data_[Th12Ru2Pt4S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Ru  2.2000  1.3000  0.6610
  Pt  2.2800  1.3500  0.8050
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.4189]
_cell_length_b [4.0891]
_cell_length_c [8.5114]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.4504]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Th6RuPt2S3]
_chemical_formula_sum '[Th12 Ru2 Pt4 S6]'
_cell_volume [614.8152]
_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
[
  Th  Th0  4  0.0008  0.0000  0.2351  1
  Th  Th1  4  0.1593  0.5000  0.0855  1
  Th  Th2  4  0.1670  0.5000  0.5827  1
  Ru  Ru3  2  0.0000  0.5000  0.0000  1
  Pt  Pt4  4  0.1674  0.0000  0.3371  1
  S  S5  4  0.1687  0.0000  0.8343  1
  S  S6  2  0.0000  0.5000  0.5000  1
]