data_[K6Rh6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [17.4946]
_cell_length_b [2.9611]
_cell_length_c [5.7258]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [KRh]
_chemical_formula_sum '[K6 Rh6]'
_cell_volume [296.6157]
_cell_formula_units_Z [6]
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  4  0.1914  0.4921  0.9096  1
  K  K1  2  0.0000  0.9912  0.9280  1
  Rh  Rh2  4  0.1202  0.9889  0.4132  1
  Rh  Rh3  2  0.0000  0.4886  0.4283  1
]