data_[Cs6Ho3Cr9Cl36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ho  1.2300  1.7500  1.0410
  Cr  1.6600  1.4000  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [9.1060]
_cell_length_b [9.1060]
_cell_length_c [22.9385]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Cs2Ho(CrCl4)3]
_chemical_formula_sum '[Cs6 Ho3 Cr9 Cl36]'
_cell_volume [1647.2321]
_cell_formula_units_Z [3]
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
[
  Cs  Cs0  6  0.0000  0.0000  0.3932  1.0
  Ho  Ho1  3  0.0000  0.0000  0.0000  1.0
  Cr  Cr2  9  0.0000  0.5000  0.5000  1.0
  Cl  Cl3  18  0.0480  0.5240  0.6064  1.0
  Cl  Cl4  18  0.0716  0.5358  0.8484  1.0
]