.0 O O59 1 0.50000000 0.64870300 0.33673500 1.0 O O60 1 0.50000000 0.70396200 0.83782900 1.0 O O61 1 0.50000000 0.70786500 0.05827700 1.0