data_[Tm16Ni4Rh2]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.8016]
_cell_length_b [4.9196]
_cell_length_c [6.5199]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.0823]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm8Ni2Rh]
_chemical_formula_sum '[Tm16 Ni4 Rh2]'
_cell_volume [517.8305]
_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  0.0360  0.0000  0.7897  1.0
  Tm  Tm1  4  0.0920  0.5000  0.4492  1.0
  Tm  Tm2  4  0.1706  0.5000  0.9777  1.0
  Tm  Tm3  4  0.2015  0.0000  0.3252  1.0
  Ni  Ni4  4  0.1872  0.0000  0.7188  1.0
  Rh  Rh5  2  0.0000  0.5000  0.0000  1.0
]