data_[Na3Tm3In6Cl18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  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 [R3]
_cell_length_a [7.5325]
_cell_length_b [7.5325]
_cell_length_c [18.5438]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [NaTm(InCl3)2]
_chemical_formula_sum '[Na3 Tm3 In6 Cl18]'
_cell_volume [911.1791]
_cell_formula_units_Z [3]
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
[
  Na  Na0  3  0.0000  0.0000  0.8152  1.0
  Tm  Tm1  3  0.0000  0.0000  0.3195  1.0
  In  In2  3  0.0000  0.0000  0.0364  1.0
  In  In3  3  0.0000  0.0000  0.5383  1.0
  Cl  Cl4  9  0.0274  0.5908  0.0732  1.0
  Cl  Cl5  9  0.0995  0.3395  0.9108  1.0
]