data_[La2Pa2Cu4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pa  1.5000  1.8000  1.0400
  Cu  1.9000  1.3500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [5.3446]
_cell_length_b [5.3446]
_cell_length_c [10.7394]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [LaPa(CuO4)2]
_chemical_formula_sum '[La2 Pa2 Cu4 O16]'
_cell_volume [306.7643]
_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
[
  La  La0  2  0.0000  0.5000  0.2500  1
  Pa  Pa1  2  0.0000  0.0000  0.0000  1
  Cu  Cu2  2  0.0000  0.0000  0.5000  1
  Cu  Cu3  2  0.0000  0.5000  0.7500  1
  O  O4  8  0.0687  0.8452  0.7889  1
  O  O5  8  0.1605  0.3022  0.4663  1
]