# generated using pymatgen
data_LiMn2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.63487500
_cell_length_b   6.64773432
_cell_length_c   11.00261515
_cell_angle_alpha   94.07718060
_cell_angle_beta   105.88685995
_cell_angle_gamma   98.53524598
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2O4
_chemical_formula_sum   'Li6 Mn12 O24'
_cell_volume   458.38995036
_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  0.49000900  0.98931700  0.13415600  1
  Li  Li1  1  0.36694300  0.87639300  0.36038100  1
  Li  Li2  1  0.21976200  0.71944400  0.86476500  1
  Li  Li3  1  0.01342700  0.52264800  0.36615600  1
  Li  Li4  1  0.86123700  0.36751900  0.87955400  1
  Li  Li5  1  0.62834200  0.11587900  0.62601000  1
  Mn  Mn6  1  0.91445900  0.92020500  0.25446000  1
  Mn  Mn7  1  0.84555300  0.82212200  0.50361800  1
  Mn  Mn8  1  0.66979800  0.66316300  0.00182600  1
  Mn  Mn9  1  0.74632500  0.75144000  0.75056600  1
  Mn  Mn10  1  0.57525600  0.58515000  0.24764800  1
  Mn  Mn11  1  0.51747700  0.48807500  0.50328900  1
  Mn  Mn12  1  0.32393000  0.33615700  0.99245400  1
  Mn  Mn13  1  0.41591400  0.42090200  0.74954200  1
  Mn  Mn14  1  0.23803700  0.26251200  0.24686600  1
  Mn  Mn15  1  0.17601800  0.16360700  0.50625900  1
  Mn  Mn16  1  0.99255300  0.00269000  0.99978800  1
  Mn  Mn17  1  0.08566300  0.07859100  0.74988400  1
  O  O18  1  0.17112600  0.96965900  0.19921600  1
  O  O19  1  0.75959400  0.95346500  0.08111200  1
  O  O20  1  0.08027800  0.87485600  0.42599700  1
  O  O21  1  0.65193700  0.88360200  0.30227200  1
  O  O22  1  0.01180000  0.79160500  0.70713300  1
  O  O23  1  0.60397900  0.78461300  0.57469600  1
  O  O24  1  0.40655100  0.62562600  0.04491500  1
  O  O25  1  0.48828200  0.70548700  0.80161600  1
  O  O26  1  0.83929700  0.63292900  0.20257200  1
  O  O27  1  0.33035900  0.54795200  0.31567000  1
  O  O28  1  0.90423000  0.71349400  0.92441600  1
  O  O29  1  0.75832500  0.54061200  0.43656600  1
  O  O30  1  0.26809300  0.44814600  0.57145300  1
  O  O31  1  0.06763400  0.29390400  0.04158500  1
  O  O32  1  0.67694800  0.45463800  0.70654800  1
  O  O33  1  0.16853500  0.37461200  0.81711500  1
  O  O34  1  0.46891300  0.29145800  0.16287300  1
  O  O35  1  0.01841700  0.21524300  0.33566800  1
  O  O36  1  0.57047400  0.37698500  0.92184400  1
  O  O37  1  0.42960000  0.18879400  0.45653200  1
  O  O38  1  0.33189900  0.12853200  0.68295200  1
  O  O39  1  0.93330300  0.11120700  0.57761600  1
  O  O40  1  0.23797900  0.04150100  0.92751000  1
  O  O41  1  0.82469200  0.04708400  0.79604300  1
