data_[Nd4Sc4Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Sc  1.3600  1.6000  0.8850
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.4897]
_cell_length_b [6.4948]
_cell_length_c [6.9931]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.1023]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NdScPt]
_chemical_formula_sum '[Nd4 Sc4 Pt4]'
_cell_volume [294.6986]
_cell_formula_units_Z [4]
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  0.2476  0.0000  0.8712  1.0
  Sc  Sc1  4  0.0000  0.2518  0.5000  1.0
  Pt  Pt2  4  0.2411  0.0000  0.2839  1.0
]