# generated using pymatgen data_BaSrMg6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.38589900 _cell_length_b 7.27436300 _cell_length_c 12.83155100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaSrMg6 _chemical_formula_sum 'Ba2 Sr2 Mg12' _cell_volume 502.72713655 _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 Ba Ba0 1 0.50000000 0.50000000 0.16810000 1.0 Ba Ba1 1 0.50000000 0.00000000 0.66810000 1.0 Sr Sr2 1 0.50000000 0.00000000 0.16814100 1.0 Sr Sr3 1 0.50000000 0.50000000 0.66814100 1.0 Mg Mg4 1 0.50000000 0.25231400 0.41982100 1.0 Mg Mg5 1 0.50000000 0.74768600 0.41982100 1.0 Mg Mg6 1 0.00000000 0.75565100 0.05819000 1.0 Mg Mg7 1 0.00000000 0.24434900 0.05819000 1.0 Mg Mg8 1 0.00000000 0.00000000 0.35321300 1.0 Mg Mg9 1 0.00000000 0.50000000 0.35452000 1.0 Mg Mg10 1 0.50000000 0.75231400 0.91982100 1.0 Mg Mg11 1 0.50000000 0.24768600 0.91982100 1.0 Mg Mg12 1 0.00000000 0.25565100 0.55819000 1.0 Mg Mg13 1 0.00000000 0.74434900 0.55819000 1.0 Mg Mg14 1 0.00000000 0.50000000 0.85321300 1.0 Mg Mg15 1 0.00000000 0.00000000 0.85452000 1.0