data_[La12Ga4Te2I6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Te  2.1000  1.4000  1.2933
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8922]
_cell_length_b [13.6405]
_cell_length_c [8.0325]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0351]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6Ga2TeI3]
_chemical_formula_sum '[La12 Ga4 Te2 I6]'
_cell_volume [817.4425]
_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
[
  La  La0  8  0.2474  0.1743  0.2162  1.0
  La  La1  4  0.2196  0.5000  0.2113  1.0
  Ga  Ga2  4  0.0000  0.3320  0.0000  1.0
  Te  Te3  2  0.0000  0.0000  0.0000  1.0
  I  I4  4  0.0000  0.1612  0.5000  1.0
  I  I5  2  0.0000  0.5000  0.5000  1.0
]