# generated using pymatgen data_Hf9BW4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.58545377 _cell_length_b 8.58545377 _cell_length_c 8.54572800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999822 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf9BW4 _chemical_formula_sum 'Hf18 B2 W8' _cell_volume 545.51439229 _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 0.53884200 0.07768400 0.25000000 1.0 Hf Hf1 1 0.46115800 0.92231600 0.75000000 1.0 Hf Hf2 1 0.92231600 0.46115800 0.25000000 1.0 Hf Hf3 1 0.07768400 0.53884200 0.75000000 1.0 Hf Hf4 1 0.53884200 0.46115800 0.25000000 1.0 Hf Hf5 1 0.46115800 0.53884200 0.75000000 1.0 Hf Hf6 1 0.20299400 0.40598700 0.05541300 1.0 Hf Hf7 1 0.79700600 0.59401300 0.94458700 1.0 Hf Hf8 1 0.59401300 0.79700600 0.05541300 1.0 Hf Hf9 1 0.79700600 0.59401300 0.55541300 1.0 Hf Hf10 1 0.40598700 0.20299400 0.94458700 1.0 Hf Hf11 1 0.20299400 0.40598700 0.44458700 1.0 Hf Hf12 1 0.20299400 0.79700600 0.05541300 1.0 Hf Hf13 1 0.40598700 0.20299400 0.55541300 1.0 Hf Hf14 1 0.79700600 0.20299400 0.94458700 1.0 Hf Hf15 1 0.59401300 0.79700600 0.44458700 1.0 Hf Hf16 1 0.79700600 0.20299400 0.55541300 1.0 Hf Hf17 1 0.20299400 0.79700600 0.44458700 1.0 B B18 1 0.33333300 0.66666700 0.25000000 1.0 B B19 1 0.66666700 0.33333300 0.75000000 1.0 W W20 1 0.00000000 0.00000000 0.00000000 1.0 W W21 1 0.00000000 0.00000000 0.50000000 1.0 W W22 1 0.88854100 0.77708200 0.25000000 1.0 W W23 1 0.11145900 0.22291800 0.75000000 1.0 W W24 1 0.22291800 0.11145900 0.25000000 1.0 W W25 1 0.77708200 0.88854100 0.75000000 1.0 W W26 1 0.88854100 0.11145900 0.25000000 1.0 W W27 1 0.11145900 0.88854100 0.75000000 1.0