data_[La24Mg4Ge8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Mg  1.3100  1.5000  0.8600
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [10.2718]
_cell_length_b [10.4073]
_cell_length_c [10.8531]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [La6MgGe2]
_chemical_formula_sum '[La24 Mg4 Ge8]'
_cell_volume [1160.2162]
_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  8  0.0000  0.2030  0.2544  1
  La  La1  8  0.1986  0.5000  0.1703  1
  La  La2  8  0.2247  0.3252  0.5000  1
  Mg  Mg3  2  0.0000  0.0000  0.0000  1
  Mg  Mg4  2  0.0000  0.0000  0.5000  1
  Ge  Ge5  4  0.0000  0.3346  0.0000  1
  Ge  Ge6  4  0.0000  0.5000  0.3812  1
]