data_[Sm4Dy6Th2S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Dy  1.2200  1.7500  1.1310
  Th  1.3000  1.8000  1.0800
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.3277]
_cell_length_b [3.9503]
_cell_length_c [7.9601]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0915]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm2Dy3ThS6]
_chemical_formula_sum '[Sm4 Dy6 Th2 S12]'
_cell_volume [528.4765]
_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
[
  Sm  Sm0  4  0.1649  0.0000  0.3300  1
  Dy  Dy1  4  0.1658  0.0000  0.8343  1
  Dy  Dy2  2  0.0000  0.5000  0.5000  1
  Th  Th3  2  0.0000  0.5000  0.0000  1
  S  S4  4  0.0026  0.0000  0.7410  1
  S  S5  4  0.1656  0.5000  0.5890  1
  S  S6  4  0.1706  0.5000  0.0783  1
]