data_[Nd10In4Sn10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.5422]
_cell_length_b [4.6765]
_cell_length_c [11.7266]
_cell_angle_alpha [90.0000]
_cell_angle_beta [129.0985]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd5In2Sn5]
_chemical_formula_sum '[Nd10 In4 Sn10]'
_cell_volume [704.0110]
_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  0.1055  0.5000  0.9226  1.0
  Nd  Nd1  4  0.1995  0.5000  0.3318  1.0
  Nd  Nd2  2  0.0000  0.5000  0.5000  1.0
  In  In3  4  0.1383  0.0000  0.7507  1.0
  Sn  Sn4  4  0.0699  0.0000  0.3481  1.0
  Sn  Sn5  4  0.2392  0.0000  0.1802  1.0
  Sn  Sn6  2  0.0000  0.0000  0.0000  1.0
]