data_[Mo2W10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mo  2.1600  1.4500  0.7750
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.0532]
_cell_length_b [3.1890]
_cell_length_c [6.3814]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.5415]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [MoW5]
_chemical_formula_sum '[Mo2 W10]'
_cell_volume [193.9636]
_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
[
  Mo  Mo0  2  0.0000  0.5000  0.5000  1.0
  W  W1  4  0.1665  0.0000  0.3336  1.0
  W  W2  4  0.1668  0.0000  0.8331  1.0
  W  W3  2  0.0000  0.5000  0.0000  1.0
]