# generated using pymatgen data_HfTaCo4P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.85580734 _cell_length_b 11.85580723 _cell_length_c 3.60424673 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99611763 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfTaCo4P3 _chemical_formula_sum 'Hf4 Ta4 Co16 P12' _cell_volume 438.75734143 _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 Hf Hf0 1 0.66663195 0.33283873 0.00000000 1.0 Hf Hf1 1 0.33283873 0.66663195 0.00000000 1.0 Hf Hf2 1 0.17627709 0.00012714 0.50000000 1.0 Hf Hf3 1 0.00012714 0.17627709 0.50000000 1.0 Ta Ta4 1 0.44452007 0.44452007 0.00000000 1.0 Ta Ta5 1 0.55588451 0.99965367 0.00000000 1.0 Ta Ta6 1 0.99965367 0.55588451 0.00000000 1.0 Ta Ta7 1 0.82296181 0.82296181 0.50000000 1.0 Co Co8 1 0.19332744 0.37374526 0.00000000 1.0 Co Co9 1 0.17956590 0.80673715 0.00000000 1.0 Co Co10 1 0.82001259 0.62901025 0.00000000 1.0 Co Co11 1 0.80673715 0.17956590 0.00000000 1.0 Co Co12 1 0.37374526 0.19332744 0.00000000 1.0 Co Co13 1 0.12825051 0.48690479 0.50000000 1.0 Co Co14 1 0.35799837 0.87193972 0.50000000 1.0 Co Co15 1 0.51509531 0.64275332 0.50000000 1.0 Co Co16 1 0.64275332 0.51509531 0.50000000 1.0 Co Co17 1 0.87193972 0.35799837 0.50000000 1.0 Co Co18 1 0.48690479 0.12825051 0.50000000 1.0 Co Co19 1 0.99825583 0.99825583 0.00000000 1.0 Co Co20 1 0.72302578 0.99813456 0.50000000 1.0 Co Co21 1 0.99813456 0.72302578 0.50000000 1.0 Co Co22 1 0.62901025 0.82001259 0.00000000 1.0 Co Co23 1 0.27759444 0.27759444 0.50000000 1.0 P P24 1 0.65107368 0.65107368 0.00000000 1.0 P P25 1 0.34993776 0.99993672 0.00000000 1.0 P P26 1 0.99993672 0.34993776 0.00000000 1.0 P P27 1 0.48087381 0.30944988 0.50000000 1.0 P P28 1 0.69126496 0.17086410 0.50000000 1.0 P P29 1 0.82816615 0.51896985 0.50000000 1.0 P P30 1 0.51896985 0.82816615 0.50000000 1.0 P P31 1 0.17086410 0.69126496 0.50000000 1.0 P P32 1 0.82422647 0.99911032 0.00000000 1.0 P P33 1 0.99911032 0.82422647 0.00000000 1.0 P P34 1 0.30944988 0.48087381 0.50000000 1.0 P P35 1 0.17488212 0.17488212 0.00000000 1.0