# generated using pymatgen data_BaSrPb6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.26359630 _cell_length_b 7.26359630 _cell_length_c 17.54980400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000269 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaSrPb6 _chemical_formula_sum 'Ba3 Sr3 Pb18' _cell_volume 801.87428667 _cell_formula_units_Z 3 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 0.33333300 0.66666700 0.24994000 1.0 Ba Ba1 1 0.33333300 0.66666700 0.75003100 1.0 Ba Ba2 1 0.00000000 0.00000000 0.41115700 1.0 Sr Sr3 1 0.66666700 0.33333300 0.58849900 1.0 Sr Sr4 1 0.66666700 0.33333300 0.91148900 1.0 Sr Sr5 1 0.00000000 0.00000000 0.08878800 1.0 Pb Pb6 1 0.99871900 0.49935900 0.41963900 1.0 Pb Pb7 1 0.50064100 0.49935900 0.41963900 1.0 Pb Pb8 1 0.50064100 0.00128100 0.41963900 1.0 Pb Pb9 1 0.66540600 0.83270300 0.58081400 1.0 Pb Pb10 1 0.16729700 0.83270300 0.58081400 1.0 Pb Pb11 1 0.16729700 0.33459400 0.58081400 1.0 Pb Pb12 1 0.66749800 0.83374900 0.91981200 1.0 Pb Pb13 1 0.16625100 0.83374900 0.91981200 1.0 Pb Pb14 1 0.16625100 0.33250200 0.91981200 1.0 Pb Pb15 1 0.99888700 0.49944400 0.08035600 1.0 Pb Pb16 1 0.50055600 0.49944400 0.08035600 1.0 Pb Pb17 1 0.50055600 0.00111300 0.08035600 1.0 Pb Pb18 1 0.36788800 0.18394400 0.24910800 1.0 Pb Pb19 1 0.81605600 0.18394400 0.24910800 1.0 Pb Pb20 1 0.81605600 0.63211200 0.24910800 1.0 Pb Pb21 1 0.30063000 0.15031500 0.75012300 1.0 Pb Pb22 1 0.84968500 0.15031500 0.75012300 1.0 Pb Pb23 1 0.84968500 0.69937000 0.75012300 1.0