data_[Pr4Mo8O30]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.5247]
_cell_length_b [7.6742]
_cell_length_c [12.0067]
_cell_angle_alpha [88.6995]
_cell_angle_beta [83.8997]
_cell_angle_gamma [84.4292]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Pr2Mo4O15]
_chemical_formula_sum '[Pr4 Mo8 O30]'
_cell_volume [686.1088]
_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
[
  Pr  Pr0  2  0.2435  0.4102  0.2224  1
  Pr  Pr1  2  0.3199  0.9104  0.7771  1
  Mo  Mo2  2  0.0959  0.6680  0.5322  1
  Mo  Mo3  2  0.2277  0.9250  0.1291  1
  Mo  Mo4  2  0.2737  0.4281  0.8722  1
  Mo  Mo5  2  0.4366  0.2501  0.5255  1
  O  O6  2  0.0037  0.9981  0.8469  1
  O  O7  2  0.0345  0.1714  0.5311  1
  O  O8  2  0.0534  0.5082  0.8427  1
  O  O9  2  0.0829  0.4792  0.4034  1
  O  O10  2  0.1328  0.7653  0.6610  1
  O  O11  2  0.2654  0.7148  0.1953  1
  O  O12  2  0.2770  0.4035  0.0195  1
  O  O13  2  0.2923  0.9005  0.9830  1
  O  O14  2  0.2970  0.4280  0.5872  1
  O  O15  2  0.3323  0.7129  0.4472  1
  O  O16  2  0.3374  0.2167  0.8133  1
  O  O17  2  0.3534  0.0916  0.1849  1
  O  O18  2  0.3778  0.0519  0.5950  1
  O  O19  2  0.4162  0.2606  0.3776  1
  O  O20  2  0.4267  0.5927  0.8203  1
]