data_[Li6Mo2P4O16]
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 [C2/m]
_cell_length_a [8.4320]
_cell_length_b [5.5753]
_cell_length_c [6.2494]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.1821]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li3Mo(PO4)2]
_chemical_formula_sum '[Li6 Mo2 P4 O16]'
_cell_volume [293.7846]
_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
[
  Li  Li0  4  0.1664  0.0000  0.2812  1.0
  Li  Li1  2  0.0000  0.5000  0.5000  1.0
  Mo  Mo2  2  0.0000  0.5000  0.0000  1.0
  P  P3  4  0.1490  0.0000  0.7623  1.0
  O  O4  8  0.0335  0.2233  0.7586  1.0
  O  O5  4  0.2428  0.5000  0.4314  1.0
  O  O6  4  0.2454  0.0000  0.9751  1.0
]