data_[La4Co4O11]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Co  1.8800  1.3500  0.7683
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.4837]
_cell_length_b [7.7218]
_cell_length_c [5.5391]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.1995]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [La4Co4O11]
_chemical_formula_sum '[La4 Co4 O11]'
_cell_volume [234.5435]
_cell_formula_units_Z [1]
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  1  0.0085  0.0000  0.9648  1
  La  La1  1  0.4833  0.0000  0.4644  1
  La  La2  1  0.5078  0.5000  0.5410  1
  La  La3  1  0.9944  0.5000  0.0316  1
  Co  Co4  2  0.5052  0.2532  0.9996  1
  Co  Co5  2  0.9947  0.2453  0.4982  1
  O  O6  2  0.2108  0.2199  0.2302  1
  O  O7  2  0.2745  0.2203  0.7083  1
  O  O8  2  0.7381  0.3061  0.2877  1
  O  O9  2  0.7940  0.3087  0.7625  1
  O  O10  1  0.4235  0.5000  0.9867  1
  O  O11  1  0.5800  0.0000  0.0162  1
  O  O12  1  0.9043  0.0000  0.5308  1
]