# generated using pymatgen
data_LiMnF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.19547800
_cell_length_b   5.97720700
_cell_length_c   8.33816400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnF3
_chemical_formula_sum   'Li4 Mn4 F12'
_cell_volume   258.93707593
_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  0.96988500  0.64615700  0.75000000  1
  Li  Li1  1  0.53011500  0.14615700  0.75000000  1
  Li  Li2  1  0.46988500  0.85384300  0.25000000  1
  Li  Li3  1  0.03011500  0.35384300  0.25000000  1
  Mn  Mn4  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn5  1  0.00000000  0.00000000  0.50000000  1
  Mn  Mn6  1  0.50000000  0.50000000  0.00000000  1
  Mn  Mn7  1  0.50000000  0.50000000  0.50000000  1
  F  F8  1  0.34027400  0.52610400  0.25000000  1
  F  F9  1  0.31664800  0.19853800  0.57234300  1
  F  F10  1  0.31664800  0.19853800  0.92765700  1
  F  F11  1  0.18335200  0.69853800  0.57234300  1
  F  F12  1  0.18335200  0.69853800  0.92765700  1
  F  F13  1  0.15972600  0.02610400  0.25000000  1
  F  F14  1  0.84027400  0.97389600  0.75000000  1
  F  F15  1  0.81664800  0.30146200  0.42765700  1
  F  F16  1  0.81664800  0.30146200  0.07234300  1
  F  F17  1  0.68335200  0.80146200  0.07234300  1
  F  F18  1  0.68335200  0.80146200  0.42765700  1
  F  F19  1  0.65972600  0.47389600  0.75000000  1
