# generated using pymatgen
data_LiMn2F5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.74227900
_cell_length_b   8.12174800
_cell_length_c   8.69112700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2F5
_chemical_formula_sum   'Li4 Mn8 F20'
_cell_volume   475.91821414
_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  0.75000000  0.16602900  0.31712900  1
  Li  Li1  1  0.75000000  0.33397100  0.81712900  1
  Li  Li2  1  0.25000000  0.66602900  0.18287100  1
  Li  Li3  1  0.25000000  0.83397100  0.68287100  1
  Mn  Mn4  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn5  1  0.50000000  0.00000000  0.00000000  1
  Mn  Mn6  1  0.25000000  0.10212700  0.33015100  1
  Mn  Mn7  1  0.25000000  0.39787300  0.83015100  1
  Mn  Mn8  1  0.00000000  0.50000000  0.50000000  1
  Mn  Mn9  1  0.50000000  0.50000000  0.50000000  1
  Mn  Mn10  1  0.75000000  0.60212700  0.16984900  1
  Mn  Mn11  1  0.75000000  0.89787300  0.66984900  1
  F  F12  1  0.75000000  0.04414400  0.49098600  1
  F  F13  1  0.51147900  0.13580800  0.20666400  1
  F  F14  1  0.98852100  0.13580800  0.20666400  1
  F  F15  1  0.75000000  0.10679400  0.87851700  1
  F  F16  1  0.25000000  0.15407000  0.92285000  1
  F  F17  1  0.25000000  0.34593000  0.42285000  1
  F  F18  1  0.75000000  0.39320600  0.37851700  1
  F  F19  1  0.51147900  0.36419200  0.70666400  1
  F  F20  1  0.98852100  0.36419200  0.70666400  1
  F  F21  1  0.75000000  0.45585600  0.99098600  1
  F  F22  1  0.25000000  0.54414400  0.00901400  1
  F  F23  1  0.01147900  0.63580800  0.29333600  1
  F  F24  1  0.48852100  0.63580800  0.29333600  1
  F  F25  1  0.25000000  0.60679400  0.62148300  1
  F  F26  1  0.75000000  0.65407000  0.57715000  1
  F  F27  1  0.75000000  0.84593000  0.07715000  1
  F  F28  1  0.25000000  0.89320600  0.12148300  1
  F  F29  1  0.01147900  0.86419200  0.79333600  1
  F  F30  1  0.48852100  0.86419200  0.79333600  1
  F  F31  1  0.25000000  0.95585600  0.50901400  1
