data_[La8P8Au4O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  P  2.1900  1.0000  0.5500
  Au  2.5400  1.3500  1.0700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.4870]
_cell_length_b [4.2929]
_cell_length_c [10.1425]
_cell_angle_alpha [90.0000]
_cell_angle_beta [130.7711]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La2P2AuO]
_chemical_formula_sum '[La8 P8 Au4 O4]'
_cell_volume [510.6743]
_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
[
  La  La0  4  0.1324  0.0000  0.9525  1.0
  La  La1  4  0.1733  0.0000  0.6149  1.0
  P  P2  4  0.0467  0.5000  0.6419  1.0
  P  P3  4  0.1473  0.0000  0.2683  1.0
  Au  Au4  4  0.0884  0.5000  0.3014  1.0
  O  O5  4  0.2226  0.5000  0.0748  1.0
]