# generated using pymatgen data_Hf5Nb(B2Ru5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.44289443 _cell_length_b 9.44289443 _cell_length_c 3.09168013 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf5Nb(B2Ru5)2 _chemical_formula_sum 'Hf5 Nb1 B4 Ru10' _cell_volume 275.67972307 _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 0.82354054 0.67506820 0.00000000 1.0 Hf Hf1 1 0.17645946 0.32493180 0.00000000 1.0 Hf Hf2 1 0.32493180 0.82354054 0.00000000 1.0 Hf Hf3 1 0.67506820 0.17645946 0.00000000 1.0 Hf Hf4 1 0.50000000 0.50000000 0.00000000 1.0 Nb Nb5 1 0.00000000 0.00000000 0.00000000 1.0 B B6 1 0.62019071 0.87801756 0.00000000 1.0 B B7 1 0.37980929 0.12198244 0.00000000 1.0 B B8 1 0.12198244 0.62019071 0.00000000 1.0 B B9 1 0.87801756 0.37980929 0.00000000 1.0 Ru Ru10 1 0.57331933 0.72096476 0.50000000 1.0 Ru Ru11 1 0.42668067 0.27903524 0.50000000 1.0 Ru Ru12 1 0.06851885 0.78226133 0.50000000 1.0 Ru Ru13 1 0.93148115 0.21773867 0.50000000 1.0 Ru Ru14 1 0.27903524 0.57331933 0.50000000 1.0 Ru Ru15 1 0.72096476 0.42668067 0.50000000 1.0 Ru Ru16 1 0.21773867 0.06851885 0.50000000 1.0 Ru Ru17 1 0.78226133 0.93148115 0.50000000 1.0 Ru Ru18 1 0.50000000 0.00000000 0.50000000 1.0 Ru Ru19 1 0.00000000 0.50000000 0.50000000 1.0