data_[Pr12Os4Pd2I6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Os  2.2000  1.3000  0.6730
  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 [7.3488]
_cell_length_b [12.7274]
_cell_length_c [8.5719]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.5842]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr6Os2PdI3]
_chemical_formula_sum '[Pr12 Os4 Pd2 I6]'
_cell_volume [768.3910]
_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  8  0.2373  0.1745  0.1878  1
  Pr  Pr1  4  0.2129  0.5000  0.1867  1
  Os  Os2  4  0.0000  0.3332  0.0000  1
  Pd  Pd3  2  0.0000  0.0000  0.0000  1
  I  I4  4  0.0000  0.1666  0.5000  1
  I  I5  2  0.0000  0.5000  0.5000  1
]