data_[Dy2Cl2F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Cl  3.1600  1.0000  0.7800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.4567]
_cell_length_b [4.4597]
_cell_length_c [6.6153]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.4308]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [DyClF]
_chemical_formula_sum '[Dy2 Cl2 F2]'
_cell_volume [130.6526]
_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  0.2500  0.2500  0.4999  1
  Cl  Cl1  2  0.2058  0.7500  0.2331  1
  F  F2  2  0.2777  0.7500  0.6638  1
]