data_[La24Cu24O60]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cu  1.9000  1.3500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.9416]
_cell_length_b [3.7719]
_cell_length_c [27.5713]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.8592]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La2Cu2O5]
_chemical_formula_sum '[La24 Cu24 O60]'
_cell_volume [1413.4962]
_cell_formula_units_Z [12]
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  8  0.1246  0.7570  0.4028  1
  La  La1  8  0.1385  0.2683  0.7686  1
  La  La2  8  0.1537  0.2869  0.6346  1
  Cu  Cu3  8  0.0070  0.2342  0.1809  1
  Cu  Cu4  8  0.0125  0.2573  0.0398  1
  Cu  Cu5  8  0.1839  0.1157  0.5288  1
  O  O6  8  0.0078  0.2666  0.6810  1
  O  O7  8  0.0124  0.2449  0.1109  1
  O  O8  8  0.0425  0.2448  0.5359  1
  O  O9  8  0.1704  0.2729  0.4609  1
  O  O10  8  0.1721  0.2056  0.3374  1
  O  O11  8  0.1876  0.2200  0.2089  1
  O  O12  8  0.2035  0.1951  0.0874  1
  O  O13  4  0.0000  0.2334  0.2500  1
]