data_LaGeCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92
_cell_length_b   5.92
_cell_length_c   5.92
_cell_angle_alpha   144.0
_cell_angle_beta   122.01
_cell_angle_gamma   70.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaGeCl2
_chemical_formula_sum   'La1 Ge1 Cl2'
_cell_volume   101.72
_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
  La  La3  1  0.0  0.0  0.84  1.0
  Ge  Ge2  1  0.0  0.0  0.0  1.0
  Cl  Cl0  1  0.83  0.0  0.6  1.0
  Cl  Cl1  1  0.0  0.87  0.25  1.0

data_LaGeCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.66
_cell_length_b   5.74
_cell_length_c   5.92
_cell_angle_alpha   119.0
_cell_angle_beta   108.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaGeCl2
_chemical_formula_sum   'La1 Ge1 Cl2'
_cell_volume   101.72
_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
  La  La0  1  0.16  0.16  0.16  1.0
  Ge  Ge1  1  0.0  0.0  0.0  1.0
  Cl  Cl2  1  0.23  0.4  0.23  1.0
  Cl  Cl3  1  0.75  0.62  0.62  1.0

La Ge Cl Cl