data_[Ho12Si2C4S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Si  1.9000  1.1000  0.5400
  C  2.5500  0.7000  0.3000
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.8775]
_cell_length_b [3.7520]
_cell_length_c [7.8622]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0737]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho6SiC2S3]
_chemical_formula_sum '[Ho12 Si2 C4 S6]'
_cell_volume [482.9262]
_cell_formula_units_Z [2]
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
[
  Ho  Ho0  4  0.0146  0.0000  0.2627  1.0
  Ho  Ho1  4  0.1704  0.5000  0.1190  1.0
  Ho  Ho2  4  0.1770  0.5000  0.5629  1.0
  Si  Si3  2  0.0000  0.5000  0.0000  1.0
  C  C4  4  0.1707  0.0000  0.3411  1.0
  S  S5  4  0.1642  0.0000  0.8309  1.0
  S  S6  2  0.0000  0.5000  0.5000  1.0
]