data_[Ba4In2Sb2P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  In  1.7800  1.5500  0.9400
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.9424]
_cell_length_b [4.8514]
_cell_length_c [10.2686]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.5924]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ba2InSbP]
_chemical_formula_sum '[Ba4 In2 Sb2 P2]'
_cell_volume [377.1576]
_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  2  0.1958  0.2500  0.3896  1.0
  Ba  Ba1  2  0.2311  0.2500  0.9790  1.0
  In  In2  2  0.4939  0.7500  0.2511  1.0
  Sb  Sb3  2  0.3039  0.7500  0.6959  1.0
  P  P4  2  0.1661  0.7500  0.1777  1.0
]