# generated using pymatgen data_Dy3Hf(P3Ir4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.98543934 _cell_length_b 11.13978418 _cell_length_c 12.84019313 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Dy3Hf(P3Ir4)2 _chemical_formula_sum 'Dy6 Hf2 P12 Ir16' _cell_volume 570.06520869 _cell_formula_units_Z 2 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 Dy Dy0 1 0.00000000 0.50000000 0.52345390 1.0 Dy Dy1 1 0.50000000 0.00000000 0.47654610 1.0 Dy Dy2 1 0.50000000 0.82143108 0.20386490 1.0 Dy Dy3 1 0.50000000 0.17856892 0.20386490 1.0 Dy Dy4 1 0.00000000 0.67856892 0.79613510 1.0 Dy Dy5 1 0.00000000 0.32143108 0.79613510 1.0 Hf Hf6 1 0.50000000 0.50000000 0.15992353 1.0 Hf Hf7 1 0.00000000 0.00000000 0.84007647 1.0 P P8 1 0.50000000 0.50000000 0.87593816 1.0 P P9 1 0.00000000 0.00000000 0.12406184 1.0 P P10 1 0.50000000 0.50000000 0.36100185 1.0 P P11 1 0.00000000 0.00000000 0.63899815 1.0 P P12 1 0.50000000 0.31396323 0.61717360 1.0 P P13 1 0.50000000 0.68603677 0.61717360 1.0 P P14 1 0.00000000 0.18603677 0.38282640 1.0 P P15 1 0.00000000 0.81396323 0.38282640 1.0 P P16 1 0.50000000 0.84161278 0.88626131 1.0 P P17 1 0.50000000 0.15838722 0.88626131 1.0 P P18 1 0.00000000 0.65838722 0.11373869 1.0 P P19 1 0.00000000 0.34161278 0.11373869 1.0 Ir Ir20 1 0.50000000 0.50000000 0.69849806 1.0 Ir Ir21 1 0.00000000 0.00000000 0.30150194 1.0 Ir Ir22 1 0.00000000 0.50000000 0.99536601 1.0 Ir Ir23 1 0.50000000 0.00000000 0.00463399 1.0 Ir Ir24 1 0.50000000 0.33131182 0.98135255 1.0 Ir Ir25 1 0.50000000 0.66868818 0.98135255 1.0 Ir Ir26 1 0.00000000 0.16868818 0.01864745 1.0 Ir Ir27 1 0.00000000 0.83131182 0.01864745 1.0 Ir Ir28 1 0.50000000 0.29740546 0.43345597 1.0 Ir Ir29 1 0.50000000 0.70259454 0.43345597 1.0 Ir Ir30 1 0.00000000 0.20259454 0.56654403 1.0 Ir Ir31 1 0.00000000 0.79740546 0.56654403 1.0 Ir Ir32 1 0.50000000 0.87104289 0.70920791 1.0 Ir Ir33 1 0.50000000 0.12895711 0.70920791 1.0 Ir Ir34 1 0.00000000 0.62895711 0.29079209 1.0 Ir Ir35 1 0.00000000 0.37104289 0.29079209 1.0