data_[Y4Ho4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ho  1.2300  1.7500  1.0410
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.8893]
_cell_length_b [4.0915]
_cell_length_c [8.3258]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.4131]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [YHoS3]
_chemical_formula_sum '[Y4 Ho4 S12]'
_cell_volume [480.4863]
_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
[
  Y  Y0  4  0.1306  0.5000  0.7911  1
  Ho  Ho1  4  0.1473  0.0000  0.2611  1
  S  S2  4  0.0449  0.0000  0.8620  1
  S  S3  4  0.1443  0.5000  0.4747  1
  S  S4  4  0.2336  0.5000  0.1564  1
]