data_[Hf14Hg2Bi4H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Hg  2.0000  1.5000  1.2450
  Bi  2.0200  1.6000  1.0350
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.1188]
_cell_length_b [6.1114]
_cell_length_c [12.4407]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.3875]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Hf7Hg(BiH)2]
_chemical_formula_sum '[Hf14 Hg2 Bi4 H4]'
_cell_volume [457.5819]
_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
[
  Hf  Hf0  8  0.1811  0.2507  0.8146  1.0
  Hf  Hf1  4  0.1395  0.5000  0.3959  1.0
  Hf  Hf2  2  0.0000  0.5000  0.0000  1.0
  Hg  Hg3  2  0.0000  0.0000  0.0000  1.0
  Bi  Bi4  4  0.1368  0.0000  0.3692  1.0
  H  H5  4  0.0631  0.5000  0.1687  1.0
]