# generated using pymatgen
data_LiMn2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.66985861
_cell_length_b   5.66985861
_cell_length_c   5.70941328
_cell_angle_alpha   63.57723242
_cell_angle_beta   63.39348600
_cell_angle_gamma   95.79209751
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2O4
_chemical_formula_sum   'Li2 Mn4 O8'
_cell_volume   136.24147409
_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  0.00000000  0.00000000  0.50000000  1
  Li  Li1  1  0.00000000  0.50000000  0.00000000  1
  Mn  Mn2  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn3  1  0.50000000  0.00000000  0.50000000  1
  Mn  Mn4  1  0.50000000  0.50000000  0.00000000  1
  Mn  Mn5  1  0.00000000  0.50000000  0.50000000  1
  O  O6  1  0.24373000  0.75285800  0.01981300  1
  O  O7  1  0.72732800  0.73645700  0.51981300  1
  O  O8  1  0.78768000  0.25385400  0.45853600  1
  O  O9  1  0.78761000  0.75378400  0.95853600  1
  O  O10  1  0.75627000  0.24714200  0.98018700  1
  O  O11  1  0.27267200  0.26354300  0.48018700  1
  O  O12  1  0.21232000  0.74614600  0.54146400  1
  O  O13  1  0.21239000  0.24621600  0.04146400  1
