data_[La8Cu8Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cu  1.9000  1.3500  0.8200
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.8552]
_cell_length_b [4.2840]
_cell_length_c [11.2984]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.8778]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La2Cu2Ge]
_chemical_formula_sum '[La8 Cu8 Ge4]'
_cell_volume [464.4406]
_cell_formula_units_Z [4]
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  0.0933  0.0000  0.8920  1.0
  La  La1  4  0.1892  0.5000  0.6381  1.0
  Cu  Cu2  4  0.0487  0.0000  0.4182  1.0
  Cu  Cu3  4  0.1134  0.5000  0.1120  1.0
  Ge  Ge4  4  0.0909  0.5000  0.3270  1.0
]