# generated using pymatgen data_Rb5Tl9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.43827861 _cell_length_b 10.43832030 _cell_length_c 17.84151011 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99991105 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb5Tl9 _chemical_formula_sum 'Rb15 Tl27' _cell_volume 1683.53494332 _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 Rb Rb0 1 0.61304054 -0.00000000 0.18518728 1.0 Rb Rb1 1 0.38695736 0.38695807 0.18518697 1.0 Rb Rb2 1 -0.00000071 0.61304193 0.18518697 1.0 Rb Rb3 1 0.61304054 -0.00000000 0.81481272 1.0 Rb Rb4 1 0.38695736 0.38695807 0.81481303 1.0 Rb Rb5 1 -0.00000071 0.61304193 0.81481303 1.0 Rb Rb6 1 0.66667396 0.33332394 0.00000000 1.0 Rb Rb7 1 0.33335202 0.66667606 0.00000000 1.0 Rb Rb8 1 0.27334334 -0.00000000 0.31436004 1.0 Rb Rb9 1 0.72663825 0.72664223 0.31435838 1.0 Rb Rb10 1 0.99999602 0.27335677 0.31435838 1.0 Rb Rb11 1 0.27334334 -0.00000000 0.68563996 1.0 Rb Rb12 1 0.72663825 0.72664223 0.68564162 1.0 Rb Rb13 1 0.99999602 0.27335677 0.68564162 1.0 Rb Rb14 1 0.99999357 0.00000000 0.50000000 1.0 Tl Tl15 1 -0.00000002 0.00000000 0.14881342 1.0 Tl Tl16 1 -0.00000002 0.00000000 0.85118658 1.0 Tl Tl17 1 0.78616838 -0.00000000 0.00000000 1.0 Tl Tl18 1 0.21383120 0.21382409 0.00000000 1.0 Tl Tl19 1 0.00000811 0.78617591 0.00000000 1.0 Tl Tl20 1 0.28208802 0.00000000 0.09105708 1.0 Tl Tl21 1 0.71791390 0.71791392 0.09104706 1.0 Tl Tl22 1 -0.00000102 0.28208608 0.09104706 1.0 Tl Tl23 1 0.28208802 0.00000000 0.90894292 1.0 Tl Tl24 1 0.71791390 0.71791392 0.90895294 1.0 Tl Tl25 1 -0.00000102 0.28208608 0.90895294 1.0 Tl Tl26 1 0.17307704 0.46289017 0.50000000 1.0 Tl Tl27 1 0.28978260 0.82690067 0.50000000 1.0 Tl Tl28 1 0.53710829 0.71021071 0.50000000 1.0 Tl Tl29 1 0.71018588 0.53710983 0.50000000 1.0 Tl Tl30 1 0.46288393 0.17309933 0.50000000 1.0 Tl Tl31 1 0.82689659 0.28978829 0.50000000 1.0 Tl Tl32 1 0.62050429 0.00000000 0.39822691 1.0 Tl Tl33 1 0.37949926 0.37950515 0.39823149 1.0 Tl Tl34 1 -0.00000689 0.62049485 0.39823049 1.0 Tl Tl35 1 0.62050429 0.00000000 0.60177309 1.0 Tl Tl36 1 0.37949926 0.37950515 0.60176851 1.0 Tl Tl37 1 -0.00000689 0.62049485 0.60176951 1.0 Tl Tl38 1 0.33333096 0.66666306 0.34553594 1.0 Tl Tl39 1 0.33333096 0.66666306 0.65446406 1.0 Tl Tl40 1 0.66666591 0.33333694 0.34553594 1.0 Tl Tl41 1 0.66666591 0.33333694 0.65446406 1.0