data_[Tm4Mg8Zn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Mg  1.3100  1.5000  0.8600
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.7430]
_cell_length_b [18.0685]
_cell_length_c [4.6838]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Tm(MgZn)2]
_chemical_formula_sum '[Tm4 Mg8 Zn8]'
_cell_volume [401.3947]
_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  0.1594  0.2500  1
  Mg  Mg1  4  0.0000  0.3456  0.2500  1
  Mg  Mg2  4  0.0000  0.4542  0.7500  1
  Zn  Zn3  4  0.0000  0.0439  0.7500  1
  Zn  Zn4  4  0.0000  0.2538  0.7500  1
]