data_[Cd6Ag12Ge2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.3486]
_cell_length_b [6.9774]
_cell_length_c [9.9757]
_cell_angle_alpha [90.0000]
_cell_angle_beta [129.3293]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cd3Ag6Ge]
_chemical_formula_sum '[Cd6 Ag12 Ge2]'
_cell_volume [395.6505]
_cell_formula_units_Z [2]
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  0.2580  0.6665  0.0582  1
  Cd  Cd1  2  0.5000  0.0000  0.0000  1
  Ag  Ag2  4  0.0063  0.1318  0.2962  1
  Ag  Ag3  4  0.2579  0.1988  0.6832  1
  Ag  Ag4  4  0.3789  0.6002  0.8410  1
  Ge  Ge5  2  0.0000  0.0000  0.0000  1
]