# generated using pymatgen data_LiZrCu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.97737091 _cell_length_b 8.97737091 _cell_length_c 8.97737091 _cell_angle_alpha 121.48526893 _cell_angle_beta 110.40707856 _cell_angle_gamma 97.41370689 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiZrCu2 _chemical_formula_sum 'Li1 Zr1 Cu2' _cell_volume 532.65377161 _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 Zr Zr1 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu2 1 0.24712300 0.00000000 0.24712300 1.0 Cu Cu3 1 0.75287700 0.00000000 0.75287700 1.0