# generated using pymatgen data_Hf2Nb3Co19P12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.62743551 _cell_length_b 11.62743696 _cell_length_c 3.58043115 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000418 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2Nb3Co19P12 _chemical_formula_sum 'Hf2 Nb3 Co19 P12' _cell_volume 419.21216150 _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 0.33333300 0.66666700 0.50000000 1.0 Hf Hf1 1 0.66666700 0.33333300 0.50000000 1.0 Nb Nb2 1 0.81873509 0.00000000 0.00000000 1.0 Nb Nb3 1 0.00000000 0.81873509 0.00000000 1.0 Nb Nb4 1 0.18126491 0.18126491 0.00000000 1.0 Co Co5 1 0.62407048 0.80403021 0.50000000 1.0 Co Co6 1 0.19596979 0.82004127 0.50000000 1.0 Co Co7 1 0.17995873 0.37592952 0.50000000 1.0 Co Co8 1 0.37592952 0.17995873 0.50000000 1.0 Co Co9 1 0.80403021 0.62407048 0.50000000 1.0 Co Co10 1 0.82004127 0.19596979 0.50000000 1.0 Co Co11 1 0.28113268 0.00000000 0.00000000 1.0 Co Co12 1 0.00000000 0.28113268 0.00000000 1.0 Co Co13 1 0.71886732 0.71886732 0.00000000 1.0 Co Co14 1 0.44779390 1.00000000 0.50000000 1.0 Co Co15 1 1.00000000 0.44779390 0.50000000 1.0 Co Co16 1 0.55220610 0.55220610 0.50000000 1.0 Co Co17 1 0.51635428 0.87440004 0.00000000 1.0 Co Co18 1 0.12559996 0.64195424 0.00000000 1.0 Co Co19 1 0.35804576 0.48364572 0.00000000 1.0 Co Co20 1 0.48364572 0.35804576 0.00000000 1.0 Co Co21 1 0.87440004 0.51635428 0.00000000 1.0 Co Co22 1 0.64195424 0.12559996 0.00000000 1.0 Co Co23 1 0.00000000 0.00000000 0.50000000 1.0 P P24 1 0.17644251 0.00000000 0.50000000 1.0 P P25 1 0.00000000 0.17644251 0.50000000 1.0 P P26 1 0.82355749 0.82355749 0.50000000 1.0 P P27 1 0.51831086 0.68584166 0.00000000 1.0 P P28 1 0.31415834 0.83246920 0.00000000 1.0 P P29 1 0.16753080 0.48168914 0.00000000 1.0 P P30 1 0.48168914 0.16753080 0.00000000 1.0 P P31 1 0.68584166 0.51831086 0.00000000 1.0 P P32 1 0.83246920 0.31415834 0.00000000 1.0 P P33 1 0.63948373 0.00000000 0.50000000 1.0 P P34 1 0.00000000 0.63948373 0.50000000 1.0 P P35 1 0.36051627 0.36051627 0.50000000 1.0