data_[Ba4Li4Ga4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [12.0585]
_cell_length_b [4.8102]
_cell_length_c [6.7133]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.7665]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [BaLiGa]
_chemical_formula_sum '[Ba4 Li4 Ga4]'
_cell_volume [359.0635]
_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
[
  Ba  Ba0  2  0.1265  0.5000  0.4284  1.0
  Ba  Ba1  2  0.4220  0.0000  0.8185  1.0
  Li  Li2  2  0.2553  0.5000  0.0288  1.0
  Li  Li3  2  0.4258  0.5000  0.4411  1.0
  Ga  Ga4  2  0.1408  0.0000  0.8619  1.0
  Ga  Ga5  2  0.3021  0.0000  0.2488  1.0
]