data_[Y6B3H3Pt18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  B  2.0400  0.8500  0.4100
  H  2.2000  0.2500  0.0000
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.8401]
_cell_length_b [5.8401]
_cell_length_c [15.9046]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Y2BHPt6]
_chemical_formula_sum '[Y6 B3 H3 Pt18]'
_cell_volume [469.7733]
_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
[
  Y  Y0  3  0.0000  0.0000  0.2699  1.0
  Y  Y1  3  0.0000  0.0000  0.7498  1.0
  B  B2  3  0.0000  0.0000  0.0070  1.0
  H  H3  3  0.0000  0.0000  0.4182  1.0
  Pt  Pt4  9  0.0011  0.5005  0.2541  1.0
  Pt  Pt5  9  0.0141  0.5071  0.7710  1.0
]