data_[Sr4Cd4Ga8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Cd  1.6900  1.5500  1.0900
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [8.1287]
_cell_length_b [4.3796]
_cell_length_c [11.3447]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [SrCdGa2]
_chemical_formula_sum '[Sr4 Cd4 Ga8]'
_cell_volume [403.8794]
_cell_formula_units_Z [4]
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
[
  Sr  Sr0  4  0.1391  0.2500  0.8607  1.0
  Cd  Cd1  4  0.0111  0.2500  0.3844  1.0
  Ga  Ga2  4  0.1667  0.2500  0.1641  1.0
  Ga  Ga3  4  0.2398  0.2500  0.5658  1.0
]