# generated using pymatgen data_HfMg6BO7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.24968366 _cell_length_b 4.17639756 _cell_length_c 4.17639756 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfMg6BO7 _chemical_formula_sum 'Hf1 Mg6 B1 O7' _cell_volume 178.77802224 _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 0.50238411 0.00000000 -0.00000000 1.0 Mg Mg1 1 0.97588164 0.50000000 0.50000000 1.0 Mg Mg2 1 0.55272527 0.50000000 0.50000000 1.0 Mg Mg3 1 0.19167579 0.00000000 0.50000000 1.0 Mg Mg4 1 0.76970934 -0.00000000 0.50000000 1.0 Mg Mg5 1 0.19167579 0.50000000 -0.00000000 1.0 Mg Mg6 1 0.76970934 0.50000000 0.00000000 1.0 B B7 1 0.01870020 0.00000000 -0.00000000 1.0 O O8 1 0.30979592 0.00000000 -0.00000000 1.0 O O9 1 0.71923043 0.00000000 -0.00000000 1.0 O O10 1 0.75163778 0.50000000 0.50000000 1.0 O O11 1 0.96869532 -0.00000000 0.50000000 1.0 O O12 1 0.52974187 0.00000000 0.50000000 1.0 O O13 1 0.96869532 0.50000000 0.00000000 1.0 O O14 1 0.52974187 0.50000000 -0.00000000 1.0