# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05237700
_cell_length_b   5.11907784
_cell_length_c   10.41466350
_cell_angle_alpha   85.00222017
_cell_angle_beta   76.58263969
_cell_angle_gamma   70.42926854
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   246.85826831
_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  0.06526100  0.50431200  0.85874800  1
  Li  Li1  1  0.63402700  0.50079600  0.72445600  1
  Li  Li2  1  0.20845700  0.49965900  0.57543800  1
  Li  Li3  1  0.78471300  0.49964000  0.42615800  1
  Li  Li4  1  0.36375600  0.49809100  0.28283200  1
  Li  Li5  1  0.93486700  0.49911200  0.14020600  1
  Li  Li6  1  0.50735000  0.50485200  0.99448900  1
  Li  Li7  1  0.57164300  0.00162600  0.85584800  1
  Mn  Mn8  1  0.00442800  0.99528000  0.99293600  1
  Mn  Mn9  1  0.70805400  0.00189100  0.57926000  1
  Co  Co10  1  0.13937300  0.00126700  0.71624500  1
  Co  Co11  1  0.28161100  0.00331400  0.42642500  1
  Co  Co12  1  0.85908900  0.99617900  0.28474000  1
  Co  Co13  1  0.43532800  0.99999600  0.13408100  1
  O  O14  1  0.76332800  0.76929700  0.00267700  1
  O  O15  1  0.29300000  0.77221400  0.85780800  1
  O  O16  1  0.89467900  0.77671200  0.70651100  1
  O  O17  1  0.45282000  0.78517500  0.57516000  1
  O  O18  1  0.01365400  0.77241500  0.43392600  1
  O  O19  1  0.59543100  0.76814000  0.28461800  1
  O  O20  1  0.16933200  0.76978200  0.13874700  1
  O  O21  1  0.39576800  0.22302600  0.70504000  1
  O  O22  1  0.95478400  0.22262400  0.57875200  1
  O  O23  1  0.55090400  0.22632100  0.43118500  1
  O  O24  1  0.11739800  0.23370500  0.29221700  1
  O  O25  1  0.70250000  0.22458000  0.13700400  1
  O  O26  1  0.24582400  0.22313800  0.00754300  1
  O  O27  1  0.85261800  0.22685700  0.85695100  1
