data_[Ce9Pr3Th12P24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Pr  1.1300  1.8500  1.0600
  Th  1.3000  1.8000  1.0800
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.2729]
_cell_length_b [8.2729]
_cell_length_c [20.2264]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ce3Pr(ThP2)4]
_chemical_formula_sum '[Ce9 Pr3 Th12 P24]'
_cell_volume [1198.8634]
_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
[
  Ce  Ce0  9  0.0000  0.5000  0.0000  1
  Pr  Pr1  3  -0.0000  -0.0000  0.0000  1
  Th  Th2  9  0.0000  0.5000  0.5000  1
  Th  Th3  3  -0.0000  -0.0000  0.5000  1
  P  P4  18  0.0037  0.5019  0.2500  1
  P  P5  6  0.0000  0.0000  0.2509  1
]