data_[Na4Li4Ga12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.6640]
_cell_length_b [6.4631]
_cell_length_c [7.7636]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.6001]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [NaLiGa3]
_chemical_formula_sum '[Na4 Li4 Ga12]'
_cell_volume [406.9384]
_cell_formula_units_Z [4]
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
[
  Na  Na0  4  0.0498  0.2281  0.4878  1.0
  Li  Li1  4  0.3109  0.5306  0.7644  1.0
  Ga  Ga2  4  0.2249  0.5953  0.3820  1.0
  Ga  Ga3  4  0.3523  0.6002  0.1244  1.0
  Ga  Ga4  4  0.4317  0.2163  0.0297  1.0
]