data_[Li20Co4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Co  1.8800  1.3500  0.7683
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pnnm]
_cell_length_a [7.0810]
_cell_length_b [7.9933]
_cell_length_c [6.6826]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [58]
_chemical_formula_structural [Li5CoO4]
_chemical_formula_sum '[Li20 Co4 O16]'
_cell_volume [378.2429]
_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
[
  Li  Li0  8  0.0221  0.8445  0.2551  1
  Li  Li1  4  0.0000  0.5000  0.2566  1
  Li  Li2  4  0.2421  0.2038  0.5000  1
  Li  Li3  4  0.2440  0.4022  0.0000  1
  Co  Co4  4  0.2323  0.1028  0.0000  1
  O  O5  8  0.2176  0.0240  0.2596  1
  O  O6  4  0.0232  0.2631  0.0000  1
  O  O7  4  0.0315  0.7162  0.5000  1
]