data_[Sr4Pa8Cl44]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Pa  1.5000  1.8000  1.0400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [11.9487]
_cell_length_b [11.9487]
_cell_length_c [13.6311]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [SrPa2Cl11]
_chemical_formula_sum '[Sr4 Pa8 Cl44]'
_cell_volume [1946.1496]
_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
[
  Sr  Sr0  4  0.0000  0.0000  0.2500  1
  Pa  Pa1  8  0.1653  0.6653  0.0000  1
  Cl  Cl2  32  0.0614  0.2182  0.3658  1
  Cl  Cl3  8  0.1886  0.3114  0.0000  1
  Cl  Cl4  4  0.0000  0.5000  0.0000  1
]