data_[Ge2Se3Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  Se  2.5500  1.1500  1.0133
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.8468]
_cell_length_b [7.6375]
_cell_length_c [17.0212]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [93.1486]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Ge2Se3Cl2]
_chemical_formula_sum '[Ge2 Se3 Cl2]'
_cell_volume [888.7346]
_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  0.0235  0.7880  0.4365  1
  Ge  Ge1  1  0.5405  0.9120  0.5553  1
  Se  Se2  1  0.0405  0.0212  0.5496  1
  Se  Se3  1  0.3317  0.0985  0.4711  1
  Se  Se4  1  0.7541  0.1754  0.5169  1
  Cl  Cl5  1  0.1457  0.5806  0.5142  1
  Cl  Cl6  1  0.6637  0.7076  0.4564  1
]