data_[Ba4Si4Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Si  1.9000  1.1000  0.5400
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.8950]
_cell_length_b [7.2726]
_cell_length_c [7.8553]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.2495]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [BaSiRh]
_chemical_formula_sum '[Ba4 Si4 Rh4]'
_cell_volume [325.5925]
_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  0.1772  0.5958  0.8145  1.0
  Si  Si1  4  0.3831  0.1554  0.7738  1.0
  Rh  Rh2  4  0.4057  0.1184  0.0819  1.0
]