# generated using pymatgen data_BaMg4Si3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.60960111 _cell_length_b 4.60960111 _cell_length_c 8.59931776 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaMg4Si3 _chemical_formula_sum 'Ba1 Mg4 Si3' _cell_volume 182.72193606 _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 -0.00000000 -0.00000000 0.00000000 1.0 Mg Mg1 1 0.50000000 -0.00000000 0.68318672 1.0 Mg Mg2 1 0.00000000 0.50000000 0.68318672 1.0 Mg Mg3 1 0.50000000 -0.00000000 0.31681328 1.0 Mg Mg4 1 -0.00000000 0.50000000 0.31681328 1.0 Si Si5 1 -0.00000000 -0.00000000 0.50000000 1.0 Si Si6 1 0.50000000 0.50000000 0.85742860 1.0 Si Si7 1 0.50000000 0.50000000 0.14257140 1.0