# generated using pymatgen
data_LiMnF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04817300
_cell_length_b   5.38545300
_cell_length_c   9.00696600
_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   244.86966839
_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  0.00000000  0.25000000  0.18776700  1
  Li  Li1  1  0.00000000  0.75000000  0.81223300  1
  Li  Li2  1  0.50000000  0.75000000  0.68776700  1
  Li  Li3  1  0.50000000  0.25000000  0.31223300  1
  Mn  Mn4  1  0.00000000  0.75000000  0.40188200  1
  Mn  Mn5  1  0.00000000  0.25000000  0.59811800  1
  Mn  Mn6  1  0.50000000  0.75000000  0.09811800  1
  Mn  Mn7  1  0.50000000  0.25000000  0.90188200  1
  F  F8  1  0.78122200  0.91474800  0.58734700  1
  F  F9  1  0.78122200  0.41474800  0.41265300  1
  F  F10  1  0.75000000  0.45225400  0.75000000  1
  F  F11  1  0.75000000  0.95225400  0.25000000  1
  F  F12  1  0.71877800  0.41474800  0.08734700  1
  F  F13  1  0.71877800  0.91474800  0.91265300  1
  F  F14  1  0.28122200  0.08525200  0.08734700  1
  F  F15  1  0.28122200  0.58525200  0.91265300  1
  F  F16  1  0.25000000  0.54774600  0.25000000  1
  F  F17  1  0.25000000  0.04774600  0.75000000  1
  F  F18  1  0.21877800  0.08525200  0.41265300  1
  F  F19  1  0.21877800  0.58525200  0.58734700  1
