# generated using pymatgen
data_LiMn2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.86603943
_cell_length_b   5.86603943
_cell_length_c   9.76392000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999356
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2O4
_chemical_formula_sum   'Li4 Mn8 O16'
_cell_volume   290.96773131
_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  0.33333300  0.66666700  0.88673600  1
  Li  Li1  1  0.00000000  0.00000000  0.99735700  1
  Li  Li2  1  0.00000000  0.00000000  0.49735700  1
  Li  Li3  1  0.66666700  0.33333300  0.38673600  1
  Mn  Mn4  1  0.16886100  0.83113900  0.21530800  1
  Mn  Mn5  1  0.33333300  0.66666700  0.49315000  1
  Mn  Mn6  1  0.16886100  0.33772200  0.21530800  1
  Mn  Mn7  1  0.66227800  0.83113900  0.21530800  1
  Mn  Mn8  1  0.33772200  0.16886100  0.71530800  1
  Mn  Mn9  1  0.66666700  0.33333300  0.99315000  1
  Mn  Mn10  1  0.83113900  0.66227800  0.71530800  1
  Mn  Mn11  1  0.83113900  0.16886100  0.71530800  1
  O  O12  1  0.15807600  0.84192400  0.60683400  1
  O  O13  1  0.03361500  0.51680700  0.32968100  1
  O  O14  1  0.33333300  0.66666700  0.10943900  1
  O  O15  1  0.00000000  0.00000000  0.31175800  1
  O  O16  1  0.00000000  0.00000000  0.81175800  1
  O  O17  1  0.15807600  0.31615200  0.60683400  1
  O  O18  1  0.48319300  0.96638500  0.32968100  1
  O  O19  1  0.48319300  0.51680700  0.32968100  1
  O  O20  1  0.31615200  0.15807600  0.10683400  1
  O  O21  1  0.68384800  0.84192400  0.60683400  1
  O  O22  1  0.51680700  0.48319300  0.82968100  1
  O  O23  1  0.51680700  0.03361500  0.82968100  1
  O  O24  1  0.66666700  0.33333300  0.60943900  1
  O  O25  1  0.84192400  0.68384800  0.10683400  1
  O  O26  1  0.96638500  0.48319300  0.82968100  1
  O  O27  1  0.84192400  0.15807600  0.10683400  1
