data_[Tm4Ni6Ge4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ni  1.9100  1.3500  0.7400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.1072]
_cell_length_b [3.8004]
_cell_length_c [6.5731]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.6704]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm2Ni3Ge2]
_chemical_formula_sum '[Tm4 Ni6 Ge4]'
_cell_volume [229.4363]
_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  4  0.1319  0.0000  0.7604  1.0
  Ni  Ni1  4  0.1137  0.5000  0.4314  1.0
  Ni  Ni2  2  0.0000  0.5000  0.0000  1.0
  Ge  Ge3  4  0.1508  0.0000  0.2295  1.0
]