# generated using pymatgen
data_Li4MnO2F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85025206
_cell_length_b   7.68513735
_cell_length_c   7.78869035
_cell_angle_alpha   85.91131220
_cell_angle_beta   88.36596273
_cell_angle_gamma   64.32106055
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnO2F3
_chemical_formula_sum   'Li16 Mn4 O8 F12'
_cell_volume   368.59807762
_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  1  0.49999400  0.50000800  0.99999600  1
  Li  Li1  1  0.00000500  0.49999300  0.50000400  1
  Li  Li2  1  0.25000100  0.00000000  0.24999800  1
  Li  Li3  1  0.75000200  0.99999800  0.74999900  1
  Li  Li4  1  0.69319600  0.68155400  0.19787000  1
  Li  Li5  1  0.19320300  0.68155800  0.69787900  1
  Li  Li6  1  0.30679700  0.31843900  0.80212000  1
  Li  Li7  1  0.80680600  0.31844500  0.30213200  1
  Li  Li8  1  0.40227900  0.90967000  0.89176100  1
  Li  Li9  1  0.90229000  0.90967100  0.39177000  1
  Li  Li10  1  0.59771200  0.09032400  0.10823000  1
  Li  Li11  1  0.09772100  0.09033000  0.60824100  1
  Li  Li12  1  0.13078300  0.40864400  0.13425500  1
  Li  Li13  1  0.63078300  0.40865700  0.63426000  1
  Li  Li14  1  0.86921900  0.59134300  0.86573800  1
  Li  Li15  1  0.36922000  0.59135400  0.36574500  1
  Mn  Mn16  1  0.44228400  0.20008100  0.46123900  1
  Mn  Mn17  1  0.05772400  0.79991600  0.03875900  1
  Mn  Mn18  1  0.94224300  0.20005900  0.96128500  1
  Mn  Mn19  1  0.55773700  0.79994800  0.53871700  1
  O  O20  1  0.56577000  0.96040000  0.34000600  1
  O  O21  1  0.06574100  0.96038400  0.84007600  1
  O  O22  1  0.43425400  0.03962500  0.65992200  1
  O  O23  1  0.93422700  0.03960200  0.15999500  1
  O  O24  1  0.82628500  0.43341500  0.06773400  1
  O  O25  1  0.32629400  0.43341200  0.56770700  1
  O  O26  1  0.17370800  0.56658700  0.93229100  1
  O  O27  1  0.67370700  0.56659300  0.43227100  1
  F  F28  1  0.61524600  0.25188800  0.87192100  1
  F  F29  1  0.11525200  0.25189000  0.37191200  1
  F  F30  1  0.38475000  0.74810600  0.12808900  1
  F  F31  1  0.88475700  0.74811100  0.62807900  1
  F  F32  1  0.02753800  0.65913500  0.26296800  1
  F  F33  1  0.52753500  0.65915400  0.76294200  1
  F  F34  1  0.97246400  0.34084800  0.73706000  1
  F  F35  1  0.47246800  0.34086200  0.23702800  1
  F  F36  1  0.71232700  0.85023600  0.97391600  1
  F  F37  1  0.21232700  0.85023700  0.47391400  1
  F  F38  1  0.28767300  0.14976100  0.02608700  1
  F  F39  1  0.78767600  0.14976200  0.52608300  1
