# generated using pymatgen
data_Li4Mn3O6F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.44843200
_cell_length_b   8.75364252
_cell_length_c   7.70772852
_cell_angle_alpha   111.98586196
_cell_angle_beta   106.77261482
_cell_angle_gamma   75.28096462
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3O6F
_chemical_formula_sum   'Li8 Mn6 O12 F2'
_cell_volume   262.84162979
_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  0.57006200  0.14801500  0.28818400  1
  Li  Li1  1  0.07012400  0.64796600  0.78818500  1
  Li  Li2  1  0.85849100  0.70914400  0.42610100  1
  Li  Li3  1  0.35851500  0.20917600  0.92610200  1
  Li  Li4  1  0.14464800  0.27900000  0.56834500  1
  Li  Li5  1  0.64462600  0.77898300  0.06837700  1
  Li  Li6  1  0.78382400  0.07814800  0.64585100  1
  Li  Li7  1  0.28389300  0.57815000  0.14589200  1
  Mn  Mn8  1  0.71443900  0.42859000  0.85711100  1
  Mn  Mn9  1  0.00139600  0.99613900  0.99902100  1
  Mn  Mn10  1  0.42715000  0.86102200  0.71526200  1
  Mn  Mn11  1  0.21422100  0.92854800  0.35713000  1
  Mn  Mn12  1  0.50139400  0.49620600  0.49910800  1
  Mn  Mn13  1  0.92711300  0.36093100  0.21515500  1
  O  O14  1  0.64523700  0.29839900  0.58873900  1
  O  O15  1  0.14522200  0.79833100  0.08879000  1
  O  O16  1  0.28335800  0.05883300  0.62551100  1
  O  O17  1  0.78347700  0.55875200  0.12553200  1
  O  O18  1  0.07018100  0.12978800  0.27025300  1
  O  O19  1  0.57020700  0.62984000  0.77026800  1
  O  O20  1  0.35834000  0.72734400  0.44406300  1
  O  O21  1  0.85840500  0.22728900  0.94404400  1
  O  O22  1  0.49395800  0.99179000  0.97982800  1
  O  O23  1  0.99395800  0.49174200  0.47979100  1
  O  O24  1  0.93450500  0.86534200  0.73446000  1
  O  O25  1  0.43448700  0.36542100  0.23450800  1
  F  F26  1  0.71432300  0.92855800  0.35719700  1
  F  F27  1  0.21444300  0.42855200  0.85719500  1
