data_[Pr4In4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  In  1.7800  1.5500  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.4490]
_cell_length_b [5.9355]
_cell_length_c [7.6623]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.8208]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [PrInO3]
_chemical_formula_sum '[Pr4 In4 O12]'
_cell_volume [291.7855]
_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
[
  Pr  Pr0  4  0.3629  0.2194  0.3348  1.0
  In  In1  4  0.0943  0.7385  0.4297  1.0
  O  O2  4  0.0549  0.5654  0.1709  1.0
  O  O3  4  0.2141  0.0766  0.0501  1.0
  O  O4  4  0.4118  0.6663  0.8825  1.0
]