data_[La6Pr3Ni6Rh21]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Ni  1.9100  1.3500  0.7400
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.3402]
_cell_length_b [5.3402]
_cell_length_c [25.8537]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [La2PrNi2Rh7]
_chemical_formula_sum '[La6 Pr3 Ni6 Rh21]'
_cell_volume [638.5169]
_cell_formula_units_Z [3]
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
[
  La  La0  6  0.0000  0.0000  0.1393  1
  Pr  Pr1  3  0.0000  0.0000  0.0000  1
  Ni  Ni2  6  0.0000  0.0000  0.3332  1
  Rh  Rh3  18  0.0007  0.5003  0.9216  1
  Rh  Rh4  3  -0.0000  -0.0000  0.5000  1
]