data_[La12Ni4Ge2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ni  1.9100  1.3500  0.7400
  Ge  2.0100  1.2500  0.7700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.3286]
_cell_length_b [4.2561]
_cell_length_c [8.6959]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.2267]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6Ni2GeCl3]
_chemical_formula_sum '[La12 Ni4 Ge2 Cl6]'
_cell_volume [654.5386]
_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
[
  La  La0  4  0.0180  0.0000  0.2473  1.0
  La  La1  4  0.1681  0.5000  0.0973  1.0
  La  La2  4  0.1787  0.5000  0.5685  1.0
  Ni  Ni3  4  0.1725  0.0000  0.3332  1.0
  Ge  Ge4  2  0.0000  0.5000  0.0000  1.0
  Cl  Cl5  4  0.1547  0.0000  0.8248  1.0
  Cl  Cl6  2  0.0000  0.5000  0.5000  1.0
]