# generated using pymatgen data_LiNi4O5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.10153091 _cell_length_b 5.10153091 _cell_length_c 5.10153091 _cell_angle_alpha 99.59762802 _cell_angle_beta 99.59762802 _cell_angle_gamma 131.80089730 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNi4O5 _chemical_formula_sum 'Li1 Ni4 O5' _cell_volume 90.34883671 _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 0.00000000 0.00000000 0.00000000 1.0 Ni Ni1 1 0.39884900 0.79649200 0.19534100 1.0 Ni Ni2 1 0.79649200 0.60115100 0.39764300 1.0 Ni Ni3 1 0.20350800 0.39884900 0.60235700 1.0 Ni Ni4 1 0.60115100 0.20350800 0.80465900 1.0 O O5 1 0.30903800 0.10286100 0.41189900 1.0 O O6 1 0.69096200 0.89713900 0.58810100 1.0 O O7 1 0.10286100 0.69096200 0.79382300 1.0 O O8 1 0.50000000 0.50000000 0.00000000 1.0 O O9 1 0.89713900 0.30903800 0.20617700 1.0