# generated using pymatgen data_ThAlZn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.99471018 _cell_length_b 5.99471103 _cell_length_c 5.99471095 _cell_angle_alpha 138.38743138 _cell_angle_beta 138.38744396 _cell_angle_gamma 60.31013600 _symmetry_Int_Tables_number 1 _chemical_formula_structural ThAlZn3 _chemical_formula_sum 'Th1 Al1 Zn3' _cell_volume 94.01206281 _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 Th Th0 1 0.99905731 0.99905731 1.00000000 1.0 Al Al1 1 0.61743652 0.61743652 0.00000000 1.0 Zn Zn2 1 0.75189148 0.25189148 0.50000000 1.0 Zn Zn3 1 0.25189148 0.75189148 0.50000000 1.0 Zn Zn4 1 0.37972322 0.37972322 1.00000000 1.0