data_[Pr6Tl4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Tl  1.6200  1.9000  1.3325
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.1249]
_cell_length_b [4.6467]
_cell_length_c [9.2645]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.7297]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr3(TlPd2)2]
_chemical_formula_sum '[Pr6 Tl4 Pd8]'
_cell_volume [435.3697]
_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  0.1292  0.5000  0.3862  1.0
  Pr  Pr1  2  0.0000  0.0000  0.0000  1.0
  Tl  Tl2  4  0.1724  0.5000  0.7805  1.0
  Pd  Pd3  4  0.0763  0.0000  0.6258  1.0
  Pd  Pd4  4  0.2095  0.5000  0.0851  1.0
]