data_[Dy4Mg7Sc1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Mg  1.3100  1.5000  0.8600
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.2292]
_cell_length_b [5.2292]
_cell_length_c [13.1610]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Dy4Mg7Sc]
_chemical_formula_sum '[Dy4 Mg7 Sc1]'
_cell_volume [311.6610]
_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  2  0.3333  0.6667  0.6570  1
  Dy  Dy1  2  0.3333  0.6667  0.9183  1
  Mg  Mg2  2  0.0000  0.0000  0.2436  1
  Mg  Mg3  2  0.3333  0.6667  0.1837  1
  Mg  Mg4  2  0.3333  0.6667  0.4190  1
  Mg  Mg5  1  0.0000  0.0000  0.0000  1
  Sc  Sc6  1  0.0000  0.0000  0.5000  1
]