data_[Th2Zr2Te2N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Zr  1.3300  1.5500  0.8600
  Te  2.1000  1.4000  1.2933
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.9695]
_cell_length_b [4.1432]
_cell_length_c [7.7951]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5112]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [ThZrTeN2]
_chemical_formula_sum '[Th2 Zr2 Te2 N4]'
_cell_volume [212.1644]
_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
[
  Th  Th0  2  0.3228  0.2500  0.0716  1
  Zr  Zr1  2  0.3661  0.2500  0.5828  1
  Te  Te2  2  0.0382  0.7500  0.7320  1
  N  N3  2  0.4829  0.7500  0.1270  1
  N  N4  2  0.4858  0.7500  0.6129  1
]