data_[U9Mo18O72]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P3]
_cell_length_a [17.7398]
_cell_length_b [17.7398]
_cell_length_c [6.2190]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [143]
_chemical_formula_structural [U(MoO4)2]
_chemical_formula_sum '[U9 Mo18 O72]'
_cell_volume [1694.9107]
_cell_formula_units_Z [9]
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
[
  U  U0  3  0.0027  0.3340  0.2612  1
  U  U1  3  0.3341  0.3336  0.7504  1
  U  U2  1  0.0000  0.0000  0.0049  1
  U  U3  1  0.3333  0.6667  0.5288  1
  U  U4  1  0.6667  0.3333  0.0100  1
  Mo  Mo5  3  0.0695  0.2298  0.7619  1
  Mo  Mo6  3  0.1078  0.5053  0.7512  1
  Mo  Mo7  3  0.1706  0.7314  0.2545  1
  Mo  Mo8  3  0.2287  0.1608  0.2509  1
  Mo  Mo9  3  0.4385  0.1700  0.7666  1
  Mo  Mo10  3  0.5052  0.4044  0.2532  1
  O  O11  3  0.0239  0.2475  0.5222  1
  O  O12  3  0.0246  0.2562  0.9870  1
  O  O13  3  0.0401  0.5517  0.7322  1
  O  O14  3  0.0418  0.1150  0.7977  1
  O  O15  3  0.0833  0.4397  0.9878  1
  O  O16  3  0.0883  0.4368  0.5211  1
  O  O17  3  0.0891  0.6875  0.4605  1
  O  O18  3  0.1144  0.0728  0.2130  1
  O  O19  3  0.1168  0.8160  0.7595  1
  O  O20  3  0.1180  0.6874  0.0037  1
  O  O21  3  0.1542  0.3696  0.2494  1
  O  O22  3  0.2239  0.5913  0.7462  1
  O  O23  3  0.2453  0.2203  0.4958  1
  O  O24  3  0.2545  0.7016  0.3268  1
  O  O25  3  0.2561  0.2348  0.0298  1
  O  O26  3  0.2986  0.1163  0.2519  1
  O  O27  3  0.3731  0.2196  0.7721  1
  O  O28  3  0.4110  0.0968  0.9888  1
  O  O29  3  0.4171  0.1070  0.5254  1
  O  O30  3  0.4336  0.3664  0.0259  1
  O  O31  3  0.4426  0.3526  0.4896  1
  O  O32  3  0.4815  0.0309  0.2718  1
  O  O33  3  0.5545  0.2542  0.8009  1
  O  O34  3  0.5914  0.3759  0.2079  1
]