# generated using pymatgen data_Li5Ti2Mn8O20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.05319331 _cell_length_b 6.05319331 _cell_length_c 24.81875204 _cell_angle_alpha 80.15257827 _cell_angle_beta 80.15257827 _cell_angle_gamma 57.69379674 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Ti2Mn8O20 _chemical_formula_sum 'Li10 Ti4 Mn16 O40' _cell_volume 753.82425118 _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 0.48258700 0.48258700 0.57559600 1.0 Li Li1 1 0.51741300 0.51741300 0.42440400 1.0 Li Li2 1 0.12786700 0.12786700 0.62576900 1.0 Li Li3 1 0.87213300 0.87213300 0.37423100 1.0 Li Li4 1 0.93174900 0.93174900 0.22521200 1.0 Li Li5 1 0.27591900 0.27591900 0.17542400 1.0 Li Li6 1 0.32257700 0.32257700 0.02248600 1.0 Li Li7 1 0.06825100 0.06825100 0.77478800 1.0 Li Li8 1 0.67742300 0.67742300 0.97751400 1.0 Li Li9 1 0.72408100 0.72408100 0.82457600 1.0 Ti Ti10 1 0.81192200 0.81192200 0.59843900 1.0 Ti Ti11 1 0.18807800 0.18807800 0.40156100 1.0 Ti Ti12 1 0.79835300 0.79835300 0.09980500 1.0 Ti Ti13 1 0.20164700 0.20164700 0.90019500 1.0 Mn Mn14 1 0.00000000 0.00000000 0.50000000 1.0 Mn Mn15 1 0.00000000 0.50000000 0.50000000 1.0 Mn Mn16 1 0.50000000 0.00000000 0.50000000 1.0 Mn Mn17 1 0.40169900 0.40169900 0.30028700 1.0 Mn Mn18 1 0.60542700 0.60542700 0.19978500 1.0 Mn Mn19 1 0.40465600 0.90181600 0.30009000 1.0 Mn Mn20 1 0.29885000 0.79543400 0.09986600 1.0 Mn Mn21 1 0.90181600 0.40465600 0.30009000 1.0 Mn Mn22 1 0.79543400 0.29885000 0.09986600 1.0 Mn Mn23 1 0.00000000 0.00000000 0.00000000 1.0 Mn Mn24 1 0.70115000 0.20456600 0.90013400 1.0 Mn Mn25 1 0.20456600 0.70115000 0.90013400 1.0 Mn Mn26 1 0.59830100 0.59830100 0.69971300 1.0 Mn Mn27 1 0.39457300 0.39457300 0.80021500 1.0 Mn Mn28 1 0.09818400 0.59534400 0.69991000 1.0 Mn Mn29 1 0.59534400 0.09818400 0.69991000 1.0 O O30 1 0.31974000 0.87327400 0.44881100 1.0 O O31 1 0.87327400 0.31974000 0.44881100 1.0 O O32 1 0.12672600 0.68026000 0.55118900 1.0 O O33 1 0.68026000 0.12672600 0.55118900 1.0 O O34 1 0.06844800 0.06844800 0.34661800 1.0 O O35 1 0.84307800 0.84307800 0.45804900 1.0 O O36 1 0.67547200 0.67547200 0.55158200 1.0 O O37 1 0.56532300 0.56532300 0.34336300 1.0 O O38 1 0.32452800 0.32452800 0.44841800 1.0 O O39 1 0.15692200 0.15692200 0.54195100 1.0 O O40 1 0.74393000 0.29220400 0.25570900 1.0 O O41 1 0.29220400 0.74393000 0.25570900 1.0 O O42 1 0.06113600 0.51247800 0.34497300 1.0 O O43 1 0.51247800 0.06113600 0.34497300 1.0 O O44 1 0.23916100 0.23916100 0.25719000 1.0 O O45 1 0.46703600 0.46703600 0.14783900 1.0 O O46 1 0.94873000 0.94873000 0.14138900 1.0 O O47 1 0.73885000 0.73885000 0.25629400 1.0 O O48 1 0.12106800 0.67959600 0.04913400 1.0 O O49 1 0.67959600 0.12106800 0.04913400 1.0 O O50 1 0.47704700 0.92322500 0.14899800 1.0 O O51 1 0.92322500 0.47704700 0.14899800 1.0 O O52 1 0.32040400 0.87893200 0.95086600 1.0 O O53 1 0.87893200 0.32040400 0.95086600 1.0 O O54 1 0.87616600 0.87616600 0.95022300 1.0 O O55 1 0.05127000 0.05127000 0.85861100 1.0 O O56 1 0.64899200 0.64899200 0.05933000 1.0 O O57 1 0.53296400 0.53296400 0.85216100 1.0 O O58 1 0.12383400 0.12383400 0.04977700 1.0 O O59 1 0.35100800 0.35100800 0.94067000 1.0 O O60 1 0.52295300 0.07677500 0.85100200 1.0 O O61 1 0.07677500 0.52295300 0.85100200 1.0 O O62 1 0.70779600 0.25607000 0.74429100 1.0 O O63 1 0.25607000 0.70779600 0.74429100 1.0 O O64 1 0.26115000 0.26115000 0.74370600 1.0 O O65 1 0.43467700 0.43467700 0.65663700 1.0 O O66 1 0.76083900 0.76083900 0.74281000 1.0 O O67 1 0.93155200 0.93155200 0.65338200 1.0 O O68 1 0.48752200 0.93886400 0.65502700 1.0 O O69 1 0.93886400 0.48752200 0.65502700 1.0