data_GeWCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.73
_cell_length_b   8.73
_cell_length_c   8.73
_cell_angle_alpha   21.48
_cell_angle_beta   21.48
_cell_angle_gamma   21.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeWCl2
_chemical_formula_sum   'Ge1 W1 Cl2'
_cell_volume   78.02
_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  0.0  1.0
  W  W3  1  0.0  0.0  0.27  1.0
  Cl  Cl0  1  0.0  0.0  0.98  1.0
  Cl  Cl1  1  0.0  0.0  0.66  1.0

data_GeWCl2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.63
_cell_length_b   3.25
_cell_length_c   8.73
_cell_angle_alpha   90.0
_cell_angle_beta   102.42
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   GeWCl2
_chemical_formula_sum   'Ge2 W2 Cl4'
_cell_volume   156.03
_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
  Ge  Ge0  2  -0.0  0.0  1.0  1.0
  W  W1  2  -0.0  0.0  0.73  1.0
  Cl  Cl2  2  -0.0  0.0  0.34  1.0
  Cl  Cl3  2  -0.0  0.0  0.02  1.0

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