data_[Li2Co2Sn6]
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
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.8725]
_cell_length_b [4.0487]
_cell_length_c [9.4706]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.9446]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiCoSn3]
_chemical_formula_sum '[Li2 Co2 Sn6]'
_cell_volume [221.7934]
_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  0.2000  0.2500  0.1774  1.0
  Co  Co1  2  0.1775  0.7500  0.6798  1.0
  Sn  Sn2  2  0.1047  0.7500  0.4003  1.0
  Sn  Sn3  2  0.3012  0.7500  0.9501  1.0
  Sn  Sn4  2  0.4365  0.2500  0.6980  1.0
]