data_[Tm2In4Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  In  1.7800  1.5500  0.9400
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1709]
_cell_length_b [7.3658]
_cell_length_c [13.3728]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.0111]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Tm(InCl3)2]
_chemical_formula_sum '[Tm2 In4 Cl12]'
_cell_volume [605.3816]
_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
[
  Tm  Tm0  2  0.5000  0.0000  0.5000  1.0
  In  In1  4  0.1876  0.0259  0.6955  1.0
  Cl  Cl2  4  0.1835  0.1926  0.4874  1.0
  Cl  Cl3  4  0.2000  0.7267  0.8529  1.0
  Cl  Cl4  4  0.4867  0.1740  0.3236  1.0
]