data_[Tb2B4Pt5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  B  2.0400  0.8500  0.4100
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.5203]
_cell_length_b [5.5639]
_cell_length_c [6.1884]
_cell_angle_alpha [72.0937]
_cell_angle_beta [81.3833]
_cell_angle_gamma [61.2993]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Tb2B4Pt5]
_chemical_formula_sum '[Tb2 B4 Pt5]'
_cell_volume [158.6469]
_cell_formula_units_Z [1]
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  1  0.0053  0.1489  0.7188  1
  Tb  Tb1  1  0.0150  0.8098  0.3148  1
  B  B2  1  0.1497  0.2512  0.2807  1
  B  B3  1  0.3807  0.3985  0.7468  1
  B  B4  1  0.6323  0.8719  0.7407  1
  B  B5  1  0.7997  0.4046  0.2872  1
  Pt  Pt6  1  0.0055  0.5900  0.9195  1
  Pt  Pt7  1  0.4777  0.0384  0.0532  1
  Pt  Pt8  1  0.4836  0.2430  0.4432  1
  Pt  Pt9  1  0.5201  0.5476  0.9858  1
  Pt  Pt10  1  0.5307  0.6959  0.5091  1
]