data_[Rb4Pd6S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Pd  2.2000  1.4000  0.8462
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [6.3754]
_cell_length_b [10.7198]
_cell_length_c [7.5813]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.8641]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Rb2Pd3S4]
_chemical_formula_sum '[Rb4 Pd6 S8]'
_cell_volume [470.1056]
_cell_formula_units_Z [2]
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  2  0.1615  0.0000  0.3205  1.0
  Rb  Rb1  2  0.3468  0.5000  0.6841  1.0
  Pd  Pd2  4  0.2538  0.2449  0.0042  1.0
  Pd  Pd3  2  0.0025  0.5000  0.0042  1.0
  S  S4  4  0.1029  0.3299  0.2159  1.0
  S  S5  4  0.3794  0.1704  0.7783  1.0
]