# generated using pymatgen data_LiLuO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.30961506 _cell_length_b 5.83669663 _cell_length_c 4.30961506 _cell_angle_alpha 68.33478303 _cell_angle_beta 90.00000000 _cell_angle_gamma 111.66521697 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiLuO2 _chemical_formula_sum 'Li2 Lu2 O4' _cell_volume 92.45560133 _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 0.25000000 0.50000000 0.25000000 1.0 Li Li1 1 0.50000000 0.00000000 0.50000000 1.0 Lu Lu2 1 0.00000000 0.00000000 -0.00000000 1.0 Lu Lu3 1 0.75000000 0.50000000 0.75000000 1.0 O O4 1 0.77611870 0.55223740 0.22388130 1.0 O O5 1 0.22388130 0.44776260 0.77611870 1.0 O O6 1 0.52611870 0.05223740 0.97388130 1.0 O O7 1 0.97388130 0.94776260 0.52611870 1.0