data_[Nd4Ge2Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ge  2.0100  1.2500  0.7700
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.8462]
_cell_length_b [5.7241]
_cell_length_c [6.2827]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.9876]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd2GePt6]
_chemical_formula_sum '[Nd4 Ge2 Pt12]'
_cell_volume [343.5998]
_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  0.1431  0.5000  0.8523  1
  Ge  Ge1  2  0.0000  0.0000  0.0000  1
  Pt  Pt2  8  0.1354  0.2572  0.3129  1
  Pt  Pt3  4  0.1212  0.0000  0.6936  1
]