data_[Cs4Ho4Mn4S12]
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
  Mn  1.5500  1.4000  0.6483
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [15.6973]
_cell_length_b [4.0927]
_cell_length_c [10.7919]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [CsHoMnS3]
_chemical_formula_sum '[Cs4 Ho4 Mn4 S12]'
_cell_volume [693.3238]
_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  0.2373  0.2500  0.4670  1
  Ho  Ho1  4  0.0187  0.2500  0.1496  1
  Mn  Mn2  4  0.0161  0.7500  0.3972  1
  S  S3  4  0.0686  0.7500  0.6143  1
  S  S4  4  0.0852  0.2500  0.9224  1
  S  S5  4  0.1202  0.7500  0.2438  1
]