data_[In3Rh9Pb3S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [5.7443]
_cell_length_b [5.7443]
_cell_length_c [14.0107]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [InRh3PbS2]
_chemical_formula_sum '[In3 Rh9 Pb3 S6]'
_cell_volume [400.3757]
_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
[
  In  In0  3  0.0000  0.0000  0.0000  1.0
  Rh  Rh1  9  0.0000  0.5000  0.0000  1.0
  Pb  Pb2  3  -0.0000  -0.0000  0.5000  1.0
  S  S3  6  0.0000  0.0000  0.2183  1.0
]