data_[Tm12Ge12Ru8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ge  2.0100  1.2500  0.7700
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [4.2409]
_cell_length_b [10.6978]
_cell_length_c [13.8060]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Tm3Ge3Ru2]
_chemical_formula_sum '[Tm12 Ge12 Ru8]'
_cell_volume [626.3546]
_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  8  0.0000  0.0773  0.6137  1.0
  Tm  Tm1  4  0.0000  0.3536  0.7500  1.0
  Ge  Ge2  8  0.0000  0.3857  0.5406  1.0
  Ge  Ge3  4  0.0000  0.3390  0.2500  1.0
  Ru  Ru4  8  0.0000  0.2128  0.0833  1.0
]