# generated using pymatgen data_Li7Ni5O12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.77097100 _cell_length_b 6.36874612 _cell_length_c 6.46624876 _cell_angle_alpha 96.58075900 _cell_angle_beta 116.44261766 _cell_angle_gamma 103.05752710 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li7Ni5O12 _chemical_formula_sum 'Li7 Ni5 O12' _cell_volume 200.88473393 _cell_formula_units_Z 1 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 0.24828500 0.66955900 0.16465900 1.0 Li Li1 1 0.00000000 0.00000000 0.00000000 1.0 Li Li2 1 0.74678000 0.99794700 0.49675200 1.0 Li Li3 1 0.75256900 0.67282200 0.16433700 1.0 Li Li4 1 0.75171500 0.33044100 0.83534100 1.0 Li Li5 1 0.25322000 0.00205300 0.50324800 1.0 Li Li6 1 0.24743100 0.32717800 0.83566300 1.0 Ni Ni7 1 0.00045600 0.66790700 0.66938100 1.0 Ni Ni8 1 0.50359600 0.66654100 0.67075300 1.0 Ni Ni9 1 0.50000000 0.00000000 0.00000000 1.0 Ni Ni10 1 0.49640400 0.33345900 0.32924700 1.0 Ni Ni11 1 0.99954400 0.33209300 0.33061900 1.0 O O12 1 0.86155800 0.66289300 0.88719500 1.0 O O13 1 0.39180700 0.01934700 0.23942400 1.0 O O14 1 0.60819300 0.98065300 0.76057600 1.0 O O15 1 0.37952300 0.68733400 0.91881500 1.0 O O16 1 0.85612500 0.01794800 0.23860000 1.0 O O17 1 0.86920500 0.34796100 0.56178600 1.0 O O18 1 0.14387500 0.98205200 0.76140000 1.0 O O19 1 0.13844200 0.33710700 0.11280500 1.0 O O20 1 0.37464400 0.34971500 0.57952700 1.0 O O21 1 0.62535600 0.65028500 0.42047300 1.0 O O22 1 0.62047700 0.31266600 0.08118500 1.0 O O23 1 0.13079500 0.65203900 0.43821400 1.0