data_[Pr12Sn12Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Sn  1.9600  1.4500  0.8300
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.5379]
_cell_length_b [4.6319]
_cell_length_c [15.4084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.3952]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr3Sn3Rh]
_chemical_formula_sum '[Pr12 Sn12 Rh4]'
_cell_volume [776.7285]
_cell_formula_units_Z [4]
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  0.0230  0.5000  0.3817  1
  Pr  Pr1  4  0.0990  0.5000  0.9207  1
  Pr  Pr2  4  0.2422  0.5000  0.2406  1
  Sn  Sn3  4  0.0314  0.0000  0.2366  1
  Sn  Sn4  4  0.1228  0.0000  0.0763  1
  Sn  Sn5  4  0.1496  0.0000  0.5353  1
  Rh  Rh6  4  0.2472  0.0000  0.3871  1
]