data_[Tm4Cd1In3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.6970]
_cell_length_b [4.7660]
_cell_length_c [11.9695]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Tm4CdIn3]
_chemical_formula_sum '[Tm4 Cd1 In3]'
_cell_volume [210.9020]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.1580  1
  Tm  Tm1  1  0.0000  0.5000  0.8425  1
  Tm  Tm2  1  0.5000  0.0000  0.6605  1
  Tm  Tm3  1  0.5000  0.5000  0.3379  1
  Cd  Cd4  1  0.5000  0.5000  0.0761  1
  In  In5  1  0.0000  0.0000  0.4219  1
  In  In6  1  0.0000  0.5000  0.5789  1
  In  In7  1  0.5000  0.0000  0.9242  1
]