data_Cd2GaAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28
_cell_length_b   5.28
_cell_length_c   5.28
_cell_angle_alpha   97.77
_cell_angle_beta   97.77
_cell_angle_gamma   33.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2GaAg
_chemical_formula_sum   'Cd2 Ga1 Ag1'
_cell_volume   81.6
_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  0.44  0.0  0.33  1.0
  Cd  Cd2  1  0.92  0.0  0.9  1.0
  Ga  Ga3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.68  0.0  0.61  1.0

data_Cd2GaAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.09
_cell_length_b   5.28
_cell_length_c   5.28
_cell_angle_alpha   97.77
_cell_angle_beta   90.0
_cell_angle_gamma   106.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2GaAg
_chemical_formula_sum   'Cd2 Ga1 Ag1'
_cell_volume   81.6
_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  0.0  0.08  0.1  1.0
  Cd  Cd1  1  0.0  0.56  0.67  1.0
  Ga  Ga2  1  0.0  0.0  0.0  1.0
  Ag  Ag3  1  0.0  0.32  0.39  1.0

Cd Cd Ga Ag