# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99594300
_cell_length_b   5.29094074
_cell_length_c   10.20495882
_cell_angle_alpha   95.43498337
_cell_angle_beta   101.68425590
_cell_angle_gamma   102.80319857
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   254.82547643
_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  0.50000000  0.00000000  0.50000000  1
  Li  Li1  1  0.07432900  0.14422200  0.64438400  1
  Li  Li2  1  0.64284800  0.28414800  0.78887200  1
  Li  Li3  1  0.35715200  0.71585200  0.21112800  1
  Li  Li4  1  0.92567100  0.85577800  0.35561600  1
  Li  Li5  1  0.21551300  0.43129900  0.92945000  1
  Li  Li6  1  0.78448700  0.56870100  0.07055000  1
  Li  Li7  1  0.50000000  0.00000000  0.00000000  1
  Mn  Mn8  1  0.78809100  0.57580500  0.57449100  1
  Mn  Mn9  1  0.21190900  0.42419500  0.42550900  1
  Co  Co10  1  0.35858300  0.71969100  0.71766800  1
  Co  Co11  1  0.93621300  0.87181900  0.86380700  1
  Co  Co12  1  0.06378700  0.12818100  0.13619300  1
  Co  Co13  1  0.64141700  0.28030900  0.28233200  1
  O  O14  1  0.56743600  0.63600800  0.40179000  1
  O  O15  1  0.14296500  0.77873000  0.54761100  1
  O  O16  1  0.70518500  0.91992500  0.69140500  1
  O  O17  1  0.40968000  0.34514500  0.12080200  1
  O  O18  1  0.98678800  0.48681300  0.25603400  1
  O  O19  1  0.25314000  0.05124700  0.82411200  1
  O  O20  1  0.87509100  0.19899900  0.97134200  1
  O  O21  1  0.43256400  0.36399200  0.59821000  1
  O  O22  1  0.01321200  0.51318700  0.74396600  1
  O  O23  1  0.59032000  0.65485500  0.87919800  1
  O  O24  1  0.29481500  0.08007500  0.30859500  1
  O  O25  1  0.85703500  0.22127000  0.45238900  1
  O  O26  1  0.12490900  0.80100100  0.02865800  1
  O  O27  1  0.74686000  0.94875300  0.17588800  1
