data_[Ac12Pd10Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.7089]
_cell_length_b [13.3284]
_cell_length_c [7.6989]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1652]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac6Pd5Cl]
_chemical_formula_sum '[Ac12 Pd10 Cl2]'
_cell_volume [747.1959]
_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  0.2376  0.3247  0.7398  1
  Ac  Ac1  4  0.2354  0.5000  0.2560  1
  Pd  Pd2  4  0.0000  0.1589  0.5000  1
  Pd  Pd3  4  0.0000  0.3328  0.0000  1
  Pd  Pd4  2  0.0000  0.5000  0.5000  1
  Cl  Cl5  2  0.0000  0.0000  0.0000  1
]