data_[Tm16Ga4Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ga  1.8100  1.3000  0.7600
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.6518]
_cell_length_b [13.2186]
_cell_length_c [6.1706]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.6875]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tm4GaBi]
_chemical_formula_sum '[Tm16 Ga4 Bi4]'
_cell_volume [655.7453]
_cell_formula_units_Z [4]
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  8  0.1033  0.1813  0.5589  1.0
  Tm  Tm1  8  0.2121  0.4099  0.8610  1.0
  Ga  Ga2  4  0.0000  0.0009  0.2500  1.0
  Bi  Bi3  4  0.0000  0.3861  0.2500  1.0
]