data_[Th3Sb1P2Rh9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Sb  2.0500  1.4500  0.8300
  P  2.1900  1.0000  0.5500
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.9094]
_cell_length_b [5.9094]
_cell_length_c [9.7059]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Th3SbP2Rh9]
_chemical_formula_sum '[Th3 Sb1 P2 Rh9]'
_cell_volume [293.5318]
_cell_formula_units_Z [1]
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
[
  Th  Th0  2  0.3333  0.6667  0.6734  1
  Th  Th1  1  0.0000  0.0000  0.0000  1
  Sb  Sb2  1  0.0000  0.0000  0.5000  1
  P  P3  2  0.3333  0.6667  0.1537  1
  Rh  Rh4  6  0.1592  0.3184  0.2882  1
  Rh  Rh5  3  0.0000  0.5000  0.0000  1
]