# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.02338000
_cell_length_b   5.04283517
_cell_length_c   16.67786973
_cell_angle_alpha   90.06830735
_cell_angle_beta   91.48179724
_cell_angle_gamma   91.73022485
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   254.07616822
_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  0.92840600  0.35712400  0.85704000  1
  Li  Li1  1  0.35411800  0.21628300  0.71351800  1
  Li  Li2  1  0.78019000  0.07475700  0.57094400  1
  Li  Li3  1  0.21402400  0.92890700  0.42816400  1
  Li  Li4  1  0.64847400  0.78379500  0.28590000  1
  Li  Li5  1  0.07457200  0.64034600  0.14390700  1
  Li  Li6  1  0.50123000  0.49844700  0.00047400  1
  Li  Li7  1  0.71456400  0.42857000  0.42781500  1
  Mn  Mn8  1  0.99414400  0.99946800  0.00232300  1
  Mn  Mn9  1  0.86001400  0.71203600  0.71209400  1
  Co  Co10  1  0.42845600  0.85711400  0.85694000  1
  Co  Co11  1  0.27461400  0.56820600  0.56397700  1
  Co  Co12  1  0.15001200  0.28841200  0.29114800  1
  Co  Co13  1  0.57274600  0.14734900  0.14509600  1
  O  O14  1  0.42646000  0.15980900  0.92787900  1
  O  O15  1  0.90891500  0.01582600  0.78461500  1
  O  O16  1  0.29699100  0.86150200  0.63898200  1
  O  O17  1  0.72515600  0.73810900  0.50491100  1
  O  O18  1  0.17268800  0.57643300  0.34792500  1
  O  O19  1  0.58778300  0.43867500  0.21562300  1
  O  O20  1  0.00246000  0.30502900  0.07376400  1
  O  O21  1  0.42834800  0.55303000  0.78686300  1
  O  O22  1  0.84514500  0.41111900  0.64093700  1
  O  O23  1  0.25704500  0.28047100  0.50743500  1
  O  O24  1  0.70630800  0.11727500  0.35127500  1
  O  O25  1  0.13855300  0.00025900  0.21570500  1
  O  O26  1  0.56091200  0.84333300  0.07557400  1
  O  O27  1  0.94767200  0.69831900  0.92917500  1
