# generated using pymatgen data_Dy5Nb3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.69792479 _cell_length_b 12.69792539 _cell_length_c 3.97393886 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000101 _symmetry_Int_Tables_number 1 _chemical_formula_structural Dy5Nb3(P3Ir4)4 _chemical_formula_sum 'Dy5 Nb3 P12 Ir16' _cell_volume 554.90332760 _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 Dy Dy0 1 0.33333300 0.66666700 0.50000000 1.0 Dy Dy1 1 0.66666700 0.33333300 0.50000000 1.0 Dy Dy2 1 1.00000000 0.81429909 0.00000000 1.0 Dy Dy3 1 0.18570091 0.18570091 0.00000000 1.0 Dy Dy4 1 0.81429909 0.00000000 0.00000000 1.0 Nb Nb5 1 1.00000000 0.45163627 0.50000000 1.0 Nb Nb6 1 0.54836373 0.54836373 0.50000000 1.0 Nb Nb7 1 0.45163627 0.00000000 0.50000000 1.0 P P8 1 0.00000000 0.64241435 0.50000000 1.0 P P9 1 0.35758565 0.35758565 0.50000000 1.0 P P10 1 0.64241435 1.00000000 0.50000000 1.0 P P11 1 0.51722612 0.68461230 0.00000000 1.0 P P12 1 0.31538770 0.83261381 0.00000000 1.0 P P13 1 0.16738619 0.48277388 0.00000000 1.0 P P14 1 0.48277388 0.16738619 0.00000000 1.0 P P15 1 0.68461230 0.51722612 0.00000000 1.0 P P16 1 0.83261381 0.31538770 0.00000000 1.0 P P17 1 1.00000000 0.17656162 0.50000000 1.0 P P18 1 0.82343838 0.82343838 0.50000000 1.0 P P19 1 0.17656162 0.00000000 0.50000000 1.0 Ir Ir20 1 0.50724237 0.86296162 0.00000000 1.0 Ir Ir21 1 0.13703838 0.64428075 0.00000000 1.0 Ir Ir22 1 0.35571925 0.49275763 0.00000000 1.0 Ir Ir23 1 0.49275763 0.35571925 0.00000000 1.0 Ir Ir24 1 0.86296162 0.50724237 0.00000000 1.0 Ir Ir25 1 0.64428075 0.13703838 0.00000000 1.0 Ir Ir26 1 1.00000000 0.28245264 0.00000000 1.0 Ir Ir27 1 0.71754736 0.71754736 0.00000000 1.0 Ir Ir28 1 0.28245264 0.00000000 0.00000000 1.0 Ir Ir29 1 0.62768918 0.80581879 0.50000000 1.0 Ir Ir30 1 0.19418121 0.82187139 0.50000000 1.0 Ir Ir31 1 0.17812861 0.37231082 0.50000000 1.0 Ir Ir32 1 0.37231082 0.17812861 0.50000000 1.0 Ir Ir33 1 0.80581879 0.62768918 0.50000000 1.0 Ir Ir34 1 0.82187139 0.19418121 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0