data_[Li4Mo8P4O32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mo  2.1600  1.4500  0.7750
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [5.2486]
_cell_length_b [6.7275]
_cell_length_c [17.7272]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [LiMo2PO8]
_chemical_formula_sum '[Li4 Mo8 P4 O32]'
_cell_volume [625.9432]
_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
[
  Li  Li0  4  0.2244  0.4873  0.2090  1
  Mo  Mo1  4  0.2446  0.4037  0.5485  1
  Mo  Mo2  4  0.2476  0.2532  0.8751  1
  P  P3  4  0.2343  0.0416  0.6921  1
  O  O4  4  0.0407  0.9649  0.4175  1
  O  O5  4  0.0446  0.7930  0.9898  1
  O  O6  4  0.0480  0.4649  0.8024  1
  O  O7  4  0.0495  0.5958  0.6167  1
  O  O8  4  0.0954  0.1100  0.1573  1
  O  O9  4  0.1631  0.9107  0.2723  1
  O  O10  4  0.2392  0.2414  0.6484  1
  O  O11  4  0.2406  0.4055  0.9566  1
]