data_[Cr4Pd16Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.1443]
_cell_length_b [3.8393]
_cell_length_c [6.1751]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.6039]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cr2Pd8Pt]
_chemical_formula_sum '[Cr4 Pd16 Pt2]'
_cell_volume [324.5001]
_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
[
  Cr  Cr0  4  0.2309  0.0000  0.6120  1.0
  Pd  Pd1  4  0.0493  0.0000  0.7294  1.0
  Pd  Pd2  4  0.0972  0.5000  0.4598  1.0
  Pd  Pd3  4  0.1430  0.0000  0.1976  1.0
  Pd  Pd4  4  0.1841  0.5000  0.9110  1.0
  Pt  Pt5  2  0.0000  0.5000  0.0000  1.0
]