data_[Rb6Co6H18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Co  1.8800  1.3500  0.7683
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [5.5841]
_cell_length_b [5.5841]
_cell_length_c [13.1051]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [194]
_chemical_formula_structural [RbCoH3]
_chemical_formula_sum '[Rb6 Co6 H18]'
_cell_volume [353.8925]
_cell_formula_units_Z [6]
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  4  0.3333  0.6667  0.0970  1
  Rb  Rb1  2  0.0000  0.0000  0.2500  1
  Co  Co2  4  0.3333  0.6667  0.6605  1
  Co  Co3  2  0.0000  0.0000  0.0000  1
  H  H4  12  0.1946  0.3892  0.5870  1
  H  H5  6  0.0869  0.5435  0.7500  1
]