# generated using pymatgen data_Y3Zr2Pb3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.91724572 _cell_length_b 8.91724484 _cell_length_c 6.21323047 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000936 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y3Zr2Pb3 _chemical_formula_sum 'Y6 Zr4 Pb6' _cell_volume 427.86767715 _cell_formula_units_Z 2 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 Y Y0 1 0.75702762 0.75702753 0.25000000 1.0 Y Y1 1 0.00000010 0.24297234 0.25000000 1.0 Y Y2 1 0.75702763 0.99999993 0.75000000 1.0 Y Y3 1 0.24297237 0.00000007 0.25000000 1.0 Y Y4 1 0.99999990 0.75702766 0.75000000 1.0 Y Y5 1 0.24297238 0.24297247 0.75000000 1.0 Zr Zr6 1 0.33333321 0.66666655 0.49999999 1.0 Zr Zr7 1 0.66666679 0.33333345 0.50000001 1.0 Zr Zr8 1 0.33333321 0.66666655 0.00000001 1.0 Zr Zr9 1 0.66666679 0.33333345 0.99999999 1.0 Pb Pb10 1 0.60302577 0.60302568 0.75000000 1.0 Pb Pb11 1 0.39697397 0.00000004 0.75000000 1.0 Pb Pb12 1 0.60302603 0.99999996 0.25000000 1.0 Pb Pb13 1 0.00000017 0.39697438 0.75000000 1.0 Pb Pb14 1 0.39697423 0.39697432 0.25000000 1.0 Pb Pb15 1 0.99999983 0.60302562 0.25000000 1.0