# generated using pymatgen data_AlPPd4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.41298970 _cell_length_b 6.63204728 _cell_length_c 11.42197644 _cell_angle_alpha 89.93789103 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural AlPPd4 _chemical_formula_sum 'Al3 P3 Pd12' _cell_volume 258.53753068 _cell_formula_units_Z 3 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 Al Al0 1 -0.00000000 0.50138434 0.16679039 1.0 Al Al1 1 -0.00000000 0.49991086 0.83468793 1.0 Al Al2 1 -0.00000000 0.00009683 0.33190164 1.0 P P3 1 0.50000000 0.00234393 -0.00035111 1.0 P P4 1 0.50000000 0.49518721 0.49977013 1.0 P P5 1 -0.00000000 0.99511176 0.66593067 1.0 Pd Pd6 1 -0.00000000 0.74555622 0.99902555 1.0 Pd Pd7 1 -0.00000000 0.23411460 0.50718966 1.0 Pd Pd8 1 0.00000000 0.63746227 0.62928675 1.0 Pd Pd9 1 -0.00000000 0.12964393 0.12649492 1.0 Pd Pd10 1 -0.00000000 0.12286346 0.86195128 1.0 Pd Pd11 1 -0.00000000 0.62844082 0.37458286 1.0 Pd Pd12 1 0.50000000 0.89847314 0.50373120 1.0 Pd Pd13 1 0.50000000 0.39297786 0.99723023 1.0 Pd Pd14 1 0.50000000 0.80263315 0.79966367 1.0 Pd Pd15 1 0.50000000 0.30189268 0.30437346 1.0 Pd Pd16 1 0.50000000 0.30983216 0.69830763 1.0 Pd Pd17 1 0.50000000 0.80227277 0.19943613 1.0