data_NaCd2Ga
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.12
_cell_length_b   4.75
_cell_length_c   6.21
_cell_angle_alpha   90.0
_cell_angle_beta   102.87
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaCd2Ga
_chemical_formula_sum   'Na1 Cd2 Ga1'
_cell_volume   89.82
_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
  Na  Na3  1  0.85  0.0  0.46  1.0
  Cd  Cd0  1  0.9  0.37  0.06  1.0
  Cd  Cd1  1  0.74  0.0  0.54  1.0
  Ga  Ga2  1  0.25  0.37  0.04  1.0

data_NaCd2Ga
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.12
_cell_length_b   4.75
_cell_length_c   6.21
_cell_angle_alpha   90.0
_cell_angle_beta   102.87
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaCd2Ga
_chemical_formula_sum   'Na1 Cd2 Ga1'
_cell_volume   89.82
_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
  Na  Na0  1  0.85  0.0  0.46  1.0
  Cd  Cd1  1  0.74  0.0  0.54  1.0
  Cd  Cd2  1  0.9  0.37  0.06  1.0
  Ga  Ga3  1  0.25  0.37  0.04  1.0

Na Cd Cd Ga