data_[Pm2Dy6Th4N12]
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
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.5082]
_cell_length_b [3.5706]
_cell_length_c [7.1261]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.1679]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PmDy3Th2N6]
_chemical_formula_sum '[Pm2 Dy6 Th4 N12]'
_cell_volume [384.2243]
_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
[
  Pm  Pm0  2  0.0000  0.5000  0.0000  1
  Dy  Dy1  4  0.1647  0.0000  0.8344  1
  Dy  Dy2  2  0.0000  0.5000  0.5000  1
  Th  Th3  4  0.1653  0.0000  0.3296  1
  N  N4  4  0.0008  0.0000  0.2580  1
  N  N5  4  0.1657  0.5000  0.5846  1
  N  N6  4  0.1691  0.5000  0.0833  1
]