data_[Zn8Sb4N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Sb  2.0500  1.4500  0.8300
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [10.1064]
_cell_length_b [5.8245]
_cell_length_c [5.4673]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Zn2SbN3]
_chemical_formula_sum '[Zn8 Sb4 N12]'
_cell_volume [321.8288]
_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
[
  Zn  Zn0  8  0.1721  0.3375  0.0268  1.0
  Sb  Sb1  4  0.0000  0.1780  0.5384  1.0
  N  N2  8  0.1649  0.3324  0.6517  1.0
  N  N3  4  0.0000  0.1582  0.1602  1.0
]