# generated using pymatgen
data_LiMn6(OF2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05257762
_cell_length_b   7.96757277
_cell_length_c   5.91906962
_cell_angle_alpha   94.73048300
_cell_angle_beta   95.40223287
_cell_angle_gamma   85.88003987
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn6(OF2)4
_chemical_formula_sum   'Li1 Mn6 O4 F8'
_cell_volume   235.92262061
_cell_formula_units_Z   1
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  0.48369800  0.48858500  0.47992800  1
  Mn  Mn1  1  0.48464800  0.01012900  0.50532100  1
  Mn  Mn2  1  0.62770200  0.68505500  0.15696700  1
  Mn  Mn3  1  0.46385200  0.33220700  0.87851900  1
  Mn  Mn4  1  0.97645500  0.68360700  0.66560400  1
  Mn  Mn5  1  0.98829500  0.33139900  0.35827600  1
  Mn  Mn6  1  0.00703600  0.99295900  0.00333600  1
  O  O7  1  0.84675100  0.76216900  0.94401300  1
  O  O8  1  0.65971800  0.75435500  0.48144000  1
  O  O9  1  0.67061800  0.44123900  0.17794700  1
  O  O10  1  0.30717500  0.26160300  0.53627400  1
  F  F11  1  0.81025900  0.42624500  0.65112900  1
  F  F12  1  0.82902200  0.09663600  0.31628700  1
  F  F13  1  0.67279400  0.10132400  0.82398400  1
  F  F14  1  0.32174500  0.58485200  0.82961200  1
  F  F15  1  0.36966300  0.90065300  0.16415300  1
  F  F16  1  0.13518900  0.57793700  0.38293300  1
  F  F17  1  0.16051800  0.24097300  0.05783200  1
  F  F18  1  0.17097000  0.91973800  0.68019600  1
