data_[Nd8Y6In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Y  1.2200  1.8000  1.0400
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.5531]
_cell_length_b [5.4227]
_cell_length_c [8.6567]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.0081]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd4Y3In2]
_chemical_formula_sum '[Nd8 Y6 In4]'
_cell_volume [569.1739]
_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  4  0.1157  0.0000  0.6566  1
  Nd  Nd1  4  0.1704  0.5000  0.9638  1
  Y  Y2  4  0.0823  0.5000  0.3547  1
  Y  Y3  2  0.0000  0.0000  0.0000  1
  In  In4  4  0.2059  0.0000  0.3170  1
]