data_[Li6Co8B8O24]
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
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pc]
_cell_length_a [5.2170]
_cell_length_b [8.9268]
_cell_length_c [11.2548]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.8954]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [7]
_chemical_formula_structural [Li3Co4(BO3)4]
_chemical_formula_sum '[Li6 Co8 B8 O24]'
_cell_volume [471.5172]
_cell_formula_units_Z [2]
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  2  0.0109  0.2546  0.3489  1
  Li  Li1  2  0.4394  0.2454  0.0896  1
  Li  Li2  2  0.9270  0.2469  0.5931  1
  Co  Co3  2  0.0313  0.4065  0.8719  1
  Co  Co4  2  0.4578  0.4130  0.6324  1
  Co  Co5  2  0.5223  0.0765  0.3590  1
  Co  Co6  2  0.9524  0.0836  0.1123  1
  B  B7  2  0.0342  0.0806  0.8749  1
  B  B8  2  0.4535  0.0834  0.6202  1
  B  B9  2  0.5433  0.4172  0.3744  1
  B  B10  2  0.9571  0.4196  0.1270  1
  O  O11  2  0.1276  0.0470  0.3378  1
  O  O12  2  0.1627  0.4188  0.0767  1
  O  O13  2  0.1715  0.2182  0.8820  1
  O  O14  2  0.3011  0.2112  0.6095  1
  O  O15  2  0.3054  0.4303  0.4007  1
  O  O16  2  0.3690  0.0548  0.1551  1
  O  O17  2  0.6445  0.4574  0.8328  1
  O  O18  2  0.6802  0.2827  0.3888  1
  O  O19  2  0.6890  0.0838  0.5945  1
  O  O20  2  0.8181  0.0776  0.9131  1
  O  O21  2  0.8429  0.2892  0.1471  1
  O  O22  2  0.8762  0.4423  0.6597  1
]