# generated using pymatgen data_Ti13Pb3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.79320552 _cell_length_b 5.99438966 _cell_length_c 10.29236692 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti13Pb3 _chemical_formula_sum 'Ti13 Pb3' _cell_volume 295.72380229 _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 Ti Ti0 1 0.50000000 0.50000000 0.33252633 1.0 Ti Ti1 1 0.50000000 -0.00000000 0.85049374 1.0 Ti Ti2 1 0.50000000 0.74090486 0.08717757 1.0 Ti Ti3 1 0.50000000 0.26083170 0.57678415 1.0 Ti Ti4 1 0.50000000 0.25909514 0.08717757 1.0 Ti Ti5 1 0.50000000 0.73916830 0.57678415 1.0 Ti Ti6 1 0.00000000 -0.00000000 0.15541456 1.0 Ti Ti7 1 -0.00000000 0.50000000 0.66192118 1.0 Ti Ti8 1 -0.00000000 0.73427858 0.40734213 1.0 Ti Ti9 1 0.00000000 0.25765171 0.92768147 1.0 Ti Ti10 1 -0.00000000 0.26572142 0.40734213 1.0 Ti Ti11 1 -0.00000000 0.74234829 0.92768147 1.0 Ti Ti12 1 -0.00000000 0.50000000 0.16906907 1.0 Pb Pb13 1 -0.00000000 -0.00000000 0.66801265 1.0 Pb Pb14 1 0.50000000 -0.00000000 0.33333348 1.0 Pb Pb15 1 0.50000000 0.50000000 0.83118835 1.0