# generated using pymatgen data_Pa2TiZnPd12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.64524893 _cell_length_b 5.64524985 _cell_length_c 9.34020469 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999459 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pa2TiZnPd12 _chemical_formula_sum 'Pa2 Ti1 Zn1 Pd12' _cell_volume 257.78243064 _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 Pa Pa0 1 0.33333300 0.66666700 0.25487756 1.0 Pa Pa1 1 0.66666700 0.33333300 0.74512244 1.0 Ti Ti2 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn3 1 0.00000000 0.00000000 0.50000000 1.0 Pd Pd4 1 0.50000000 0.50000000 0.50000000 1.0 Pd Pd5 1 0.50000000 0.00000000 0.50000000 1.0 Pd Pd6 1 0.00000000 0.50000000 0.50000000 1.0 Pd Pd7 1 0.50000000 0.50000000 0.00000000 1.0 Pd Pd8 1 0.50000000 0.00000000 0.00000000 1.0 Pd Pd9 1 0.00000000 0.50000000 0.00000000 1.0 Pd Pd10 1 0.83366586 0.66733272 0.24636806 1.0 Pd Pd11 1 0.33266728 0.16633414 0.24636806 1.0 Pd Pd12 1 0.83366586 0.16633414 0.24636806 1.0 Pd Pd13 1 0.16633414 0.33266728 0.75363194 1.0 Pd Pd14 1 0.66733272 0.83366586 0.75363194 1.0 Pd Pd15 1 0.16633414 0.83366586 0.75363194 1.0