data_[Dy12In4Se4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [Pnma]
_cell_length_a [9.0908]
_cell_length_b [3.9953]
_cell_length_c [15.1740]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Dy3InSe]
_chemical_formula_sum '[Dy12 In4 Se4]'
_cell_volume [551.1192]
_cell_formula_units_Z [4]
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
[
  Dy  Dy0  4  0.0375  0.7500  0.3835  1
  Dy  Dy1  4  0.1591  0.7500  0.9826  1
  Dy  Dy2  4  0.2087  0.2500  0.2205  1
  In  In3  4  0.0639  0.2500  0.8263  1
  Se  Se4  4  0.1604  0.7500  0.5552  1
]