# generated using pymatgen
data_LiMn3OF8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.73532600
_cell_length_b   5.13787300
_cell_length_c   23.15704776
_cell_angle_alpha   80.45940366
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn3OF8
_chemical_formula_sum   'Li4 Mn12 O4 F32'
_cell_volume   672.93908314
_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  0.01571800  0.10017500  0.46633200  1
  Li  Li1  1  0.98428200  0.10017500  0.96633200  1
  Li  Li2  1  0.51289300  0.88177600  0.03549800  1
  Li  Li3  1  0.48710700  0.88177600  0.53549800  1
  Mn  Mn4  1  0.14525600  0.77015100  0.75677800  1
  Mn  Mn5  1  0.04103400  0.62324000  0.38138300  1
  Mn  Mn6  1  0.02833400  0.86836800  0.11951400  1
  Mn  Mn7  1  0.95896600  0.62324000  0.88138300  1
  Mn  Mn8  1  0.97166600  0.86836800  0.61951400  1
  Mn  Mn9  1  0.85474400  0.77015100  0.25677800  1
  Mn  Mn10  1  0.73948400  0.37764100  0.74581700  1
  Mn  Mn11  1  0.53226200  0.36013200  0.11691600  1
  Mn  Mn12  1  0.52846900  0.11342300  0.38355700  1
  Mn  Mn13  1  0.47153100  0.11342300  0.88355700  1
  Mn  Mn14  1  0.46773800  0.36013200  0.61691600  1
  Mn  Mn15  1  0.26051600  0.37764100  0.24581700  1
  O  O16  1  0.04593500  0.53248600  0.30467700  1
  O  O17  1  0.02960000  0.65125800  0.19622200  1
  O  O18  1  0.95406500  0.53248600  0.80467700  1
  O  O19  1  0.97040000  0.65125800  0.69622200  1
  F  F20  1  0.28669100  0.92651200  0.35322600  1
  F  F21  1  0.27905500  0.14545100  0.14890300  1
  F  F22  1  0.21838100  0.29778500  0.91204300  1
  F  F23  1  0.25300700  0.63469200  0.58469100  1
  F  F24  1  0.01355100  0.08483000  0.04595800  1
  F  F25  1  0.01458800  0.74619300  0.45206000  1
  F  F26  1  0.01201200  0.09336800  0.25063800  1
  F  F27  1  0.98798800  0.09336800  0.75063800  1
  F  F28  1  0.98541200  0.74619300  0.95206000  1
  F  F29  1  0.98644900  0.08483000  0.54595800  1
  F  F30  1  0.78161900  0.29778500  0.41204300  1
  F  F31  1  0.74699300  0.63469200  0.08469100  1
  F  F32  1  0.71330900  0.92651200  0.85322600  1
  F  F33  1  0.72094500  0.14545100  0.64890300  1
  F  F34  1  0.78486800  0.85003900  0.34722000  1
  F  F35  1  0.78306300  0.06824100  0.14563500  1
  F  F36  1  0.71565100  0.68373000  0.59013600  1
  F  F37  1  0.75129500  0.34096200  0.91545200  1
  F  F38  1  0.52332700  0.35101300  0.31099800  1
  F  F39  1  0.53818100  0.47324300  0.19101400  1
  F  F40  1  0.55695900  0.89411600  0.24631600  1
  F  F41  1  0.51352700  0.88670200  0.45457300  1
  F  F42  1  0.51216900  0.24094900  0.04615300  1
  F  F43  1  0.48647300  0.88670200  0.95457300  1
  F  F44  1  0.48783100  0.24094900  0.54615300  1
  F  F45  1  0.44304100  0.89411600  0.74631600  1
  F  F46  1  0.47667300  0.35101300  0.81099800  1
  F  F47  1  0.46181900  0.47324300  0.69101400  1
  F  F48  1  0.24870500  0.34096200  0.41545200  1
  F  F49  1  0.28434900  0.68373000  0.09013600  1
  F  F50  1  0.21513200  0.85003900  0.84722000  1
  F  F51  1  0.21693700  0.06824100  0.64563500  1
