data_[Cd10Ni2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.7478]
_cell_length_b [3.1158]
_cell_length_c [16.1561]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Cd5Ni]
_chemical_formula_sum '[Cd10 Ni2]'
_cell_volume [239.0033]
_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
[
  Cd  Cd0  2  0.0000  0.0000  0.3431  1.0
  Cd  Cd1  2  0.0000  0.0000  0.6637  1.0
  Cd  Cd2  2  0.0000  0.0000  0.9948  1.0
  Cd  Cd3  2  0.5000  0.0000  0.2395  1.0
  Cd  Cd4  2  0.5000  0.0000  0.5369  1.0
  Ni  Ni5  2  0.5000  0.0000  0.8886  1.0
]