data_[Cd6Ga6Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ga  1.8100  1.3000  0.7600
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.3357]
_cell_length_b [12.8097]
_cell_length_c [6.2660]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [CdGaPt]
_chemical_formula_sum '[Cd6 Ga6 Pt6]'
_cell_volume [348.0118]
_cell_formula_units_Z [6]
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  4  0.0000  0.3578  0.6278  1.0
  Cd  Cd1  2  0.0000  0.0000  0.7844  1.0
  Ga  Ga2  4  0.0000  0.3109  0.1555  1.0
  Ga  Ga3  2  0.0000  0.0000  0.2204  1.0
  Pt  Pt4  4  0.0000  0.1661  0.4370  1.0
  Pt  Pt5  2  0.0000  0.5000  0.9924  1.0
]