# generated using pymatgen data_Hf18Tc3Ni2W5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62486721 _cell_length_b 8.62486718 _cell_length_c 8.40791425 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000012 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf18Tc3Ni2W5 _chemical_formula_sum 'Hf18 Tc3 Ni2 W5' _cell_volume 541.65622424 _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 0.19947120 0.80052880 0.44257441 1.0 Hf Hf1 1 0.19947120 0.39894340 0.44257441 1.0 Hf Hf2 1 0.60105660 0.80052880 0.44257441 1.0 Hf Hf3 1 0.80002684 0.19997316 0.55822347 1.0 Hf Hf4 1 0.80002684 0.60005367 0.55822347 1.0 Hf Hf5 1 0.39994633 0.19997316 0.55822347 1.0 Hf Hf6 1 0.80002684 0.19997316 0.94177653 1.0 Hf Hf7 1 0.80002684 0.60005367 0.94177653 1.0 Hf Hf8 1 0.39994633 0.19997316 0.94177653 1.0 Hf Hf9 1 0.19947120 0.80052880 0.05742559 1.0 Hf Hf10 1 0.19947120 0.39894340 0.05742559 1.0 Hf Hf11 1 0.60105660 0.80052880 0.05742559 1.0 Hf Hf12 1 0.54126134 0.45873866 0.25000000 1.0 Hf Hf13 1 0.54126134 0.08252368 0.25000000 1.0 Hf Hf14 1 0.91747632 0.45873866 0.25000000 1.0 Hf Hf15 1 0.45760039 0.54239961 0.75000000 1.0 Hf Hf16 1 0.45760039 0.91520079 0.75000000 1.0 Hf Hf17 1 0.08479921 0.54239961 0.75000000 1.0 Tc Tc18 1 0.11203417 0.88796583 0.75000000 1.0 Tc Tc19 1 0.11203417 0.22407034 0.75000000 1.0 Tc Tc20 1 0.77592966 0.88796583 0.75000000 1.0 Ni Ni21 1 0.33333300 0.66666700 0.25000000 1.0 Ni Ni22 1 0.66666700 0.33333300 0.75000000 1.0 W W23 1 0.88863855 0.11136145 0.25000000 1.0 W W24 1 0.88863855 0.77727609 0.25000000 1.0 W W25 1 0.22272391 0.11136145 0.25000000 1.0 W W26 1 0.00000000 0.00000000 0.50404801 1.0 W W27 1 0.00000000 0.00000000 0.99595199 1.0