data_[Dy2Zr2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Zr  1.3300  1.5500  0.8600
]
_symmetry_space_group_name_H-M [Pmma]
_cell_length_a [5.3626]
_cell_length_b [3.3651]
_cell_length_c [5.9721]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [DyZr]
_chemical_formula_sum '[Dy2 Zr2]'
_cell_volume [107.7692]
_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  0.0000  0.8342  1
  Zr  Zr1  2  0.2500  0.5000  0.3596  1
]