# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.32646798
_cell_length_b   10.32646798
_cell_length_c   5.17769542
_cell_angle_alpha   84.76987110
_cell_angle_beta   84.76987110
_cell_angle_gamma   151.20290037
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   247.45042006
_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  0.78472900  0.21527100  0.50000000  1
  Li  Li1  1  0.21527100  0.78472900  0.50000000  1
  Li  Li2  1  0.64087800  0.35912200  0.50000000  1
  Li  Li3  1  0.06729200  0.93270800  0.50000000  1
  Li  Li4  1  0.50000000  0.50000000  0.50000000  1
  Li  Li5  1  0.93270800  0.06729200  0.50000000  1
  Li  Li6  1  0.35912200  0.64087800  0.50000000  1
  Li  Li7  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn8  1  0.85938200  0.14061800  0.00000000  1
  Mn  Mn9  1  0.14061800  0.85938200  0.00000000  1
  Co  Co10  1  0.28521500  0.71478500  0.00000000  1
  Co  Co11  1  0.71478500  0.28521500  0.00000000  1
  Co  Co12  1  0.56943400  0.43056600  0.00000000  1
  Co  Co13  1  0.43056600  0.56943400  0.00000000  1
  O  O14  1  0.55777000  0.98858000  0.22920000  1
  O  O15  1  0.98858000  0.55777000  0.22920000  1
  O  O16  1  0.39709200  0.11114100  0.20851600  1
  O  O17  1  0.84244400  0.68754100  0.23869700  1
  O  O18  1  0.28267100  0.28267100  0.22743100  1
  O  O19  1  0.68754100  0.84244400  0.23869700  1
  O  O20  1  0.11114100  0.39709200  0.20851600  1
  O  O21  1  0.01142000  0.44223000  0.77080000  1
  O  O22  1  0.44223000  0.01142000  0.77080000  1
  O  O23  1  0.88885900  0.60290800  0.79148400  1
  O  O24  1  0.31245900  0.15755600  0.76130300  1
  O  O25  1  0.71732900  0.71732900  0.77256900  1
  O  O26  1  0.15755600  0.31245900  0.76130300  1
  O  O27  1  0.60290800  0.88885900  0.79148400  1
