data_[Ce12Ga2Sn10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ga  1.8100  1.3000  0.7600
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.8743]
_cell_length_b [9.0024]
_cell_length_c [14.5929]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Ce6GaSn5]
_chemical_formula_sum '[Ce12 Ga2 Sn10]'
_cell_volume [640.3399]
_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  8  0.0000  0.2449  0.1636  1
  Ce  Ce1  4  0.0000  0.2603  0.5000  1
  Ga  Ga2  2  0.0000  0.0000  0.0000  1
  Sn  Sn3  4  0.0000  0.0000  0.3361  1
  Sn  Sn4  4  0.0000  0.5000  0.3318  1
  Sn  Sn5  2  0.0000  0.5000  0.0000  1
]