# generated using pymatgen data_Hf9TaNiW3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.70005565 _cell_length_b 8.70005576 _cell_length_c 8.44049362 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000336 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9TaNiW3 _chemical_formula_sum 'Hf18 Ta2 Ni2 W6' _cell_volume 553.27688869 _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 0.20081460 0.79918540 0.44074211 1.0 Hf Hf1 1 0.20081460 0.40163119 0.44074211 1.0 Hf Hf2 1 0.59836881 0.79918540 0.44074211 1.0 Hf Hf3 1 0.79918540 0.20081460 0.55925789 1.0 Hf Hf4 1 0.79918540 0.59836881 0.55925789 1.0 Hf Hf5 1 0.40163119 0.20081460 0.55925789 1.0 Hf Hf6 1 0.79918540 0.20081460 0.94074211 1.0 Hf Hf7 1 0.79918540 0.59836881 0.94074211 1.0 Hf Hf8 1 0.40163119 0.20081460 0.94074211 1.0 Hf Hf9 1 0.20081460 0.79918540 0.05925789 1.0 Hf Hf10 1 0.20081460 0.40163119 0.05925789 1.0 Hf Hf11 1 0.59836881 0.79918540 0.05925789 1.0 Hf Hf12 1 0.54232177 0.45767823 0.25000000 1.0 Hf Hf13 1 0.54232177 0.08464254 0.25000000 1.0 Hf Hf14 1 0.91535746 0.45767823 0.25000000 1.0 Hf Hf15 1 0.45767823 0.54232177 0.75000000 1.0 Hf Hf16 1 0.45767823 0.91535746 0.75000000 1.0 Hf Hf17 1 0.08464254 0.54232177 0.75000000 1.0 Ta Ta18 1 0.00000000 0.00000000 0.50000000 1.0 Ta Ta19 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni20 1 0.33333300 0.66666700 0.25000000 1.0 Ni Ni21 1 0.66666700 0.33333300 0.75000000 1.0 W W22 1 0.88577983 0.11422017 0.25000000 1.0 W W23 1 0.88577983 0.77155967 0.25000000 1.0 W W24 1 0.22844033 0.11422017 0.25000000 1.0 W W25 1 0.11422017 0.88577983 0.75000000 1.0 W W26 1 0.11422017 0.22844033 0.75000000 1.0 W W27 1 0.77155967 0.88577983 0.75000000 1.0