data_[Na6Sc4In2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Sc  1.3600  1.6000  0.8850
  In  1.7800  1.5500  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.5675]
_cell_length_b [9.6436]
_cell_length_c [5.8218]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6209]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na3Sc2InO6]
_chemical_formula_sum '[Na6 Sc4 In2 O12]'
_cell_volume [296.2153]
_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  0.0000  0.1662  0.5000  1.0
  Na  Na1  2  0.0000  0.5000  0.5000  1.0
  Sc  Sc2  4  0.0000  0.3333  0.0000  1.0
  In  In3  2  0.0000  0.0000  0.0000  1.0
  O  O4  8  0.2410  0.1717  0.2074  1.0
  O  O5  4  0.2259  0.5000  0.2084  1.0
]