data_Ge2RuCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13
_cell_length_b   5.13
_cell_length_c   2.92
_cell_angle_alpha   105.87
_cell_angle_beta   105.87
_cell_angle_gamma   86.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2RuCl
_chemical_formula_sum   'Ge2 Ru1 Cl1'
_cell_volume   71.08
_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  Ge1  1  0.32  0.76  0.35  1.0
  Ge  Ge2  1  0.32  0.24  0.35  1.0
  Ru  Ru3  1  0.73  0.0  0.0  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_Ge2RuCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.92
_cell_length_b   5.13
_cell_length_c   5.13
_cell_angle_alpha   86.65
_cell_angle_beta   74.13
_cell_angle_gamma   74.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2RuCl
_chemical_formula_sum   'Ge2 Ru1 Cl1'
_cell_volume   71.08
_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  0.35  0.68  0.24  1.0
  Ge  Ge1  1  0.35  0.68  0.76  1.0
  Ru  Ru2  1  -0.0  0.27  0.0  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Ge Ge Ru Cl