data_[K2Ba28Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ba  0.8900  2.1500  1.4900
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [12.1641]
_cell_length_b [11.1111]
_cell_length_c [14.2109]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [KBa14Rh]
_chemical_formula_sum '[K2 Ba28 Rh2]'
_cell_volume [1920.7065]
_cell_formula_units_Z [2]
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  2  0.5000  0.0000  0.1245  1
  Ba  Ba1  8  0.3137  0.1823  0.6300  1
  Ba  Ba2  4  0.0000  0.2195  0.8451  1
  Ba  Ba3  4  0.2324  0.0000  0.3463  1
  Ba  Ba4  4  0.2829  0.0000  0.8910  1
  Ba  Ba5  4  0.5000  0.2390  0.3678  1
  Ba  Ba6  2  0.0000  0.0000  0.1098  1
  Ba  Ba7  2  0.0000  0.0000  0.5861  1
  Rh  Rh8  2  0.5000  0.0000  0.7589  1
]