data_[Nd2Cd6In2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.2872]
_cell_length_b [6.3402]
_cell_length_c [6.3592]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.2251]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [NdCd3In]
_chemical_formula_sum '[Nd2 Cd6 In2]'
_cell_volume [253.0882]
_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
[
  Nd  Nd0  2  0.3353  0.7500  0.3432  1.0
  Cd  Cd1  4  0.1566  0.5006  0.8435  1.0
  Cd  Cd2  2  0.4583  0.2500  0.1366  1.0
  In  In3  2  0.1527  0.2500  0.4478  1.0
]