data_[Tm16Al4Co2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Al  1.6100  1.2500  0.6750
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.1146]
_cell_length_b [5.2042]
_cell_length_c [6.6416]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.6620]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm8Al2Co]
_chemical_formula_sum '[Tm16 Al4 Co2]'
_cell_volume [549.7790]
_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  0.0142  0.0000  0.7779  1.0
  Tm  Tm1  4  0.0962  0.5000  0.4151  1.0
  Tm  Tm2  4  0.1444  0.5000  0.9340  1.0
  Tm  Tm3  4  0.2016  0.0000  0.2729  1.0
  Al  Al4  4  0.1792  0.0000  0.6977  1.0
  Co  Co5  2  0.0000  0.5000  0.0000  1.0
]