data_[Ge6Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P31m]
_cell_length_a [10.2868]
_cell_length_b [10.2868]
_cell_length_c [19.6642]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [157]
_chemical_formula_structural [Ge3Cl5]
_chemical_formula_sum '[Ge6 Cl10]'
_cell_volume [1802.0673]
_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
[
  Ge  Ge0  3  0.0000  0.7544  0.5029  1
  Ge  Ge1  2  0.3333  0.6667  0.4922  1
  Ge  Ge2  1  0.0000  0.0000  0.6656  1
  Cl  Cl3  6  0.2062  0.7703  0.4284  1
  Cl  Cl4  3  0.0000  0.2000  0.6050  1
  Cl  Cl5  1  0.0000  0.0000  0.4562  1
]