data_[Cd2In4Ga1Hg2]
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
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4099]
_cell_length_b [6.4484]
_cell_length_c [6.4956]
_cell_angle_alpha [72.8584]
_cell_angle_beta [68.8450]
_cell_angle_gamma [72.3842]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cd2In4GaHg2]
_chemical_formula_sum '[Cd2 In4 Ga1 Hg2]'
_cell_volume [233.3966]
_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  0.2665  0.1726  0.1787  1.0
  In  In1  2  0.1642  0.6875  0.3852  1.0
  In  In2  2  0.3667  0.1982  0.6330  1.0
  Ga  Ga3  1  0.0000  0.0000  0.0000  1.0
  Hg  Hg4  2  0.2916  0.6073  0.8558  1.0
]