data_Bi2PdCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.45
_cell_length_b   3.45
_cell_length_c   8.14
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Bi2PdCl
_chemical_formula_sum   'Bi2 Pd1 Cl1'
_cell_volume   97.01
_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
  Bi  Bi0  1  0.73  0.73  0.81  1.0
  Bi  Bi1  1  0.73  0.73  0.33  1.0
  Pd  Pd3  1  0.0  0.0  0.07  1.0
  Cl  Cl2  1  0.0  0.0  0.0  1.0

data_Bi2PdCl
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.88
_cell_length_b   4.88
_cell_length_c   8.14
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Bi2PdCl
_chemical_formula_sum   'Bi4 Pd2 Cl2'
_cell_volume   194.02
_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
  Bi  Bi0  2  0.23  0.5  0.33  1.0
  Bi  Bi1  2  0.23  0.5  0.81  1.0
  Pd  Pd2  2  0.0  0.0  0.07  1.0
  Cl  Cl3  2  0.0  0.0  0.0  1.0

Bi Bi Pd Cl
Bi Bi Pd Cl 0 3 + + + 1 2 o + o 1 2 + o o 1 2 + + o 1 1 + o o 1 1 o + o 1 3 + + o 2 3 o o o 