data_[Ce4Th8Re4N16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Th  1.3000  1.8000  1.0800
  Re  1.9000  1.3500  0.7125
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.4038]
_cell_length_b [12.1514]
_cell_length_c [12.1408]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [CeTh2ReN4]
_chemical_formula_sum '[Ce4 Th8 Re4 N16]'
_cell_volume [502.1623]
_cell_formula_units_Z [4]
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
[
  Ce  Ce0  4  0.0000  0.1106  0.7500  1
  Th  Th1  8  0.0000  0.3671  0.5508  1
  Re  Re2  4  0.0000  0.1511  0.2500  1
  N  N3  8  0.0000  0.2798  0.1333  1
  N  N4  4  0.0000  0.0000  0.0000  1
  N  N5  4  0.0000  0.4571  0.7500  1
]