data_[Zn4Mo12O36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [14.8341]
_cell_length_b [7.5535]
_cell_length_c [10.6434]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.8582]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [Zn(MoO3)3]
_chemical_formula_sum '[Zn4 Mo12 O36]'
_cell_volume [978.5957]
_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
[
  Zn  Zn0  4  0.2508  0.2449  0.0046  1
  Mo  Mo1  4  0.0018  0.4949  0.2520  1
  Mo  Mo2  4  0.1296  0.8999  0.6949  1
  Mo  Mo3  4  0.3842  0.4009  0.8286  1
  O  O4  4  0.0674  0.3243  0.1934  1
  O  O5  4  0.1095  0.3875  0.9143  1
  O  O6  4  0.1580  0.0338  0.8505  1
  O  O7  4  0.2387  0.1363  0.1731  1
  O  O8  4  0.2712  0.3654  0.8393  1
  O  O9  4  0.3424  0.4679  0.1683  1
  O  O10  4  0.3973  0.1177  0.0894  1
  O  O11  4  0.4346  0.1856  0.8099  1
  O  O12  4  0.4968  0.4903  0.5038  1
]