data_[Rh4S7]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rh  2.2800  1.3500  0.7450
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P6mm]
_cell_length_a [10.7753]
_cell_length_b [10.7753]
_cell_length_c [17.9758]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [183]
_chemical_formula_structural [Rh4S7]
_chemical_formula_sum '[Rh4 S7]'
_cell_volume [1807.4822]
_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
[
  Rh  Rh0  3  0.0000  0.5000  0.4739  1
  Rh  Rh1  1  0.0000  0.0000  0.4862  1
  S  S2  6  0.1915  0.5958  0.5368  1
  S  S3  1  0.0000  0.0000  0.3713  1
]