# generated using pymatgen data_Th2Al2ZnCu7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.16307184 _cell_length_b 5.18046562 _cell_length_c 8.87090319 _cell_angle_alpha 89.24413351 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th2Al2ZnCu7 _chemical_formula_sum 'Th2 Al2 Zn1 Cu7' _cell_volume 191.29902085 _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 0.00000000 0.24787373 0.74822354 1.0 Th Th1 1 0.00000000 0.75212627 0.25177646 1.0 Al Al2 1 0.50000000 0.74190012 0.74569606 1.0 Al Al3 1 0.50000000 0.25809988 0.25430394 1.0 Zn Zn4 1 0.50000000 0.00000000 0.00000000 1.0 Cu Cu5 1 0.00000000 0.25683639 0.08471705 1.0 Cu Cu6 1 0.00000000 0.75047003 0.58207220 1.0 Cu Cu7 1 0.00000000 0.74316361 0.91528295 1.0 Cu Cu8 1 0.00000000 0.24952997 0.41792780 1.0 Cu Cu9 1 0.50000000 0.50000000 0.50000000 1.0 Cu Cu10 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu11 1 0.50000000 0.00000000 0.50000000 1.0