# generated using pymatgen data_NdDy7(P7Ir8)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.93313773 _cell_length_b 12.58992250 _cell_length_c 13.08604937 _cell_angle_alpha 80.92316283 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdDy7(P7Ir8)2 _chemical_formula_sum 'Nd1 Dy7 P14 Ir16' _cell_volume 639.87927898 _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 Nd Nd0 1 0.25000000 0.27900817 0.10146205 1.0 Dy Dy1 1 0.75000000 0.79081934 0.56217710 1.0 Dy Dy2 1 0.25000000 0.20957043 0.43821488 1.0 Dy Dy3 1 0.75000000 0.48005849 0.70700685 1.0 Dy Dy4 1 0.25000000 0.52055219 0.29353311 1.0 Dy Dy5 1 0.75000000 0.71941259 0.89853540 1.0 Dy Dy6 1 0.25000000 0.10363598 0.79046230 1.0 Dy Dy7 1 0.75000000 0.89676375 0.21037771 1.0 P P8 1 0.25000000 0.90793142 0.41161085 1.0 P P9 1 0.75000000 0.47112232 0.12912118 1.0 P P10 1 0.25000000 0.53055593 0.87065019 1.0 P P11 1 0.75000000 0.09218097 0.58888599 1.0 P P12 1 0.25000000 0.74123316 0.08027448 1.0 P P13 1 0.75000000 0.25584262 0.91650796 1.0 P P14 1 0.75000000 0.15701159 0.28317727 1.0 P P15 1 0.25000000 0.84377869 0.71773654 1.0 P P16 1 0.25000000 0.04859100 0.10060014 1.0 P P17 1 0.75000000 0.94628245 0.89909470 1.0 P P18 1 0.25000000 0.31263858 0.68901321 1.0 P P19 1 0.75000000 0.68794037 0.31106919 1.0 P P20 1 0.25000000 0.60933755 0.56533810 1.0 P P21 1 0.75000000 0.39168386 0.43597469 1.0 Ir Ir22 1 0.25000000 0.99016345 0.57612020 1.0 Ir Ir23 1 0.75000000 0.00986776 0.42414565 1.0 Ir Ir24 1 0.25000000 0.66275603 0.72849422 1.0 Ir Ir25 1 0.75000000 0.33945132 0.27386200 1.0 Ir Ir26 1 0.25000000 0.55211668 0.04895466 1.0 Ir Ir27 1 0.75000000 0.45264246 0.94844050 1.0 Ir Ir28 1 0.25000000 0.05950868 0.27335883 1.0 Ir Ir29 1 0.75000000 0.93951527 0.72677845 1.0 Ir Ir30 1 0.25000000 0.42254700 0.52488025 1.0 Ir Ir31 1 0.75000000 0.57851580 0.47603854 1.0 Ir Ir32 1 0.25000000 0.91357161 0.99687219 1.0 Ir Ir33 1 0.75000000 0.08243427 0.00106304 1.0 Ir Ir34 1 0.25000000 0.72982636 0.39558162 1.0 Ir Ir35 1 0.75000000 0.27033917 0.60484664 1.0 Ir Ir36 1 0.25000000 0.34139003 0.85789453 1.0 Ir Ir37 1 0.75000000 0.65940365 0.14184378 1.0