data_[Ac8In2Ir3]
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
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.3283]
_cell_length_b [7.5462]
_cell_length_c [9.7151]
_cell_angle_alpha [69.9356]
_cell_angle_beta [69.4870]
_cell_angle_gamma [81.5154]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Ac8In2Ir3]
_chemical_formula_sum '[Ac8 In2 Ir3]'
_cell_volume [472.4190]
_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  0.0371  0.7238  0.6254  1
  Ac  Ac1  2  0.1095  0.8424  0.1721  1
  Ac  Ac2  2  0.3119  0.3922  0.9124  1
  Ac  Ac3  2  0.4604  0.9553  0.7219  1
  In  In4  2  0.3496  0.3985  0.4777  1
  Ir  Ir5  2  0.0874  0.7639  0.8966  1
  Ir  Ir6  1  0.5000  0.0000  0.0000  1
]