data_[Rb6H2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  H  2.2000  0.2500  0.0000
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.2699]
_cell_length_b [4.9398]
_cell_length_c [13.0899]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.5546]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Rb3HAu]
_chemical_formula_sum '[Rb6 H2 Au2]'
_cell_volume [527.3257]
_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
[
  Rb  Rb0  2  0.2059  0.7500  0.7356  1.0
  Rb  Rb1  2  0.2417  0.2500  0.0568  1.0
  Rb  Rb2  2  0.3831  0.7500  0.3836  1.0
  H  H3  2  0.4400  0.7500  0.6063  1.0
  Au  Au4  2  0.0403  0.7500  0.1874  1.0
]