data_[Na2Th2Mo2N8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Th  1.3000  1.8000  1.0800
  Mo  2.1600  1.4500  0.7750
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.4448]
_cell_length_b [5.9832]
_cell_length_c [7.2653]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.1148]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [NaThMoN4]
_chemical_formula_sum '[Na2 Th2 Mo2 N8]'
_cell_volume [279.9630]
_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
[
  Na  Na0  2  0.3776  0.7500  0.8668  1
  Th  Th1  2  0.1765  0.7500  0.4188  1
  Mo  Mo2  2  0.3291  0.2500  0.6539  1
  N  N3  4  0.1374  0.0129  0.6603  1
  N  N4  2  0.4321  0.7500  0.1902  1
  N  N5  2  0.4534  0.2500  0.4296  1
]