data_[Zr14Bi4H4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Bi  2.0200  1.6000  1.0350
  H  2.2000  0.2500  0.0000
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.1388]
_cell_length_b [6.1424]
_cell_length_c [13.0142]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.3319]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zr7Bi2H2Pb]
_chemical_formula_sum '[Zr14 Bi4 H4 Pb2]'
_cell_volume [481.1574]
_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
[
  Zr  Zr0  8  0.1727  0.2511  0.8106  1.0
  Zr  Zr1  4  0.1578  0.5000  0.4015  1.0
  Zr  Zr2  2  0.0000  0.5000  0.0000  1.0
  Bi  Bi3  4  0.1485  0.0000  0.3663  1.0
  H  H4  4  0.0686  0.5000  0.1678  1.0
  Pb  Pb5  2  0.0000  0.0000  0.0000  1.0
]