data_[K4Ni4Rh4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ni  1.9100  1.3500  0.7400
  Rh  2.2800  1.3500  0.7450
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.5950]
_cell_length_b [14.1807]
_cell_length_c [9.3661]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [KNiRhS3]
_chemical_formula_sum '[K4 Ni4 Rh4 S12]'
_cell_volume [477.4852]
_cell_formula_units_Z [4]
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
[
  K  K0  4  0.0000  0.2499  0.2500  1
  Ni  Ni1  4  0.0000  0.0276  0.7500  1
  Rh  Rh2  4  0.0000  0.5000  0.0000  1
  S  S3  8  0.0000  0.1088  0.5517  1
  S  S4  4  0.0000  0.4358  0.7500  1
]