data_[Mo24H96C32N8O80]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mo  2.1600  1.4500  0.7750
  H  2.2000  0.2500  0.0000
  C  2.5500  0.7000  0.3000
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Fm-3m]
_cell_length_a [14.5589]
_cell_length_b [14.5589]
_cell_length_c [14.5589]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [225]
_chemical_formula_structural [Mo3H12C4NO10]
_chemical_formula_sum '[Mo24 H96 C32 N8 O80]'
_cell_volume [3085.9406]
_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
[
  Mo  Mo0  24  0.0000  0.0000  0.1618  1
  H  H1  96  0.1475  0.1475  0.2651  1
  C  C2  32  0.1904  0.1904  0.3096  1
  N  N3  8  0.2500  0.2500  0.2500  1
  O  O4  48  0.0000  0.1309  0.1309  1
  O  O5  24  0.0000  0.0000  0.2796  1
  O  O6  4  0.0000  0.0000  0.0000  1
  O  O7  4  0.0000  0.0000  0.5000  1
]