# generated using pymatgen data_LuZr3(AlRe3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.27489637 _cell_length_b 5.27489687 _cell_length_c 8.65962029 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999067 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuZr3(AlRe3)2 _chemical_formula_sum 'Lu1 Zr3 Al2 Re6' _cell_volume 208.66875599 _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 Lu Lu0 1 0.33333300 0.66666700 0.43511334 1.0 Zr Zr1 1 0.66666700 0.33333300 0.93403868 1.0 Zr Zr2 1 0.66666700 0.33333300 0.56683958 1.0 Zr Zr3 1 0.33333300 0.66666700 0.06650811 1.0 Al Al4 1 0.00000000 0.00000000 0.99923949 1.0 Al Al5 1 0.00000000 0.00000000 0.49954753 1.0 Re Re6 1 0.17031236 0.34062372 0.75153503 1.0 Re Re7 1 0.82979544 0.17020456 0.24803606 1.0 Re Re8 1 0.34040813 0.17020456 0.24803606 1.0 Re Re9 1 0.65937628 0.82968764 0.75153503 1.0 Re Re10 1 0.82979544 0.65959187 0.24803606 1.0 Re Re11 1 0.17031236 0.82968764 0.75153503 1.0