# generated using pymatgen data_Nd16Y4(IrRh3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.16258936 _cell_length_b 11.16258936 _cell_length_c 6.51846933 _cell_angle_alpha 90.11225440 _cell_angle_beta 90.11225440 _cell_angle_gamma 89.96238153 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd16Y4(IrRh3)3 _chemical_formula_sum 'Nd16 Y4 Ir3 Rh9' _cell_volume 812.22015802 _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 0.28965870 0.08986175 0.38936569 1.0 Nd Nd1 1 0.28984242 0.90946746 0.88937451 1.0 Nd Nd2 1 0.71019986 0.08829026 0.88909214 1.0 Nd Nd3 1 0.70999708 0.91008349 0.38893569 1.0 Nd Nd4 1 0.58658870 0.78825222 0.88946270 1.0 Nd Nd5 1 0.58687750 0.21098697 0.38868760 1.0 Nd Nd6 1 0.41311765 0.78892167 0.38865691 1.0 Nd Nd7 1 0.41055153 0.21042249 0.88930388 1.0 Nd Nd8 1 0.21174778 0.41341130 0.61053730 1.0 Nd Nd9 1 0.21107833 0.58688235 0.11134309 1.0 Nd Nd10 1 0.78901303 0.41312250 0.11131240 1.0 Nd Nd11 1 0.78957751 0.58944847 0.61069612 1.0 Nd Nd12 1 0.91013825 0.71034130 0.11063431 1.0 Nd Nd13 1 0.91170974 0.28980014 0.61090786 1.0 Nd Nd14 1 0.09053254 0.71015758 0.61062549 1.0 Nd Nd15 1 0.08991651 0.29000292 0.11106431 1.0 Y Y16 1 0.99994059 0.99993991 0.49985079 1.0 Y Y17 1 0.00006009 0.00005941 0.00014921 1.0 Y Y18 1 0.49946500 0.49967552 0.00013440 1.0 Y Y19 1 0.50032448 0.50053500 0.49986560 1.0 Ir Ir20 1 0.65117951 0.65042099 0.24981512 1.0 Ir Ir21 1 0.34957901 0.34882049 0.25018488 1.0 Ir Ir22 1 0.34889019 0.65110981 0.75000000 1.0 Rh Rh23 1 0.84909918 0.15090082 0.25000000 1.0 Rh Rh24 1 0.84973762 0.84981803 0.74953697 1.0 Rh Rh25 1 0.15018197 0.15026238 0.75046303 1.0 Rh Rh26 1 0.15043442 0.84956558 0.25000000 1.0 Rh Rh27 1 0.65201345 0.34798655 0.75000000 1.0 Rh Rh28 1 0.49999653 0.00043442 0.12621841 1.0 Rh Rh29 1 0.50025342 0.00126918 0.62657827 1.0 Rh Rh30 1 0.99873082 0.49974658 0.87342173 1.0 Rh Rh31 1 0.99956558 0.50000347 0.37378159 1.0