data_[Ba8La4In4O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  La  1.1000  1.9500  1.1720
  In  1.7800  1.5500  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.7248]
_cell_length_b [14.9138]
_cell_length_c [11.6928]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ba2LaInO5]
_chemical_formula_sum '[Ba8 La4 In4 O20]'
_cell_volume [649.5424]
_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
[
  Ba  Ba0  4  0.0000  0.1029  0.6927  1.0
  Ba  Ba1  4  0.0000  0.1388  0.2954  1.0
  La  La2  4  0.0000  0.2165  0.0134  1.0
  In  In3  4  0.0000  0.4783  0.4587  1.0
  O  O4  4  0.0000  0.0489  0.0419  1.0
  O  O5  4  0.0000  0.2789  0.6493  1.0
  O  O6  4  0.0000  0.3231  0.3898  1.0
  O  O7  4  0.0000  0.3755  0.9985  1.0
  O  O8  4  0.0000  0.4909  0.7842  1.0
]