data_[Nd6Si8Pd14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Si  1.9000  1.1000  0.5400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.8612]
_cell_length_b [4.1054]
_cell_length_c [9.6232]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.8327]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd3Si4Pd7]
_chemical_formula_sum '[Nd6 Si8 Pd14]'
_cell_volume [508.0316]
_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  0.1762  0.5000  0.1748  1
  Nd  Nd1  2  0.0000  0.0000  0.5000  1
  Si  Si2  4  0.1090  0.0000  0.3265  1
  Si  Si3  4  0.1645  0.5000  0.7745  1
  Pd  Pd4  4  0.0076  0.5000  0.7747  1
  Pd  Pd5  4  0.1703  0.0000  0.9225  1
  Pd  Pd6  4  0.1936  0.5000  0.5351  1
  Pd  Pd7  2  0.0000  0.0000  0.0000  1
]