# generated using pymatgen
data_Li4MnF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.83607352
_cell_length_b   8.83607352
_cell_length_c   4.94861900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999641
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnF6
_chemical_formula_sum   'Li12 Mn3 F18'
_cell_volume   334.60567865
_cell_formula_units_Z   3
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  0.31430500  0.00000000  0.50000000  1
  Li  Li1  1  0.35063600  0.00000000  0.00000000  1
  Li  Li2  1  0.31430500  0.31430500  0.50000000  1
  Li  Li3  1  0.64936400  0.00000000  0.00000000  1
  Li  Li4  1  0.68569500  0.00000000  0.50000000  1
  Li  Li5  1  0.35063600  0.35063600  0.00000000  1
  Li  Li6  1  0.64936400  0.64936400  0.00000000  1
  Li  Li7  1  0.00000000  0.31430500  0.50000000  1
  Li  Li8  1  0.00000000  0.35063600  0.00000000  1
  Li  Li9  1  0.68569500  0.68569500  0.50000000  1
  Li  Li10  1  0.00000000  0.64936400  0.00000000  1
  Li  Li11  1  0.00000000  0.68569500  0.50000000  1
  Mn  Mn12  1  0.33333300  0.66666700  0.49191200  1
  Mn  Mn13  1  0.66666700  0.33333300  0.50808800  1
  Mn  Mn14  1  0.00000000  0.00000000  0.00000000  1
  F  F15  1  0.11950000  0.23900000  0.22892900  1
  F  F16  1  0.21332200  0.42664400  0.72482600  1
  F  F17  1  0.09462000  0.54731000  0.25928600  1
  F  F18  1  0.45269000  0.54731000  0.25928600  1
  F  F19  1  0.21332200  0.78667800  0.72482600  1
  F  F20  1  0.11950000  0.88050000  0.22892900  1
  F  F21  1  0.23900000  0.11950000  0.77107100  1
  F  F22  1  0.57335600  0.78667800  0.72482600  1
  F  F23  1  0.45269000  0.90538000  0.25928600  1
  F  F24  1  0.76100000  0.88050000  0.22892900  1
  F  F25  1  0.42664400  0.21332200  0.27517400  1
  F  F26  1  0.54731000  0.09462000  0.74071400  1
  F  F27  1  0.54731000  0.45269000  0.74071400  1
  F  F28  1  0.78667800  0.21332200  0.27517400  1
  F  F29  1  0.88050000  0.11950000  0.77107100  1
  F  F30  1  0.78667800  0.57335600  0.27517400  1
  F  F31  1  0.90538000  0.45269000  0.74071400  1
  F  F32  1  0.88050000  0.76100000  0.77107100  1
