data_[Tm4Ga4Au6]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.4562]
_cell_length_b [4.0833]
_cell_length_c [7.1934]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.2625]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm2Ga2Au3]
_chemical_formula_sum '[Tm4 Ga4 Au6]'
_cell_volume [280.0028]
_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  4  0.1324  0.0000  0.7676  1.0
  Ga  Ga1  4  0.1563  0.0000  0.2041  1.0
  Au  Au2  4  0.1159  0.5000  0.4393  1.0
  Au  Au3  2  0.0000  0.5000  0.0000  1.0
]