data_[Pm2Dy4Th3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Dy  1.2200  1.7500  1.1310
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.5716]
_cell_length_b [3.5716]
_cell_length_c [26.6681]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [Pm2Dy4Th3]
_chemical_formula_sum '[Pm2 Dy4 Th3]'
_cell_volume [294.6050]
_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
[
  Pm  Pm0  1  0.0000  0.0000  0.0918  1
  Pm  Pm1  1  0.0000  0.0000  0.8709  1
  Dy  Dy2  1  0.0000  0.0000  0.2187  1
  Dy  Dy3  1  0.0000  0.0000  0.4352  1
  Dy  Dy4  1  0.3333  0.6667  0.5421  1
  Dy  Dy5  1  0.3333  0.6667  0.7597  1
  Th  Th6  1  0.0000  0.0000  0.6513  1
  Th  Th7  1  0.3333  0.6667  0.3245  1
  Th  Th8  1  0.3333  0.6667  0.9829  1
]