data_[Na3In12Sb3S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  In  1.7800  1.5500  0.9400
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [7.9126]
_cell_length_b [7.9126]
_cell_length_c [19.3362]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [NaIn4SbS8]
_chemical_formula_sum '[Na3 In12 Sb3 S24]'
_cell_volume [1048.4255]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.3757  1
  In  In1  9  0.1736  0.3471  0.8338  1
  In  In2  3  0.0000  0.0000  0.6212  1
  Sb  Sb3  3  0.0000  0.0000  0.0097  1
  S  S4  9  0.0290  0.5145  0.7559  1
  S  S5  9  0.1731  0.3463  0.5755  1
  S  S6  3  0.0000  0.0000  0.2399  1
  S  S7  3  0.0000  0.0000  0.7581  1
]