data_[Ce6Zn16Ga6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.4325]
_cell_length_b [9.5893]
_cell_length_c [12.9280]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Ce3Zn8Ga3]
_chemical_formula_sum '[Ce6 Zn16 Ga6]'
_cell_volume [549.5017]
_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  0.0000  0.0000  0.1873  1.0
  Ce  Ce1  2  0.0000  0.0000  0.5000  1.0
  Zn  Zn2  8  0.0000  0.2716  0.3546  1.0
  Zn  Zn3  8  0.0000  0.3690  0.1623  1.0
  Ga  Ga4  4  0.0000  0.2141  0.0000  1.0
  Ga  Ga5  2  0.0000  0.5000  0.5000  1.0
]