data_[Ac4Al2In2Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.4627]
_cell_length_b [5.5988]
_cell_length_c [8.7929]
_cell_angle_alpha [90.0000]
_cell_angle_beta [133.1246]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac2AlInPt6]
_chemical_formula_sum '[Ac4 Al2 In2 Pt12]'
_cell_volume [447.8044]
_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  0.2479  0.0000  0.7912  1
  Al  Al1  2  0.0000  0.5000  0.5000  1
  In  In2  2  0.0000  0.0000  0.0000  1
  Pt  Pt3  8  0.0053  0.2504  0.2680  1
  Pt  Pt4  4  0.2468  0.5000  0.5973  1
]