data_[Rb12Mo4H28]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Mo  2.1600  1.4500  0.7750
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Fmm2]
_cell_length_a [8.9629]
_cell_length_b [9.3256]
_cell_length_c [8.7428]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [42]
_chemical_formula_structural [Rb3MoH7]
_chemical_formula_sum '[Rb12 Mo4 H28]'
_cell_volume [730.7649]
_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
[
  Rb  Rb0  8  0.2500  0.2500  0.2876  1
  Rb  Rb1  4  0.0000  0.0000  0.5526  1
  Mo  Mo2  4  0.0000  0.0000  0.0327  1
  H  H3  8  0.0000  0.2013  0.0329  1
  H  H4  8  0.1127  0.0000  0.8653  1
  H  H5  8  0.1937  0.0000  0.0899  1
  H  H6  4  0.0000  0.0000  0.2408  1
]