data_[Na8Sr12N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Sr  0.9500  2.0000  1.3200
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [18.8299]
_cell_length_b [6.4580]
_cell_length_c [7.5987]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.2893]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Na2Sr3N]
_chemical_formula_sum '[Na8 Sr12 N4]'
_cell_volume [906.1513]
_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
[
  Na  Na0  8  0.2088  0.5000  0.1061  1.0
  Sr  Sr1  8  0.0910  0.0003  0.0435  1.0
  Sr  Sr2  4  0.0000  0.4460  0.2500  1.0
  N  N3  4  0.0000  0.0701  0.2500  1.0
]