data_[Pr12Cu4Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Cu  1.9000  1.3500  0.8200
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.7063]
_cell_length_b [6.7557]
_cell_length_c [8.1524]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.9080]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr3CuRh]
_chemical_formula_sum '[Pr12 Cu4 Rh4]'
_cell_volume [543.1430]
_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  0.0055  0.0000  0.7503  1.0
  Pr  Pr1  4  0.1834  0.5000  0.8299  1.0
  Pr  Pr2  4  0.1952  0.5000  0.3548  1.0
  Cu  Cu3  4  0.0000  0.3147  0.0000  1.0
  Rh  Rh4  4  0.0000  0.2941  0.5000  1.0
]