data_Cd2NiAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.0
_cell_length_b   4.64
_cell_length_c   5.0
_cell_angle_alpha   90.0
_cell_angle_beta   91.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2NiAg
_chemical_formula_sum   'Cd2 Ni1 Ag1'
_cell_volume   69.66
_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
  Cd  Cd1  1  0.61  0.0  0.73  1.0
  Cd  Cd2  1  0.52  0.32  0.53  1.0
  Ni  Ni3  1  0.07  0.0  0.26  1.0
  Ag  Ag0  1  0.05  0.32  0.98  1.0

data_Cd2NiAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.0
_cell_length_b   4.64
_cell_length_c   5.0
_cell_angle_alpha   90.0
_cell_angle_beta   91.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2NiAg
_chemical_formula_sum   'Cd2 Ni1 Ag1'
_cell_volume   69.66
_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
  Cd  Cd0  1  0.52  0.32  0.53  1.0
  Cd  Cd1  1  0.61  0.0  0.73  1.0
  Ni  Ni2  1  0.07  0.0  0.26  1.0
  Ag  Ag3  1  0.05  0.32  0.98  1.0

Cd Cd Ni Ag