# generated using pymatgen data_HfTa2(MoP)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.78946156 _cell_length_b 6.82558392 _cell_length_c 3.35284138 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.82508453 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfTa2(MoP)3 _chemical_formula_sum 'Hf1 Ta2 Mo3 P3' _cell_volume 134.79741400 _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 0.59692773 1.00000000 0.50000000 1.0 Ta Ta1 1 0.99827283 0.59698185 0.50000000 1.0 Ta Ta2 1 0.40129097 0.40301815 0.50000000 1.0 Mo Mo3 1 0.25349294 1.00000000 0.00000000 1.0 Mo Mo4 1 0.74647200 0.74200289 0.00000000 1.0 Mo Mo5 1 0.00446912 0.25799711 0.00000000 1.0 P P6 1 0.66729473 0.33598571 0.00000000 1.0 P P7 1 0.33130802 0.66401429 0.00000000 1.0 P P8 1 0.00047266 1.00000000 0.50000000 1.0