data_[Li4Co10Si2B4]
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
  Si  1.9000  1.1000  0.5400
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [8.6399]
_cell_length_b [8.6399]
_cell_length_c [2.6451]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Li2Co5SiB2]
_chemical_formula_sum '[Li4 Co10 Si2 B4]'
_cell_volume [197.4513]
_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  4  0.1753  0.6753  0.0000  1.0
  Co  Co1  8  0.0686  0.2121  0.5000  1.0
  Co  Co2  2  0.0000  0.5000  0.5000  1.0
  Si  Si3  2  0.0000  0.0000  0.0000  1.0
  B  B4  4  0.1242  0.3758  0.0000  1.0
]