data_[Rh4Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rh  2.2800  1.3500  0.7450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.0930]
_cell_length_b [10.5486]
_cell_length_c [6.5209]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.1375]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [RhCl3]
_chemical_formula_sum '[Rh4 Cl12]'
_cell_volume [398.2894]
_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
[
  Rh  Rh0  4  0.0000  0.1667  0.0000  1.0
  Cl  Cl1  8  0.2475  0.3231  0.2119  1.0
  Cl  Cl2  4  0.2168  0.0000  0.2123  1.0
]