# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.00530700
_cell_length_b   5.78735432
_cell_length_c   9.37193211
_cell_angle_alpha   89.34317610
_cell_angle_beta   100.01081470
_cell_angle_gamma   106.64026504
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   255.94057959
_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  0.14882100  0.79026000  0.28119900  1
  Li  Li1  1  0.42510100  0.35441500  0.85942200  1
  Li  Li2  1  0.57489900  0.64558500  0.14057800  1
  Li  Li3  1  0.85117900  0.20974000  0.71880100  1
  Li  Li4  1  0.00000000  0.50000000  0.00000000  1
  Li  Li5  1  0.28134300  0.06823800  0.57179300  1
  Li  Li6  1  0.71865700  0.93176200  0.42820700  1
  Li  Li7  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn8  1  0.71201900  0.42568200  0.42477300  1
  Mn  Mn9  1  0.28798100  0.57431800  0.57522700  1
  Co  Co10  1  0.56799900  0.14234700  0.13220800  1
  Co  Co11  1  0.85740500  0.71504000  0.71822500  1
  Co  Co12  1  0.14259500  0.28496000  0.28177500  1
  Co  Co13  1  0.43200100  0.85765300  0.86779200  1
  O  O14  1  0.99943100  0.73212500  0.49570600  1
  O  O15  1  0.31373600  0.30600600  0.07762300  1
  O  O16  1  0.42236800  0.58271700  0.35373300  1
  O  O17  1  0.69081400  0.15913100  0.93096700  1
  O  O18  1  0.86207300  0.44313200  0.21052900  1
  O  O19  1  0.15321300  0.00345000  0.78410000  1
  O  O20  1  0.57854400  0.87606100  0.64480400  1
  O  O21  1  0.30918600  0.84086900  0.06903300  1
  O  O22  1  0.57763200  0.41728300  0.64626700  1
  O  O23  1  0.68626400  0.69399400  0.92237700  1
  O  O24  1  0.00056900  0.26787500  0.50429400  1
  O  O25  1  0.13792700  0.55686800  0.78947100  1
  O  O26  1  0.42145600  0.12393900  0.35519600  1
  O  O27  1  0.84678700  0.99655000  0.21590000  1
