data_GePdCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.77
_cell_length_b   6.77
_cell_length_c   6.77
_cell_angle_alpha   150.84
_cell_angle_beta   144.14
_cell_angle_gamma   46.86
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GePdCl2
_chemical_formula_sum   'Ge1 Pd1 Cl2'
_cell_volume   88.16
_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
  Ge  Ge2  1  0.0  0.0  0.03  1.0
  Pd  Pd3  1  0.0  0.08  0.69  1.0
  Cl  Cl0  1  0.0  0.0  0.14  1.0
  Cl  Cl1  1  0.7  0.0  0.97  1.0

data_GePdCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.41
_cell_length_b   4.17
_cell_length_c   6.77
_cell_angle_alpha   107.93
_cell_angle_beta   104.58
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GePdCl2
_chemical_formula_sum   'Ge1 Pd1 Cl2'
_cell_volume   88.16
_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
  Ge  Ge0  1  0.0  0.03  0.03  1.0
  Pd  Pd1  1  0.92  0.61  0.61  1.0
  Cl  Cl2  1  0.0  0.14  0.14  1.0
  Cl  Cl3  1  0.0  0.97  0.27  1.0

Ge Pd Cl Cl
Ge Pd Cl Cl 0 2 o o o 0 1 o o - 1 3 - o - 1 3 o o o 1 1 o + + 1 2 o o o 1 2 o o + 2 3 - o - 