data_[La24Al2Ge10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Al  1.6100  1.2500  0.6750
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [10.0099]
_cell_length_b [10.3749]
_cell_length_c [10.6534]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [La12AlGe5]
_chemical_formula_sum '[La24 Al2 Ge10]'
_cell_volume [1106.3831]
_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  8  0.0000  0.1972  0.2483  1
  La  La1  8  0.2121  0.5000  0.1738  1
  La  La2  8  0.2341  0.6770  0.5000  1
  Al  Al3  2  0.0000  0.0000  0.5000  1
  Ge  Ge4  4  0.0000  0.3683  0.0000  1
  Ge  Ge5  4  0.0000  0.5000  0.3815  1
  Ge  Ge6  2  0.0000  0.0000  0.0000  1
]