# generated using pymatgen data_Nb16Ir3Pt13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.96355075 _cell_length_b 8.96355111 _cell_length_c 6.96493486 _cell_angle_alpha 76.02019057 _cell_angle_beta 76.02019008 _cell_angle_gamma 77.97740185 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb16Ir3Pt13 _chemical_formula_sum 'Nb16 Ir3 Pt13' _cell_volume 520.21777716 _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 Nb Nb0 1 0.99982944 0.25168616 0.24716723 1.0 Nb Nb1 1 0.25168616 0.99982944 0.24716723 1.0 Nb Nb2 1 0.75162534 0.50176390 0.24338017 1.0 Nb Nb3 1 0.50176390 0.75162534 0.24338017 1.0 Nb Nb4 1 0.87541853 0.12755729 0.99865796 1.0 Nb Nb5 1 0.12755729 0.87541853 0.99865796 1.0 Nb Nb6 1 0.62801707 0.37825305 0.99709103 1.0 Nb Nb7 1 0.37825305 0.62801707 0.99709103 1.0 Nb Nb8 1 0.12326472 0.37503349 0.50345246 1.0 Nb Nb9 1 0.37503349 0.12326472 0.50345246 1.0 Nb Nb10 1 0.87339047 0.62342240 0.50597926 1.0 Nb Nb11 1 0.62342240 0.87339047 0.50597926 1.0 Nb Nb12 1 0.74679759 0.99690603 0.75272073 1.0 Nb Nb13 1 0.99690603 0.74679759 0.75272073 1.0 Nb Nb14 1 0.49940004 0.24763886 0.75153704 1.0 Nb Nb15 1 0.24763886 0.49940004 0.75153704 1.0 Ir Ir16 1 0.68762288 0.68762288 0.87453962 1.0 Ir Ir17 1 0.93887831 0.43610106 0.87501921 1.0 Ir Ir18 1 0.43610106 0.93887831 0.87501921 1.0 Pt Pt19 1 0.31304775 0.31304775 0.12625826 1.0 Pt Pt20 1 0.06172690 0.06172690 0.62447645 1.0 Pt Pt21 1 0.81326263 0.81326263 0.12662926 1.0 Pt Pt22 1 0.56191113 0.56191113 0.62275526 1.0 Pt Pt23 1 0.43704506 0.43704506 0.37554444 1.0 Pt Pt24 1 0.18739335 0.18739335 0.87540925 1.0 Pt Pt25 1 0.93799257 0.93799257 0.37437258 1.0 Pt Pt26 1 0.06352364 0.56283481 0.12639115 1.0 Pt Pt27 1 0.56283481 0.06352364 0.12639115 1.0 Pt Pt28 1 0.81206538 0.31160403 0.62359324 1.0 Pt Pt29 1 0.31160403 0.81206538 0.62359324 1.0 Pt Pt30 1 0.18758474 0.68740336 0.37501646 1.0 Pt Pt31 1 0.68740336 0.18758474 0.37501646 1.0