# generated using pymatgen
data_LiMn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.68012205
_cell_length_b   13.47266319
_cell_length_c   5.72022054
_cell_angle_alpha   77.75093396
_cell_angle_beta   64.69259324
_cell_angle_gamma   100.60075734
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn3O6
_chemical_formula_sum   'Li4 Mn12 O24'
_cell_volume   432.27270797
_cell_formula_units_Z   4
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  0.15102300  0.82462600  0.25842900  1
  Li  Li1  1  0.15266100  0.32464000  0.27187700  1
  Li  Li2  1  0.51619000  0.00849200  0.24083400  1
  Li  Li3  1  0.51582700  0.50763400  0.73478300  1
  Mn  Mn4  1  0.98999500  0.50318900  0.00151100  1
  Mn  Mn5  1  0.33217900  0.66793700  0.50164400  1
  Mn  Mn6  1  0.00373100  0.99927700  0.99781800  1
  Mn  Mn7  1  0.33274900  0.16693100  0.50045700  1
  Mn  Mn8  1  0.33401100  0.66537600  0.00210400  1
  Mn  Mn9  1  0.66267200  0.83293500  0.50463700  1
  Mn  Mn10  1  0.33435900  0.16678100  0.99816100  1
  Mn  Mn11  1  0.66364200  0.33415600  0.50048800  1
  Mn  Mn12  1  0.67680900  0.82989200  0.99822700  1
  Mn  Mn13  1  0.67818900  0.32965200  0.99501300  1
  Mn  Mn14  1  0.00384300  0.50082100  0.49695100  1
  Mn  Mn15  1  0.98849700  0.00397800  0.50215400  1
  O  O16  1  0.11421500  0.65707400  0.36433800  1
  O  O17  1  0.22198600  0.50933600  0.12401900  1
  O  O18  1  0.11454200  0.15990800  0.36114700  1
  O  O19  1  0.11400300  0.65564400  0.86717600  1
  O  O20  1  0.22201900  0.01007100  0.14273000  1
  O  O21  1  0.22155600  0.51418300  0.63905200  1
  O  O22  1  0.44464200  0.82405800  0.35810300  1
  O  O23  1  0.11469200  0.15219000  0.86662500  1
  O  O24  1  0.55211800  0.67730100  0.13822400  1
  O  O25  1  0.21970900  0.01337100  0.62299500  1
  O  O26  1  0.44685100  0.32088500  0.35668200  1
  O  O27  1  0.44515500  0.81925500  0.87824100  1
  O  O28  1  0.55256600  0.17373100  0.13743600  1
  O  O29  1  0.55246300  0.67679800  0.63593700  1
  O  O30  1  0.77034000  0.98729500  0.36056200  1
  O  O31  1  0.44504600  0.32328200  0.87505100  1
  O  O32  1  0.89459900  0.84472800  0.14171300  1
  O  O33  1  0.55218700  0.18131100  0.63194400  1
  O  O34  1  0.77208300  0.48853500  0.37737700  1
  O  O35  1  0.77332200  0.98509400  0.87901700  1
  O  O36  1  0.89361400  0.34846500  0.13711700  1
  O  O37  1  0.89406900  0.84904700  0.62231700  1
  O  O38  1  0.77290200  0.48482600  0.86108000  1
  O  O39  1  0.89632200  0.34605400  0.61871200  1
