data_[Rb4Cu4P8S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Cu  1.9000  1.3500  0.8200
  P  2.1900  1.0000  0.5500
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.0347]
_cell_length_b [15.3375]
_cell_length_c [5.8529]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.1399]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [RbCu(PS3)2]
_chemical_formula_sum '[Rb4 Cu4 P8 S24]'
_cell_volume [1143.9524]
_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
[
  Rb  Rb0  4  0.0000  0.1382  0.2500  1.0
  Cu  Cu1  4  0.0000  0.3574  0.7500  1.0
  P  P2  8  0.2151  0.4337  0.1319  1.0
  S  S3  8  0.1312  0.0747  0.8060  1.0
  S  S4  8  0.1377  0.3224  0.0065  1.0
  S  S5  8  0.1479  0.4536  0.4343  1.0
]