# generated using pymatgen data_Zr6Ti6Sn9Sb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.52570928 _cell_length_b 9.57671703 _cell_length_c 5.79648850 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.82397258 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Ti6Sn9Sb _chemical_formula_sum 'Zr6 Ti6 Sn9 Sb1' _cell_volume 458.75118309 _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 Zr Zr0 1 0.84413230 0.68826460 0.75000000 1.0 Zr Zr1 1 0.15407841 0.84485322 0.25000000 1.0 Zr Zr2 1 0.69077481 0.84485322 0.25000000 1.0 Zr Zr3 1 0.30602567 0.15685935 0.75000000 1.0 Zr Zr4 1 0.85083369 0.15685935 0.75000000 1.0 Zr Zr5 1 0.15368164 0.30736229 0.25000000 1.0 Ti Ti6 1 0.49988940 0.99977880 0.49913212 1.0 Ti Ti7 1 0.49868901 0.50050989 0.99938161 1.0 Ti Ti8 1 0.00182088 0.50050989 0.99938161 1.0 Ti Ti9 1 0.00182088 0.50050989 0.50061839 1.0 Ti Ti10 1 0.49988940 0.99977880 0.00086788 1.0 Ti Ti11 1 0.49868901 0.50050989 0.50061839 1.0 Sn Sn12 1 0.78941507 0.21174213 0.25000000 1.0 Sn Sn13 1 0.42232706 0.21174213 0.25000000 1.0 Sn Sn14 1 0.58154289 0.79296939 0.75000000 1.0 Sn Sn15 1 0.21142850 0.79296939 0.75000000 1.0 Sn Sn16 1 0.78754488 0.57508975 0.25000000 1.0 Sn Sn17 1 0.66586748 0.33173297 0.75000000 1.0 Sn Sn18 1 0.33448710 0.66897521 0.25000000 1.0 Sn Sn19 1 0.99819552 0.99639203 0.49939683 1.0 Sn Sn20 1 0.99819552 0.99639203 0.00060317 1.0 Sb Sb21 1 0.21067189 0.42134378 0.75000000 1.0