data_[Ba4Pr2In4Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Pr  1.1300  1.8500  1.0600
  In  1.7800  1.5500  0.9400
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.0192]
_cell_length_b [4.7504]
_cell_length_c [8.3054]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.2035]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2Pr(InSb2)2]
_chemical_formula_sum '[Ba4 Pr2 In4 Sb8]'
_cell_volume [634.1078]
_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
[
  Ba  Ba0  4  0.1273  0.0000  0.5724  1.0
  Pr  Pr1  2  0.0000  0.0000  0.0000  1.0
  In  In2  4  0.1686  0.5000  0.9867  1.0
  Sb  Sb3  4  0.0053  0.5000  0.7328  1.0
  Sb  Sb4  4  0.2055  0.0000  0.2100  1.0
]