# generated using pymatgen data_Cs6Na4Tl13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.34673296 _cell_length_b 10.34673537 _cell_length_c 10.34673614 _cell_angle_alpha 109.47114730 _cell_angle_beta 109.47112035 _cell_angle_gamma 109.47112516 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs6Na4Tl13 _chemical_formula_sum 'Cs6 Na4 Tl13' _cell_volume 852.68673648 _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 Cs Cs0 1 0.82961747 0.32961803 0.49999979 1.0 Cs Cs1 1 0.17038231 0.67038203 0.50000026 1.0 Cs Cs2 1 0.32961730 0.49999997 0.82961774 1.0 Cs Cs3 1 0.67038282 0.50000022 0.17038237 1.0 Cs Cs4 1 0.50000001 0.82961782 0.32961739 1.0 Cs Cs5 1 0.50000021 0.17038215 0.67038263 1.0 Na Na6 1 0.50000012 0.50000000 0.50000000 1.0 Na Na7 1 0.50000004 -0.00000003 0.00000002 1.0 Na Na8 1 -0.00000003 0.50000001 0.00000001 1.0 Na Na9 1 -0.00000001 -0.00000002 0.50000002 1.0 Tl Tl10 1 0.00000045 0.00000036 0.00000041 1.0 Tl Tl11 1 0.86054807 0.76710262 0.62765219 1.0 Tl Tl12 1 0.13945180 0.23289721 0.37234745 1.0 Tl Tl13 1 0.13945153 0.76710312 0.90655356 1.0 Tl Tl14 1 0.86054850 0.23289692 0.09344648 1.0 Tl Tl15 1 0.76710233 0.62765221 0.86054813 1.0 Tl Tl16 1 0.23289754 0.37234744 0.13945179 1.0 Tl Tl17 1 0.76710313 0.90655346 0.13945153 1.0 Tl Tl18 1 0.23289681 0.09344653 0.86054861 1.0 Tl Tl19 1 0.62765223 0.86054810 0.76710223 1.0 Tl Tl20 1 0.37234734 0.13945177 0.23289748 1.0 Tl Tl21 1 0.09344669 0.86054895 0.23289701 1.0 Tl Tl22 1 0.90655332 0.13945113 0.76710292 1.0