# generated using pymatgen data_Mg6BSb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.47962200 _cell_length_b 5.95149500 _cell_length_c 13.03259400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6BSb _chemical_formula_sum 'Mg12 B2 Sb2' _cell_volume 347.45479379 _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 Mg Mg0 1 0.00000000 0.24665200 0.06369200 1.0 Mg Mg1 1 0.00000000 0.75334800 0.06369200 1.0 Mg Mg2 1 0.00000000 0.00000000 0.32319200 1.0 Mg Mg3 1 0.50000000 0.72439100 0.39696400 1.0 Mg Mg4 1 0.50000000 0.27560900 0.39696400 1.0 Mg Mg5 1 0.50000000 0.00000000 0.17809500 1.0 Mg Mg6 1 0.00000000 0.74665200 0.56369200 1.0 Mg Mg7 1 0.00000000 0.25334800 0.56369200 1.0 Mg Mg8 1 0.00000000 0.50000000 0.82319200 1.0 Mg Mg9 1 0.50000000 0.22439100 0.89696400 1.0 Mg Mg10 1 0.50000000 0.77560900 0.89696400 1.0 Mg Mg11 1 0.50000000 0.50000000 0.67809500 1.0 B B12 1 0.00000000 0.50000000 0.41961300 1.0 B B13 1 0.00000000 0.00000000 0.91961300 1.0 Sb Sb14 1 0.50000000 0.50000000 0.15779000 1.0 Sb Sb15 1 0.50000000 0.00000000 0.65779000 1.0