# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.91795300
_cell_length_b   5.12455595
_cell_length_c   16.84140749
_cell_angle_alpha   87.62786344
_cell_angle_beta   88.01476594
_cell_angle_gamma   89.00807177
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   251.43454240
_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  0.50000000  0.00000000  1
  Li  Li1  1  0.93960600  0.65000800  0.13837100  1
  Li  Li2  1  0.35349300  0.77938200  0.28749600  1
  Li  Li3  1  0.78225200  0.92703100  0.42898400  1
  Li  Li4  1  0.21774800  0.07296900  0.57101600  1
  Li  Li5  1  0.64650700  0.22061800  0.71250400  1
  Li  Li6  1  0.06039400  0.34999200  0.86162900  1
  Li  Li7  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn8  1  0.56485500  0.87051600  0.86167100  1
  Mn  Mn9  1  0.43514500  0.12948400  0.13832900  1
  Co  Co10  1  0.86603700  0.29048700  0.28591100  1
  Co  Co11  1  0.28918700  0.43100900  0.42919100  1
  Co  Co12  1  0.71081300  0.56899100  0.57080900  1
  Co  Co13  1  0.13396300  0.70951300  0.71408900  1
  O  O14  1  0.05637900  0.69908700  0.91963600  1
  O  O15  1  0.45490400  0.84252300  0.07815900  1
  O  O16  1  0.92367900  0.98564000  0.20797000  1
  O  O17  1  0.31868300  0.13194500  0.35622000  1
  O  O18  1  0.71231400  0.27108000  0.49757500  1
  O  O19  1  0.13244100  0.40228100  0.63868200  1
  O  O20  1  0.58891900  0.56432300  0.78251900  1
  O  O21  1  0.94362100  0.30091300  0.08036400  1
  O  O22  1  0.41108100  0.43567700  0.21748100  1
  O  O23  1  0.86755900  0.59771900  0.36131800  1
  O  O24  1  0.28768600  0.72892000  0.50242500  1
  O  O25  1  0.68131700  0.86805500  0.64378000  1
  O  O26  1  0.07632100  0.01436000  0.79203000  1
  O  O27  1  0.54509600  0.15747700  0.92184100  1
