data_[Pr6Zn4Ru8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Zn  1.6500  1.3500  0.8800
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.7159]
_cell_length_b [4.4131]
_cell_length_c [8.3031]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.8232]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr3(ZnRu2)2]
_chemical_formula_sum '[Pr6 Zn4 Ru8]'
_cell_volume [388.0125]
_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  0.1296  0.5000  0.3752  1.0
  Pr  Pr1  2  0.0000  0.0000  0.0000  1.0
  Zn  Zn2  4  0.1648  0.5000  0.7686  1.0
  Ru  Ru3  4  0.0763  0.0000  0.6275  1.0
  Ru  Ru4  4  0.2456  0.0000  0.9188  1.0
]