data_[La8Zn2Cl10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Zn  1.6500  1.3500  0.8800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.3002]
_cell_length_b [4.0870]
_cell_length_c [8.8216]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.8091]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La4ZnCl5]
_chemical_formula_sum '[La8 Zn2 Cl10]'
_cell_volume [643.3776]
_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  4  0.0039  0.0000  0.2457  1
  La  La1  4  0.1661  0.5000  0.0761  1
  Zn  Zn2  2  0.0000  0.5000  0.0000  1
  Cl  Cl3  4  0.1645  0.0000  0.8307  1
  Cl  Cl4  4  0.1686  0.0000  0.3126  1
  Cl  Cl5  2  0.0000  0.5000  0.5000  1
]