# generated using pymatgen data_Hf9NiW4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.72175400 _cell_length_b 8.72175354 _cell_length_c 8.48196500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000174 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9NiW4 _chemical_formula_sum 'Hf18 Ni2 W8' _cell_volume 558.77213887 _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 0.19928400 0.80071600 0.44127800 1.0 Hf Hf1 1 0.19928400 0.39856900 0.44127800 1.0 Hf Hf2 1 0.60143100 0.80071600 0.44127800 1.0 Hf Hf3 1 0.80071600 0.19928400 0.55872200 1.0 Hf Hf4 1 0.80071600 0.60143100 0.55872200 1.0 Hf Hf5 1 0.39856900 0.19928400 0.55872200 1.0 Hf Hf6 1 0.80071600 0.19928400 0.94127800 1.0 Hf Hf7 1 0.80071600 0.60143100 0.94127800 1.0 Hf Hf8 1 0.39856900 0.19928400 0.94127800 1.0 Hf Hf9 1 0.19928400 0.80071600 0.05872200 1.0 Hf Hf10 1 0.19928400 0.39856900 0.05872200 1.0 Hf Hf11 1 0.60143100 0.80071600 0.05872200 1.0 Hf Hf12 1 0.54110400 0.45889600 0.25000000 1.0 Hf Hf13 1 0.54110400 0.08220700 0.25000000 1.0 Hf Hf14 1 0.91779300 0.45889600 0.25000000 1.0 Hf Hf15 1 0.45889600 0.54110400 0.75000000 1.0 Hf Hf16 1 0.45889600 0.91779300 0.75000000 1.0 Hf Hf17 1 0.08220700 0.54110400 0.75000000 1.0 Ni Ni18 1 0.33333300 0.66666700 0.25000000 1.0 Ni Ni19 1 0.66666700 0.33333300 0.75000000 1.0 W W20 1 0.88826800 0.11173200 0.25000000 1.0 W W21 1 0.88826800 0.77653600 0.25000000 1.0 W W22 1 0.22346400 0.11173200 0.25000000 1.0 W W23 1 0.11173200 0.88826800 0.75000000 1.0 W W24 1 0.11173200 0.22346400 0.75000000 1.0 W W25 1 0.77653600 0.88826800 0.75000000 1.0 W W26 1 0.00000000 0.00000000 0.50000000 1.0 W W27 1 0.00000000 0.00000000 0.00000000 1.0