data_[Cd6In2Ga2Sn1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.4286]
_cell_length_b [5.5725]
_cell_length_c [10.5619]
_cell_angle_alpha [78.6423]
_cell_angle_beta [81.7710]
_cell_angle_gamma [61.6280]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cd6In2Ga2Sn]
_chemical_formula_sum '[Cd6 In2 Ga2 Sn1]'
_cell_volume [275.1673]
_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  2  0.0908  0.7272  0.2530  1.0
  Cd  Cd1  2  0.2690  0.5738  0.7695  1.0
  Cd  Cd2  2  0.4259  0.0748  0.2646  1.0
  In  In3  2  0.1717  0.1650  0.0059  1.0
  Ga  Ga4  2  0.3284  0.3530  0.5031  1.0
  Sn  Sn5  1  0.0000  0.0000  0.5000  1.0
]