# generated using pymatgen data_ScAlCo2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.18923867 _cell_length_b 4.18922850 _cell_length_c 4.18917034 _cell_angle_alpha 60.00463842 _cell_angle_beta 60.00473680 _cell_angle_gamma 60.00255711 _symmetry_Int_Tables_number 1 _chemical_formula_structural ScAlCo2 _chemical_formula_sum 'Sc1 Al1 Co2' _cell_volume 51.99018187 _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 Sc Sc0 1 0.74999810 0.75000496 0.75000456 1.0 Al Al1 1 0.24998796 0.25000381 0.25000457 1.0 Co Co2 1 0.50001543 0.50000765 0.50000206 1.0 Co Co3 1 -0.00000049 0.99998357 0.99998981 1.0