# generated using pymatgen
data_LiMn2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68967149
_cell_length_b   5.68967149
_cell_length_c   5.68967149
_cell_angle_alpha   116.60582489
_cell_angle_beta   116.42209337
_cell_angle_gamma   96.15217388
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2O4
_chemical_formula_sum   'Li2 Mn4 O8'
_cell_volume   136.25226739
_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  0.50000000  0.50000000  0.00000000  1
  Li  Li1  1  0.00000000  0.50000000  0.50000000  1
  Mn  Mn2  1  0.50000000  0.00000000  0.00000000  1
  Mn  Mn3  1  0.50000000  0.50000000  0.50000000  1
  Mn  Mn4  1  0.00000000  0.50000000  0.00000000  1
  Mn  Mn5  1  0.00000000  0.00000000  0.50000000  1
  O  O6  1  0.25820100  0.77267200  0.51447100  1
  O  O7  1  0.24179900  0.25627000  0.01447100  1
  O  O8  1  0.75000000  0.71235500  0.46235500  1
  O  O9  1  0.25000000  0.71235500  0.96235500  1
  O  O10  1  0.74179900  0.22732800  0.48552900  1
  O  O11  1  0.75820100  0.74373000  0.98552900  1
  O  O12  1  0.25000000  0.28764500  0.53764500  1
  O  O13  1  0.75000000  0.28764500  0.03764500  1
