data_[Tm12Rh10Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Rh  2.2800  1.3500  0.7450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.8112]
_cell_length_b [14.4159]
_cell_length_c [6.8475]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Tm6Rh5Au]
_chemical_formula_sum '[Tm12 Rh10 Au2]'
_cell_volume [474.9244]
_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  8  0.0000  0.1699  0.2517  1
  Tm  Tm1  4  0.0000  0.5000  0.2563  1
  Rh  Rh2  4  0.0000  0.3328  0.0000  1
  Rh  Rh3  4  0.0000  0.3338  0.5000  1
  Rh  Rh4  2  0.0000  0.0000  0.5000  1
  Au  Au5  2  0.0000  0.0000  0.0000  1
]