# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13233503
_cell_length_b   5.13233503
_cell_length_c   17.95276985
_cell_angle_alpha   83.62864609
_cell_angle_beta   83.62864609
_cell_angle_gamma   32.59724149
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   253.05241073
_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  0.35337900  0.35337900  0.29204600  1
  Li  Li1  1  0.79419300  0.79419300  0.43735500  1
  Li  Li2  1  0.20580700  0.20580700  0.56264500  1
  Li  Li3  1  0.64662100  0.64662100  0.70795400  1
  Li  Li4  1  0.06826900  0.06826900  0.85951700  1
  Li  Li5  1  0.50000000  0.50000000  0.00000000  1
  Li  Li6  1  0.93173100  0.93173100  0.14048300  1
  Li  Li7  1  0.50000000  0.50000000  0.50000000  1
  Mn  Mn8  1  0.63996200  0.63996200  0.21463100  1
  Mn  Mn9  1  0.36003800  0.36003800  0.78536900  1
  Co  Co10  1  0.07482700  0.07482700  0.37021200  1
  Co  Co11  1  0.92517300  0.92517300  0.62978800  1
  Co  Co12  1  0.78360100  0.78360100  0.93060600  1
  Co  Co13  1  0.21639900  0.21639900  0.06939400  1
  O  O14  1  0.26853900  0.26853900  0.18138300  1
  O  O15  1  0.69781100  0.69781100  0.31245000  1
  O  O16  1  0.14523400  0.14523400  0.45711500  1
  O  O17  1  0.55861400  0.55861400  0.61254100  1
  O  O18  1  0.98586400  0.98586400  0.75729000  1
  O  O19  1  0.41779900  0.41779900  0.88770100  1
  O  O20  1  0.85194500  0.85194500  0.03473200  1
  O  O21  1  0.44138600  0.44138600  0.38745900  1
  O  O22  1  0.85476600  0.85476600  0.54288500  1
  O  O23  1  0.30218900  0.30218900  0.68755000  1
  O  O24  1  0.73146100  0.73146100  0.81861700  1
  O  O25  1  0.14805500  0.14805500  0.96526800  1
  O  O26  1  0.58220100  0.58220100  0.11229900  1
  O  O27  1  0.01413600  0.01413600  0.24271000  1
