# generated using pymatgen data_Li4As6Ir3Pd4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.99215726 _cell_length_b 6.97647401 _cell_length_c 6.97647457 _cell_angle_alpha 108.87790399 _cell_angle_beta 109.72251404 _cell_angle_gamma 109.72250732 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li4As6Ir3Pd4 _chemical_formula_sum 'Li4 As6 Ir3 Pd4' _cell_volume 262.25460416 _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 Li Li0 1 1.00000000 0.99726834 0.49982420 1.0 Li Li1 1 0.50000000 0.00149217 0.99850783 1.0 Li Li2 1 1.00000000 0.50017580 0.00273166 1.0 Li Li3 1 0.50000000 0.50149217 0.49850783 1.0 As As4 1 0.69488927 0.68957621 0.00531406 1.0 As As5 1 0.31372834 0.30939944 0.00432790 1.0 As As6 1 1.00000000 0.69509160 0.68248819 1.0 As As7 1 1.00000000 0.31751181 0.30490840 1.0 As As8 1 0.68627166 0.99567210 0.69060056 1.0 As As9 1 0.30511073 0.99468594 0.31042379 1.0 Ir Ir10 1 1.00000000 0.99988755 0.00011245 1.0 Ir Ir11 1 0.74847568 0.49961110 0.24886458 1.0 Ir Ir12 1 0.25152432 0.75113542 0.50038890 1.0 Pd Pd13 1 0.25078527 0.50007789 0.75070737 1.0 Pd Pd14 1 0.74921473 0.24929263 0.49992211 1.0 Pd Pd15 1 0.50000000 0.24881492 0.75118508 1.0 Pd Pd16 1 0.50000000 0.74881492 0.25118508 1.0