# generated using pymatgen data_Li4Cr3NiO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.91734778 _cell_length_b 5.92495236 _cell_length_c 10.24005139 _cell_angle_alpha 72.86345361 _cell_angle_beta 90.15872397 _cell_angle_gamma 120.44875256 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4Cr3NiO8 _chemical_formula_sum 'Li8 Cr6 Ni2 O16' _cell_volume 291.04411910 _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 0.74870800 0.49684400 0.75125200 1.0 Li Li1 1 0.25132300 0.50312000 0.24875800 1.0 Li Li2 1 0.00010300 0.49991500 0.00004000 1.0 Li Li3 1 0.49990800 0.49995300 0.50002100 1.0 Li Li4 1 0.25559400 0.00538100 0.74519700 1.0 Li Li5 1 0.74418100 0.99439900 0.25492000 1.0 Li Li6 1 0.50012400 0.99978000 0.00006300 1.0 Li Li7 1 0.99987200 0.00004100 0.50001700 1.0 Cr Cr8 1 0.99991700 0.49999000 0.50004600 1.0 Cr Cr9 1 0.25452200 0.50223600 0.75071300 1.0 Cr Cr10 1 0.74551400 0.49786100 0.24924300 1.0 Cr Cr11 1 0.75151800 0.00364100 0.74872500 1.0 Cr Cr12 1 0.24856500 0.99675700 0.25122900 1.0 Cr Cr13 1 0.50037300 0.50007000 0.99986200 1.0 Ni Ni14 1 0.49959900 0.99988700 0.49998100 1.0 Ni Ni15 1 0.00039400 0.00030900 0.99992900 1.0 O O16 1 0.11854300 0.25990300 0.62913900 1.0 O O17 1 0.61309200 0.25780500 0.12633100 1.0 O O18 1 0.38698000 0.74199700 0.87367800 1.0 O O19 1 0.88126700 0.74015300 0.37082900 1.0 O O20 1 0.37835900 0.27169600 0.88085200 1.0 O O21 1 0.85548200 0.25479300 0.38037400 1.0 O O22 1 0.62056400 0.76117600 0.63107200 1.0 O O23 1 0.11166500 0.75476500 0.13129000 1.0 O O24 1 0.84649600 0.74408800 0.87950700 1.0 O O25 1 0.35872100 0.75351100 0.37400600 1.0 O O26 1 0.62205500 0.72838500 0.11897800 1.0 O O27 1 0.14406200 0.74501800 0.61978900 1.0 O O28 1 0.37923900 0.23885900 0.36891600 1.0 O O29 1 0.88846500 0.24518000 0.86874700 1.0 O O30 1 0.15385900 0.25614300 0.12042900 1.0 O O31 1 0.64093300 0.24635100 0.62606700 1.0