data_[Ce2Er8In14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.6728]
_cell_length_b [5.7379]
_cell_length_c [11.3151]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.4694]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeEr4In7]
_chemical_formula_sum '[Ce2 Er8 In14]'
_cell_volume [694.1649]
_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
  Er  Er1  4  0.1072  0.5000  0.3320  1
  Er  Er2  4  0.1912  0.0000  0.7826  1
  In  In3  4  0.0950  0.0000  0.4621  1
  In  In4  4  0.1763  0.5000  0.8956  1
  In  In5  4  0.2486  0.0000  0.3237  1
  In  In6  2  0.0000  0.5000  0.0000  1
]