data_[Tm12Pt2Pb6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Pt  2.2800  1.3500  0.8050
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [11.6064]
_cell_length_b [3.6915]
_cell_length_c [13.9018]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.2527]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Tm6PtPb3]
_chemical_formula_sum '[Tm12 Pt2 Pb6]'
_cell_volume [565.6499]
_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  2  0.0863  0.2500  0.4348  1
  Tm  Tm1  2  0.1162  0.7500  0.8575  1
  Tm  Tm2  2  0.1692  0.7500  0.2419  1
  Tm  Tm3  2  0.2409  0.7500  0.6627  1
  Tm  Tm4  2  0.4006  0.2500  0.1044  1
  Tm  Tm5  2  0.4941  0.7500  0.3349  1
  Pt  Pt6  2  0.0669  0.2500  0.6930  1
  Pb  Pb7  2  0.1187  0.2500  0.0464  1
  Pb  Pb8  2  0.3320  0.7500  0.4752  1
  Pb  Pb9  2  0.3641  0.2500  0.8646  1
]