# generated using pymatgen data_BaMg6Al _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.75608046 _cell_length_b 7.75608046 _cell_length_c 4.97847200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 132.54938366 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaMg6Al _chemical_formula_sum 'Ba1 Mg6 Al1' _cell_volume 220.63187946 _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 Ba Ba0 1 0.29481600 0.70518400 0.50000000 1.0 Mg Mg1 1 0.32444800 0.19688000 0.50000000 1.0 Mg Mg2 1 0.80312000 0.67555200 0.50000000 1.0 Mg Mg3 1 0.17577300 0.31847700 0.00000000 1.0 Mg Mg4 1 0.68152300 0.82422700 0.00000000 1.0 Mg Mg5 1 0.70556900 0.29443100 0.00000000 1.0 Mg Mg6 1 0.12372900 0.87627100 0.00000000 1.0 Al Al7 1 0.89102900 0.10897100 0.50000000 1.0