data_[Dy2Cd4I16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Cd  1.6900  1.5500  1.0900
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.1515]
_cell_length_b [13.0482]
_cell_length_c [6.9888]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.4012]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Dy(CdI4)2]
_chemical_formula_sum '[Dy2 Cd4 I16]'
_cell_volume [1104.8501]
_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
[
  Dy  Dy0  2  0.0000  0.0000  0.0000  1.0
  Cd  Cd1  4  0.2389  0.0000  0.6629  1.0
  I  I2  8  0.1095  0.1673  0.7765  1.0
  I  I3  4  0.0302  0.5000  0.2537  1.0
  I  I4  4  0.2150  0.0000  0.2535  1.0
]