# generated using pymatgen data_Li4Ti2Mn7O18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.94834800 _cell_length_b 9.04583400 _cell_length_c 25.01948300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Ti2Mn7O18 _chemical_formula_sum 'Li8 Ti4 Mn14 O36' _cell_volume 667.27628136 _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 0.50000000 0.69009100 0.48924500 1.0 Li Li1 1 0.50000000 0.69353200 0.70650800 1.0 Li Li2 1 0.50000000 0.80646800 0.20650800 1.0 Li Li3 1 0.50000000 0.80990900 0.98924500 1.0 Li Li4 1 0.50000000 0.19009100 0.01075500 1.0 Li Li5 1 0.50000000 0.19353200 0.79349200 1.0 Li Li6 1 0.50000000 0.30646800 0.29349200 1.0 Li Li7 1 0.50000000 0.30990900 0.51075500 1.0 Ti Ti8 1 0.50000000 0.50321000 0.60402300 1.0 Ti Ti9 1 0.50000000 0.99679000 0.10402300 1.0 Ti Ti10 1 0.50000000 0.00321000 0.89597700 1.0 Ti Ti11 1 0.50000000 0.49679000 0.39597700 1.0 Mn Mn12 1 0.50000000 0.50000000 0.00000000 1.0 Mn Mn13 1 0.50000000 0.52391600 0.81014800 1.0 Mn Mn14 1 0.00000000 0.64336100 0.08611800 1.0 Mn Mn15 1 0.00000000 0.64730800 0.30596900 1.0 Mn Mn16 1 0.00000000 0.85269200 0.80596900 1.0 Mn Mn17 1 0.00000000 0.85663900 0.58611800 1.0 Mn Mn18 1 0.50000000 0.97608400 0.31014800 1.0 Mn Mn19 1 0.50000000 0.00000000 0.50000000 1.0 Mn Mn20 1 0.50000000 0.02391600 0.68985200 1.0 Mn Mn21 1 0.00000000 0.14336100 0.41388200 1.0 Mn Mn22 1 0.00000000 0.14730800 0.19403100 1.0 Mn Mn23 1 0.00000000 0.35269200 0.69403100 1.0 Mn Mn24 1 0.00000000 0.35663900 0.91388200 1.0 Mn Mn25 1 0.50000000 0.47608400 0.18985200 1.0 O O26 1 0.50000000 0.49849400 0.92371100 1.0 O O27 1 0.50000000 0.50150600 0.07628900 1.0 O O28 1 0.00000000 0.55401000 0.44072800 1.0 O O29 1 0.00000000 0.54905300 0.66061900 1.0 O O30 1 0.00000000 0.60103200 0.16175700 1.0 O O31 1 0.50000000 0.60542600 0.25855600 1.0 O O32 1 0.00000000 0.66033700 0.00872200 1.0 O O33 1 0.00000000 0.64884200 0.78140600 1.0 O O34 1 0.50000000 0.68802400 0.35496300 1.0 O O35 1 0.50000000 0.71005800 0.58781300 1.0 O O36 1 0.50000000 0.78994200 0.08781300 1.0 O O37 1 0.50000000 0.81197600 0.85496300 1.0 O O38 1 0.00000000 0.85115800 0.28140600 1.0 O O39 1 0.00000000 0.83966300 0.50872200 1.0 O O40 1 0.50000000 0.89457400 0.75855600 1.0 O O41 1 0.00000000 0.89896800 0.66175700 1.0 O O42 1 0.00000000 0.95094700 0.16061900 1.0 O O43 1 0.00000000 0.94599000 0.94072800 1.0 O O44 1 0.50000000 0.99849400 0.57628900 1.0 O O45 1 0.50000000 0.00150600 0.42371100 1.0 O O46 1 0.00000000 0.05401000 0.05927200 1.0 O O47 1 0.00000000 0.04905300 0.83938100 1.0 O O48 1 0.00000000 0.10103200 0.33824300 1.0 O O49 1 0.50000000 0.10542600 0.24144400 1.0 O O50 1 0.00000000 0.16033700 0.49127800 1.0 O O51 1 0.00000000 0.14884200 0.71859400 1.0 O O52 1 0.50000000 0.18802400 0.14503700 1.0 O O53 1 0.50000000 0.21005800 0.91218700 1.0 O O54 1 0.50000000 0.28994200 0.41218700 1.0 O O55 1 0.50000000 0.31197600 0.64503700 1.0 O O56 1 0.00000000 0.35115800 0.21859400 1.0 O O57 1 0.00000000 0.33966300 0.99127800 1.0 O O58 1 0.50000000 0.39457400 0.74144400 1.0 O O59 1 0.00000000 0.39896800 0.83824300 1.0 O O60 1 0.00000000 0.45094700 0.33938100 1.0 O O61 1 0.00000000 0.44599000 0.55927200 1.0