# generated using pymatgen data_ZrScZn2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.30959221 _cell_length_b 11.30959221 _cell_length_c 11.30959221 _cell_angle_alpha 120.29704546 _cell_angle_beta 119.89171425 _cell_angle_gamma 89.83696634 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrScZn2 _chemical_formula_sum 'Zr1 Sc1 Zn2' _cell_volume 1021.40300835 _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 Zr Zr0 1 0.00000000 0.50000000 0.50000000 1.0 Sc Sc1 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn2 1 0.00000000 0.25016200 0.25016200 1.0 Zn Zn3 1 0.00000000 0.74983800 0.74983800 1.0