# generated using pymatgen data_Hf6FeCo17P12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.58666604 _cell_length_b 10.19772279 _cell_length_c 11.78380982 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6FeCo17P12 _chemical_formula_sum 'Hf6 Fe1 Co17 P12' _cell_volume 431.00257723 _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 0.00000000 0.50000000 0.52720480 1.0 Hf Hf1 1 0.50000000 0.00000000 0.47196037 1.0 Hf Hf2 1 0.50000000 0.82228915 0.20847090 1.0 Hf Hf3 1 0.50000000 0.17771085 0.20847090 1.0 Hf Hf4 1 0.00000000 0.67714929 0.79203335 1.0 Hf Hf5 1 0.00000000 0.32285071 0.79203335 1.0 Fe Fe6 1 0.50000000 0.50000000 0.16236074 1.0 Co Co7 1 0.00000000 0.00000000 0.83757535 1.0 Co Co8 1 0.50000000 0.50000000 0.70378806 1.0 Co Co9 1 0.00000000 0.00000000 0.29621714 1.0 Co Co10 1 0.00000000 0.50000000 0.98854327 1.0 Co Co11 1 0.50000000 0.00000000 0.01060225 1.0 Co Co12 1 0.50000000 0.33220003 0.99451579 1.0 Co Co13 1 0.50000000 0.66779997 0.99451579 1.0 Co Co14 1 0.00000000 0.16690429 0.00548952 1.0 Co Co15 1 0.00000000 0.83309571 0.00548952 1.0 Co Co16 1 0.50000000 0.29982429 0.43317991 1.0 Co Co17 1 0.50000000 0.70017571 0.43317991 1.0 Co Co18 1 0.00000000 0.20025826 0.56734289 1.0 Co Co19 1 0.00000000 0.79974174 0.56734289 1.0 Co Co20 1 0.50000000 0.87581601 0.70691099 1.0 Co Co21 1 0.50000000 0.12418399 0.70691099 1.0 Co Co22 1 0.00000000 0.62564480 0.29314879 1.0 Co Co23 1 0.00000000 0.37435520 0.29314879 1.0 P P24 1 0.50000000 0.50000000 0.87996831 1.0 P P25 1 0.00000000 0.00000000 0.12023763 1.0 P P26 1 0.50000000 0.50000000 0.35251691 1.0 P P27 1 0.00000000 0.00000000 0.64682409 1.0 P P28 1 0.50000000 0.31762971 0.61730953 1.0 P P29 1 0.50000000 0.68237029 0.61730953 1.0 P P30 1 0.00000000 0.18249712 0.38297194 1.0 P P31 1 0.00000000 0.81750288 0.38297194 1.0 P P32 1 0.50000000 0.84259257 0.88808784 1.0 P P33 1 0.50000000 0.15740743 0.88808784 1.0 P P34 1 0.00000000 0.65748211 0.11164059 1.0 P P35 1 0.00000000 0.34251789 0.11164059 1.0