data_[Pr6Tm2Sb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Tm  1.2500  1.7500  1.0950
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [7.7959]
_cell_length_b [9.0278]
_cell_length_c [7.8014]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5156]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [Pr3TmSb4]
_chemical_formula_sum '[Pr6 Tm2 Sb8]'
_cell_volume [517.5171]
_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  2  0.0000  0.3741  0.2500  1
  Pr  Pr1  2  0.5000  0.1244  0.2500  1
  Pr  Pr2  2  0.5000  0.3738  0.7500  1
  Tm  Tm3  2  0.0000  0.1245  0.7500  1
  Sb  Sb4  4  0.2400  0.1197  0.5002  1
  Sb  Sb5  4  0.2454  0.3701  0.9950  1
]