data_[Tm14Zn4Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Zn  1.6500  1.3500  0.8800
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [7.3696]
_cell_length_b [10.5864]
_cell_length_c [7.4837]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Tm7(ZnAu)2]
_chemical_formula_sum '[Tm14 Zn4 Au4]'
_cell_volume [583.8649]
_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  0.2500  0.2500  0.2828  1
  Tm  Tm1  4  0.0000  0.5000  0.2618  1
  Tm  Tm2  2  0.0000  0.0000  0.0000  1
  Zn  Zn3  4  0.0000  0.2935  0.0000  1
  Au  Au4  4  0.1917  0.0000  0.5000  1
]