data_[Pr12Pt4Rh2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Pt  2.2800  1.3500  0.8050
  Rh  2.2800  1.3500  0.7450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.4180]
_cell_length_b [4.2125]
_cell_length_c [8.9665]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.5058]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr6Pt2RhCl3]
_chemical_formula_sum '[Pr12 Pt4 Rh2 Cl6]'
_cell_volume [695.5186]
_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
[
  Pr  Pr0  4  0.0092  0.0000  0.2221  1.0
  Pr  Pr1  4  0.1536  0.5000  0.1043  1.0
  Pr  Pr2  4  0.1748  0.5000  0.5615  1.0
  Pt  Pt3  4  0.1672  0.0000  0.3347  1.0
  Rh  Rh4  2  0.0000  0.5000  0.0000  1.0
  Cl  Cl5  4  0.1652  0.0000  0.8297  1.0
  Cl  Cl6  2  0.0000  0.5000  0.5000  1.0
]