data_[Ba2Ge2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ge  2.0100  1.2500  0.7700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.9006]
_cell_length_b [9.8777]
_cell_length_c [8.4528]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.7316]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [BaGeCl4]
_chemical_formula_sum '[Ba2 Ge2 Cl8]'
_cell_volume [476.4768]
_cell_formula_units_Z [2]
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
[
  Ba  Ba0  2  0.0571  0.2500  0.6325  1.0
  Ge  Ge1  2  0.1949  0.7500  0.9096  1.0
  Cl  Cl2  4  0.0830  0.5739  0.6972  1.0
  Cl  Cl3  2  0.1681  0.2500  0.0253  1.0
  Cl  Cl4  2  0.4131  0.7500  0.2870  1.0
]