# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.05010747
_cell_length_b   17.05010747
_cell_length_c   5.18879376
_cell_angle_alpha   86.65978874
_cell_angle_beta   86.65978874
_cell_angle_gamma   9.72792792
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   254.44037634
_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  0.50229100  0.50229100  0.49653300  1
  Li  Li1  1  0.92988200  0.92988200  0.36600100  1
  Li  Li2  1  0.36026000  0.36026000  0.21956500  1
  Li  Li3  1  0.78439600  0.78439600  0.07118300  1
  Li  Li4  1  0.21028200  0.21028200  0.93052500  1
  Li  Li5  1  0.07470700  0.07470700  0.65164900  1
  Li  Li6  1  0.64109900  0.64109900  0.77281000  1
  Li  Li7  1  0.57010800  0.57010800  0.14933200  1
  Mn  Mn8  1  0.00171800  0.00171800  0.00723500  1
  Mn  Mn9  1  0.28627500  0.28627500  0.56733500  1
  Co  Co10  1  0.42803600  0.42803600  0.86424800  1
  Co  Co11  1  0.85848800  0.85848800  0.71997100  1
  Co  Co12  1  0.71181100  0.71181100  0.42470000  1
  Co  Co13  1  0.13783300  0.13783300  0.26229200  1
  O  O14  1  0.53079800  0.53079800  0.83825400  1
  O  O15  1  0.96304100  0.96304100  0.71043100  1
  O  O16  1  0.39198800  0.39198800  0.56191200  1
  O  O17  1  0.81709600  0.81709600  0.40272100  1
  O  O18  1  0.25088000  0.25088000  0.28103900  1
  O  O19  1  0.10940500  0.10940500  0.96691200  1
  O  O20  1  0.67831100  0.67831100  0.12579600  1
  O  O21  1  0.46717600  0.46717600  0.15509700  1
  O  O22  1  0.89411800  0.89411800  0.03935300  1
  O  O23  1  0.32110100  0.32110100  0.85288900  1
  O  O24  1  0.75516600  0.75516600  0.72913800  1
  O  O25  1  0.18307100  0.18307100  0.59161100  1
  O  O26  1  0.03136200  0.03136200  0.29010200  1
  O  O27  1  0.60930100  0.60930100  0.45136500  1
