data_ZnCdNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53
_cell_length_b   4.53
_cell_length_c   4.53
_cell_angle_alpha   130.32
_cell_angle_beta   126.95
_cell_angle_gamma   75.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCdNi2
_chemical_formula_sum   'Zn1 Cd1 Ni2'
_cell_volume   54.96
_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
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Cd  Cd0  1  0.0  0.0  0.58  1.0
  Ni  Ni1  1  0.9  0.0  0.75  1.0
  Ni  Ni2  1  0.0  0.02  0.83  1.0

data_ZnCdNi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.8
_cell_length_b   4.04
_cell_length_c   4.53
_cell_angle_alpha   116.52
_cell_angle_beta   114.84
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCdNi2
_chemical_formula_sum   'Zn1 Cd1 Ni2'
_cell_volume   54.96
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.42  0.42  0.42  1.0
  Ni  Ni2  1  0.15  0.25  0.15  1.0
  Ni  Ni3  1  0.17  0.2  0.2  1.0

Zn Cd Ni Ni