data_[Ac3In1Ga2Pd9]
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
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.9821]
_cell_length_b [5.9821]
_cell_length_c [11.3315]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Ac3InGa2Pd9]
_chemical_formula_sum '[Ac3 In1 Ga2 Pd9]'
_cell_volume [351.1801]
_cell_formula_units_Z [1]
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  2  0.3333  0.6667  0.7192  1
  Ac  Ac1  1  0.0000  0.0000  0.0000  1
  In  In2  1  0.0000  0.0000  0.5000  1
  Ga  Ga3  2  0.3333  0.6667  0.1603  1
  Pd  Pd4  6  0.1596  0.8404  0.3096  1
  Pd  Pd5  3  0.0000  0.5000  0.0000  1
]