# generated using pymatgen data_K2Ba6Yb3Bi5O24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.76540977 _cell_length_b 12.76540977 _cell_length_c 6.04261619 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 140.98852037 _symmetry_Int_Tables_number 1 _chemical_formula_structural K2Ba6Yb3Bi5O24 _chemical_formula_sum 'K2 Ba6 Yb3 Bi5 O24' _cell_volume 619.83167482 _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 K K0 1 0.50000000 0.00000000 0.50000000 1.0 K K1 1 0.00000000 0.50000000 0.50000000 1.0 Ba Ba2 1 0.37635723 0.12608893 0.00000000 1.0 Ba Ba3 1 0.87391107 0.62364277 0.00000000 1.0 Ba Ba4 1 0.74750668 0.74750668 0.50000000 1.0 Ba Ba5 1 0.62364277 0.87391107 0.00000000 1.0 Ba Ba6 1 0.25249332 0.25249332 0.50000000 1.0 Ba Ba7 1 0.12608893 0.37635723 0.00000000 1.0 Yb Yb8 1 0.00000000 0.00000000 0.00000000 1.0 Yb Yb9 1 0.62742087 0.37257913 0.50000000 1.0 Yb Yb10 1 0.37257913 0.62742087 0.50000000 1.0 Bi Bi11 1 0.50000000 0.50000000 0.00000000 1.0 Bi Bi12 1 0.87494349 0.12505651 0.50000000 1.0 Bi Bi13 1 0.74891073 0.25108927 0.00000000 1.0 Bi Bi14 1 0.25108927 0.74891073 0.00000000 1.0 Bi Bi15 1 0.12505651 0.87494349 0.50000000 1.0 O O16 1 0.36790216 0.11996594 0.50000000 1.0 O O17 1 0.56177033 0.43822967 0.24814589 1.0 O O18 1 0.56177033 0.43822967 0.75185411 1.0 O O19 1 0.43822967 0.56177033 0.24814589 1.0 O O20 1 0.43822967 0.56177033 0.75185411 1.0 O O21 1 0.88003406 0.63209784 0.50000000 1.0 O O22 1 0.74612419 0.74612419 0.00000000 1.0 O O23 1 0.63209784 0.88003406 0.50000000 1.0 O O24 1 0.50000000 0.00000000 0.00000000 1.0 O O25 1 0.06369864 0.93630136 0.25426786 1.0 O O26 1 0.06369864 0.93630136 0.74573214 1.0 O O27 1 0.93630136 0.06369864 0.74573214 1.0 O O28 1 0.93630136 0.06369864 0.25426786 1.0 O O29 1 0.81520128 0.18479872 0.23406437 1.0 O O30 1 0.81520128 0.18479872 0.76593563 1.0 O O31 1 0.68731916 0.31268084 0.76288326 1.0 O O32 1 0.68731916 0.31268084 0.23711674 1.0 O O33 1 0.25387581 0.25387581 0.00000000 1.0 O O34 1 0.00000000 0.50000000 0.00000000 1.0 O O35 1 0.11996594 0.36790216 0.50000000 1.0 O O36 1 0.31268084 0.68731916 0.23711674 1.0 O O37 1 0.31268084 0.68731916 0.76288326 1.0 O O38 1 0.18479872 0.81520128 0.76593563 1.0 O O39 1 0.18479872 0.81520128 0.23406437 1.0