# generated using pymatgen data_Li4Ti4Fe4CoO18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.92701700 _cell_length_b 9.11561700 _cell_length_c 24.75607300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Ti4Fe4CoO18 _chemical_formula_sum 'Li8 Ti8 Fe8 Co2 O36' _cell_volume 660.53079378 _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 0.20500800 0.98654800 1.0 Li Li1 1 0.00000000 0.19946700 0.18929400 1.0 Li Li2 1 0.00000000 0.30053300 0.68929400 1.0 Li Li3 1 0.00000000 0.29499200 0.48654800 1.0 Li Li4 1 0.00000000 0.70500800 0.51345200 1.0 Li Li5 1 0.00000000 0.69946700 0.31070600 1.0 Li Li6 1 0.00000000 0.80053300 0.81070600 1.0 Li Li7 1 0.00000000 0.79499200 0.01345200 1.0 Ti Ti8 1 0.00000000 0.00250000 0.09917600 1.0 Ti Ti9 1 0.50000000 0.15481500 0.80731000 1.0 Ti Ti10 1 0.50000000 0.34518500 0.30731000 1.0 Ti Ti11 1 0.00000000 0.49750000 0.59917600 1.0 Ti Ti12 1 0.00000000 0.50250000 0.40082400 1.0 Ti Ti13 1 0.50000000 0.65481500 0.69269000 1.0 Ti Ti14 1 0.50000000 0.84518500 0.19269000 1.0 Ti Ti15 1 0.00000000 0.99750000 0.90082400 1.0 Fe Fe16 1 0.00000000 0.00524500 0.31323300 1.0 Fe Fe17 1 0.50000000 0.14221200 0.58345100 1.0 Fe Fe18 1 0.50000000 0.35778800 0.08345100 1.0 Fe Fe19 1 0.00000000 0.49475500 0.81323300 1.0 Fe Fe20 1 0.00000000 0.50524500 0.18676700 1.0 Fe Fe21 1 0.50000000 0.64221200 0.91654900 1.0 Fe Fe22 1 0.50000000 0.85778800 0.41654900 1.0 Fe Fe23 1 0.00000000 0.99475500 0.68676700 1.0 Co Co24 1 0.00000000 0.00000000 0.50000000 1.0 Co Co25 1 0.00000000 0.50000000 0.00000000 1.0 O O26 1 0.00000000 0.00070500 0.42319000 1.0 O O27 1 0.00000000 0.99929500 0.57681000 1.0 O O28 1 0.50000000 0.06166100 0.94450900 1.0 O O29 1 0.50000000 0.04645000 0.15793500 1.0 O O30 1 0.50000000 0.12119400 0.66088600 1.0 O O31 1 0.00000000 0.11656000 0.75672900 1.0 O O32 1 0.50000000 0.14000100 0.50564300 1.0 O O33 1 0.50000000 0.13264500 0.29231400 1.0 O O34 1 0.00000000 0.18605500 0.85873700 1.0 O O35 1 0.00000000 0.20534000 0.08154900 1.0 O O36 1 0.00000000 0.29466000 0.58154900 1.0 O O37 1 0.00000000 0.31394500 0.35873700 1.0 O O38 1 0.50000000 0.36735500 0.79231400 1.0 O O39 1 0.50000000 0.35999900 0.00564300 1.0 O O40 1 0.00000000 0.38344000 0.25672900 1.0 O O41 1 0.50000000 0.37880600 0.16088600 1.0 O O42 1 0.50000000 0.45355000 0.65793500 1.0 O O43 1 0.50000000 0.43833900 0.44450900 1.0 O O44 1 0.00000000 0.50070500 0.07681000 1.0 O O45 1 0.00000000 0.49929500 0.92319000 1.0 O O46 1 0.50000000 0.56166100 0.55549100 1.0 O O47 1 0.50000000 0.54645000 0.34206500 1.0 O O48 1 0.50000000 0.62119400 0.83911400 1.0 O O49 1 0.00000000 0.61656000 0.74327100 1.0 O O50 1 0.50000000 0.64000100 0.99435700 1.0 O O51 1 0.50000000 0.63264500 0.20768600 1.0 O O52 1 0.00000000 0.68605500 0.64126300 1.0 O O53 1 0.00000000 0.70534000 0.41845100 1.0 O O54 1 0.00000000 0.79466000 0.91845100 1.0 O O55 1 0.00000000 0.81394500 0.14126300 1.0 O O56 1 0.50000000 0.86735500 0.70768600 1.0 O O57 1 0.50000000 0.85999900 0.49435700 1.0 O O58 1 0.00000000 0.88344000 0.24327100 1.0 O O59 1 0.50000000 0.87880600 0.33911400 1.0 O O60 1 0.50000000 0.95355000 0.84206500 1.0 O O61 1 0.50000000 0.93833900 0.05549100 1.0