data_[La4Re4O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Re  1.9000  1.3500  0.7125
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.2828]
_cell_length_b [6.6506]
_cell_length_c [7.7021]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.5194]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LaReO5]
_chemical_formula_sum '[La4 Re4 O20]'
_cell_volume [432.6216]
_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  0.0000  0.4471  0.2500  1.0
  Re  Re1  4  0.0000  0.0000  0.0000  1.0
  O  O2  8  0.0090  0.2810  0.9667  1.0
  O  O3  8  0.2171  0.0130  0.6106  1.0
  O  O4  4  0.0000  0.0601  0.2500  1.0
]