data_[Nd4Cd3Ag1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.7092]
_cell_length_b [4.9407]
_cell_length_c [12.4099]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Nd4Cd3Ag]
_chemical_formula_sum '[Nd4 Cd3 Ag1]'
_cell_volume [227.4224]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.1534  1.0
  Nd  Nd1  1  0.0000  0.5000  0.8467  1.0
  Nd  Nd2  1  0.5000  0.0000  0.6615  1.0
  Nd  Nd3  1  0.5000  0.5000  0.3370  1.0
  Cd  Cd4  1  0.0000  0.0000  0.4284  1.0
  Cd  Cd5  1  0.0000  0.5000  0.5698  1.0
  Cd  Cd6  1  0.5000  0.0000  0.9325  1.0
  Ag  Ag7  1  0.5000  0.5000  0.0707  1.0
]