data_[Ce2Y10Sb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Y  1.2200  1.8000  1.0400
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.6364]
_cell_length_b [13.2233]
_cell_length_c [7.6322]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4956]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeY5Sb6]
_chemical_formula_sum '[Ce2 Y10 Sb12]'
_cell_volume [726.5082]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.0000  1.0
  Y  Y1  4  0.0000  0.1655  0.5000  1.0
  Y  Y2  4  0.0000  0.3331  0.0000  1.0
  Y  Y3  2  0.0000  0.5000  0.5000  1.0
  Sb  Sb4  8  0.2485  0.3324  0.7482  1.0
  Sb  Sb5  4  0.2480  0.5000  0.2501  1.0
]