# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.98473241
_cell_length_b   2.98473241
_cell_length_c   34.49033675
_cell_angle_alpha   86.38162092
_cell_angle_beta   86.38162092
_cell_angle_gamma   57.57735905
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   258.69108678
_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  0.72658600  0.72658600  0.92441300  1
  Li  Li1  1  0.13125300  0.13125300  0.78699800  1
  Li  Li2  1  0.57075800  0.57075800  0.64314800  1
  Li  Li3  1  0.99901900  0.99901900  0.49998200  1
  Li  Li4  1  0.42452200  0.42452200  0.35919900  1
  Li  Li5  1  0.86088000  0.86088000  0.21267600  1
  Li  Li6  1  0.28237600  0.28237600  0.07388100  1
  Li  Li7  1  0.42867500  0.42867500  0.85586700  1
  Mn  Mn8  1  0.00266200  0.00266200  0.00107100  1
  Mn  Mn9  1  0.14367900  0.14367900  0.28611800  1
  Co  Co10  1  0.85765300  0.85765300  0.71257700  1
  Co  Co11  1  0.28491200  0.28491200  0.57182500  1
  Co  Co12  1  0.71177900  0.71177900  0.42978200  1
  Co  Co13  1  0.57168700  0.57168700  0.14306400  1
  O  O14  1  0.36993400  0.36993400  0.97003900  1
  O  O15  1  0.78754200  0.78754200  0.81826500  1
  O  O16  1  0.23272800  0.23272800  0.68097200  1
  O  O17  1  0.61446500  0.61446500  0.53908300  1
  O  O18  1  0.08921300  0.08921300  0.39801000  1
  O  O19  1  0.52433500  0.52433500  0.25311700  1
  O  O20  1  0.92132200  0.92132200  0.10964100  1
  O  O21  1  0.07132700  0.07132700  0.89340900  1
  O  O22  1  0.49154400  0.49154400  0.74172500  1
  O  O23  1  0.95471100  0.95471100  0.60439200  1
  O  O24  1  0.33514400  0.33514400  0.46114000  1
  O  O25  1  0.76038000  0.76038000  0.31984300  1
  O  O26  1  0.22207400  0.22207400  0.17633600  1
  O  O27  1  0.62883900  0.62883900  0.03342600  1
