# generated using pymatgen data_Hf16TcNi4Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.63900448 _cell_length_b 8.63900422 _cell_length_c 8.63900516 _cell_angle_alpha 59.99968375 _cell_angle_beta 59.99967835 _cell_angle_gamma 59.99968121 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf16TcNi4Mo3 _chemical_formula_sum 'Hf16 Tc1 Ni4 Mo3' _cell_volume 455.90355754 _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 0.69474338 0.10185071 0.10185071 1.0 Hf Hf1 1 0.10185071 0.69474338 0.10185071 1.0 Hf Hf2 1 0.10185071 0.10185071 0.69474338 1.0 Hf Hf3 1 0.10192334 0.10192334 0.10192334 1.0 Hf Hf4 1 0.31481781 0.31481781 0.68402511 1.0 Hf Hf5 1 0.68506509 0.68506509 0.31490431 1.0 Hf Hf6 1 0.31481781 0.68402511 0.31481781 1.0 Hf Hf7 1 0.68506509 0.31490431 0.68506509 1.0 Hf Hf8 1 0.68402511 0.31481781 0.31481781 1.0 Hf Hf9 1 0.31490431 0.68506509 0.68506509 1.0 Hf Hf10 1 0.95197781 0.95197781 0.54790790 1.0 Hf Hf11 1 0.54748883 0.54748883 0.95240611 1.0 Hf Hf12 1 0.95197781 0.54790790 0.95197781 1.0 Hf Hf13 1 0.54748883 0.95240611 0.54748883 1.0 Hf Hf14 1 0.54790790 0.95197781 0.95197781 1.0 Hf Hf15 1 0.95240611 0.54748883 0.54748883 1.0 Tc Tc16 1 0.33421412 0.33421412 0.33421412 1.0 Ni Ni17 1 0.32570033 0.89118842 0.89118842 1.0 Ni Ni18 1 0.89118842 0.32570033 0.89118842 1.0 Ni Ni19 1 0.89118842 0.89118842 0.32570033 1.0 Ni Ni20 1 0.89138476 0.89138476 0.89138476 1.0 Mo Mo21 1 0.00316069 0.33242380 0.33242380 1.0 Mo Mo22 1 0.33242380 0.00316069 0.33242380 1.0 Mo Mo23 1 0.33242380 0.33242380 0.00316069 1.0