data_[Pr24Sm4Tm8Th4]
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
  Tm  1.2500  1.7500  1.0950
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.4348]
_cell_length_b [15.1004]
_cell_length_c [9.8535]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.5800]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Pr6SmTm2Th]
_chemical_formula_sum '[Pr24 Sm4 Tm8 Th4]'
_cell_volume [1388.1133]
_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  8  0.0676  0.1729  0.9425  1
  Pr  Pr1  8  0.0945  0.3948  0.1195  1
  Pr  Pr2  8  0.2072  0.2177  0.3141  1
  Sm  Sm3  4  0.0000  0.4059  0.7500  1
  Tm  Tm4  8  0.2413  0.0444  0.5517  1
  Th  Th5  4  0.0000  0.0307  0.2500  1
]