data_[Ce12Ge6As2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ge  2.0100  1.2500  0.7700
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1409]
_cell_length_b [8.1214]
_cell_length_c [12.1549]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.6771]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ce6Ge3As]
_chemical_formula_sum '[Ce12 Ge6 As2]'
_cell_volume [572.6080]
_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
[
  Ce  Ce0  4  0.0604  0.0738  0.2500  1
  Ce  Ce1  4  0.2347  0.6792  0.0762  1
  Ce  Ce2  4  0.4133  0.1773  0.0724  1
  Ge  Ge3  4  0.2996  0.1225  0.7521  1
  Ge  Ge4  2  0.5000  0.0000  0.5000  1
  As  As5  2  0.0000  0.0000  0.0000  1
]