data_[Dy2Th3Sc7]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Th  1.3000  1.8000  1.0800
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.0250]
_cell_length_b [3.3498]
_cell_length_c [16.5823]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.5796]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Dy2Th3Sc7]
_chemical_formula_sum '[Dy2 Th3 Sc7]'
_cell_volume [332.4738]
_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  0.0419  0.5000  0.6760  1
  Th  Th1  2  0.4612  0.0000  0.3387  1
  Th  Th2  1  0.5000  0.5000  0.0000  1
  Sc  Sc3  2  0.2339  0.5000  0.1633  1
  Sc  Sc4  2  0.2568  0.5000  0.5039  1
  Sc  Sc5  2  0.2759  0.0000  0.8376  1
  Sc  Sc6  1  0.0000  0.0000  0.0000  1
]