# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.02615300
_cell_length_b   5.12124300
_cell_length_c   17.12644361
_cell_angle_alpha   85.62553062
_cell_angle_beta   88.50484932
_cell_angle_gamma   75.66046400
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   256.39449747
_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  0.42985500  0.14246200  0.85588100  1
  Li  Li1  1  0.85199900  0.28330800  0.71315900  1
  Li  Li2  1  0.28555500  0.42179300  0.57200000  1
  Li  Li3  1  0.71444500  0.57820700  0.42800000  1
  Li  Li4  1  0.14800100  0.71669200  0.28684100  1
  Li  Li5  1  0.57014500  0.85753800  0.14411900  1
  Li  Li6  1  0.00000000  0.00000000  0.00000000  1
  Li  Li7  1  0.00000000  0.00000000  0.50000000  1
  Mn  Mn8  1  0.70635200  0.57241600  0.92674700  1
  Mn  Mn9  1  0.29364800  0.42758400  0.07325300  1
  Co  Co10  1  0.13731300  0.71450700  0.78171500  1
  Co  Co11  1  0.56862000  0.86407200  0.63629800  1
  Co  Co12  1  0.43138000  0.13592800  0.36370200  1
  Co  Co13  1  0.86268700  0.28549300  0.21828500  1
  O  O14  1  0.03875600  0.84474700  0.88664400  1
  O  O15  1  0.52032200  0.97629300  0.74203700  1
  O  O16  1  0.91857900  0.11655900  0.60947700  1
  O  O17  1  0.35663600  0.28135100  0.45332000  1
  O  O18  1  0.76347000  0.40679300  0.32012800  1
  O  O19  1  0.23493200  0.55457700  0.17820600  1
  O  O20  1  0.61879600  0.70109400  0.03261500  1
  O  O21  1  0.76506800  0.44542300  0.82179400  1
  O  O22  1  0.23653000  0.59320700  0.67987200  1
  O  O23  1  0.64336400  0.71864900  0.54668000  1
  O  O24  1  0.08142100  0.88344100  0.39052300  1
  O  O25  1  0.47967800  0.02370700  0.25796300  1
  O  O26  1  0.96124400  0.15525300  0.11335600  1
  O  O27  1  0.38120400  0.29890600  0.96738500  1
