data_[Tm2Be3Al1Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Be  1.5700  1.0500  0.5900
  Al  1.6100  1.2500  0.6750
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.1844]
_cell_length_b [4.1844]
_cell_length_c [9.8140]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Tm2Be3AlAu4]
_chemical_formula_sum '[Tm2 Be3 Al1 Au4]'
_cell_volume [171.8332]
_cell_formula_units_Z [1]
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  2  0.0000  0.5000  0.7514  1.0
  Be  Be1  2  0.0000  0.5000  0.1203  1.0
  Be  Be2  1  0.0000  0.0000  0.5000  1.0
  Al  Al3  1  0.5000  0.5000  0.5000  1.0
  Au  Au4  2  0.0000  0.5000  0.3553  1.0
  Au  Au5  1  0.0000  0.0000  0.0000  1.0
  Au  Au6  1  0.5000  0.5000  0.0000  1.0
]