data_[Ac4In4Ga6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.9539]
_cell_length_b [4.6343]
_cell_length_c [7.2287]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7101]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac2In2Ga3]
_chemical_formula_sum '[Ac4 In4 Ga6]'
_cell_volume [376.9891]
_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
[
  Ac  Ac0  4  0.1331  0.0000  0.7800  1
  In  In1  4  0.1694  0.0000  0.2820  1
  Ga  Ga2  4  0.0821  0.5000  0.4152  1
  Ga  Ga3  2  0.0000  0.5000  0.0000  1
]