# generated using pymatgen data_BaSrSmWO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.96825930 _cell_length_b 5.96825930 _cell_length_c 8.69370480 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaSrSmWO6 _chemical_formula_sum 'Ba2 Sr2 Sm2 W2 O12' _cell_volume 309.67080015 _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 0.50000000 1.0 Ba Ba1 1 -0.00000000 -0.00000000 0.50000000 1.0 Sr Sr2 1 0.50000000 0.50000000 0.00000000 1.0 Sr Sr3 1 -0.00000000 -0.00000000 0.00000000 1.0 Sm Sm4 1 0.50000000 -0.00000000 0.75152981 1.0 Sm Sm5 1 0.00000000 0.50000000 0.24847019 1.0 W W6 1 0.50000000 -0.00000000 0.24151482 1.0 W W7 1 -0.00000000 0.50000000 0.75848518 1.0 O O8 1 0.50000000 -0.00000000 0.01095221 1.0 O O9 1 -0.00000000 0.50000000 0.98904779 1.0 O O10 1 0.50000000 -0.00000000 0.48123429 1.0 O O11 1 -0.00000000 0.50000000 0.51876571 1.0 O O12 1 0.71492440 0.67746644 0.75992855 1.0 O O13 1 0.28507560 0.32253356 0.75992855 1.0 O O14 1 0.82253356 0.21492440 0.75992855 1.0 O O15 1 0.17746644 0.78507560 0.75992855 1.0 O O16 1 0.78507560 0.17746644 0.24007145 1.0 O O17 1 0.21492440 0.82253356 0.24007145 1.0 O O18 1 0.67746644 0.71492440 0.24007145 1.0 O O19 1 0.32253356 0.28507560 0.24007145 1.0