data_[Tb4Cu2P2Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Cu  1.9000  1.3500  0.8200
  P  2.1900  1.0000  0.5500
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [5.5308]
_cell_length_b [8.6232]
_cell_length_c [8.0280]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Tb2CuPPt6]
_chemical_formula_sum '[Tb4 Cu2 P2 Pt12]'
_cell_volume [382.8863]
_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
[
  Tb  Tb0  4  0.0000  0.2257  0.2726  1.0
  Cu  Cu1  2  0.0000  0.5000  0.7153  1.0
  P  P2  2  0.0000  0.0000  0.7666  1.0
  Pt  Pt3  4  0.0000  0.2481  0.8838  1.0
  Pt  Pt4  4  0.2421  0.5000  0.4564  1.0
  Pt  Pt5  4  0.2473  0.5000  0.9856  1.0
]