# generated using pymatgen data_Hf3Sc5(Co4P3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.00792417 _cell_length_b 11.98575697 _cell_length_c 3.60797159 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.05097755 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Sc5(Co4P3)4 _chemical_formula_sum 'Hf3 Sc5 Co16 P12' _cell_volume 449.47322535 _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 Hf Hf0 1 0.81837346 0.81930771 0.50000000 1.0 Hf Hf1 1 0.44250258 0.44312068 0.00000000 1.0 Hf Hf2 1 0.55722047 0.00034968 0.00000000 1.0 Sc Sc3 1 0.00034698 0.18184947 0.50000000 1.0 Sc Sc4 1 0.33313577 0.66682691 0.00000000 1.0 Sc Sc5 1 0.66664183 0.33360677 0.00000000 1.0 Sc Sc6 1 0.99925638 0.55683312 0.00000000 1.0 Sc Sc7 1 0.18176085 0.00132548 0.50000000 1.0 Co Co8 1 0.63025855 0.82304670 0.00000000 1.0 Co Co9 1 0.37124433 0.19407703 0.00000000 1.0 Co Co10 1 0.99908836 0.72182152 0.50000000 1.0 Co Co11 1 0.27859517 0.27786600 0.50000000 1.0 Co Co12 1 0.87346392 0.35547739 0.50000000 1.0 Co Co13 1 0.72180907 0.99804555 0.50000000 1.0 Co Co14 1 0.82248974 0.62979529 0.00000000 1.0 Co Co15 1 0.17734687 0.80572725 0.00000000 1.0 Co Co16 1 0.35553833 0.87407082 0.50000000 1.0 Co Co17 1 0.12573470 0.48082134 0.50000000 1.0 Co Co18 1 0.64566532 0.52082050 0.50000000 1.0 Co Co19 1 0.99828255 0.99744042 0.00000000 1.0 Co Co20 1 0.51967536 0.64554361 0.50000000 1.0 Co Co21 1 0.48190859 0.12590570 0.50000000 1.0 Co Co22 1 0.19397952 0.37069656 0.00000000 1.0 Co Co23 1 0.80642498 0.17676112 0.00000000 1.0 P P24 1 0.00033923 0.34856524 0.00000000 1.0 P P25 1 0.82618559 0.51682333 0.50000000 1.0 P P26 1 0.69219570 0.17444141 0.50000000 1.0 P P27 1 0.17354312 0.17377979 0.00000000 1.0 P P28 1 0.65366161 0.65319819 0.00000000 1.0 P P29 1 0.82604446 0.00091773 0.00000000 1.0 P P30 1 0.51654656 0.82581933 0.50000000 1.0 P P31 1 0.17328100 0.69046280 0.50000000 1.0 P P32 1 0.34620756 0.99947361 0.00000000 1.0 P P33 1 0.48302749 0.30860696 0.50000000 1.0 P P34 1 0.00050839 0.82417750 0.00000000 1.0 P P35 1 0.30771460 0.48259749 0.50000000 1.0