data_[Li9Ac3Ga6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ac  1.1000  1.9500  1.2600
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [9.9851]
_cell_length_b [9.9851]
_cell_length_c [4.5880]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [191]
_chemical_formula_structural [Li3AcGa2]
_chemical_formula_sum '[Li9 Ac3 Ga6]'
_cell_volume [396.1454]
_cell_formula_units_Z [3]
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  0.0000  0.2906  0.0000  1
  Li  Li1  3  0.0000  0.5000  0.5000  1
  Ac  Ac2  2  0.3333  0.6667  0.0000  1
  Ac  Ac3  1  0.0000  0.0000  0.5000  1
  Ga  Ga4  6  0.1886  0.3772  0.5000  1
]