data_[Ac12Co2Pd4I4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Co  1.8800  1.3500  0.7683
  Pd  2.2000  1.4000  0.8462
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.6234]
_cell_length_b [13.3376]
_cell_length_c [8.8418]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.2129]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac6Co(PdI)2]
_chemical_formula_sum '[Ac12 Co2 Pd4 I4]'
_cell_volume [858.7593]
_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  8  0.2252  0.8439  0.6879  1
  Ac  Ac1  4  0.2422  0.5000  0.6889  1
  Co  Co2  2  0.0000  0.0000  0.5000  1
  Pd  Pd3  4  0.0000  0.3304  0.5000  1
  I  I4  4  0.0000  0.1686  0.0000  1
]