data_[Nd2Al4Zn2Cu2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Al  1.6100  1.2500  0.6750
  Zn  1.6500  1.3500  0.8800
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.2588]
_cell_length_b [4.2798]
_cell_length_c [10.4282]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [NdAl2ZnCu]
_chemical_formula_sum '[Nd2 Al4 Zn2 Cu2]'
_cell_volume [190.0751]
_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  0.5536  1.0
  Al  Al1  2  0.0000  0.0000  0.9508  1.0
  Al  Al2  2  0.0000  0.5000  0.7984  1.0
  Zn  Zn3  2  0.0000  0.5000  0.3044  1.0
  Cu  Cu4  2  0.0000  0.0000  0.1807  1.0
]