data_[Cs4Ho4Pb4]
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
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [29.7388]
_cell_length_b [3.8056]
_cell_length_c [4.7509]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.9099]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsHoPb]
_chemical_formula_sum '[Cs4 Ho4 Pb4]'
_cell_volume [537.6119]
_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
[
  Cs  Cs0  4  0.0835  0.0000  0.7329  1.0
  Ho  Ho1  4  0.2147  0.0000  0.7463  1.0
  Pb  Pb2  4  0.1751  0.5000  0.2420  1.0
]