data_[Na4Sn4Se10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Sn  1.9600  1.4500  0.8300
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.7542]
_cell_length_b [5.8980]
_cell_length_c [6.1877]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.4016]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2Sn2Se5]
_chemical_formula_sum '[Na4 Sn4 Se10]'
_cell_volume [535.3078]
_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  4  0.1534  0.5000  0.9083  1.0
  Sn  Sn1  4  0.1486  0.0000  0.4344  1.0
  Se  Se2  4  0.1409  0.0000  0.8582  1.0
  Se  Se3  4  0.1707  0.5000  0.4205  1.0
  Se  Se4  2  0.0000  0.0000  0.0000  1.0
]