data_[Pd2Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.3703]
_cell_length_b [3.4202]
_cell_length_c [11.8752]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1620]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [PdCl2]
_chemical_formula_sum '[Pd2 Cl4]'
_cell_volume [177.2341]
_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
[
  Pd  Pd0  1  0.0000  0.5000  0.0000  1.0
  Pd  Pd1  1  0.5000  0.0000  0.5000  1.0
  Cl  Cl2  2  0.1337  0.0000  0.8786  1.0
  Cl  Cl3  2  0.4430  0.5000  0.3672  1.0
]