data_[Ho12Pt2Se4S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Pt  2.2800  1.3500  0.8050
  Se  2.5500  1.1500  1.0133
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.9148]
_cell_length_b [11.9843]
_cell_length_c [6.8759]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6920]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho6PtSe2S3]
_chemical_formula_sum '[Ho12 Pt2 Se4 S6]'
_cell_volume [536.4789]
_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  8  0.2466  0.1628  0.2554  1.0
  Ho  Ho1  4  0.2377  0.0000  0.7383  1.0
  Pt  Pt2  2  0.0000  0.0000  0.0000  1.0
  Se  Se3  4  0.0000  0.3352  0.0000  1.0
  S  S4  4  0.0000  0.1735  0.5000  1.0
  S  S5  2  0.0000  0.5000  0.5000  1.0
]