data_[Tm16Zn2Ni4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Zn  1.6500  1.3500  0.8800
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.1900]
_cell_length_b [4.9549]
_cell_length_c [6.6563]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.2083]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm8ZnNi2]
_chemical_formula_sum '[Tm16 Zn2 Ni4]'
_cell_volume [541.5704]
_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  0.0364  0.0000  0.7815  1.0
  Tm  Tm1  4  0.0947  0.5000  0.4701  1.0
  Tm  Tm2  4  0.1757  0.5000  0.9839  1.0
  Tm  Tm3  4  0.1993  0.0000  0.3294  1.0
  Zn  Zn4  2  0.0000  0.5000  0.0000  1.0
  Ni  Ni5  4  0.1826  0.0000  0.7164  1.0
]