# generated using pymatgen
data_Li4Mn5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.71877519
_cell_length_b   5.71877519
_cell_length_c   12.77992531
_cell_angle_alpha   77.35870825
_cell_angle_beta   77.35870825
_cell_angle_gamma   89.93068344
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn5O12
_chemical_formula_sum   'Li8 Mn10 O24'
_cell_volume   397.46333648
_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  0.78435781  0.53939318  0.92150669  1
  Li  Li1  1  0.53939318  0.78435781  0.42150669  1
  Li  Li2  1  0.88186821  0.11813179  0.75000000  1
  Li  Li3  1  0.11813179  0.88186821  0.25000000  1
  Li  Li4  1  -0.00000000  0.00000000  0.50000000  1
  Li  Li5  1  0.21564219  0.46060682  0.07849331  1
  Li  Li6  1  0.46060682  0.21564219  0.57849331  1
  Li  Li7  1  -0.00000000  0.00000000  0.00000000  1
  Mn  Mn8  1  0.66758825  0.67116704  0.16442580  1
  Mn  Mn9  1  0.16594588  0.66801772  0.66398070  1
  Mn  Mn10  1  0.67116704  0.66758825  0.66442580  1
  Mn  Mn11  1  0.50000000  0.00000000  0.00000000  1
  Mn  Mn12  1  0.33198228  0.83405412  0.83601930  1
  Mn  Mn13  1  0.33241175  0.32883296  0.83557420  1
  Mn  Mn14  1  0.83405412  0.33198228  0.33601930  1
  Mn  Mn15  1  0.66801772  0.16594588  0.16398070  1
  Mn  Mn16  1  0.32883296  0.33241175  0.33557420  1
  Mn  Mn17  1  -0.00000000  0.50000000  0.50000000  1
  O  O18  1  0.58601241  0.56332317  0.32374479  1
  O  O19  1  0.22411246  0.72644573  0.51438792  1
  O  O20  1  0.91656243  0.87431386  0.66950864  1
  O  O21  1  0.07757836  0.55874800  0.34167925  1
  O  O22  1  0.76229430  0.72639944  0.51385761  1
  O  O23  1  0.56332317  0.58601241  0.82374479  1
  O  O24  1  0.55874800  0.07757836  0.84167925  1
  O  O25  1  0.27360056  0.23770570  0.98614239  1
  O  O26  1  0.41477570  0.88289113  0.67322464  1
  O  O27  1  0.27355427  0.77588754  0.98561208  1
  O  O28  1  0.12568614  0.08343757  0.83049136  1
  O  O29  1  0.11710887  0.58522430  0.82677536  1
  O  O30  1  0.87431386  0.91656243  0.16950864  1
  O  O31  1  0.88289113  0.41477570  0.17322464  1
  O  O32  1  0.72644573  0.22411246  0.01438792  1
  O  O33  1  0.58522430  0.11710887  0.32677536  1
  O  O34  1  0.72639944  0.76229430  0.01385761  1
  O  O35  1  0.44125200  0.92242164  0.15832075  1
  O  O36  1  0.43667683  0.41398759  0.17625521  1
  O  O37  1  0.23770570  0.27360056  0.48614239  1
  O  O38  1  0.92242164  0.44125200  0.65832075  1
  O  O39  1  0.08343757  0.12568614  0.33049136  1
  O  O40  1  0.77588754  0.27355427  0.48561208  1
  O  O41  1  0.41398759  0.43667683  0.67625521  1
