# generated using pymatgen data_BaLi2SmSi4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.88981877 _cell_length_b 8.12662536 _cell_length_c 11.02785331 _cell_angle_alpha 89.82139500 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaLi2SmSi4 _chemical_formula_sum 'Ba2 Li4 Sm2 Si8' _cell_volume 348.60087803 _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 0.25000000 0.63826136 0.63282596 1.0 Ba Ba1 1 0.75000000 0.36173864 0.36717404 1.0 Li Li2 1 0.25000000 0.00567482 0.38436721 1.0 Li Li3 1 0.75000000 0.99432518 0.61563279 1.0 Li Li4 1 0.25000000 0.49458302 0.10558643 1.0 Li Li5 1 0.75000000 0.50541698 0.89441357 1.0 Sm Sm6 1 0.25000000 0.12159540 0.87035628 1.0 Sm Sm7 1 0.75000000 0.87840460 0.12964372 1.0 Si Si8 1 0.75000000 0.26003287 0.05957650 1.0 Si Si9 1 0.25000000 0.73996713 0.94042350 1.0 Si Si10 1 0.75000000 0.79104884 0.40940068 1.0 Si Si11 1 0.25000000 0.20895116 0.59059932 1.0 Si Si12 1 0.75000000 0.83871430 0.83775689 1.0 Si Si13 1 0.25000000 0.16128570 0.16224311 1.0 Si Si14 1 0.75000000 0.31006022 0.69176055 1.0 Si Si15 1 0.25000000 0.68993978 0.30823945 1.0