# generated using pymatgen
data_Li5MnO3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.35478700
_cell_length_b   7.03464000
_cell_length_c   9.51022400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5MnO3F
_chemical_formula_sum   'Li20 Mn4 O12 F4'
_cell_volume   425.14161881
_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  0.00056200  0.92530800  0.38292300  1
  Li  Li1  1  0.50673500  0.95956000  0.37602400  1
  Li  Li2  1  0.99326500  0.95956000  0.87602400  1
  Li  Li3  1  0.49943800  0.92530800  0.88292300  1
  Li  Li4  1  0.24390200  0.75000000  0.10674200  1
  Li  Li5  1  0.25609800  0.75000000  0.60674200  1
  Li  Li6  1  0.00056200  0.57469200  0.38292300  1
  Li  Li7  1  0.50673500  0.54044000  0.37602400  1
  Li  Li8  1  0.99326500  0.54044000  0.87602400  1
  Li  Li9  1  0.49943800  0.57469200  0.88292300  1
  Li  Li10  1  0.00673500  0.45956000  0.12397600  1
  Li  Li11  1  0.99943800  0.42530800  0.61707700  1
  Li  Li12  1  0.50056200  0.42530800  0.11707700  1
  Li  Li13  1  0.49326500  0.45956000  0.62397600  1
  Li  Li14  1  0.74390200  0.25000000  0.39325800  1
  Li  Li15  1  0.75609800  0.25000000  0.89325800  1
  Li  Li16  1  0.99943800  0.07469200  0.61707700  1
  Li  Li17  1  0.00673500  0.04044000  0.12397600  1
  Li  Li18  1  0.49326500  0.04044000  0.62397600  1
  Li  Li19  1  0.50056200  0.07469200  0.11707700  1
  Mn  Mn20  1  0.75631000  0.75000000  0.09716500  1
  Mn  Mn21  1  0.74369000  0.75000000  0.59716500  1
  Mn  Mn22  1  0.25631000  0.25000000  0.40283500  1
  Mn  Mn23  1  0.24369000  0.25000000  0.90283500  1
  O  O24  1  0.74553200  0.00474900  0.99888100  1
  O  O25  1  0.75446800  0.00474900  0.49888100  1
  O  O26  1  0.00140100  0.75000000  0.22893800  1
  O  O27  1  0.49859900  0.75000000  0.72893800  1
  O  O28  1  0.74553200  0.49525100  0.99888100  1
  O  O29  1  0.75446800  0.49525100  0.49888100  1
  O  O30  1  0.25446800  0.50474900  0.00111900  1
  O  O31  1  0.24553200  0.50474900  0.50111900  1
  O  O32  1  0.99859900  0.25000000  0.77106200  1
  O  O33  1  0.50140100  0.25000000  0.27106200  1
  O  O34  1  0.24553200  0.99525100  0.50111900  1
  O  O35  1  0.25446800  0.99525100  0.00111900  1
  F  F36  1  0.00950400  0.75000000  0.74176800  1
  F  F37  1  0.49049600  0.75000000  0.24176800  1
  F  F38  1  0.99049600  0.25000000  0.25823200  1
  F  F39  1  0.50950400  0.25000000  0.75823200  1
