data_[La2Sm2Dy2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  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 [P2_1/m]
_cell_length_a [6.9338]
_cell_length_b [3.9437]
_cell_length_c [10.5252]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.5241]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LaSmDyS3]
_chemical_formula_sum '[La2 Sm2 Dy2 S6]'
_cell_volume [280.9619]
_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
[
  La  La0  2  0.3482  0.2500  0.3048  1.0
  Sm  Sm1  2  0.1265  0.2500  0.6334  1.0
  Dy  Dy2  2  0.2321  0.7500  0.9448  1.0
  S  S3  2  0.0505  0.7500  0.1520  1.0
  S  S4  2  0.2764  0.7500  0.4962  1.0
  S  S5  2  0.4517  0.2500  0.8445  1.0
]