data_[Nd6Zn6Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Zn  1.6500  1.3500  0.8800
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [3.7852]
_cell_length_b [4.5390]
_cell_length_c [19.6108]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Nd3Zn3Pt]
_chemical_formula_sum '[Nd6 Zn6 Pt2]'
_cell_volume [336.9329]
_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  0.0000  0.0000  0.0065  1
  Nd  Nd1  2  0.0000  0.5000  0.1829  1
  Nd  Nd2  2  0.0000  0.5000  0.8091  1
  Zn  Zn3  2  0.0000  0.0000  0.4335  1
  Zn  Zn4  2  0.0000  0.5000  0.3626  1
  Zn  Zn5  2  0.0000  0.5000  0.6390  1
  Pt  Pt6  2  0.0000  0.0000  0.5664  1
]