# generated using pymatgen data_YbP2Ir3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.95821975 _cell_length_b 11.24577131 _cell_length_c 12.46652880 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YbP2Ir3 _chemical_formula_sum 'Yb6 P12 Ir18' _cell_volume 554.92551531 _cell_formula_units_Z 6 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 Yb Yb0 1 0.00000000 0.50000000 0.52640671 1.0 Yb Yb1 1 0.50000000 0.00000000 0.47359329 1.0 Yb Yb2 1 0.50000000 0.82468672 0.20652627 1.0 Yb Yb3 1 0.50000000 0.17531328 0.20652627 1.0 Yb Yb4 1 0.00000000 0.67531328 0.79347373 1.0 Yb Yb5 1 0.00000000 0.32468672 0.79347373 1.0 P P6 1 0.50000000 0.50000000 0.88172830 1.0 P P7 1 0.00000000 0.00000000 0.11827170 1.0 P P8 1 0.50000000 0.50000000 0.35557309 1.0 P P9 1 0.00000000 0.00000000 0.64442691 1.0 P P10 1 0.50000000 0.31317256 0.61900838 1.0 P P11 1 0.50000000 0.68682744 0.61900838 1.0 P P12 1 0.00000000 0.18682744 0.38099162 1.0 P P13 1 0.00000000 0.81317256 0.38099162 1.0 P P14 1 0.50000000 0.83773493 0.89059691 1.0 P P15 1 0.50000000 0.16226507 0.89059691 1.0 P P16 1 0.00000000 0.66226507 0.10940309 1.0 P P17 1 0.00000000 0.33773493 0.10940309 1.0 Ir Ir18 1 0.50000000 0.50000000 0.17225574 1.0 Ir Ir19 1 0.00000000 0.00000000 0.82774426 1.0 Ir Ir20 1 0.50000000 0.50000000 0.70031212 1.0 Ir Ir21 1 0.00000000 0.00000000 0.29968788 1.0 Ir Ir22 1 0.00000000 0.50000000 0.99501470 1.0 Ir Ir23 1 0.50000000 0.00000000 0.00498530 1.0 Ir Ir24 1 0.50000000 0.33373649 0.99438039 1.0 Ir Ir25 1 0.50000000 0.66626351 0.99438039 1.0 Ir Ir26 1 0.00000000 0.16626351 0.00561961 1.0 Ir Ir27 1 0.00000000 0.83373649 0.00561961 1.0 Ir Ir28 1 0.50000000 0.29384082 0.42836968 1.0 Ir Ir29 1 0.50000000 0.70615918 0.42836968 1.0 Ir Ir30 1 0.00000000 0.20615918 0.57163032 1.0 Ir Ir31 1 0.00000000 0.79384082 0.57163032 1.0 Ir Ir32 1 0.50000000 0.87100220 0.71290181 1.0 Ir Ir33 1 0.50000000 0.12899780 0.71290181 1.0 Ir Ir34 1 0.00000000 0.62899780 0.28709819 1.0 Ir Ir35 1 0.00000000 0.37100220 0.28709819 1.0