data_BaPd2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84
_cell_length_b   5.84
_cell_length_c   5.84
_cell_angle_alpha   48.88
_cell_angle_beta   48.88
_cell_angle_gamma   48.88
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaPd2Cl
_chemical_formula_sum   'Ba1 Pd2 Cl1'
_cell_volume   103.6
_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
  Ba  Ba0  1  0.0  0.0  0.69  1.0
  Pd  Pd2  1  0.0  0.0  0.64  1.0
  Pd  Pd3  1  0.0  0.0  0.75  1.0
  Cl  Cl1  1  0.0  0.0  0.0  1.0

data_BaPd2Cl
_symmetry_space_group_name_H-M   Cm
_cell_length_a   8.37
_cell_length_b   4.83
_cell_length_c   5.84
_cell_angle_alpha   90.0
_cell_angle_beta   118.54
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BaPd2Cl
_chemical_formula_sum   'Ba2 Pd4 Cl2'
_cell_volume   207.2
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ba  Ba0  2  0.0  0.0  0.69  1.0
  Pd  Pd1  2  0.0  0.0  0.64  1.0
  Pd  Pd2  2  0.0  0.0  0.75  1.0
  Cl  Cl3  2  0.0  0.0  0.0  1.0

Ba Pd Pd Cl