data_[La12Si8Rh8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Si  1.9000  1.1000  0.5400
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pbcm]
_cell_length_a [5.7538]
_cell_length_b [8.1276]
_cell_length_c [13.5031]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [57]
_chemical_formula_structural [La3(SiRh)2]
_chemical_formula_sum '[La12 Si8 Rh8]'
_cell_volume [631.4721]
_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  0.3574  0.1088  0.0994  1
  La  La1  4  0.1503  0.7438  0.7500  1
  Si  Si2  4  0.1288  0.7500  0.0000  1
  Si  Si3  4  0.3389  0.0984  0.7500  1
  Rh  Rh4  8  0.1209  0.0346  0.5905  1
]