# generated using pymatgen data_Y3P6Ir8W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.99093344 _cell_length_b 11.05205518 _cell_length_c 12.75589988 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y3P6Ir8W _chemical_formula_sum 'Y6 P12 Ir16 W2' _cell_volume 562.63744303 _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 0.00000000 0.50000000 0.52248085 1.0 Y Y1 1 0.50000000 0.00000000 0.47751915 1.0 Y Y2 1 0.50000000 0.81907824 0.20444696 1.0 Y Y3 1 0.50000000 0.18092176 0.20444696 1.0 Y Y4 1 0.00000000 0.68092176 0.79555304 1.0 Y Y5 1 0.00000000 0.31907824 0.79555304 1.0 P P6 1 0.50000000 0.50000000 0.87371120 1.0 P P7 1 0.00000000 0.00000000 0.12628880 1.0 P P8 1 0.50000000 0.50000000 0.34744199 1.0 P P9 1 0.00000000 0.00000000 0.65255801 1.0 P P10 1 0.50000000 0.31425987 0.61773621 1.0 P P11 1 0.50000000 0.68574013 0.61773621 1.0 P P12 1 0.00000000 0.18574013 0.38226379 1.0 P P13 1 0.00000000 0.81425987 0.38226379 1.0 P P14 1 0.50000000 0.84501416 0.88555759 1.0 P P15 1 0.50000000 0.15498584 0.88555759 1.0 P P16 1 0.00000000 0.65498584 0.11444241 1.0 P P17 1 0.00000000 0.34501416 0.11444241 1.0 Ir Ir18 1 0.50000000 0.50000000 0.69687166 1.0 Ir Ir19 1 0.00000000 0.00000000 0.30312834 1.0 Ir Ir20 1 0.00000000 0.50000000 0.99696629 1.0 Ir Ir21 1 0.50000000 0.00000000 0.00303371 1.0 Ir Ir22 1 0.50000000 0.33147066 0.97957437 1.0 Ir Ir23 1 0.50000000 0.66852934 0.97957437 1.0 Ir Ir24 1 0.00000000 0.16852934 0.02042563 1.0 Ir Ir25 1 0.00000000 0.83147066 0.02042563 1.0 Ir Ir26 1 0.50000000 0.29888953 0.43247588 1.0 Ir Ir27 1 0.50000000 0.70111047 0.43247588 1.0 Ir Ir28 1 0.00000000 0.20111047 0.56752412 1.0 Ir Ir29 1 0.00000000 0.79888953 0.56752412 1.0 Ir Ir30 1 0.50000000 0.87260795 0.71028764 1.0 Ir Ir31 1 0.50000000 0.12739205 0.71028764 1.0 Ir Ir32 1 0.00000000 0.62739205 0.28971236 1.0 Ir Ir33 1 0.00000000 0.37260795 0.28971236 1.0 W W34 1 0.50000000 0.50000000 0.16071336 1.0 W W35 1 0.00000000 0.00000000 0.83928664 1.0