data_[Li6Ga6Sn2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P6_3/m]
_cell_length_a [7.7097]
_cell_length_b [7.7097]
_cell_length_c [4.8696]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [176]
_chemical_formula_structural [Li3Ga3Sn]
_chemical_formula_sum '[Li6 Ga6 Sn2]'
_cell_volume [250.6686]
_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  6  0.0996  0.6364  0.7500  1.0
  Ga  Ga1  6  0.0423  0.8125  0.2500  1.0
  Sn  Sn2  2  0.3333  0.6667  0.2500  1.0
]