data_[Dy2Th2Be2N6]
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
  Be  1.5700  1.0500  0.5900
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.8942]
_cell_length_b [3.3794]
_cell_length_c [7.2551]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2917]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [DyThBeN3]
_chemical_formula_sum '[Dy2 Th2 Be2 N6]'
_cell_volume [166.3124]
_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  2  0.1850  0.7500  0.6527  1
  Th  Th1  2  0.2131  0.7500  0.1765  1
  Be  Be2  2  0.3973  0.2500  0.9247  1
  N  N3  2  0.1445  0.2500  0.8845  1
  N  N4  2  0.1665  0.2500  0.4039  1
  N  N5  2  0.4941  0.7500  0.8469  1
]