data_[Ba4Sn4Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sn  1.9600  1.4500  0.8300
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.8730]
_cell_length_b [7.2194]
_cell_length_c [8.6650]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.0970]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [BaSnRh]
_chemical_formula_sum '[Ba4 Sn4 Rh4]'
_cell_volume [360.1885]
_cell_formula_units_Z [4]
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
[
  Ba  Ba0  4  0.2038  0.6399  0.4158  1.0
  Sn  Sn1  4  0.2957  0.1353  0.5903  1.0
  Rh  Rh2  4  0.3722  0.1048  0.3244  1.0
]