data_[Li1Cu2Pd1Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.2995]
_cell_length_b [6.4935]
_cell_length_c [6.8437]
_cell_angle_alpha [86.2164]
_cell_angle_beta [69.8061]
_cell_angle_gamma [70.9181]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiCu2PdCl6]
_chemical_formula_sum '[Li1 Cu2 Pd1 Cl6]'
_cell_volume [247.9554]
_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
[
  Li  Li0  1  0.6918  0.5083  0.0373  1
  Cu  Cu1  1  0.1038  0.9025  0.0039  1
  Cu  Cu2  1  0.1379  0.3474  0.3911  1
  Pd  Pd3  1  0.6198  0.0744  0.7121  1
  Cl  Cl4  1  0.0197  0.2468  0.1425  1
  Cl  Cl5  1  0.2539  0.6311  0.2012  1
  Cl  Cl6  1  0.4157  0.8422  0.6996  1
  Cl  Cl7  1  0.4521  0.3092  0.4966  1
  Cl  Cl8  1  0.7753  0.8558  0.9551  1
  Cl  Cl9  1  0.8533  0.2976  0.6990  1
]