data_[La9Ce3Al24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ce  1.1200  1.8500  1.0800
  Al  1.6100  1.2500  0.6750
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.7018]
_cell_length_b [5.7018]
_cell_length_c [28.0687]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [La3CeAl8]
_chemical_formula_sum '[La9 Ce3 Al24]'
_cell_volume [790.2656]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.0006  1.0
  La  La1  3  0.0000  0.0000  0.4993  1.0
  La  La2  3  0.0000  0.0000  0.6253  1.0
  Ce  Ce3  3  0.0000  0.0000  0.1249  1.0
  Al  Al4  9  0.1668  0.3336  0.3966  1.0
  Al  Al5  9  0.1675  0.3350  0.8951  1.0
  Al  Al6  3  0.0000  0.0000  0.3123  1.0
  Al  Al7  3  0.0000  0.0000  0.8123  1.0
]