# generated using pymatgen data_YEr2(P2Ir3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.96074793 _cell_length_b 11.12716021 _cell_length_c 12.67457667 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YEr2(P2Ir3)3 _chemical_formula_sum 'Y2 Er4 P12 Ir18' _cell_volume 558.59238137 _cell_formula_units_Z 2 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 Y Y0 1 0.75000000 0.25000000 0.47710573 1.0 Y Y1 1 0.25000000 0.75000000 0.52289427 1.0 Er Er2 1 0.25000000 0.93329597 0.79490085 1.0 Er Er3 1 0.25000000 0.56670403 0.79490085 1.0 Er Er4 1 0.75000000 0.06670403 0.20509915 1.0 Er Er5 1 0.75000000 0.43329597 0.20509915 1.0 P P6 1 0.25000000 0.25000000 0.12347745 1.0 P P7 1 0.75000000 0.75000000 0.87652255 1.0 P P8 1 0.25000000 0.25000000 0.63935135 1.0 P P9 1 0.75000000 0.75000000 0.36064865 1.0 P P10 1 0.25000000 0.43489407 0.38178107 1.0 P P11 1 0.25000000 0.06510593 0.38178107 1.0 P P12 1 0.75000000 0.56510593 0.61821893 1.0 P P13 1 0.75000000 0.93489407 0.61821893 1.0 P P14 1 0.25000000 0.90702162 0.10606065 1.0 P P15 1 0.25000000 0.59297838 0.10606065 1.0 P P16 1 0.75000000 0.09297838 0.89393935 1.0 P P17 1 0.75000000 0.40702162 0.89393935 1.0 Ir Ir18 1 0.25000000 0.25000000 0.81774895 1.0 Ir Ir19 1 0.75000000 0.75000000 0.18225105 1.0 Ir Ir20 1 0.25000000 0.25000000 0.29972659 1.0 Ir Ir21 1 0.75000000 0.75000000 0.70027341 1.0 Ir Ir22 1 0.75000000 0.25000000 0.02774712 1.0 Ir Ir23 1 0.25000000 0.75000000 0.97225288 1.0 Ir Ir24 1 0.25000000 0.41358541 0.99832656 1.0 Ir Ir25 1 0.25000000 0.08641459 0.99832656 1.0 Ir Ir26 1 0.75000000 0.58641459 0.00167344 1.0 Ir Ir27 1 0.75000000 0.91358541 0.00167344 1.0 Ir Ir28 1 0.25000000 0.45447184 0.57060062 1.0 Ir Ir29 1 0.25000000 0.04552816 0.57060062 1.0 Ir Ir30 1 0.75000000 0.54552816 0.42939938 1.0 Ir Ir31 1 0.75000000 0.95447184 0.42939938 1.0 Ir Ir32 1 0.25000000 0.88210586 0.28487131 1.0 Ir Ir33 1 0.25000000 0.61789414 0.28487131 1.0 Ir Ir34 1 0.75000000 0.11789414 0.71512869 1.0 Ir Ir35 1 0.75000000 0.38210586 0.71512869 1.0