# generated using pymatgen data_Hf16TaTc3Ni4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.61542255 _cell_length_b 8.61542270 _cell_length_c 8.61542339 _cell_angle_alpha 60.24372378 _cell_angle_beta 60.24372377 _cell_angle_gamma 60.24372068 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf16TaTc3Ni4 _chemical_formula_sum 'Hf16 Ta1 Tc3 Ni4' _cell_volume 454.67840270 _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 0.69552792 0.10155692 0.10155692 1.0 Hf Hf1 1 0.10155692 0.69552792 0.10155692 1.0 Hf Hf2 1 0.10155692 0.10155692 0.69552792 1.0 Hf Hf3 1 0.10246437 0.10246437 0.10246437 1.0 Hf Hf4 1 0.31491906 0.31491906 0.68943618 1.0 Hf Hf5 1 0.68527918 0.68527918 0.31478292 1.0 Hf Hf6 1 0.31491906 0.68943618 0.31491906 1.0 Hf Hf7 1 0.68527918 0.31478292 0.68527918 1.0 Hf Hf8 1 0.68943618 0.31491906 0.31491906 1.0 Hf Hf9 1 0.31478292 0.68527918 0.68527918 1.0 Hf Hf10 1 0.95370262 0.95370262 0.54602478 1.0 Hf Hf11 1 0.54938118 0.54938118 0.95115389 1.0 Hf Hf12 1 0.95370262 0.54602478 0.95370262 1.0 Hf Hf13 1 0.54938118 0.95115389 0.54938118 1.0 Hf Hf14 1 0.54602478 0.95370262 0.95370262 1.0 Hf Hf15 1 0.95115389 0.54938118 0.54938118 1.0 Ta Ta16 1 0.32653135 0.32653135 0.32653135 1.0 Tc Tc17 1 0.99565738 0.33433007 0.33433007 1.0 Tc Tc18 1 0.33433007 0.99565738 0.33433007 1.0 Tc Tc19 1 0.33433007 0.33433007 0.99565738 1.0 Ni Ni20 1 0.32581498 0.89154555 0.89154555 1.0 Ni Ni21 1 0.89154555 0.32581498 0.89154555 1.0 Ni Ni22 1 0.89154555 0.89154555 0.32581498 1.0 Ni Ni23 1 0.89117405 0.89117405 0.89117405 1.0