data_[Tl2Bi2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Bi  2.0200  1.6000  1.0350
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0082]
_cell_length_b [5.5799]
_cell_length_c [6.4169]
_cell_angle_alpha [71.6535]
_cell_angle_beta [68.1660]
_cell_angle_gamma [64.8434]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TlBiH]
_chemical_formula_sum '[Tl2 Bi2 H2]'
_cell_volume [148.0273]
_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
[
  Tl  Tl0  2  0.4057  0.8609  0.3218  1
  Bi  Bi1  2  0.1877  0.7083  0.9107  1
  H  H2  2  0.0262  0.5038  0.4354  1
]