data_[Cs4N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.7063]
_cell_length_b [4.6428]
_cell_length_c [9.6311]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6213]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [CsN]
_chemical_formula_sum '[Cs4 N4]'
_cell_volume [366.7008]
_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
[
  Cs  Cs0  2  0.0245  0.0000  0.2023  1.0
  Cs  Cs1  2  0.4206  0.5000  0.7321  1.0
  N  N2  2  0.1175  0.5000  0.0028  1.0
  N  N3  2  0.1904  0.5000  0.9185  1.0
]