data_[Nb8Mo8H24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  Mo  2.1600  1.4500  0.7750
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [7.8533]
_cell_length_b [10.4328]
_cell_length_c [4.6756]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.3247]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [NbMoH3]
_chemical_formula_sum '[Nb8 Mo8 H24]'
_cell_volume [365.7026]
_cell_formula_units_Z [8]
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
[
  Nb  Nb0  8  0.1742  0.4179  0.0669  1
  Mo  Mo1  4  0.0000  0.0775  0.2500  1
  Mo  Mo2  4  0.0000  0.2001  0.7500  1
  H  H3  8  0.0932  0.3975  0.6150  1
  H  H4  8  0.1510  0.2099  0.1352  1
  H  H5  8  0.1733  0.1687  0.5541  1
]