data_[Dy1Hf1Cu6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Hf  1.3000  1.5500  0.8500
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [4.4932]
_cell_length_b [5.7312]
_cell_length_c [4.6808]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [DyHfCu6]
_chemical_formula_sum '[Dy1 Hf1 Cu6]'
_cell_volume [120.5369]
_cell_formula_units_Z [1]
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  1  0.0000  0.5000  0.8418  1
  Hf  Hf1  1  0.5000  0.0000  0.1485  1
  Cu  Cu2  2  0.0000  0.2227  0.3390  1
  Cu  Cu3  2  0.5000  0.2331  0.6482  1
  Cu  Cu4  1  0.0000  0.0000  0.8160  1
  Cu  Cu5  1  0.5000  0.5000  0.2193  1
]