data_[K2Dy2In2Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Dy  1.2200  1.7500  1.1310
  In  1.7800  1.5500  0.9400
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.6468]
_cell_length_b [4.0947]
_cell_length_c [11.3175]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0970]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KDyInSe3]
_chemical_formula_sum '[K2 Dy2 In2 Se6]'
_cell_volume [383.0005]
_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
[
  K  K0  2  0.2309  0.2500  0.2645  1.0
  Dy  Dy1  2  0.3537  0.7500  0.8546  1.0
  In  In2  2  0.1339  0.2500  0.5785  1.0
  Se  Se3  2  0.1030  0.2500  0.8053  1.0
  Se  Se4  2  0.3449  0.7500  0.5879  1.0
  Se  Se5  2  0.4085  0.7500  0.1138  1.0
]