# generated using pymatgen
data_Li4Mn3(OF3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.19279659
_cell_length_b   6.94854885
_cell_length_c   8.34159352
_cell_angle_alpha   90.09979379
_cell_angle_beta   74.68565171
_cell_angle_gamma   102.72774607
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3(OF3)2
_chemical_formula_sum   'Li8 Mn6 O4 F12'
_cell_volume   337.08570094
_cell_formula_units_Z   2
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  0.99794300  0.99978100  0.02380600  1
  Li  Li1  1  0.99789300  0.49988400  0.52380500  1
  Li  Li2  1  0.25204400  0.75012500  0.72660000  1
  Li  Li3  1  0.25188200  0.25019100  0.22657800  1
  Li  Li4  1  0.47033000  0.49261600  0.47660900  1
  Li  Li5  1  0.47031300  0.99256700  0.97649100  1
  Li  Li6  1  0.78013300  0.75748900  0.77380800  1
  Li  Li7  1  0.78003800  0.25743300  0.27381200  1
  Mn  Mn8  1  0.12484700  0.62514000  0.12511000  1
  Mn  Mn9  1  0.36274100  0.88002900  0.36226600  1
  Mn  Mn10  1  0.88692000  0.37003200  0.88808400  1
  Mn  Mn11  1  0.12495100  0.12529100  0.62509300  1
  Mn  Mn12  1  0.36352800  0.38004500  0.86239600  1
  Mn  Mn13  1  0.88629600  0.86993000  0.38794300  1
  O  O14  1  0.18567500  0.91756400  0.18223800  1
  O  O15  1  0.18650400  0.41782400  0.68252200  1
  O  O16  1  0.06435700  0.83325800  0.56746500  1
  O  O17  1  0.06425900  0.33313600  0.06776200  1
  F  F18  1  0.29534800  0.05702000  0.81952600  1
  F  F19  1  0.29521200  0.55705400  0.31959200  1
  F  F20  1  0.95469500  0.19231000  0.42869000  1
  F  F21  1  0.95471700  0.69243900  0.92872500  1
  F  F22  1  0.43860700  0.20660800  0.40020800  1
  F  F23  1  0.43886000  0.70666800  0.90006000  1
  F  F24  1  0.81125200  0.04216600  0.85012800  1
  F  F25  1  0.81108700  0.54161200  0.35042300  1
  F  F26  1  0.71233800  0.96700900  0.21339100  1
  F  F27  1  0.71298400  0.46693300  0.71364000  1
  F  F28  1  0.53714100  0.78398600  0.53662000  1
  F  F29  1  0.53710500  0.28385800  0.03661300  1
