# generated using pymatgen data_YCo2(PIr)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.84118301 _cell_length_b 10.53400728 _cell_length_c 12.14529794 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YCo2(PIr)3 _chemical_formula_sum 'Y4 Co8 P12 Ir12' _cell_volume 491.43579514 _cell_formula_units_Z 4 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 0.25000000 0.91670053 0.21096247 1.0 Y Y1 1 0.75000000 0.08329947 0.78903753 1.0 Y Y2 1 0.75000000 0.41670053 0.28903753 1.0 Y Y3 1 0.25000000 0.58329947 0.71096247 1.0 Co Co4 1 0.25000000 0.61682071 0.19760341 1.0 Co Co5 1 0.75000000 0.38317929 0.80239659 1.0 Co Co6 1 0.75000000 0.11682071 0.30239659 1.0 Co Co7 1 0.25000000 0.88317929 0.69760341 1.0 Co Co8 1 0.25000000 0.03767335 0.43363783 1.0 Co Co9 1 0.75000000 0.96232665 0.56636217 1.0 Co Co10 1 0.75000000 0.53767335 0.06636217 1.0 Co Co11 1 0.25000000 0.46232665 0.93363783 1.0 P P12 1 0.25000000 0.06614894 0.61056495 1.0 P P13 1 0.75000000 0.93385106 0.38943505 1.0 P P14 1 0.75000000 0.56614894 0.88943505 1.0 P P15 1 0.25000000 0.43385106 0.11056495 1.0 P P16 1 0.25000000 0.22552229 0.36862468 1.0 P P17 1 0.75000000 0.77447771 0.63137532 1.0 P P18 1 0.75000000 0.72552229 0.13137532 1.0 P P19 1 0.25000000 0.27447771 0.86862468 1.0 P P20 1 0.25000000 0.90102991 0.87758746 1.0 P P21 1 0.75000000 0.09897009 0.12241254 1.0 P P22 1 0.75000000 0.40102991 0.62241254 1.0 P P23 1 0.25000000 0.59897009 0.37758746 1.0 Ir Ir24 1 0.25000000 0.77761336 0.49260676 1.0 Ir Ir25 1 0.75000000 0.22238664 0.50739324 1.0 Ir Ir26 1 0.75000000 0.27761336 0.00739324 1.0 Ir Ir27 1 0.25000000 0.72238664 0.99260676 1.0 Ir Ir28 1 0.25000000 0.08979129 0.97617640 1.0 Ir Ir29 1 0.75000000 0.91020871 0.02382360 1.0 Ir Ir30 1 0.75000000 0.58979129 0.52382360 1.0 Ir Ir31 1 0.25000000 0.41020871 0.47617640 1.0 Ir Ir32 1 0.25000000 0.27136459 0.67669378 1.0 Ir Ir33 1 0.75000000 0.72863541 0.32330622 1.0 Ir Ir34 1 0.75000000 0.77136459 0.82330622 1.0 Ir Ir35 1 0.25000000 0.22863541 0.17669378 1.0