# generated using pymatgen data_Hf9Ta3TcP _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.68730218 _cell_length_b 8.68730121 _cell_length_c 8.66352528 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999617 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9Ta3TcP _chemical_formula_sum 'Hf18 Ta6 Tc2 P2' _cell_volume 566.23290538 _cell_formula_units_Z 2 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 0.19843596 0.80156404 0.45075301 1.0 Hf Hf1 1 0.19843596 0.39687192 0.45075301 1.0 Hf Hf2 1 0.60312808 0.80156404 0.45075301 1.0 Hf Hf3 1 0.80156404 0.19843596 0.54924699 1.0 Hf Hf4 1 0.80156404 0.60312808 0.54924699 1.0 Hf Hf5 1 0.39687192 0.19843596 0.54924699 1.0 Hf Hf6 1 0.80156404 0.19843596 0.95075301 1.0 Hf Hf7 1 0.80156404 0.60312808 0.95075301 1.0 Hf Hf8 1 0.39687192 0.19843596 0.95075301 1.0 Hf Hf9 1 0.19843596 0.80156404 0.04924699 1.0 Hf Hf10 1 0.19843596 0.39687192 0.04924699 1.0 Hf Hf11 1 0.60312808 0.80156404 0.04924699 1.0 Hf Hf12 1 0.53872153 0.46127847 0.25000000 1.0 Hf Hf13 1 0.53872153 0.07744207 0.25000000 1.0 Hf Hf14 1 0.92255793 0.46127847 0.25000000 1.0 Hf Hf15 1 0.46127847 0.53872153 0.75000000 1.0 Hf Hf16 1 0.46127847 0.92255793 0.75000000 1.0 Hf Hf17 1 0.07744207 0.53872153 0.75000000 1.0 Ta Ta18 1 0.88963724 0.11036276 0.25000000 1.0 Ta Ta19 1 0.88963724 0.77927349 0.25000000 1.0 Ta Ta20 1 0.22072651 0.11036276 0.25000000 1.0 Ta Ta21 1 0.11036276 0.88963724 0.75000000 1.0 Ta Ta22 1 0.11036276 0.22072651 0.75000000 1.0 Ta Ta23 1 0.77927349 0.88963724 0.75000000 1.0 Tc Tc24 1 0.00000000 0.00000000 0.50000000 1.0 Tc Tc25 1 0.00000000 0.00000000 0.00000000 1.0 P P26 1 0.33333300 0.66666700 0.25000000 1.0 P P27 1 0.66666700 0.33333300 0.75000000 1.0