data_[Nd2Sn6Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Sn  1.9600  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.6733]
_cell_length_b [4.5191]
_cell_length_c [12.5322]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2654]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [NdSn3Pt]
_chemical_formula_sum '[Nd2 Sn6 Pt2]'
_cell_volume [260.4294]
_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  2  0.1709  0.5000  0.3346  1.0
  Sn  Sn1  2  0.0580  0.0000  0.1172  1.0
  Sn  Sn2  2  0.2791  0.0000  0.5617  1.0
  Sn  Sn3  2  0.4117  0.5000  0.8844  1.0
  Pt  Pt4  2  0.3982  0.0000  0.7704  1.0
]