data_[Tm6Ni36P9Pt3]
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
  P  2.1900  1.0000  0.5500
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.4986]
_cell_length_b [8.4986]
_cell_length_c [11.5959]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Tm2Ni12P3Pt]
_chemical_formula_sum '[Tm6 Ni36 P9 Pt3]'
_cell_volume [725.3164]
_cell_formula_units_Z [3]
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  6  0.0000  0.0000  0.2891  1
  Ni  Ni1  18  0.0034  0.5017  0.3132  1
  Ni  Ni2  18  0.0186  0.5093  0.1107  1
  P  P3  9  0.0000  0.5000  0.5000  1
  Pt  Pt4  3  0.0000  0.0000  0.0000  1
]