data_[Tm4Al12Ni4Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Al  1.6100  1.2500  0.6750
  Ni  1.9100  1.3500  0.7400
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [6.0950]
_cell_length_b [12.2825]
_cell_length_c [5.7332]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [TmAl3NiAu]
_chemical_formula_sum '[Tm4 Al12 Ni4 Au4]'
_cell_volume [429.1946]
_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  4  0.0000  0.2783  0.7500  1
  Al  Al1  8  0.2155  0.5000  0.0000  1
  Al  Al2  4  0.0000  0.1337  0.2500  1
  Ni  Ni3  4  0.0000  0.0688  0.7500  1
  Au  Au4  4  0.0000  0.3432  0.2500  1
]