data_[Pr6Sm2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Sm  1.1700  1.8500  1.2290
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [7.5191]
_cell_length_b [5.7475]
_cell_length_c [7.5420]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.7514]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Pr3SmRh]
_chemical_formula_sum '[Pr6 Sm2 Rh2]'
_cell_volume [317.8921]
_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  1  0.0004  0.0000  0.3731  1.0
  Pr  Pr1  1  0.0432  0.0000  0.8396  1.0
  Pr  Pr2  1  0.4087  0.5000  0.1457  1.0
  Pr  Pr3  1  0.5324  0.0000  0.4969  1.0
  Pr  Pr4  1  0.5776  0.0000  0.9758  1.0
  Pr  Pr5  1  0.8055  0.5000  0.5641  1.0
  Sm  Sm6  1  0.2779  0.5000  0.6138  1.0
  Sm  Sm7  1  0.9255  0.5000  0.0966  1.0
  Rh  Rh8  1  0.2765  0.0000  0.1739  1.0
  Rh  Rh9  1  0.6091  0.5000  0.8436  1.0
]