# generated using pymatgen
data_LiMnO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.29809500
_cell_length_b   5.91777500
_cell_length_c   8.72163000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnO2
_chemical_formula_sum   'Li6 Mn6 O12'
_cell_volume   221.83604700
_cell_formula_units_Z   6
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  0.00000000  0.87045100  0.83389000  1
  Li  Li1  1  0.00000000  0.87045100  0.16611000  1
  Li  Li2  1  0.00000000  0.37717800  0.50000000  1
  Li  Li3  1  0.50000000  0.62282200  0.00000000  1
  Li  Li4  1  0.50000000  0.12954900  0.33389000  1
  Li  Li5  1  0.50000000  0.12954900  0.66611000  1
  Mn  Mn6  1  0.00000000  0.36873500  0.82857000  1
  Mn  Mn7  1  0.00000000  0.90732100  0.50000000  1
  Mn  Mn8  1  0.00000000  0.36873500  0.17143000  1
  Mn  Mn9  1  0.50000000  0.63126500  0.32857000  1
  Mn  Mn10  1  0.50000000  0.63126500  0.67143000  1
  Mn  Mn11  1  0.50000000  0.09267900  0.00000000  1
  O  O12  1  0.00000000  0.58030000  0.00000000  1
  O  O13  1  0.00000000  0.62443100  0.32660800  1
  O  O14  1  0.00000000  0.62443100  0.67339200  1
  O  O15  1  0.00000000  0.13377900  0.00000000  1
  O  O16  1  0.00000000  0.13970300  0.32860600  1
  O  O17  1  0.00000000  0.13970300  0.67139400  1
  O  O18  1  0.50000000  0.86029700  0.82860600  1
  O  O19  1  0.50000000  0.86622100  0.50000000  1
  O  O20  1  0.50000000  0.86029700  0.17139400  1
  O  O21  1  0.50000000  0.41970000  0.50000000  1
  O  O22  1  0.50000000  0.37556900  0.82660800  1
  O  O23  1  0.50000000  0.37556900  0.17339200  1
