# generated using pymatgen data_LiNiO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.70241441 _cell_length_b 5.70241441 _cell_length_c 5.78667195 _cell_angle_alpha 59.77487557 _cell_angle_beta 59.77487557 _cell_angle_gamma 60.38805555 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNiO2 _chemical_formula_sum 'Li4 Ni4 O8' _cell_volume 132.98231577 _cell_formula_units_Z 4 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 0.50000000 0.50000000 -0.00000000 1.0 Li Li1 1 0.50000000 0.50000000 0.50000000 1.0 Li Li2 1 0.50000000 0.00000000 -0.00000000 1.0 Li Li3 1 0.00000000 0.50000000 -0.00000000 1.0 Ni Ni4 1 0.00000000 0.00000000 -0.00000000 1.0 Ni Ni5 1 0.50000000 0.00000000 0.50000000 1.0 Ni Ni6 1 0.00000000 0.50000000 0.50000000 1.0 Ni Ni7 1 0.00000000 0.00000000 0.50000000 1.0 O O8 1 0.76397703 0.76397703 0.74597940 1.0 O O9 1 0.78134307 0.24313062 0.72177224 1.0 O O10 1 0.75033110 0.75033110 0.28843123 1.0 O O11 1 0.75686938 0.21865693 0.27822776 1.0 O O12 1 0.24313062 0.78134307 0.72177224 1.0 O O13 1 0.24966890 0.24966890 0.71156877 1.0 O O14 1 0.21865693 0.75686938 0.27822776 1.0 O O15 1 0.23602297 0.23602297 0.25402060 1.0