data_[Li4Al6Ga4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Al  1.6100  1.2500  0.6750
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.0506]
_cell_length_b [4.0105]
_cell_length_c [6.3252]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.1095]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Al3Ga2]
_chemical_formula_sum '[Li4 Al6 Ga4]'
_cell_volume [228.2851]
_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  0.0727  0.5000  0.7161  1.0
  Al  Al1  4  0.2136  0.5000  0.1461  1.0
  Al  Al2  2  0.0000  0.0000  0.0000  1.0
  Ga  Ga3  4  0.1411  0.0000  0.4276  1.0
]