# generated using pymatgen data_Cs7O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 16.68373117 _cell_length_b 16.68373117 _cell_length_c 9.32175705 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000328 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cs7O _chemical_formula_sum 'Cs21 O3' _cell_volume 2247.06049043 _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 Cs Cs0 1 0.44389007 0.22194454 0.50000000 1.0 Cs Cs1 1 0.47815095 0.52184905 0.78245641 1.0 Cs Cs2 1 0.77805546 0.22194454 0.50000000 1.0 Cs Cs3 1 0.47815095 0.52184905 0.21754359 1.0 Cs Cs4 1 0.88317161 0.76634223 0.00000000 1.0 Cs Cs5 1 0.11551823 0.23103645 0.50000000 1.0 Cs Cs6 1 0.47815095 0.95630190 0.78245641 1.0 Cs Cs7 1 0.56017150 0.78008525 0.00000000 1.0 Cs Cs8 1 0.47815095 0.95630190 0.21754359 1.0 Cs Cs9 1 0.21991475 0.43982850 0.00000000 1.0 Cs Cs10 1 0.33333300 0.66666700 0.79790683 1.0 Cs Cs11 1 0.77805546 0.55610993 0.50000000 1.0 Cs Cs12 1 0.66666700 0.33333300 0.00000000 1.0 Cs Cs13 1 0.76896355 0.88448177 0.50000000 1.0 Cs Cs14 1 0.88317161 0.11682839 0.00000000 1.0 Cs Cs15 1 0.23365777 0.11682839 0.00000000 1.0 Cs Cs16 1 0.33333300 0.66666700 0.20209317 1.0 Cs Cs17 1 0.04369810 0.52184905 0.78245641 1.0 Cs Cs18 1 0.11551823 0.88448177 0.50000000 1.0 Cs Cs19 1 0.21991475 0.78008525 0.00000000 1.0 Cs Cs20 1 0.04369810 0.52184905 0.21754359 1.0 O O21 1 0.41386538 0.58613462 0.00000000 1.0 O O22 1 0.17227025 0.58613462 0.00000000 1.0 O O23 1 0.41386538 0.82772975 0.00000000 1.0