# generated using pymatgen data_Li4Ti4Cr4NiO18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.26891700 _cell_length_b 24.17762700 _cell_length_c 2.93211400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Ti4Cr4NiO18 _chemical_formula_sum 'Li8 Ti8 Cr8 Ni2 O36' _cell_volume 657.08797279 _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 0.20106400 0.98942800 0.00000000 1.0 Li Li1 1 0.16801000 0.19138600 0.00000000 1.0 Li Li2 1 0.33199000 0.69138600 0.00000000 1.0 Li Li3 1 0.29893600 0.48942800 0.00000000 1.0 Li Li4 1 0.70106400 0.51057200 0.00000000 1.0 Li Li5 1 0.66801000 0.30861400 0.00000000 1.0 Li Li6 1 0.83199000 0.80861400 0.00000000 1.0 Li Li7 1 0.79893600 0.01057200 0.00000000 1.0 Ti Ti8 1 0.98180500 0.09839800 0.00000000 1.0 Ti Ti9 1 0.18982800 0.80914800 0.50000000 1.0 Ti Ti10 1 0.31017200 0.30914800 0.50000000 1.0 Ti Ti11 1 0.51819500 0.59839800 0.00000000 1.0 Ti Ti12 1 0.48180500 0.40160200 0.00000000 1.0 Ti Ti13 1 0.68982800 0.69085200 0.50000000 1.0 Ti Ti14 1 0.81017200 0.19085200 0.50000000 1.0 Ti Ti15 1 0.01819500 0.90160200 0.00000000 1.0 Cr Cr16 1 0.96547700 0.31670500 0.00000000 1.0 Cr Cr17 1 0.17006900 0.58630600 0.50000000 1.0 Cr Cr18 1 0.32993100 0.08630600 0.50000000 1.0 Cr Cr19 1 0.53452300 0.81670500 0.00000000 1.0 Cr Cr20 1 0.46547700 0.18329500 0.00000000 1.0 Cr Cr21 1 0.67006900 0.91369400 0.50000000 1.0 Cr Cr22 1 0.82993100 0.41369400 0.50000000 1.0 Cr Cr23 1 0.03452300 0.68329500 0.00000000 1.0 Ni Ni24 1 0.00000000 0.50000000 0.00000000 1.0 Ni Ni25 1 0.50000000 0.00000000 0.00000000 1.0 O O26 1 0.96867200 0.40550800 0.00000000 1.0 O O27 1 0.03132800 0.59449200 0.00000000 1.0 O O28 1 0.07802600 0.94761500 0.50000000 1.0 O O29 1 0.02151900 0.15567100 0.50000000 1.0 O O30 1 0.17487400 0.66622700 0.50000000 1.0 O O31 1 0.13514300 0.75828200 0.00000000 1.0 O O32 1 0.13436100 0.50391600 0.50000000 1.0 O O33 1 0.10559400 0.29760900 0.50000000 1.0 O O34 1 0.20677200 0.86199200 0.00000000 1.0 O O35 1 0.18529400 0.07621100 0.00000000 1.0 O O36 1 0.31470600 0.57621100 0.00000000 1.0 O O37 1 0.29322800 0.36199200 0.00000000 1.0 O O38 1 0.39440600 0.79760900 0.50000000 1.0 O O39 1 0.36563900 0.00391600 0.50000000 1.0 O O40 1 0.36485700 0.25828200 0.00000000 1.0 O O41 1 0.32512600 0.16622700 0.50000000 1.0 O O42 1 0.47848100 0.65567100 0.50000000 1.0 O O43 1 0.42197400 0.44761500 0.50000000 1.0 O O44 1 0.46867200 0.09449200 0.00000000 1.0 O O45 1 0.53132800 0.90550800 0.00000000 1.0 O O46 1 0.57802600 0.55238500 0.50000000 1.0 O O47 1 0.52151900 0.34432900 0.50000000 1.0 O O48 1 0.67487500 0.83377300 0.50000000 1.0 O O49 1 0.63514300 0.74171800 0.00000000 1.0 O O50 1 0.63436100 0.99608400 0.50000000 1.0 O O51 1 0.60559400 0.20239100 0.50000000 1.0 O O52 1 0.70677200 0.63800800 0.00000000 1.0 O O53 1 0.68529400 0.42378900 0.00000000 1.0 O O54 1 0.81470600 0.92378900 0.00000000 1.0 O O55 1 0.79322800 0.13800800 0.00000000 1.0 O O56 1 0.89440600 0.70239100 0.50000000 1.0 O O57 1 0.86563900 0.49608400 0.50000000 1.0 O O58 1 0.86485700 0.24171800 0.00000000 1.0 O O59 1 0.82512500 0.33377300 0.50000000 1.0 O O60 1 0.97848100 0.84432900 0.50000000 1.0 O O61 1 0.92197400 0.05238500 0.50000000 1.0