data_[Rb4P4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  P  2.1900  1.0000  0.5500
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.5452]
_cell_length_b [11.0333]
_cell_length_c [6.7329]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.0117]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [RbPPd2]
_chemical_formula_sum '[Rb4 P4 Pd8]'
_cell_volume [381.9056]
_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  0.2455  0.0980  0.4806  1
  P  P1  4  0.3945  0.6556  0.4212  1
  Pd  Pd2  4  0.2010  0.7033  0.6549  1
  Pd  Pd3  4  0.2421  0.0308  0.9851  1
]