# generated using pymatgen
data_LiMn2F6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.75630800
_cell_length_b   4.76293000
_cell_length_c   10.63825778
_cell_angle_alpha   65.07785319
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2F6
_chemical_formula_sum   'Li2 Mn4 F12'
_cell_volume   218.55717994
_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  0.00000000  0.00000000  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1
  Mn  Mn2  1  0.50039800  0.33019600  0.16596600  1
  Mn  Mn3  1  0.00039800  0.66980400  0.33403400  1
  Mn  Mn4  1  0.99960200  0.33019600  0.66596600  1
  Mn  Mn5  1  0.49960200  0.66980400  0.83403400  1
  F  F6  1  0.69625600  0.29704000  0.00471000  1
  F  F7  1  0.20013100  0.03731300  0.16675500  1
  F  F8  1  0.79700900  0.61824700  0.17718400  1
  F  F9  1  0.70013100  0.96268700  0.33324500  1
  F  F10  1  0.29700900  0.38175300  0.32281600  1
  F  F11  1  0.19625600  0.70296000  0.49529000  1
  F  F12  1  0.80374400  0.29704000  0.50471000  1
  F  F13  1  0.70299100  0.61824700  0.67718400  1
  F  F14  1  0.29986900  0.03731300  0.66675500  1
  F  F15  1  0.20299100  0.38175300  0.82281600  1
  F  F16  1  0.79986900  0.96268700  0.83324500  1
  F  F17  1  0.30374400  0.70296000  0.99529000  1
