data_ZrCd2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.95
_cell_length_b   4.79
_cell_length_c   5.97
_cell_angle_alpha   90.0
_cell_angle_beta   98.13
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCd2Ag
_chemical_formula_sum   'Zr1 Cd2 Ag1'
_cell_volume   83.4
_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
  Zr  Zr3  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.24  0.0  0.89  1.0
  Cd  Cd2  1  0.34  0.39  0.49  1.0
  Ag  Ag0  1  0.73  0.39  0.39  1.0

data_ZrCd2Ag
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.95
_cell_length_b   4.79
_cell_length_c   5.97
_cell_angle_alpha   90.0
_cell_angle_beta   98.13
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCd2Ag
_chemical_formula_sum   'Zr1 Cd2 Ag1'
_cell_volume   83.4
_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
  Zr  Zr0  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.24  0.0  0.89  1.0
  Cd  Cd2  1  0.34  0.39  0.49  1.0
  Ag  Ag3  1  0.73  0.39  0.39  1.0

Zr Cd Cd Ag