# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13544000
_cell_length_b   7.66074231
_cell_length_c   7.71071401
_cell_angle_alpha   118.98009302
_cell_angle_beta   109.08114708
_cell_angle_gamma   83.35979248
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   250.45069182
_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  0.50819400  0.21403400  0.07797000  1
  Li  Li1  1  0.50586600  0.48563000  0.49346400  1
  Li  Li2  1  0.50143300  0.64529600  0.21563600  1
  Li  Li3  1  0.50240200  0.92740400  0.64385100  1
  Li  Li4  1  0.50080300  0.07517400  0.36472600  1
  Li  Li5  1  0.48563400  0.35422800  0.77391400  1
  Li  Li6  1  0.49787900  0.78931600  0.93091400  1
  Li  Li7  1  0.99503100  0.28506200  0.42806100  1
  Mn  Mn8  1  0.00404500  0.00313100  0.00508100  1
  Mn  Mn9  1  0.99944500  0.42807600  0.14376300  1
  Co  Co10  1  0.99830000  0.57200600  0.85692200  1
  Co  Co11  1  0.01169700  0.87325500  0.29682300  1
  Co  Co12  1  0.98728000  0.14902100  0.70328100  1
  Co  Co13  1  0.00062700  0.70608600  0.56799900  1
  O  O14  1  0.21636100  0.97245400  0.82209900  1
  O  O15  1  0.22350000  0.24502600  0.22746800  1
  O  O16  1  0.21937400  0.40015900  0.96132800  1
  O  O17  1  0.23133100  0.65733900  0.37658500  1
  O  O18  1  0.23764800  0.83958100  0.10904700  1
  O  O19  1  0.23992900  0.08932000  0.53171000  1
  O  O20  1  0.22035900  0.54858700  0.68961500  1
  O  O21  1  0.77127800  0.46831100  0.31134900  1
  O  O22  1  0.77999900  0.75999800  0.77009400  1
  O  O23  1  0.76951300  0.88667600  0.46861200  1
  O  O24  1  0.77737400  0.18552100  0.91337900  1
  O  O25  1  0.75237400  0.31171100  0.61143700  1
  O  O26  1  0.78918700  0.60368600  0.03927800  1
  O  O27  1  0.77313800  0.02391300  0.16559600  1
