data_[Sr12Cd8Ga12]
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 [Cmcm]
_cell_length_a [4.7966]
_cell_length_b [11.7284]
_cell_length_c [15.9551]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Sr3Cd2Ga3]
_chemical_formula_sum '[Sr12 Cd8 Ga12]'
_cell_volume [897.5804]
_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  8  0.0000  0.0921  0.6100  1
  Sr  Sr1  4  0.0000  0.3748  0.7500  1
  Cd  Cd2  8  0.0000  0.2036  0.0930  1
  Ga  Ga3  8  0.0000  0.3978  0.5363  1
  Ga  Ga4  4  0.0000  0.3339  0.2500  1
]