data_[Tm24Ir4Pb10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ir  2.2000  1.3500  0.7650
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.0586]
_cell_length_b [7.5434]
_cell_length_c [9.5744]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.5247]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm12Ir2Pb5]
_chemical_formula_sum '[Tm24 Ir4 Pb10]'
_cell_volume [1187.0848]
_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  8  0.1430  0.2604  0.5683  1
  Tm  Tm1  8  0.1596  0.2581  0.0892  1
  Tm  Tm2  4  0.0057  0.0000  0.8310  1
  Tm  Tm3  4  0.0059  0.5000  0.2447  1
  Ir  Ir4  4  0.0000  0.2941  0.0000  1
  Pb  Pb5  4  0.1911  0.5000  0.8398  1
  Pb  Pb6  4  0.2086  0.5000  0.3650  1
  Pb  Pb7  2  0.0000  0.0000  0.5000  1
]