# generated using pymatgen data_Li4Ti2Mn4Cr3O18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.92884800 _cell_length_b 9.02911700 _cell_length_c 25.23211300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Ti2Mn4Cr3O18 _chemical_formula_sum 'Li8 Ti4 Mn8 Cr6 O36' _cell_volume 667.26098937 _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 0.18026700 0.00064100 1.0 Li Li1 1 0.00000000 0.19765100 0.20298000 1.0 Li Li2 1 0.00000000 0.30234900 0.70298000 1.0 Li Li3 1 0.00000000 0.31973300 0.50064100 1.0 Li Li4 1 0.00000000 0.68026700 0.49935900 1.0 Li Li5 1 0.00000000 0.69765100 0.29702000 1.0 Li Li6 1 0.00000000 0.80234900 0.79702000 1.0 Li Li7 1 0.00000000 0.81973300 0.99935900 1.0 Ti Ti8 1 0.00000000 0.00040900 0.10676700 1.0 Ti Ti9 1 0.00000000 0.49959100 0.60676700 1.0 Ti Ti10 1 0.00000000 0.50040900 0.39323300 1.0 Ti Ti11 1 0.00000000 0.99959100 0.89323300 1.0 Mn Mn12 1 0.00000000 0.02178000 0.30995900 1.0 Mn Mn13 1 0.50000000 0.13797200 0.58756100 1.0 Mn Mn14 1 0.50000000 0.36202800 0.08756100 1.0 Mn Mn15 1 0.00000000 0.47822000 0.80995900 1.0 Mn Mn16 1 0.00000000 0.52178000 0.19004100 1.0 Mn Mn17 1 0.50000000 0.63797200 0.91243900 1.0 Mn Mn18 1 0.50000000 0.86202800 0.41243900 1.0 Mn Mn19 1 0.00000000 0.97822000 0.69004100 1.0 Cr Cr20 1 0.00000000 0.00000000 0.50000000 1.0 Cr Cr21 1 0.50000000 0.14361100 0.80434900 1.0 Cr Cr22 1 0.50000000 0.35638900 0.30434900 1.0 Cr Cr23 1 0.00000000 0.50000000 0.00000000 1.0 Cr Cr24 1 0.50000000 0.64361100 0.69565100 1.0 Cr Cr25 1 0.50000000 0.85638900 0.19565100 1.0 O O26 1 0.00000000 0.00099700 0.42091000 1.0 O O27 1 0.00000000 0.99900300 0.57909000 1.0 O O28 1 0.50000000 0.03440500 0.94092500 1.0 O O29 1 0.50000000 0.05642700 0.16166700 1.0 O O30 1 0.50000000 0.10302400 0.66230600 1.0 O O31 1 0.00000000 0.11591200 0.75523800 1.0 O O32 1 0.50000000 0.15188300 0.50970800 1.0 O O33 1 0.50000000 0.14171900 0.28311900 1.0 O O34 1 0.00000000 0.18170700 0.85683600 1.0 O O35 1 0.00000000 0.22206700 0.08889100 1.0 O O36 1 0.00000000 0.27793300 0.58889100 1.0 O O37 1 0.00000000 0.31829300 0.35683600 1.0 O O38 1 0.50000000 0.35828100 0.78311900 1.0 O O39 1 0.50000000 0.34811700 0.00970800 1.0 O O40 1 0.00000000 0.38408800 0.25523800 1.0 O O41 1 0.50000000 0.39697600 0.16230600 1.0 O O42 1 0.50000000 0.44357300 0.66166700 1.0 O O43 1 0.50000000 0.46559500 0.44092500 1.0 O O44 1 0.00000000 0.50099700 0.07909000 1.0 O O45 1 0.00000000 0.49900300 0.92091000 1.0 O O46 1 0.50000000 0.53440500 0.55907500 1.0 O O47 1 0.50000000 0.55642700 0.33833300 1.0 O O48 1 0.50000000 0.60302400 0.83769400 1.0 O O49 1 0.00000000 0.61591200 0.74476200 1.0 O O50 1 0.50000000 0.65188300 0.99029200 1.0 O O51 1 0.50000000 0.64171900 0.21688100 1.0 O O52 1 0.00000000 0.68170700 0.64316400 1.0 O O53 1 0.00000000 0.72206700 0.41110900 1.0 O O54 1 0.00000000 0.77793300 0.91110900 1.0 O O55 1 0.00000000 0.81829300 0.14316400 1.0 O O56 1 0.50000000 0.85828100 0.71688100 1.0 O O57 1 0.50000000 0.84811700 0.49029200 1.0 O O58 1 0.00000000 0.88408800 0.24476200 1.0 O O59 1 0.50000000 0.89697600 0.33769400 1.0 O O60 1 0.50000000 0.94357300 0.83833300 1.0 O O61 1 0.50000000 0.96559500 0.05907500 1.0