data_[Hg4B4H4Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  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 [C2/m]
_cell_length_a [12.9250]
_cell_length_b [3.5411]
_cell_length_c [7.4639]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.5229]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HgBHPt3]
_chemical_formula_sum '[Hg4 B4 H4 Pt12]'
_cell_volume [334.7233]
_cell_formula_units_Z [4]
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
[
  Hg  Hg0  4  0.1364  0.5000  0.0318  1.0
  B  B1  4  0.1435  0.5000  0.5469  1.0
  H  H2  4  0.0094  0.0000  0.7319  1.0
  Pt  Pt3  4  0.0145  0.5000  0.3143  1.0
  Pt  Pt4  4  0.1571  0.0000  0.7235  1.0
  Pt  Pt5  4  0.1855  0.0000  0.3553  1.0
]