data_[Li4Mn2P2O8F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.4489]
_cell_length_b [5.4651]
_cell_length_c [7.5365]
_cell_angle_alpha [107.1480]
_cell_angle_beta [106.6638]
_cell_angle_gamma [94.9754]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li2MnPO4F]
_chemical_formula_sum '[Li4 Mn2 P2 O8 F2]'
_cell_volume [201.8147]
_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  1  0.0009  0.4994  0.5147  1.0
  Li  Li1  1  0.4131  0.7524  0.8480  1.0
  Li  Li2  1  0.5512  0.1948  0.1691  1.0
  Li  Li3  1  0.8685  0.5507  0.1535  1.0
  Mn  Mn4  1  0.0186  0.0180  0.5134  1.0
  Mn  Mn5  1  0.9977  0.0042  0.9910  1.0
  P  P6  1  0.3751  0.6597  0.2303  1.0
  P  P7  1  0.6312  0.3454  0.7616  1.0
  O  O8  1  0.2087  0.7269  0.3689  1.0
  O  O9  1  0.2585  0.3763  0.0878  1.0
  O  O10  1  0.3408  0.3472  0.6587  1.0
  O  O11  1  0.3510  0.8554  0.1127  1.0
  O  O12  1  0.6564  0.1611  0.8894  1.0
  O  O13  1  0.6690  0.6668  0.3349  1.0
  O  O14  1  0.7474  0.6298  0.9133  1.0
  O  O15  1  0.7804  0.2751  0.6144  1.0
  F  F16  1  0.0908  0.8298  0.7253  1.0
  F  F17  1  0.9092  0.1792  0.2716  1.0
]