# generated using pymatgen data_Zr4Ta4AlP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.56637923 _cell_length_b 6.98094571 _cell_length_c 8.43809274 _cell_angle_alpha 89.37292568 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr4Ta4AlP3 _chemical_formula_sum 'Zr4 Ta4 Al1 P3' _cell_volume 210.06807998 _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 0.25000000 0.03704075 0.67125595 1.0 Zr Zr1 1 0.25000000 0.53500608 0.82834105 1.0 Zr Zr2 1 0.75000000 0.46970113 0.16092167 1.0 Zr Zr3 1 0.75000000 0.95384001 0.32977350 1.0 Ta Ta4 1 0.75000000 0.85684978 0.93935825 1.0 Ta Ta5 1 0.25000000 0.64137659 0.44263961 1.0 Ta Ta6 1 0.75000000 0.37232786 0.56915558 1.0 Ta Ta7 1 0.25000000 0.13181581 0.05356721 1.0 Al Al8 1 0.25000000 0.25869063 0.35902520 1.0 P P9 1 0.25000000 0.76295911 0.14436182 1.0 P P10 1 0.75000000 0.74426021 0.64248490 1.0 P P11 1 0.75000000 0.23613303 0.85911427 1.0