data_[K3Sm3Dy12S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Sm  1.1700  1.8500  1.2290
  Dy  1.2200  1.7500  1.1310
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.2145]
_cell_length_b [8.2145]
_cell_length_c [20.3780]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [KSm(DyS2)4]
_chemical_formula_sum '[K3 Sm3 Dy12 S24]'
_cell_volume [1190.8459]
_cell_formula_units_Z [3]
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
[
  K  K0  3  0.0000  0.0000  0.3728  1.0
  Sm  Sm1  3  0.0000  0.0000  0.0045  1.0
  Dy  Dy2  9  0.1725  0.3451  0.8319  1.0
  Dy  Dy3  3  0.0000  0.0000  0.6253  1.0
  S  S4  9  0.0408  0.5204  0.7576  1.0
  S  S5  9  0.1751  0.3502  0.5797  1.0
  S  S6  3  0.0000  0.0000  0.2327  1.0
  S  S7  3  0.0000  0.0000  0.7573  1.0
]