data_[Li6Th3Ga3Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Th  1.3000  1.8000  1.0800
  Ga  1.8100  1.3000  0.7600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.4284]
_cell_length_b [4.4284]
_cell_length_c [21.8007]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Li2ThGaRh4]
_chemical_formula_sum '[Li6 Th3 Ga3 Rh12]'
_cell_volume [370.2454]
_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
[
  Li  Li0  6  0.0000  0.0000  0.2431  1
  Th  Th1  3  0.0000  0.0000  0.0000  1
  Ga  Ga2  3  -0.0000  -0.0000  0.5000  1
  Rh  Rh3  6  0.0000  0.0000  0.1279  1
  Rh  Rh4  6  0.0000  0.0000  0.3828  1
]