# generated using pymatgen data_Lu3Sc7(CuPb3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.76720884 _cell_length_b 8.76720909 _cell_length_c 6.29066068 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999165 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu3Sc7(CuPb3)2 _chemical_formula_sum 'Lu3 Sc7 Cu2 Pb6' _cell_volume 418.74500917 _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 0.76011842 0.76011842 0.25000000 1.0 Lu Lu1 1 0.23988158 0.00000000 0.25000000 1.0 Lu Lu2 1 0.00000000 0.23988158 0.25000000 1.0 Sc Sc3 1 0.66666700 0.33333300 0.50211753 1.0 Sc Sc4 1 0.33333300 0.66666700 0.50211753 1.0 Sc Sc5 1 0.33333300 0.66666700 0.99788247 1.0 Sc Sc6 1 0.66666700 0.33333300 0.99788247 1.0 Sc Sc7 1 0.26892008 0.26892008 0.75000000 1.0 Sc Sc8 1 0.73107992 1.00000000 0.75000000 1.0 Sc Sc9 1 1.00000000 0.73107992 0.75000000 1.0 Cu Cu10 1 0.00000000 0.00000000 0.55264625 1.0 Cu Cu11 1 0.00000000 0.00000000 0.94735375 1.0 Pb Pb12 1 0.39749372 0.39749372 0.25000000 1.0 Pb Pb13 1 0.60250628 1.00000000 0.25000000 1.0 Pb Pb14 1 1.00000000 0.60250628 0.25000000 1.0 Pb Pb15 1 0.61893811 0.61893811 0.75000000 1.0 Pb Pb16 1 0.38106189 0.00000000 0.75000000 1.0 Pb Pb17 1 0.00000000 0.38106189 0.75000000 1.0