data_[Dy6Zr2Sc8]
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
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [10.6687]
_cell_length_b [6.8579]
_cell_length_c [5.9373]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Dy3ZrSc4]
_chemical_formula_sum '[Dy6 Zr2 Sc8]'
_cell_volume [434.4002]
_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  4  0.2467  0.3700  0.0187  1.0
  Dy  Dy1  2  0.0000  0.3723  0.3635  1.0
  Zr  Zr2  2  0.0000  0.6352  0.8523  1.0
  Sc  Sc3  4  0.2434  0.8779  0.0170  1.0
  Sc  Sc4  2  0.0000  0.1127  0.8518  1.0
  Sc  Sc5  2  0.0000  0.8729  0.3458  1.0
]