# generated using pymatgen
data_LiMnF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.86448000
_cell_length_b   7.09813400
_cell_length_c   7.61470400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnF5
_chemical_formula_sum   'Li4 Mn4 F20'
_cell_volume   371.02644387
_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  0.75134300  0.25000000  0.01700800  1
  Li  Li1  1  0.25134300  0.75000000  0.48299200  1
  Li  Li2  1  0.74865700  0.25000000  0.51700800  1
  Li  Li3  1  0.24865700  0.75000000  0.98299200  1
  Mn  Mn4  1  0.74696600  0.75000000  0.11950700  1
  Mn  Mn5  1  0.24696600  0.25000000  0.38049300  1
  Mn  Mn6  1  0.75303400  0.75000000  0.61950700  1
  Mn  Mn7  1  0.25303400  0.25000000  0.88049300  1
  F  F8  1  0.01193700  0.75000000  0.11551800  1
  F  F9  1  0.48158600  0.75000000  0.12492100  1
  F  F10  1  0.25845800  0.25000000  0.12913700  1
  F  F11  1  0.74615000  0.00609500  0.12244700  1
  F  F12  1  0.74615000  0.49390500  0.12244700  1
  F  F13  1  0.24615000  0.50609500  0.37755300  1
  F  F14  1  0.24615000  0.99390500  0.37755300  1
  F  F15  1  0.75845800  0.75000000  0.37086300  1
  F  F16  1  0.98158600  0.25000000  0.37507900  1
  F  F17  1  0.51193700  0.25000000  0.38448200  1
  F  F18  1  0.48806300  0.75000000  0.61551800  1
  F  F19  1  0.01841400  0.75000000  0.62492100  1
  F  F20  1  0.24154200  0.25000000  0.62913700  1
  F  F21  1  0.75385000  0.00609500  0.62244700  1
  F  F22  1  0.75385000  0.49390500  0.62244700  1
  F  F23  1  0.25385000  0.50609500  0.87755300  1
  F  F24  1  0.25385000  0.99390500  0.87755300  1
  F  F25  1  0.74154200  0.75000000  0.87086300  1
  F  F26  1  0.51841400  0.25000000  0.87507900  1
  F  F27  1  0.98806300  0.25000000  0.88448200  1
